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 bmr19087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.95 _LACS_plot.Line_1_terminator_val_y_1 -2.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.45 _LACS_plot.Line_2_terminator_val_x_2 6.66 _LACS_plot.Line_2_terminator_val_y_2 5.21 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 VAL -7.95 -2.25 0 52 THR 5.78 6.77 0 11 SER 0.87 1.06 1 12 ALA 0.22 0.32 1 13 ILE 0.14 0.06 1 21 ALA -1.16 -0.92 1 22 ALA -1.32 -2.19 1 28 VAL 0.19 -0.03 1 29 LYS -0.12 -0.07 1 31 ALA -0.48 -0.18 1 32 ALA -0.11 -0.01 1 34 ARG -0.86 -0.09 1 35 ALA -2.55 -0.93 1 36 GLU -1.35 -0.13 1 37 VAL -3.27 -1.56 1 38 ARG -4.20 -0.91 1 39 VAL -2.95 -1.56 1 40 TYR -5.78 -2.36 1 41 ASN -1.41 -0.47 1 42 ILE -0.39 -0.59 1 43 SER -2.16 0.30 1 45 THR 0.02 0.01 1 48 ALA 3.51 2.90 1 49 ALA 2.77 2.36 1 50 ALA 4.66 3.35 1 51 ARG 3.95 3.51 1 53 ALA 4.08 3.70 1 54 ASP 4.67 3.81 1 55 ARG 3.87 3.29 1 56 LEU 3.45 2.34 1 57 LYS 4.46 3.80 1 58 ALA 3.76 2.57 1 59 ALA -1.01 -0.74 1 61 PHE 1.22 0.78 1 62 THR -1.77 -2.10 1 63 VAL 1.04 0.38 1 64 THR -2.83 0.09 1 65 ASP -2.82 -1.60 1 66 VAL -0.97 -0.04 1 68 ASN -6.09 -1.18 1 69 LEU -0.80 -1.38 1 70 SER -3.42 -0.94 1 71 LEU 1.27 0.95 1 73 ASP 2.49 1.67 1 74 VAL -1.44 -0.07 1 75 ALA -4.78 -1.51 1 76 ALA 1.84 2.11 1 77 THR -2.34 0.71 1 78 THR -2.01 -1.82 1 79 VAL -5.06 -1.29 1 80 TYR -5.85 -2.40 1 81 TYR -2.61 -0.90 1 82 THR 1.77 0.58 1 83 GLU 1.91 1.48 1 84 VAL 2.78 2.40 1 85 GLU 4.96 5.16 1 87 GLU 5.33 3.49 1 88 ARG 3.75 2.78 1 89 ALA 5.64 4.81 1 90 THR 2.90 3.05 1 91 ALA 4.11 3.44 1 92 ASP 3.99 3.07 1 93 ALA 6.40 4.20 1 94 VAL 3.58 3.21 1 96 ARG 6.66 5.07 1 97 THR -1.49 -0.52 1 98 LEU -6.95 -2.09 1 100 ALA -0.47 0.24 1 101 ALA -2.04 -1.21 1 103 GLU -0.69 -0.18 1 104 LEU 2.13 3.31 1 105 ARG 0.83 1.60 1 106 LEU 3.72 2.98 1 108 GLU -1.45 -1.61 1 109 LEU 1.43 1.24 1 110 SER 0.70 -0.22 1 111 ASP 3.54 1.31 1 112 GLN 2.28 1.72 1 116 VAL -4.60 -1.03 1 117 ILE -2.67 -1.62 1 118 VAL -3.50 -3.51 1 119 VAL -3.22 -1.57 1 120 VAL -0.58 -0.97 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.95 _LACS_plot.Line_1_terminator_val_y_1 5.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.55 _LACS_plot.Line_2_terminator_val_x_2 6.66 _LACS_plot.Line_2_terminator_val_y_2 -1.45 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 VAL -7.95 5.70 0 52 THR 5.78 0.99 0 11 SER 0.87 0.19 1 12 ALA 0.22 0.10 1 13 ILE 0.14 -0.08 1 21 ALA -1.16 0.24 1 22 ALA -1.32 -0.87 1 28 VAL 0.19 -0.22 1 29 LYS -0.12 0.05 1 31 ALA -0.48 0.30 1 32 ALA -0.11 0.10 1 34 ARG -0.86 0.77 1 35 ALA -2.55 1.62 1 36 GLU -1.35 1.22 1 37 VAL -3.27 1.71 1 38 ARG -4.20 3.29 1 39 VAL -2.95 1.39 1 40 TYR -5.78 3.42 1 41 ASN -1.41 0.94 1 42 ILE -0.39 -0.20 1 43 SER -2.16 2.46 1 45 THR 0.02 -0.01 1 48 ALA 3.51 -0.61 1 49 ALA 2.77 -0.41 1 50 ALA 4.66 -1.31 1 51 ARG 3.95 -0.44 1 53 ALA 4.08 -0.38 1 54 ASP 4.67 -0.86 1 55 ARG 3.87 -0.58 1 56 LEU 3.45 -1.11 1 57 LYS 4.46 -0.66 1 58 ALA 3.76 -1.19 1 59 ALA -1.01 0.27 1 61 PHE 1.22 -0.44 1 62 THR -1.77 -0.33 1 63 VAL 1.04 -0.66 1 64 THR -2.83 2.92 1 65 ASP -2.82 1.22 1 66 VAL -0.97 0.93 1 68 ASN -6.09 4.91 1 69 LEU -0.80 -0.58 1 70 SER -3.42 2.48 1 71 LEU 1.27 -0.32 1 73 ASP 2.49 -0.82 1 74 VAL -1.44 1.37 1 75 ALA -4.78 3.27 1 76 ALA 1.84 0.27 1 77 THR -2.34 3.05 1 78 THR -2.01 0.19 1 79 VAL -5.06 3.77 1 80 TYR -5.85 3.45 1 81 TYR -2.61 1.71 1 82 THR 1.77 -1.19 1 83 GLU 1.91 -0.43 1 84 VAL 2.78 -0.38 1 85 GLU 4.96 0.20 1 87 GLU 5.33 -1.84 1 88 ARG 3.75 -0.97 1 89 ALA 5.64 -0.83 1 90 THR 2.90 0.15 1 91 ALA 4.11 -0.67 1 92 ASP 3.99 -0.92 1 93 ALA 6.40 -2.20 1 94 VAL 3.58 -0.37 1 96 ARG 6.66 -1.59 1 97 THR -1.49 0.97 1 98 LEU -6.95 4.86 1 100 ALA -0.47 0.71 1 101 ALA -2.04 0.83 1 103 GLU -0.69 0.51 1 104 LEU 2.13 1.18 1 105 ARG 0.83 0.77 1 106 LEU 3.72 -0.74 1 108 GLU -1.45 -0.16 1 109 LEU 1.43 -0.19 1 110 SER 0.70 -0.92 1 111 ASP 3.54 -2.23 1 112 GLN 2.28 -0.56 1 116 VAL -4.60 3.57 1 117 ILE -2.67 1.05 1 118 VAL -3.50 -0.01 1 119 VAL -3.22 1.65 1 120 VAL -0.58 -0.39 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.95 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 6.66 _LACS_plot.Line_2_terminator_val_y_2 -0.54 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 VAL -5.06 1.85 0 12 ALA 0.22 0.04 1 13 ILE 0.14 0.02 1 21 ALA -1.16 -0.03 1 22 ALA -1.32 0.41 1 28 VAL 0.19 0.02 1 29 LYS -0.12 0.10 1 31 ALA -0.48 0.03 1 32 ALA -0.11 0.12 1 34 ARG -0.86 0.05 1 35 ALA -2.55 0.29 1 36 GLU -1.35 0.08 1 37 VAL -3.27 0.78 1 38 ARG -4.20 0.59 1 39 VAL -2.95 0.68 1 40 TYR -5.78 0.60 1 41 ASN -1.41 0.29 1 42 ILE -0.39 1.28 1 43 SER -2.16 0.26 1 45 THR 0.02 0.03 1 48 ALA 3.51 -0.29 1 49 ALA 2.77 -0.34 1 50 ALA 4.66 -0.33 1 51 ARG 3.95 -0.15 1 52 THR 5.78 -0.19 1 53 ALA 4.08 -0.43 1 54 ASP 4.67 -0.21 1 55 ARG 3.87 -0.17 1 56 LEU 3.45 -0.01 1 57 LYS 4.46 0.19 1 58 ALA 3.76 -0.11 1 59 ALA -1.01 0.17 1 61 PHE 1.22 -0.13 1 62 THR -1.77 0.54 1 63 VAL 1.04 0.00 1 64 THR -2.83 -0.34 1 65 ASP -2.82 0.74 1 66 VAL -6.09 0.20 1 69 LEU -3.42 0.08 1 71 LEU 1.27 -0.08 1 73 ASP 2.49 -0.15 1 74 VAL -1.44 0.10 1 75 ALA -4.78 0.34 1 76 ALA 1.84 0.38 1 77 THR -2.34 0.29 1 78 THR -2.01 0.48 1 80 TYR -5.85 0.92 1 81 TYR -2.61 0.37 1 82 THR 1.77 0.13 1 83 GLU 1.91 -0.23 1 84 VAL 2.78 -0.46 1 85 GLU 4.96 -0.40 1 87 GLU 5.33 -0.98 1 88 ARG 3.75 -0.14 1 89 ALA 5.64 -0.20 1 90 THR 2.90 -0.55 1 91 ALA 4.11 -0.22 1 92 ASP 3.99 -0.05 1 93 ALA 6.40 -1.18 1 94 VAL 3.58 -0.14 1 96 ARG 6.66 -0.36 1 97 THR -1.49 -0.03 1 98 LEU -6.95 0.42 1 100 ALA -0.47 -0.11 1 101 ALA -2.04 0.93 1 102 VAL -7.95 0.53 1 103 GLU -0.69 -0.75 1 104 LEU 2.13 -0.08 1 105 ARG 0.83 -0.28 1 106 LEU 3.72 -0.25 1 108 GLU -1.45 0.19 1 109 LEU 1.43 -0.53 1 110 SER 0.70 -0.06 1 111 ASP 3.54 -0.35 1 112 GLN 2.28 0.01 1 116 VAL -4.60 0.77 1 117 ILE -2.67 0.80 1 118 VAL -3.50 1.44 1 119 VAL -3.22 0.70 1 120 VAL -0.58 0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.95 _LACS_plot.Line_1_terminator_val_y_1 -3.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 6.66 _LACS_plot.Line_2_terminator_val_y_2 2.16 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 THR -2.34 6.98 0 11 SER 0.87 -0.08 1 12 ALA 0.22 0.01 1 21 ALA -1.16 -0.79 1 28 VAL 0.19 -0.52 1 31 ALA -0.48 -0.94 1 34 ARG -0.86 -0.45 1 35 ALA -2.55 -1.63 1 36 GLU -1.35 -1.98 1 37 VAL -3.27 -2.02 1 38 ARG -4.20 -2.06 1 39 VAL -2.95 -2.94 1 40 TYR -5.78 -0.78 1 41 ASN -1.41 1.10 1 42 ILE -0.39 0.05 1 49 ALA 2.77 0.27 1 50 ALA 4.66 1.84 1 51 ARG 3.95 3.63 1 52 THR 5.78 0.93 1 53 ALA 4.08 1.21 1 54 ASP 4.67 3.08 1 55 ARG 3.87 3.25 1 56 LEU 3.45 1.71 1 57 LYS 4.46 4.84 1 58 ALA 3.76 0.72 1 59 ALA -1.01 -1.00 1 61 PHE 1.22 -0.60 1 62 THR -1.77 0.97 1 63 VAL -2.83 -2.52 1 65 ASP -2.82 -0.07 1 66 VAL -0.97 -1.43 1 68 ASN -6.09 -2.85 1 69 LEU -0.80 -0.82 1 70 SER 1.27 -0.49 1 73 ASP 2.49 -0.96 1 74 VAL -1.44 -1.40 1 75 ALA -4.78 -1.87 1 76 ALA 1.84 -0.56 1 78 THR -2.01 -2.60 1 79 VAL -5.06 0.51 1 80 TYR -5.85 -2.66 1 81 TYR -2.61 -0.18 1 82 THR 1.77 -0.45 1 83 GLU 1.91 0.87 1 84 VAL 4.96 1.68 1 87 GLU 5.33 0.93 1 88 ARG 3.75 4.15 1 89 ALA 5.64 0.42 1 90 THR 2.90 0.75 1 91 ALA 4.11 2.75 1 92 ASP 3.99 3.13 1 93 ALA 6.40 1.97 1 94 VAL 3.58 2.80 1 96 ARG 6.66 0.75 1 97 THR -1.49 -0.06 1 98 LEU -6.95 -2.45 1 100 ALA -0.47 -2.62 1 101 ALA -2.04 0.29 1 102 VAL -7.95 -2.26 1 103 GLU -0.69 0.78 1 104 LEU 2.13 0.74 1 105 ARG 3.72 0.36 1 108 GLU -1.45 0.29 1 109 LEU 1.43 -0.33 1 110 SER 0.70 0.46 1 111 ASP 2.28 -1.77 1 116 VAL -4.60 -2.22 1 117 ILE -2.67 -1.08 1 118 VAL -3.50 -1.87 1 119 VAL -3.22 -0.65 1 120 VAL -0.58 -0.87 1 stop_ save_