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 bmr15281_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 -3.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.30 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 4.46 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 PHE 0.10 -2.32 0 10 ARG 5.33 3.21 1 11 ALA 3.87 2.98 1 12 GLU 1.32 2.50 1 13 TRP -1.07 0.34 1 14 ASP 5.20 3.57 1 15 ALA 3.75 2.52 1 16 ALA 2.15 2.16 1 17 LYS 5.55 3.88 1 18 ALA 2.98 2.01 1 19 GLN -0.61 0.06 1 21 ARG -2.33 -1.12 1 22 PHE -4.76 -2.79 1 23 GLU 0.09 0.18 1 25 SER -2.33 -0.75 1 26 ALA 5.34 4.17 1 27 VAL 4.27 3.06 1 28 ASP 2.17 2.39 1 29 LEU 2.97 1.99 1 30 ALA 3.03 2.03 1 31 ASP 2.09 1.07 1 34 ILE -0.85 -0.38 1 35 HIS 2.00 2.76 1 36 LEU -1.22 0.92 1 37 SER -3.29 -0.31 1 38 ALA -0.45 -0.20 1 40 GLU 3.12 2.02 1 41 GLN -1.32 -0.07 1 42 ALA 5.06 4.21 1 43 GLN 3.56 2.98 1 44 GLU 3.70 2.65 1 45 THR 5.95 5.10 1 46 ALA 3.53 2.91 1 47 ALA 2.73 2.53 1 48 LYS 2.34 2.36 1 49 TRP -2.20 -0.34 1 50 PHE 0.06 0.07 1 51 ARG 3.09 2.22 1 53 GLN 0.86 0.58 1 54 ALA -2.54 -1.12 1 55 ASN 2.14 0.89 1 56 LEU -3.65 -0.72 1 57 VAL -4.71 -2.23 1 58 LEU -6.80 -2.81 1 59 LEU -2.38 -2.35 1 60 ALA -4.82 -2.18 1 61 VAL -5.17 -1.43 1 62 GLU 0.81 0.28 1 63 ALA 1.95 2.35 1 64 GLU 1.81 0.76 1 66 LEU 1.64 1.05 1 68 GLU 1.41 1.88 1 69 ASP -2.44 -1.82 1 70 LEU -4.55 -2.18 1 71 LYS 0.19 -1.62 1 72 TRP -4.11 -1.39 1 73 GLU -1.22 -0.25 1 74 ALA -2.79 -1.35 1 75 SER 3.92 2.90 1 76 ARG -1.42 -0.35 1 79 ALA -1.55 -0.38 1 80 ARG -3.79 -0.65 1 81 PHE -8.54 -4.30 1 83 HIS -4.24 -1.27 1 84 LEU 4.86 2.13 1 85 TYR 2.94 0.95 1 86 ARG -4.58 -1.43 1 88 LEU 1.05 0.11 1 89 LEU 6.20 4.63 1 90 VAL 2.81 1.52 1 91 SER 0.38 -0.01 1 92 GLU 1.63 1.04 1 93 VAL 3.12 2.64 1 94 THR -3.02 -0.13 1 95 ARG -6.88 -3.19 1 96 GLU -4.13 -1.13 1 97 ALA 0.03 0.62 1 98 ASP -3.39 -1.56 1 99 LEU -3.78 -1.52 1 100 ASP -3.58 -1.61 1 101 LEU -1.91 -1.90 1 102 ASP 2.65 2.15 1 103 ALA -0.92 -0.12 1 104 ASP 1.79 1.56 1 106 VAL -0.91 -0.80 1 108 GLN 1.94 1.42 1 109 LEU 3.35 2.04 1 111 ASP -0.96 1.69 1 112 HIS 0.80 0.41 1 113 LEU 0.93 0.33 1 114 ALA 1.07 0.67 1 115 LEU 0.14 0.38 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15281_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 4.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.70 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -1.73 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 PHE 0.10 -2.42 0 10 ARG 5.33 -2.12 1 11 ALA 3.87 -0.89 1 12 GLU 1.32 1.18 1 13 TRP -1.07 1.41 1 14 ASP 5.20 -1.63 1 15 ALA 3.75 -1.23 1 16 ALA 2.15 0.01 1 17 LYS 5.55 -1.67 1 18 ALA 2.98 -0.97 1 19 GLN -0.61 0.67 1 21 ARG -2.33 1.21 1 22 PHE -4.76 1.97 1 23 GLU 0.09 0.09 1 25 SER -2.33 1.58 1 26 ALA 5.34 -1.17 1 27 VAL 4.27 -1.21 1 28 ASP 2.17 0.22 1 29 LEU 2.97 -0.98 1 30 ALA 3.03 -1.00 1 31 ASP 2.09 -1.02 1 34 ILE -0.85 0.47 1 35 HIS 2.00 0.76 1 36 LEU -1.22 2.14 1 37 SER -3.29 2.98 1 38 ALA -0.45 0.25 1 40 GLU 3.12 -1.10 1 41 GLN -1.32 1.25 1 42 ALA 5.06 -0.85 1 43 GLN 3.56 -0.58 1 44 GLU 3.70 -1.05 1 45 THR 5.95 -0.85 1 46 ALA 3.53 -0.62 1 47 ALA 2.73 -0.20 1 48 LYS 2.34 0.02 1 49 TRP -2.20 1.86 1 50 PHE 0.06 0.01 1 51 ARG 3.09 -0.87 1 53 GLN 0.86 -0.28 1 54 ALA -2.54 1.42 1 55 ASN 2.14 -1.25 1 56 LEU -3.65 2.93 1 57 VAL -4.71 2.48 1 58 LEU -6.80 3.99 1 59 LEU -2.38 0.03 1 60 ALA -4.82 2.64 1 61 VAL -5.17 3.74 1 62 GLU 0.81 -0.53 1 63 ALA 1.95 0.40 1 64 GLU 1.81 -1.05 1 66 LEU 1.64 -0.59 1 68 GLU 1.41 0.47 1 69 ASP -2.44 0.62 1 70 LEU -4.55 2.37 1 71 LYS 0.19 -1.81 1 72 TRP -4.11 2.72 1 73 GLU -1.22 0.97 1 74 ALA -2.79 1.44 1 75 SER 3.92 -1.02 1 76 ARG -1.42 1.07 1 79 ALA -1.55 1.17 1 80 ARG -3.79 3.14 1 81 PHE -8.54 4.24 1 83 HIS -4.24 2.97 1 84 LEU 4.86 -2.73 1 85 TYR 2.94 -1.99 1 86 ARG -4.58 3.15 1 88 LEU 1.05 -0.94 1 89 LEU 6.20 -1.57 1 90 VAL 2.81 -1.29 1 91 SER 0.38 -0.39 1 92 GLU 1.63 -0.59 1 93 VAL 3.12 -0.48 1 94 THR -3.02 2.89 1 95 ARG -6.88 3.69 1 96 GLU -4.13 3.00 1 97 ALA 0.03 0.59 1 98 ASP -3.39 1.83 1 99 LEU -3.78 2.26 1 100 ASP -3.58 1.97 1 101 LEU -1.91 0.01 1 102 ASP 2.65 -0.50 1 103 ALA -0.92 0.80 1 104 ASP 1.79 -0.23 1 106 VAL -0.91 0.11 1 108 GLN 1.94 -0.52 1 109 LEU 3.35 -1.31 1 111 ASP -0.96 2.65 1 112 HIS 0.80 -0.39 1 113 LEU 0.93 -0.60 1 114 ALA 1.07 -0.40 1 115 LEU 0.14 0.24 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15281_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.54 _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 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -0.47 _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 81 PHE -8.54 0.60 0 36 LEU -1.22 0.85 0 10 ARG 5.33 -0.30 1 11 ALA 3.87 -0.07 1 12 GLU 1.32 -0.17 1 13 TRP -1.07 0.28 1 14 ASP 5.20 -0.59 1 15 ALA 3.75 -0.16 1 16 ALA 2.15 0.01 1 17 LYS 5.55 -0.86 1 18 ALA 2.98 -0.22 1 19 GLN -0.61 0.20 1 21 ARG -2.33 0.78 1 22 PHE -4.76 0.56 1 23 GLU 0.09 -0.46 1 25 SER -2.33 0.41 1 26 ALA 5.34 -0.36 1 27 VAL 4.27 -0.53 1 28 ASP 2.17 -0.13 1 29 LEU 2.97 -0.58 1 30 ALA 3.03 -0.32 1 31 ASP 2.09 -0.23 1 33 PHE 0.10 -0.41 1 34 ILE -0.85 -0.35 1 35 HIS 2.00 -0.28 1 37 SER -3.29 0.81 1 38 ALA -0.45 0.65 1 40 GLU 3.12 -0.12 1 41 GLN -1.32 0.41 1 42 ALA 5.06 -0.39 1 43 GLN 3.56 -0.40 1 44 GLU 3.70 -0.14 1 45 THR 5.95 -0.23 1 46 ALA 3.53 -0.07 1 47 ALA 2.73 -0.37 1 48 LYS 2.34 -0.38 1 49 TRP -2.20 0.15 1 50 PHE 0.06 0.30 1 51 ARG 3.09 -0.14 1 53 GLN 0.86 0.10 1 54 ALA -2.54 0.02 1 55 ASN 2.14 -0.14 1 56 LEU -3.65 0.34 1 57 VAL -4.71 0.51 1 58 LEU -6.80 0.42 1 59 LEU -2.38 0.37 1 60 ALA -4.82 0.42 1 61 VAL -5.17 0.12 1 62 GLU 0.81 0.20 1 63 ALA 1.95 -0.33 1 64 GLU 1.81 -0.32 1 66 LEU 1.64 -0.13 1 68 GLU 1.41 -0.05 1 69 ASP -2.44 0.51 1 70 LEU -4.55 0.40 1 71 LYS 0.19 0.06 1 72 TRP -4.11 0.41 1 73 GLU -1.22 0.42 1 74 ALA -2.79 0.38 1 75 SER 3.92 -0.15 1 76 ARG -1.42 0.04 1 79 ALA -1.55 0.29 1 80 ARG -3.79 0.27 1 83 HIS -4.24 0.82 1 84 LEU 4.86 -0.04 1 85 TYR 2.94 0.03 1 86 ARG -4.58 -0.05 1 88 LEU 1.05 0.22 1 89 LEU 6.20 -0.33 1 90 VAL 2.81 -0.19 1 91 SER 0.38 -0.13 1 92 GLU 1.63 -0.07 1 93 VAL 3.12 -0.09 1 94 THR -3.02 0.31 1 95 ARG -6.88 0.98 1 96 GLU -4.13 0.22 1 97 ALA 0.03 0.21 1 98 ASP -3.39 0.43 1 99 LEU -3.78 0.29 1 100 ASP -3.58 0.30 1 101 LEU -1.91 -0.02 1 102 ASP 2.65 -0.22 1 103 ALA -0.92 0.17 1 104 ASP 1.79 -0.36 1 106 VAL -0.91 0.16 1 108 GLN 1.94 -0.01 1 109 LEU 3.35 -0.32 1 111 ASP -0.96 -0.25 1 112 HIS 0.80 -0.19 1 113 LEU 0.93 -0.09 1 114 ALA 1.07 -0.19 1 115 LEU 0.14 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15281_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 -2.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.67 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 2.36 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 ARG -2.33 -4.75 0 33 PHE 0.10 -4.41 0 81 PHE -8.54 -1.15 0 84 LEU 4.86 -2.28 0 10 ARG 5.33 1.55 1 11 ALA 3.87 4.05 1 12 GLU 1.32 2.98 1 13 TRP -1.07 0.73 1 14 ASP 5.20 3.82 1 15 ALA 3.75 2.32 1 16 ALA 2.15 2.30 1 17 LYS 5.55 2.53 1 18 ALA 2.98 1.14 1 19 GLN -0.61 0.61 1 22 PHE -4.76 -1.98 1 23 GLU 0.09 -1.74 1 25 SER -2.33 -0.81 1 26 ALA 5.34 3.30 1 27 VAL 4.27 0.33 1 28 ASP 2.17 2.10 1 29 LEU 2.97 2.49 1 30 ALA 3.03 1.57 1 31 ASP 2.09 0.31 1 34 ILE -0.85 0.62 1 35 HIS 2.00 1.64 1 36 LEU -1.22 -2.79 1 37 SER -3.29 -0.17 1 38 ALA -0.45 1.84 1 40 GLU 3.12 -0.18 1 41 GLN -1.32 1.73 1 42 ALA 5.06 0.03 1 43 GLN 3.56 1.91 1 44 GLU 3.70 2.49 1 45 THR 5.95 1.53 1 46 ALA 3.53 0.83 1 47 ALA 2.73 0.75 1 48 LYS 2.34 2.53 1 49 TRP -2.20 0.82 1 50 PHE 0.06 -1.64 1 51 ARG 3.09 2.83 1 53 GLN 0.86 -3.07 1 54 ALA -2.54 -0.52 1 55 ASN 2.14 -1.13 1 56 LEU -3.65 -0.79 1 57 VAL -4.71 -3.83 1 58 LEU -6.80 -2.25 1 59 LEU -2.38 -2.34 1 60 ALA -4.82 -2.17 1 61 VAL -5.17 -1.63 1 62 GLU 0.81 1.10 1 63 ALA 1.95 2.51 1 64 GLU 1.81 0.93 1 66 LEU 1.64 -0.29 1 68 GLU 1.41 -1.64 1 69 ASP -2.44 -3.34 1 70 LEU -4.55 -1.45 1 71 LYS 0.19 0.29 1 72 TRP -4.11 -1.14 1 73 GLU -1.22 0.00 1 74 ALA -2.79 1.48 1 75 SER -1.42 -1.13 1 79 ALA -1.55 -0.59 1 80 ARG -3.79 -1.59 1 83 HIS -4.24 -0.90 1 85 TYR 2.94 -2.58 1 86 ARG -4.58 -1.65 1 88 LEU 1.05 1.69 1 89 LEU 6.20 2.21 1 90 VAL 2.81 0.73 1 91 SER 0.38 -0.88 1 92 GLU 1.63 -0.21 1 93 VAL 3.12 -0.04 1 94 THR -3.02 -3.31 1 95 ARG -6.88 -2.12 1 96 GLU -4.13 -2.57 1 97 ALA 0.03 -0.21 1 98 ASP -3.39 -1.35 1 99 LEU -3.78 -1.34 1 100 ASP -3.58 0.60 1 101 LEU -1.91 1.88 1 102 ASP 2.65 0.73 1 103 ALA -0.92 -0.19 1 104 ASP 1.79 0.63 1 106 VAL -0.91 0.22 1 108 GLN 1.94 0.55 1 109 LEU 3.35 0.86 1 111 ASP -0.96 3.02 1 112 HIS 0.80 -0.24 1 113 LEU 0.93 -0.11 1 114 ALA 1.07 0.22 1 115 LEU 0.14 -0.24 1 stop_ save_