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 bmr18200_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.86 _LACS_plot.Line_1_terminator_val_y_1 -2.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 5.78 _LACS_plot.Line_2_terminator_val_y_2 4.49 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 ARG 5.72 0.16 0 11 THR 0.36 0.06 1 12 LEU 0.22 -0.17 1 13 THR 0.06 -0.14 1 15 HIS 0.10 0.43 1 16 LYS -0.98 -0.39 1 17 THR 1.56 1.48 1 18 ILE -3.41 -1.23 1 19 SER -4.11 -1.67 1 20 PHE -3.48 -1.79 1 22 SER 0.62 1.12 1 23 LEU -2.03 -0.96 1 24 THR -2.14 0.18 1 25 ILE -1.77 0.09 1 26 ASP -5.12 -2.75 1 28 VAL 4.76 3.18 1 29 ASN -0.17 -0.54 1 31 GLN -5.80 -2.16 1 32 VAL -1.84 -0.91 1 33 LEU -5.37 -2.28 1 34 LEU -4.45 -2.09 1 37 GLU -3.71 -2.29 1 38 ASN 0.69 1.48 1 39 VAL -0.31 -0.49 1 40 ALA 0.59 -0.25 1 41 LEU -5.86 -2.08 1 42 SER -1.80 -1.07 1 43 THR 5.28 4.30 1 44 ALA 2.39 2.07 1 45 ASP 4.91 3.02 1 46 PHE 5.78 4.84 1 47 ASP 5.19 3.59 1 48 LEU 3.64 2.97 1 49 LEU 4.28 2.77 1 50 TRP 3.34 2.78 1 51 GLU 3.08 2.75 1 52 LEU 3.20 3.20 1 53 ALA 2.59 1.74 1 54 THR 1.87 1.29 1 55 HIS 0.29 -0.13 1 56 ALA 1.77 2.03 1 58 GLN -2.76 -1.79 1 59 ILE 2.39 1.35 1 60 MET -2.30 -2.28 1 61 ASP -2.28 -1.29 1 62 ARG 5.22 4.52 1 63 ASP 4.22 3.20 1 64 ALA 2.49 1.89 1 65 LEU 2.29 1.91 1 66 LEU 2.29 1.66 1 67 LYS 3.70 2.70 1 68 ASN 0.90 0.92 1 69 LEU 0.49 0.11 1 70 ARG 0.38 0.24 1 72 VAL -0.58 -0.48 1 73 THR 0.34 -0.13 1 74 TYR -0.16 -0.14 1 75 ASP -0.20 -0.16 1 77 MET 0.44 0.36 1 78 ASP 1.51 1.26 1 79 ARG 0.84 -0.06 1 80 SER 1.57 1.29 1 81 VAL 4.49 3.33 1 82 ASP 4.14 3.70 1 83 VAL 4.78 3.51 1 84 ALA 2.23 2.68 1 85 ILE 5.55 1.22 1 87 ARG 3.44 3.51 1 88 LEU 2.97 3.04 1 89 ARG 4.46 3.88 1 90 LYS 3.40 2.73 1 91 LYS 2.75 2.10 1 92 LEU 1.19 -1.91 1 93 LEU 5.41 0.39 1 94 ASP -3.07 -1.86 1 96 ALA 1.74 2.00 1 97 THR 2.95 2.17 1 98 GLU -3.26 -3.00 1 100 TYR -2.55 -1.06 1 101 ARG 3.35 2.20 1 103 LYS -0.91 0.36 1 104 THR 1.16 1.03 1 105 VAL 0.85 -0.79 1 106 ARG 3.52 1.94 1 107 ASN 2.96 1.79 1 108 LYS -1.34 0.76 1 110 TYR -5.42 -0.99 1 111 LEU -5.65 -0.72 1 112 PHE -1.62 -0.83 1 113 ALA -3.80 -3.32 1 115 HIS 0.51 0.40 1 116 ALA -3.28 -0.54 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18200_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.86 _LACS_plot.Line_1_terminator_val_y_1 3.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 5.78 _LACS_plot.Line_2_terminator_val_y_2 -1.29 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 ARG 5.72 -5.56 0 11 THR 0.36 -0.30 1 12 LEU 0.22 -0.39 1 13 THR 0.06 -0.20 1 15 HIS 0.10 0.33 1 16 LYS -0.98 0.59 1 17 THR 1.56 -0.08 1 18 ILE -3.41 2.18 1 19 SER -4.11 2.44 1 20 PHE -3.48 1.69 1 22 SER 0.62 0.50 1 23 LEU -2.03 1.07 1 24 THR -2.14 2.32 1 25 ILE -1.77 1.86 1 26 ASP -5.12 2.37 1 28 VAL 4.76 -1.58 1 29 ASN -0.17 -0.37 1 31 GLN -5.80 3.64 1 32 VAL -1.84 0.93 1 33 LEU -5.37 3.09 1 34 LEU -4.45 2.36 1 37 GLU -3.71 1.42 1 38 ASN 0.69 0.79 1 39 VAL -0.31 -0.18 1 40 ALA 0.59 -0.84 1 41 LEU -5.86 3.78 1 42 SER -1.80 0.73 1 43 THR 5.28 -0.98 1 44 ALA 2.39 -0.32 1 45 ASP 4.91 -1.89 1 46 PHE 5.78 -0.94 1 47 ASP 5.19 -1.60 1 48 LEU 3.64 -0.67 1 49 LEU 4.28 -1.51 1 50 TRP 3.34 -0.56 1 51 GLU 3.08 -0.33 1 52 LEU 3.20 0.00 1 53 ALA 2.59 -0.85 1 54 THR 1.87 -0.58 1 55 HIS 0.29 -0.42 1 56 ALA 1.77 0.26 1 58 GLN -2.76 0.97 1 59 ILE 2.39 -1.04 1 60 MET -2.30 0.02 1 61 ASP -2.28 0.99 1 62 ARG 5.22 -0.70 1 63 ASP 4.22 -1.02 1 64 ALA 2.49 -0.60 1 65 LEU 2.29 -0.38 1 66 LEU 2.29 -0.63 1 67 LYS 3.70 -1.00 1 68 ASN 0.90 0.02 1 69 LEU 0.49 -0.38 1 70 ARG 0.38 -0.14 1 72 VAL -0.58 0.10 1 73 THR 0.34 -0.47 1 74 TYR -0.16 0.02 1 75 ASP -0.20 0.04 1 77 MET 0.44 -0.08 1 78 ASP 1.51 -0.25 1 79 ARG 0.84 -0.90 1 80 SER 1.57 -0.28 1 81 VAL 4.49 -1.16 1 82 ASP 4.14 -0.44 1 83 VAL 4.78 -1.27 1 84 ALA 2.23 0.45 1 85 ILE 5.55 -4.33 1 87 ARG 3.44 0.07 1 88 LEU 2.97 0.07 1 89 ARG 4.46 -0.58 1 90 LYS 3.40 -0.67 1 91 LYS 2.75 -0.65 1 92 LEU 1.19 -3.10 1 93 LEU 5.41 -5.02 1 94 ASP -3.07 1.21 1 96 ALA 1.74 0.26 1 97 THR 2.95 -0.78 1 98 GLU -3.26 0.26 1 100 TYR -2.55 1.49 1 101 ARG 3.35 -1.15 1 103 LYS -0.91 1.27 1 104 THR 1.16 -0.13 1 105 VAL 0.85 -1.64 1 106 ARG 3.52 -1.58 1 107 ASN 2.96 -1.17 1 108 LYS -1.34 2.10 1 110 TYR -5.42 4.43 1 111 LEU -5.65 4.93 1 112 PHE -1.62 0.79 1 113 ALA -3.80 0.48 1 115 HIS 0.51 -0.11 1 116 ALA -3.28 2.74 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18200_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.86 _LACS_plot.Line_1_terminator_val_y_1 0.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 5.78 _LACS_plot.Line_2_terminator_val_y_2 -0.59 _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 53 ALA 2.59 -1.99 0 11 THR 0.36 -0.06 1 12 LEU 0.22 0.07 1 13 THR 0.06 -0.09 1 15 HIS 0.10 -0.06 1 16 LYS -0.98 0.18 1 17 THR 1.56 0.34 1 18 ILE -3.41 0.40 1 19 SER -4.11 0.96 1 20 PHE -3.48 -0.08 1 22 SER 0.62 0.01 1 23 LEU -2.03 1.01 1 24 THR -2.14 0.62 1 25 ILE -1.77 0.45 1 26 ASP -5.12 0.49 1 28 VAL 4.76 -0.53 1 29 ASN -0.17 -0.29 1 30 ARG 5.72 -1.37 1 31 GLN -5.80 0.41 1 32 VAL -1.84 0.50 1 33 LEU -5.37 0.86 1 34 LEU -4.45 1.00 1 37 GLU -3.71 0.27 1 38 ASN 0.69 0.13 1 39 VAL -0.31 0.01 1 40 ALA 0.59 0.13 1 41 LEU -5.86 0.63 1 42 SER -1.80 0.02 1 43 THR 5.28 -0.30 1 44 ALA 2.39 -0.08 1 45 ASP 4.91 -0.32 1 46 PHE 5.78 -0.95 1 47 ASP 5.19 -0.14 1 48 LEU 3.64 -0.26 1 49 LEU 4.28 -0.59 1 50 TRP 3.34 -0.85 1 51 GLU 3.08 -0.50 1 52 LEU 3.20 -0.49 1 54 THR 1.87 -0.72 1 55 HIS 0.29 -0.11 1 56 ALA 1.77 -0.13 1 58 GLN -2.76 0.27 1 59 ILE 2.39 -0.36 1 60 MET -2.30 0.33 1 61 ASP -2.28 0.12 1 62 ARG 5.22 -0.49 1 63 ASP 4.22 -0.28 1 64 ALA 2.49 -0.26 1 65 LEU 2.29 -0.36 1 66 LEU 2.29 -0.36 1 67 LYS 3.70 -0.34 1 68 ASN 0.90 -0.09 1 69 LEU 0.49 0.07 1 70 ARG 0.38 0.04 1 72 VAL -0.58 0.07 1 73 THR 0.34 -0.05 1 74 TYR -0.16 0.06 1 75 ASP -0.20 -0.05 1 77 MET 0.44 -0.04 1 78 ASP 1.51 -0.16 1 79 ARG 0.84 0.06 1 80 SER 1.57 -0.49 1 81 VAL 4.49 -0.47 1 82 ASP 4.14 -0.52 1 83 VAL 4.78 -0.44 1 84 ALA 2.23 -0.36 1 85 ILE 5.55 -0.72 1 87 ARG 3.44 0.05 1 88 LEU 2.97 -0.49 1 89 ARG 4.46 0.06 1 90 LYS 3.40 -0.16 1 91 LYS 2.75 -0.25 1 92 LEU 1.19 0.29 1 93 LEU 5.41 -0.41 1 94 ASP -3.07 -0.31 1 96 ALA 1.74 -0.36 1 97 THR 2.95 -0.17 1 98 GLU -3.26 0.24 1 100 TYR -2.55 0.10 1 101 ARG 3.35 -0.90 1 103 LYS -0.91 -0.20 1 104 THR 1.16 -0.05 1 105 VAL 0.85 -0.05 1 106 ARG 3.52 -0.57 1 107 ASN 2.96 -0.38 1 108 LYS -1.34 0.16 1 110 TYR -5.42 0.89 1 111 LEU -5.65 0.41 1 112 PHE -1.62 0.10 1 113 ALA -3.80 0.32 1 115 HIS 0.51 0.47 1 116 ALA -3.28 0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18200_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.86 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.44 _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 5.78 _LACS_plot.Line_2_terminator_val_y_2 1.82 _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 26 ASP -5.12 1.16 0 92 LEU 1.19 -4.11 0 30 ARG 5.72 -2.10 0 98 GLU -3.26 -5.49 0 11 THR 0.36 -0.23 1 12 LEU 0.22 -0.39 1 13 THR 0.06 -0.38 1 15 HIS 0.10 -0.31 1 16 LYS -0.98 -0.91 1 17 THR 1.56 -0.37 1 18 ILE -3.41 -2.56 1 19 SER -4.11 -2.03 1 20 PHE -3.48 -1.21 1 22 SER 0.62 0.68 1 23 LEU -2.03 -2.29 1 24 THR -2.14 -1.85 1 25 ILE -1.77 -2.86 1 28 VAL 4.76 0.77 1 29 ASN -0.17 -1.20 1 31 GLN -5.80 -1.87 1 32 VAL -1.84 -2.79 1 33 LEU -5.37 -2.40 1 34 LEU -4.45 0.48 1 37 GLU -3.71 -1.25 1 39 VAL -0.31 -1.22 1 40 ALA 0.59 -1.24 1 41 LEU -5.86 -0.09 1 42 SER -1.80 -0.15 1 43 THR 5.28 1.02 1 44 ALA 2.39 2.73 1 45 ASP 4.91 1.86 1 46 PHE 5.78 1.41 1 47 ASP 5.19 2.88 1 48 LEU 3.64 -0.06 1 49 LEU 4.28 -0.11 1 50 TRP 3.34 2.86 1 51 GLU 3.08 2.22 1 52 LEU 3.20 0.61 1 53 ALA 2.59 2.29 1 54 THR 1.87 -0.21 1 55 HIS 0.29 -0.12 1 56 ALA 1.77 1.26 1 58 GLN -2.76 -1.31 1 59 ILE 2.39 -0.24 1 60 MET -2.30 -1.51 1 61 ASP -2.28 -0.13 1 62 ARG 5.22 1.03 1 63 ASP 4.22 1.99 1 64 ALA 2.49 2.59 1 65 LEU 2.29 0.75 1 66 LEU 2.29 1.46 1 67 LYS 3.70 1.45 1 68 ASN 0.90 0.42 1 69 LEU 0.49 -0.45 1 70 ARG 0.38 0.76 1 72 VAL -0.58 -0.39 1 73 THR 0.34 -0.52 1 74 TYR -0.16 -0.28 1 75 ASP -0.20 0.25 1 77 MET 0.44 -0.03 1 78 ASP 1.51 0.55 1 79 ARG 0.84 0.06 1 80 SER 1.57 1.71 1 81 VAL 4.49 -0.15 1 82 ASP 4.14 2.69 1 83 VAL 4.78 2.35 1 84 ALA 2.23 1.79 1 85 ILE 5.55 1.93 1 87 ARG 3.44 2.73 1 88 LEU 2.97 1.22 1 89 ARG 4.46 1.66 1 90 LYS 3.40 4.20 1 91 LYS 2.75 0.08 1 93 LEU 5.41 -1.58 1 94 ASP -3.07 0.29 1 96 ALA 1.74 1.15 1 97 THR 2.95 0.09 1 100 TYR -2.55 -3.02 1 101 ARG 3.35 -1.02 1 103 LYS -0.91 0.19 1 104 THR 1.16 -0.60 1 105 VAL 0.85 -1.27 1 106 ARG 3.52 -0.53 1 107 ASN 2.96 -0.41 1 108 LYS -1.34 -1.04 1 110 TYR -5.42 -2.44 1 111 LEU -5.65 -3.99 1 112 PHE -1.62 -2.39 1 113 ALA -3.80 -1.59 1 115 HIS 0.51 0.62 1 116 ALA -3.28 -1.85 1 stop_ save_