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 bmr26776_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.74 _LACS_plot.Line_1_terminator_val_y_1 -2.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 5.40 _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 67 MET -4.12 0.66 0 13 SER -0.09 0.16 1 14 ARG -2.16 -0.88 1 15 THR -0.24 0.33 1 16 VAL -3.97 -2.25 1 17 LEU -4.21 -2.20 1 18 ALA -3.30 -2.30 1 19 VAL -1.96 -2.21 1 20 ASP -1.40 1.06 1 21 ASP 2.08 1.03 1 22 SER -1.86 -2.35 1 24 SER 4.54 2.72 1 25 VAL 4.78 3.82 1 26 ARG 4.93 4.87 1 27 SER 4.02 3.04 1 28 MET 4.14 3.58 1 29 VAL 5.99 4.84 1 30 ALA 4.15 3.15 1 31 MET 4.48 3.72 1 32 THR 6.33 5.18 1 33 LEU 3.75 2.32 1 34 ARG 4.71 3.69 1 35 GLU 3.20 2.42 1 36 ALA -1.57 -0.85 1 38 TYR 0.71 0.16 1 39 ARG -0.11 -0.43 1 40 VAL -3.67 -1.82 1 41 ILE -3.37 -1.68 1 42 GLU -5.74 -1.26 1 43 ALA -5.73 -1.95 1 44 THR 0.59 0.88 1 45 ASP -0.37 -0.37 1 47 ARG 4.17 2.63 1 48 GLU 1.38 2.07 1 50 LEU 3.52 3.14 1 51 GLU 3.35 2.69 1 52 LYS 3.33 3.03 1 53 ALA 3.20 1.87 1 54 LEU 0.13 -0.22 1 55 SER -0.18 1.17 1 56 GLU -2.21 -0.62 1 58 VAL -2.90 -1.28 1 59 ASP -0.90 1.57 1 60 ALA -4.79 -1.27 1 61 ILE -4.50 -0.92 1 62 ILE -3.15 -1.88 1 63 THR -4.55 -3.31 1 64 ASP -5.16 -2.24 1 65 GLN 1.15 0.23 1 66 ASN 3.19 1.53 1 69 ASN 7.39 6.07 1 70 LEU -1.03 0.97 1 71 ASP -0.90 -1.26 1 73 LEU 4.34 3.72 1 75 PHE 2.75 1.16 1 76 ILE 5.19 1.70 1 77 ARG 5.02 4.43 1 78 ALA 2.76 2.36 1 79 PHE 2.08 2.25 1 80 ARG 2.73 0.86 1 81 GLU 0.53 0.45 1 82 HIS 0.39 0.46 1 84 GLU 3.85 2.99 1 85 SER 0.98 0.93 1 86 LYS 3.65 2.32 1 88 LYS -0.37 -1.23 1 90 ILE -4.80 -1.43 1 91 ILE -4.61 -2.51 1 92 PHE -5.10 -1.57 1 93 LEU -3.64 -2.08 1 94 SER -4.29 -2.37 1 95 THR 3.07 2.69 1 96 ASP -0.78 0.42 1 97 SER -2.39 -1.32 1 98 ALA 0.65 0.58 1 99 ASP 4.24 3.63 1 100 THR 4.60 2.80 1 101 LEU 2.97 1.92 1 102 LYS 4.62 3.40 1 103 GLN 4.88 2.92 1 104 GLN 3.34 3.45 1 105 ALA 4.54 2.64 1 106 ARG 4.77 3.42 1 107 GLU 3.19 2.42 1 108 ALA 0.32 -0.29 1 110 ALA -0.03 0.30 1 111 MET -0.65 0.23 1 113 TRP -0.67 -0.33 1 114 MET -3.73 -0.62 1 115 VAL -2.02 -1.96 1 116 LYS -0.87 0.87 1 118 PHE -5.63 -3.20 1 119 THR -3.89 -2.71 1 120 GLN 3.51 2.95 1 122 GLN 3.20 2.48 1 123 LEU 3.60 2.45 1 124 LEU 3.65 2.55 1 125 ALA 4.95 3.85 1 126 VAL 3.41 0.60 1 127 ILE 3.86 2.74 1 128 LYS 3.27 2.71 1 129 LYS 2.14 1.15 1 130 VAL -0.70 0.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26776_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.74 _LACS_plot.Line_1_terminator_val_y_1 3.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 -1.99 _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 67 MET -4.12 4.78 0 13 SER -0.09 0.25 1 14 ARG -2.16 1.28 1 15 THR -0.24 0.57 1 16 VAL -3.97 1.72 1 17 LEU -4.21 2.01 1 18 ALA -3.30 1.00 1 19 VAL -1.96 -0.25 1 20 ASP -1.40 2.46 1 21 ASP 2.08 -1.05 1 22 SER -1.86 -0.49 1 24 SER 4.54 -1.82 1 25 VAL 4.78 -0.96 1 26 ARG 4.93 -0.06 1 27 SER 4.02 -0.98 1 28 MET 4.14 -0.56 1 29 VAL 5.99 -1.15 1 30 ALA 4.15 -1.00 1 31 MET 4.48 -0.76 1 32 THR 6.33 -1.15 1 33 LEU 3.75 -1.43 1 34 ARG 4.71 -1.02 1 35 GLU 3.20 -0.78 1 36 ALA -1.57 0.72 1 38 TYR 0.71 -0.55 1 39 ARG -0.11 -0.32 1 40 VAL -3.67 1.85 1 41 ILE -3.37 1.69 1 42 GLU -5.74 4.48 1 43 ALA -5.73 3.78 1 44 THR 0.59 0.29 1 45 ASP -0.37 0.00 1 47 ARG 4.17 -1.54 1 48 GLU 1.38 0.69 1 50 LEU 3.52 -0.38 1 51 GLU 3.35 -0.66 1 52 LYS 3.33 -0.30 1 53 ALA 3.20 -1.33 1 54 LEU 0.13 -0.35 1 55 SER -0.18 1.35 1 56 GLU -2.21 1.59 1 58 VAL -2.90 1.62 1 59 ASP -0.90 2.47 1 60 ALA -4.79 3.52 1 61 ILE -4.50 3.58 1 62 ILE -3.15 1.27 1 63 THR -4.55 1.24 1 64 ASP -5.16 2.92 1 65 GLN 1.15 -0.92 1 66 ASN 3.19 -1.66 1 69 ASN 7.39 -1.32 1 70 LEU -1.03 2.00 1 71 ASP -0.90 -0.36 1 73 LEU 4.34 -0.62 1 75 PHE 2.75 -1.59 1 76 ILE 5.19 -3.49 1 77 ARG 5.02 -0.59 1 78 ALA 2.76 -0.40 1 79 PHE 2.08 0.17 1 80 ARG 2.73 -1.87 1 81 GLU 0.53 -0.08 1 82 HIS 0.39 0.07 1 84 GLU 3.85 -0.86 1 85 SER 0.98 -0.05 1 86 LYS 3.65 -1.33 1 88 LYS -0.37 -0.86 1 90 ILE -4.80 3.37 1 91 ILE -4.61 2.10 1 92 PHE -5.10 3.53 1 93 LEU -3.64 1.56 1 94 SER -4.29 1.92 1 95 THR 3.07 -0.38 1 96 ASP -0.78 1.20 1 97 SER -2.39 1.07 1 98 ALA 0.65 -0.07 1 99 ASP 4.24 -0.61 1 100 THR 4.60 -1.80 1 101 LEU 2.97 -1.05 1 102 LYS 4.62 -1.22 1 103 GLN 4.88 -1.96 1 104 GLN 3.34 0.11 1 105 ALA 4.54 -1.90 1 106 ARG 4.77 -1.35 1 107 GLU 3.19 -0.77 1 108 ALA 0.32 -0.61 1 110 ALA -0.03 0.33 1 111 MET -0.65 0.88 1 113 TRP -0.67 0.34 1 114 MET -3.73 3.11 1 115 VAL -2.02 0.06 1 116 LYS -0.87 1.74 1 118 PHE -5.63 2.43 1 119 THR -3.89 1.18 1 120 GLN 3.51 -0.56 1 122 GLN 3.20 -0.72 1 123 LEU 3.60 -1.15 1 124 LEU 3.65 -1.10 1 125 ALA 4.95 -1.10 1 126 VAL 3.41 -2.81 1 127 ILE 3.86 -1.12 1 128 LYS 3.27 -0.56 1 129 LYS 2.14 -0.99 1 130 VAL -0.70 0.73 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26776_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.74 _LACS_plot.Line_1_terminator_val_y_1 0.73 _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 0.31 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 GLN 1.15 1.28 0 13 SER -0.09 0.04 1 14 ARG -2.16 0.32 1 15 THR -0.24 0.88 1 16 VAL -3.97 0.46 1 17 LEU -4.21 0.67 1 18 ALA -3.30 0.91 1 19 VAL -1.96 0.47 1 20 ASP -1.40 -0.07 1 21 ASP 2.08 0.29 1 22 SER -1.86 0.28 1 24 SER 4.54 -0.24 1 25 VAL 4.78 -0.32 1 26 ARG 4.93 -0.61 1 27 SER 4.02 -0.24 1 28 MET 4.14 -0.14 1 29 VAL 5.99 -0.81 1 30 ALA 4.15 -0.40 1 31 MET 4.48 -0.35 1 32 THR 6.33 -0.46 1 33 LEU 3.75 -0.18 1 34 ARG 4.71 0.45 1 35 GLU 3.20 -0.24 1 36 ALA -1.57 0.16 1 38 TYR 0.71 0.04 1 39 ARG -0.11 0.20 1 40 VAL -3.67 1.22 1 41 ILE -3.37 0.25 1 42 GLU -5.74 0.95 1 43 ALA -5.73 0.41 1 44 THR 0.59 0.15 1 45 ASP -0.37 0.60 1 47 ARG 4.17 -0.38 1 48 GLU 1.38 -0.35 1 50 LEU 3.52 -0.48 1 51 GLU 3.35 -0.50 1 52 LYS 3.33 -0.32 1 53 ALA 3.20 -0.52 1 54 LEU 0.13 0.05 1 55 SER -0.18 0.10 1 56 GLU -2.21 0.23 1 58 VAL -2.90 -0.09 1 59 ASP -0.90 0.31 1 60 ALA -4.79 0.47 1 61 ILE -4.50 0.66 1 62 ILE -3.15 0.79 1 63 THR -4.55 1.06 1 64 ASP -5.16 0.83 1 66 ASN 3.19 0.12 1 67 MET -4.12 -0.03 1 69 ASN 7.39 -0.69 1 70 LEU -1.03 0.10 1 71 ASP -0.90 -0.06 1 73 LEU 4.34 -0.14 1 75 PHE 2.75 0.00 1 76 ILE 5.19 -0.69 1 77 ARG 5.02 -0.34 1 78 ALA 2.76 0.02 1 79 PHE 2.08 -0.27 1 80 ARG 2.73 -0.09 1 81 GLU 0.53 -0.20 1 82 HIS 0.39 -0.23 1 84 GLU 3.85 -0.23 1 85 SER 0.98 -0.76 1 86 LYS 3.65 -0.33 1 88 LYS -0.37 0.21 1 90 ILE -4.80 0.76 1 91 ILE -4.61 0.34 1 92 PHE -5.10 0.60 1 93 LEU -3.64 0.70 1 94 SER -4.29 0.97 1 95 THR 3.07 0.02 1 96 ASP -0.78 0.15 1 97 SER -2.39 -0.12 1 98 ALA 0.65 -0.22 1 99 ASP 4.24 -0.55 1 100 THR 4.60 -0.41 1 101 LEU 2.97 -0.44 1 102 LYS 4.62 -1.23 1 103 GLN 4.88 -0.43 1 104 GLN 3.34 -0.40 1 105 ALA 4.54 -0.63 1 106 ARG 4.77 -0.13 1 107 GLU 3.19 -0.33 1 108 ALA 0.32 0.05 1 110 ALA -0.03 0.18 1 111 MET -0.65 0.16 1 113 TRP -0.67 0.32 1 114 MET -3.73 0.14 1 115 VAL -2.02 1.01 1 116 LYS -0.87 -0.51 1 118 PHE -5.63 0.82 1 119 THR -3.89 0.32 1 120 GLN 3.51 -0.22 1 122 GLN 3.20 -0.40 1 123 LEU 3.60 -0.49 1 124 LEU 3.65 -0.21 1 125 ALA 4.95 -0.32 1 126 VAL 3.41 -0.43 1 127 ILE 3.86 -0.29 1 128 LYS 3.27 -0.21 1 129 LYS 2.14 0.14 1 130 VAL -0.70 0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26776_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.74 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.04 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 3.03 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 ASN 3.19 -3.30 0 13 SER -0.09 -0.34 1 14 ARG -2.16 -0.90 1 15 THR -0.24 -0.55 1 16 VAL -3.97 -2.90 1 17 LEU -4.21 -5.10 1 18 ALA -3.30 -2.79 1 19 VAL -1.96 -1.64 1 20 ASP -1.40 -1.83 1 21 ASP 2.08 -0.15 1 22 SER -1.86 1.20 1 24 SER 4.54 2.80 1 25 VAL 4.78 1.47 1 26 ARG 4.93 1.87 1 27 SER 4.02 2.12 1 28 MET 4.14 3.54 1 29 VAL 5.99 0.86 1 30 ALA 4.15 1.62 1 31 MET 4.48 2.33 1 32 THR 6.33 1.80 1 33 LEU 3.75 1.69 1 34 ARG 4.71 5.61 1 35 GLU 3.20 0.59 1 36 ALA -1.57 -1.11 1 38 TYR 0.71 -0.01 1 39 ARG -0.11 -0.92 1 40 VAL -3.67 -0.37 1 41 ILE -3.37 -2.42 1 42 GLU -5.74 -1.31 1 43 ALA -5.73 -1.55 1 44 THR 0.59 -1.39 1 45 ASP -0.37 0.38 1 47 ARG 4.17 2.29 1 48 GLU 1.38 2.46 1 50 LEU 3.52 -0.69 1 51 GLU 3.35 4.37 1 52 LYS 3.33 1.27 1 53 ALA 3.20 -0.22 1 54 LEU 0.13 0.64 1 55 SER -0.18 -0.91 1 56 GLU -2.21 -1.25 1 58 VAL -2.90 -2.05 1 59 ASP -0.90 -1.06 1 60 ALA -4.79 -3.53 1 61 ILE -4.50 -2.84 1 62 ILE -3.15 -2.28 1 63 THR -4.55 -4.61 1 64 ASP -5.16 -0.46 1 65 GLN 1.15 0.15 1 67 MET -4.12 -3.36 1 69 ASN 7.39 0.63 1 70 LEU -1.03 -3.78 1 71 ASP -0.90 -1.29 1 73 LEU 4.34 1.27 1 75 PHE 2.75 0.38 1 76 ILE 5.19 1.73 1 77 ARG 5.02 2.90 1 78 ALA 2.76 3.45 1 79 PHE 2.08 1.63 1 80 ARG 2.73 0.39 1 81 GLU 0.53 0.23 1 82 HIS 0.39 2.26 1 84 GLU 3.85 -0.17 1 85 SER 0.98 1.43 1 86 LYS 3.65 1.37 1 88 LYS -0.37 -0.35 1 90 ILE -4.80 -1.68 1 91 ILE -4.61 -2.02 1 92 PHE -5.10 -1.26 1 93 LEU -3.64 -2.50 1 94 SER -4.29 0.30 1 95 THR 3.07 0.62 1 96 ASP -0.78 -1.00 1 97 SER -2.39 -0.80 1 98 ALA 0.65 0.54 1 100 THR 4.60 1.95 1 101 LEU 2.97 -0.11 1 102 LYS 4.62 3.16 1 103 GLN 4.88 2.37 1 104 GLN 3.34 3.31 1 105 ALA 4.54 1.32 1 106 ARG 4.77 4.72 1 107 GLU 3.19 1.07 1 108 ALA 0.32 -1.96 1 110 ALA -0.03 -0.03 1 111 MET -0.65 -0.24 1 113 TRP -0.67 -1.66 1 114 MET -3.73 -3.05 1 115 VAL -2.02 0.28 1 116 LYS -0.87 -0.17 1 118 PHE -5.63 -1.27 1 119 THR -3.89 0.56 1 120 GLN 3.51 2.64 1 122 GLN 3.20 0.19 1 123 LEU 3.60 1.22 1 124 LEU 3.65 3.09 1 125 ALA 4.95 1.17 1 126 VAL 3.41 0.99 1 127 ILE 3.86 2.36 1 128 LYS 3.27 2.07 1 129 LYS 2.14 0.11 1 130 VAL -0.70 -0.72 1 stop_ save_