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 bmr5778_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 -2.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.53 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 4.83 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 GLU -2.66 -3.78 0 11 TRP -0.39 0.14 1 12 LEU -6.50 -1.22 1 18 TYR 0.36 0.39 1 19 ILE 0.13 -0.56 1 20 LYS 2.49 -0.20 1 21 THR -2.42 -1.89 1 22 TRP -2.63 -1.62 1 23 ARG -2.59 -1.00 1 25 ARG -7.04 -1.82 1 26 TYR 0.94 0.09 1 27 PHE -6.41 -1.94 1 28 LEU -2.71 -0.04 1 29 LEU -4.15 -2.10 1 30 LYS -3.85 -1.48 1 31 SER 3.75 2.60 1 32 ASP -0.46 -1.27 1 34 SER 2.18 1.61 1 35 PHE -3.56 -2.99 1 36 ILE -4.03 -2.05 1 38 TYR -6.01 -1.32 1 39 LYS 2.57 2.79 1 40 GLU -5.80 -3.46 1 41 ARG 0.00 0.29 1 43 GLU -0.35 0.03 1 44 ALA -1.25 -0.22 1 46 ASP 0.28 -0.73 1 47 GLN 0.18 -0.22 1 48 THR 0.53 0.02 1 49 LEU -0.27 -0.29 1 52 LEU 0.13 0.49 1 53 ASN -5.39 -1.06 1 54 ASN -0.47 -0.33 1 55 PHE -3.75 -2.74 1 56 SER -3.13 -2.82 1 58 ALA 2.42 1.48 1 61 GLN -3.42 -1.26 1 62 LEU -5.06 -1.53 1 63 MET -4.17 -0.91 1 64 LYS -2.20 -0.45 1 65 THR -1.65 -1.91 1 67 ARG -3.83 -2.08 1 69 ARG -3.37 -1.86 1 71 ASN 3.37 1.99 1 72 THR 0.80 0.79 1 73 PHE -3.85 -1.28 1 74 VAL -4.50 -2.12 1 87 THR 1.39 1.13 1 88 PHE -6.09 -1.88 1 89 HIS -3.11 0.49 1 90 VAL -4.26 -3.31 1 91 ASP 1.60 2.10 1 92 SER -2.23 -1.12 1 94 ASP 3.88 2.57 1 95 GLU 1.67 2.09 1 96 ARG 6.54 4.64 1 97 GLU 3.62 2.42 1 98 GLU 3.23 2.64 1 101 ARG 3.89 2.91 1 102 ALA 3.68 2.63 1 103 ILE 5.70 4.80 1 104 GLN 3.11 2.60 1 106 VAL 5.72 3.95 1 107 ALA 4.59 3.51 1 108 ASN 3.61 2.04 1 109 SER 2.47 1.90 1 110 LEU 0.23 -0.39 1 111 LYS 1.36 1.81 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5778_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 4.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.65 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.47 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -1.71 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 GLU -2.66 -1.12 0 11 TRP -0.39 0.53 1 12 LEU -6.50 5.28 1 18 TYR 0.36 0.03 1 19 ILE 0.13 -0.69 1 20 LYS 2.49 -2.69 1 21 THR -2.42 0.53 1 22 TRP -2.63 1.01 1 23 ARG -2.59 1.59 1 25 ARG -7.04 5.22 1 26 TYR 0.94 -0.85 1 27 PHE -6.41 4.47 1 28 LEU -2.71 2.67 1 29 LEU -4.15 2.05 1 30 LYS -3.85 2.37 1 31 SER 3.75 -1.15 1 32 ASP -0.46 -0.81 1 34 SER 2.18 -0.57 1 35 PHE -3.56 0.57 1 36 ILE -4.03 1.98 1 38 TYR -6.01 4.69 1 39 LYS 2.57 0.22 1 40 GLU -5.80 2.34 1 41 ARG 0.00 0.29 1 43 GLU -0.35 0.38 1 44 ALA -1.25 1.03 1 46 ASP 0.28 -1.01 1 47 GLN 0.18 -0.40 1 48 THR 0.53 -0.51 1 49 LEU -0.27 -0.02 1 52 LEU 0.13 0.36 1 53 ASN -5.39 4.33 1 54 ASN -0.47 0.14 1 55 PHE -3.75 1.01 1 56 SER -3.13 0.31 1 58 ALA 2.42 -0.94 1 61 GLN -3.42 2.16 1 62 LEU -5.06 3.53 1 63 MET -4.17 3.26 1 64 LYS -2.20 1.75 1 65 THR -1.65 -0.26 1 67 ARG -3.83 1.75 1 69 ARG -3.37 1.51 1 71 ASN 3.37 -1.38 1 72 THR 0.80 -0.01 1 73 PHE -3.85 2.57 1 74 VAL -4.50 2.38 1 87 THR 1.39 -0.26 1 88 PHE -6.09 4.21 1 89 HIS -3.11 3.60 1 90 VAL -4.26 0.95 1 91 ASP 1.60 0.50 1 92 SER -2.23 1.11 1 94 ASP 3.88 -1.31 1 95 GLU 1.67 0.42 1 96 ARG 6.54 -1.90 1 97 GLU 3.62 -1.20 1 98 GLU 3.23 -0.59 1 101 ARG 3.89 -0.98 1 102 ALA 3.68 -1.05 1 103 ILE 5.70 -0.90 1 104 GLN 3.11 -0.51 1 106 VAL 5.72 -1.77 1 107 ALA 4.59 -1.08 1 108 ASN 3.61 -1.57 1 109 SER 2.47 -0.57 1 110 LEU 0.23 -0.62 1 111 LYS 1.36 0.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5778_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.30 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -0.79 _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 41 ARG 0.00 -1.62 0 11 TRP -0.39 0.30 1 12 LEU -6.50 0.34 1 18 TYR 0.36 -0.05 1 19 ILE 0.13 -0.10 1 20 LYS 2.49 -0.31 1 21 THR -2.42 -0.20 1 22 TRP -2.63 0.19 1 23 ARG -2.59 0.52 1 25 ARG -7.04 0.50 1 26 TYR 0.94 -0.66 1 27 PHE -6.41 0.97 1 28 LEU -2.71 0.58 1 29 LEU -4.15 1.15 1 30 LYS -3.85 1.08 1 31 SER 3.75 -0.30 1 32 ASP -0.46 -0.02 1 34 SER 2.18 -0.09 1 35 PHE -3.56 1.12 1 36 ILE -4.03 0.48 1 38 TYR -6.01 0.05 1 39 LYS 2.57 -0.15 1 40 GLU -5.80 0.41 1 43 GLU -0.35 -0.29 1 44 ALA -1.25 -0.04 1 46 ASP 0.28 -0.12 1 47 GLN 0.18 0.00 1 48 THR 0.53 -0.11 1 49 LEU -0.27 -0.05 1 52 LEU 0.13 -0.13 1 53 ASN -5.39 0.16 1 54 ASN -0.47 0.22 1 55 PHE -3.75 0.53 1 56 SER -3.13 0.86 1 58 ALA 2.42 -0.34 1 61 GLN -3.42 0.32 1 62 LEU -5.06 1.20 1 63 MET -4.17 0.32 1 64 LYS -2.20 0.55 1 65 THR -1.65 0.35 1 66 GLU -2.66 0.73 1 67 ARG -3.83 -0.24 1 69 ARG -3.37 0.05 1 71 ASN 3.37 -0.68 1 72 THR 0.80 -0.29 1 73 PHE -3.85 0.98 1 74 VAL -4.50 0.79 1 87 THR 1.39 1.19 1 88 PHE -6.09 0.90 1 89 HIS -3.11 0.52 1 90 VAL -4.26 0.66 1 91 ASP 1.60 -0.03 1 92 SER -2.23 0.26 1 94 ASP 3.88 -0.24 1 95 GLU 1.67 -0.20 1 96 ARG 6.54 -0.51 1 97 GLU 3.62 -0.50 1 98 GLU 3.23 -0.47 1 101 ARG 3.89 -0.47 1 102 ALA 3.68 -0.36 1 103 ILE 5.70 -0.86 1 104 GLN 3.11 -0.52 1 106 VAL 5.72 -0.54 1 107 ALA 4.59 -0.46 1 108 ASN 3.61 -0.29 1 109 SER 2.47 -0.04 1 110 LEU 0.23 0.10 1 111 LYS 1.36 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5778_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 -2.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 -1.14 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 1.56 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 98 GLU 3.23 3.59 0 34 SER 2.18 -3.22 0 56 SER -3.13 2.42 0 11 TRP -0.39 1.16 1 12 LEU -6.50 -1.94 1 20 LYS 2.49 -0.81 1 21 THR -2.42 -1.11 1 22 TRP -2.63 0.09 1 23 ARG -2.59 -0.85 1 25 ARG -7.04 -4.19 1 26 TYR 0.94 -1.61 1 27 PHE -6.41 -0.88 1 28 LEU -2.71 -3.17 1 29 LEU -4.15 -1.98 1 30 LYS -3.85 1.38 1 31 SER 3.75 -1.03 1 32 ASP -0.46 0.61 1 35 PHE -3.56 -2.16 1 36 ILE -4.03 -3.02 1 38 TYR -6.01 -0.47 1 39 LYS 2.57 -1.62 1 40 GLU -5.80 -2.64 1 43 GLU -0.35 -1.10 1 46 ASP 0.28 -0.55 1 47 GLN 0.18 -0.38 1 48 THR 0.53 -0.39 1 49 LEU -0.27 -1.53 1 52 LEU 0.13 -0.59 1 53 ASN -5.39 -1.97 1 54 ASN -0.47 -2.36 1 58 ALA 2.42 0.17 1 61 GLN -3.42 -1.56 1 62 LEU -5.06 -0.83 1 63 MET -4.17 -1.86 1 64 LYS -2.20 -1.80 1 65 THR -1.65 -3.38 1 66 GLU -2.66 -1.61 1 67 ARG -3.83 -0.01 1 69 ARG -3.37 -2.13 1 71 ASN 3.37 -0.76 1 72 THR 0.80 1.06 1 73 PHE -3.85 -4.58 1 74 VAL -4.50 -1.06 1 87 THR 1.39 -2.98 1 88 PHE -6.09 -1.95 1 89 HIS -3.11 -1.64 1 90 VAL -4.26 -1.66 1 91 ASP 1.60 -0.61 1 94 ASP 3.88 1.85 1 95 GLU 1.67 1.92 1 96 ARG 6.54 0.42 1 97 GLU 3.62 1.88 1 101 ARG 3.89 2.34 1 102 ALA 3.68 0.74 1 103 ILE 5.70 0.45 1 104 GLN 3.11 1.70 1 106 VAL 5.72 2.81 1 107 ALA 4.59 3.19 1 108 ASN 3.61 2.08 1 109 SER 2.47 -0.39 1 110 LEU 0.23 -1.24 1 stop_ save_