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 bmr18899_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.81 _LACS_plot.Line_1_terminator_val_y_1 -2.33 _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 -1.10 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 6.27 _LACS_plot.Y_axis_chem_shift_offset -0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 17 ILE 3.88 0.22 0 70 ASP -5.81 -1.48 0 10 ILE 5.08 5.02 1 11 ALA 4.30 3.18 1 14 ASP 4.94 3.23 1 15 ALA 3.70 2.35 1 18 SER 4.14 3.16 1 19 ARG 1.93 2.24 1 20 TYR -0.08 0.35 1 23 LEU -1.45 -0.61 1 26 MET -3.59 -0.27 1 27 SER 2.88 2.15 1 28 ASP -2.90 -0.74 1 31 ARG 3.04 2.89 1 32 ALA 4.84 3.24 1 33 GLU 3.55 2.89 1 34 ALA 3.26 2.64 1 35 ILE 4.69 2.44 1 36 ILE 4.73 1.41 1 38 ARG 4.16 3.31 1 39 VAL 6.05 4.61 1 40 GLN 6.38 4.10 1 41 ALA 3.41 2.50 1 42 ARG 5.14 3.71 1 43 VAL 5.34 4.26 1 44 ALA 2.63 2.18 1 45 TYR 3.17 3.23 1 46 GLU 0.14 -0.35 1 47 GLU 3.19 0.28 1 48 ILE 1.48 1.01 1 49 THR -0.86 -0.65 1 50 ASP -1.78 0.10 1 51 LEU 2.39 2.68 1 52 PHE 6.93 4.68 1 53 GLU 3.38 2.99 1 54 VAL 8.37 5.94 1 55 SER 5.04 4.86 1 56 ALA 0.67 2.56 1 58 TYR 7.17 6.66 1 59 LEU 4.49 5.12 1 60 VAL 6.49 5.57 1 61 ALA 2.80 2.65 1 62 THR 5.98 4.26 1 63 ALA 4.95 3.49 1 64 ARG 0.82 0.74 1 66 HIS 3.10 1.52 1 67 ILE 3.51 3.25 1 71 ALA 3.14 0.17 1 73 LYS 3.20 0.50 1 74 ARG 0.61 -0.10 1 76 ALA 3.26 3.46 1 77 LEU 4.55 3.12 1 78 ASN 2.97 3.18 1 79 SER 5.47 4.40 1 80 ALA 2.67 3.05 1 81 LEU 4.49 2.93 1 82 LEU 3.70 2.76 1 83 PHE 6.19 4.93 1 84 LEU 5.21 3.53 1 85 ARG 3.71 3.30 1 86 ARG 2.46 1.82 1 87 ASN -1.46 0.28 1 89 VAL -0.18 -0.42 1 90 GLN 1.15 0.18 1 91 VAL -4.78 -2.77 1 92 PHE -3.19 -2.36 1 93 ASP 0.91 1.23 1 94 SER -3.74 -1.21 1 96 GLU 2.04 2.08 1 97 LEU 2.77 2.10 1 98 ALA 4.72 3.41 1 99 ASP 3.58 2.79 1 100 LEU 1.77 2.39 1 101 THR 7.27 5.36 1 102 VAL 5.78 4.79 1 104 ALA 1.82 1.76 1 105 ALA 2.47 2.47 1 106 THR -0.18 0.48 1 108 GLU 0.65 1.56 1 109 ILE -1.98 -1.12 1 110 SER -3.22 -1.17 1 111 VAL 5.77 4.80 1 112 SER 4.58 3.29 1 113 SER 4.38 3.39 1 114 VAL 6.05 4.57 1 115 ALA 4.22 3.42 1 116 ASP 3.27 3.06 1 117 THR 7.60 5.69 1 118 LEU 2.65 3.11 1 119 ARG 3.34 2.65 1 120 ARG 4.06 3.01 1 121 LEU 3.37 2.37 1 122 TYR -2.79 -1.43 1 124 SER -0.51 -0.17 1 125 ALA -0.60 -0.17 1 126 ASP -0.39 0.05 1 128 LEU 0.73 0.16 1 129 GLU -0.21 0.15 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18899_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.81 _LACS_plot.Line_1_terminator_val_y_1 3.48 _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 0.90 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 -2.10 _LACS_plot.Y_axis_chem_shift_offset -0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 17 ILE 3.88 -3.66 0 70 ASP -5.81 4.33 0 10 ILE 5.08 -0.06 1 11 ALA 4.30 -1.12 1 14 ASP 4.94 -1.71 1 15 ALA 3.70 -1.35 1 18 SER 4.14 -0.98 1 19 ARG 1.93 0.31 1 20 TYR -0.08 0.43 1 23 LEU -1.45 0.84 1 26 MET -3.59 3.32 1 27 SER 2.88 -0.73 1 28 ASP -2.90 2.16 1 31 ARG 3.04 -0.15 1 32 ALA 4.84 -1.60 1 33 GLU 3.55 -0.66 1 34 ALA 3.26 -0.62 1 35 ILE 4.69 -2.25 1 36 ILE 4.73 -3.32 1 38 ARG 4.16 -0.85 1 39 VAL 6.05 -1.44 1 40 GLN 6.38 -2.28 1 41 ALA 3.41 -0.91 1 42 ARG 5.14 -1.43 1 43 VAL 5.34 -1.08 1 44 ALA 2.63 -0.45 1 45 TYR 3.17 0.06 1 46 GLU 0.14 -0.49 1 47 GLU 3.19 -2.91 1 48 ILE 1.48 -0.47 1 49 THR -0.86 0.21 1 50 ASP -1.78 1.88 1 51 LEU 2.39 0.29 1 52 PHE 6.93 -2.25 1 53 GLU 3.38 -0.39 1 54 VAL 8.37 -2.43 1 55 SER 5.04 -0.18 1 56 ALA 0.67 1.89 1 58 TYR 7.17 -0.51 1 59 LEU 4.49 0.63 1 60 VAL 6.49 -0.92 1 61 ALA 2.80 -0.15 1 62 THR 5.98 -1.72 1 63 ALA 4.95 -1.46 1 64 ARG 0.82 -0.08 1 66 HIS 3.10 -1.58 1 67 ILE 3.51 -0.26 1 71 ALA 3.14 -2.97 1 73 LYS 3.20 -2.70 1 74 ARG 0.61 -0.71 1 76 ALA 3.26 0.20 1 77 LEU 4.55 -1.43 1 78 ASN 2.97 0.21 1 79 SER 5.47 -1.07 1 80 ALA 2.67 0.38 1 81 LEU 4.49 -1.56 1 82 LEU 3.70 -0.94 1 83 PHE 6.19 -1.26 1 84 LEU 5.21 -1.68 1 85 ARG 3.71 -0.41 1 86 ARG 2.46 -0.64 1 87 ASN -1.46 1.74 1 89 VAL -0.18 -0.24 1 90 GLN 1.15 -0.97 1 91 VAL -4.78 2.01 1 92 PHE -3.19 0.83 1 93 ASP 0.91 0.32 1 94 SER -3.74 2.53 1 96 GLU 2.04 0.04 1 97 LEU 2.77 -0.67 1 98 ALA 4.72 -1.31 1 99 ASP 3.58 -0.79 1 100 LEU 1.77 0.62 1 101 THR 7.27 -1.91 1 102 VAL 5.78 -0.99 1 104 ALA 1.82 -0.06 1 105 ALA 2.47 0.00 1 106 THR -0.18 0.66 1 108 GLU 0.65 0.91 1 109 ILE -1.98 0.86 1 110 SER -3.22 2.05 1 111 VAL 5.77 -0.97 1 112 SER 4.58 -1.29 1 113 SER 4.38 -0.99 1 114 VAL 6.05 -1.48 1 115 ALA 4.22 -0.80 1 116 ASP 3.27 -0.21 1 117 THR 7.60 -1.91 1 118 LEU 2.65 0.46 1 119 ARG 3.34 -0.69 1 120 ARG 4.06 -1.05 1 121 LEU 3.37 -1.00 1 122 TYR -2.79 1.36 1 124 SER -0.51 0.34 1 125 ALA -0.60 0.43 1 126 ASP -0.39 0.44 1 128 LEU 0.73 -0.57 1 129 GLU -0.21 0.36 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18899_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.81 _LACS_plot.Line_1_terminator_val_y_1 0.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 ARG 3.34 -2.17 0 10 ILE 5.08 -0.43 1 11 ALA 4.30 -0.09 1 14 ASP 4.94 0.04 1 15 ALA 3.70 -0.18 1 17 ILE 3.88 -0.41 1 18 SER 4.14 -0.38 1 19 ARG 1.93 -0.34 1 20 TYR -0.08 0.13 1 23 LEU -1.45 -0.01 1 26 MET -3.59 0.20 1 27 SER 2.88 -0.22 1 28 ASP -2.90 0.11 1 31 ARG 3.04 -0.28 1 32 ALA 4.84 -0.49 1 33 GLU 3.55 -0.58 1 34 ALA 3.26 -0.22 1 35 ILE 4.69 -0.42 1 36 ILE 4.73 -0.47 1 38 ARG 4.16 -0.24 1 39 VAL 6.05 -0.85 1 40 GLN 6.38 -1.00 1 41 ALA 3.41 -0.11 1 42 ARG 5.14 -0.32 1 43 VAL 5.34 -0.62 1 44 ALA 2.63 -0.06 1 45 TYR 3.17 -0.28 1 46 GLU 0.14 -0.18 1 47 GLU 3.19 -0.50 1 48 ILE 1.48 -0.18 1 49 THR -0.86 -0.04 1 50 ASP -1.78 -0.01 1 51 LEU 2.39 -0.42 1 52 PHE 6.93 -0.46 1 53 GLU 3.38 -0.37 1 54 VAL 8.37 -0.89 1 55 SER 5.04 -0.80 1 56 ALA 0.67 -0.38 1 58 TYR 7.17 -0.69 1 59 LEU 4.49 -0.45 1 60 VAL 6.49 -0.80 1 61 ALA 2.80 -0.28 1 62 THR 5.98 -0.40 1 63 ALA 4.95 -0.45 1 64 ARG 0.82 0.16 1 66 HIS 3.10 -0.78 1 67 ILE 3.51 -0.95 1 70 ASP -5.81 0.36 1 71 ALA 3.14 0.40 1 73 LYS 3.20 -0.17 1 76 ALA 3.26 -0.16 1 77 LEU 4.55 -0.30 1 78 ASN 2.97 -0.34 1 79 SER 5.47 -0.20 1 80 ALA 2.67 -0.30 1 82 LEU 3.70 -0.33 1 83 PHE 6.19 -1.10 1 84 LEU 5.21 -0.80 1 85 ARG 3.71 -0.01 1 86 ARG 2.46 -0.35 1 87 ASN -1.46 -0.12 1 89 VAL -0.18 -0.08 1 90 GLN 1.15 -0.05 1 91 VAL -4.78 -0.14 1 92 PHE -3.19 0.25 1 93 ASP 0.91 -0.15 1 94 SER -3.74 0.44 1 96 GLU 2.04 -0.08 1 97 LEU 2.77 -0.33 1 98 ALA 4.72 -0.22 1 99 ASP 3.58 -0.20 1 100 LEU 1.77 -0.23 1 101 THR 7.27 -0.61 1 102 VAL 5.78 -0.51 1 104 ALA 1.82 0.05 1 105 ALA 2.47 -0.45 1 106 THR -0.18 0.01 1 108 GLU 0.65 -0.27 1 109 ILE -1.98 0.18 1 110 SER -3.22 0.01 1 111 VAL 5.77 -0.58 1 112 SER 4.58 -0.25 1 113 SER 4.38 -0.12 1 114 VAL 6.05 -0.49 1 115 ALA 4.22 -0.45 1 116 ASP 3.27 -0.32 1 117 THR 7.60 -0.10 1 118 LEU 2.65 -0.51 1 120 ARG 4.06 -0.48 1 121 LEU 3.37 -0.44 1 122 TYR -2.79 0.66 1 124 SER -0.51 0.08 1 125 ALA -0.60 0.06 1 126 ASP -0.39 -0.06 1 128 LEU 0.73 -0.10 1 129 GLU -0.21 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18899_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.78 _LACS_plot.Line_1_terminator_val_y_1 -1.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.29 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 2.70 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 91 VAL -4.78 -2.01 0 10 ILE 5.08 1.23 1 14 ASP 4.94 2.62 1 15 ALA 3.70 2.38 1 17 ILE 3.88 3.04 1 18 SER 4.14 0.90 1 19 ARG 1.93 1.31 1 20 TYR -0.08 0.95 1 26 MET -3.59 -1.05 1 27 SER 2.88 0.18 1 31 ARG 3.04 1.21 1 32 ALA 4.84 0.74 1 33 GLU 3.55 2.56 1 34 ALA 3.26 2.77 1 35 ILE 4.69 1.66 1 36 ILE 4.73 2.06 1 38 ARG 4.16 2.94 1 39 VAL 6.05 1.15 1 40 GLN 6.38 2.83 1 41 ALA 3.41 1.88 1 42 ARG 5.14 1.90 1 43 VAL 5.34 1.62 1 44 ALA 2.63 2.78 1 45 TYR 3.17 2.16 1 46 GLU 0.14 -1.55 1 47 GLU 3.19 -1.41 1 48 ILE 1.48 -0.02 1 49 THR -0.86 -0.14 1 50 ASP -1.78 0.45 1 51 LEU 2.39 1.36 1 52 PHE 6.93 2.28 1 53 GLU 3.38 3.54 1 54 VAL 8.37 1.45 1 55 SER 5.04 1.89 1 56 ALA 0.67 0.44 1 58 TYR 7.17 2.86 1 59 LEU 4.49 1.13 1 60 VAL 6.49 0.86 1 61 ALA 2.80 3.74 1 62 THR 5.98 2.89 1 63 ALA 4.95 1.42 1 64 ARG 0.82 1.72 1 66 HIS 3.10 0.59 1 67 ILE 3.51 -0.76 1 73 LYS 3.20 -0.35 1 76 ALA 3.26 2.31 1 77 LEU 4.55 0.52 1 78 ASN 2.97 3.63 1 79 SER 5.47 -0.41 1 80 ALA 2.67 3.20 1 81 LEU 4.49 0.96 1 82 LEU 3.70 0.33 1 83 PHE 6.19 1.95 1 84 LEU 5.21 0.75 1 85 ARG 3.71 0.83 1 86 ARG 2.46 -0.03 1 87 ASN -1.46 -1.43 1 89 VAL -0.18 -1.21 1 90 GLN 1.15 -0.75 1 92 PHE -3.19 -2.19 1 93 ASP 0.91 -0.84 1 96 GLU 2.04 1.88 1 97 LEU 2.77 1.44 1 98 ALA 4.72 2.39 1 99 ASP 3.58 2.87 1 100 LEU 1.77 0.44 1 101 THR 7.27 1.56 1 102 VAL 5.78 2.09 1 104 ALA 1.82 2.75 1 105 ALA 2.47 1.48 1 106 THR -0.18 1.70 1 108 GLU 0.65 -0.60 1 109 ILE -1.98 -2.01 1 110 SER -3.22 0.41 1 111 VAL 5.77 1.04 1 112 SER 4.58 2.16 1 113 SER 4.38 3.02 1 114 VAL 6.05 1.38 1 115 ALA 4.22 0.93 1 116 ASP 3.27 2.79 1 117 THR 7.60 0.83 1 118 LEU 2.65 -0.16 1 119 ARG 3.34 2.87 1 120 ARG 4.06 2.19 1 121 LEU 3.37 1.63 1 122 TYR -2.79 1.25 1 124 SER -0.51 -0.43 1 125 ALA -0.60 -0.61 1 128 LEU 0.73 0.01 1 stop_ save_