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 bmr11142_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.99 _LACS_plot.Line_1_terminator_val_y_1 -4.28 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.01 _LACS_plot.Line_2_terminator_val_x_2 8.44 _LACS_plot.Line_2_terminator_val_y_2 4.53 _LACS_plot.Y_axis_chem_shift_offset 2.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 MET 3.97 -2.05 0 46 HIS 5.04 4.31 0 39 MET 5.42 -0.89 0 82 GLN 3.68 -2.60 0 10 GLN 3.77 0.20 1 11 MET 4.70 1.62 1 12 LEU 2.94 0.24 1 13 LEU 5.24 1.67 1 14 ASP 4.57 1.19 1 15 TRP 6.11 2.53 1 17 ARG 4.47 1.66 1 18 ALA 3.52 0.28 1 19 LYS 1.01 -3.24 1 20 THR -0.83 -3.43 1 21 ARG 2.99 -0.15 1 23 TYR 2.08 -1.23 1 24 GLU 0.07 -1.88 1 25 HIS 3.12 0.70 1 26 VAL -1.39 -2.58 1 27 ASP -0.46 -2.61 1 28 ILE 2.80 -0.80 1 29 GLN -2.84 -3.37 1 30 ASN -1.47 -3.31 1 31 PHE 1.93 -0.49 1 32 SER -0.89 -3.08 1 33 SER 5.01 1.50 1 34 SER 3.09 0.70 1 35 TRP 0.65 -2.52 1 36 SER 2.65 1.44 1 37 ASP -0.22 -3.32 1 40 ALA 5.28 1.13 1 41 PHE 4.92 2.58 1 43 ALA 2.21 0.24 1 44 LEU 1.99 0.43 1 45 VAL 4.75 2.56 1 47 ASN 2.79 2.14 1 48 PHE 1.00 0.46 1 49 PHE -0.62 -3.24 1 51 GLU 0.66 -2.79 1 52 ALA 2.36 0.31 1 53 PHE -0.74 -4.21 1 54 ASP -1.65 -4.24 1 55 TYR 4.83 1.37 1 57 GLN -0.27 -2.70 1 58 LEU 0.15 -3.34 1 59 SER -3.99 -4.46 1 61 GLN 2.36 -0.62 1 62 ASN 0.30 -4.65 1 63 ARG 4.85 1.86 1 64 ARG 5.59 2.19 1 65 GLN 3.74 0.79 1 66 ASN 4.49 0.18 1 67 PHE 4.71 1.54 1 68 GLU 3.17 0.73 1 69 VAL 5.48 1.62 1 70 ALA 3.79 1.72 1 71 PHE 2.34 -2.77 1 72 SER 4.97 1.36 1 73 SER 5.33 2.59 1 74 ALA 3.66 0.89 1 75 GLU 3.38 1.16 1 76 THR 4.65 2.09 1 77 HIS 4.41 1.20 1 78 ALA -2.82 -4.15 1 79 ASP 2.70 -1.16 1 83 LEU 0.64 -1.36 1 84 LEU -2.03 -5.32 1 85 ASP -2.23 -3.17 1 86 THR 8.44 4.42 1 87 GLU 3.98 0.21 1 88 ASP 3.33 0.60 1 90 VAL 3.56 0.25 1 91 ARG 2.23 -0.01 1 92 LEU -0.96 -3.05 1 93 ARG 2.75 -0.32 1 94 GLU -2.98 -3.46 1 96 ASP -0.86 -2.19 1 97 TRP 2.30 -1.49 1 98 LYS 5.69 1.17 1 100 VAL 6.62 3.15 1 101 TYR 2.63 0.84 1 102 THR 6.17 2.79 1 103 TYR 4.74 2.22 1 104 ILE 5.47 0.30 1 105 GLN 4.03 1.72 1 106 GLU 2.95 -0.61 1 107 PHE 5.49 2.17 1 108 TYR 5.31 2.26 1 109 ARG 5.23 1.69 1 111 LEU 3.61 0.29 1 112 VAL 5.03 1.32 1 113 GLN 4.38 0.75 1 114 LYS -0.51 -2.36 1 116 LEU -0.31 -1.79 1 117 VAL -2.57 -3.24 1 119 THR -0.31 -2.47 1 127 SER -0.04 -2.27 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11142_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.99 _LACS_plot.Line_1_terminator_val_y_1 -0.29 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -3.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.01 _LACS_plot.Line_2_terminator_val_x_2 8.44 _LACS_plot.Line_2_terminator_val_y_2 -3.91 _LACS_plot.Y_axis_chem_shift_offset 2.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 MET 3.97 -6.02 0 46 HIS 5.04 -0.73 0 39 MET 5.42 -6.31 0 82 GLN 3.68 -6.28 0 10 GLN 3.77 -3.57 1 11 MET 4.70 -3.08 1 12 LEU 2.94 -2.70 1 13 LEU 5.24 -3.57 1 14 ASP 4.57 -3.38 1 15 TRP 6.11 -3.58 1 17 ARG 4.47 -2.81 1 18 ALA 3.52 -3.24 1 19 LYS 1.01 -4.25 1 20 THR -0.83 -2.60 1 21 ARG 2.99 -3.14 1 23 TYR 2.08 -3.31 1 24 GLU 0.07 -1.95 1 25 HIS 3.12 -2.42 1 26 VAL -1.39 -1.19 1 27 ASP -0.46 -2.15 1 28 ILE 2.80 -3.60 1 29 GLN -2.84 -0.53 1 30 ASN -1.47 -1.84 1 31 PHE 1.93 -2.42 1 32 SER -0.89 -2.19 1 33 SER 5.01 -3.51 1 34 SER 3.09 -2.39 1 35 TRP 0.65 -3.17 1 36 SER 2.65 -1.21 1 37 ASP -0.22 -3.10 1 40 ALA 5.28 -4.15 1 41 PHE 4.92 -2.34 1 43 ALA 2.21 -1.97 1 44 LEU 1.99 -1.56 1 45 VAL 4.75 -2.19 1 47 ASN 2.79 -0.65 1 48 PHE 1.00 -0.54 1 49 PHE -0.62 -2.62 1 51 GLU 0.66 -3.45 1 52 ALA 2.36 -2.05 1 53 PHE -0.74 -3.47 1 54 ASP -1.65 -2.59 1 55 TYR 4.83 -3.46 1 57 GLN -0.27 -2.43 1 58 LEU 0.15 -3.49 1 59 SER -3.99 -0.47 1 61 GLN 2.36 -2.98 1 62 ASN 0.30 -4.95 1 63 ARG 4.85 -2.99 1 64 ARG 5.59 -3.40 1 65 GLN 3.74 -2.95 1 66 ASN 4.49 -4.31 1 67 PHE 4.71 -3.17 1 68 GLU 3.17 -2.44 1 69 VAL 5.48 -3.86 1 70 ALA 3.79 -2.07 1 71 PHE 2.34 -5.11 1 72 SER 4.97 -3.61 1 73 SER 5.33 -2.74 1 74 ALA 3.66 -2.77 1 75 GLU 3.38 -2.22 1 76 THR 4.65 -2.56 1 77 HIS 4.41 -3.21 1 78 ALA -2.82 -1.33 1 79 ASP 2.70 -3.86 1 83 LEU 0.64 -2.00 1 84 LEU -2.03 -3.29 1 85 ASP -2.23 -0.94 1 86 THR 8.44 -4.02 1 87 GLU 3.98 -3.77 1 88 ASP 3.33 -2.73 1 90 VAL 3.56 -3.31 1 91 ARG 2.23 -2.24 1 92 LEU -0.96 -2.09 1 93 ARG 2.75 -3.07 1 94 GLU -2.98 -0.48 1 96 ASP -0.86 -1.33 1 97 TRP 2.30 -3.79 1 98 LYS 5.69 -4.52 1 100 VAL 6.62 -3.47 1 101 TYR 2.63 -1.79 1 102 THR 6.17 -3.38 1 103 TYR 4.74 -2.52 1 104 ILE 5.47 -5.17 1 105 GLN 4.03 -2.31 1 106 GLU 2.95 -3.56 1 107 PHE 5.49 -3.32 1 108 TYR 5.31 -3.05 1 109 ARG 5.23 -3.54 1 111 LEU 3.61 -3.32 1 112 VAL 5.03 -3.71 1 113 GLN 4.38 -3.63 1 114 LYS -0.51 -1.85 1 116 LEU -0.31 -1.48 1 117 VAL -2.57 -0.67 1 119 THR -0.31 -2.16 1 127 SER -0.04 -2.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11142_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.99 _LACS_plot.Line_1_terminator_val_y_1 0.09 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.07 _LACS_plot.Line_2_terminator_val_x_2 8.44 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 THR 8.44 -0.34 0 43 ALA 2.21 -1.29 0 98 LYS 5.69 -1.48 0 31 PHE 1.93 0.63 0 10 GLN 3.77 -0.50 1 11 MET 4.70 -0.32 1 12 LEU 2.94 0.03 1 13 LEU 5.24 -0.44 1 14 ASP 4.57 -0.31 1 15 TRP 6.11 -0.25 1 17 ARG 4.47 -0.77 1 18 ALA 3.52 -0.37 1 19 LYS 1.01 -0.46 1 20 THR -0.83 -0.25 1 21 ARG 2.99 -0.38 1 23 TYR 2.08 -0.65 1 24 GLU 0.07 -0.56 1 25 HIS 3.12 -0.62 1 26 VAL -1.39 -0.23 1 27 ASP -0.46 -0.21 1 28 ILE 2.80 -0.78 1 29 GLN -2.84 -0.04 1 30 ASN -1.47 -0.40 1 32 SER -0.89 0.40 1 33 SER 5.01 -0.17 1 34 SER 3.09 -0.04 1 35 TRP 0.65 -0.31 1 36 SER 2.65 0.00 1 37 ASP -0.22 -0.06 1 39 MET 5.42 -0.42 1 40 ALA 5.28 -0.69 1 41 PHE 4.92 -0.06 1 44 LEU 1.99 -0.75 1 45 VAL 4.75 -0.07 1 46 HIS 5.04 -1.37 1 47 ASN 2.79 -0.65 1 48 PHE 1.00 -0.75 1 49 PHE -0.62 0.01 1 51 GLU 0.66 -0.22 1 52 ALA 2.36 -0.40 1 53 PHE -0.74 -0.08 1 54 ASP -1.65 0.33 1 55 TYR 4.83 -0.78 1 57 GLN -0.27 -0.14 1 58 LEU 0.15 0.03 1 59 SER -3.99 -0.14 1 61 GLN 2.36 -0.35 1 62 ASN 0.30 0.11 1 63 ARG 4.85 -0.82 1 64 ARG 5.59 -0.74 1 65 GLN 3.74 -0.52 1 66 ASN 4.49 -0.87 1 67 PHE 4.71 -1.28 1 68 GLU 3.17 -0.49 1 69 VAL 5.48 -0.68 1 70 ALA 3.79 -0.54 1 71 PHE 2.34 0.00 1 72 SER 4.97 -0.14 1 73 SER 5.33 -0.67 1 74 ALA 3.66 -0.27 1 75 GLU 3.38 -0.05 1 76 THR 4.65 -0.62 1 77 HIS 4.41 -0.68 1 78 ALA -2.82 0.17 1 79 ASP 2.70 -0.10 1 82 GLN 3.68 0.19 1 83 LEU 0.64 -0.50 1 84 LEU -2.03 -0.26 1 85 ASP -2.23 -0.30 1 87 GLU 3.98 -0.55 1 88 ASP 3.33 -0.37 1 89 MET 3.97 -0.42 1 90 VAL 3.56 -0.34 1 91 ARG 2.23 -0.30 1 92 LEU -0.96 -0.06 1 93 ARG 2.75 -0.25 1 94 GLU -2.98 0.05 1 96 ASP -0.86 -0.21 1 97 TRP 2.30 0.17 1 100 VAL 6.62 -0.67 1 101 TYR 2.63 -1.20 1 102 THR 6.17 -0.87 1 103 TYR 4.74 -0.65 1 104 ILE 5.47 -0.58 1 105 GLN 4.03 -0.75 1 106 GLU 2.95 -0.18 1 107 PHE 5.49 -0.66 1 108 TYR 5.31 -1.31 1 109 ARG 5.23 -0.72 1 111 LEU 3.61 -0.72 1 112 VAL 5.03 -0.44 1 113 GLN 4.38 -0.42 1 114 LYS -0.51 -0.09 1 116 LEU -0.31 -0.09 1 117 VAL -2.57 -0.05 1 119 THR -0.31 -0.12 1 127 SER -0.04 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11142_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.99 _LACS_plot.Line_1_terminator_val_y_1 -4.49 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.43 _LACS_plot.Line_2_terminator_val_x_2 8.44 _LACS_plot.Line_2_terminator_val_y_2 0.75 _LACS_plot.Y_axis_chem_shift_offset 2.66 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 THR 8.44 -2.01 0 59 SER -3.99 -1.22 0 71 PHE 2.34 3.00 0 10 GLN 3.77 -0.72 1 11 MET 4.70 1.19 1 12 LEU 2.94 -0.22 1 13 LEU 5.24 -1.01 1 14 ASP 4.57 0.80 1 15 TRP 6.11 -1.10 1 17 ARG 4.47 -0.71 1 18 ALA 3.52 0.86 1 19 LYS 1.01 -3.37 1 20 THR -0.83 -2.40 1 21 ARG 2.99 -1.14 1 23 TYR 2.08 -2.00 1 24 GLU 0.07 -3.03 1 25 HIS 3.12 -2.29 1 26 VAL -1.39 -3.68 1 27 ASP -0.46 -4.01 1 28 ILE 2.80 -3.58 1 29 GLN -2.84 -3.77 1 30 ASN -1.47 -3.51 1 31 PHE 1.93 -5.62 1 32 SER -0.89 -0.93 1 33 SER 5.01 0.70 1 34 SER 3.09 -3.48 1 35 TRP 0.65 -0.87 1 36 SER 2.65 -2.03 1 37 ASP -0.22 -3.35 1 39 MET 5.42 -0.43 1 40 ALA 5.28 -0.99 1 41 PHE 4.92 -0.28 1 43 ALA 2.21 -3.18 1 44 LEU 1.99 -2.43 1 45 VAL 4.75 -0.40 1 46 HIS 5.04 -0.80 1 47 ASN 2.79 -0.36 1 48 PHE 1.00 -3.73 1 49 PHE -0.62 -4.70 1 51 GLU 0.66 -1.00 1 52 ALA 2.36 -2.72 1 53 PHE -0.74 -6.07 1 54 ASP -1.65 -1.35 1 55 TYR 4.83 -1.45 1 57 GLN -0.27 -2.24 1 58 LEU 0.15 -3.04 1 61 GLN 2.36 -1.07 1 62 ASN 0.30 -3.56 1 63 ARG 4.85 -2.18 1 64 ARG 5.59 -1.69 1 65 GLN 3.74 -1.65 1 66 ASN 4.49 -0.28 1 67 PHE 4.71 -2.05 1 68 GLU 3.17 1.85 1 69 VAL 5.48 0.46 1 70 ALA 3.79 -0.42 1 72 SER 4.97 0.66 1 73 SER 5.33 -0.87 1 74 ALA 3.66 0.13 1 75 GLU 3.38 -0.25 1 76 THR 4.65 -0.89 1 77 HIS 4.41 -1.39 1 78 ALA -2.82 -5.20 1 79 ASP 2.70 -4.24 1 82 GLN 3.68 -1.23 1 83 LEU 0.64 -2.62 1 84 LEU -2.03 -5.22 1 85 ASP -2.23 -1.71 1 87 GLU 3.98 0.67 1 88 ASP 3.33 -0.77 1 89 MET 3.97 -0.45 1 90 VAL 3.56 -0.81 1 91 ARG 2.23 -1.78 1 92 LEU -0.96 -2.96 1 93 ARG 2.75 -1.90 1 94 GLU -2.98 -4.45 1 96 ASP -0.86 -0.57 1 97 TRP 2.30 -1.10 1 98 LYS 5.69 1.14 1 100 VAL 6.62 -1.51 1 101 TYR 2.63 -1.67 1 102 THR 6.17 -0.76 1 103 TYR 4.74 -2.19 1 104 ILE 5.47 -0.85 1 105 GLN 4.03 0.03 1 106 GLU 2.95 -1.00 1 107 PHE 5.49 -1.50 1 108 TYR 5.31 -1.55 1 109 ARG 5.23 1.37 1 111 LEU 3.61 0.36 1 112 VAL 5.03 2.53 1 113 GLN 4.38 -0.34 1 114 LYS -0.51 -2.43 1 116 LEU -0.31 -3.35 1 117 VAL -2.57 -4.05 1 127 SER -0.04 -3.04 1 stop_ save_