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 bmr11425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.30 _LACS_plot.Line_1_terminator_val_y_1 -5.67 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.05 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 3.74 _LACS_plot.Y_axis_chem_shift_offset 2.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ASP 2.16 -4.79 0 10 ILE -1.80 -3.95 1 11 SER -6.30 -5.79 1 12 PHE -3.75 -4.44 1 13 ASP -0.61 -3.65 1 14 ILE -0.27 -2.18 1 17 GLN -5.64 -5.44 1 18 GLU -0.75 -3.39 1 19 ILE -5.57 -4.52 1 20 LEU -3.55 -4.78 1 21 THR 0.21 -2.27 1 22 LYS 4.25 0.51 1 25 VAL -0.26 -3.49 1 26 THR 2.62 -1.26 1 27 ILE -5.43 -4.85 1 28 SER -2.37 -4.50 1 29 VAL -4.24 -4.34 1 30 ASP -4.00 -5.00 1 32 VAL -4.16 -3.62 1 33 VAL -2.35 -4.28 1 34 TYR -2.70 -4.69 1 35 TYR -5.52 -4.74 1 36 ARG -5.36 -4.57 1 37 VAL 2.22 -1.54 1 38 GLN -0.21 -2.15 1 39 ASN -0.71 -3.18 1 40 ALA 2.07 -0.82 1 41 THR 3.60 -0.05 1 42 LEU 1.50 -1.49 1 43 ALA 1.74 -1.12 1 44 VAL 1.89 -1.55 1 45 ALA 0.94 -1.72 1 46 ASN 0.06 -2.15 1 47 ILE 0.33 -2.34 1 48 THR 2.85 -0.83 1 49 ASN 0.76 -2.13 1 50 ALA 3.13 -0.14 1 51 ASP 3.17 0.98 1 52 SER 4.47 0.42 1 53 ALA 3.94 -0.20 1 55 ARG 5.42 1.24 1 56 LEU 3.92 0.15 1 57 LEU 1.39 -1.63 1 58 ALA 4.12 0.76 1 59 GLN 4.67 1.48 1 60 THR 5.15 1.65 1 61 THR 8.39 3.40 1 62 LEU 3.97 1.20 1 63 ARG 4.86 1.48 1 64 ASN 3.54 -0.18 1 65 VAL 4.87 0.99 1 66 LEU 5.56 0.65 1 68 THR -0.74 -3.05 1 69 LYS -5.31 -6.18 1 70 ASN -0.64 -3.18 1 71 LEU 5.53 1.58 1 73 GLN 1.37 -0.42 1 74 ILE 5.09 1.57 1 75 LEU 2.70 -0.93 1 76 SER 1.66 -0.61 1 77 ASP 0.04 -3.35 1 78 ARG 4.88 1.92 1 79 GLU 4.30 0.69 1 80 GLU 3.13 -0.16 1 81 ILE 4.80 1.22 1 82 ALA 4.59 0.60 1 83 HIS 4.16 1.02 1 84 ASN 3.50 0.53 1 85 MET 4.20 0.91 1 86 GLN 7.33 2.13 1 87 SER 4.49 0.65 1 88 THR 5.40 1.77 1 89 LEU 2.39 -0.26 1 90 ASP 3.44 0.70 1 91 ASP 3.82 0.40 1 92 ALA 0.94 -1.15 1 93 THR 0.45 -2.13 1 94 ASP 4.78 1.05 1 95 ALA 2.68 -1.17 1 96 TRP -2.26 -5.59 1 98 ILE -5.14 -4.56 1 99 LYS -3.83 -6.23 1 100 VAL -2.24 -4.39 1 101 GLU -1.53 -2.22 1 102 ARG -2.52 -2.61 1 103 VAL -2.99 -3.79 1 104 GLU -5.38 -4.95 1 105 ILE 0.84 -2.75 1 106 LYS 1.57 -1.97 1 107 ASP 0.20 -1.23 1 108 VAL -0.48 -3.13 1 109 LYS -3.21 -4.54 1 110 LEU 0.03 -3.07 1 112 VAL 0.68 -2.32 1 113 GLN 0.19 -1.26 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.30 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -3.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.05 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 -4.65 _LACS_plot.Y_axis_chem_shift_offset 2.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ASP 2.16 -6.95 0 10 ILE -1.80 -2.15 1 11 SER -6.30 0.51 1 12 PHE -3.75 -0.69 1 13 ASP -0.61 -3.04 1 14 ILE -0.27 -1.91 1 17 GLN -5.64 0.20 1 18 GLU -0.75 -2.64 1 19 ILE -5.57 1.05 1 20 LEU -3.55 -1.23 1 21 THR 0.21 -2.48 1 22 LYS 4.25 -3.74 1 25 VAL -0.26 -3.23 1 26 THR 2.62 -3.88 1 27 ILE -5.43 0.58 1 28 SER -2.37 -2.13 1 29 VAL -4.24 -0.10 1 30 ASP -4.00 -1.00 1 32 VAL -4.16 0.54 1 33 VAL -2.35 -1.93 1 34 TYR -2.70 -1.99 1 35 TYR -5.52 0.78 1 36 ARG -5.36 0.79 1 37 VAL 2.22 -3.76 1 38 GLN -0.21 -1.94 1 39 ASN -0.71 -2.47 1 40 ALA 2.07 -2.89 1 41 THR 3.60 -3.65 1 42 LEU 1.50 -2.99 1 43 ALA 1.74 -2.86 1 44 VAL 1.89 -3.44 1 45 ALA 0.94 -2.66 1 46 ASN 0.06 -2.21 1 47 ILE 0.33 -2.67 1 48 THR 2.85 -3.68 1 49 ASN 0.76 -2.89 1 50 ALA 3.13 -3.27 1 51 ASP 3.17 -2.19 1 52 SER 4.47 -4.05 1 53 ALA 3.94 -4.14 1 55 ARG 5.42 -4.18 1 56 LEU 3.92 -3.77 1 57 LEU 1.39 -3.02 1 58 ALA 4.12 -3.36 1 59 GLN 4.67 -3.19 1 60 THR 5.15 -3.50 1 61 THR 8.39 -4.99 1 62 LEU 3.97 -2.77 1 63 ARG 4.86 -3.38 1 64 ASN 3.54 -3.72 1 65 VAL 4.87 -3.88 1 66 LEU 5.56 -4.91 1 68 THR -0.74 -2.31 1 69 LYS -5.31 -0.87 1 70 ASN -0.64 -2.54 1 71 LEU 5.53 -3.95 1 73 GLN 1.37 -1.79 1 74 ILE 5.09 -3.52 1 75 LEU 2.70 -3.63 1 76 SER 1.66 -2.27 1 77 ASP 0.04 -3.39 1 78 ARG 4.88 -2.96 1 79 GLU 4.30 -3.61 1 80 GLU 3.13 -3.29 1 81 ILE 4.80 -3.58 1 82 ALA 4.59 -3.99 1 83 HIS 4.16 -3.14 1 84 ASN 3.50 -2.97 1 85 MET 4.20 -3.29 1 86 GLN 7.33 -5.20 1 87 SER 4.49 -3.84 1 88 THR 5.40 -3.63 1 89 LEU 2.39 -2.65 1 90 ASP 3.44 -2.74 1 91 ASP 3.82 -3.42 1 92 ALA 0.94 -2.09 1 93 THR 0.45 -2.58 1 94 ASP 4.78 -3.73 1 95 ALA 2.68 -3.85 1 96 TRP -2.26 -3.33 1 98 ILE -5.14 0.58 1 99 LYS -3.83 -2.40 1 100 VAL -2.24 -2.15 1 101 GLU -1.53 -0.69 1 102 ARG -2.52 -0.09 1 103 VAL -2.99 -0.80 1 104 GLU -5.38 0.43 1 105 ILE 0.84 -3.59 1 106 LYS 1.57 -3.54 1 107 ASP 0.20 -1.43 1 108 VAL -0.48 -2.65 1 109 LYS -3.21 -1.33 1 110 LEU 0.03 -3.10 1 112 VAL 0.68 -3.00 1 113 GLN 0.19 -1.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.30 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 -0.86 _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 93 THR 0.45 -1.11 0 10 ILE -1.80 -0.16 1 11 SER -6.30 1.03 1 12 PHE -3.75 0.14 1 13 ASP -0.61 0.27 1 14 ILE -0.27 -0.18 1 17 GLN -5.64 0.03 1 18 GLU -0.75 0.51 1 19 ILE -5.57 0.05 1 20 LEU -3.55 0.60 1 21 THR 0.21 0.30 1 22 LYS 4.25 -0.41 1 23 ASP 2.16 -0.09 1 25 VAL -0.26 0.49 1 26 THR 2.62 0.46 1 27 ILE -5.43 0.75 1 28 SER -2.37 0.90 1 29 VAL -4.24 0.88 1 30 ASP -4.00 0.08 1 32 VAL -4.16 0.58 1 33 VAL -2.35 0.25 1 34 TYR -2.70 0.63 1 35 TYR -5.52 0.95 1 36 ARG -5.36 0.47 1 37 VAL 2.22 -0.02 1 38 GLN -0.21 0.05 1 39 ASN -0.71 -0.02 1 40 ALA 2.07 -0.34 1 41 THR 3.60 -0.35 1 42 LEU 1.50 -0.01 1 43 ALA 1.74 -0.03 1 44 VAL 1.89 -0.15 1 45 ALA 0.94 -0.15 1 46 ASN 0.06 -0.10 1 47 ILE 0.33 -0.14 1 48 THR 2.85 -0.34 1 49 ASN 0.76 -0.29 1 50 ALA 3.13 -0.91 1 51 ASP 3.17 -0.63 1 52 SER 4.47 0.21 1 53 ALA 3.94 -0.57 1 55 ARG 5.42 -0.85 1 56 LEU 3.92 -0.37 1 57 LEU 1.39 -0.26 1 58 ALA 4.12 -0.44 1 59 GLN 4.67 -0.65 1 60 THR 5.15 -0.60 1 61 THR 8.39 -0.32 1 62 LEU 3.97 -0.37 1 63 ARG 4.86 -0.64 1 64 ASN 3.54 -0.42 1 65 VAL 4.87 -0.40 1 66 LEU 5.56 -0.49 1 68 THR -0.74 0.02 1 69 LYS -5.31 0.27 1 70 ASN -0.64 0.10 1 71 LEU 5.53 -0.41 1 73 GLN 1.37 -0.22 1 74 ILE 5.09 -0.92 1 75 LEU 2.70 -0.33 1 76 SER 1.66 -0.87 1 77 ASP 0.04 0.45 1 78 ARG 4.88 -0.64 1 79 GLU 4.30 -0.34 1 80 GLU 3.13 -0.30 1 81 ILE 4.80 -0.61 1 82 ALA 4.59 -0.56 1 83 HIS 4.16 -0.31 1 84 ASN 3.50 -0.39 1 85 MET 4.20 -0.60 1 86 GLN 7.33 -0.84 1 87 SER 4.49 -0.48 1 88 THR 5.40 -0.45 1 89 LEU 2.39 -0.38 1 90 ASP 3.44 -0.32 1 91 ASP 3.82 -0.49 1 92 ALA 0.94 -0.36 1 94 ASP 4.78 -0.27 1 95 ALA 2.68 -0.32 1 96 TRP -2.26 0.09 1 98 ILE -5.14 0.43 1 99 LYS -3.83 0.45 1 100 VAL -2.24 0.25 1 101 GLU -1.53 -0.11 1 102 ARG -2.52 0.04 1 103 VAL -2.99 0.57 1 104 GLU -5.38 0.24 1 105 ILE 0.84 -0.09 1 106 LYS 1.57 -0.18 1 107 ASP 0.20 -0.13 1 108 VAL -0.48 0.09 1 109 LYS -3.21 0.12 1 112 VAL 0.68 -0.18 1 113 GLN 0.19 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.30 _LACS_plot.Line_1_terminator_val_y_1 -5.10 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.49 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 0.34 _LACS_plot.Y_axis_chem_shift_offset 2.72 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 THR 8.39 -2.40 0 113 GLN 0.19 1.59 0 10 ILE -1.80 -5.60 1 11 SER -6.30 -2.90 1 12 PHE -3.75 -6.30 1 13 ASP -0.61 -2.70 1 14 ILE -0.27 -3.60 1 17 GLN -5.64 -4.40 1 18 GLU -0.75 -3.40 1 19 ILE -5.57 -6.50 1 20 LEU -3.55 -2.60 1 21 THR 0.21 -1.00 1 22 LYS 4.25 -2.30 1 23 ASP 2.16 -5.10 1 25 VAL -0.26 -3.33 1 26 THR 2.62 -3.53 1 27 ILE -5.43 -5.00 1 28 SER -2.37 -2.70 1 29 VAL -4.24 -5.50 1 30 ASP -4.00 -4.20 1 32 VAL -4.16 -6.00 1 34 TYR -2.70 -2.90 1 35 TYR -5.52 -3.50 1 36 ARG -5.36 -3.90 1 37 VAL 2.22 -3.60 1 38 GLN -0.21 -3.29 1 39 ASN -0.71 -3.30 1 40 ALA 2.07 -2.00 1 41 THR 3.60 -1.60 1 42 LEU 1.50 -2.40 1 43 ALA 1.74 -1.80 1 44 VAL 1.89 -2.20 1 45 ALA 0.94 -2.40 1 46 ASN 0.06 -2.60 1 47 ILE 0.33 -3.20 1 48 THR 2.85 -2.50 1 49 ASN 0.76 -2.10 1 50 ALA 3.13 -1.18 1 51 ASP 3.17 -1.69 1 52 SER 4.47 -0.81 1 53 ALA 3.94 -0.01 1 55 ARG 5.42 0.30 1 56 LEU 3.92 -0.70 1 57 LEU 1.39 0.50 1 58 ALA 4.12 -2.40 1 59 GLN 4.67 -1.10 1 60 THR 5.15 -1.30 1 62 LEU 3.97 -2.60 1 63 ARG 4.86 0.10 1 64 ASN 3.54 0.60 1 65 VAL 4.87 0.60 1 66 LEU 5.56 -2.50 1 68 THR -0.74 -3.40 1 69 LYS -5.31 -3.20 1 70 ASN -0.64 -0.60 1 71 LEU 5.53 -2.40 1 73 GLN 1.37 -1.20 1 74 ILE 5.09 -2.90 1 75 LEU 2.70 -0.30 1 76 SER 1.66 -1.50 1 77 ASP 0.04 -2.97 1 78 ARG 4.88 -1.40 1 79 GLU 4.30 -0.50 1 80 GLU 3.13 -0.10 1 81 ILE 4.80 -0.65 1 82 ALA 4.59 -0.72 1 83 HIS 4.16 0.50 1 84 ASN 3.50 0.24 1 85 MET 4.20 -1.90 1 86 GLN 7.33 -1.70 1 87 SER 4.49 -0.50 1 88 THR 5.40 0.00 1 89 LEU 2.39 -0.70 1 90 ASP 3.44 -0.40 1 91 ASP 3.82 -0.90 1 92 ALA 0.94 -2.00 1 93 THR 0.45 -0.10 1 94 ASP 4.78 0.20 1 95 ALA 2.68 -3.00 1 96 TRP -2.26 -3.60 1 98 ILE -5.14 -5.10 1 102 ARG -2.52 -6.20 1 103 VAL -2.99 -5.40 1 104 GLU -5.38 -3.90 1 105 ILE 0.84 -3.60 1 108 VAL -0.48 -4.40 1 112 VAL 0.68 -3.55 1 stop_ save_