############################## # Heteronuclear NOE values # ############################## save_heteronucl_NOEs_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronucl_NOEs_1 _Heteronucl_NOE_list.Entry_ID 50333 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name 'holo PiuA hNOE' _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 2 '1H-15N heteronoe' . . . 50333 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 $software_1 . . 50333 1 2 $software_2 . . 50333 1 3 $software_3 . . 50333 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 5 5 ALA N N 15 . 1 1 5 5 ALA H H 1 -2.631745 -0.041399 . . . 38 ALA N . 38 ALA H 50333 1 2 . 1 1 7 7 THR N N 15 . 1 1 7 7 THR H H 1 -0.208984 -0.004929 . . . 40 THR N . 40 THR H 50333 1 3 . 1 1 8 8 GLU N N 15 . 1 1 8 8 GLU H H 1 0.088955 0.003927 . . . 41 GLU N . 41 GLU H 50333 1 4 . 1 1 9 9 ILE N N 15 . 1 1 9 9 ILE H H 1 0.439271 0.00735 . . . 42 ILE N . 42 ILE H 50333 1 5 . 1 1 10 10 THR N N 15 . 1 1 10 10 THR H H 1 0.649953 0.007619 . . . 43 THR N . 43 THR H 50333 1 6 . 1 1 11 11 ILE N N 15 . 1 1 11 11 ILE H H 1 0.808341 0.011722 . . . 44 ILE N . 44 ILE H 50333 1 7 . 1 1 12 12 LYS N N 15 . 1 1 12 12 LYS H H 1 0.722697 0.011654 . . . 45 LYS N . 45 LYS H 50333 1 8 . 1 1 13 13 SER N N 15 . 1 1 13 13 SER H H 1 0.769375 0.008186 . . . 46 SER N . 46 SER H 50333 1 9 . 1 1 15 15 LEU N N 15 . 1 1 15 15 LEU H H 1 0.862441 0.012375 . . . 48 LEU N . 48 LEU H 50333 1 10 . 1 1 17 17 GLU N N 15 . 1 1 17 17 GLU H H 1 0.765251 0.00877 . . . 50 GLU N . 50 GLU H 50333 1 11 . 1 1 18 18 VAL N N 15 . 1 1 18 18 VAL H H 1 0.823994 0.012304 . . . 51 VAL N . 51 VAL H 50333 1 12 . 1 1 19 19 LYS N N 15 . 1 1 19 19 LYS H H 1 0.794287 0.009971 . . . 52 LYS N . 52 LYS H 50333 1 13 . 1 1 20 20 LEU N N 15 . 1 1 20 20 LEU H H 1 0.780988 0.010698 . . . 53 LEU N . 53 LEU H 50333 1 14 . 1 1 21 21 SER N N 15 . 1 1 21 21 SER H H 1 0.776697 0.016459 . . . 54 SER N . 54 SER H 50333 1 15 . 1 1 22 22 LYS N N 15 . 1 1 22 22 LYS H H 1 0.73072 0.005941 . . . 55 LYS N . 55 LYS H 50333 1 16 . 1 1 23 23 VAL N N 15 . 1 1 23 23 VAL H H 1 0.638168 0.006961 . . . 56 VAL N . 56 VAL H 50333 1 17 . 1 1 25 25 GLU N N 15 . 1 1 25 25 GLU H H 1 0.772885 0.015698 . . . 58 GLU N . 58 GLU H 50333 1 18 . 1 1 26 26 LYS N N 15 . 1 1 26 26 LYS H H 1 0.853996 0.011869 . . . 59 LYS N . 59 LYS H 50333 1 19 . 1 1 27 27 ILE N N 15 . 1 1 27 27 ILE H H 1 0.818445 0.011396 . . . 60 ILE N . 60 ILE H 50333 1 20 . 1 1 28 28 VAL N N 15 . 1 1 28 28 VAL H H 1 0.826769 0.010559 . . . 61 VAL N . 61 VAL H 50333 1 21 . 1 1 29 29 THR N N 15 . 1 1 29 29 THR H H 1 0.817145 0.008284 . . . 62 THR N . 62 THR H 50333 1 22 . 1 1 30 30 PHE N N 15 . 1 1 30 30 PHE H H 1 0.831731 0.020934 . . . 63 PHE N . 63 PHE H 50333 1 23 . 1 1 31 31 ASP N N 15 . 1 1 31 31 ASP H H 1 0.887311 0.016402 . . . 64 ASP N . 64 ASP H 50333 1 24 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.833113 0.019431 . . . 65 LEU N . 65 LEU H 50333 1 25 . 1 1 33 33 GLY N N 15 . 1 1 33 33 GLY H H 1 0.926599 0.011056 . . . 66 GLY N . 66 GLY H 50333 1 26 . 1 1 34 34 ALA N N 15 . 1 1 34 34 ALA H H 1 0.913316 0.00958 . . . 67 ALA N . 67 ALA H 50333 1 27 . 1 1 35 35 ALA N N 15 . 1 1 35 35 ALA H H 1 0.866299 0.007396 . . . 68 ALA N . 68 ALA H 50333 1 28 . 1 1 36 36 ASP N N 15 . 1 1 36 36 ASP H H 1 0.904357 0.00934 . . . 69 ASP N . 69 ASP H 50333 1 29 . 1 1 37 37 THR N N 15 . 1 1 37 37 THR H H 1 0.811535 0.00701 . . . 70 THR N . 70 THR H 50333 1 30 . 1 1 39 39 ARG N N 15 . 1 1 39 39 ARG H H 1 0.786929 0.008693 . . . 72 ARG N . 72 ARG H 50333 1 31 . 1 1 40 40 ALA N N 15 . 1 1 40 40 ALA H H 1 0.850482 0.008216 . . . 73 ALA N . 73 ALA H 50333 1 32 . 1 1 41 41 LEU N N 15 . 1 1 41 41 LEU H H 1 0.841831 0.011548 . . . 74 LEU N . 74 LEU H 50333 1 33 . 1 1 42 42 GLY N N 15 . 1 1 42 42 GLY H H 1 0.793894 0.009791 . . . 75 GLY N . 75 GLY H 50333 1 34 . 1 1 43 43 PHE N N 15 . 1 1 43 43 PHE H H 1 0.858046 0.010409 . . . 76 PHE N . 76 PHE H 50333 1 35 . 1 1 44 44 GLU N N 15 . 1 1 44 44 GLU H H 1 0.823516 0.007508 . . . 77 GLU N . 77 GLU H 50333 1 36 . 1 1 45 45 LYS N N 15 . 1 1 45 45 LYS H H 1 0.828648 0.007542 . . . 78 LYS N . 78 LYS H 50333 1 37 . 1 1 47 47 ILE N N 15 . 1 1 47 47 ILE H H 1 0.847062 0.007325 . . . 80 ILE N . 80 ILE H 50333 1 38 . 1 1 48 48 VAL N N 15 . 1 1 48 48 VAL H H 1 0.859282 0.014519 . . . 81 VAL N . 81 VAL H 50333 1 39 . 1 1 49 49 GLY N N 15 . 1 1 49 49 GLY H H 1 0.857571 0.010074 . . . 82 GLY N . 82 GLY H 50333 1 40 . 1 1 50 50 MET N N 15 . 1 1 50 50 MET H H 1 0.856184 0.0093 . . . 83 MET N . 83 MET H 50333 1 41 . 1 1 52 52 THR N N 15 . 1 1 52 52 THR H H 1 0.865334 0.011458 . . . 85 THR N . 85 THR H 50333 1 42 . 1 1 53 53 LYS N N 15 . 1 1 53 53 LYS H H 1 0.804869 0.013246 . . . 86 LYS N . 86 LYS H 50333 1 43 . 1 1 54 54 THR N N 15 . 1 1 54 54 THR H H 1 0.771528 0.01457 . . . 87 THR N . 87 THR H 50333 1 44 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.716146 0.014937 . . . 88 VAL N . 88 VAL H 50333 1 45 . 1 1 57 57 THR N N 15 . 1 1 57 57 THR H H 1 0.832036 0.009766 . . . 90 THR N . 90 THR H 50333 1 46 . 1 1 58 58 TYR N N 15 . 1 1 58 58 TYR H H 1 0.845589 0.013999 . . . 91 TYR N . 91 TYR H 50333 1 47 . 1 1 59 59 LEU N N 15 . 1 1 59 59 LEU H H 1 0.870195 0.012004 . . . 92 LEU N . 92 LEU H 50333 1 48 . 1 1 61 61 ASP N N 15 . 1 1 61 61 ASP H H 1 0.834675 0.007889 . . . 94 ASP N . 94 ASP H 50333 1 49 . 1 1 62 62 LEU N N 15 . 1 1 62 62 LEU H H 1 0.762774 0.007299 . . . 95 LEU N . 95 LEU H 50333 1 50 . 1 1 63 63 VAL N N 15 . 1 1 63 63 VAL H H 1 0.839092 0.007698 . . . 96 VAL N . 96 VAL H 50333 1 51 . 1 1 64 64 GLY N N 15 . 1 1 64 64 GLY H H 1 0.819247 0.008164 . . . 97 GLY N . 97 GLY H 50333 1 52 . 1 1 65 65 THR N N 15 . 1 1 65 65 THR H H 1 0.764131 0.007974 . . . 98 THR N . 98 THR H 50333 1 53 . 1 1 66 66 VAL N N 15 . 1 1 66 66 VAL H H 1 0.670421 0.007336 . . . 99 VAL N . 99 VAL H 50333 1 54 . 1 1 67 67 LYS N N 15 . 1 1 67 67 LYS H H 1 0.832305 0.012658 . . . 100 LYS N . 100 LYS H 50333 1 55 . 1 1 68 68 ASN N N 15 . 1 1 68 68 ASN H H 1 0.847775 0.010047 . . . 101 ASN N . 101 ASN H 50333 1 56 . 1 1 69 69 VAL N N 15 . 1 1 69 69 VAL H H 1 0.855938 0.018608 . . . 102 VAL N . 102 VAL H 50333 1 57 . 1 1 70 70 GLY N N 15 . 1 1 70 70 GLY H H 1 0.814986 0.008575 . . . 103 GLY N . 103 GLY H 50333 1 58 . 1 1 71 71 SER N N 15 . 1 1 71 71 SER H H 1 0.838157 0.010558 . . . 104 SER N . 104 SER H 50333 1 59 . 1 1 72 72 MET N N 15 . 1 1 72 72 MET H H 1 0.866027 0.023239 . . . 105 MET N . 105 MET H 50333 1 60 . 1 1 73 73 LYS N N 15 . 1 1 73 73 LYS H H 1 0.832379 0.020185 . . . 106 LYS N . 106 LYS H 50333 1 61 . 1 1 74 74 GLU N N 15 . 1 1 74 74 GLU H H 1 0.831717 0.011985 . . . 107 GLU N . 107 GLU H 50333 1 62 . 1 1 76 76 ASP N N 15 . 1 1 76 76 ASP H H 1 0.918597 0.013436 . . . 109 ASP N . 109 ASP H 50333 1 63 . 1 1 77 77 LEU N N 15 . 1 1 77 77 LEU H H 1 0.841504 0.012544 . . . 110 LEU N . 110 LEU H 50333 1 64 . 1 1 78 78 GLU N N 15 . 1 1 78 78 GLU H H 1 0.805609 0.008148 . . . 111 GLU N . 111 GLU H 50333 1 65 . 1 1 79 79 ALA N N 15 . 1 1 79 79 ALA H H 1 0.886125 0.008775 . . . 112 ALA N . 112 ALA H 50333 1 66 . 1 1 80 80 ILE N N 15 . 1 1 80 80 ILE H H 1 0.853342 0.012383 . . . 113 ILE N . 113 ILE H 50333 1 67 . 1 1 81 81 ALA N N 15 . 1 1 81 81 ALA H H 1 0.788384 0.009753 . . . 114 ALA N . 114 ALA H 50333 1 68 . 1 1 82 82 ALA N N 15 . 1 1 82 82 ALA H H 1 0.889224 0.008117 . . . 115 ALA N . 115 ALA H 50333 1 69 . 1 1 83 83 LEU N N 15 . 1 1 83 83 LEU H H 1 0.870434 0.010573 . . . 116 LEU N . 116 LEU H 50333 1 70 . 1 1 84 84 GLU N N 15 . 1 1 84 84 GLU H H 1 0.856882 0.009675 . . . 117 GLU N . 117 GLU H 50333 1 71 . 1 1 86 86 ASP N N 15 . 1 1 86 86 ASP H H 1 0.863969 0.013928 . . . 119 ASP N . 119 ASP H 50333 1 72 . 1 1 87 87 LEU N N 15 . 1 1 87 87 LEU H H 1 0.891653 0.008599 . . . 120 LEU N . 120 LEU H 50333 1 73 . 1 1 88 88 ILE N N 15 . 1 1 88 88 ILE H H 1 0.898923 0.010954 . . . 121 ILE N . 121 ILE H 50333 1 74 . 1 1 89 89 ILE N N 15 . 1 1 89 89 ILE H H 1 0.853701 0.014208 . . . 122 ILE N . 122 ILE H 50333 1 75 . 1 1 90 90 ALA N N 15 . 1 1 90 90 ALA H H 1 0.953736 0.012357 . . . 123 ALA N . 123 ALA H 50333 1 76 . 1 1 91 91 SER N N 15 . 1 1 91 91 SER H H 1 0.780309 0.012997 . . . 124 SER N . 124 SER H 50333 1 77 . 1 1 93 93 ARG N N 15 . 1 1 93 93 ARG H H 1 0.857723 0.014917 . . . 126 ARG N . 126 ARG H 50333 1 78 . 1 1 94 94 THR N N 15 . 1 1 94 94 THR H H 1 0.853525 0.017231 . . . 127 THR N . 127 THR H 50333 1 79 . 1 1 95 95 GLN N N 15 . 1 1 95 95 GLN H H 1 0.83286 0.008717 . . . 128 GLN N . 128 GLN H 50333 1 80 . 1 1 96 96 LYS N N 15 . 1 1 96 96 LYS H H 1 0.802388 0.012215 . . . 129 LYS N . 129 LYS H 50333 1 81 . 1 1 97 97 PHE N N 15 . 1 1 97 97 PHE H H 1 0.770068 0.011511 . . . 130 PHE N . 130 PHE H 50333 1 82 . 1 1 98 98 VAL N N 15 . 1 1 98 98 VAL H H 1 0.85083 0.010013 . . . 131 VAL N . 131 VAL H 50333 1 83 . 1 1 99 99 ASP N N 15 . 1 1 99 99 ASP H H 1 0.860375 0.007704 . . . 132 ASP N . 132 ASP H 50333 1 84 . 1 1 100 100 LYS N N 15 . 1 1 100 100 LYS H H 1 0.817443 0.010763 . . . 133 LYS N . 133 LYS H 50333 1 85 . 1 1 101 101 PHE N N 15 . 1 1 101 101 PHE H H 1 0.820023 0.010384 . . . 134 PHE N . 134 PHE H 50333 1 86 . 1 1 102 102 LYS N N 15 . 1 1 102 102 LYS H H 1 0.854864 0.013049 . . . 135 LYS N . 135 LYS H 50333 1 87 . 1 1 103 103 GLU N N 15 . 1 1 103 103 GLU H H 1 0.834586 0.008059 . . . 136 GLU N . 136 GLU H 50333 1 88 . 1 1 105 105 ALA N N 15 . 1 1 105 105 ALA H H 1 0.82101 0.007961 . . . 138 ALA N . 138 ALA H 50333 1 89 . 1 1 107 107 THR N N 15 . 1 1 107 107 THR H H 1 0.830991 0.012072 . . . 140 THR N . 140 THR H 50333 1 90 . 1 1 108 108 VAL N N 15 . 1 1 108 108 VAL H H 1 0.919084 0.012929 . . . 141 VAL N . 141 VAL H 50333 1 91 . 1 1 109 109 LEU N N 15 . 1 1 109 109 LEU H H 1 0.869274 0.015585 . . . 142 LEU N . 142 LEU H 50333 1 92 . 1 1 110 110 PHE N N 15 . 1 1 110 110 PHE H H 1 0.922439 0.019581 . . . 143 PHE N . 143 PHE H 50333 1 93 . 1 1 111 111 GLN N N 15 . 1 1 111 111 GLN H H 1 0.753175 0.011576 . . . 144 GLN N . 144 GLN H 50333 1 94 . 1 1 112 112 ALA N N 15 . 1 1 112 112 ALA H H 1 0.706147 0.013286 . . . 145 ALA N . 145 ALA H 50333 1 95 . 1 1 113 113 SER N N 15 . 1 1 113 113 SER H H 1 0.772993 0.011378 . . . 146 SER N . 146 SER H 50333 1 96 . 1 1 114 114 LYS N N 15 . 1 1 114 114 LYS H H 1 0.746518 0.026984 . . . 147 LYS N . 147 LYS H 50333 1 97 . 1 1 115 115 ASP N N 15 . 1 1 115 115 ASP H H 1 0.710196 0.011336 . . . 148 ASP N . 148 ASP H 50333 1 98 . 1 1 116 116 ASP N N 15 . 1 1 116 116 ASP H H 1 0.752615 0.008492 . . . 149 ASP N . 149 ASP H 50333 1 99 . 1 1 117 117 TYR N N 15 . 1 1 117 117 TYR H H 1 0.856005 0.012778 . . . 150 TYR N . 150 TYR H 50333 1 100 . 1 1 118 118 TRP N N 15 . 1 1 118 118 TRP H H 1 0.848338 0.010389 . . . 151 TRP N . 151 TRP H 50333 1 101 . 1 1 119 119 THR N N 15 . 1 1 119 119 THR H H 1 0.890909 0.008845 . . . 152 THR N . 152 THR H 50333 1 102 . 1 1 120 120 SER N N 15 . 1 1 120 120 SER H H 1 0.843028 0.01031 . . . 153 SER N . 153 SER H 50333 1 103 . 1 1 121 121 THR N N 15 . 1 1 121 121 THR H H 1 0.93907 0.011861 . . . 154 THR N . 154 THR H 50333 1 104 . 1 1 122 122 LYS N N 15 . 1 1 122 122 LYS H H 1 0.865063 0.011014 . . . 155 LYS N . 155 LYS H 50333 1 105 . 1 1 123 123 ALA N N 15 . 1 1 123 123 ALA H H 1 0.829104 0.009105 . . . 156 ALA N . 156 ALA H 50333 1 106 . 1 1 124 124 ASN N N 15 . 1 1 124 124 ASN H H 1 0.842701 0.008433 . . . 157 ASN N . 157 ASN H 50333 1 107 . 1 1 125 125 ILE N N 15 . 1 1 125 125 ILE H H 1 0.87292 0.009632 . . . 158 ILE N . 158 ILE H 50333 1 108 . 1 1 126 126 GLU N N 15 . 1 1 126 126 GLU H H 1 0.915699 0.010434 . . . 159 GLU N . 159 GLU H 50333 1 109 . 1 1 127 127 SER N N 15 . 1 1 127 127 SER H H 1 0.812949 0.008462 . . . 160 SER N . 160 SER H 50333 1 110 . 1 1 129 129 ALA N N 15 . 1 1 129 129 ALA H H 1 0.89979 0.008769 . . . 162 ALA N . 162 ALA H 50333 1 111 . 1 1 130 130 SER N N 15 . 1 1 130 130 SER H H 1 0.777436 0.009441 . . . 163 SER N . 163 SER H 50333 1 112 . 1 1 131 131 ALA N N 15 . 1 1 131 131 ALA H H 1 0.851443 0.007284 . . . 164 ALA N . 164 ALA H 50333 1 113 . 1 1 132 132 PHE N N 15 . 1 1 132 132 PHE H H 1 0.907363 0.010909 . . . 165 PHE N . 165 PHE H 50333 1 114 . 1 1 133 133 GLY N N 15 . 1 1 133 133 GLY H H 1 0.803886 0.007087 . . . 166 GLY N . 166 GLY H 50333 1 115 . 1 1 134 134 GLU N N 15 . 1 1 134 134 GLU H H 1 0.790027 0.012036 . . . 167 GLU N . 167 GLU H 50333 1 116 . 1 1 135 135 THR N N 15 . 1 1 135 135 THR H H 1 0.858777 0.031212 . . . 168 THR N . 168 THR H 50333 1 117 . 1 1 136 136 SER N N 15 . 1 1 136 136 SER H H 1 0.834386 0.009252 . . . 169 SER N . 169 SER H 50333 1 118 . 1 1 137 137 THR N N 15 . 1 1 137 137 THR H H 1 0.8338 0.007671 . . . 170 THR N . 170 THR H 50333 1 119 . 1 1 138 138 GLN N N 15 . 1 1 138 138 GLN H H 1 0.783348 0.007903 . . . 171 GLN N . 171 GLN H 50333 1 120 . 1 1 139 139 LYS N N 15 . 1 1 139 139 LYS H H 1 0.765613 0.006503 . . . 172 LYS N . 172 LYS H 50333 1 121 . 1 1 140 140 ALA N N 15 . 1 1 140 140 ALA H H 1 0.832615 0.00946 . . . 173 ALA N . 173 ALA H 50333 1 122 . 1 1 141 141 LYS N N 15 . 1 1 141 141 LYS H H 1 0.833321 0.008208 . . . 174 LYS N . 174 LYS H 50333 1 123 . 1 1 142 142 GLU N N 15 . 1 1 142 142 GLU H H 1 0.869518 0.00767 . . . 175 GLU N . 175 GLU H 50333 1 124 . 1 1 143 143 GLU N N 15 . 1 1 143 143 GLU H H 1 0.845472 0.011521 . . . 176 GLU N . 176 GLU H 50333 1 125 . 1 1 144 144 LEU N N 15 . 1 1 144 144 LEU H H 1 0.864379 0.010894 . . . 177 LEU N . 177 LEU H 50333 1 126 . 1 1 145 145 ALA N N 15 . 1 1 145 145 ALA H H 1 0.832871 0.008367 . . . 178 ALA N . 178 ALA H 50333 1 127 . 1 1 146 146 LYS N N 15 . 1 1 146 146 LYS H H 1 0.881334 0.010188 . . . 179 LYS N . 179 LYS H 50333 1 128 . 1 1 147 147 LEU N N 15 . 1 1 147 147 LEU H H 1 0.836368 0.013058 . . . 180 LEU N . 180 LEU H 50333 1 129 . 1 1 148 148 ASP N N 15 . 1 1 148 148 ASP H H 1 0.879903 0.009568 . . . 181 ASP N . 181 ASP H 50333 1 130 . 1 1 149 149 LYS N N 15 . 1 1 149 149 LYS H H 1 0.864896 0.009774 . . . 182 LYS N . 182 LYS H 50333 1 131 . 1 1 150 150 SER N N 15 . 1 1 150 150 SER H H 1 0.782006 0.008209 . . . 183 SER N . 183 SER H 50333 1 132 . 1 1 151 151 ILE N N 15 . 1 1 151 151 ILE H H 1 0.850063 0.012268 . . . 184 ILE N . 184 ILE H 50333 1 133 . 1 1 152 152 GLN N N 15 . 1 1 152 152 GLN H H 1 0.794236 0.008952 . . . 185 GLN N . 185 GLN H 50333 1 134 . 1 1 155 155 ALA N N 15 . 1 1 155 155 ALA H H 1 0.842784 0.007615 . . . 188 ALA N . 188 ALA H 50333 1 135 . 1 1 156 156 THR N N 15 . 1 1 156 156 THR H H 1 0.874584 0.008209 . . . 189 THR N . 189 THR H 50333 1 136 . 1 1 157 157 LYS N N 15 . 1 1 157 157 LYS H H 1 0.827112 0.009247 . . . 190 LYS N . 190 LYS H 50333 1 137 . 1 1 158 158 ASN N N 15 . 1 1 158 158 ASN H H 1 0.827863 0.008447 . . . 191 ASN N . 191 ASN H 50333 1 138 . 1 1 159 159 GLU N N 15 . 1 1 159 159 GLU H H 1 0.753175 0.007263 . . . 192 GLU N . 192 GLU H 50333 1 139 . 1 1 160 160 SER N N 15 . 1 1 160 160 SER H H 1 0.666366 0.009384 . . . 193 SER N . 193 SER H 50333 1 140 . 1 1 161 161 SER N N 15 . 1 1 161 161 SER H H 1 0.721081 0.006917 . . . 194 SER N . 194 SER H 50333 1 141 . 1 1 162 162 ASP N N 15 . 1 1 162 162 ASP H H 1 0.746323 0.028761 . . . 195 ASP N . 195 ASP H 50333 1 142 . 1 1 164 164 LYS N N 15 . 1 1 164 164 LYS H H 1 0.851702 0.015079 . . . 197 LYS N . 197 LYS H 50333 1 143 . 1 1 165 165 ALA N N 15 . 1 1 165 165 ALA H H 1 0.864162 0.010329 . . . 198 ALA N . 198 ALA H 50333 1 144 . 1 1 166 166 LEU N N 15 . 1 1 166 166 LEU H H 1 0.833004 0.012062 . . . 199 LEU N . 199 LEU H 50333 1 145 . 1 1 167 167 ALA N N 15 . 1 1 167 167 ALA H H 1 0.820209 0.015876 . . . 200 ALA N . 200 ALA H 50333 1 146 . 1 1 168 168 ILE N N 15 . 1 1 168 168 ILE H H 1 0.856295 0.012291 . . . 201 ILE N . 201 ILE H 50333 1 147 . 1 1 169 169 LEU N N 15 . 1 1 169 169 LEU H H 1 0.83044 0.017858 . . . 202 LEU N . 202 LEU H 50333 1 148 . 1 1 170 170 LEU N N 15 . 1 1 170 170 LEU H H 1 0.857809 0.018657 . . . 203 LEU N . 203 LEU H 50333 1 149 . 1 1 171 171 ASN N N 15 . 1 1 171 171 ASN H H 1 0.837187 0.009601 . . . 204 ASN N . 204 ASN H 50333 1 150 . 1 1 172 172 GLU N N 15 . 1 1 172 172 GLU H H 1 0.751332 0.016313 . . . 205 GLU N . 205 GLU H 50333 1 151 . 1 1 173 173 GLY N N 15 . 1 1 173 173 GLY H H 1 0.769963 0.010442 . . . 206 GLY N . 206 GLY H 50333 1 152 . 1 1 174 174 LYS N N 15 . 1 1 174 174 LYS H H 1 0.773136 0.010322 . . . 207 LYS N . 207 LYS H 50333 1 153 . 1 1 175 175 MET N N 15 . 1 1 175 175 MET H H 1 0.838519 0.014648 . . . 208 MET N . 208 MET H 50333 1 154 . 1 1 176 176 ALA N N 15 . 1 1 176 176 ALA H H 1 0.860405 0.015864 . . . 209 ALA N . 209 ALA H 50333 1 155 . 1 1 177 177 ALA N N 15 . 1 1 177 177 ALA H H 1 0.847732 0.011905 . . . 210 ALA N . 210 ALA H 50333 1 156 . 1 1 178 178 PHE N N 15 . 1 1 178 178 PHE H H 1 0.881828 0.017282 . . . 211 PHE N . 211 PHE H 50333 1 157 . 1 1 179 179 GLY N N 15 . 1 1 179 179 GLY H H 1 0.866755 0.013529 . . . 212 GLY N . 212 GLY H 50333 1 158 . 1 1 180 180 ALA N N 15 . 1 1 180 180 ALA H H 1 0.8917 0.011195 . . . 213 ALA N . 213 ALA H 50333 1 159 . 1 1 182 182 SER N N 15 . 1 1 182 182 SER H H 1 0.546923 0.0104 . . . 215 SER N . 215 SER H 50333 1 160 . 1 1 184 184 PHE N N 15 . 1 1 184 184 PHE H H 1 0.918759 0.016617 . . . 217 PHE N . 217 PHE H 50333 1 161 . 1 1 186 186 PHE N N 15 . 1 1 186 186 PHE H H 1 0.857939 0.010596 . . . 219 PHE N . 219 PHE H 50333 1 162 . 1 1 187 187 LEU N N 15 . 1 1 187 187 LEU H H 1 0.88078 0.012969 . . . 220 LEU N . 220 LEU H 50333 1 163 . 1 1 188 188 TYR N N 15 . 1 1 188 188 TYR H H 1 0.88739 0.016502 . . . 221 TYR N . 221 TYR H 50333 1 164 . 1 1 189 189 GLN N N 15 . 1 1 189 189 GLN H H 1 0.818919 0.014782 . . . 222 GLN N . 222 GLN H 50333 1 165 . 1 1 190 190 THR N N 15 . 1 1 190 190 THR H H 1 0.880324 0.012429 . . . 223 THR N . 223 THR H 50333 1 166 . 1 1 191 191 LEU N N 15 . 1 1 191 191 LEU H H 1 0.878522 0.014318 . . . 224 LEU N . 224 LEU H 50333 1 167 . 1 1 192 192 LYS N N 15 . 1 1 192 192 LYS H H 1 0.884509 0.012412 . . . 225 LYS N . 225 LYS H 50333 1 168 . 1 1 193 193 PHE N N 15 . 1 1 193 193 PHE H H 1 0.806528 0.011105 . . . 226 PHE N . 226 PHE H 50333 1 169 . 1 1 194 194 LYS N N 15 . 1 1 194 194 LYS H H 1 0.7654 0.012572 . . . 227 LYS N . 227 LYS H 50333 1 170 . 1 1 196 196 THR N N 15 . 1 1 196 196 THR H H 1 0.861959 0.014294 . . . 229 THR N . 229 THR H 50333 1 171 . 1 1 197 197 ASP N N 15 . 1 1 197 197 ASP H H 1 0.873718 0.016029 . . . 230 ASP N . 230 ASP H 50333 1 172 . 1 1 198 198 THR N N 15 . 1 1 198 198 THR H H 1 0.59104 0.006558 . . . 231 THR N . 231 THR H 50333 1 173 . 1 1 199 199 LYS N N 15 . 1 1 199 199 LYS H H 1 0.737222 0.010596 . . . 232 LYS N . 232 LYS H 50333 1 174 . 1 1 200 200 PHE N N 15 . 1 1 200 200 PHE H H 1 0.71448 0.008474 . . . 233 PHE N . 233 PHE H 50333 1 175 . 1 1 201 201 GLU N N 15 . 1 1 201 201 GLU H H 1 0.678619 0.010004 . . . 234 GLU N . 234 GLU H 50333 1 176 . 1 1 202 202 ASP N N 15 . 1 1 202 202 ASP H H 1 0.679647 0.035568 . . . 235 ASP N . 235 ASP H 50333 1 177 . 1 1 205 205 HIS N N 15 . 1 1 205 205 HIS H H 1 0.913917 0.02141 . . . 238 HIS N . 238 HIS H 50333 1 178 . 1 1 206 206 GLY N N 15 . 1 1 206 206 GLY H H 1 0.803723 0.01399 . . . 239 GLY N . 239 GLY H 50333 1 179 . 1 1 207 207 GLN N N 15 . 1 1 207 207 GLN H H 1 0.864558 0.013538 . . . 240 GLN N . 240 GLN H 50333 1 180 . 1 1 208 208 GLU N N 15 . 1 1 208 208 GLU H H 1 0.858233 0.009375 . . . 241 GLU N . 241 GLU H 50333 1 181 . 1 1 209 209 VAL N N 15 . 1 1 209 209 VAL H H 1 0.839119 0.011612 . . . 242 VAL N . 242 VAL H 50333 1 182 . 1 1 210 210 SER N N 15 . 1 1 210 210 SER H H 1 0.806522 0.012281 . . . 243 SER N . 243 SER H 50333 1 183 . 1 1 211 211 PHE N N 15 . 1 1 211 211 PHE H H 1 0.832156 0.008113 . . . 244 PHE N . 244 PHE H 50333 1 184 . 1 1 212 212 GLU N N 15 . 1 1 212 212 GLU H H 1 0.818986 0.007732 . . . 245 GLU N . 245 GLU H 50333 1 185 . 1 1 214 214 VAL N N 15 . 1 1 214 214 VAL H H 1 0.832751 0.008297 . . . 247 VAL N . 247 VAL H 50333 1 186 . 1 1 215 215 LYS N N 15 . 1 1 215 215 LYS H H 1 0.844031 0.008013 . . . 248 LYS N . 248 LYS H 50333 1 187 . 1 1 217 217 ILE N N 15 . 1 1 217 217 ILE H H 1 0.828096 0.012347 . . . 250 ILE N . 250 ILE H 50333 1 188 . 1 1 218 218 ASN N N 15 . 1 1 218 218 ASN H H 1 0.755518 0.010009 . . . 251 ASN N . 251 ASN H 50333 1 189 . 1 1 220 220 ASP N N 15 . 1 1 220 220 ASP H H 1 0.837326 0.012245 . . . 253 ASP N . 253 ASP H 50333 1 190 . 1 1 221 221 ILE N N 15 . 1 1 221 221 ILE H H 1 0.842883 0.010007 . . . 254 ILE N . 254 ILE H 50333 1 191 . 1 1 222 222 LEU N N 15 . 1 1 222 222 LEU H H 1 0.844544 0.008269 . . . 255 LEU N . 255 LEU H 50333 1 192 . 1 1 223 223 PHE N N 15 . 1 1 223 223 PHE H H 1 0.878278 0.013538 . . . 256 PHE N . 256 PHE H 50333 1 193 . 1 1 224 224 VAL N N 15 . 1 1 224 224 VAL H H 1 0.873925 0.011806 . . . 257 VAL N . 257 VAL H 50333 1 194 . 1 1 225 225 ILE N N 15 . 1 1 225 225 ILE H H 1 0.834502 0.015312 . . . 258 ILE N . 258 ILE H 50333 1 195 . 1 1 226 226 ASN N N 15 . 1 1 226 226 ASN H H 1 0.881658 0.014641 . . . 259 ASN N . 259 ASN H 50333 1 196 . 1 1 227 227 ARG N N 15 . 1 1 227 227 ARG H H 1 0.837136 0.019924 . . . 260 ARG N . 260 ARG H 50333 1 197 . 1 1 228 228 THR N N 15 . 1 1 228 228 THR H H 1 0.910608 0.012619 . . . 261 THR N . 261 THR H 50333 1 198 . 1 1 229 229 LEU N N 15 . 1 1 229 229 LEU H H 1 0.877625 0.011808 . . . 262 LEU N . 262 LEU H 50333 1 199 . 1 1 230 230 ALA N N 15 . 1 1 230 230 ALA H H 1 0.834128 0.010173 . . . 263 ALA N . 263 ALA H 50333 1 200 . 1 1 231 231 ILE N N 15 . 1 1 231 231 ILE H H 1 0.787153 0.013052 . . . 264 ILE N . 264 ILE H 50333 1 201 . 1 1 232 232 GLY N N 15 . 1 1 232 232 GLY H H 1 0.856054 0.007763 . . . 265 GLY N . 265 GLY H 50333 1 202 . 1 1 233 233 GLY N N 15 . 1 1 233 233 GLY H H 1 0.465457 0.006575 . . . 266 GLY N . 266 GLY H 50333 1 203 . 1 1 234 234 ASP N N 15 . 1 1 234 234 ASP H H 1 0.847192 0.013102 . . . 267 ASP N . 267 ASP H 50333 1 204 . 1 1 235 235 ASN N N 15 . 1 1 235 235 ASN H H 1 0.790332 0.018796 . . . 268 ASN N . 268 ASN H 50333 1 205 . 1 1 236 236 SER N N 15 . 1 1 236 236 SER H H 1 0.862796 0.011711 . . . 269 SER N . 269 SER H 50333 1 206 . 1 1 237 237 SER N N 15 . 1 1 237 237 SER H H 1 0.792386 0.011006 . . . 270 SER N . 270 SER H 50333 1 207 . 1 1 239 239 ASP N N 15 . 1 1 239 239 ASP H H 1 0.811669 0.006391 . . . 272 ASP N . 272 ASP H 50333 1 208 . 1 1 240 240 GLY N N 15 . 1 1 240 240 GLY H H 1 0.761332 0.013754 . . . 273 GLY N . 273 GLY H 50333 1 209 . 1 1 241 241 VAL N N 15 . 1 1 241 241 VAL H H 1 0.813396 0.006646 . . . 274 VAL N . 274 VAL H 50333 1 210 . 1 1 242 242 LEU N N 15 . 1 1 242 242 LEU H H 1 0.768294 0.011475 . . . 275 LEU N . 275 LEU H 50333 1 211 . 1 1 243 243 GLU N N 15 . 1 1 243 243 GLU H H 1 0.769236 0.010224 . . . 276 GLU N . 276 GLU H 50333 1 212 . 1 1 244 244 ASN N N 15 . 1 1 244 244 ASN H H 1 0.726257 0.006872 . . . 277 ASN N . 277 ASN H 50333 1 213 . 1 1 245 245 ALA N N 15 . 1 1 245 245 ALA H H 1 0.893386 0.013414 . . . 278 ALA N . 278 ALA H 50333 1 214 . 1 1 246 246 LEU N N 15 . 1 1 246 246 LEU H H 1 0.799013 0.010027 . . . 279 LEU N . 279 LEU H 50333 1 215 . 1 1 247 247 ILE N N 15 . 1 1 247 247 ILE H H 1 0.716902 0.009613 . . . 280 ILE N . 280 ILE H 50333 1 216 . 1 1 248 248 ALA N N 15 . 1 1 248 248 ALA H H 1 0.845364 0.009716 . . . 281 ALA N . 281 ALA H 50333 1 217 . 1 1 249 249 GLU N N 15 . 1 1 249 249 GLU H H 1 0.805072 0.008435 . . . 282 GLU N . 282 GLU H 50333 1 218 . 1 1 250 250 THR N N 15 . 1 1 250 250 THR H H 1 0.849786 0.008471 . . . 283 THR N . 283 THR H 50333 1 219 . 1 1 252 252 ALA N N 15 . 1 1 252 252 ALA H H 1 0.847064 0.009341 . . . 285 ALA N . 285 ALA H 50333 1 220 . 1 1 253 253 ALA N N 15 . 1 1 253 253 ALA H H 1 0.845864 0.007221 . . . 286 ALA N . 286 ALA H 50333 1 221 . 1 1 255 255 ASN N N 15 . 1 1 255 255 ASN H H 1 0.833906 0.008823 . . . 288 ASN N . 288 ASN H 50333 1 222 . 1 1 256 256 GLY N N 15 . 1 1 256 256 GLY H H 1 0.876902 0.007796 . . . 289 GLY N . 289 GLY H 50333 1 223 . 1 1 257 257 LYS N N 15 . 1 1 257 257 LYS H H 1 0.866523 0.010564 . . . 290 LYS N . 290 LYS H 50333 1 224 . 1 1 258 258 ILE N N 15 . 1 1 258 258 ILE H H 1 0.877567 0.007934 . . . 291 ILE N . 291 ILE H 50333 1 225 . 1 1 259 259 ILE N N 15 . 1 1 259 259 ILE H H 1 0.829965 0.010321 . . . 292 ILE N . 292 ILE H 50333 1 226 . 1 1 260 260 GLN N N 15 . 1 1 260 260 GLN H H 1 0.796645 0.011059 . . . 293 GLN N . 293 GLN H 50333 1 227 . 1 1 261 261 LEU N N 15 . 1 1 261 261 LEU H H 1 0.787045 0.01526 . . . 294 LEU N . 294 LEU H 50333 1 228 . 1 1 262 262 THR N N 15 . 1 1 262 262 THR H H 1 0.886819 0.010351 . . . 295 THR N . 295 THR H 50333 1 229 . 1 1 264 264 ASP N N 15 . 1 1 264 264 ASP H H 1 0.868438 0.011343 . . . 297 ASP N . 297 ASP H 50333 1 230 . 1 1 265 265 LEU N N 15 . 1 1 265 265 LEU H H 1 0.897492 0.012412 . . . 298 LEU N . 298 LEU H 50333 1 231 . 1 1 266 266 TRP N N 15 . 1 1 266 266 TRP H H 1 0.886722 0.016252 . . . 299 TRP N . 299 TRP H 50333 1 232 . 1 1 267 267 TYR N N 15 . 1 1 267 267 TYR H H 1 0.876173 0.011974 . . . 300 TYR N . 300 TYR H 50333 1 233 . 1 1 268 268 LEU N N 15 . 1 1 268 268 LEU H H 1 0.829416 0.017993 . . . 301 LEU N . 301 LEU H 50333 1 234 . 1 1 269 269 SER N N 15 . 1 1 269 269 SER H H 1 0.908719 0.00882 . . . 302 SER N . 302 SER H 50333 1 235 . 1 1 270 270 GLY N N 15 . 1 1 270 270 GLY H H 1 0.878203 0.012522 . . . 303 GLY N . 303 GLY H 50333 1 236 . 1 1 271 271 GLY N N 15 . 1 1 271 271 GLY H H 1 0.885393 0.012779 . . . 304 GLY N . 304 GLY H 50333 1 237 . 1 1 272 272 GLY N N 15 . 1 1 272 272 GLY H H 1 0.902227 0.009791 . . . 305 GLY N . 305 GLY H 50333 1 238 . 1 1 273 273 LEU N N 15 . 1 1 273 273 LEU H H 1 0.852299 0.013848 . . . 306 LEU N . 306 LEU H 50333 1 239 . 1 1 274 274 GLU N N 15 . 1 1 274 274 GLU H H 1 0.850514 0.0114 . . . 307 GLU N . 307 GLU H 50333 1 240 . 1 1 275 275 SER N N 15 . 1 1 275 275 SER H H 1 0.874849 0.013466 . . . 308 SER N . 308 SER H 50333 1 241 . 1 1 276 276 THR N N 15 . 1 1 276 276 THR H H 1 0.817812 0.008174 . . . 309 THR N . 309 THR H 50333 1 242 . 1 1 277 277 LYS N N 15 . 1 1 277 277 LYS H H 1 0.822225 0.011893 . . . 310 LYS N . 310 LYS H 50333 1 243 . 1 1 278 278 LEU N N 15 . 1 1 278 278 LEU H H 1 0.872255 0.012275 . . . 311 LEU N . 311 LEU H 50333 1 244 . 1 1 279 279 MET N N 15 . 1 1 279 279 MET H H 1 0.855665 0.01536 . . . 312 MET N . 312 MET H 50333 1 245 . 1 1 280 280 ILE N N 15 . 1 1 280 280 ILE H H 1 0.880224 0.012301 . . . 313 ILE N . 313 ILE H 50333 1 246 . 1 1 283 283 ILE N N 15 . 1 1 283 283 ILE H H 1 0.807649 0.013803 . . . 316 ILE N . 316 ILE H 50333 1 247 . 1 1 284 284 GLN N N 15 . 1 1 284 284 GLN H H 1 0.858776 0.012615 . . . 317 GLN N . 317 GLN H 50333 1 248 . 1 1 285 285 LYS N N 15 . 1 1 285 285 LYS H H 1 0.814256 0.008293 . . . 318 LYS N . 318 LYS H 50333 1 249 . 1 1 286 286 ALA N N 15 . 1 1 286 286 ALA H H 1 0.736429 0.008219 . . . 319 ALA N . 319 ALA H 50333 1 250 . 1 1 287 287 LEU N N 15 . 1 1 287 287 LEU H H 1 0.622999 0.008762 . . . 320 LEU N . 320 LEU H 50333 1 251 . 1 1 288 288 LYS N N 15 . 1 1 288 288 LYS H H 1 -0.046582 -0.003375 . . . 321 LYS N . 321 LYS H 50333 1 stop_ save_