############################## # 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 15562 _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 600.13 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 5.00E+06 _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 19 'NMR relaxation' . . . 15562 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 $NMRPipe . . 15562 1 2 $SPARKY . . 15562 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 4 4 GLU N N 15 . 1 1 4 4 GLU H H 1 -0.02932 0.00335 . . . . . . . . . . 15562 1 2 . 1 1 6 6 GLN N N 15 . 1 1 6 6 GLN H H 1 0.10927 0.00665 . . . . . . . . . . 15562 1 3 . 1 1 7 7 ALA N N 15 . 1 1 7 7 ALA H H 1 0.25403 0.00634 . . . . . . . . . . 15562 1 4 . 1 1 9 9 ARG N N 15 . 1 1 9 9 ARG H H 1 0.36731 0.00763 . . . . . . . . . . 15562 1 5 . 1 1 10 10 GLU N N 15 . 1 1 10 10 GLU H H 1 0.26466 0.00667 . . . . . . . . . . 15562 1 6 . 1 1 11 11 ALA N N 15 . 1 1 11 11 ALA H H 1 0.33697 0.00797 . . . . . . . . . . 15562 1 7 . 1 1 12 12 ARG N N 15 . 1 1 12 12 ARG H H 1 0.3717 0.00863 . . . . . . . . . . 15562 1 8 . 1 1 13 13 LEU N N 15 . 1 1 13 13 LEU H H 1 0.264 0.00535 . . . . . . . . . . 15562 1 9 . 1 1 15 15 GLN N N 15 . 1 1 15 15 GLN H H 1 0.22936 0.00748 . . . . . . . . . . 15562 1 10 . 1 1 18 18 ASN N N 15 . 1 1 18 18 ASN H H 1 0.11115 0.00863 . . . . . . . . . . 15562 1 11 . 1 1 19 19 ASN N N 15 . 1 1 19 19 ASN H H 1 0.21245 0.00818 . . . . . . . . . . 15562 1 12 . 1 1 22 22 GLY N N 15 . 1 1 22 22 GLY H H 1 -0.37273 0.00799 . . . . . . . . . . 15562 1 13 . 1 1 23 23 THR N N 15 . 1 1 23 23 THR H H 1 -0.26624 0.00792 . . . . . . . . . . 15562 1 14 . 1 1 24 24 ASN N N 15 . 1 1 24 24 ASN H H 1 -0.33775 0.00885 . . . . . . . . . . 15562 1 15 . 1 1 25 25 GLY N N 15 . 1 1 25 25 GLY H H 1 -0.44496 0.00987 . . . . . . . . . . 15562 1 16 . 1 1 26 26 ASP N N 15 . 1 1 26 26 ASP H H 1 -0.08719 0.00391 . . . . . . . . . . 15562 1 17 . 1 1 27 27 ARG N N 15 . 1 1 27 27 ARG H H 1 -0.26414 0.00656 . . . . . . . . . . 15562 1 18 . 1 1 28 28 ASN N N 15 . 1 1 28 28 ASN H H 1 -0.12516 0.00609 . . . . . . . . . . 15562 1 19 . 1 1 29 29 SER N N 15 . 1 1 29 29 SER H H 1 -0.33348 0.01115 . . . . . . . . . . 15562 1 20 . 1 1 30 30 GLY N N 15 . 1 1 30 30 GLY H H 1 -0.27993 0.00504 . . . . . . . . . . 15562 1 21 . 1 1 32 32 ASN N N 15 . 1 1 32 32 ASN H H 1 -0.52827 0.01043 . . . . . . . . . . 15562 1 22 . 1 1 33 33 ASN N N 15 . 1 1 33 33 ASN H H 1 -0.53201 0.01004 . . . . . . . . . . 15562 1 23 . 1 1 34 34 GLY N N 15 . 1 1 34 34 GLY H H 1 -0.41193 0.00833 . . . . . . . . . . 15562 1 24 . 1 1 35 35 GLY N N 15 . 1 1 35 35 GLY H H 1 -0.42193 0.00411 . . . . . . . . . . 15562 1 25 . 1 1 37 37 GLU N N 15 . 1 1 37 37 GLU H H 1 -0.05084 0.00364 . . . . . . . . . . 15562 1 26 . 1 1 38 38 ASN N N 15 . 1 1 38 38 ASN H H 1 -0.09596 0.00505 . . . . . . . . . . 15562 1 27 . 1 1 39 39 SER N N 15 . 1 1 39 39 SER H H 1 -0.22708 0.00734 . . . . . . . . . . 15562 1 28 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 0.15812 0.00516 . . . . . . . . . . 15562 1 29 . 1 1 42 42 VAL N N 15 . 1 1 42 42 VAL H H 1 0.3667 0.01314 . . . . . . . . . . 15562 1 30 . 1 1 43 43 GLY N N 15 . 1 1 43 43 GLY H H 1 0.54187 0.02619 . . . . . . . . . . 15562 1 31 . 1 1 45 45 ALA N N 15 . 1 1 45 45 ALA H H 1 0.63628 0.01572 . . . . . . . . . . 15562 1 32 . 1 1 46 46 ILE N N 15 . 1 1 46 46 ILE H H 1 0.67886 0.03265 . . . . . . . . . . 15562 1 33 . 1 1 47 47 ALA N N 15 . 1 1 47 47 ALA H H 1 0.70849 0.02237 . . . . . . . . . . 15562 1 34 . 1 1 48 48 ASN N N 15 . 1 1 48 48 ASN H H 1 0.68366 0.01595 . . . . . . . . . . 15562 1 35 . 1 1 50 50 LEU N N 15 . 1 1 50 50 LEU H H 1 0.71781 0.0183 . . . . . . . . . . 15562 1 36 . 1 1 51 51 GLU N N 15 . 1 1 51 51 GLU H H 1 0.73578 0.03241 . . . . . . . . . . 15562 1 37 . 1 1 53 53 GLN N N 15 . 1 1 53 53 GLN H H 1 0.77028 0.021 . . . . . . . . . . 15562 1 38 . 1 1 54 54 ALA N N 15 . 1 1 54 54 ALA H H 1 0.75067 0.02101 . . . . . . . . . . 15562 1 39 . 1 1 55 55 LEU N N 15 . 1 1 55 55 LEU H H 1 0.77241 0.02426 . . . . . . . . . . 15562 1 40 . 1 1 56 56 GLU N N 15 . 1 1 56 56 GLU H H 1 0.69744 0.01739 . . . . . . . . . . 15562 1 41 . 1 1 57 57 ARG N N 15 . 1 1 57 57 ARG H H 1 0.78283 0.01921 . . . . . . . . . . 15562 1 42 . 1 1 58 58 LEU N N 15 . 1 1 58 58 LEU H H 1 0.7329 0.00761 . . . . . . . . . . 15562 1 43 . 1 1 59 59 SER N N 15 . 1 1 59 59 SER H H 1 0.73295 0.01715 . . . . . . . . . . 15562 1 44 . 1 1 61 61 VAL N N 15 . 1 1 61 61 VAL H H 1 0.7525 0.01944 . . . . . . . . . . 15562 1 45 . 1 1 62 62 ALA N N 15 . 1 1 62 62 ALA H H 1 0.74752 0.01792 . . . . . . . . . . 15562 1 46 . 1 1 63 63 LEU N N 15 . 1 1 63 63 LEU H H 1 0.71972 0.01887 . . . . . . . . . . 15562 1 47 . 1 1 64 64 VAL N N 15 . 1 1 64 64 VAL H H 1 0.64 0.01885 . . . . . . . . . . 15562 1 48 . 1 1 65 65 ARG N N 15 . 1 1 65 65 ARG H H 1 0.70998 0.02527 . . . . . . . . . . 15562 1 49 . 1 1 66 66 ARG N N 15 . 1 1 66 66 ARG H H 1 0.74596 0.0298 . . . . . . . . . . 15562 1 50 . 1 1 67 67 ASP N N 15 . 1 1 67 67 ASP H H 1 0.79326 0.02504 . . . . . . . . . . 15562 1 51 . 1 1 68 68 ARG N N 15 . 1 1 68 68 ARG H H 1 0.69182 0.0218 . . . . . . . . . . 15562 1 52 . 1 1 69 69 ALA N N 15 . 1 1 69 69 ALA H H 1 0.70263 0.0245 . . . . . . . . . . 15562 1 53 . 1 1 70 70 GLN N N 15 . 1 1 70 70 GLN H H 1 0.73546 0.01987 . . . . . . . . . . 15562 1 54 . 1 1 71 71 ALA N N 15 . 1 1 71 71 ALA H H 1 0.79059 0.02057 . . . . . . . . . . 15562 1 55 . 1 1 72 72 VAL N N 15 . 1 1 72 72 VAL H H 1 0.74724 0.02466 . . . . . . . . . . 15562 1 56 . 1 1 74 74 THR N N 15 . 1 1 74 74 THR H H 1 0.77907 0.02377 . . . . . . . . . . 15562 1 57 . 1 1 76 76 LEU N N 15 . 1 1 76 76 LEU H H 1 0.76516 0.01397 . . . . . . . . . . 15562 1 58 . 1 1 78 78 LYS N N 15 . 1 1 78 78 LYS H H 1 0.73548 0.01685 . . . . . . . . . . 15562 1 59 . 1 1 79 79 LEU N N 15 . 1 1 79 79 LEU H H 1 0.74415 0.02746 . . . . . . . . . . 15562 1 60 . 1 1 81 81 ALA N N 15 . 1 1 81 81 ALA H H 1 0.75374 0.02091 . . . . . . . . . . 15562 1 61 . 1 1 82 82 THR N N 15 . 1 1 82 82 THR H H 1 0.70185 0.01849 . . . . . . . . . . 15562 1 62 . 1 1 83 83 ASN N N 15 . 1 1 83 83 ASN H H 1 0.65261 0.01687 . . . . . . . . . . 15562 1 63 . 1 1 84 84 ASN N N 15 . 1 1 84 84 ASN H H 1 0.49382 0.00646 . . . . . . . . . . 15562 1 64 . 1 1 85 85 VAL N N 15 . 1 1 85 85 VAL H H 1 0.19123 0.00386 . . . . . . . . . . 15562 1 65 . 1 1 87 87 HIS N N 15 . 1 1 87 87 HIS H H 1 0.62504 0.01309 . . . . . . . . . . 15562 1 66 . 1 1 88 88 LYS N N 15 . 1 1 88 88 LYS H H 1 0.64762 0.01656 . . . . . . . . . . 15562 1 67 . 1 1 89 89 ILE N N 15 . 1 1 89 89 ILE H H 1 0.71905 0.03754 . . . . . . . . . . 15562 1 68 . 1 1 90 90 THR N N 15 . 1 1 90 90 THR H H 1 0.7646 0.028 . . . . . . . . . . 15562 1 69 . 1 1 91 91 GLU N N 15 . 1 1 91 91 GLU H H 1 0.75317 0.02494 . . . . . . . . . . 15562 1 70 . 1 1 92 92 ALA N N 15 . 1 1 92 92 ALA H H 1 0.7048 0.01415 . . . . . . . . . . 15562 1 71 . 1 1 93 93 GLU N N 15 . 1 1 93 93 GLU H H 1 0.75548 0.02225 . . . . . . . . . . 15562 1 72 . 1 1 94 94 ILE N N 15 . 1 1 94 94 ILE H H 1 0.74677 0.02282 . . . . . . . . . . 15562 1 73 . 1 1 95 95 VAL N N 15 . 1 1 95 95 VAL H H 1 0.61689 0.01718 . . . . . . . . . . 15562 1 74 . 1 1 96 96 SER N N 15 . 1 1 96 96 SER H H 1 0.7684 0.0185 . . . . . . . . . . 15562 1 75 . 1 1 98 98 LEU N N 15 . 1 1 98 98 LEU H H 1 0.73172 0.01855 . . . . . . . . . . 15562 1 76 . 1 1 99 99 ASN N N 15 . 1 1 99 99 ASN H H 1 0.59672 0.01281 . . . . . . . . . . 15562 1 77 . 1 1 100 100 GLY N N 15 . 1 1 100 100 GLY H H 1 0.69733 0.01927 . . . . . . . . . . 15562 1 78 . 1 1 101 101 ILE N N 15 . 1 1 101 101 ILE H H 1 0.686 0.00563 . . . . . . . . . . 15562 1 79 . 1 1 102 102 ALA N N 15 . 1 1 102 102 ALA H H 1 0.62412 0.01338 . . . . . . . . . . 15562 1 80 . 1 1 103 103 LYS N N 15 . 1 1 103 103 LYS H H 1 0.60559 0.01553 . . . . . . . . . . 15562 1 81 . 1 1 104 104 GLN N N 15 . 1 1 104 104 GLN H H 1 0.57995 0.01244 . . . . . . . . . . 15562 1 82 . 1 1 105 105 GLN N N 15 . 1 1 105 105 GLN H H 1 0.44303 0.01243 . . . . . . . . . . 15562 1 83 . 1 1 108 108 GLN N N 15 . 1 1 108 108 GLN H H 1 0.21774 0.00773 . . . . . . . . . . 15562 1 84 . 1 1 109 109 ASN N N 15 . 1 1 109 109 ASN H H 1 0.2032 0.00593 . . . . . . . . . . 15562 1 85 . 1 1 112 112 LYS N N 15 . 1 1 112 112 LYS H H 1 0.2381 0.00752 . . . . . . . . . . 15562 1 86 . 1 1 113 113 ILE N N 15 . 1 1 113 113 ILE H H 1 0.1399 0.00475 . . . . . . . . . . 15562 1 87 . 1 1 114 114 ILE N N 15 . 1 1 114 114 ILE H H 1 0.14971 0.00633 . . . . . . . . . . 15562 1 88 . 1 1 115 115 PHE N N 15 . 1 1 115 115 PHE H H 1 0.18718 0.0072 . . . . . . . . . . 15562 1 89 . 1 1 116 116 GLU N N 15 . 1 1 116 116 GLU H H 1 0.1278 0.00582 . . . . . . . . . . 15562 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_Heteronuclear_noe_list_2 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode Heteronuclear_noe_list_2 _Heteronucl_NOE_list.Entry_ID 15562 _Heteronucl_NOE_list.ID 2 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 500.13 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 5.00E+06 _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 19 'NMR relaxation' . . . 15562 2 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 $NMRPipe . . 15562 2 2 $SPARKY . . 15562 2 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 4 4 GLU N N 15 . 1 1 4 4 GLU H H 1 -0.29144 0.0102 . . . . . . . . . . 15562 2 2 . 1 1 5 5 LEU N N 15 . 1 1 5 5 LEU H H 1 -0.08091 0.008 . . . . . . . . . . 15562 2 3 . 1 1 7 7 ALA N N 15 . 1 1 7 7 ALA H H 1 0.26424 0.0106 . . . . . . . . . . 15562 2 4 . 1 1 8 8 ILE N N 15 . 1 1 8 8 ILE H H 1 0.27698 0.01101 . . . . . . . . . . 15562 2 5 . 1 1 9 9 ARG N N 15 . 1 1 9 9 ARG H H 1 0.24267 0.00956 . . . . . . . . . . 15562 2 6 . 1 1 10 10 GLU N N 15 . 1 1 10 10 GLU H H 1 0.20517 0.01113 . . . . . . . . . . 15562 2 7 . 1 1 11 11 ALA N N 15 . 1 1 11 11 ALA H H 1 0.22628 0.01069 . . . . . . . . . . 15562 2 8 . 1 1 12 12 ARG N N 15 . 1 1 12 12 ARG H H 1 0.246 0.0119 . . . . . . . . . . 15562 2 9 . 1 1 13 13 LEU N N 15 . 1 1 13 13 LEU H H 1 0.18 0.00937 . . . . . . . . . . 15562 2 10 . 1 1 14 14 ALA N N 15 . 1 1 14 14 ALA H H 1 0.18 0.00937 . . . . . . . . . . 15562 2 11 . 1 1 15 15 GLN N N 15 . 1 1 15 15 GLN H H 1 0.08773 0.00924 . . . . . . . . . . 15562 2 12 . 1 1 18 18 ASN N N 15 . 1 1 18 18 ASN H H 1 -0.21075 0.01615 . . . . . . . . . . 15562 2 13 . 1 1 22 22 GLY N N 15 . 1 1 22 22 GLY H H 1 -0.98644 0.02246 . . . . . . . . . . 15562 2 14 . 1 1 23 23 THR N N 15 . 1 1 23 23 THR H H 1 -0.78059 0.02197 . . . . . . . . . . 15562 2 15 . 1 1 24 24 ASN N N 15 . 1 1 24 24 ASN H H 1 -0.77876 0.02618 . . . . . . . . . . 15562 2 16 . 1 1 25 25 GLY N N 15 . 1 1 25 25 GLY H H 1 -0.80353 0.02209 . . . . . . . . . . 15562 2 17 . 1 1 26 26 ASP N N 15 . 1 1 26 26 ASP H H 1 -0.4836 0.01077 . . . . . . . . . . 15562 2 18 . 1 1 27 27 ARG N N 15 . 1 1 27 27 ARG H H 1 -0.48417 0.01431 . . . . . . . . . . 15562 2 19 . 1 1 28 28 ASN N N 15 . 1 1 28 28 ASN H H 1 -0.41462 0.01693 . . . . . . . . . . 15562 2 20 . 1 1 29 29 SER N N 15 . 1 1 29 29 SER H H 1 -0.58116 0.02159 . . . . . . . . . . 15562 2 21 . 1 1 30 30 GLY N N 15 . 1 1 30 30 GLY H H 1 -0.60944 0.01457 . . . . . . . . . . 15562 2 22 . 1 1 31 31 ALA N N 15 . 1 1 31 31 ALA H H 1 -0.1979 0.00719 . . . . . . . . . . 15562 2 23 . 1 1 32 32 ASN N N 15 . 1 1 32 32 ASN H H 1 -0.6918 0.02091 . . . . . . . . . . 15562 2 24 . 1 1 33 33 ASN N N 15 . 1 1 33 33 ASN H H 1 -0.72118 0.01792 . . . . . . . . . . 15562 2 25 . 1 1 34 34 GLY N N 15 . 1 1 34 34 GLY H H 1 -0.70501 0.02139 . . . . . . . . . . 15562 2 26 . 1 1 35 35 GLY N N 15 . 1 1 35 35 GLY H H 1 -0.8588 0.00948 . . . . . . . . . . 15562 2 27 . 1 1 37 37 GLU N N 15 . 1 1 37 37 GLU H H 1 -0.35925 0.01128 . . . . . . . . . . 15562 2 28 . 1 1 38 38 ASN N N 15 . 1 1 38 38 ASN H H 1 -0.34938 0.01436 . . . . . . . . . . 15562 2 29 . 1 1 39 39 SER N N 15 . 1 1 39 39 SER H H 1 -0.67949 0.01936 . . . . . . . . . . 15562 2 30 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 -0.06424 0.00897 . . . . . . . . . . 15562 2 31 . 1 1 42 42 VAL N N 15 . 1 1 42 42 VAL H H 1 0.28895 0.02012 . . . . . . . . . . 15562 2 32 . 1 1 43 43 GLY N N 15 . 1 1 43 43 GLY H H 1 0.50306 0.03429 . . . . . . . . . . 15562 2 33 . 1 1 44 44 ALA N N 15 . 1 1 44 44 ALA H H 1 0.61915 0.02631 . . . . . . . . . . 15562 2 34 . 1 1 45 45 ALA N N 15 . 1 1 45 45 ALA H H 1 0.59626 0.02533 . . . . . . . . . . 15562 2 35 . 1 1 46 46 ILE N N 15 . 1 1 46 46 ILE H H 1 0.64287 0.05084 . . . . . . . . . . 15562 2 36 . 1 1 47 47 ALA N N 15 . 1 1 47 47 ALA H H 1 0.64177 0.03542 . . . . . . . . . . 15562 2 37 . 1 1 48 48 ASN N N 15 . 1 1 48 48 ASN H H 1 0.61962 0.02756 . . . . . . . . . . 15562 2 38 . 1 1 50 50 LEU N N 15 . 1 1 50 50 LEU H H 1 0.69374 0.03117 . . . . . . . . . . 15562 2 39 . 1 1 51 51 GLU N N 15 . 1 1 51 51 GLU H H 1 0.71932 0.04246 . . . . . . . . . . 15562 2 40 . 1 1 53 53 GLN N N 15 . 1 1 53 53 GLN H H 1 0.71347 0.02884 . . . . . . . . . . 15562 2 41 . 1 1 54 54 ALA N N 15 . 1 1 54 54 ALA H H 1 0.71326 0.03536 . . . . . . . . . . 15562 2 42 . 1 1 55 55 LEU N N 15 . 1 1 55 55 LEU H H 1 0.73659 0.03475 . . . . . . . . . . 15562 2 43 . 1 1 56 56 GLU N N 15 . 1 1 56 56 GLU H H 1 0.60123 0.02346 . . . . . . . . . . 15562 2 44 . 1 1 57 57 ARG N N 15 . 1 1 57 57 ARG H H 1 0.76838 0.02892 . . . . . . . . . . 15562 2 45 . 1 1 58 58 LEU N N 15 . 1 1 58 58 LEU H H 1 0.71937 0.01164 . . . . . . . . . . 15562 2 46 . 1 1 59 59 SER N N 15 . 1 1 59 59 SER H H 1 0.68637 0.03013 . . . . . . . . . . 15562 2 47 . 1 1 60 60 ARG N N 15 . 1 1 60 60 ARG H H 1 0.65407 0.01099 . . . . . . . . . . 15562 2 48 . 1 1 61 61 VAL N N 15 . 1 1 61 61 VAL H H 1 0.66037 0.03017 . . . . . . . . . . 15562 2 49 . 1 1 62 62 ALA N N 15 . 1 1 62 62 ALA H H 1 0.67787 0.02736 . . . . . . . . . . 15562 2 50 . 1 1 63 63 LEU N N 15 . 1 1 63 63 LEU H H 1 0.67468 0.02924 . . . . . . . . . . 15562 2 51 . 1 1 64 64 VAL N N 15 . 1 1 64 64 VAL H H 1 0.64794 0.03439 . . . . . . . . . . 15562 2 52 . 1 1 65 65 ARG N N 15 . 1 1 65 65 ARG H H 1 0.65067 0.03693 . . . . . . . . . . 15562 2 53 . 1 1 66 66 ARG N N 15 . 1 1 66 66 ARG H H 1 0.71883 0.03838 . . . . . . . . . . 15562 2 54 . 1 1 67 67 ASP N N 15 . 1 1 67 67 ASP H H 1 0.7204 0.02759 . . . . . . . . . . 15562 2 55 . 1 1 68 68 ARG N N 15 . 1 1 68 68 ARG H H 1 0.63919 0.03488 . . . . . . . . . . 15562 2 56 . 1 1 69 69 ALA N N 15 . 1 1 69 69 ALA H H 1 0.73564 0.03945 . . . . . . . . . . 15562 2 57 . 1 1 70 70 GLN N N 15 . 1 1 70 70 GLN H H 1 0.68387 0.02895 . . . . . . . . . . 15562 2 58 . 1 1 71 71 ALA N N 15 . 1 1 71 71 ALA H H 1 0.73915 0.02928 . . . . . . . . . . 15562 2 59 . 1 1 72 72 VAL N N 15 . 1 1 72 72 VAL H H 1 0.69303 0.03698 . . . . . . . . . . 15562 2 60 . 1 1 74 74 THR N N 15 . 1 1 74 74 THR H H 1 0.77389 0.03679 . . . . . . . . . . 15562 2 61 . 1 1 76 76 LEU N N 15 . 1 1 76 76 LEU H H 1 0.68304 0.02283 . . . . . . . . . . 15562 2 62 . 1 1 78 78 LYS N N 15 . 1 1 78 78 LYS H H 1 0.73041 0.02888 . . . . . . . . . . 15562 2 63 . 1 1 79 79 LEU N N 15 . 1 1 79 79 LEU H H 1 0.71652 0.0398 . . . . . . . . . . 15562 2 64 . 1 1 81 81 ALA N N 15 . 1 1 81 81 ALA H H 1 0.71452 0.03046 . . . . . . . . . . 15562 2 65 . 1 1 82 82 THR N N 15 . 1 1 82 82 THR H H 1 0.68777 0.02974 . . . . . . . . . . 15562 2 66 . 1 1 83 83 ASN N N 15 . 1 1 83 83 ASN H H 1 0.60618 0.0262 . . . . . . . . . . 15562 2 67 . 1 1 84 84 ASN N N 15 . 1 1 84 84 ASN H H 1 0.3808 0.00945 . . . . . . . . . . 15562 2 68 . 1 1 85 85 VAL N N 15 . 1 1 85 85 VAL H H 1 0.12372 0.00541 . . . . . . . . . . 15562 2 69 . 1 1 87 87 HIS N N 15 . 1 1 87 87 HIS H H 1 0.54256 0.021 . . . . . . . . . . 15562 2 70 . 1 1 88 88 LYS N N 15 . 1 1 88 88 LYS H H 1 0.60148 0.02982 . . . . . . . . . . 15562 2 71 . 1 1 89 89 ILE N N 15 . 1 1 89 89 ILE H H 1 0.64649 0.04859 . . . . . . . . . . 15562 2 72 . 1 1 90 90 THR N N 15 . 1 1 90 90 THR H H 1 0.68074 0.0437 . . . . . . . . . . 15562 2 73 . 1 1 91 91 GLU N N 15 . 1 1 91 91 GLU H H 1 0.77488 0.0456 . . . . . . . . . . 15562 2 74 . 1 1 92 92 ALA N N 15 . 1 1 92 92 ALA H H 1 0.61224 0.02241 . . . . . . . . . . 15562 2 75 . 1 1 93 93 GLU N N 15 . 1 1 93 93 GLU H H 1 0.76982 0.03816 . . . . . . . . . . 15562 2 76 . 1 1 94 94 ILE N N 15 . 1 1 94 94 ILE H H 1 0.66633 0.03487 . . . . . . . . . . 15562 2 77 . 1 1 95 95 VAL N N 15 . 1 1 95 95 VAL H H 1 0.56981 0.03278 . . . . . . . . . . 15562 2 78 . 1 1 96 96 SER N N 15 . 1 1 96 96 SER H H 1 0.7026 0.02798 . . . . . . . . . . 15562 2 79 . 1 1 98 98 LEU N N 15 . 1 1 98 98 LEU H H 1 0.70059 0.03424 . . . . . . . . . . 15562 2 80 . 1 1 99 99 ASN N N 15 . 1 1 99 99 ASN H H 1 0.53198 0.02302 . . . . . . . . . . 15562 2 81 . 1 1 100 100 GLY N N 15 . 1 1 100 100 GLY H H 1 0.64757 0.02852 . . . . . . . . . . 15562 2 82 . 1 1 101 101 ILE N N 15 . 1 1 101 101 ILE H H 1 0.63446 0.00885 . . . . . . . . . . 15562 2 83 . 1 1 102 102 ALA N N 15 . 1 1 102 102 ALA H H 1 0.61964 0.02225 . . . . . . . . . . 15562 2 84 . 1 1 103 103 LYS N N 15 . 1 1 103 103 LYS H H 1 0.58048 0.02131 . . . . . . . . . . 15562 2 85 . 1 1 104 104 GLN N N 15 . 1 1 104 104 GLN H H 1 0.48905 0.01963 . . . . . . . . . . 15562 2 86 . 1 1 105 105 GLN N N 15 . 1 1 105 105 GLN H H 1 0.36435 0.0165 . . . . . . . . . . 15562 2 87 . 1 1 109 109 ASN N N 15 . 1 1 109 109 ASN H H 1 0.10878 0.00918 . . . . . . . . . . 15562 2 88 . 1 1 114 114 ILE N N 15 . 1 1 114 114 ILE H H 1 0.11665 0.01026 . . . . . . . . . . 15562 2 89 . 1 1 115 115 PHE N N 15 . 1 1 115 115 PHE H H 1 0.03635 0.01022 . . . . . . . . . . 15562 2 90 . 1 1 116 116 GLU N N 15 . 1 1 116 116 GLU H H 1 0.04024 0.00963 . . . . . . . . . . 15562 2 stop_ save_