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 bmr6538_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 -2.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 5.40 _LACS_plot.Line_2_terminator_val_y_2 3.83 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 PHE 1.89 -2.32 0 107 ILE -1.58 -4.42 0 10 VAL -2.92 -1.77 1 12 VAL -3.90 -1.89 1 13 SER 1.67 1.11 1 15 LYS -1.83 -1.17 1 17 VAL -3.85 -1.48 1 18 GLN -3.00 -0.99 1 19 LEU 0.65 -2.16 1 20 ARG -3.88 -1.76 1 22 SER -3.53 -1.55 1 23 ASN 2.66 1.13 1 24 ILE -4.25 -1.60 1 25 GLN -2.25 -0.86 1 26 THR -0.67 -0.68 1 27 LYS -0.92 -0.59 1 28 ASP 3.16 1.29 1 29 VAL -6.03 -3.39 1 30 SER -2.69 -1.50 1 31 VAL -5.21 -2.29 1 32 GLN -5.73 -0.62 1 33 TRP -4.96 -0.74 1 34 LYS -6.64 -1.34 1 35 LYS -4.96 -1.91 1 36 THR 1.56 0.42 1 37 GLU -1.26 -0.20 1 38 GLN 2.43 1.75 1 40 SER -2.38 -1.51 1 41 HIS 1.16 1.62 1 42 ARG 0.25 0.69 1 43 LYS -1.51 -0.78 1 44 ILE -2.48 -1.28 1 45 GLU 0.58 1.15 1 46 ILE 0.92 2.04 1 47 LEU -3.47 -0.92 1 48 ASN -4.73 -1.08 1 49 TRP -2.40 -0.61 1 50 TYR -1.61 -1.11 1 51 ASN 1.69 1.31 1 52 ASP 1.25 0.60 1 55 SER -1.79 -1.66 1 56 TRP -2.40 -0.64 1 57 SER 3.52 2.92 1 58 ASN -3.09 -1.41 1 59 VAL 4.24 3.02 1 60 SER 2.80 2.23 1 61 PHE 1.42 -0.97 1 62 SER 3.55 1.85 1 63 ASP 0.45 1.09 1 64 ILE -1.18 1.02 1 65 TYR -6.17 -2.50 1 67 PHE -5.45 -1.48 1 68 ASP -4.48 -2.05 1 69 TYR 2.23 0.80 1 71 ASP -2.27 -2.45 1 73 ALA 0.42 1.08 1 74 LEU -2.60 -2.26 1 75 SER -3.29 -2.22 1 76 ILE -0.08 0.20 1 77 LYS 5.07 4.52 1 78 SER 0.53 -1.38 1 79 ALA 0.91 1.05 1 80 LYS -5.33 -2.47 1 81 LEU 5.40 4.14 1 82 GLN 3.98 2.18 1 83 ASP 1.74 1.90 1 84 SER 1.99 2.34 1 86 HIS -3.58 0.42 1 87 TYR -4.58 -0.80 1 88 LEU -5.72 -1.32 1 89 LEU -1.13 -2.32 1 90 GLU -4.66 -1.84 1 91 ILE 1.04 0.12 1 93 ASN -5.41 -0.61 1 94 THR 3.38 3.24 1 98 VAL -0.03 1.03 1 100 ASN -3.22 -0.98 1 101 LYS -2.06 -3.34 1 102 ASN -3.29 0.20 1 103 PHE -4.92 -1.07 1 104 GLN -0.73 -1.09 1 105 LEU -3.61 -1.48 1 106 LEU -3.46 -0.98 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6538_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 4.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.58 _LACS_plot.Line_2_terminator_val_x_2 5.40 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 PHE 1.89 -4.21 0 107 ILE -1.58 -2.84 0 10 VAL -2.92 1.15 1 12 VAL -3.90 2.01 1 13 SER 1.67 -0.56 1 15 LYS -1.83 0.66 1 17 VAL -3.85 2.37 1 18 GLN -3.00 2.01 1 19 LEU 0.65 -2.81 1 20 ARG -3.88 2.12 1 22 SER -3.53 1.98 1 23 ASN 2.66 -1.53 1 24 ILE -4.25 2.65 1 25 GLN -2.25 1.39 1 26 THR -0.67 -0.01 1 27 LYS -0.92 0.33 1 28 ASP 3.16 -1.87 1 29 VAL -6.03 2.64 1 30 SER -2.69 1.19 1 31 VAL -5.21 2.92 1 32 GLN -5.73 5.11 1 33 TRP -4.96 4.22 1 34 LYS -6.64 5.30 1 35 LYS -4.96 3.05 1 36 THR 1.56 -1.14 1 37 GLU -1.26 1.06 1 38 GLN 2.43 -0.68 1 40 SER -2.38 0.87 1 41 HIS 1.16 0.46 1 42 ARG 0.25 0.44 1 43 LYS -1.51 0.73 1 44 ILE -2.48 1.20 1 45 GLU 0.58 0.57 1 46 ILE 0.92 1.12 1 47 LEU -3.47 2.55 1 48 ASN -4.73 3.65 1 49 TRP -2.40 1.79 1 50 TYR -1.61 0.50 1 51 ASN 1.69 -0.38 1 52 ASP 1.25 -0.65 1 55 SER -1.79 0.13 1 56 TRP -2.40 1.76 1 57 SER 3.52 -0.60 1 58 ASN -3.09 1.68 1 59 VAL 4.24 -1.22 1 60 SER 2.80 -0.57 1 61 PHE 1.42 -2.39 1 62 SER 3.55 -1.70 1 63 ASP 0.45 0.64 1 64 ILE -1.18 2.20 1 65 TYR -6.17 3.67 1 67 PHE -5.45 3.97 1 68 ASP -4.48 2.43 1 69 TYR 2.23 -1.43 1 71 ASP -2.27 -0.18 1 73 ALA 0.42 0.66 1 74 LEU -2.60 0.34 1 75 SER -3.29 1.07 1 76 ILE -0.08 0.28 1 77 LYS 5.07 -0.55 1 78 SER 0.53 -1.91 1 79 ALA 0.91 0.14 1 80 LYS -5.33 2.86 1 81 LEU 5.40 -1.26 1 82 GLN 3.98 -1.80 1 83 ASP 1.74 0.16 1 84 SER 1.99 0.35 1 86 HIS -3.58 4.00 1 87 TYR -4.58 3.78 1 88 LEU -5.72 4.40 1 89 LEU -1.13 -1.19 1 90 GLU -4.66 2.82 1 91 ILE 1.04 -0.92 1 93 ASN -5.41 4.80 1 94 THR 3.38 -0.14 1 98 VAL -0.03 1.06 1 100 ASN -3.22 2.24 1 101 LYS -2.06 -1.28 1 102 ASN -3.29 3.49 1 103 PHE -4.92 3.85 1 104 GLN -0.73 -0.36 1 105 LEU -3.61 2.13 1 106 LEU -3.46 2.48 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6538_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 0.84 _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 0.26 _LACS_plot.Line_2_terminator_val_x_2 5.40 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 ASN -5.41 -0.15 0 71 ASP -2.27 -0.66 0 62 SER 3.55 -1.31 0 10 VAL -2.92 1.17 1 12 VAL -3.90 0.63 1 13 SER 1.67 -0.71 1 15 LYS -1.83 0.36 1 17 VAL -3.85 0.19 1 18 GLN -3.00 0.38 1 19 LEU 0.65 -0.31 1 20 ARG -3.88 0.12 1 22 SER -3.53 0.15 1 23 ASN 2.66 -0.44 1 24 ILE -4.25 0.47 1 25 GLN -2.25 0.16 1 26 THR -0.67 0.19 1 27 LYS -0.92 0.23 1 28 ASP 3.16 -0.24 1 29 VAL -6.03 0.94 1 30 SER -2.69 -0.04 1 31 VAL -5.21 0.76 1 32 GLN -5.73 0.71 1 33 TRP -4.96 1.07 1 34 LYS -6.64 0.97 1 35 LYS -4.96 0.72 1 36 THR 1.56 0.30 1 37 GLU -1.26 -0.09 1 38 GLN 2.43 -0.24 1 40 SER -2.38 0.03 1 41 HIS 1.16 -0.18 1 42 ARG 0.25 -0.11 1 43 LYS -1.51 0.48 1 44 ILE -2.48 0.14 1 45 GLU 0.58 -0.12 1 46 ILE 0.92 0.37 1 47 LEU -3.47 0.61 1 48 ASN -4.73 0.56 1 49 TRP -2.40 0.05 1 50 TYR -1.61 -0.08 1 51 ASN 1.69 -0.57 1 52 ASP 1.25 -0.17 1 55 SER -1.79 0.16 1 56 TRP -2.40 0.29 1 57 SER 3.52 -0.28 1 58 ASN -3.09 -0.06 1 59 VAL 4.24 -0.21 1 60 SER 2.80 -0.14 1 61 PHE 1.42 -0.07 1 63 ASP 0.45 -0.01 1 64 ILE -1.18 -0.37 1 65 TYR -6.17 1.07 1 67 PHE -5.45 0.84 1 68 ASP -4.48 -0.11 1 69 TYR 2.23 -0.76 1 72 PHE 1.89 -0.29 1 73 ALA 0.42 0.22 1 74 LEU -2.60 0.49 1 75 SER -3.29 0.69 1 76 ILE -0.08 0.01 1 77 LYS 5.07 -0.60 1 78 SER 0.53 -0.87 1 79 ALA 0.91 -0.20 1 80 LYS -5.33 0.44 1 81 LEU 5.40 -0.54 1 82 GLN 3.98 -0.09 1 83 ASP 1.74 -0.03 1 84 SER 1.99 -0.19 1 86 HIS -3.58 0.81 1 87 TYR -4.58 0.52 1 88 LEU -5.72 0.80 1 89 LEU -1.13 0.05 1 90 GLU -4.66 0.43 1 91 ILE 1.04 0.61 1 94 THR 3.38 -0.33 1 98 VAL -0.03 0.43 1 100 ASN -3.22 0.71 1 101 LYS -2.06 0.48 1 102 ASN -3.29 0.73 1 103 PHE -4.92 0.78 1 104 GLN -0.73 0.65 1 105 LEU -3.61 1.02 1 106 LEU -3.46 0.40 1 107 ILE -1.58 0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6538_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 -2.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.14 _LACS_plot.Line_2_terminator_val_x_2 5.40 _LACS_plot.Line_2_terminator_val_y_2 0.56 _LACS_plot.Y_axis_chem_shift_offset 0.68 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 88 LEU -5.72 -5.15 0 81 LEU 5.40 2.88 0 56 TRP -2.40 2.59 0 19 LEU 0.65 -4.26 0 10 VAL -2.92 -0.11 1 12 VAL -3.90 -0.76 1 13 SER 1.67 1.07 1 17 VAL -3.85 -3.43 1 18 GLN -3.00 -2.36 1 22 SER -3.53 -1.41 1 23 ASN 2.66 -0.65 1 25 GLN -2.25 -1.27 1 26 THR -0.67 -0.03 1 27 LYS -0.92 -1.27 1 28 ASP 3.16 -1.22 1 29 VAL -6.03 -1.49 1 30 SER -2.69 -1.50 1 31 VAL -5.21 -2.01 1 32 GLN -5.73 -1.22 1 33 TRP -4.96 0.82 1 34 LYS -6.64 -2.71 1 35 LYS -4.96 -1.55 1 36 THR 1.56 0.22 1 37 GLU -1.26 -0.50 1 40 SER -2.38 -0.97 1 41 HIS 1.16 1.17 1 42 ARG 0.25 -0.96 1 43 LYS -1.51 -0.39 1 44 ILE -2.48 -0.44 1 45 GLU 0.58 -0.60 1 46 ILE 0.92 -1.15 1 47 LEU -3.47 -3.37 1 48 ASN -4.73 -2.29 1 49 TRP -2.40 -2.20 1 50 TYR -1.61 -1.38 1 51 ASN 1.69 -0.94 1 52 ASP 1.25 -0.91 1 55 SER -1.79 -0.19 1 57 SER 3.52 -1.11 1 58 ASN -3.09 0.87 1 59 VAL 4.24 1.23 1 60 SER 2.80 2.34 1 61 PHE 1.42 1.09 1 62 SER 3.55 -0.34 1 63 ASP 0.45 0.03 1 64 ILE -1.18 -0.93 1 65 TYR -6.17 -1.25 1 67 PHE -5.45 -2.97 1 68 ASP -4.48 -1.53 1 69 TYR 2.23 -0.58 1 71 ASP -2.27 -2.38 1 72 PHE 1.89 -0.99 1 73 ALA 0.42 -0.30 1 74 LEU -2.60 -2.29 1 75 SER -3.29 -0.95 1 76 ILE -0.08 -0.45 1 77 LYS 5.07 0.54 1 78 SER 0.53 -1.33 1 79 ALA 0.91 -0.84 1 80 LYS -5.33 1.00 1 82 GLN 3.98 0.03 1 83 ASP 1.74 1.09 1 84 SER 1.99 -1.82 1 86 HIS -3.58 0.50 1 87 TYR -4.58 -2.56 1 89 LEU -1.13 -3.40 1 90 GLU -4.66 -0.44 1 91 ILE 1.04 -0.06 1 98 VAL -0.03 -0.75 1 100 ASN -3.22 -1.19 1 101 LYS -2.06 -2.60 1 102 ASN -3.29 0.09 1 103 PHE -4.92 -1.51 1 104 GLN -0.73 -2.11 1 105 LEU -3.61 -2.00 1 106 LEU -3.46 -4.25 1 107 ILE -1.58 -1.87 1 stop_ save_