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 bmr10314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.99 _LACS_plot.Line_1_terminator_val_y_1 -2.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.93 _LACS_plot.Line_2_terminator_val_x_2 9.93 _LACS_plot.Line_2_terminator_val_y_2 7.25 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 ASN -7.99 -0.44 0 39 TYR -5.28 -5.59 0 10 LYS -2.42 0.71 1 11 SER -4.67 -1.12 1 13 TRP -3.06 -0.96 1 14 LEU -4.74 0.10 1 15 LEU -2.57 -0.73 1 16 ARG -5.80 -2.00 1 17 GLN 1.71 0.39 1 18 SER -1.46 -1.55 1 19 THR 3.85 2.97 1 20 ILE 2.52 1.88 1 21 LEU -0.06 -0.01 1 22 LYS 4.55 0.68 1 23 ARG -3.22 -1.43 1 24 TRP -0.72 -0.51 1 25 LYS -4.39 -1.55 1 26 LYS 1.33 1.32 1 28 TRP -1.27 -0.90 1 29 PHE -3.66 -0.99 1 30 ASP -5.04 -0.21 1 31 LEU -3.89 -1.69 1 32 TRP -3.65 -1.00 1 33 SER 3.96 3.13 1 34 ASP -0.05 -0.72 1 36 HIS 5.89 5.25 1 37 LEU -3.54 -1.26 1 38 ILE -3.25 -1.25 1 40 TYR -6.87 -1.59 1 41 ASP 2.66 3.54 1 42 ASP -1.86 -0.90 1 43 GLN 3.15 1.03 1 44 THR 1.78 1.58 1 45 ARG 5.94 1.53 1 46 GLN 0.94 1.89 1 47 SER -1.67 -1.80 1 48 ILE 1.08 1.64 1 49 GLU 0.38 0.99 1 50 ASP -4.44 -1.64 1 51 LYS -4.85 -1.46 1 52 VAL -4.81 -1.55 1 53 HIS -2.50 -0.70 1 54 MET 9.93 5.31 1 56 VAL -0.40 1.16 1 57 ASP 0.25 2.20 1 59 ILE -0.30 0.33 1 60 ASN -2.63 0.20 1 61 ILE -2.43 -0.48 1 62 ARG -5.34 -2.21 1 63 THR -3.75 -1.27 1 65 HIS 2.82 4.00 1 66 GLU -0.92 0.29 1 68 ARG -2.53 -0.52 1 69 ASP 2.62 1.14 1 70 ILE -5.61 -2.29 1 71 GLN -2.78 -1.67 1 74 ASP 2.27 1.79 1 76 LYS -2.15 -2.30 1 78 ARG 4.74 3.28 1 79 ASP 1.48 1.62 1 81 LEU -2.80 -0.09 1 82 LEU -3.63 0.15 1 83 GLN -6.27 -1.75 1 84 ILE -0.98 -0.12 1 85 VAL 1.14 0.44 1 87 ARG 2.61 2.40 1 88 ASP 1.54 0.10 1 90 LYS 0.38 0.61 1 91 THR -1.42 -0.13 1 92 ILE -1.04 -0.32 1 93 SER 1.19 1.12 1 94 LEU -5.67 -2.07 1 96 ALA -2.80 -1.47 1 97 GLU 0.63 1.43 1 98 SER -4.81 -1.76 1 99 THR 6.46 4.69 1 100 ASP 4.12 3.40 1 101 ASP 1.57 2.78 1 103 LEU 3.71 2.63 1 104 ALA 3.64 2.68 1 105 TRP 5.00 4.20 1 106 LYS 6.06 5.08 1 107 PHE 4.71 3.43 1 108 THR 5.81 4.55 1 109 LEU 3.33 2.47 1 110 GLN 5.16 3.68 1 111 ASP 3.76 3.11 1 112 SER 2.54 3.04 1 113 ARG 2.46 2.40 1 114 THR 0.12 -0.20 1 115 SER 0.32 0.70 1 118 SER -0.08 0.14 1 119 SER -0.25 0.17 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.99 _LACS_plot.Line_1_terminator_val_y_1 5.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.07 _LACS_plot.Line_2_terminator_val_x_2 9.93 _LACS_plot.Line_2_terminator_val_y_2 -2.68 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 ASN -7.99 7.55 0 39 TYR -5.28 -0.31 0 10 LYS -2.42 3.13 1 11 SER -4.67 3.55 1 13 TRP -3.06 2.10 1 14 LEU -4.74 4.84 1 15 LEU -2.57 1.84 1 16 ARG -5.80 3.80 1 17 GLN 1.71 -1.32 1 18 SER -1.46 -0.09 1 19 THR 3.85 -0.88 1 20 ILE 2.52 -0.64 1 21 LEU -0.06 0.05 1 22 LYS 4.55 -3.87 1 23 ARG -3.22 1.79 1 24 TRP -0.72 0.21 1 25 LYS -4.39 2.84 1 26 LYS 1.33 -0.01 1 28 TRP -1.27 0.37 1 29 PHE -3.66 2.67 1 30 ASP -5.04 4.83 1 31 LEU -3.89 2.20 1 32 TRP -3.65 2.65 1 33 SER 3.96 -0.83 1 34 ASP -0.05 -0.67 1 36 HIS 5.89 -0.64 1 37 LEU -3.54 2.28 1 38 ILE -3.25 2.00 1 40 TYR -6.87 5.28 1 41 ASP 2.66 0.88 1 42 ASP -1.86 0.96 1 43 GLN 3.15 -2.12 1 44 THR 1.78 -0.20 1 45 ARG 5.94 -4.41 1 46 GLN 0.94 0.95 1 47 SER -1.67 -0.13 1 48 ILE 1.08 0.56 1 49 GLU 0.38 0.61 1 50 ASP -4.44 2.80 1 51 LYS -4.85 3.39 1 52 VAL -4.81 3.26 1 53 HIS -2.50 1.80 1 54 MET 9.93 -4.62 1 56 VAL -0.40 1.56 1 57 ASP 0.25 1.95 1 59 ILE -0.30 0.63 1 60 ASN -2.63 2.83 1 61 ILE -2.43 1.95 1 62 ARG -5.34 3.13 1 63 THR -3.75 2.48 1 65 HIS 2.82 1.18 1 66 GLU -0.92 1.21 1 68 ARG -2.53 2.01 1 69 ASP 2.62 -1.48 1 70 ILE -5.61 3.32 1 71 GLN -2.78 1.11 1 74 ASP 2.27 -0.48 1 76 LYS -2.15 -0.15 1 78 ARG 4.74 -1.46 1 79 ASP 1.48 0.14 1 81 LEU -2.80 2.71 1 82 LEU -3.63 3.78 1 83 GLN -6.27 4.52 1 84 ILE -0.98 0.86 1 85 VAL 1.14 -0.70 1 87 ARG 2.61 -0.21 1 88 ASP 1.54 -1.44 1 90 LYS 0.38 0.23 1 91 THR -1.42 1.29 1 92 ILE -1.04 0.72 1 93 SER 1.19 -0.07 1 94 LEU -5.67 3.60 1 96 ALA -2.80 1.33 1 97 GLU 0.63 0.80 1 98 SER -4.81 3.05 1 99 THR 6.46 -1.77 1 100 ASP 4.12 -0.72 1 101 ASP 1.57 1.21 1 103 LEU 3.71 -1.08 1 104 ALA 3.64 -0.96 1 105 TRP 5.00 -0.80 1 106 LYS 6.06 -0.98 1 107 PHE 4.71 -1.28 1 108 THR 5.81 -1.26 1 109 LEU 3.33 -0.86 1 110 GLN 5.16 -1.48 1 111 ASP 3.76 -0.65 1 112 SER 2.54 0.50 1 113 ARG 2.46 -0.06 1 114 THR 0.12 -0.32 1 115 SER 0.32 0.38 1 118 SER -0.08 0.22 1 119 SER -0.25 0.42 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.99 _LACS_plot.Line_1_terminator_val_y_1 1.00 _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 0.28 _LACS_plot.Line_2_terminator_val_x_2 9.93 _LACS_plot.Line_2_terminator_val_y_2 -1.00 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 ASP -4.44 -0.51 0 54 MET 9.93 -0.45 0 43 GLN 3.15 -1.58 0 10 LYS -2.42 -0.08 1 11 SER -4.67 1.47 1 13 TRP -3.06 0.89 1 14 LEU -4.74 0.19 1 15 LEU -2.57 0.78 1 16 ARG -5.80 1.13 1 17 GLN 1.71 -0.88 1 18 SER -1.46 0.22 1 19 THR 3.85 -0.30 1 20 ILE 2.52 -0.15 1 21 LEU -0.06 -0.13 1 22 LYS 4.55 -0.51 1 23 ARG -3.22 0.31 1 24 TRP -0.72 0.15 1 25 LYS -4.39 0.50 1 26 LYS 1.33 0.44 1 27 ASN -7.99 0.89 1 28 TRP -1.27 -0.17 1 29 PHE -3.66 0.38 1 30 ASP -5.04 0.78 1 31 LEU -3.89 1.28 1 32 TRP -3.65 0.78 1 33 SER 3.96 -0.28 1 34 ASP -0.05 0.19 1 36 HIS 5.89 0.27 1 37 LEU -3.54 1.07 1 38 ILE -3.25 0.42 1 39 TYR -5.28 1.28 1 40 TYR -6.87 0.71 1 41 ASP 2.66 0.02 1 42 ASP -1.86 0.34 1 44 THR 1.78 -0.40 1 45 ARG 5.94 -1.57 1 46 GLN 0.94 -0.13 1 47 SER -1.67 0.37 1 48 ILE 1.08 -0.59 1 49 GLU 0.38 -0.01 1 51 LYS -4.85 0.75 1 52 VAL -4.81 0.30 1 53 HIS -2.50 -0.02 1 56 VAL -0.40 -0.01 1 57 ASP 0.25 0.05 1 59 ILE -0.30 0.32 1 60 ASN -2.63 0.03 1 61 ILE -2.43 0.74 1 62 ARG -5.34 0.53 1 63 THR -3.75 0.55 1 65 HIS 2.82 -0.58 1 66 GLU -0.92 -0.26 1 68 ARG -2.53 0.10 1 69 ASP 2.62 -0.37 1 70 ILE -5.61 0.49 1 71 GLN -2.78 0.20 1 74 ASP 2.27 -0.41 1 76 LYS -2.15 0.12 1 78 ARG 4.74 -0.77 1 79 ASP 1.48 -0.33 1 81 LEU -2.80 0.52 1 82 LEU -3.63 0.52 1 83 GLN -6.27 1.15 1 84 ILE -0.98 0.03 1 85 VAL 1.14 0.20 1 87 ARG 2.61 -0.28 1 88 ASP 1.54 -0.21 1 90 LYS 0.38 0.01 1 91 THR -1.42 0.73 1 92 ILE -1.04 0.05 1 93 SER 1.19 0.51 1 94 LEU -5.67 1.50 1 96 ALA -2.80 0.32 1 97 GLU 0.63 -0.28 1 98 SER -4.81 0.18 1 99 THR 6.46 -0.60 1 100 ASP 4.12 -0.25 1 101 ASP 1.57 -0.03 1 103 LEU 3.71 -0.43 1 104 ALA 3.64 -0.09 1 105 TRP 5.00 -0.63 1 106 LYS 6.06 -0.73 1 107 PHE 4.71 -0.27 1 108 THR 5.81 -0.31 1 109 LEU 3.33 -0.12 1 110 GLN 5.16 -0.37 1 111 ASP 3.76 -0.20 1 112 SER 2.54 -0.12 1 113 ARG 2.46 -0.67 1 114 THR 0.12 0.12 1 115 SER 0.32 0.02 1 118 SER -0.08 0.11 1 119 SER -0.25 0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.99 _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 0.36 _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 9.93 _LACS_plot.Line_2_terminator_val_y_2 2.64 _LACS_plot.Y_axis_chem_shift_offset 0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 104 ALA 3.64 4.57 0 54 MET 9.93 0.50 0 32 TRP -3.65 3.31 0 10 LYS -2.42 -3.64 1 11 SER -4.67 -0.96 1 13 TRP -3.06 2.45 1 14 LEU -4.74 -1.41 1 15 LEU -2.57 -1.63 1 16 ARG -5.80 -1.19 1 17 GLN 1.71 -0.94 1 18 SER -1.46 1.22 1 19 THR 3.85 1.09 1 20 ILE 2.52 0.70 1 21 LEU -0.06 -1.06 1 22 LYS 4.55 -1.21 1 23 ARG -3.22 -1.03 1 24 TRP -0.72 -0.12 1 25 LYS -4.39 -1.64 1 26 LYS 1.33 -0.67 1 27 ASN -7.99 -3.23 1 28 TRP -1.27 -1.58 1 29 PHE -3.66 -1.33 1 30 ASP -5.04 -2.35 1 31 LEU -3.89 -1.55 1 34 ASP -0.05 0.89 1 36 HIS 5.89 -1.52 1 37 LEU -3.54 -3.57 1 38 ILE -3.25 -3.32 1 39 TYR -5.28 -0.54 1 40 TYR -6.87 1.01 1 41 ASP 2.66 -0.91 1 42 ASP -1.86 -1.02 1 43 GLN 3.15 -0.22 1 44 THR 1.78 1.22 1 45 ARG 5.94 -1.60 1 46 GLN 0.94 1.02 1 47 SER -1.67 -1.10 1 48 ILE 1.08 -0.02 1 49 GLU 0.38 -1.11 1 50 ASP -4.44 -4.88 1 51 LYS -4.85 -1.86 1 52 VAL -4.81 -2.08 1 53 HIS -2.50 0.85 1 56 VAL -0.40 0.31 1 57 ASP 0.25 0.43 1 59 ILE -0.30 -0.83 1 60 ASN -2.63 -2.50 1 61 ILE -2.43 -1.41 1 62 ARG -5.34 -1.26 1 63 THR -3.75 1.20 1 65 HIS 2.82 1.53 1 66 GLU -0.92 1.49 1 68 ARG -2.53 -0.31 1 69 ASP 2.62 -1.70 1 70 ILE -5.61 -3.28 1 71 GLN -2.78 -1.02 1 74 ASP 2.27 0.78 1 76 LYS -2.15 -1.18 1 78 ARG 4.74 0.98 1 79 ASP 1.48 -0.62 1 81 LEU -2.80 -1.71 1 82 LEU -3.63 -2.66 1 83 GLN -6.27 -1.28 1 84 ILE -0.98 -1.99 1 85 VAL 1.14 0.24 1 90 LYS 0.38 -1.57 1 91 THR -1.42 -0.77 1 92 ILE -1.04 -1.18 1 93 SER 1.19 -2.73 1 94 LEU -5.67 -1.67 1 96 ALA -2.80 -1.90 1 97 GLU 0.63 -0.14 1 98 SER -4.81 0.40 1 99 THR 6.46 1.74 1 100 ASP 4.12 2.64 1 101 ASP 1.57 1.01 1 103 LEU 3.71 0.57 1 105 TRP 5.00 1.54 1 106 LYS 6.06 1.52 1 107 PHE 4.71 3.05 1 108 THR 5.81 3.09 1 109 LEU 3.33 2.80 1 110 GLN 5.16 3.66 1 111 ASP 3.76 2.57 1 112 SER 2.54 1.03 1 113 ARG 2.46 0.13 1 114 THR 0.12 -0.14 1 115 SER 0.32 -0.31 1 118 SER -0.08 0.20 1 119 SER -0.25 -0.58 1 stop_ save_