data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6318_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 6.85 _LACS_plot.Y_axis_chem_shift_offset -0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 ILE 2.60 -1.40 0 105 ASP -6.60 0.00 0 11 MET -2.00 1.20 1 12 ALA 0.50 0.60 1 13 SER 0.10 0.50 1 14 GLU -0.60 0.00 1 15 GLU -1.70 -0.10 1 17 GLN -3.40 -1.30 1 18 VAL 0.70 0.40 1 19 ILE 0.40 -0.60 1 20 ALA -1.50 -1.30 1 22 HIS 1.40 2.00 1 23 THR -6.30 -3.20 1 24 VAL 4.60 3.90 1 25 GLU 5.90 4.90 1 26 THR 5.30 4.90 1 27 TRP 2.50 3.20 1 28 ASN 3.80 3.20 1 29 GLU 2.70 3.10 1 30 GLN 4.00 2.70 1 31 LEU 4.60 3.10 1 32 GLN 5.20 3.70 1 33 LYS 3.90 3.10 1 34 ALA 2.50 2.00 1 35 ASN 4.10 3.30 1 36 GLU 2.00 2.10 1 37 SER 0.00 0.40 1 38 LYS 5.30 1.80 1 39 THR -0.30 0.80 1 40 LEU 1.40 1.30 1 41 VAL -3.70 -2.00 1 42 VAL -1.80 -1.80 1 43 VAL -3.60 -1.90 1 44 ASP -0.70 -2.90 1 45 PHE 1.30 1.00 1 46 THR -4.30 -3.10 1 47 ALA -3.00 -0.50 1 48 SER 3.90 3.40 1 49 TRP -3.40 -3.40 1 54 ARG 3.70 3.20 1 55 PHE 3.00 2.40 1 56 ILE -3.70 -0.90 1 57 ALA 8.70 6.90 1 59 PHE 3.10 3.20 1 60 PHE 4.10 4.50 1 61 ALA 3.30 2.10 1 62 ASP 3.00 3.20 1 63 LEU 3.50 2.60 1 64 ALA 2.00 1.50 1 65 LYS 2.10 2.10 1 66 LYS 0.70 1.50 1 67 LEU -1.70 -0.90 1 69 ASN 1.90 0.50 1 70 VAL -1.70 -0.40 1 71 LEU -2.80 -1.10 1 72 PHE -1.80 -1.10 1 73 LEU -6.50 -2.70 1 74 LYS -4.70 -1.10 1 75 VAL -3.00 -0.50 1 76 ASP -2.90 -1.80 1 77 THR 4.90 3.40 1 78 ASP 2.10 2.20 1 79 GLU 0.40 2.00 1 80 LEU -0.90 -2.90 1 81 LYS 4.00 3.90 1 82 SER 4.80 2.90 1 83 VAL 4.50 3.60 1 84 ALA 3.70 2.80 1 85 SER 3.90 3.10 1 86 ASP 3.90 3.30 1 87 TRP 1.70 0.10 1 88 ALA 2.50 0.20 1 90 GLN -1.90 0.40 1 91 ALA -3.30 -0.80 1 92 MET -2.80 -0.80 1 94 THR -1.60 1.60 1 95 PHE -3.60 -2.20 1 96 MET -5.40 -1.40 1 97 PHE -2.10 -1.10 1 98 LEU -6.40 -1.30 1 99 LYS -2.20 2.00 1 100 GLU 2.00 1.10 1 102 LYS -3.00 -1.50 1 103 ILE 1.70 1.20 1 104 LEU -1.00 0.10 1 106 LYS -4.10 0.10 1 107 VAL -3.00 0.10 1 108 VAL 0.20 0.30 1 110 ALA -0.40 -1.40 1 111 LYS -1.90 -1.50 1 112 LYS 5.40 5.10 1 113 ASP 4.50 3.20 1 114 GLU 3.00 3.00 1 115 LEU 4.70 4.30 1 116 GLN 4.50 4.60 1 117 SER 4.20 3.40 1 118 THR 7.30 5.60 1 119 ILE 6.30 5.80 1 120 ALA 3.60 2.90 1 121 LYS 2.70 2.50 1 122 HIS -1.10 1.60 1 123 LEU -0.20 0.60 1 124 ALA 0.60 1.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6318_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 4.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.83 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 -1.84 _LACS_plot.Y_axis_chem_shift_offset -0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 ILE 2.60 -4.00 0 105 ASP -6.60 6.60 0 11 MET -2.00 3.20 1 12 ALA 0.50 0.10 1 13 SER 0.10 0.40 1 14 GLU -0.60 0.60 1 15 GLU -1.70 1.60 1 17 GLN -3.40 2.10 1 18 VAL 0.70 -0.30 1 19 ILE 0.40 -1.00 1 20 ALA -1.50 0.20 1 22 HIS 1.40 0.60 1 23 THR -6.30 3.10 1 24 VAL 4.60 -0.70 1 25 GLU 5.90 -1.00 1 26 THR 5.30 -0.40 1 27 TRP 2.50 0.70 1 28 ASN 3.80 -0.60 1 29 GLU 2.70 0.40 1 30 GLN 4.00 -1.30 1 31 LEU 4.60 -1.50 1 32 GLN 5.20 -1.50 1 33 LYS 3.90 -0.80 1 34 ALA 2.50 -0.50 1 35 ASN 4.10 -0.80 1 36 GLU 2.00 0.10 1 37 SER 0.00 0.40 1 38 LYS 5.30 -3.50 1 39 THR -0.30 1.10 1 40 LEU 1.40 -0.10 1 41 VAL -3.70 1.70 1 42 VAL -1.80 0.00 1 43 VAL -3.60 1.70 1 44 ASP -0.70 -2.20 1 45 PHE 1.30 -0.30 1 46 THR -4.30 1.20 1 47 ALA -3.00 2.50 1 48 SER 3.90 -0.50 1 49 TRP -3.40 0.00 1 54 ARG 3.70 -0.50 1 55 PHE 3.00 -0.60 1 56 ILE -3.70 2.80 1 57 ALA 8.70 -1.80 1 59 PHE 3.10 0.10 1 60 PHE 4.10 0.40 1 61 ALA 3.30 -1.20 1 62 ASP 3.00 0.20 1 63 LEU 3.50 -0.90 1 64 ALA 2.00 -0.50 1 65 LYS 2.10 0.00 1 66 LYS 0.70 0.80 1 67 LEU -1.70 0.80 1 69 ASN 1.90 -1.40 1 70 VAL -1.70 1.30 1 71 LEU -2.80 1.70 1 72 PHE -1.80 0.70 1 73 LEU -6.50 3.80 1 74 LYS -4.70 3.60 1 75 VAL -3.00 2.50 1 76 ASP -2.90 1.10 1 77 THR 4.90 -1.50 1 78 ASP 2.10 0.10 1 79 GLU 0.40 1.60 1 80 LEU -0.90 -2.00 1 81 LYS 4.00 -0.10 1 82 SER 4.80 -1.90 1 83 VAL 4.50 -0.90 1 84 ALA 3.70 -0.90 1 85 SER 3.90 -0.80 1 86 ASP 3.90 -0.60 1 87 TRP 1.70 -1.60 1 88 ALA 2.50 -2.30 1 90 GLN -1.90 2.30 1 91 ALA -3.30 2.50 1 92 MET -2.80 2.00 1 94 THR -1.60 3.20 1 95 PHE -3.60 1.40 1 96 MET -5.40 4.00 1 97 PHE -2.10 1.00 1 98 LEU -6.40 5.10 1 99 LYS -2.20 4.20 1 100 GLU 2.00 -0.90 1 102 LYS -3.00 1.50 1 103 ILE 1.70 -0.50 1 104 LEU -1.00 1.10 1 106 LYS -4.10 4.20 1 107 VAL -3.00 3.10 1 108 VAL 0.20 0.10 1 110 ALA -0.40 -1.00 1 111 LYS -1.90 0.40 1 112 LYS 5.40 -0.30 1 113 ASP 4.50 -1.30 1 114 GLU 3.00 0.00 1 115 LEU 4.70 -0.40 1 116 GLN 4.50 0.10 1 117 SER 4.20 -0.80 1 118 THR 7.30 -1.70 1 119 ILE 6.30 -0.50 1 120 ALA 3.60 -0.70 1 121 LYS 2.70 -0.20 1 122 HIS -1.10 2.70 1 123 LEU -0.20 0.80 1 124 ALA 0.60 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6318_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 0.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 ALA 2.00 -1.48 0 11 MET -2.00 -0.19 1 12 ALA 0.50 -0.02 1 13 SER 0.10 -0.06 1 14 GLU -0.60 -0.02 1 15 GLU -1.70 0.06 1 17 GLN -3.40 0.08 1 18 VAL 0.70 -0.12 1 19 ILE 0.40 0.01 1 20 ALA -1.50 0.31 1 22 HIS 1.40 -0.05 1 23 THR -6.30 0.47 1 24 VAL 4.60 -0.35 1 25 GLU 5.90 -0.17 1 26 THR 5.30 -0.20 1 27 TRP 2.50 -0.17 1 28 ASN 3.80 -0.61 1 29 GLU 2.70 -0.35 1 30 GLN 4.00 -0.50 1 31 LEU 4.60 -0.73 1 32 GLN 5.20 -0.36 1 33 LYS 3.90 -0.31 1 34 ALA 2.50 -0.19 1 35 ASN 4.10 -0.36 1 36 GLU 2.00 -0.25 1 37 SER 0.00 -0.05 1 38 LYS 5.30 -0.54 1 39 THR -0.30 -0.08 1 40 LEU 1.40 0.06 1 41 VAL -3.70 0.76 1 42 VAL -1.80 0.32 1 43 VAL -3.60 0.55 1 44 ASP -0.70 -0.35 1 45 PHE 1.30 0.24 1 46 THR -4.30 0.07 1 47 ALA -3.00 0.24 1 48 SER 3.90 -0.48 1 49 TRP -3.40 -0.08 1 54 ARG 3.70 -0.23 1 55 PHE 3.00 -0.17 1 56 ILE -3.70 0.21 1 57 ALA 8.70 -0.36 1 59 PHE 3.10 -0.27 1 60 PHE 4.10 -0.70 1 61 ALA 3.30 -0.58 1 62 ASP 3.00 -0.42 1 63 LEU 3.50 -0.84 1 65 LYS 2.10 -0.36 1 66 LYS 0.70 -0.25 1 67 LEU -1.70 0.31 1 69 ASN 1.90 -0.06 1 70 VAL -1.70 -0.11 1 71 LEU -2.80 0.31 1 72 PHE -1.80 0.66 1 73 LEU -6.50 1.23 1 74 LYS -4.70 0.61 1 75 VAL -3.00 -0.41 1 76 ASP -2.90 0.38 1 77 THR 4.90 -0.77 1 78 ASP 2.10 0.19 1 79 GLU 0.40 -0.08 1 80 LEU -0.90 0.47 1 81 LYS 4.00 -0.22 1 82 SER 4.80 -0.27 1 83 VAL 4.50 -0.31 1 84 ALA 3.70 -0.64 1 85 SER 3.90 -0.19 1 86 ASP 3.90 -0.34 1 87 TRP 1.70 -0.32 1 88 ALA 2.50 -0.34 1 89 ILE 2.60 -0.30 1 90 GLN -1.90 0.12 1 91 ALA -3.30 0.17 1 92 MET -2.80 0.17 1 94 THR -1.60 0.60 1 95 PHE -3.60 1.34 1 96 MET -5.40 0.83 1 97 PHE -2.10 0.74 1 98 LEU -6.40 1.17 1 99 LYS -2.20 0.06 1 100 GLU 2.00 -0.54 1 102 LYS -3.00 0.28 1 103 ILE 1.70 0.11 1 104 LEU -1.00 -0.02 1 105 ASP -6.60 0.16 1 106 LYS -4.10 1.31 1 107 VAL -3.00 0.36 1 108 VAL 0.20 0.44 1 110 ALA -0.40 0.14 1 111 LYS -1.90 0.21 1 112 LYS 5.40 -0.86 1 113 ASP 4.50 -0.27 1 114 GLU 3.00 -0.21 1 115 LEU 4.70 -0.21 1 116 GLN 4.50 -0.33 1 117 SER 4.20 -0.23 1 118 THR 7.30 -0.67 1 119 ILE 6.30 -0.48 1 120 ALA 3.60 -0.37 1 121 LYS 2.70 -0.38 1 122 HIS -1.10 0.15 1 123 LEU -0.20 0.04 1 124 ALA 0.60 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6318_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 -2.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.02 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 3.21 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 124 ALA 0.60 -8.50 0 11 MET -2.00 0.10 1 12 ALA 0.50 0.20 1 13 SER 0.10 0.10 1 14 GLU -0.60 -0.40 1 15 GLU -1.70 0.90 1 17 GLN -3.40 -0.90 1 18 VAL 0.70 0.00 1 19 ILE 0.40 -1.30 1 20 ALA -1.50 -1.10 1 22 HIS 1.40 -1.10 1 23 THR -6.30 0.00 1 24 VAL 4.60 0.90 1 25 GLU 5.90 3.00 1 26 THR 5.30 1.70 1 27 TRP 2.50 -0.30 1 28 ASN 3.80 3.60 1 29 GLU 2.70 2.80 1 30 GLN 4.00 2.80 1 31 LEU 4.60 2.40 1 32 GLN 5.20 3.10 1 33 LYS 3.90 3.20 1 34 ALA 2.50 3.50 1 35 ASN 4.10 2.70 1 36 GLU 2.00 1.40 1 37 SER 0.00 -0.10 1 38 LYS 5.30 -1.70 1 39 THR -0.30 -0.30 1 40 LEU 1.40 -3.90 1 41 VAL -3.70 -1.30 1 42 VAL -1.80 -1.70 1 43 VAL -3.60 -1.10 1 44 ASP -0.70 -2.00 1 45 PHE 1.30 -2.60 1 46 THR -4.30 -4.30 1 47 ALA -3.00 1.40 1 48 SER 3.90 0.20 1 49 TRP -3.40 -0.40 1 54 ARG 3.70 3.00 1 55 PHE 3.00 1.20 1 56 ILE -3.70 -1.10 1 57 ALA 8.70 1.10 1 59 PHE 3.10 1.10 1 60 PHE 4.10 -0.20 1 61 ALA 3.30 2.40 1 62 ASP 3.00 2.50 1 63 LEU 3.50 -0.50 1 64 ALA 2.00 2.00 1 65 LYS 2.10 2.10 1 66 LYS 0.70 -0.20 1 67 LEU -1.70 -1.80 1 69 ASN 1.90 -2.10 1 70 VAL -1.70 -3.20 1 71 LEU -2.80 -4.00 1 72 PHE -1.80 -1.10 1 73 LEU -6.50 -1.50 1 74 LYS -4.70 -1.90 1 75 VAL -3.00 -3.80 1 76 ASP -2.90 1.70 1 77 THR 4.90 0.60 1 78 ASP 2.10 1.10 1 79 GLU 0.40 0.50 1 80 LEU -0.90 -1.30 1 81 LYS 4.00 3.30 1 82 SER 4.80 1.40 1 83 VAL 4.50 1.30 1 84 ALA 3.70 1.30 1 85 SER 3.90 3.90 1 86 ASP 3.90 1.70 1 87 TRP 1.70 -2.60 1 88 ALA 2.50 -1.40 1 89 ILE 2.60 0.60 1 90 GLN -1.90 -1.50 1 91 ALA -3.30 -2.30 1 92 MET -2.80 -0.70 1 94 THR -1.60 -2.80 1 95 PHE -3.60 -0.50 1 96 MET -5.40 -2.50 1 97 PHE -2.10 -1.40 1 98 LEU -6.40 -2.00 1 99 LYS -2.20 0.10 1 100 GLU 2.00 -0.40 1 102 LYS -3.00 -1.00 1 103 ILE 1.70 0.60 1 104 LEU -1.00 -0.50 1 105 ASP -6.60 -1.70 1 106 LYS -4.10 -1.50 1 107 VAL -3.00 -2.00 1 108 VAL 0.20 -0.60 1 110 ALA -0.40 -1.50 1 111 LYS -1.90 -1.00 1 112 LYS 5.40 1.20 1 113 ASP 4.50 2.80 1 114 GLU 3.00 3.40 1 115 LEU 4.70 0.00 1 116 GLN 4.50 2.80 1 117 SER 4.20 2.60 1 118 THR 7.30 0.80 1 119 ILE 6.30 0.50 1 120 ALA 3.60 2.60 1 121 LYS 2.70 1.10 1 122 HIS -1.10 0.60 1 123 LEU -0.20 -1.30 1 stop_ save_