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 bmr30020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 -2.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 3.85 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 SER 5.80 6.00 0 52 ILE 0.10 -3.20 0 10 VAL -2.90 -1.20 1 12 ALA -5.30 -0.60 1 13 ASP -1.10 -0.40 1 14 VAL -4.00 -1.00 1 15 SER -0.50 0.00 1 16 GLU 0.00 1.00 1 17 TYR -0.80 -0.30 1 18 HIS -1.50 0.90 1 20 ASN 0.60 0.20 1 21 ILE 0.30 0.30 1 22 LYS 0.70 0.30 1 23 ASN 0.80 0.30 1 24 TRP 0.90 0.30 1 25 GLN 0.80 0.50 1 26 ILE 0.60 0.60 1 27 GLU 0.40 0.40 1 28 SER 0.10 0.10 1 29 TYR 0.80 0.40 1 31 GLU -0.30 0.20 1 33 GLU 0.10 0.10 1 34 PHE 0.60 0.50 1 35 HIS -0.70 1.10 1 36 THR -1.30 -0.40 1 37 ALA -1.70 -0.20 1 38 LYS -4.30 -1.50 1 39 VAL -1.30 -0.80 1 40 HIS -3.40 -0.20 1 41 LEU -4.30 -1.60 1 42 LYS -3.20 -0.80 1 44 ALA 1.50 0.50 1 47 GLN -4.30 -1.60 1 48 THR -5.30 -2.20 1 49 ILE 3.20 1.30 1 50 SER -1.60 -0.50 1 51 ALA -2.70 -0.20 1 53 LYS 1.00 1.50 1 54 PHE -3.60 0.30 1 55 ALA -4.20 -1.10 1 56 SER -0.60 0.70 1 57 PHE -3.80 -4.50 1 59 THR -3.00 -2.90 1 61 LEU -4.00 -1.50 1 63 THR -4.30 -2.90 1 66 THR -2.00 -2.10 1 67 PHE 1.60 0.10 1 68 GLN -6.20 -1.80 1 69 GLN 2.80 2.60 1 71 GLU 2.20 2.20 1 73 HIS -3.20 1.70 1 74 SER -0.20 -1.00 1 75 ILE 3.40 2.60 1 76 ASN 0.10 0.10 1 78 ASN 5.20 4.60 1 79 SER 4.60 3.30 1 80 VAL 5.70 4.20 1 81 LEU 3.10 0.80 1 82 GLU 3.00 3.10 1 83 ARG 3.70 2.90 1 84 LYS 0.60 1.10 1 86 ILE 6.00 2.50 1 88 LEU -3.10 -1.60 1 89 GLU 0.30 2.00 1 90 ARG -5.10 -2.50 1 92 VAL -2.80 -1.80 1 93 VAL -4.00 -1.50 1 94 ALA 0.30 -0.20 1 95 ILE 3.10 0.60 1 96 SER -3.00 -1.80 1 98 SER 4.70 3.10 1 99 ASN 1.20 1.10 1 100 PHE -0.10 1.00 1 103 ASP -3.30 -1.80 1 107 GLU 2.80 0.90 1 108 VAL -2.70 -1.40 1 109 MET 1.60 0.70 1 110 LYS -3.70 -0.80 1 111 ARG -6.30 -2.20 1 112 VAL -1.40 -1.00 1 113 ALA -5.30 -3.00 1 114 VAL -6.00 -2.90 1 115 GLU -4.00 -0.90 1 116 ALA -6.50 -2.50 1 117 VAL -1.70 -0.30 1 119 SER -3.80 -1.00 1 120 THR 1.10 1.30 1 121 ALA 0.00 0.20 1 122 ALA 0.20 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 3.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.08 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -2.15 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 SER 5.80 0.20 0 52 ILE 0.10 -3.30 0 10 VAL -2.90 1.70 1 12 ALA -5.30 4.70 1 13 ASP -1.10 0.70 1 14 VAL -4.00 3.00 1 15 SER -0.50 0.50 1 16 GLU 0.00 1.00 1 17 TYR -0.80 0.50 1 18 HIS -1.50 2.40 1 20 ASN 0.60 -0.40 1 21 ILE 0.30 0.00 1 22 LYS 0.70 -0.40 1 23 ASN 0.80 -0.50 1 24 TRP 0.90 -0.60 1 25 GLN 0.80 -0.30 1 26 ILE 0.60 0.00 1 27 GLU 0.40 0.00 1 28 SER 0.10 0.00 1 29 TYR 0.80 -0.40 1 31 GLU -0.30 0.50 1 33 GLU 0.10 0.00 1 34 PHE 0.60 -0.10 1 35 HIS -0.70 1.80 1 36 THR -1.30 0.90 1 37 ALA -1.70 1.50 1 38 LYS -4.30 2.80 1 39 VAL -1.30 0.50 1 40 HIS -3.40 3.20 1 41 LEU -4.30 2.70 1 42 LYS -3.20 2.40 1 44 ALA 1.50 -1.00 1 47 GLN -4.30 2.70 1 48 THR -5.30 3.10 1 49 ILE 3.20 -1.90 1 50 SER -1.60 1.10 1 51 ALA -2.70 2.50 1 53 LYS 1.00 0.50 1 54 PHE -3.60 3.90 1 55 ALA -4.20 3.10 1 56 SER -0.60 1.30 1 57 PHE -3.80 -0.70 1 59 THR -3.00 0.10 1 61 LEU -4.00 2.50 1 63 THR -4.30 1.40 1 66 THR -2.00 -0.10 1 67 PHE 1.60 -1.50 1 68 GLN -6.20 4.40 1 69 GLN 2.80 -0.20 1 71 GLU 2.20 0.00 1 73 HIS -3.20 4.90 1 74 SER -0.20 -0.80 1 75 ILE 3.40 -0.80 1 76 ASN 0.10 0.00 1 78 ASN 5.20 -0.60 1 79 SER 4.60 -1.30 1 80 VAL 5.70 -1.50 1 81 LEU 3.10 -2.30 1 82 GLU 3.00 0.10 1 83 ARG 3.70 -0.80 1 84 LYS 0.60 0.50 1 86 ILE 6.00 -3.50 1 88 LEU -3.10 1.50 1 89 GLU 0.30 1.70 1 90 ARG -5.10 2.60 1 92 VAL -2.80 1.00 1 93 VAL -4.00 2.50 1 94 ALA 0.30 -0.50 1 95 ILE 3.10 -2.50 1 96 SER -3.00 1.20 1 98 SER 4.70 -1.60 1 99 ASN 1.20 -0.10 1 100 PHE -0.10 1.10 1 103 ASP -3.30 1.50 1 107 GLU 2.80 -1.90 1 108 VAL -2.70 1.30 1 109 MET 1.60 -0.90 1 110 LYS -3.70 2.90 1 111 ARG -6.30 4.10 1 112 VAL -1.40 0.40 1 113 ALA -5.30 2.30 1 114 VAL -6.00 3.10 1 115 GLU -4.00 3.10 1 116 ALA -6.50 4.00 1 117 VAL -1.70 1.40 1 119 SER -3.80 2.80 1 120 THR 1.10 0.20 1 121 ALA 0.00 0.20 1 122 ALA 0.20 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.50 _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 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 112 VAL -1.40 1.03 0 10 VAL -2.90 0.55 1 12 ALA -5.30 0.42 1 13 ASP -1.10 0.70 1 14 VAL -4.00 0.35 1 15 SER -0.50 0.27 1 16 GLU 0.00 -0.26 1 17 TYR -0.80 0.01 1 18 HIS -1.50 -0.42 1 20 ASN 0.60 -0.05 1 21 ILE 0.30 -0.13 1 22 LYS 0.70 -0.14 1 23 ASN 0.80 -0.12 1 24 TRP 0.90 -0.16 1 25 GLN 0.80 -0.20 1 26 ILE 0.60 -0.17 1 27 GLU 0.40 -0.15 1 28 SER 0.10 -0.18 1 29 TYR 0.80 -0.12 1 31 GLU -0.30 -0.10 1 33 GLU 0.10 -0.24 1 34 PHE 0.60 -0.17 1 35 HIS -0.70 -0.25 1 36 THR -1.30 0.00 1 37 ALA -1.70 0.02 1 38 LYS -4.30 0.58 1 39 VAL -1.30 -0.03 1 40 HIS -3.40 0.48 1 41 LEU -4.30 0.27 1 42 LYS -3.20 0.66 1 44 ALA 1.50 -0.17 1 47 GLN -4.30 0.55 1 48 THR -5.30 0.09 1 49 ILE 3.20 0.29 1 50 SER -1.60 0.20 1 51 ALA -2.70 0.06 1 52 ILE 0.10 0.21 1 53 LYS 1.00 -0.07 1 54 PHE -3.60 -0.05 1 55 ALA -4.20 0.62 1 56 SER -0.60 -0.08 1 57 PHE -3.80 0.83 1 59 THR -3.00 0.35 1 61 LEU -4.00 0.38 1 63 THR -4.30 -0.06 1 66 THR -2.00 0.11 1 67 PHE 1.60 0.34 1 68 GLN -6.20 0.15 1 69 GLN 2.80 -0.42 1 71 GLU 2.20 -0.46 1 73 HIS -3.20 -0.14 1 74 SER -0.20 0.15 1 75 ILE 3.40 -0.07 1 76 ASN 0.10 0.26 1 77 SER 5.80 -0.40 1 78 ASN 5.20 -0.74 1 79 SER 4.60 -0.38 1 80 VAL 5.70 -0.63 1 81 LEU 3.10 -0.56 1 82 GLU 3.00 -0.67 1 83 ARG 3.70 -0.37 1 84 LYS 0.60 -0.14 1 86 ILE 6.00 -0.50 1 88 LEU -3.10 0.42 1 89 GLU 0.30 -0.13 1 90 ARG -5.10 0.87 1 92 VAL -2.80 0.90 1 93 VAL -4.00 0.02 1 94 ALA 0.30 0.03 1 95 ILE 3.10 -0.47 1 96 SER -3.00 0.30 1 98 SER 4.70 -0.37 1 99 ASN 1.20 -0.18 1 100 PHE -0.10 -0.22 1 103 ASP -3.30 -0.14 1 107 GLU 2.80 -0.38 1 108 VAL -2.70 0.00 1 109 MET 1.60 -0.13 1 110 LYS -3.70 0.17 1 111 ARG -6.30 0.84 1 113 ALA -5.30 0.82 1 114 VAL -6.00 0.99 1 115 GLU -4.00 0.87 1 116 ALA -6.50 0.85 1 117 VAL -1.70 0.36 1 119 SER -3.80 0.71 1 120 THR 1.10 0.02 1 121 ALA 0.00 -0.03 1 122 ALA 0.20 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 -2.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.06 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 1.45 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 ILE 3.10 -2.80 0 10 VAL -2.90 -2.10 1 12 ALA -5.30 -3.00 1 13 ASP -1.10 -0.70 1 14 VAL -4.00 -1.50 1 15 SER -0.50 -0.20 1 16 GLU 0.00 -1.10 1 17 TYR -0.80 -1.10 1 20 ASN 0.60 0.20 1 21 ILE 0.30 -0.40 1 23 ASN 0.80 -0.10 1 24 TRP 0.90 0.10 1 25 GLN 0.80 -0.20 1 26 ILE 0.60 0.00 1 27 GLU 0.40 -0.20 1 28 SER 0.10 -0.40 1 29 TYR 0.80 0.30 1 33 GLU 0.10 -0.30 1 35 HIS -0.70 0.50 1 36 THR -1.30 -0.60 1 37 ALA -1.70 -1.30 1 38 LYS -4.30 -1.40 1 39 VAL -1.30 -2.50 1 40 HIS -3.40 0.60 1 41 LEU -4.30 -2.60 1 42 LYS -3.20 -1.60 1 47 GLN -4.30 -0.50 1 48 THR -5.30 -0.80 1 49 ILE 3.20 0.40 1 50 SER -1.60 0.20 1 51 ALA -2.70 -2.90 1 52 ILE 0.10 -1.20 1 53 LYS 1.00 -0.20 1 54 PHE -3.60 -2.60 1 55 ALA -4.20 -2.40 1 56 SER -0.60 -1.40 1 57 PHE -3.80 -1.70 1 61 LEU -4.00 -0.30 1 63 THR -4.30 -3.00 1 66 THR -2.00 -0.50 1 67 PHE 1.60 1.20 1 68 GLN -6.20 -1.30 1 69 GLN 2.80 0.10 1 71 GLU 2.20 -0.90 1 73 HIS -3.20 -1.00 1 75 ILE 3.40 -0.20 1 76 ASN 0.10 -0.20 1 77 SER 5.80 -1.00 1 78 ASN 5.20 1.10 1 79 SER 4.60 2.60 1 80 VAL 5.70 0.90 1 81 LEU 3.10 1.40 1 82 GLU 3.00 2.50 1 83 ARG 3.70 2.90 1 84 LYS 0.60 1.70 1 86 ILE 6.00 1.60 1 88 LEU -3.10 -0.90 1 89 GLU 0.30 -2.40 1 90 ARG -5.10 -2.30 1 92 VAL -2.80 -1.20 1 93 VAL -4.00 -1.70 1 94 ALA 0.30 -0.60 1 98 SER 4.70 2.40 1 99 ASN 1.20 0.30 1 100 PHE -0.10 -1.10 1 107 GLU 2.80 -1.30 1 108 VAL -2.70 -1.20 1 109 MET 1.60 -0.10 1 110 LYS -3.70 -0.90 1 111 ARG -6.30 -1.10 1 112 VAL -1.40 -3.10 1 113 ALA -5.30 -1.70 1 114 VAL -6.00 -2.60 1 115 GLU -4.00 -1.90 1 116 ALA -6.50 -3.10 1 117 VAL -1.70 -1.10 1 119 SER -3.80 -0.50 1 120 THR 1.10 -0.70 1 121 ALA 0.00 -1.40 1 stop_ save_