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 bmr34452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.77 _LACS_plot.Line_1_terminator_val_y_1 -2.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _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 8.53 _LACS_plot.Line_2_terminator_val_y_2 5.90 _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 52 LEU -5.77 -1.77 0 48 ARG 4.30 0.32 0 14 ARG 0.84 0.05 1 17 LEU 2.77 2.18 1 18 ALA 3.98 3.48 1 19 GLU 3.08 2.51 1 20 ARG 3.41 2.84 1 21 LEU 4.12 2.29 1 22 ARG 4.31 3.22 1 24 GLN -2.12 -1.92 1 26 VAL 0.24 -0.67 1 27 GLN -0.11 -0.29 1 28 VAL -2.95 -1.89 1 29 ASP -5.27 -2.11 1 30 TYR -2.88 -0.93 1 31 LEU -2.59 -1.28 1 33 LEU 2.06 1.49 1 34 ASP 0.23 -1.47 1 35 TYR 0.19 1.18 1 37 ALA 1.23 0.58 1 39 GLU 0.06 -0.58 1 40 LEU 3.49 3.06 1 41 LEU 4.42 2.74 1 42 ALA 4.19 2.43 1 43 ARG 4.04 2.93 1 44 VAL 5.42 3.89 1 45 ARG 3.43 2.49 1 46 ALA 2.29 2.15 1 47 GLU -1.00 -1.34 1 49 LEU -1.06 -0.24 1 50 ASN -0.99 0.80 1 53 VAL -3.24 -1.58 1 54 VAL -5.67 -3.42 1 55 SER -0.99 -0.25 1 56 SER -3.59 -1.58 1 58 GLN 4.53 3.06 1 60 LEU 4.13 2.79 1 61 GLN 5.09 3.01 1 62 ASN 3.75 2.52 1 63 LEU 3.94 3.15 1 64 TYR 3.71 3.13 1 65 GLN 4.10 2.75 1 66 LEU 1.70 2.07 1 67 ALA 1.70 1.91 1 68 ALA 3.01 0.75 1 69 ALA 2.60 1.66 1 70 ASP -0.87 -0.09 1 71 TRP 6.17 5.32 1 73 GLU 0.71 1.46 1 74 ILE 3.53 1.58 1 76 ARG 1.02 0.94 1 77 LEU 0.81 0.28 1 79 LEU -3.46 -2.40 1 80 PHE -0.72 -0.84 1 81 VAL -3.07 -3.19 1 83 SER -2.19 -0.90 1 85 ARG 3.50 2.74 1 86 VAL 4.20 2.97 1 87 ALA 4.90 3.08 1 88 GLU 3.19 2.48 1 89 MET 2.77 3.37 1 90 ALA 3.62 2.80 1 91 ARG 5.85 4.07 1 92 GLU 3.49 2.57 1 93 LEU -0.26 -0.13 1 95 ALA 1.25 0.59 1 96 GLN -0.84 1.08 1 97 ARG -1.64 -1.81 1 98 VAL 0.44 -0.08 1 99 ILE -1.32 -1.04 1 100 ASP -0.34 -1.13 1 102 ARG 5.03 2.68 1 104 ALA -1.77 -1.17 1 105 SER -1.81 -1.20 1 106 ALA 8.53 6.19 1 108 ALA 3.62 2.25 1 109 LEU 4.04 2.48 1 110 LEU 3.64 2.45 1 111 ALA 3.58 2.00 1 112 ALA 3.02 1.88 1 113 LEU 1.74 1.70 1 114 THR 2.52 1.85 1 115 SER 2.36 1.67 1 116 ALA 1.48 0.88 1 117 ALA 1.13 0.61 1 118 LEU 0.67 0.33 1 119 GLU 0.16 0.13 1 120 HIS -0.07 1.74 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.77 _LACS_plot.Line_1_terminator_val_y_1 2.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _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 8.53 _LACS_plot.Line_2_terminator_val_y_2 -2.63 _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 52 LEU -5.77 4.00 0 48 ARG 4.30 -3.98 0 14 ARG 0.84 -0.79 1 17 LEU 2.77 -0.59 1 18 ALA 3.98 -0.50 1 19 GLU 3.08 -0.57 1 20 ARG 3.41 -0.57 1 21 LEU 4.12 -1.83 1 22 ARG 4.31 -1.09 1 24 GLN -2.12 0.20 1 26 VAL 0.24 -0.91 1 27 GLN -0.11 -0.18 1 28 VAL -2.95 1.06 1 29 ASP -5.27 3.16 1 30 TYR -2.88 1.95 1 31 LEU -2.59 1.31 1 33 LEU 2.06 -0.57 1 34 ASP 0.23 -1.70 1 35 TYR 0.19 0.99 1 37 ALA 1.23 -0.65 1 39 GLU 0.06 -0.64 1 40 LEU 3.49 -0.43 1 41 LEU 4.42 -1.68 1 42 ALA 4.19 -1.76 1 43 ARG 4.04 -1.11 1 44 VAL 5.42 -1.53 1 45 ARG 3.43 -0.94 1 46 ALA 2.29 -0.14 1 47 GLU -1.00 -0.34 1 49 LEU -1.06 0.82 1 50 ASN -0.99 1.79 1 53 VAL -3.24 1.66 1 54 VAL -5.67 2.25 1 55 SER -0.99 0.74 1 56 SER -3.59 2.01 1 58 GLN 4.53 -1.47 1 60 LEU 4.13 -1.34 1 61 GLN 5.09 -2.08 1 62 ASN 3.75 -1.23 1 63 LEU 3.94 -0.79 1 64 TYR 3.71 -0.58 1 65 GLN 4.10 -1.35 1 66 LEU 1.70 0.37 1 67 ALA 1.70 0.21 1 68 ALA 3.01 -2.26 1 69 ALA 2.60 -0.94 1 70 ASP -0.87 0.78 1 71 TRP 6.17 -0.85 1 73 GLU 0.71 0.75 1 74 ILE 3.53 -1.95 1 76 ARG 1.02 -0.08 1 77 LEU 0.81 -0.53 1 79 LEU -3.46 1.06 1 80 PHE -0.72 -0.12 1 81 VAL -3.07 -0.12 1 83 SER -2.19 1.29 1 85 ARG 3.50 -0.76 1 86 VAL 4.20 -1.23 1 87 ALA 4.90 -1.82 1 88 GLU 3.19 -0.71 1 89 MET 2.77 0.60 1 90 ALA 3.62 -0.82 1 91 ARG 5.85 -1.78 1 92 GLU 3.49 -0.92 1 93 LEU -0.26 0.13 1 95 ALA 1.25 -0.66 1 96 GLN -0.84 1.92 1 97 ARG -1.64 -0.17 1 98 VAL 0.44 -0.52 1 99 ILE -1.32 0.28 1 100 ASP -0.34 -0.79 1 102 ARG 5.03 -2.35 1 104 ALA -1.77 0.60 1 105 SER -1.81 0.61 1 106 ALA 8.53 -2.34 1 108 ALA 3.62 -1.37 1 109 LEU 4.04 -1.56 1 110 LEU 3.64 -1.19 1 111 ALA 3.58 -1.58 1 112 ALA 3.02 -1.14 1 113 LEU 1.74 -0.04 1 114 THR 2.52 -0.67 1 115 SER 2.36 -0.69 1 116 ALA 1.48 -0.60 1 117 ALA 1.13 -0.52 1 118 LEU 0.67 -0.34 1 119 GLU 0.16 -0.03 1 120 HIS -0.07 1.81 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.77 _LACS_plot.Line_1_terminator_val_y_1 0.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.02 _LACS_plot.Line_2_terminator_val_x_2 8.53 _LACS_plot.Line_2_terminator_val_y_2 -0.87 _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 64 TYR 3.71 -1.19 0 53 VAL -3.24 0.78 0 81 VAL -3.07 0.79 0 52 LEU -5.77 0.90 0 14 ARG 0.84 -0.31 1 17 LEU 2.77 -0.55 1 18 ALA 3.98 -0.84 1 19 GLU 3.08 -0.51 1 20 ARG 3.41 -0.42 1 21 LEU 4.12 -0.70 1 22 ARG 4.31 -0.07 1 24 GLN -2.12 -0.12 1 26 VAL 0.24 -0.53 1 27 GLN -0.11 -0.17 1 28 VAL -2.95 0.22 1 29 ASP -5.27 0.07 1 30 TYR -2.88 0.30 1 31 LEU -2.59 -0.40 1 33 LEU 2.06 -0.45 1 34 ASP 0.23 -0.26 1 35 TYR 0.19 -0.47 1 37 ALA 1.23 -0.17 1 39 GLU 0.06 0.23 1 40 LEU 3.49 -0.29 1 41 LEU 4.42 -0.57 1 42 ALA 4.19 -0.46 1 43 ARG 4.04 -0.32 1 44 VAL 5.42 -0.74 1 45 ARG 3.43 -0.39 1 46 ALA 2.29 -0.33 1 47 GLU -1.00 -0.26 1 48 ARG 4.30 -0.62 1 49 LEU -1.06 -0.39 1 50 ASN -0.99 -0.04 1 54 VAL -5.67 0.61 1 55 SER -0.99 -0.03 1 56 SER -3.59 0.11 1 58 GLN 4.53 -0.46 1 60 LEU 4.13 -0.36 1 61 GLN 5.09 -0.68 1 62 ASN 3.75 -0.41 1 63 LEU 3.94 -0.46 1 65 GLN 4.10 -0.66 1 66 LEU 1.70 -0.34 1 67 ALA 1.70 -0.53 1 68 ALA 3.01 -0.60 1 69 ALA 2.60 -0.15 1 70 ASP -0.87 0.29 1 71 TRP 6.17 -0.60 1 73 GLU 0.71 -0.45 1 74 ILE 3.53 -0.80 1 76 ARG 1.02 -0.55 1 77 LEU 0.81 -0.55 1 79 LEU -3.46 0.58 1 80 PHE -0.72 0.23 1 83 SER -2.19 0.11 1 85 ARG 3.50 -0.30 1 86 VAL 4.20 -0.46 1 87 ALA 4.90 -0.56 1 88 GLU 3.19 -0.52 1 89 MET 2.77 -0.62 1 90 ALA 3.62 -0.52 1 91 ARG 5.85 -0.28 1 92 GLU 3.49 -0.47 1 93 LEU -0.26 -0.30 1 95 ALA 1.25 -0.45 1 96 GLN -0.84 -0.29 1 97 ARG -1.64 -0.06 1 98 VAL 0.44 0.06 1 99 ILE -1.32 -0.23 1 100 ASP -0.34 -0.43 1 102 ARG 5.03 -0.41 1 104 ALA -1.77 -0.01 1 105 SER -1.81 -0.18 1 106 ALA 8.53 -0.64 1 108 ALA 3.62 -0.31 1 109 LEU 4.04 -0.37 1 110 LEU 3.64 -0.58 1 111 ALA 3.58 -0.35 1 112 ALA 3.02 -0.31 1 113 LEU 1.74 -0.34 1 114 THR 2.52 -0.36 1 115 SER 2.36 -0.32 1 116 ALA 1.48 -0.26 1 117 ALA 1.13 -0.27 1 118 LEU 0.67 -0.28 1 119 GLU 0.16 -0.37 1 120 HIS -0.07 -0.39 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.77 _LACS_plot.Line_1_terminator_val_y_1 -3.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.65 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 5.84 _LACS_plot.Line_2_terminator_val_y_2 2.55 _LACS_plot.Y_axis_chem_shift_offset 0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 LEU -5.77 1.70 0 17 LEU 2.77 -0.66 1 18 ALA 3.98 1.17 1 19 GLU 3.08 3.01 1 20 ARG 3.41 2.87 1 21 LEU 4.12 1.62 1 22 ARG 4.31 4.73 1 24 GLN -2.12 -0.68 1 26 VAL 0.24 -1.06 1 27 GLN -0.11 -1.79 1 28 VAL -2.95 -2.29 1 29 ASP -5.27 -2.59 1 30 TYR -2.88 -0.15 1 33 LEU 2.06 -0.28 1 34 ASP 0.23 -1.30 1 37 ALA 1.23 1.31 1 39 GLU 0.06 1.36 1 40 LEU 3.49 0.16 1 41 LEU 4.42 0.06 1 42 ALA 4.19 2.60 1 43 ARG 4.04 1.49 1 44 VAL 5.42 2.23 1 46 ALA 2.29 1.50 1 47 GLU -1.00 -1.52 1 48 ARG 4.30 -1.32 1 49 LEU -1.06 -0.98 1 50 ASN -0.99 -1.40 1 53 VAL -3.24 -1.30 1 55 SER -0.99 -1.13 1 58 GLN 4.53 2.32 1 60 LEU 4.13 -0.56 1 61 GLN 5.09 2.33 1 62 ASN 3.75 2.09 1 63 LEU 3.94 -0.82 1 64 TYR 3.71 2.10 1 65 GLN 4.10 2.93 1 66 LEU 1.70 -2.77 1 67 ALA 1.70 -0.05 1 68 ALA 3.01 0.79 1 69 ALA 2.60 -0.14 1 70 ASP -0.87 0.21 1 73 GLU 0.71 2.77 1 74 ILE 3.53 0.23 1 76 ARG 1.02 0.19 1 79 LEU -3.46 -3.26 1 80 PHE -0.72 -1.11 1 85 ARG 3.50 2.64 1 86 VAL 4.20 0.83 1 87 ALA 4.90 0.89 1 88 GLU 3.19 2.32 1 89 MET 2.77 2.01 1 90 ALA 3.62 1.47 1 91 ARG 5.85 4.91 1 92 GLU 3.49 1.66 1 93 LEU -0.26 0.23 1 95 ALA 1.25 0.05 1 96 GLN -0.84 -0.36 1 97 ARG -1.64 -4.08 1 98 VAL 0.44 -0.48 1 99 ILE -1.32 -2.46 1 100 ASP -0.34 1.00 1 104 ALA -1.77 -0.30 1 105 SER -1.81 -1.10 1 108 ALA 3.62 3.07 1 109 LEU 4.04 0.63 1 110 LEU 3.64 1.85 1 111 ALA 3.58 1.99 1 112 ALA 3.02 1.65 1 113 LEU 1.74 0.41 1 114 THR 2.52 1.09 1 115 SER 2.36 0.81 1 116 ALA 1.48 0.18 1 117 ALA 1.13 0.38 1 118 LEU 0.67 0.01 1 119 GLU 0.16 -0.29 1 stop_ save_