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 bmr5822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 -3.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 5.31 _LACS_plot.Line_2_terminator_val_y_2 3.89 _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 45 LYS -6.30 -0.53 0 50 LEU -7.76 -1.34 0 10 LEU 3.02 2.56 1 11 GLU 2.44 1.84 1 12 ASN -0.32 -0.02 1 13 LYS -2.80 -3.29 1 14 SER -1.40 -0.97 1 15 LYS 3.19 2.32 1 16 ASP 5.31 3.18 1 17 SER 0.59 1.02 1 18 LEU -2.47 -1.54 1 19 VAL -7.17 -3.45 1 20 ASP -2.24 -2.17 1 21 ILE -7.70 -3.38 1 22 ILE -4.78 -3.16 1 24 ILE -3.12 -2.14 1 26 LYS 1.60 2.23 1 27 SER -3.06 -1.42 1 28 TYR -4.94 -2.26 1 29 GLU 1.02 0.96 1 30 ASP -0.41 -0.63 1 31 ALA -3.15 -2.01 1 32 THR -2.70 -1.13 1 33 LYS -4.53 -2.04 1 34 ILE 0.59 0.33 1 35 THR 0.18 -0.15 1 36 VAL 2.98 2.25 1 37 ARG 2.70 1.20 1 38 SER -0.29 -0.29 1 39 ASN 0.83 0.20 1 40 ASN -1.33 -0.37 1 41 ARG -2.72 -1.02 1 42 GLU -4.70 -1.69 1 43 VAL -1.77 -0.73 1 44 ALA -4.97 -1.69 1 46 ARG -0.66 -1.04 1 47 ASN -3.60 -1.96 1 48 ILE -0.48 -0.60 1 49 TYR -5.61 -2.33 1 51 MET -2.53 -2.12 1 52 ASP 3.20 1.20 1 53 THR 1.41 1.32 1 54 SER -1.22 -1.24 1 56 LYS -4.64 -2.60 1 57 VAL -5.42 -3.41 1 58 VAL 0.89 0.36 1 59 THR -4.79 -3.47 1 60 ALA -0.26 0.34 1 61 THR -3.46 -1.76 1 62 LEU -6.24 -1.91 1 63 TRP 3.49 3.10 1 65 GLU 3.72 2.93 1 66 ASP 3.05 1.95 1 67 ALA 2.85 3.63 1 68 ASP 0.40 0.12 1 69 LYS 2.52 2.62 1 70 PHE -2.61 -2.24 1 71 ASP -2.37 -2.54 1 73 SER 0.46 0.11 1 74 ARG 3.26 1.53 1 75 GLN -0.07 0.48 1 77 VAL -4.20 -1.87 1 78 LEU -5.00 -2.94 1 79 ALA -2.86 -1.18 1 80 ILE -4.40 -2.93 1 81 LYS -1.81 -1.16 1 83 ALA -4.43 -1.47 1 84 ARG 3.40 2.13 1 85 VAL -0.42 0.07 1 86 SER -2.12 -1.25 1 87 ASP 2.37 1.25 1 88 PHE -2.19 -0.82 1 91 ARG -3.15 -1.56 1 92 SER -5.45 -2.15 1 93 LEU -1.92 -1.60 1 94 SER 4.42 1.24 1 95 VAL -3.45 -2.02 1 96 LEU -0.79 -1.22 1 98 SER 0.03 -0.47 1 99 SER -0.96 0.54 1 100 THR -1.66 -0.41 1 101 ILE -2.79 -0.98 1 102 ILE -1.80 -1.77 1 103 ALA 3.34 2.31 1 104 ASN 0.21 -1.39 1 106 ASP -1.67 -1.18 1 107 ILE 4.39 3.93 1 109 GLU 1.56 2.04 1 110 ALA 4.03 2.38 1 111 TYR 3.69 2.84 1 112 LYS 3.45 3.33 1 113 LEU 3.63 3.49 1 114 ARG 4.51 3.55 1 116 TRP 3.81 4.00 1 117 PHE 2.78 2.04 1 118 ASP 0.47 0.88 1 119 ALA -0.57 0.65 1 120 GLU 1.69 0.51 1 122 GLN -0.85 -0.81 1 123 ALA 2.97 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 4.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 5.31 _LACS_plot.Line_2_terminator_val_y_2 -1.42 _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 45 LYS -6.30 5.77 0 50 LEU -7.76 6.42 0 10 LEU 3.02 -0.46 1 11 GLU 2.44 -0.60 1 12 ASN -0.32 0.30 1 13 LYS -2.80 -0.49 1 14 SER -1.40 0.43 1 15 LYS 3.19 -0.87 1 16 ASP 5.31 -2.13 1 17 SER 0.59 0.43 1 18 LEU -2.47 0.93 1 19 VAL -7.17 3.72 1 20 ASP -2.24 0.07 1 21 ILE -7.70 4.32 1 22 ILE -4.78 1.62 1 24 ILE -3.12 0.98 1 26 LYS 1.60 0.63 1 27 SER -3.06 1.64 1 28 TYR -4.94 2.68 1 29 GLU 1.02 -0.06 1 30 ASP -0.41 -0.22 1 31 ALA -3.15 1.14 1 32 THR -2.70 1.57 1 33 LYS -4.53 2.49 1 34 ILE 0.59 -0.26 1 35 THR 0.18 -0.33 1 36 VAL 2.98 -0.73 1 37 ARG 2.70 -1.50 1 38 SER -0.29 0.00 1 39 ASN 0.83 -0.63 1 40 ASN -1.33 0.96 1 41 ARG -2.72 1.70 1 42 GLU -4.70 3.01 1 43 VAL -1.77 1.04 1 44 ALA -4.97 3.28 1 46 ARG -0.66 -0.38 1 47 ASN -3.60 1.64 1 48 ILE -0.48 -0.12 1 49 TYR -5.61 3.28 1 51 MET -2.53 0.41 1 52 ASP 3.20 -2.00 1 53 THR 1.41 -0.09 1 54 SER -1.22 -0.02 1 56 LYS -4.64 2.04 1 57 VAL -5.42 2.01 1 58 VAL 0.89 -0.53 1 59 THR -4.79 1.32 1 60 ALA -0.26 0.60 1 61 THR -3.46 1.70 1 62 LEU -6.24 4.33 1 63 TRP 3.49 -0.39 1 65 GLU 3.72 -0.79 1 66 ASP 3.05 -1.10 1 67 ALA 2.85 0.78 1 68 ASP 0.40 -0.28 1 69 LYS 2.52 0.10 1 70 PHE -2.61 0.37 1 71 ASP -2.37 -0.17 1 73 SER 0.46 -0.35 1 74 ARG 3.26 -1.73 1 75 GLN -0.07 0.55 1 77 VAL -4.20 2.33 1 78 LEU -5.00 2.06 1 79 ALA -2.86 1.68 1 80 ILE -4.40 1.47 1 81 LYS -1.81 0.65 1 83 ALA -4.43 2.96 1 84 ARG 3.40 -1.27 1 85 VAL -0.42 0.49 1 86 SER -2.12 0.87 1 87 ASP 2.37 -1.12 1 88 PHE -2.19 1.37 1 91 ARG -3.15 1.59 1 92 SER -5.45 3.30 1 93 LEU -1.92 0.32 1 94 SER 4.42 -3.18 1 95 VAL -3.45 1.43 1 96 LEU -0.79 -0.43 1 98 SER 0.03 -0.50 1 99 SER -0.96 1.50 1 100 THR -1.66 1.25 1 101 ILE -2.79 1.81 1 102 ILE -1.80 0.03 1 103 ALA 3.34 -1.03 1 104 ASN 0.21 -1.60 1 106 ASP -1.67 0.49 1 107 ILE 4.39 -0.46 1 109 GLU 1.56 0.48 1 110 ALA 4.03 -1.65 1 111 TYR 3.69 -0.85 1 112 LYS 3.45 -0.12 1 113 LEU 3.63 -0.14 1 114 ARG 4.51 -0.96 1 116 TRP 3.81 0.19 1 117 PHE 2.78 -0.74 1 118 ASP 0.47 0.41 1 119 ALA -0.57 1.22 1 120 GLU 1.69 -1.18 1 122 GLN -0.85 0.04 1 123 ALA 2.97 -1.34 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 0.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 5.31 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _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 52 ASP 3.20 -2.70 0 10 LEU 3.02 -0.65 1 11 GLU 2.44 -0.54 1 12 ASN -0.32 -0.08 1 13 LYS -2.80 0.14 1 14 SER -1.40 0.13 1 15 LYS 3.19 -0.90 1 16 ASP 5.31 -0.54 1 17 SER 0.59 -0.24 1 18 LEU -2.47 0.89 1 19 VAL -7.17 0.45 1 20 ASP -2.24 1.18 1 21 ILE -7.70 0.71 1 22 ILE -4.78 0.89 1 24 ILE -3.12 0.00 1 26 LYS 1.60 -0.48 1 27 SER -3.06 0.37 1 28 TYR -4.94 0.11 1 29 GLU 1.02 -0.17 1 30 ASP -0.41 0.21 1 31 ALA -3.15 0.12 1 32 THR -2.70 0.53 1 33 LYS -4.53 0.35 1 34 ILE 0.59 0.19 1 35 THR 0.18 -0.12 1 36 VAL 2.98 -0.39 1 37 ARG 2.70 -0.46 1 38 SER -0.29 -0.17 1 39 ASN 0.83 -0.44 1 40 ASN -1.33 -0.09 1 41 ARG -2.72 0.51 1 42 GLU -4.70 0.26 1 43 VAL -1.77 0.41 1 44 ALA -4.97 0.23 1 45 LYS -6.30 -0.08 1 46 ARG -0.66 0.29 1 47 ASN -3.60 0.21 1 48 ILE -0.48 0.48 1 49 TYR -5.61 0.94 1 50 LEU -7.76 0.98 1 51 MET -2.53 0.15 1 53 THR 1.41 -0.45 1 54 SER -1.22 -0.14 1 56 LYS -4.64 1.05 1 57 VAL -5.42 0.50 1 58 VAL 0.89 0.04 1 59 THR -4.79 0.83 1 60 ALA -0.26 0.09 1 61 THR -3.46 0.19 1 62 LEU -6.24 0.62 1 63 TRP 3.49 -0.38 1 65 GLU 3.72 -0.42 1 66 ASP 3.05 -0.79 1 67 ALA 2.85 -0.51 1 68 ASP 0.40 -0.29 1 69 LYS 2.52 -0.84 1 70 PHE -2.61 -0.49 1 71 ASP -2.37 0.00 1 73 SER 0.46 -0.29 1 74 ARG 3.26 -0.59 1 75 GLN -0.07 -0.07 1 77 VAL -4.20 0.61 1 78 LEU -5.00 0.72 1 79 ALA -2.86 0.75 1 80 ILE -4.40 0.50 1 81 LYS -1.81 0.09 1 83 ALA -4.43 0.71 1 84 ARG 3.40 -0.21 1 85 VAL -0.42 -0.01 1 86 SER -2.12 0.07 1 87 ASP 2.37 -0.29 1 88 PHE -2.19 0.26 1 91 ARG -3.15 0.26 1 92 SER -5.45 0.93 1 93 LEU -1.92 0.29 1 94 SER 4.42 -0.29 1 95 VAL -3.45 0.16 1 96 LEU -0.79 -0.22 1 98 SER 0.03 0.05 1 99 SER -0.96 0.19 1 100 THR -1.66 0.44 1 101 ILE -2.79 0.09 1 102 ILE -1.80 0.48 1 103 ALA 3.34 -0.98 1 104 ASN 0.21 0.08 1 106 ASP -1.67 0.42 1 107 ILE 4.39 -0.68 1 109 GLU 1.56 -0.50 1 110 ALA 4.03 -0.38 1 111 TYR 3.69 -0.37 1 112 LYS 3.45 -0.39 1 113 LEU 3.63 -0.50 1 114 ARG 4.51 -0.41 1 116 TRP 3.81 -0.16 1 117 PHE 2.78 -0.53 1 118 ASP 0.47 -0.23 1 119 ALA -0.57 -0.36 1 120 GLU 1.69 -0.80 1 122 GLN -0.85 -0.16 1 123 ALA 2.97 -0.43 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 -2.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 5.31 _LACS_plot.Line_2_terminator_val_y_2 1.04 _LACS_plot.Y_axis_chem_shift_offset 0.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 99 SER -0.96 6.63 0 91 ARG -3.15 6.53 0 21 ILE -7.70 4.88 0 10 LEU 3.02 1.21 1 11 GLU 2.44 -0.50 1 12 ASN -0.32 -0.06 1 13 LYS -2.80 -0.69 1 14 SER -1.40 0.77 1 15 LYS 3.19 -0.69 1 16 ASP 5.31 -1.17 1 17 SER 0.59 6.12 1 18 LEU -2.47 0.28 1 19 VAL -7.17 -3.32 1 20 ASP -2.24 -0.69 1 22 ILE -4.78 4.72 1 24 ILE -3.12 -0.44 1 26 LYS 1.60 -0.98 1 27 SER -3.06 -3.00 1 28 TYR -4.94 0.23 1 29 GLU 1.02 0.29 1 30 ASP -0.41 -0.29 1 31 ALA -3.15 0.71 1 32 THR -2.70 -0.50 1 33 LYS -4.53 -1.60 1 34 ILE 0.59 -0.30 1 35 THR 0.18 0.02 1 36 VAL 2.98 1.15 1 37 ARG 2.70 0.18 1 38 SER -0.29 -0.54 1 39 ASN 0.83 -1.02 1 40 ASN -1.33 -1.15 1 41 ARG -2.72 -0.45 1 42 GLU -4.70 -2.68 1 43 VAL -1.77 -1.99 1 44 ALA -4.97 -1.89 1 45 LYS -6.30 -2.53 1 46 ARG -0.66 -1.50 1 47 ASN -3.60 4.45 1 48 ILE -0.48 -0.95 1 49 TYR -5.61 -3.08 1 50 LEU -7.76 -1.64 1 51 MET -2.53 -0.69 1 52 ASP 3.20 0.04 1 53 THR 1.41 1.83 1 54 SER -1.22 -2.82 1 56 LYS -4.64 -0.13 1 57 VAL -5.42 4.72 1 58 VAL 0.89 -1.58 1 59 THR -4.79 -3.00 1 60 ALA -0.26 6.07 1 61 THR -3.46 -2.32 1 62 LEU -6.24 2.39 1 63 TRP 3.49 1.66 1 65 GLU 3.72 1.98 1 66 ASP 3.05 1.89 1 67 ALA 2.85 1.57 1 68 ASP 0.40 -0.54 1 69 LYS 2.52 -2.48 1 70 PHE -2.61 -1.23 1 71 ASP -2.37 -1.30 1 73 SER 0.46 -1.43 1 74 ARG -0.07 -1.53 1 77 VAL -4.20 -3.43 1 78 LEU -5.00 -2.37 1 79 ALA -2.86 -1.77 1 80 ILE -4.40 0.77 1 81 LYS -1.81 -2.99 1 83 ALA -4.43 0.12 1 84 ARG 3.40 -0.15 1 85 VAL -0.42 -1.42 1 86 SER -2.12 -0.27 1 87 ASP 2.37 1.05 1 88 PHE -2.19 -1.13 1 92 SER -5.45 -1.22 1 93 LEU -1.92 -1.42 1 94 SER 4.42 -1.15 1 95 VAL -0.79 0.89 1 98 SER 0.03 0.27 1 100 THR -1.66 -1.21 1 101 ILE -2.79 -2.08 1 102 ILE -1.80 -1.01 1 103 ALA 0.21 -1.43 1 106 ASP 4.39 -0.56 1 109 GLU 1.56 0.77 1 110 ALA 4.03 3.65 1 111 TYR 3.69 2.49 1 112 LYS 3.45 0.19 1 113 LEU 3.63 1.44 1 114 ARG 4.51 1.60 1 116 TRP 3.81 0.91 1 117 PHE 2.78 0.61 1 118 ASP 0.47 0.20 1 119 ALA -0.57 0.73 1 120 GLU 1.69 -0.72 1 122 GLN -0.85 -1.10 1 stop_ save_