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 bmr5058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.27 _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 1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 8.02 _LACS_plot.Line_2_terminator_val_y_2 6.49 _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 36 GLU -8.27 -1.81 0 34 ILE -1.90 -3.99 0 10 GLU 1.83 3.44 1 13 PHE 5.16 5.32 1 14 GLU 4.61 3.55 1 15 LYS 2.66 2.34 1 17 ARG 4.06 2.54 1 18 SER 4.06 3.46 1 19 GLU 3.38 3.02 1 21 GLU 3.01 3.02 1 22 LYS 4.07 3.60 1 23 ILE 4.36 3.88 1 24 ARG 3.18 0.58 1 25 LYS 2.31 1.99 1 26 LYS 1.59 2.16 1 27 TYR -2.29 -2.09 1 29 ASP -0.16 -0.85 1 30 ARG -5.42 -2.11 1 31 VAL -3.59 -2.51 1 33 VAL -6.04 -2.76 1 35 VAL -3.18 -2.05 1 37 LYS 0.16 0.02 1 38 ALA 0.52 0.35 1 40 LYS 2.30 0.55 1 41 ALA -1.36 0.33 1 42 ARG 1.43 0.04 1 43 ILE -2.62 -0.77 1 45 ASP -1.97 -0.07 1 46 LEU -3.22 -0.85 1 47 ASP 2.29 1.30 1 48 LYS -2.25 -0.78 1 49 LYS -1.09 0.73 1 50 LYS -2.17 -0.88 1 51 TYR -4.25 -0.61 1 52 LEU -1.15 -1.09 1 53 VAL -1.97 -1.26 1 55 SER 3.35 2.75 1 56 ASP 0.23 -0.59 1 57 LEU -0.79 0.58 1 58 THR -2.56 -0.75 1 59 VAL 5.77 4.57 1 61 GLN 3.58 3.20 1 62 PHE 3.94 3.71 1 63 TYR 4.34 3.69 1 64 PHE 4.99 4.24 1 65 LEU 3.76 3.44 1 66 ILE 4.54 0.49 1 67 ARG 5.14 4.69 1 68 LYS 3.20 2.34 1 69 ARG 2.63 2.54 1 70 ILE 0.61 0.49 1 71 HIS 4.24 1.58 1 72 LEU -1.24 -0.31 1 73 ARG -0.59 -0.50 1 74 ALA 3.82 3.18 1 75 GLU 1.57 0.87 1 76 ASP -0.79 0.59 1 77 ALA -1.88 -0.19 1 78 LEU -2.50 -0.13 1 79 PHE -3.81 -0.41 1 80 PHE -7.52 -5.42 1 81 PHE -5.39 -1.30 1 82 VAL -3.36 -2.05 1 83 ASN 3.33 2.22 1 84 ASN 3.34 2.76 1 85 VAL -3.71 -1.33 1 86 ILE -0.50 -0.16 1 89 THR 4.07 3.18 1 90 SER -0.22 -0.29 1 91 ALA 0.17 0.07 1 92 THR -2.77 -1.68 1 93 MET 5.06 0.64 1 95 GLN 4.65 3.38 1 96 LEU 2.33 2.73 1 97 TYR 4.52 5.30 1 98 GLN 4.66 3.74 1 99 GLU 0.31 1.76 1 100 HIS -2.92 1.75 1 101 HIS 4.78 2.47 1 103 GLU 3.04 2.48 1 104 ASP -0.24 -0.67 1 105 PHE 8.03 3.53 1 106 PHE 0.07 1.74 1 107 LEU -5.55 -1.75 1 108 TYR 0.06 0.11 1 109 ILE -4.05 -1.13 1 110 ALA -7.56 -3.36 1 111 TYR -6.94 -2.76 1 112 SER -3.62 -2.08 1 113 ASP 0.11 -0.07 1 114 GLU -4.87 -1.46 1 115 SER 1.02 0.06 1 116 VAL -2.09 -0.79 1 117 TYR 1.65 1.00 1 119 LEU 0.24 1.35 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.27 _LACS_plot.Line_1_terminator_val_y_1 5.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.51 _LACS_plot.Line_2_terminator_val_x_2 8.02 _LACS_plot.Line_2_terminator_val_y_2 -1.53 _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 36 GLU -8.27 6.46 0 34 ILE -1.90 -2.09 0 10 GLU 1.83 1.61 1 13 PHE 5.16 0.16 1 14 GLU 4.61 -1.06 1 15 LYS 2.66 -0.32 1 17 ARG 4.06 -1.52 1 18 SER 4.06 -0.60 1 19 GLU 3.38 -0.36 1 21 GLU 3.01 0.01 1 22 LYS 4.07 -0.47 1 23 ILE 4.36 -0.48 1 24 ARG 3.18 -2.60 1 25 LYS 2.31 -0.32 1 26 LYS 1.59 0.57 1 27 TYR -2.29 0.20 1 29 ASP -0.16 -0.69 1 30 ARG -5.42 3.31 1 31 VAL -3.59 1.08 1 33 VAL -6.04 3.28 1 35 VAL -3.18 1.13 1 37 LYS 0.16 -0.14 1 38 ALA 0.52 -0.17 1 40 LYS 2.30 -1.75 1 41 ALA -1.36 1.69 1 42 ARG 1.43 -1.39 1 43 ILE -2.62 1.85 1 45 ASP -1.97 1.90 1 46 LEU -3.22 2.37 1 47 ASP 2.29 -0.99 1 48 LYS -2.25 1.47 1 49 LYS -1.09 1.82 1 50 LYS -2.17 1.29 1 51 TYR -4.25 3.64 1 52 LEU -1.15 0.06 1 53 VAL -1.97 0.71 1 55 SER 3.35 -0.60 1 56 ASP 0.23 -0.82 1 57 LEU -0.79 1.37 1 58 THR -2.56 1.81 1 59 VAL 5.77 -1.20 1 61 GLN 3.58 -0.38 1 62 PHE 3.94 -0.23 1 63 TYR 4.34 -0.65 1 64 PHE 4.99 -0.75 1 65 LEU 3.76 -0.32 1 66 ILE 4.54 -4.05 1 67 ARG 5.14 -0.45 1 68 LYS 3.20 -0.86 1 69 ARG 2.63 -0.09 1 70 ILE 0.61 -0.12 1 71 HIS 4.24 -2.66 1 72 LEU -1.24 0.93 1 73 ARG -0.59 0.09 1 74 ALA 3.82 -0.64 1 75 GLU 1.57 -0.70 1 76 ASP -0.79 1.38 1 77 ALA -1.88 1.69 1 78 LEU -2.50 2.37 1 79 PHE -3.81 3.40 1 80 PHE -7.52 2.10 1 81 PHE -5.39 4.09 1 82 VAL -3.36 1.31 1 83 ASN 3.33 -1.11 1 84 ASN 3.34 -0.58 1 85 VAL -3.71 2.38 1 86 ILE -0.50 0.34 1 89 THR 4.07 -0.89 1 90 SER -0.22 -0.07 1 91 ALA 0.17 -0.10 1 92 THR -2.77 1.09 1 93 MET 5.06 -4.42 1 95 GLN 4.65 -1.27 1 96 LEU 2.33 0.40 1 97 TYR 4.52 0.78 1 98 GLN 4.66 -0.92 1 99 GLU 0.31 1.45 1 100 HIS -2.92 4.67 1 101 HIS 4.78 -2.31 1 103 GLU 3.04 -0.56 1 104 ASP -0.24 -0.43 1 105 PHE 8.03 -4.50 1 106 PHE 0.07 1.67 1 107 LEU -5.55 3.80 1 108 TYR 0.06 0.05 1 109 ILE -4.05 2.92 1 110 ALA -7.56 4.20 1 111 TYR -6.94 4.18 1 112 SER -3.62 1.54 1 113 ASP 0.11 -0.18 1 114 GLU -4.87 3.41 1 115 SER 1.02 -0.96 1 116 VAL -2.09 1.30 1 117 TYR 1.65 -0.65 1 119 LEU 0.24 1.11 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.27 _LACS_plot.Line_1_terminator_val_y_1 0.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 8.02 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _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 110 ALA -7.56 2.18 0 111 TYR -6.94 2.15 0 10 GLU 1.83 -0.69 1 13 PHE 5.16 -0.66 1 14 GLU 4.61 -0.59 1 15 LYS 2.66 -0.12 1 17 ARG 4.06 0.11 1 18 SER 4.06 -0.20 1 19 GLU 3.38 -0.24 1 21 GLU 3.01 -1.16 1 22 LYS 4.07 -0.44 1 23 ILE 4.36 -0.42 1 24 ARG 3.18 -0.32 1 25 LYS 2.31 -0.36 1 26 LYS 1.59 -0.51 1 27 TYR -2.29 0.25 1 29 ASP -0.16 0.03 1 30 ARG -5.42 0.56 1 31 VAL -3.59 -0.29 1 33 VAL -6.04 0.99 1 34 ILE -1.90 0.75 1 35 VAL -3.18 1.60 1 36 GLU -8.27 0.62 1 37 LYS 0.16 -1.26 1 38 ALA 0.52 -0.20 1 40 LYS 2.30 -0.27 1 41 ALA -1.36 0.17 1 42 ARG 1.43 0.14 1 43 ILE -2.62 0.27 1 45 ASP -1.97 0.14 1 46 LEU -3.22 0.08 1 47 ASP 2.29 -0.24 1 48 LYS -2.25 0.18 1 49 LYS -1.09 0.71 1 50 LYS -2.17 0.78 1 51 TYR -4.25 -0.09 1 52 LEU -1.15 0.51 1 53 VAL -1.97 0.37 1 55 SER 3.35 -0.78 1 56 ASP 0.23 -0.10 1 57 LEU -0.79 -0.07 1 58 THR -2.56 0.64 1 59 VAL 5.77 -0.44 1 61 GLN 3.58 -0.07 1 62 PHE 3.94 -0.16 1 63 TYR 4.34 -0.61 1 64 PHE 4.99 -0.59 1 65 LEU 3.76 -0.40 1 66 ILE 4.54 -0.74 1 67 ARG 5.14 -0.94 1 68 LYS 3.20 -0.32 1 69 ARG 2.63 -0.33 1 70 ILE 0.61 0.01 1 71 HIS 4.24 -0.52 1 72 LEU -1.24 0.14 1 73 ARG -0.59 0.02 1 74 ALA 3.82 -0.46 1 75 GLU 1.57 -0.25 1 76 ASP -0.79 0.00 1 77 ALA -1.88 -0.28 1 78 LEU -2.50 0.20 1 79 PHE -3.81 0.08 1 80 PHE -7.52 1.38 1 81 PHE -5.39 0.46 1 82 VAL -3.36 0.43 1 83 ASN 3.33 -0.42 1 84 ASN 3.34 -0.68 1 85 VAL -3.71 0.56 1 86 ILE -0.50 0.75 1 89 THR 4.07 -0.48 1 90 SER -0.22 -0.04 1 91 ALA 0.17 0.19 1 92 THR -2.77 0.55 1 93 MET 5.06 -0.14 1 95 GLN 4.65 -0.19 1 96 LEU 2.33 -0.09 1 97 TYR 4.52 -0.69 1 98 GLN 4.66 -0.28 1 99 GLU 0.31 -0.35 1 100 HIS -2.92 0.05 1 101 HIS 4.78 -0.47 1 103 GLU 3.04 -0.26 1 104 ASP -0.24 -0.51 1 105 PHE 8.03 -1.01 1 106 PHE 0.07 0.15 1 107 LEU -5.55 0.36 1 108 TYR 0.06 0.12 1 109 ILE -4.05 0.65 1 112 SER -3.62 0.18 1 113 ASP 0.11 0.19 1 114 GLU -4.87 0.29 1 115 SER 1.02 -1.06 1 116 VAL -2.09 0.01 1 117 TYR 1.65 -0.82 1 119 LEU 0.24 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.27 _LACS_plot.Line_1_terminator_val_y_1 -3.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.00 _LACS_plot.Line_2_terminator_val_x_2 8.02 _LACS_plot.Line_2_terminator_val_y_2 3.07 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 110 ALA -7.56 -0.11 0 105 PHE 8.03 -0.49 0 100 HIS -2.92 3.07 0 13 PHE 5.16 -0.02 1 14 GLU 4.61 2.68 1 17 ARG 4.06 1.78 1 18 SER 4.06 2.53 1 19 GLU 3.38 2.27 1 21 GLU 3.01 2.49 1 22 LYS 4.07 3.09 1 23 ILE 4.36 1.52 1 24 ARG 3.18 2.04 1 25 LYS 2.31 1.39 1 26 LYS 1.59 -0.25 1 29 ASP -0.16 -0.72 1 30 ARG -5.42 -1.90 1 33 VAL -6.04 -2.32 1 34 ILE -1.90 -1.56 1 35 VAL -3.18 -0.56 1 36 GLU -8.27 -2.21 1 37 LYS 0.16 0.36 1 40 LYS 2.30 -0.21 1 41 ALA -1.36 0.76 1 42 ARG 1.43 -0.52 1 43 ILE -2.62 -2.53 1 45 ASP -1.97 -0.61 1 46 LEU -3.22 -0.78 1 47 ASP 2.29 -0.80 1 48 LYS -2.25 -1.61 1 49 LYS -1.09 -2.51 1 50 LYS -2.17 -1.77 1 51 TYR -4.25 -2.03 1 52 LEU -1.15 -1.06 1 55 SER 3.35 0.10 1 56 ASP 0.23 -0.09 1 57 LEU -0.79 -0.47 1 58 THR -2.56 1.66 1 59 VAL 5.77 2.52 1 61 GLN 3.58 3.38 1 62 PHE 3.94 1.80 1 63 TYR 4.34 2.24 1 64 PHE 4.99 1.67 1 65 LEU 3.76 1.87 1 66 ILE 4.54 1.40 1 67 ARG 5.14 2.23 1 68 LYS 3.20 2.79 1 69 ARG 2.63 1.58 1 70 ILE 0.61 -1.42 1 71 HIS 4.24 0.68 1 72 LEU -1.24 0.50 1 73 ARG -0.59 1.85 1 74 ALA 3.82 1.15 1 75 GLU 1.57 0.08 1 76 ASP -0.79 -0.95 1 77 ALA -1.88 -2.65 1 78 LEU -2.50 -4.29 1 79 PHE -3.81 -1.54 1 80 PHE -7.52 -2.05 1 81 PHE -5.39 -0.07 1 82 VAL -3.36 -0.91 1 83 ASN 3.33 -0.53 1 84 ASN 3.34 -1.38 1 85 VAL -3.71 -1.51 1 89 THR 4.07 0.82 1 90 SER -0.22 0.66 1 91 ALA 0.17 -0.82 1 92 THR -2.77 1.60 1 93 MET 5.06 3.33 1 95 GLN 4.65 3.46 1 96 LEU 2.33 1.34 1 97 TYR 4.52 2.09 1 98 GLN 4.66 1.24 1 99 GLU 0.31 1.60 1 104 ASP -0.24 -2.40 1 106 PHE 0.07 -1.17 1 107 LEU -5.55 -4.72 1 108 TYR 0.06 -0.87 1 109 ILE -4.05 -1.85 1 111 TYR -6.94 -2.18 1 112 SER -3.62 -2.17 1 113 ASP 0.11 -1.33 1 114 GLU -4.87 -1.51 1 115 SER 1.02 -1.14 1 116 VAL -2.09 -1.56 1 117 TYR 1.65 -0.40 1 stop_ save_