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 bmr4670_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 -3.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.66 _LACS_plot.Line_2_terminator_val_x_2 7.93 _LACS_plot.Line_2_terminator_val_y_2 5.93 _LACS_plot.Y_axis_chem_shift_offset -0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 HIS -8.60 -0.25 0 10 ALA -6.00 -1.30 1 11 SER -5.37 -2.53 1 13 ILE -1.50 1.06 1 14 LEU -6.33 -3.05 1 15 ILE -0.56 -0.36 1 16 LYS 1.74 1.10 1 17 HIS -5.07 -0.59 1 18 GLN 4.18 3.11 1 24 ALA -3.15 -0.25 1 30 GLU -1.51 -1.19 1 36 THR -0.85 -1.03 1 37 THR 0.24 0.61 1 38 THR -1.86 -0.96 1 39 ARG 7.40 4.71 1 40 GLU 5.22 4.14 1 41 ALA 3.01 2.48 1 42 ALA 3.31 2.74 1 43 VAL 6.50 5.25 1 44 GLU 3.80 3.08 1 45 GLN 4.26 3.28 1 46 LEU 2.26 1.98 1 47 LYS 4.82 4.29 1 48 SER 4.32 3.29 1 49 ILE 3.97 3.87 1 50 ARG 6.26 4.86 1 51 GLU 3.32 2.45 1 52 ASP 4.44 3.25 1 53 ILE 3.09 3.29 1 54 VAL 5.36 4.01 1 55 SER 0.73 1.08 1 57 LYS 1.55 1.52 1 58 ALA -6.06 -2.43 1 59 ASN -3.57 -0.93 1 60 PHE 4.53 4.67 1 61 GLU 5.71 4.39 1 62 GLU 3.53 3.38 1 63 VAL 5.44 4.04 1 64 ALA 5.38 3.96 1 65 THR 2.95 3.31 1 66 ARG -0.42 1.65 1 67 VAL -0.68 0.57 1 68 SER -2.47 -0.92 1 69 ASP -0.81 2.19 1 71 SER 4.89 4.02 1 72 SER 3.95 3.08 1 73 ALA 3.14 4.19 1 75 ARG -0.80 -1.75 1 78 ASP 0.48 1.55 1 79 LEU -1.92 -0.52 1 81 SER -1.66 -0.83 1 82 PHE -2.11 -1.18 1 84 ARG 1.64 1.11 1 86 GLN 0.20 2.41 1 87 MET -3.47 -3.45 1 88 GLN 1.29 1.62 1 89 LYS 1.63 2.62 1 91 PHE 3.09 4.41 1 92 GLU 3.45 3.06 1 93 GLU 1.50 2.00 1 94 ALA 7.93 6.38 1 95 THR 5.27 4.56 1 96 TYR -0.16 0.09 1 97 ALA -1.19 -0.59 1 98 LEU -0.17 -1.03 1 99 LYS 6.91 4.53 1 100 VAL -2.15 -0.25 1 102 ASP -3.20 -2.29 1 103 ILE 0.26 1.54 1 104 SER -1.40 -0.77 1 105 ASP 3.47 1.14 1 106 ILE -4.34 -1.12 1 107 VAL -3.02 0.09 1 108 ASP 2.72 1.89 1 110 ASP 1.86 2.06 1 111 SER -4.24 -3.18 1 113 VAL -4.76 -0.78 1 114 HIS -1.60 1.45 1 115 ILE -4.90 -0.50 1 116 ILE -5.40 -2.65 1 117 LYS 0.54 0.51 1 118 ARG 0.67 -0.10 1 119 THR 0.79 2.44 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4670_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 5.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.34 _LACS_plot.Line_2_terminator_val_x_2 7.93 _LACS_plot.Line_2_terminator_val_y_2 -2.00 _LACS_plot.Y_axis_chem_shift_offset -0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 HIS -8.60 8.35 0 10 ALA -6.00 4.70 1 11 SER -5.37 2.84 1 13 ILE -1.50 2.56 1 14 LEU -6.33 3.28 1 15 ILE -0.56 0.20 1 16 LYS 1.74 -0.64 1 17 HIS -5.07 4.48 1 18 GLN 4.18 -1.07 1 24 ALA -3.15 2.90 1 30 GLU -1.51 0.32 1 36 THR -0.85 -0.18 1 37 THR 0.24 0.37 1 38 THR -1.86 0.90 1 39 ARG 7.40 -2.69 1 40 GLU 5.22 -1.08 1 41 ALA 3.01 -0.53 1 42 ALA 3.31 -0.57 1 43 VAL 6.50 -1.25 1 44 GLU 3.80 -0.72 1 45 GLN 4.26 -0.98 1 46 LEU 2.26 -0.28 1 47 LYS 4.82 -0.53 1 48 SER 4.32 -1.03 1 49 ILE 3.97 -0.10 1 50 ARG 6.26 -1.40 1 51 GLU 3.32 -0.87 1 52 ASP 4.44 -1.19 1 53 ILE 3.09 0.20 1 54 VAL 5.36 -1.35 1 55 SER 0.73 0.35 1 57 LYS 1.55 -0.03 1 58 ALA -6.06 3.63 1 59 ASN -3.57 2.64 1 60 PHE 4.53 0.14 1 61 GLU 5.71 -1.32 1 62 GLU 3.53 -0.15 1 63 VAL 5.44 -1.40 1 64 ALA 5.38 -1.42 1 65 THR 2.95 0.36 1 66 ARG -0.42 2.07 1 67 VAL -0.68 1.25 1 68 SER -2.47 1.55 1 69 ASP -0.81 3.00 1 71 SER 4.89 -0.87 1 72 SER 3.95 -0.87 1 73 ALA 3.14 1.05 1 75 ARG -0.80 -0.95 1 78 ASP 0.48 1.07 1 79 LEU -1.92 1.40 1 81 SER -1.66 0.83 1 82 PHE -2.11 0.93 1 84 ARG 1.64 -0.53 1 86 GLN 0.20 2.21 1 87 MET -3.47 0.02 1 88 GLN 1.29 0.33 1 89 LYS 1.63 0.99 1 91 PHE 3.09 1.32 1 92 GLU 3.45 -0.39 1 93 GLU 1.50 0.50 1 94 ALA 7.93 -1.55 1 95 THR 5.27 -0.71 1 96 TYR -0.16 0.25 1 97 ALA -1.19 0.60 1 98 LEU -0.17 -0.86 1 99 LYS 6.91 -2.38 1 100 VAL -2.15 1.90 1 102 ASP -3.20 0.91 1 103 ILE 0.26 1.28 1 104 SER -1.40 0.63 1 105 ASP 3.47 -2.33 1 106 ILE -4.34 3.22 1 107 VAL -3.02 3.11 1 108 ASP 2.72 -0.83 1 110 ASP 1.86 0.20 1 111 SER -4.24 1.06 1 113 VAL -4.76 3.98 1 114 HIS -1.60 3.05 1 115 ILE -4.90 4.40 1 116 ILE -5.40 2.75 1 117 LYS 0.54 -0.03 1 118 ARG 0.67 -0.77 1 119 THR 0.79 1.65 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4670_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 0.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 7.93 _LACS_plot.Line_2_terminator_val_y_2 -0.79 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 ILE -1.50 -0.67 0 113 VAL -4.76 1.62 0 111 SER -4.24 1.60 0 10 ALA -6.00 1.07 1 11 SER -5.37 1.49 1 12 HIS -8.60 1.49 1 14 LEU -6.33 0.52 1 15 ILE -0.56 0.50 1 16 LYS 1.74 -0.11 1 17 HIS -5.07 0.19 1 18 GLN 4.18 -0.42 1 24 ALA -3.15 0.06 1 30 GLU -1.51 0.15 1 36 THR -0.85 0.19 1 37 THR 0.24 0.04 1 38 THR -1.86 -0.03 1 39 ARG 7.40 -1.13 1 40 GLU 5.22 -0.60 1 41 ALA 3.01 -0.17 1 42 ALA 3.31 -0.28 1 43 VAL 6.50 -0.71 1 44 GLU 3.80 -0.42 1 45 GLN 4.26 -0.27 1 46 LEU 2.26 -0.27 1 47 LYS 4.82 -0.43 1 48 SER 4.32 -0.21 1 49 ILE 3.97 -0.40 1 50 ARG 6.26 -0.75 1 51 GLU 3.32 -0.22 1 52 ASP 4.44 -0.31 1 53 ILE 3.09 0.10 1 54 VAL 5.36 -0.16 1 55 SER 0.73 0.06 1 57 LYS 1.55 -0.15 1 58 ALA -6.06 0.21 1 59 ASN -3.57 0.22 1 60 PHE 4.53 -1.06 1 61 GLU 5.71 -0.03 1 62 GLU 3.53 -0.27 1 63 VAL 5.44 -0.56 1 64 ALA 5.38 -0.66 1 65 THR 2.95 0.00 1 66 ARG -0.42 0.24 1 67 VAL -0.68 0.00 1 68 SER -2.47 0.20 1 69 ASP -0.81 0.04 1 71 SER 4.89 -0.43 1 72 SER 3.95 -0.41 1 73 ALA 3.14 -0.56 1 75 ARG -0.80 0.44 1 78 ASP 0.48 0.23 1 79 LEU -1.92 0.08 1 81 SER -1.66 0.95 1 82 PHE -2.11 0.26 1 84 ARG 1.64 -0.29 1 86 GLN 0.20 0.01 1 87 MET -3.47 0.08 1 88 GLN 1.29 -0.16 1 89 LYS 1.63 -0.97 1 91 PHE 3.09 -0.38 1 92 GLU 3.45 -0.34 1 93 GLU 1.50 -0.14 1 94 ALA 7.93 -0.70 1 95 THR 5.27 -0.68 1 96 TYR -0.16 0.04 1 97 ALA -1.19 0.08 1 98 LEU -0.17 0.08 1 99 LYS 6.91 -1.07 1 100 VAL -2.15 0.15 1 102 ASP -3.20 1.07 1 103 ILE 0.26 -0.14 1 104 SER -1.40 0.11 1 105 ASP 3.47 0.09 1 106 ILE -4.34 0.26 1 107 VAL -3.02 0.84 1 108 ASP 2.72 -0.02 1 110 ASP 1.86 0.39 1 114 HIS -1.60 0.29 1 115 ILE -4.90 0.63 1 116 ILE -5.40 0.95 1 117 LYS 0.54 0.37 1 118 ARG 0.67 0.12 1 119 THR 0.79 -0.33 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4670_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 -3.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.36 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 3.85 _LACS_plot.Y_axis_chem_shift_offset -0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 VAL -4.76 5.70 0 10 ALA -6.00 -3.20 1 11 SER -5.37 -3.20 1 12 HIS -8.60 -2.70 1 13 ILE -1.50 -6.40 1 14 LEU -6.33 -3.70 1 15 ILE -0.56 -0.40 1 16 LYS 1.74 -4.00 1 17 HIS -5.07 2.00 1 18 GLN 4.18 0.10 1 30 GLU -1.51 1.20 1 37 THR 0.24 -2.50 1 38 THR -1.86 0.10 1 39 ARG 7.40 2.20 1 40 GLU 5.22 3.30 1 41 ALA 3.01 5.50 1 42 ALA 3.31 2.80 1 43 VAL 6.50 2.10 1 44 GLU 3.80 5.10 1 45 GLN 4.26 4.60 1 46 LEU 2.26 2.10 1 47 LYS 4.82 4.90 1 48 SER 4.32 1.80 1 49 ILE 3.97 1.80 1 50 ARG 6.26 2.50 1 51 GLU 3.32 4.90 1 52 ASP 4.44 2.70 1 53 ILE 3.09 1.80 1 54 VAL 5.36 3.20 1 55 SER 0.73 0.50 1 57 LYS 1.55 -1.40 1 58 ALA -6.06 -4.60 1 59 ASN -3.57 -1.80 1 60 PHE 4.53 -0.80 1 61 GLU 5.71 3.70 1 62 GLU 3.53 4.90 1 63 VAL 5.44 3.60 1 64 ALA 5.38 2.50 1 65 THR 2.95 -0.20 1 66 ARG -0.42 2.30 1 67 VAL -0.68 -0.70 1 68 SER -2.47 1.10 1 69 ASP -0.81 -1.20 1 72 SER 3.95 2.50 1 73 ALA 3.14 2.70 1 75 ARG -0.80 1.80 1 78 ASP 0.48 -0.80 1 79 LEU -1.92 1.90 1 81 SER -1.66 0.90 1 82 PHE -2.11 -5.80 1 84 ARG 1.64 3.40 1 86 GLN 0.20 0.40 1 87 MET -3.47 -0.80 1 88 GLN 1.29 3.40 1 89 LYS 1.63 3.30 1 91 PHE 3.09 2.00 1 92 GLU 3.45 4.70 1 93 GLU 1.50 3.60 1 94 ALA 5.27 0.70 1 96 TYR -0.16 0.80 1 97 ALA -1.19 1.30 1 98 LEU -0.17 1.60 1 99 LYS 6.91 1.60 1 100 VAL -2.15 -3.30 1 102 ASP -3.20 2.90 1 103 ILE 0.26 -1.10 1 104 SER -1.40 -1.70 1 105 ASP 3.47 1.00 1 106 ILE -4.34 -2.20 1 107 VAL -3.02 -0.10 1 108 ASP 2.72 2.70 1 110 ASP 1.86 0.00 1 111 SER -4.24 -2.80 1 114 HIS -1.60 -2.70 1 115 ILE -4.90 -4.00 1 116 ILE -5.40 -1.10 1 117 LYS 0.54 -0.50 1 118 ARG 0.67 -0.50 1 119 THR 0.79 5.90 1 stop_ save_