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 bmr25124_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 -2.54 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 5.15 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ILE -4.21 -4.83 0 10 ASP -2.16 0.87 1 11 ASP 2.67 1.15 1 12 ASP -1.06 -1.09 1 13 SER 4.20 3.04 1 14 SER 4.67 3.42 1 15 ILE 2.46 -0.32 1 16 ARG 6.01 5.63 1 17 TRP 3.21 2.98 1 18 VAL 4.77 3.66 1 19 LEU 3.41 2.87 1 20 GLU 4.80 3.97 1 21 ARG 3.42 2.49 1 22 ALA 2.01 2.14 1 23 LEU 5.15 2.67 1 24 ALA 3.59 2.31 1 26 ALA -0.61 -0.91 1 28 LEU -1.36 -1.22 1 29 THR 1.18 0.80 1 31 THR -0.66 0.16 1 32 THR -4.07 -2.70 1 33 PHE -5.19 -1.20 1 34 GLU -1.83 0.06 1 35 ASN -2.77 -0.74 1 37 ASN 4.92 3.74 1 38 GLU 1.40 2.19 1 39 VAL 4.84 3.02 1 40 LEU 4.31 2.84 1 41 ALA 3.47 2.22 1 42 ALA 2.08 2.47 1 43 LEU -0.13 0.35 1 44 ALA 2.28 1.85 1 45 SER -1.27 0.38 1 46 LYS -3.90 -0.60 1 47 THR -2.67 -1.90 1 49 ASP 0.78 2.30 1 50 VAL -3.55 -1.80 1 51 LEU -6.24 -1.96 1 52 LEU -2.35 -0.79 1 53 SER -4.02 -2.07 1 54 ASP -4.22 -0.93 1 55 ILE 4.50 4.19 1 56 ARG 4.33 1.03 1 57 MET -3.74 0.34 1 60 MET -1.58 0.47 1 61 ASP -1.96 -0.71 1 63 LEU 4.40 2.05 1 64 ALA 3.27 2.30 1 65 LEU 3.77 3.10 1 66 LEU 4.24 3.64 1 67 LYS 4.22 3.53 1 68 GLN 3.86 3.12 1 69 ILE 5.89 4.28 1 70 LYS 2.81 1.15 1 71 GLN 2.54 2.31 1 72 ARG -0.57 1.17 1 73 HIS -2.08 -0.05 1 75 MET 0.18 -1.10 1 76 LEU -1.47 0.37 1 78 VAL -3.46 -2.12 1 79 ILE -2.49 -1.07 1 81 MET -6.27 -2.51 1 82 THR -0.20 -1.16 1 83 ALA -0.34 -0.04 1 84 HIS 1.08 1.67 1 85 SER 1.64 0.67 1 86 ASP -0.41 -0.57 1 87 LEU 2.46 2.08 1 88 ASP 2.96 2.14 1 89 ALA 2.45 2.16 1 90 ALA 3.92 2.55 1 91 VAL 5.05 3.77 1 92 SER 3.93 3.10 1 93 ALA 4.61 2.67 1 94 TYR 4.40 3.32 1 95 GLN 3.84 2.77 1 96 GLN 0.17 -0.32 1 98 ALA 1.05 0.51 1 99 PHE 1.79 2.57 1 100 ASP -5.36 -1.67 1 101 TYR -4.99 -2.03 1 102 LEU -6.05 -2.68 1 104 LYS -2.90 -1.00 1 106 PHE -5.34 -4.46 1 107 ASP -2.16 -0.81 1 108 ILE 3.14 2.00 1 109 ASP 4.39 3.28 1 110 GLU 2.76 2.19 1 111 ALA 3.75 2.82 1 112 VAL 6.31 4.95 1 113 ALA 3.52 2.40 1 114 LEU 3.45 3.08 1 115 VAL 7.11 4.97 1 116 GLU 4.19 3.37 1 117 ARG 3.90 3.41 1 118 ALA 3.06 2.24 1 119 ILE 3.67 2.81 1 120 SER 1.85 1.57 1 121 HIS 1.86 2.36 1 122 TYR 0.70 0.63 1 123 GLN -0.52 -0.04 1 124 GLU 0.30 1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25124_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 3.73 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -1.95 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ILE -4.21 -0.62 0 10 ASP -2.16 3.03 1 11 ASP 2.67 -1.52 1 12 ASP -1.06 -0.03 1 13 SER 4.20 -1.16 1 14 SER 4.67 -1.25 1 15 ILE 2.46 -2.78 1 16 ARG 6.01 -0.38 1 17 TRP 3.21 -0.23 1 18 VAL 4.77 -1.11 1 19 LEU 3.41 -0.54 1 20 GLU 4.80 -0.83 1 21 ARG 3.42 -0.93 1 22 ALA 2.01 0.13 1 23 LEU 5.15 -2.48 1 24 ALA 3.59 -1.28 1 26 ALA -0.61 -0.30 1 28 LEU -1.36 0.14 1 29 THR 1.18 -0.38 1 31 THR -0.66 0.82 1 32 THR -4.07 1.37 1 33 PHE -5.19 3.99 1 34 GLU -1.83 1.89 1 35 ASN -2.77 2.03 1 37 ASN 4.92 -1.18 1 38 GLU 1.40 0.79 1 39 VAL 4.84 -1.82 1 40 LEU 4.31 -1.47 1 41 ALA 3.47 -1.25 1 42 ALA 2.08 0.39 1 43 LEU -0.13 0.48 1 44 ALA 2.28 -0.43 1 45 SER -1.27 1.65 1 46 LYS -3.90 3.30 1 47 THR -2.67 0.77 1 49 ASP 0.78 1.52 1 50 VAL -3.55 1.75 1 51 LEU -6.24 4.28 1 52 LEU -2.35 1.56 1 53 SER -4.02 1.95 1 54 ASP -4.22 3.29 1 55 ILE 4.50 -0.31 1 56 ARG 4.33 -3.30 1 57 MET -3.74 4.08 1 60 MET -1.58 2.05 1 61 ASP -1.96 1.25 1 63 LEU 4.40 -2.35 1 64 ALA 3.27 -0.97 1 65 LEU 3.77 -0.67 1 66 LEU 4.24 -0.60 1 67 LYS 4.22 -0.69 1 68 GLN 3.86 -0.74 1 69 ILE 5.89 -1.61 1 70 LYS 2.81 -1.66 1 71 GLN 2.54 -0.23 1 72 ARG -0.57 1.74 1 73 HIS -2.08 2.03 1 75 MET 0.18 -1.28 1 76 LEU -1.47 1.84 1 78 VAL -3.46 1.34 1 79 ILE -2.49 1.42 1 81 MET -6.27 3.76 1 82 THR -0.20 -0.96 1 83 ALA -0.34 0.30 1 84 HIS 1.08 0.59 1 85 SER 1.64 -0.97 1 86 ASP -0.41 -0.16 1 87 LEU 2.46 -0.38 1 88 ASP 2.96 -0.82 1 89 ALA 2.45 -0.29 1 90 ALA 3.92 -1.37 1 91 VAL 5.05 -1.28 1 92 SER 3.93 -0.83 1 93 ALA 4.61 -1.94 1 94 TYR 4.40 -1.08 1 95 GLN 3.84 -1.07 1 96 GLN 0.17 -0.49 1 98 ALA 1.05 -0.54 1 99 PHE 1.79 0.78 1 100 ASP -5.36 3.69 1 101 TYR -4.99 2.96 1 102 LEU -6.05 3.37 1 104 LYS -2.90 1.90 1 106 PHE -5.34 0.88 1 107 ASP -2.16 1.35 1 108 ILE 3.14 -1.14 1 109 ASP 4.39 -1.11 1 110 GLU 2.76 -0.57 1 111 ALA 3.75 -0.93 1 112 VAL 6.31 -1.36 1 113 ALA 3.52 -1.12 1 114 LEU 3.45 -0.37 1 115 VAL 7.11 -2.14 1 116 GLU 4.19 -0.82 1 117 ARG 3.90 -0.49 1 118 ALA 3.06 -0.82 1 119 ILE 3.67 -0.86 1 120 SER 1.85 -0.28 1 121 HIS 1.86 0.50 1 122 TYR 0.70 -0.07 1 123 GLN -0.52 0.48 1 124 GLU 0.30 1.16 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25124_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 0.47 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -0.59 _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 39 VAL 4.84 -1.52 0 10 ASP -2.16 -0.09 1 11 ASP 2.67 -0.03 1 12 ASP -1.06 0.12 1 13 SER 4.20 -0.75 1 14 SER 4.67 -0.15 1 15 ILE 2.46 -0.20 1 16 ARG 6.01 -0.63 1 17 TRP 3.21 -0.18 1 18 VAL 4.77 -0.46 1 19 LEU 3.41 -0.26 1 20 GLU 4.80 -0.34 1 21 ARG 3.42 -0.44 1 22 ALA 2.01 -0.21 1 23 LEU 5.15 -0.34 1 24 ALA 3.59 0.35 1 26 ALA -0.61 0.18 1 28 LEU -1.36 0.24 1 29 THR 1.18 0.00 1 31 THR -0.66 0.09 1 32 THR -4.07 1.10 1 33 PHE -5.19 0.10 1 34 GLU -1.83 0.10 1 35 ASN -2.77 0.22 1 37 ASN 4.92 -0.38 1 38 GLU 1.40 -0.29 1 40 LEU 4.31 -0.41 1 41 ALA 3.47 -0.16 1 42 ALA 2.08 -0.10 1 43 LEU -0.13 0.92 1 44 ALA 2.28 -0.09 1 45 SER -1.27 0.29 1 46 LYS -3.90 0.29 1 47 THR -2.67 -0.30 1 49 ASP 0.78 -0.18 1 50 VAL -3.55 0.20 1 51 LEU -6.24 1.04 1 52 LEU -2.35 0.97 1 53 SER -4.02 0.92 1 54 ASP -4.22 0.98 1 55 ILE 4.50 -0.05 1 56 ARG 4.33 0.04 1 57 MET -3.74 0.03 1 60 MET -1.58 -0.14 1 61 ASP -1.96 0.23 1 63 LEU 4.40 -0.05 1 64 ALA 3.27 -0.21 1 65 LEU 3.77 -0.30 1 66 LEU 4.24 -0.49 1 67 LYS 4.22 -0.32 1 68 GLN 3.86 -0.29 1 69 ILE 5.89 -0.61 1 70 LYS 2.81 -0.38 1 71 GLN 2.54 -0.28 1 72 ARG -0.57 -0.21 1 73 HIS -2.08 -0.04 1 75 MET 0.18 0.11 1 76 LEU -1.47 -0.39 1 78 VAL -3.46 0.97 1 79 ILE -2.49 0.33 1 80 ILE -4.21 1.08 1 81 MET -6.27 1.01 1 82 THR -0.20 0.78 1 83 ALA -0.34 0.36 1 84 HIS 1.08 -0.15 1 85 SER 1.64 -0.17 1 86 ASP -0.41 0.12 1 87 LEU 2.46 -0.27 1 88 ASP 2.96 -0.27 1 89 ALA 2.45 -0.28 1 90 ALA 3.92 -1.07 1 91 VAL 5.05 -0.48 1 92 SER 3.93 -0.26 1 93 ALA 4.61 -0.53 1 94 TYR 4.40 -0.27 1 95 GLN 3.84 -0.34 1 96 GLN 0.17 -0.02 1 98 ALA 1.05 -0.05 1 99 PHE 1.79 -0.36 1 100 ASP -5.36 -0.09 1 101 TYR -4.99 0.87 1 102 LEU -6.05 0.00 1 104 LYS -2.90 -0.15 1 106 PHE -5.34 0.55 1 107 ASP -2.16 0.18 1 108 ILE 3.14 -0.22 1 109 ASP 4.39 -0.25 1 110 GLU 2.76 -0.27 1 111 ALA 3.75 -0.56 1 112 VAL 6.31 -0.93 1 113 ALA 3.52 -0.16 1 114 LEU 3.45 -0.24 1 115 VAL 7.11 -0.87 1 116 GLU 4.19 -0.54 1 117 ARG 3.90 -0.23 1 118 ALA 3.06 -0.85 1 119 ILE 3.67 -0.46 1 120 SER 1.85 -0.18 1 121 HIS 1.86 -0.29 1 122 TYR 0.70 -0.09 1 123 GLN -0.52 -0.05 1 124 GLU 0.30 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25124_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.09 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 2.92 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 ARG 4.33 -3.51 0 10 ASP -2.16 -1.42 1 11 ASP 2.67 -1.21 1 12 ASP -1.06 0.69 1 13 SER 4.20 1.55 1 14 SER 4.67 1.81 1 15 ILE 2.46 1.39 1 16 ARG 6.01 1.04 1 17 TRP 3.21 2.29 1 18 VAL 4.77 2.86 1 19 LEU 3.41 0.16 1 20 GLU 4.80 1.90 1 21 ARG 3.42 3.47 1 22 ALA 2.01 2.66 1 23 LEU 5.15 1.24 1 24 ALA 3.59 5.41 1 28 LEU -1.36 -1.61 1 29 THR 1.18 -1.36 1 31 THR -0.66 -2.02 1 32 THR -4.07 -2.44 1 33 PHE -5.19 -1.29 1 34 GLU -1.83 -1.64 1 35 ASN -2.77 0.15 1 37 ASN 4.92 3.59 1 38 GLU 1.40 2.77 1 39 VAL 4.84 0.51 1 40 LEU 4.31 1.98 1 41 ALA 3.47 2.76 1 42 ALA 2.08 2.37 1 43 LEU -0.13 -0.21 1 44 ALA 2.28 0.94 1 45 SER -1.27 -1.26 1 46 LYS -3.90 -3.79 1 49 ASP 0.78 -0.71 1 50 VAL -3.55 -4.73 1 51 LEU -6.24 -4.34 1 52 LEU -2.35 -2.91 1 53 SER -4.02 -0.99 1 54 ASP -4.22 -0.58 1 55 ILE 4.50 0.51 1 60 MET -1.58 -2.11 1 61 ASP -1.96 0.67 1 63 LEU 4.40 1.69 1 64 ALA 3.27 3.42 1 65 LEU 3.77 -0.05 1 66 LEU 4.24 -0.37 1 67 LYS 4.22 2.85 1 68 GLN 3.86 3.32 1 69 ILE 5.89 1.39 1 70 LYS 2.81 1.34 1 71 GLN 2.54 1.02 1 72 ARG -0.57 -0.50 1 75 MET 0.18 -0.23 1 78 VAL -3.46 -0.52 1 79 ILE -2.49 -2.11 1 80 ILE -4.21 -2.95 1 81 MET -6.27 -2.48 1 82 THR -0.20 -2.15 1 83 ALA -0.34 0.01 1 84 HIS 1.08 1.41 1 85 SER 1.64 -0.04 1 86 ASP -0.41 -0.21 1 87 LEU 2.46 0.29 1 88 ASP 2.96 1.80 1 89 ALA 2.45 0.73 1 90 ALA 3.92 1.18 1 91 VAL 5.05 2.33 1 92 SER 3.93 1.36 1 93 ALA 4.61 1.49 1 94 TYR 4.40 4.05 1 95 GLN 3.84 1.68 1 96 GLN 0.17 -0.46 1 98 ALA 1.05 -1.73 1 99 PHE 1.79 -0.37 1 100 ASP -5.36 -3.25 1 101 TYR -4.99 -3.35 1 106 PHE -5.34 -0.61 1 107 ASP -2.16 1.51 1 108 ILE 3.14 -0.17 1 109 ASP 4.39 3.55 1 110 GLU 2.76 2.38 1 111 ALA 3.75 0.80 1 112 VAL 6.31 0.93 1 113 ALA 3.52 2.79 1 114 LEU 3.45 1.00 1 115 VAL 7.11 1.25 1 116 GLU 4.19 2.96 1 117 ARG 3.90 2.20 1 118 ALA 3.06 0.83 1 119 ILE 3.67 1.04 1 120 SER 1.85 0.54 1 121 HIS 1.86 0.86 1 122 TYR 0.70 -0.55 1 123 GLN -0.52 -1.44 1 stop_ save_