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 bmr17369_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.66 _LACS_plot.Line_1_terminator_val_y_1 -2.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.81 _LACS_plot.Line_2_terminator_val_x_2 5.85 _LACS_plot.Line_2_terminator_val_y_2 4.27 _LACS_plot.Y_axis_chem_shift_offset -0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 106 LEU 3.58 -0.59 0 10 HIS -0.47 0.38 1 11 MET 0.18 -1.32 1 12 GLU 3.02 2.55 1 13 TRP -5.75 -4.03 1 14 TYR 1.06 0.95 1 15 PHE -0.97 -0.40 1 17 LYS 2.75 0.79 1 18 LEU -2.54 -0.29 1 20 ARG 4.42 4.73 1 21 LYS 5.22 3.42 1 22 ASP 3.45 3.10 1 23 ALA 3.57 2.83 1 24 GLU 5.55 4.09 1 25 ARG 4.31 3.39 1 26 GLN 4.23 3.37 1 27 LEU 1.91 2.84 1 28 LEU 3.02 0.49 1 29 SER 1.20 1.42 1 30 PHE 2.76 2.28 1 32 ASN -0.94 -1.02 1 34 ARG 3.75 2.82 1 36 THR 4.88 2.76 1 37 PHE -7.66 -2.41 1 38 LEU -3.72 -0.43 1 39 ILE -1.92 -0.63 1 40 ARG -7.12 -3.58 1 41 GLU 1.34 1.77 1 42 SER -1.11 -1.10 1 43 GLU 0.76 1.75 1 44 THR 1.36 2.04 1 45 THR -0.83 -0.49 1 46 LYS 2.90 1.46 1 48 ALA -3.74 -2.74 1 49 TYR -4.46 -0.87 1 50 SER -2.68 -1.22 1 51 LEU -3.14 -1.52 1 52 SER -1.12 0.27 1 53 ILE -6.53 -1.28 1 54 ARG -0.38 0.45 1 55 ASP -6.44 -2.32 1 56 TRP -3.12 0.35 1 57 ASP -2.93 -0.63 1 58 ASP 1.82 1.40 1 59 MET 0.71 1.38 1 60 LYS -0.29 0.19 1 62 ASP 0.81 1.34 1 63 HIS 0.25 0.84 1 64 VAL -3.72 -1.93 1 65 LYS -6.14 -0.97 1 66 HIS -6.09 -0.69 1 67 TYR -3.98 -1.02 1 68 LYS 0.80 0.40 1 69 ILE -1.47 -0.87 1 70 ARG -4.11 -1.85 1 71 LYS -4.19 -2.02 1 72 LEU -1.39 -0.72 1 73 ASP 3.61 2.69 1 74 ASN 0.77 -0.16 1 77 TYR -3.42 -0.25 1 78 TYR -2.40 0.02 1 79 ILE 0.68 2.15 1 80 THR -3.93 -3.83 1 81 THR 4.61 3.23 1 82 ARG 1.63 0.99 1 83 ALA -1.13 -0.66 1 84 GLN -4.18 -2.33 1 85 PHE -5.08 -0.56 1 86 GLU 2.14 2.97 1 87 THR -6.76 -3.45 1 88 LEU 2.49 2.02 1 89 GLN 5.69 4.23 1 90 GLN 2.99 3.12 1 91 LEU 4.74 4.02 1 92 VAL 5.86 4.18 1 93 GLN 4.67 3.41 1 94 HIS 3.54 5.38 1 95 TYR 3.51 2.28 1 96 SER 2.15 1.54 1 97 GLU 0.51 1.10 1 98 ARG -2.63 -1.69 1 99 ALA 3.93 2.80 1 100 ALA 0.34 -0.11 1 102 LEU -1.32 -0.15 1 105 ARG -0.45 0.02 1 107 VAL 1.46 2.66 1 108 VAL -4.34 -1.81 1 111 HIS 1.16 1.49 1 112 LYS 1.54 2.04 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17369_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.66 _LACS_plot.Line_1_terminator_val_y_1 4.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.19 _LACS_plot.Line_2_terminator_val_x_2 5.85 _LACS_plot.Line_2_terminator_val_y_2 -1.58 _LACS_plot.Y_axis_chem_shift_offset -0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 106 LEU 3.58 -4.17 0 10 HIS -0.47 0.85 1 11 MET 0.18 -1.50 1 12 GLU 3.02 -0.47 1 13 TRP -5.75 1.72 1 14 TYR 1.06 -0.11 1 15 PHE -0.97 0.57 1 17 LYS 2.75 -1.96 1 18 LEU -2.54 2.25 1 20 ARG 4.42 0.31 1 21 LYS 5.22 -1.80 1 22 ASP 3.45 -0.35 1 23 ALA 3.57 -0.74 1 24 GLU 5.55 -1.46 1 25 ARG 4.31 -0.92 1 26 GLN 4.23 -0.86 1 27 LEU 1.91 0.93 1 28 LEU 3.02 -2.53 1 29 SER 1.20 0.22 1 30 PHE 2.76 -0.48 1 32 ASN -0.94 -0.08 1 34 ARG 3.75 -0.93 1 36 THR 4.88 -2.12 1 37 PHE -7.66 5.25 1 38 LEU -3.72 3.29 1 39 ILE -1.92 1.29 1 40 ARG -7.12 3.54 1 41 GLU 1.34 0.43 1 42 SER -1.11 0.01 1 43 GLU 0.76 0.99 1 44 THR 1.36 0.68 1 45 THR -0.83 0.34 1 46 LYS 2.90 -1.44 1 48 ALA -3.74 1.00 1 49 TYR -4.46 3.59 1 50 SER -2.68 1.46 1 51 LEU -3.14 1.62 1 52 SER -1.12 1.39 1 53 ILE -6.53 5.25 1 54 ARG -0.38 0.83 1 55 ASP -6.44 4.12 1 56 TRP -3.12 3.47 1 57 ASP -2.93 2.30 1 58 ASP 1.82 -0.42 1 59 MET 0.71 0.67 1 60 LYS -0.29 0.48 1 62 ASP 0.81 0.53 1 63 HIS 0.25 0.59 1 64 VAL -3.72 1.79 1 65 LYS -6.14 5.17 1 66 HIS -6.09 5.40 1 67 TYR -3.98 2.96 1 68 LYS 0.80 -0.40 1 69 ILE -1.47 0.60 1 70 ARG -4.11 2.26 1 71 LYS -4.19 2.17 1 72 LEU -1.39 0.67 1 73 ASP 3.61 -0.92 1 74 ASN 0.77 -0.93 1 77 TYR -3.42 3.17 1 78 TYR -2.40 2.42 1 79 ILE 0.68 1.47 1 80 THR -3.93 0.10 1 81 THR 4.61 -1.38 1 82 ARG 1.63 -0.64 1 83 ALA -1.13 0.47 1 84 GLN -4.18 1.85 1 85 PHE -5.08 4.52 1 86 GLU 2.14 0.83 1 87 THR -6.76 3.31 1 88 LEU 2.49 -0.47 1 89 GLN 5.69 -1.46 1 90 GLN 2.99 0.13 1 91 LEU 4.74 -0.72 1 92 VAL 5.86 -1.68 1 93 GLN 4.67 -1.26 1 94 HIS 3.54 1.84 1 95 TYR 3.51 -1.23 1 96 SER 2.15 -0.61 1 97 GLU 0.51 0.59 1 98 ARG -2.63 0.94 1 99 ALA 3.93 -1.13 1 100 ALA 0.34 -0.45 1 102 LEU -1.32 1.17 1 105 ARG -0.45 0.47 1 107 VAL 1.46 1.20 1 108 VAL -4.34 2.53 1 111 HIS 1.16 0.33 1 112 LYS 1.54 0.50 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17369_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.66 _LACS_plot.Line_1_terminator_val_y_1 0.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 5.85 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _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 36 THR 4.88 0.96 0 91 LEU 4.74 -2.23 0 10 HIS -0.47 -0.21 1 11 MET 0.18 -0.41 1 12 GLU 3.02 -0.47 1 13 TRP -5.75 -0.04 1 14 TYR 1.06 0.69 1 15 PHE -0.97 -0.20 1 17 LYS 2.75 -0.12 1 18 LEU -2.54 0.05 1 20 ARG 4.42 -0.90 1 21 LYS 5.22 -0.37 1 22 ASP 3.45 -0.21 1 23 ALA 3.57 -0.53 1 24 GLU 5.55 -0.59 1 25 ARG 4.31 -0.46 1 26 GLN 4.23 -0.47 1 27 LEU 1.91 -0.52 1 28 LEU 3.02 -0.15 1 29 SER 1.20 -0.05 1 30 PHE 2.76 -0.29 1 32 ASN -0.94 0.01 1 34 ARG 3.75 -0.53 1 37 PHE -7.66 1.42 1 38 LEU -3.72 0.39 1 39 ILE -1.92 1.38 1 40 ARG -7.12 0.80 1 41 GLU 1.34 -0.14 1 42 SER -1.11 0.24 1 43 GLU 0.76 -0.17 1 44 THR 1.36 -0.17 1 45 THR -0.83 0.05 1 46 LYS 2.90 -0.20 1 48 ALA -3.74 0.57 1 49 TYR -4.46 0.65 1 50 SER -2.68 1.17 1 51 LEU -3.14 0.89 1 52 SER -1.12 0.86 1 53 ILE -6.53 0.62 1 54 ARG -0.38 0.05 1 55 ASP -6.44 0.71 1 56 TRP -3.12 0.24 1 57 ASP -2.93 -0.76 1 58 ASP 1.82 -0.78 1 59 MET 0.71 -0.11 1 60 LYS -0.29 -0.27 1 62 ASP 0.81 0.48 1 63 HIS 0.25 0.01 1 64 VAL -3.72 0.67 1 65 LYS -6.14 0.13 1 66 HIS -6.09 0.99 1 67 TYR -3.98 0.45 1 68 LYS 0.80 0.25 1 69 ILE -1.47 0.22 1 70 ARG -4.11 0.25 1 71 LYS -4.19 0.60 1 72 LEU -1.39 0.09 1 73 ASP 3.61 -0.36 1 74 ASN 0.77 -0.09 1 77 TYR -3.42 1.02 1 78 TYR -2.40 0.67 1 79 ILE 0.68 0.41 1 80 THR -3.93 0.91 1 81 THR 4.61 -1.14 1 82 ARG 1.63 -0.25 1 83 ALA -1.13 0.03 1 84 GLN -4.18 0.74 1 85 PHE -5.08 0.25 1 86 GLU 2.14 -0.12 1 87 THR -6.76 0.58 1 88 LEU 2.49 -0.73 1 89 GLN 5.69 -0.34 1 90 GLN 2.99 -0.39 1 92 VAL 5.86 -1.35 1 93 GLN 4.67 -0.61 1 94 HIS 3.54 -0.75 1 95 TYR 3.51 0.41 1 96 SER 2.15 0.41 1 97 GLU 0.51 -0.22 1 98 ARG -2.63 -0.09 1 99 ALA 3.93 -0.51 1 100 ALA 0.34 -0.43 1 102 LEU -1.32 -0.44 1 105 ARG -0.45 -0.32 1 106 LEU 3.58 -0.49 1 107 VAL 1.46 -0.22 1 108 VAL -4.34 0.51 1 111 HIS 1.16 -0.15 1 112 LYS 1.54 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17369_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.66 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.30 _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 5.85 _LACS_plot.Line_2_terminator_val_y_2 1.57 _LACS_plot.Y_axis_chem_shift_offset 0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 ALA -1.13 -5.31 0 10 HIS -0.47 1.01 1 11 MET 0.18 1.83 1 12 GLU 3.02 -0.98 1 13 TRP -5.75 -0.98 1 14 TYR 1.06 -0.39 1 15 PHE -0.97 -0.23 1 17 LYS 2.75 -2.13 1 18 LEU -2.54 -1.81 1 20 ARG 4.42 1.63 1 21 LYS 5.22 3.24 1 22 ASP 3.45 2.26 1 23 ALA 3.57 1.44 1 24 GLU 5.55 0.70 1 25 ARG 4.31 2.99 1 26 GLN 4.23 3.55 1 27 LEU 1.91 1.87 1 28 LEU 3.02 -1.91 1 29 SER 1.20 -1.07 1 30 PHE 2.76 1.09 1 34 ARG 3.75 0.70 1 36 THR 4.88 -0.49 1 37 PHE -7.66 -3.45 1 38 LEU -3.72 -2.87 1 39 ILE -1.92 -3.81 1 40 ARG -7.12 -0.87 1 41 GLU 1.34 -0.03 1 42 SER -1.11 1.94 1 43 GLU 0.76 1.82 1 44 THR 1.36 0.99 1 45 THR -0.83 -1.62 1 46 LYS 2.90 1.60 1 48 ALA -3.74 -1.73 1 49 TYR -4.46 -1.63 1 50 SER -2.68 -2.22 1 51 LEU -3.14 -2.70 1 52 SER -1.12 -2.27 1 53 ILE -6.53 -2.03 1 54 ARG -0.38 -3.60 1 55 ASP -6.44 -1.77 1 56 TRP -3.12 -1.14 1 57 ASP -2.93 -2.43 1 58 ASP 1.82 -0.01 1 59 MET 0.71 1.33 1 60 LYS -0.29 0.84 1 62 ASP 0.81 -1.15 1 63 HIS 0.25 -3.12 1 64 VAL -3.72 -1.37 1 65 LYS -6.14 -2.50 1 66 HIS -6.09 0.00 1 67 TYR -3.98 -0.86 1 68 LYS 0.80 -1.01 1 69 ILE -1.47 -1.07 1 70 ARG -4.11 -2.67 1 71 LYS -4.19 0.76 1 72 LEU -1.39 0.68 1 73 ASP 3.61 0.65 1 74 ASN 0.77 -0.28 1 77 TYR -3.42 1.13 1 78 TYR -2.40 -3.45 1 79 ILE 0.68 1.05 1 80 THR -3.93 0.22 1 81 THR 4.61 0.61 1 82 ARG 1.63 -1.02 1 84 GLN -4.18 -0.47 1 85 PHE -5.08 0.01 1 86 GLU 2.14 0.25 1 87 THR -6.76 -0.08 1 88 LEU 2.49 0.78 1 89 GLN 5.69 2.13 1 90 GLN 2.99 1.96 1 91 LEU 4.74 -0.28 1 92 VAL 5.86 2.29 1 93 GLN 4.67 2.32 1 94 HIS 3.54 3.66 1 95 TYR 3.51 -0.54 1 96 SER 2.15 0.61 1 97 GLU 0.51 0.22 1 98 ARG -2.63 -4.20 1 99 ALA 3.93 0.30 1 100 ALA 0.34 -1.50 1 102 LEU -1.32 -1.16 1 105 ARG -0.45 -1.54 1 106 LEU 3.58 -0.97 1 111 HIS 1.16 0.32 1 stop_ save_