############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 16876 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 11 'hetNOE measurement' . . . 16876 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $TOPSPIN . . 16876 1 3 $SPARKY . . 16876 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 3 3 GLU N N 15 . 1 1 3 3 GLU H H 1 -1.031 0.052 . . 1 3 GLU N 1 3 GLU H 16876 1 2 . 1 1 4 4 GLU N N 15 . 1 1 4 4 GLU H H 1 -0.749 0.001 . . 1 4 GLU N 1 4 GLU H 16876 1 3 . 1 1 5 5 ILE N N 15 . 1 1 5 5 ILE H H 1 -0.419 0.003 . . 1 5 ILE N 1 5 ILE H 16876 1 4 . 1 1 6 6 LYS N N 15 . 1 1 6 6 LYS H H 1 -0.342 0.010 . . 1 6 LYS N 1 6 LYS H 16876 1 5 . 1 1 7 7 ASN N N 15 . 1 1 7 7 ASN H H 1 -0.126 0.012 . . 1 7 ASN N 1 7 ASN H 16876 1 6 . 1 1 8 8 VAL N N 15 . 1 1 8 8 VAL H H 1 0.064 0.001 . . 1 8 VAL N 1 8 VAL H 16876 1 7 . 1 1 10 10 GLU N N 15 . 1 1 10 10 GLU H H 1 -0.032 0.002 . . 1 10 GLU N 1 10 GLU H 16876 1 8 . 1 1 11 11 GLN N N 15 . 1 1 11 11 GLN H H 1 0.002 0.000 . . 1 11 GLN N 1 11 GLN H 16876 1 9 . 1 1 12 12 GLU N N 15 . 1 1 12 12 GLU H H 1 0.009 0.005 . . 1 12 GLU N 1 12 GLU H 16876 1 10 . 1 1 13 13 VAL N N 15 . 1 1 13 13 VAL H H 1 -0.046 0.002 . . 1 13 VAL N 1 13 VAL H 16876 1 11 . 1 1 15 15 LYS N N 15 . 1 1 15 15 LYS H H 1 -0.043 0.001 . . 1 15 LYS N 1 15 LYS H 16876 1 12 . 1 1 16 16 VAL N N 15 . 1 1 16 16 VAL H H 1 0.050 0.002 . . 1 16 VAL N 1 16 VAL H 16876 1 13 . 1 1 17 17 ALA N N 15 . 1 1 17 17 ALA H H 1 -0.074 0.004 . . 1 17 ALA N 1 17 ALA H 16876 1 14 . 1 1 18 18 THR N N 15 . 1 1 18 18 THR H H 1 -0.098 0.002 . . 1 18 THR N 1 18 THR H 16876 1 15 . 1 1 19 19 GLU N N 15 . 1 1 19 19 GLU H H 1 -0.044 0.005 . . 1 19 GLU N 1 19 GLU H 16876 1 16 . 1 1 20 20 GLU N N 15 . 1 1 20 20 GLU H H 1 -0.046 0.001 . . 1 20 GLU N 1 20 GLU H 16876 1 17 . 1 1 21 21 SER N N 15 . 1 1 21 21 SER H H 1 -0.080 0.001 . . 1 21 SER N 1 21 SER H 16876 1 18 . 1 1 22 22 SER N N 15 . 1 1 22 22 SER H H 1 -0.058 0.003 . . 1 22 SER N 1 22 SER H 16876 1 19 . 1 1 23 23 ALA N N 15 . 1 1 23 23 ALA H H 1 -0.016 0.005 . . 1 23 ALA N 1 23 ALA H 16876 1 20 . 1 1 24 24 GLU N N 15 . 1 1 24 24 GLU H H 1 0.010 0.003 . . 1 24 GLU N 1 24 GLU H 16876 1 21 . 1 1 25 25 VAL N N 15 . 1 1 25 25 VAL H H 1 0.077 0.002 . . 1 25 VAL N 1 25 VAL H 16876 1 22 . 1 1 26 26 THR N N 15 . 1 1 26 26 THR H H 1 0.071 0.001 . . 1 26 THR N 1 26 THR H 16876 1 23 . 1 1 27 27 ASP N N 15 . 1 1 27 27 ASP H H 1 0.123 0.005 . . 1 27 ASP N 1 27 ASP H 16876 1 24 . 1 1 28 28 ARG N N 15 . 1 1 28 28 ARG H H 1 0.219 0.005 . . 1 28 ARG N 1 28 ARG H 16876 1 25 . 1 1 29 29 GLY N N 15 . 1 1 29 29 GLY H H 1 0.235 0.003 . . 1 29 GLY N 1 29 GLY H 16876 1 26 . 1 1 30 30 LEU N N 15 . 1 1 30 30 LEU H H 1 0.283 0.008 . . 1 30 LEU N 1 30 LEU H 16876 1 27 . 1 1 31 31 PHE N N 15 . 1 1 31 31 PHE H H 1 0.247 0.009 . . 1 31 PHE N 1 31 PHE H 16876 1 28 . 1 1 32 32 ASP N N 15 . 1 1 32 32 ASP H H 1 0.202 0.008 . . 1 32 ASP N 1 32 ASP H 16876 1 29 . 1 1 33 33 PHE N N 15 . 1 1 33 33 PHE H H 1 0.266 0.008 . . 1 33 PHE N 1 33 PHE H 16876 1 30 . 1 1 34 34 LEU N N 15 . 1 1 34 34 LEU H H 1 0.235 0.019 . . 1 34 LEU N 1 34 LEU H 16876 1 31 . 1 1 35 35 GLY N N 15 . 1 1 35 35 GLY H H 1 0.243 0.009 . . 1 35 GLY N 1 35 GLY H 16876 1 32 . 1 1 36 36 LYS N N 15 . 1 1 36 36 LYS H H 1 0.233 0.014 . . 1 36 LYS N 1 36 LYS H 16876 1 33 . 1 1 37 37 LYS N N 15 . 1 1 37 37 LYS H H 1 0.184 0.007 . . 1 37 LYS N 1 37 LYS H 16876 1 34 . 1 1 38 38 LYS N N 15 . 1 1 38 38 LYS H H 1 0.177 0.012 . . 1 38 LYS N 1 38 LYS H 16876 1 35 . 1 1 39 39 ASP N N 15 . 1 1 39 39 ASP H H 1 0.160 0.002 . . 1 39 ASP N 1 39 ASP H 16876 1 36 . 1 1 40 40 GLU N N 15 . 1 1 40 40 GLU H H 1 0.120 0.002 . . 1 40 GLU N 1 40 GLU H 16876 1 37 . 1 1 41 41 THR N N 15 . 1 1 41 41 THR H H 1 0.135 0.002 . . 1 41 THR N 1 41 THR H 16876 1 38 . 1 1 42 42 LYS N N 15 . 1 1 42 42 LYS H H 1 0.015 0.004 . . 1 42 LYS N 1 42 LYS H 16876 1 39 . 1 1 44 44 GLU N N 15 . 1 1 44 44 GLU H H 1 0.011 0.005 . . 1 44 GLU N 1 44 GLU H 16876 1 40 . 1 1 45 45 GLU N N 15 . 1 1 45 45 GLU H H 1 0.069 0.002 . . 1 45 GLU N 1 45 GLU H 16876 1 41 . 1 1 46 46 THR N N 15 . 1 1 46 46 THR H H 1 0.037 0.003 . . 1 46 THR N 1 46 THR H 16876 1 42 . 1 1 48 48 ILE N N 15 . 1 1 48 48 ILE H H 1 -0.003 0.001 . . 1 48 ILE N 1 48 ILE H 16876 1 43 . 1 1 49 49 ALA N N 15 . 1 1 49 49 ALA H H 1 0.003 0.002 . . 1 49 ALA N 1 49 ALA H 16876 1 44 . 1 1 50 50 SER N N 15 . 1 1 50 50 SER H H 1 0.041 0.006 . . 1 50 SER N 1 50 SER H 16876 1 45 . 1 1 51 51 GLU N N 15 . 1 1 51 51 GLU H H 1 0.054 0.003 . . 1 51 GLU N 1 51 GLU H 16876 1 46 . 1 1 52 52 PHE N N 15 . 1 1 52 52 PHE H H 1 0.107 0.004 . . 1 52 PHE N 1 52 PHE H 16876 1 47 . 1 1 53 53 GLU N N 15 . 1 1 53 53 GLU H H 1 0.112 0.005 . . 1 53 GLU N 1 53 GLU H 16876 1 48 . 1 1 54 54 GLN N N 15 . 1 1 54 54 GLN H H 1 0.094 0.003 . . 1 54 GLN N 1 54 GLN H 16876 1 49 . 1 1 55 55 LYS N N 15 . 1 1 55 55 LYS H H 1 0.097 0.003 . . 1 55 LYS N 1 55 LYS H 16876 1 50 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.081 0.005 . . 1 56 VAL N 1 56 VAL H 16876 1 51 . 1 1 57 57 HIS N N 15 . 1 1 57 57 HIS H H 1 0.032 0.006 . . 1 57 HIS N 1 57 HIS H 16876 1 52 . 1 1 58 58 ILE N N 15 . 1 1 58 58 ILE H H 1 -0.032 0.002 . . 1 58 ILE N 1 58 ILE H 16876 1 53 . 1 1 59 59 SER N N 15 . 1 1 59 59 SER H H 1 -0.079 0.003 . . 1 59 SER N 1 59 SER H 16876 1 54 . 1 1 60 60 GLU N N 15 . 1 1 60 60 GLU H H 1 -0.051 0.003 . . 1 60 GLU N 1 60 GLU H 16876 1 55 . 1 1 62 62 GLU N N 15 . 1 1 62 62 GLU H H 1 0.032 0.005 . . 1 62 GLU N 1 62 GLU H 16876 1 56 . 1 1 64 64 GLU N N 15 . 1 1 64 64 GLU H H 1 0.035 0.006 . . 1 64 GLU N 1 64 GLU H 16876 1 57 . 1 1 65 65 VAL N N 15 . 1 1 65 65 VAL H H 1 0.057 0.003 . . 1 65 VAL N 1 65 VAL H 16876 1 58 . 1 1 66 66 LYS N N 15 . 1 1 66 66 LYS H H 1 0.057 0.005 . . 1 66 LYS N 1 66 LYS H 16876 1 59 . 1 1 67 67 HIS N N 15 . 1 1 67 67 HIS H H 1 0.134 0.005 . . 1 67 HIS N 1 67 HIS H 16876 1 60 . 1 1 68 68 GLU N N 15 . 1 1 68 68 GLU H H 1 0.147 0.003 . . 1 68 GLU N 1 68 GLU H 16876 1 61 . 1 1 69 69 SER N N 15 . 1 1 69 69 SER H H 1 0.192 0.011 . . 1 69 SER N 1 69 SER H 16876 1 62 . 1 1 70 70 LEU N N 15 . 1 1 70 70 LEU H H 1 0.223 0.016 . . 1 70 LEU N 1 70 LEU H 16876 1 63 . 1 1 71 71 LEU N N 15 . 1 1 71 71 LEU H H 1 0.244 0.019 . . 1 71 LEU N 1 71 LEU H 16876 1 64 . 1 1 72 72 GLU N N 15 . 1 1 72 72 GLU H H 1 0.243 0.012 . . 1 72 GLU N 1 72 GLU H 16876 1 65 . 1 1 73 73 LYS N N 15 . 1 1 73 73 LYS H H 1 0.216 0.010 . . 1 73 LYS N 1 73 LYS H 16876 1 66 . 1 1 74 74 LEU N N 15 . 1 1 74 74 LEU H H 1 0.250 0.033 . . 1 74 LEU N 1 74 LEU H 16876 1 67 . 1 1 75 75 HIS N N 15 . 1 1 75 75 HIS H H 1 0.099 0.011 . . 1 75 HIS N 1 75 HIS H 16876 1 68 . 1 1 76 76 ARG N N 15 . 1 1 76 76 ARG H H 1 0.218 0.001 . . 1 76 ARG N 1 76 ARG H 16876 1 69 . 1 1 77 77 SER N N 15 . 1 1 77 77 SER H H 1 0.186 0.003 . . 1 77 SER N 1 77 SER H 16876 1 70 . 1 1 78 78 ASP N N 15 . 1 1 78 78 ASP H H 1 0.123 0.002 . . 1 78 ASP N 1 78 ASP H 16876 1 71 . 1 1 79 79 SER N N 15 . 1 1 79 79 SER H H 1 0.044 0.008 . . 1 79 SER N 1 79 SER H 16876 1 72 . 1 1 80 80 SER N N 15 . 1 1 80 80 SER H H 1 0.018 0.001 . . 1 80 SER N 1 80 SER H 16876 1 73 . 1 1 81 81 SER N N 15 . 1 1 81 81 SER H H 1 -0.018 0.001 . . 1 81 SER N 1 81 SER H 16876 1 74 . 1 1 82 82 SER N N 15 . 1 1 82 82 SER H H 1 -0.076 0.008 . . 1 82 SER N 1 82 SER H 16876 1 75 . 1 1 83 83 SER N N 15 . 1 1 83 83 SER H H 1 -0.035 0.000 . . 1 83 SER N 1 83 SER H 16876 1 76 . 1 1 84 84 SER N N 15 . 1 1 84 84 SER H H 1 -0.017 0.001 . . 1 84 SER N 1 84 SER H 16876 1 77 . 1 1 85 85 SER N N 15 . 1 1 85 85 SER H H 1 -0.019 0.002 . . 1 85 SER N 1 85 SER H 16876 1 78 . 1 1 86 86 GLU N N 15 . 1 1 86 86 GLU H H 1 0.087 0.001 . . 1 86 GLU N 1 86 GLU H 16876 1 79 . 1 1 87 87 GLU N N 15 . 1 1 87 87 GLU H H 1 0.084 0.003 . . 1 87 GLU N 1 87 GLU H 16876 1 80 . 1 1 88 88 GLU N N 15 . 1 1 88 88 GLU H H 1 0.104 0.001 . . 1 88 GLU N 1 88 GLU H 16876 1 81 . 1 1 89 89 GLY N N 15 . 1 1 89 89 GLY H H 1 0.111 0.007 . . 1 89 GLY N 1 89 GLY H 16876 1 82 . 1 1 90 90 SER N N 15 . 1 1 90 90 SER H H 1 0.164 0.005 . . 1 90 SER N 1 90 SER H 16876 1 83 . 1 1 91 91 ASP N N 15 . 1 1 91 91 ASP H H 1 0.201 0.001 . . 1 91 ASP N 1 91 ASP H 16876 1 84 . 1 1 92 92 GLY N N 15 . 1 1 92 92 GLY H H 1 0.235 0.007 . . 1 92 GLY N 1 92 GLY H 16876 1 85 . 1 1 93 93 GLU N N 15 . 1 1 93 93 GLU H H 1 0.276 0.015 . . 1 93 GLU N 1 93 GLU H 16876 1 86 . 1 1 94 94 LYS N N 15 . 1 1 94 94 LYS H H 1 0.224 0.004 . . 1 94 LYS N 1 94 LYS H 16876 1 87 . 1 1 95 95 ARG N N 15 . 1 1 95 95 ARG H H 1 0.289 0.001 . . 1 95 ARG N 1 95 ARG H 16876 1 88 . 1 1 96 96 LYS N N 15 . 1 1 96 96 LYS H H 1 0.022 0.004 . . 1 96 LYS N 1 96 LYS H 16876 1 89 . 1 1 97 97 LYS N N 15 . 1 1 97 97 LYS H H 1 0.260 0.007 . . 1 97 LYS N 1 97 LYS H 16876 1 90 . 1 1 98 98 LYS N N 15 . 1 1 98 98 LYS H H 1 0.178 0.006 . . 1 98 LYS N 1 98 LYS H 16876 1 91 . 1 1 99 99 LYS N N 15 . 1 1 99 99 LYS H H 1 0.109 0.002 . . 1 99 LYS N 1 99 LYS H 16876 1 92 . 1 1 100 100 GLU N N 15 . 1 1 100 100 GLU H H 1 0.073 0.002 . . 1 100 GLU N 1 100 GLU H 16876 1 93 . 1 1 101 101 LYS N N 15 . 1 1 101 101 LYS H H 1 0.109 0.003 . . 1 101 LYS N 1 101 LYS H 16876 1 94 . 1 1 102 102 LYS N N 15 . 1 1 102 102 LYS H H 1 0.143 0.004 . . 1 102 LYS N 1 102 LYS H 16876 1 95 . 1 1 103 103 LYS N N 15 . 1 1 103 103 LYS H H 1 0.087 0.003 . . 1 103 LYS N 1 103 LYS H 16876 1 96 . 1 1 105 105 THR N N 15 . 1 1 105 105 THR H H 1 0.080 0.003 . . 1 105 THR N 1 105 THR H 16876 1 97 . 1 1 106 106 THR N N 15 . 1 1 106 106 THR H H 1 0.092 0.002 . . 1 106 THR N 1 106 THR H 16876 1 98 . 1 1 107 107 GLU N N 15 . 1 1 107 107 GLU H H 1 0.082 0.001 . . 1 107 GLU N 1 107 GLU H 16876 1 99 . 1 1 108 108 VAL N N 15 . 1 1 108 108 VAL H H 1 0.119 0.002 . . 1 108 VAL N 1 108 VAL H 16876 1 100 . 1 1 109 109 GLU N N 15 . 1 1 109 109 GLU H H 1 0.029 0.012 . . 1 109 GLU N 1 109 GLU H 16876 1 101 . 1 1 110 110 VAL N N 15 . 1 1 110 110 VAL H H 1 0.063 0.006 . . 1 110 VAL N 1 110 VAL H 16876 1 102 . 1 1 111 111 LYS N N 15 . 1 1 111 111 LYS H H 1 0.073 0.006 . . 1 111 LYS N 1 111 LYS H 16876 1 103 . 1 1 112 112 GLU N N 15 . 1 1 112 112 GLU H H 1 0.175 0.004 . . 1 112 GLU N 1 112 GLU H 16876 1 104 . 1 1 113 113 GLU N N 15 . 1 1 113 113 GLU H H 1 0.163 0.005 . . 1 113 GLU N 1 113 GLU H 16876 1 105 . 1 1 114 114 GLU N N 15 . 1 1 114 114 GLU H H 1 0.149 0.010 . . 1 114 GLU N 1 114 GLU H 16876 1 106 . 1 1 115 115 LYS N N 15 . 1 1 115 115 LYS H H 1 0.189 0.004 . . 1 115 LYS N 1 115 LYS H 16876 1 107 . 1 1 116 116 LYS N N 15 . 1 1 116 116 LYS H H 1 0.197 0.008 . . 1 116 LYS N 1 116 LYS H 16876 1 108 . 1 1 117 117 GLY N N 15 . 1 1 117 117 GLY H H 1 0.214 0.002 . . 1 117 GLY N 1 117 GLY H 16876 1 109 . 1 1 118 118 PHE N N 15 . 1 1 118 118 PHE H H 1 0.269 0.005 . . 1 118 PHE N 1 118 PHE H 16876 1 110 . 1 1 119 119 MET N N 15 . 1 1 119 119 MET H H 1 0.205 0.008 . . 1 119 MET N 1 119 MET H 16876 1 111 . 1 1 120 120 GLU N N 15 . 1 1 120 120 GLU H H 1 0.159 0.007 . . 1 120 GLU N 1 120 GLU H 16876 1 112 . 1 1 121 121 LYS N N 15 . 1 1 121 121 LYS H H 1 0.166 0.008 . . 1 121 LYS N 1 121 LYS H 16876 1 113 . 1 1 122 122 LEU N N 15 . 1 1 122 122 LEU H H 1 0.209 0.008 . . 1 122 LEU N 1 122 LEU H 16876 1 114 . 1 1 123 123 LYS N N 15 . 1 1 123 123 LYS H H 1 0.215 0.009 . . 1 123 LYS N 1 123 LYS H 16876 1 115 . 1 1 124 124 GLU N N 15 . 1 1 124 124 GLU H H 1 0.175 0.004 . . 1 124 GLU N 1 124 GLU H 16876 1 116 . 1 1 125 125 LYS N N 15 . 1 1 125 125 LYS H H 1 0.157 0.014 . . 1 125 LYS N 1 125 LYS H 16876 1 117 . 1 1 126 126 LEU N N 15 . 1 1 126 126 LEU H H 1 0.110 0.011 . . 1 126 LEU N 1 126 LEU H 16876 1 118 . 1 1 128 128 GLY N N 15 . 1 1 128 128 GLY H H 1 0.174 0.004 . . 1 128 GLY N 1 128 GLY H 16876 1 119 . 1 1 129 129 HIS N N 15 . 1 1 129 129 HIS H H 1 0.171 0.007 . . 1 129 HIS N 1 129 HIS H 16876 1 120 . 1 1 130 130 LYS N N 15 . 1 1 130 130 LYS H H 1 0.140 0.007 . . 1 130 LYS N 1 130 LYS H 16876 1 121 . 1 1 131 131 LYS N N 15 . 1 1 131 131 LYS H H 1 0.050 0.010 . . 1 131 LYS N 1 131 LYS H 16876 1 122 . 1 1 133 133 GLU N N 15 . 1 1 133 133 GLU H H 1 0.076 0.008 . . 1 133 GLU N 1 133 GLU H 16876 1 123 . 1 1 134 134 ASP N N 15 . 1 1 134 134 ASP H H 1 0.023 0.005 . . 1 134 ASP N 1 134 ASP H 16876 1 124 . 1 1 135 135 GLY N N 15 . 1 1 135 135 GLY H H 1 -0.034 0.006 . . 1 135 GLY N 1 135 GLY H 16876 1 125 . 1 1 136 136 SER N N 15 . 1 1 136 136 SER H H 1 0.055 0.002 . . 1 136 SER N 1 136 SER H 16876 1 126 . 1 1 137 137 ALA N N 15 . 1 1 137 137 ALA H H 1 -0.101 0.004 . . 1 137 ALA N 1 137 ALA H 16876 1 127 . 1 1 138 138 VAL N N 15 . 1 1 138 138 VAL H H 1 -0.290 0.000 . . 1 138 VAL N 1 138 VAL H 16876 1 128 . 1 1 139 139 ALA N N 15 . 1 1 139 139 ALA H H 1 -0.329 0.001 . . 1 139 ALA N 1 139 ALA H 16876 1 129 . 1 1 140 140 ALA N N 15 . 1 1 140 140 ALA H H 1 -0.317 0.000 . . 1 140 ALA N 1 140 ALA H 16876 1 130 . 1 1 141 141 ALA N N 15 . 1 1 141 141 ALA H H 1 -0.308 -0.001 . . 1 141 ALA N 1 141 ALA H 16876 1 131 . 1 1 143 143 VAL N N 15 . 1 1 143 143 VAL H H 1 -0.153 -0.001 . . 1 143 VAL N 1 143 VAL H 16876 1 132 . 1 1 144 144 VAL N N 15 . 1 1 144 144 VAL H H 1 -0.146 0.001 . . 1 144 VAL N 1 144 VAL H 16876 1 133 . 1 1 145 145 VAL N N 15 . 1 1 145 145 VAL H H 1 -0.100 0.001 . . 1 145 VAL N 1 145 VAL H 16876 1 134 . 1 1 149 149 VAL N N 15 . 1 1 149 149 VAL H H 1 -0.009 0.006 . . 1 149 VAL N 1 149 VAL H 16876 1 135 . 1 1 150 150 GLU N N 15 . 1 1 150 150 GLU H H 1 -0.026 0.007 . . 1 150 GLU N 1 150 GLU H 16876 1 136 . 1 1 151 151 GLU N N 15 . 1 1 151 151 GLU H H 1 0.040 0.001 . . 1 151 GLU N 1 151 GLU H 16876 1 137 . 1 1 152 152 ALA N N 15 . 1 1 152 152 ALA H H 1 0.004 0.003 . . 1 152 ALA N 1 152 ALA H 16876 1 138 . 1 1 153 153 HIS N N 15 . 1 1 153 153 HIS H H 1 -0.084 -0.002 . . 1 153 HIS N 1 153 HIS H 16876 1 139 . 1 1 155 155 VAL N N 15 . 1 1 155 155 VAL H H 1 -0.026 0.008 . . 1 155 VAL N 1 155 VAL H 16876 1 140 . 1 1 156 156 GLU N N 15 . 1 1 156 156 GLU H H 1 0.014 0.003 . . 1 156 GLU N 1 156 GLU H 16876 1 141 . 1 1 157 157 LYS N N 15 . 1 1 157 157 LYS H H 1 0.093 0.001 . . 1 157 LYS N 1 157 LYS H 16876 1 142 . 1 1 158 158 LYS N N 15 . 1 1 158 158 LYS H H 1 0.088 0.003 . . 1 158 LYS N 1 158 LYS H 16876 1 143 . 1 1 159 159 GLY N N 15 . 1 1 159 159 GLY H H 1 0.079 0.001 . . 1 159 GLY N 1 159 GLY H 16876 1 144 . 1 1 160 160 ILE N N 15 . 1 1 160 160 ILE H H 1 0.152 0.005 . . 1 160 ILE N 1 160 ILE H 16876 1 145 . 1 1 161 161 LEU N N 15 . 1 1 161 161 LEU H H 1 0.128 0.013 . . 1 161 LEU N 1 161 LEU H 16876 1 146 . 1 1 162 162 GLU N N 15 . 1 1 162 162 GLU H H 1 0.134 0.012 . . 1 162 GLU N 1 162 GLU H 16876 1 147 . 1 1 163 163 LYS N N 15 . 1 1 163 163 LYS H H 1 0.162 0.010 . . 1 163 LYS N 1 163 LYS H 16876 1 148 . 1 1 164 164 ILE N N 15 . 1 1 164 164 ILE H H 1 0.206 0.011 . . 1 164 ILE N 1 164 ILE H 16876 1 149 . 1 1 165 165 LYS N N 15 . 1 1 165 165 LYS H H 1 0.130 0.013 . . 1 165 LYS N 1 165 LYS H 16876 1 150 . 1 1 166 166 GLU N N 15 . 1 1 166 166 GLU H H 1 0.050 0.007 . . 1 166 GLU N 1 166 GLU H 16876 1 151 . 1 1 167 167 LYS N N 15 . 1 1 167 167 LYS H H 1 0.174 0.003 . . 1 167 LYS N 1 167 LYS H 16876 1 152 . 1 1 168 168 LEU N N 15 . 1 1 168 168 LEU H H 1 0.160 0.021 . . 1 168 LEU N 1 168 LEU H 16876 1 153 . 1 1 170 170 GLY N N 15 . 1 1 170 170 GLY H H 1 0.142 0.016 . . 1 170 GLY N 1 170 GLY H 16876 1 154 . 1 1 171 171 TYR N N 15 . 1 1 171 171 TYR H H 1 0.270 0.023 . . 1 171 TYR N 1 171 TYR H 16876 1 155 . 1 1 172 172 HIS N N 15 . 1 1 172 172 HIS H H 1 0.166 0.009 . . 1 172 HIS N 1 172 HIS H 16876 1 156 . 1 1 174 174 LYS N N 15 . 1 1 174 174 LYS H H 1 0.174 0.011 . . 1 174 LYS N 1 174 LYS H 16876 1 157 . 1 1 175 175 THR N N 15 . 1 1 175 175 THR H H 1 0.124 0.010 . . 1 175 THR N 1 175 THR H 16876 1 158 . 1 1 176 176 THR N N 15 . 1 1 176 176 THR H H 1 0.110 0.008 . . 1 176 THR N 1 176 THR H 16876 1 159 . 1 1 177 177 VAL N N 15 . 1 1 177 177 VAL H H 1 0.070 0.006 . . 1 177 VAL N 1 177 VAL H 16876 1 160 . 1 1 178 178 GLU N N 15 . 1 1 178 178 GLU H H 1 0.067 0.005 . . 1 178 GLU N 1 178 GLU H 16876 1 161 . 1 1 179 179 GLU N N 15 . 1 1 179 179 GLU H H 1 0.085 0.002 . . 1 179 GLU N 1 179 GLU H 16876 1 162 . 1 1 180 180 GLU N N 15 . 1 1 180 180 GLU H H 1 0.074 0.001 . . 1 180 GLU N 1 180 GLU H 16876 1 163 . 1 1 181 181 LYS N N 15 . 1 1 181 181 LYS H H 1 0.029 0.003 . . 1 181 LYS N 1 181 LYS H 16876 1 164 . 1 1 182 182 LYS N N 15 . 1 1 182 182 LYS H H 1 0.028 0.004 . . 1 182 LYS N 1 182 LYS H 16876 1 165 . 1 1 183 183 ASP N N 15 . 1 1 183 183 ASP H H 1 -0.130 0.006 . . 1 183 ASP N 1 183 ASP H 16876 1 166 . 1 1 184 184 LYS N N 15 . 1 1 184 184 LYS H H 1 -0.320 0.001 . . 1 184 LYS N 1 184 LYS H 16876 1 167 . 1 1 185 185 GLU N N 15 . 1 1 185 185 GLU H H 1 -0.762 0.010 . . 1 185 GLU N 1 185 GLU H 16876 1 stop_ save_