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 bmr30575_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.95 _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 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.38 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 5.61 _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 82 TYR 4.33 4.84 0 90 HIS 4.98 5.35 0 10 GLN -0.10 0.14 1 11 ARG 0.13 0.22 1 12 ASP -0.37 0.27 1 14 LEU 4.61 2.98 1 15 GLN 4.43 3.08 1 16 ALA 3.59 2.63 1 17 LEU 3.44 2.80 1 18 ARG 4.77 3.75 1 19 ARG 4.62 3.58 1 20 ARG 3.99 3.02 1 21 ASN 4.14 2.34 1 22 GLN 4.32 2.98 1 23 GLU 3.47 2.79 1 24 LEU 3.46 2.81 1 25 LYS 4.83 4.01 1 26 GLN 4.77 3.49 1 27 GLN 3.60 3.63 1 28 VAL 6.69 5.25 1 29 ASP 4.88 3.63 1 30 SER 4.49 3.44 1 31 LEU 3.06 2.79 1 32 LEU 4.18 2.76 1 33 SER 4.95 3.80 1 34 GLU 2.64 2.55 1 35 SER 2.66 2.47 1 36 GLN 0.17 0.09 1 37 LEU -0.08 -0.28 1 38 LYS 3.66 2.63 1 39 GLU 2.71 1.89 1 40 ALA 1.00 0.73 1 41 LEU 0.05 -0.31 1 42 GLU 0.79 0.86 1 44 ASN 4.31 3.07 1 45 LYS 3.02 2.03 1 46 ARG 4.93 4.34 1 47 GLN 4.69 3.26 1 48 HIS 3.86 4.23 1 49 ILE 5.32 3.98 1 50 TYR 5.07 4.56 1 51 GLN 4.63 3.24 1 52 ARG 3.59 2.35 1 54 ILE 4.77 2.91 1 55 GLN 4.19 3.41 1 56 LEU 2.77 2.54 1 57 LYS 5.15 4.06 1 58 GLN 4.98 3.49 1 59 ALA 2.97 2.51 1 60 ILE 5.23 4.57 1 61 ASP 4.77 3.59 1 62 GLU 3.55 2.65 1 63 ASN 4.90 2.80 1 64 LYS 4.91 4.36 1 65 ASN 3.77 3.09 1 66 ALA 3.61 2.73 1 67 LEU 2.57 2.52 1 68 GLN 3.37 2.38 1 69 LYS 0.73 0.70 1 70 LEU 1.25 0.90 1 71 SER -1.95 -0.59 1 72 LYS 2.91 2.12 1 73 ALA 1.13 0.84 1 74 ASP -0.07 0.67 1 75 GLU -0.11 -0.05 1 76 SER 1.52 1.41 1 77 ALA -0.94 -0.07 1 79 VAL -1.39 -0.59 1 80 ALA 1.69 1.22 1 81 ASN 1.99 0.57 1 83 ASN 4.65 3.27 1 84 GLN 4.55 3.39 1 85 ARG 3.21 2.68 1 86 LYS 5.82 4.64 1 87 GLU 3.53 2.73 1 88 GLU 3.57 2.99 1 89 GLU 2.11 1.61 1 91 THR 5.87 4.76 1 92 LEU 4.57 3.45 1 93 LEU 4.52 3.24 1 94 ASP 4.48 3.39 1 95 LYS 4.83 3.61 1 96 LEU 3.68 3.00 1 97 THR 7.40 6.38 1 98 GLN 4.56 3.47 1 99 GLN 3.52 3.71 1 100 LEU 3.04 2.66 1 101 GLN 4.59 3.24 1 103 LEU 3.24 2.38 1 104 ALA 4.05 3.12 1 105 VAL 4.33 3.32 1 106 THR 4.56 3.92 1 107 ILE 1.60 1.25 1 108 SER 1.23 1.05 1 109 ARG 1.16 0.96 1 110 GLU 0.08 0.27 1 111 ASN 0.45 0.29 1 112 ILE 0.33 0.29 1 113 THR 0.36 0.31 1 114 GLU -0.67 -0.34 1 115 VAL 0.71 0.43 1 117 ALA -0.26 -0.09 1 119 THR 2.57 1.27 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30575_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.95 _LACS_plot.Line_1_terminator_val_y_1 1.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.62 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -1.79 _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 82 TYR 4.33 0.51 0 90 HIS 4.98 0.37 0 10 GLN -0.10 0.24 1 11 ARG 0.13 0.09 1 12 ASP -0.37 0.64 1 14 LEU 4.61 -1.63 1 15 GLN 4.43 -1.35 1 16 ALA 3.59 -0.96 1 17 LEU 3.44 -0.64 1 18 ARG 4.77 -1.02 1 19 ARG 4.62 -1.04 1 20 ARG 3.99 -0.97 1 21 ASN 4.14 -1.80 1 22 GLN 4.32 -1.34 1 23 GLU 3.47 -0.68 1 24 LEU 3.46 -0.65 1 25 LYS 4.83 -0.82 1 26 GLN 4.77 -1.28 1 27 GLN 3.60 0.03 1 28 VAL 6.69 -1.44 1 29 ASP 4.88 -1.25 1 30 SER 4.49 -1.05 1 31 LEU 3.06 -0.27 1 32 LEU 4.18 -1.42 1 33 SER 4.95 -1.15 1 34 GLU 2.64 -0.09 1 35 SER 2.66 -0.19 1 36 GLN 0.17 -0.08 1 37 LEU -0.08 -0.20 1 38 LYS 3.66 -1.03 1 39 GLU 2.71 -0.82 1 40 ALA 1.00 -0.27 1 41 LEU 0.05 -0.36 1 42 GLU 0.79 0.07 1 44 ASN 4.31 -1.24 1 45 LYS 3.02 -0.99 1 46 ARG 4.93 -0.59 1 47 GLN 4.69 -1.43 1 48 HIS 3.86 0.37 1 49 ILE 5.32 -1.34 1 50 TYR 5.07 -0.51 1 51 GLN 4.63 -1.39 1 52 ARG 3.59 -1.24 1 54 ILE 4.77 -1.86 1 55 GLN 4.19 -0.78 1 56 LEU 2.77 -0.23 1 57 LYS 5.15 -1.09 1 58 GLN 4.98 -1.49 1 59 ALA 2.97 -0.46 1 60 ILE 5.23 -0.66 1 61 ASP 4.77 -1.18 1 62 GLU 3.55 -0.90 1 63 ASN 4.90 -2.10 1 64 LYS 4.91 -0.55 1 65 ASN 3.77 -0.68 1 66 ALA 3.61 -0.88 1 67 LEU 2.57 -0.05 1 68 GLN 3.37 -0.99 1 69 LYS 0.73 -0.03 1 70 LEU 1.25 -0.35 1 71 SER -1.95 1.36 1 72 LYS 2.91 -0.79 1 73 ALA 1.13 -0.29 1 74 ASP -0.07 0.74 1 75 GLU -0.11 0.06 1 76 SER 1.52 -0.11 1 77 ALA -0.94 0.87 1 79 VAL -1.39 0.80 1 80 ALA 1.69 -0.47 1 81 ASN 1.99 -1.42 1 83 ASN 4.65 -1.38 1 84 GLN 4.55 -1.16 1 85 ARG 3.21 -0.53 1 86 LYS 5.82 -1.18 1 87 GLU 3.53 -0.80 1 88 GLU 3.57 -0.58 1 89 GLU 2.11 -0.50 1 91 THR 5.87 -1.11 1 92 LEU 4.57 -1.12 1 93 LEU 4.52 -1.28 1 94 ASP 4.48 -1.09 1 95 LYS 4.83 -1.22 1 96 LEU 3.68 -0.68 1 97 THR 7.40 -1.02 1 98 GLN 4.56 -1.09 1 99 GLN 3.52 0.19 1 100 LEU 3.04 -0.38 1 101 GLN 4.59 -1.35 1 103 LEU 3.24 -0.86 1 104 ALA 4.05 -0.93 1 105 VAL 4.33 -1.01 1 106 THR 4.56 -0.64 1 107 ILE 1.60 -0.35 1 108 SER 1.23 -0.18 1 109 ARG 1.16 -0.20 1 110 GLU 0.08 0.19 1 111 ASN 0.45 -0.16 1 112 ILE 0.33 -0.04 1 113 THR 0.36 -0.05 1 114 GLU -0.67 0.33 1 115 VAL 0.71 -0.28 1 117 ALA -0.26 0.17 1 119 THR 2.57 -1.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30575_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.95 _LACS_plot.Line_1_terminator_val_y_1 0.13 _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 0.15 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 LYS 2.91 -0.65 0 82 TYR 4.33 -0.77 0 10 GLN -0.10 -0.03 1 11 ARG 0.13 0.00 1 12 ASP -0.37 0.11 1 14 LEU 4.61 -0.17 1 15 GLN 4.43 -0.34 1 16 ALA 3.59 -0.20 1 17 LEU 3.44 -0.29 1 18 ARG 4.77 -0.26 1 19 ARG 4.62 -0.23 1 20 ARG 3.99 -0.21 1 21 ASN 4.14 -0.27 1 22 GLN 4.32 -0.28 1 23 GLU 3.47 -0.20 1 24 LEU 3.46 -0.22 1 25 LYS 4.83 -0.42 1 26 GLN 4.77 -0.17 1 27 GLN 3.60 -0.24 1 28 VAL 6.69 -0.63 1 29 ASP 4.88 -0.30 1 30 SER 4.49 -0.20 1 31 LEU 3.06 -0.13 1 32 LEU 4.18 -0.37 1 33 SER 4.95 -0.24 1 34 GLU 2.64 -0.26 1 35 SER 2.66 -0.35 1 36 GLN 0.17 0.01 1 37 LEU -0.08 0.08 1 38 LYS 3.66 -0.24 1 39 GLU 2.71 -0.18 1 40 ALA 1.00 -0.20 1 41 LEU 0.05 -0.05 1 42 GLU 0.79 -0.10 1 44 ASN 4.31 -0.22 1 45 LYS 3.02 -0.04 1 46 ARG 4.93 -0.38 1 47 GLN 4.69 -0.16 1 48 HIS 3.86 -0.21 1 49 ILE 5.32 -0.59 1 50 TYR 5.07 -0.52 1 51 GLN 4.63 -0.48 1 52 ARG 3.59 -0.30 1 54 ILE 4.77 -0.57 1 55 GLN 4.19 -0.27 1 56 LEU 2.77 -0.19 1 57 LYS 5.15 -0.44 1 58 GLN 4.98 -0.19 1 59 ALA 2.97 -0.12 1 60 ILE 5.23 -0.70 1 61 ASP 4.77 -0.29 1 62 GLU 3.55 -0.18 1 63 ASN 4.90 -0.25 1 64 LYS 4.91 -0.47 1 65 ASN 3.77 -0.28 1 66 ALA 3.61 -0.26 1 67 LEU 2.57 -0.48 1 68 GLN 3.37 -0.16 1 69 LYS 0.73 -0.08 1 70 LEU 1.25 -0.01 1 71 SER -1.95 0.29 1 73 ALA 1.13 -0.18 1 74 ASP -0.07 -0.07 1 75 GLU -0.11 -0.05 1 76 SER 1.52 -0.09 1 77 ALA -0.94 0.10 1 79 VAL -1.39 0.09 1 80 ALA 1.69 -0.09 1 81 ASN 1.99 -0.01 1 83 ASN 4.65 -0.42 1 84 GLN 4.55 -0.23 1 85 ARG 3.21 -0.22 1 86 LYS 5.82 -0.63 1 87 GLU 3.53 -0.16 1 88 GLU 3.57 -0.27 1 89 GLU 2.11 -0.11 1 90 HIS 4.98 -0.73 1 91 THR 5.87 -0.40 1 92 LEU 4.57 -0.13 1 93 LEU 4.52 -0.38 1 94 ASP 4.48 -0.18 1 95 LYS 4.83 -0.20 1 96 LEU 3.68 -0.06 1 97 THR 7.40 -0.66 1 98 GLN 4.56 -0.25 1 99 GLN 3.52 -0.26 1 100 LEU 3.04 -0.21 1 101 GLN 4.59 -0.22 1 103 LEU 3.24 0.00 1 104 ALA 4.05 -0.26 1 105 VAL 4.33 -0.22 1 106 THR 4.56 -0.29 1 107 ILE 1.60 -0.04 1 108 SER 1.23 -0.20 1 109 ARG 1.16 -0.05 1 110 GLU 0.08 -0.10 1 111 ASN 0.45 -0.04 1 112 ILE 0.33 0.07 1 113 THR 0.36 -0.01 1 114 GLU -0.67 -0.01 1 115 VAL 0.71 -0.03 1 117 ALA -0.26 0.00 1 119 THR 2.57 0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30575_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.95 _LACS_plot.Line_1_terminator_val_y_1 -0.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.80 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 3.77 _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 71 SER -1.95 0.94 0 14 LEU 4.61 -1.14 0 10 GLN -0.10 -0.21 1 11 ARG 0.13 -0.71 1 15 GLN 4.43 2.63 1 16 ALA 3.59 2.80 1 17 LEU 3.44 0.88 1 18 ARG 4.77 3.74 1 19 ARG 4.62 3.25 1 20 ARG 3.99 3.17 1 21 ASN 4.14 2.79 1 22 GLN 4.32 3.12 1 23 GLU 3.47 3.06 1 24 LEU 3.46 1.07 1 25 LYS 4.83 1.14 1 26 GLN 4.77 3.56 1 27 GLN 3.60 3.61 1 28 VAL 6.69 0.76 1 29 ASP 4.88 3.87 1 30 SER 4.49 1.99 1 31 LEU 3.06 1.64 1 32 LEU 4.18 3.85 1 33 SER 4.95 2.97 1 34 GLU 2.64 2.45 1 35 SER 2.66 -0.56 1 36 GLN 0.17 0.44 1 37 LEU -0.08 1.18 1 38 LYS 3.66 2.12 1 39 GLU 2.71 0.05 1 40 ALA 1.00 -1.00 1 41 LEU 0.05 0.53 1 44 ASN 4.31 2.74 1 45 LYS 3.02 2.31 1 46 ARG 4.93 2.12 1 47 GLN 4.69 4.23 1 49 ILE 5.32 1.44 1 50 TYR 5.07 1.24 1 51 GLN 4.63 3.42 1 52 ARG 3.59 1.93 1 54 ILE 4.77 2.64 1 55 GLN 4.19 3.99 1 56 LEU 2.77 0.93 1 57 LYS 5.15 1.88 1 58 GLN 4.98 2.46 1 59 ALA 2.97 2.66 1 60 ILE 5.23 1.49 1 61 ASP 4.77 3.36 1 62 GLU 3.55 3.09 1 63 ASN 4.90 2.61 1 64 LYS 4.91 2.75 1 65 ASN 3.77 2.49 1 66 ALA 3.61 2.98 1 67 LEU 2.57 1.28 1 68 GLN 3.37 1.84 1 69 LYS 0.73 0.84 1 70 LEU 1.25 -0.10 1 72 LYS 2.91 0.69 1 73 ALA 1.13 0.10 1 74 ASP -0.07 0.21 1 75 GLU -0.11 0.24 1 76 SER 1.52 -0.42 1 79 VAL -1.39 -0.02 1 80 ALA 1.69 0.69 1 81 ASN 1.99 0.21 1 82 TYR 4.33 0.76 1 83 ASN 4.65 2.80 1 84 GLN 4.55 2.49 1 85 ARG 3.21 3.27 1 86 LYS 5.82 1.98 1 87 GLU 3.53 1.23 1 88 GLU 3.57 1.72 1 89 GLU 2.11 1.60 1 90 HIS 4.98 3.56 1 91 THR 5.87 1.80 1 92 LEU 4.57 0.93 1 93 LEU 4.52 2.30 1 94 ASP 4.48 2.50 1 95 LYS 4.83 2.96 1 96 LEU 3.68 1.85 1 97 THR 7.40 1.74 1 98 GLN 4.56 3.75 1 99 GLN 3.52 3.93 1 100 LEU 3.04 1.37 1 101 GLN 4.59 2.71 1 103 LEU 3.24 0.41 1 104 ALA 4.05 2.56 1 105 VAL 4.33 2.05 1 106 THR 4.56 1.88 1 107 ILE 1.60 0.24 1 108 SER 1.23 0.47 1 109 ARG 1.16 0.30 1 110 GLU 0.08 -0.27 1 111 ASN 0.45 -0.04 1 112 ILE 0.33 0.04 1 113 THR 0.36 -0.24 1 114 GLU -0.67 -0.18 1 115 VAL 0.71 0.46 1 stop_ save_