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 bmr18761_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.22 _LACS_plot.Line_1_terminator_val_y_1 -3.20 _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 -1.36 _LACS_plot.Line_2_terminator_val_x_2 6.41 _LACS_plot.Line_2_terminator_val_y_2 4.47 _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 61 HIS 0.35 3.70 0 10 PHE -3.25 -0.69 1 11 GLN 0.70 0.72 1 12 VAL -6.91 -2.92 1 13 TYR -1.54 0.21 1 14 TYR -3.12 -2.71 1 15 LEU 1.36 0.09 1 17 ASN -5.22 -2.37 1 18 VAL -3.89 -2.34 1 20 VAL -6.47 -2.92 1 21 ALA -0.60 0.93 1 22 LYS -7.36 -4.03 1 26 VAL 4.67 3.53 1 27 ASP 4.47 2.16 1 28 VAL 4.66 2.94 1 29 ILE 4.06 2.66 1 30 ASN 4.54 3.26 1 32 ALA 3.50 2.69 1 33 LEU 1.62 2.43 1 34 GLU 4.08 3.01 1 35 SER 5.41 4.36 1 36 VAL 3.85 2.94 1 37 LEU 3.62 2.35 1 38 SER 0.23 0.40 1 39 SER -1.24 -0.03 1 40 SER -2.70 -0.77 1 41 SER -2.96 -1.82 1 42 ARG 2.78 1.18 1 43 GLU 3.17 2.10 1 44 GLN -0.03 0.07 1 45 TRP -2.71 -2.31 1 46 THR 1.23 1.83 1 48 SER -4.46 -0.19 1 49 HIS -4.33 0.19 1 50 VAL -2.94 -1.74 1 51 SER -2.11 -1.94 1 52 VAL 0.56 0.01 1 53 ALA 0.40 0.00 1 55 ALA -2.06 -0.24 1 56 THR -2.54 -0.17 1 57 LEU -2.74 -1.67 1 58 THR 0.38 0.41 1 59 ILE -0.63 -0.06 1 60 LEU -5.67 -2.26 1 62 GLN 2.93 3.00 1 63 GLN 0.64 1.83 1 64 THR -0.68 -0.17 1 65 GLU 4.05 1.51 1 66 ALA -0.60 -0.24 1 67 VAL 3.25 1.87 1 68 LEU 0.63 -0.10 1 70 GLU -3.48 -0.83 1 72 ARG 2.14 0.49 1 73 VAL 4.76 4.11 1 74 ARG 3.29 2.03 1 75 PHE -0.89 -1.12 1 76 LEU 2.36 2.26 1 77 SER 0.26 1.21 1 78 PHE -3.89 1.00 1 79 LEU -2.74 -0.50 1 80 ALA -2.95 0.34 1 81 VAL 0.13 -0.10 1 83 ARG 4.18 3.28 1 84 ASP -2.86 -1.41 1 85 VAL 3.49 1.77 1 86 HIS 5.62 3.11 1 87 THR -3.71 -1.93 1 88 PHE -6.74 -1.93 1 89 ALA -8.22 -2.59 1 90 PHE -5.69 -2.52 1 91 ILE -1.80 -0.64 1 92 MET -4.93 -2.56 1 93 ALA -0.61 -0.83 1 94 ALA -1.19 -0.83 1 97 ALA -0.61 -0.83 1 98 SER -2.07 -1.72 1 99 PHE -4.00 -2.08 1 102 HIS 4.44 4.15 1 103 MET -5.87 -0.25 1 104 PHE -5.22 -0.76 1 105 TRP -2.72 -0.56 1 107 GLU -3.18 -1.23 1 109 ASN -0.05 -0.26 1 110 ALA -1.93 -0.15 1 111 ALA 4.96 4.07 1 112 SER 5.29 3.89 1 113 LEU 4.17 2.03 1 114 SER 3.46 2.46 1 115 GLU 3.23 2.72 1 116 ALA 4.31 2.45 1 117 VAL 6.42 4.80 1 118 GLN 4.41 3.81 1 119 ALA 3.88 2.63 1 120 ALA 4.22 2.49 1 123 LEU 1.90 1.20 1 124 ARG 2.52 1.42 1 125 TYR 1.24 0.79 1 126 GLN 1.19 1.03 1 129 LEU 1.35 0.67 1 130 ASP 0.21 0.30 1 131 ALA 0.96 0.77 1 132 ARG 1.50 0.88 1 133 SER 0.53 0.52 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18761_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.22 _LACS_plot.Line_1_terminator_val_y_1 5.02 _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 0.64 _LACS_plot.Line_2_terminator_val_x_2 6.41 _LACS_plot.Line_2_terminator_val_y_2 -1.94 _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 61 HIS 0.35 3.35 0 10 PHE -3.25 2.56 1 11 GLN 0.70 0.02 1 12 VAL -6.91 3.99 1 13 TYR -1.54 1.75 1 14 TYR -3.12 0.41 1 15 LEU 1.36 -1.27 1 17 ASN -5.22 2.85 1 18 VAL -3.89 1.55 1 20 VAL -6.47 3.55 1 21 ALA -0.60 1.53 1 22 LYS -7.36 3.33 1 26 VAL 4.67 -1.14 1 27 ASP 4.47 -2.31 1 28 VAL 4.66 -1.72 1 29 ILE 4.06 -1.40 1 30 ASN 4.54 -1.28 1 32 ALA 3.50 -0.81 1 33 LEU 1.62 0.81 1 34 GLU 4.08 -1.07 1 35 SER 5.41 -1.05 1 36 VAL 3.85 -0.91 1 37 LEU 3.62 -1.27 1 38 SER 0.23 0.17 1 39 SER -1.24 1.21 1 40 SER -2.70 1.93 1 41 SER -2.96 1.14 1 42 ARG 2.78 -1.60 1 43 GLU 3.17 -1.07 1 44 GLN -0.03 0.10 1 45 TRP -2.71 0.40 1 46 THR 1.23 0.60 1 48 SER -4.46 4.27 1 49 HIS -4.33 4.52 1 50 VAL -2.94 1.20 1 51 SER -2.11 0.17 1 52 VAL 0.56 -0.55 1 53 ALA 0.40 -0.40 1 55 ALA -2.06 1.82 1 56 THR -2.54 2.37 1 57 LEU -2.74 1.07 1 58 THR 0.38 0.03 1 59 ILE -0.63 0.57 1 60 LEU -5.67 3.41 1 62 GLN 2.93 0.07 1 63 GLN 0.64 1.19 1 64 THR -0.68 0.51 1 65 GLU 4.05 -2.54 1 66 ALA -0.60 0.36 1 67 VAL 3.25 -1.38 1 68 LEU 0.63 -0.73 1 70 GLU -3.48 2.65 1 72 ARG 2.14 -1.65 1 73 VAL 4.76 -0.65 1 74 ARG 3.29 -1.26 1 75 PHE -0.89 -0.23 1 76 LEU 2.36 -0.10 1 77 SER 0.26 0.95 1 78 PHE -3.89 4.89 1 79 LEU -2.74 2.24 1 80 ALA -2.95 3.29 1 81 VAL 0.13 -0.23 1 83 ARG 4.18 -0.90 1 84 ASP -2.86 1.45 1 85 VAL 3.49 -1.72 1 86 HIS 5.62 -2.51 1 87 THR -3.71 1.78 1 88 PHE -6.74 4.81 1 89 ALA -8.22 5.63 1 90 PHE -5.69 3.17 1 91 ILE -1.80 1.16 1 92 MET -4.93 2.37 1 93 ALA -0.61 -0.22 1 94 ALA -1.19 0.36 1 97 ALA -0.61 -0.22 1 98 SER -2.07 0.35 1 99 PHE -4.00 1.92 1 102 HIS 4.44 -0.29 1 103 MET -5.87 5.62 1 104 PHE -5.22 4.46 1 105 TRP -2.72 2.16 1 107 GLU -3.18 1.95 1 109 ASN -0.05 -0.21 1 110 ALA -1.93 1.78 1 111 ALA 4.96 -0.89 1 112 SER 5.29 -1.40 1 113 LEU 4.17 -2.14 1 114 SER 3.46 -1.00 1 115 GLU 3.23 -0.51 1 116 ALA 4.31 -1.86 1 117 VAL 6.42 -1.62 1 118 GLN 4.41 -0.60 1 119 ALA 3.88 -1.25 1 120 ALA 4.22 -1.73 1 123 LEU 1.90 -0.70 1 124 ARG 2.52 -1.10 1 125 TYR 1.24 -0.45 1 126 GLN 1.19 -0.16 1 129 LEU 1.35 -0.68 1 130 ASP 0.21 0.09 1 131 ALA 0.96 -0.19 1 132 ARG 1.50 -0.62 1 133 SER 0.53 -0.01 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18761_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.22 _LACS_plot.Line_1_terminator_val_y_1 1.00 _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 0.34 _LACS_plot.Line_2_terminator_val_x_2 6.41 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _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 113 LEU 4.17 -1.65 0 10 PHE -3.25 0.02 1 11 GLN 0.70 0.68 1 12 VAL -6.91 1.11 1 13 TYR -1.54 0.57 1 14 TYR -3.12 0.54 1 15 LEU 1.36 -0.63 1 17 ASN -5.22 0.97 1 18 VAL -3.89 0.38 1 20 VAL -6.47 0.66 1 21 ALA -0.60 0.11 1 22 LYS -7.36 0.09 1 26 VAL 4.67 -0.37 1 27 ASP 4.47 -0.27 1 28 VAL 4.66 -0.51 1 29 ILE 4.06 -0.38 1 30 ASN 4.54 -0.18 1 32 ALA 3.50 -0.26 1 33 LEU 1.62 -0.28 1 34 GLU 4.08 -0.35 1 35 SER 5.41 -0.40 1 36 VAL 3.85 -0.09 1 37 LEU 3.62 -0.05 1 38 SER 0.23 -0.38 1 39 SER -1.24 -0.43 1 40 SER -2.70 0.30 1 41 SER -2.96 -0.18 1 42 ARG 2.78 -0.25 1 43 GLU 3.17 -0.45 1 44 GLN -0.03 0.03 1 45 TRP -2.71 0.25 1 46 THR 1.23 0.26 1 48 SER -4.46 1.00 1 49 HIS -4.33 0.99 1 50 VAL -2.94 0.87 1 51 SER -2.11 -0.23 1 52 VAL 0.56 0.28 1 53 ALA 0.40 -0.02 1 55 ALA -2.06 0.23 1 56 THR -2.54 0.55 1 57 LEU -2.74 0.93 1 58 THR 0.38 0.54 1 59 ILE -0.63 0.43 1 60 LEU -5.67 1.08 1 61 HIS 0.35 -0.48 1 62 GLN 2.93 -0.59 1 63 GLN 0.64 0.20 1 64 THR -0.68 -0.02 1 65 GLU 4.05 -0.28 1 66 ALA -0.60 -0.09 1 67 VAL 3.25 -0.12 1 68 LEU 0.63 0.13 1 70 GLU -3.48 0.66 1 72 ARG 2.14 -0.04 1 73 VAL 4.76 -0.76 1 74 ARG 3.29 -0.27 1 75 PHE -0.89 0.38 1 76 LEU 2.36 0.63 1 77 SER 0.26 -0.51 1 78 PHE -3.89 0.08 1 79 LEU -2.74 0.68 1 80 ALA -2.95 0.04 1 81 VAL 0.13 0.58 1 83 ARG 4.18 -0.50 1 84 ASP -2.86 0.30 1 85 VAL 3.49 -0.15 1 86 HIS 5.62 -0.77 1 87 THR -3.71 0.97 1 88 PHE -6.74 0.60 1 89 ALA -8.22 1.04 1 90 PHE -5.69 0.80 1 91 ILE -1.80 0.87 1 92 MET -4.93 1.17 1 93 ALA -0.61 0.76 1 94 ALA -1.19 -0.07 1 97 ALA -0.61 0.28 1 98 SER -2.07 -0.03 1 99 PHE -4.00 0.97 1 102 HIS 4.44 -0.69 1 103 MET -5.87 0.46 1 104 PHE -5.22 0.85 1 105 TRP -2.72 -0.28 1 107 GLU -3.18 0.15 1 109 ASN -0.05 -0.19 1 110 ALA -1.93 -0.07 1 111 ALA 4.96 -0.11 1 112 SER 5.29 -0.02 1 114 SER 3.46 -1.42 1 115 GLU 3.23 -0.52 1 116 ALA 4.31 -0.16 1 117 VAL 6.42 -0.80 1 118 GLN 4.41 -0.52 1 119 ALA 3.88 -0.25 1 120 ALA 4.22 -0.23 1 123 LEU 1.90 -0.09 1 125 TYR 1.24 -0.03 1 126 GLN 1.19 -0.17 1 129 LEU 1.35 -0.10 1 130 ASP 0.21 -0.08 1 131 ALA 0.96 -0.11 1 132 ARG 1.50 -0.09 1 133 SER 0.53 0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18761_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.22 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 5.62 _LACS_plot.Line_2_terminator_val_y_2 1.98 _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 61 HIS 0.35 4.17 0 65 GLU 4.05 -2.82 0 10 PHE -3.25 -0.98 1 11 GLN 0.70 -0.54 1 12 VAL -6.91 -0.96 1 13 TYR -1.54 -0.48 1 14 TYR -3.12 -0.18 1 20 VAL -6.47 0.01 1 21 ALA -0.60 -0.46 1 26 VAL 4.67 0.49 1 27 ASP 4.47 2.91 1 28 VAL 4.66 2.95 1 29 ILE 4.06 0.82 1 30 ASN 4.54 2.89 1 32 ALA 3.50 2.11 1 33 LEU 1.62 1.38 1 34 GLU 4.08 3.07 1 35 SER 5.41 1.96 1 36 VAL 3.85 2.51 1 37 LEU 3.62 1.30 1 38 SER 0.23 0.61 1 39 SER -1.24 -0.93 1 40 SER -2.70 -2.05 1 41 SER -2.96 -0.86 1 42 ARG 2.78 0.94 1 43 GLU 3.17 0.59 1 44 GLN -0.03 0.37 1 45 TRP -2.71 0.25 1 48 SER -4.46 -1.14 1 49 HIS -4.33 1.22 1 50 VAL -2.94 -1.02 1 51 SER -2.11 -0.73 1 52 VAL 0.56 -3.06 1 55 ALA -2.06 2.33 1 56 THR -2.54 -3.51 1 57 LEU -2.74 -2.10 1 58 THR 0.38 -2.46 1 59 ILE -0.63 -1.92 1 60 LEU -5.67 -1.00 1 62 GLN 2.93 0.58 1 63 GLN 0.64 2.16 1 64 THR -0.68 1.33 1 66 ALA -0.60 -0.23 1 67 VAL 3.25 0.72 1 68 LEU 0.63 0.36 1 70 GLU -3.48 -1.51 1 73 VAL 4.76 0.62 1 74 ARG 3.29 -0.47 1 75 PHE -0.89 -0.93 1 77 SER 0.26 0.53 1 78 PHE -3.89 -3.74 1 79 LEU -2.74 -4.44 1 80 ALA -2.95 -2.66 1 81 VAL 0.13 1.16 1 83 ARG 4.18 1.92 1 84 ASP -2.86 2.02 1 85 VAL 3.49 -0.06 1 86 HIS 5.62 1.56 1 87 THR -3.71 -1.66 1 88 PHE -6.74 -3.85 1 89 ALA -8.22 -3.99 1 90 PHE -5.69 -2.93 1 91 ILE -1.80 -1.78 1 92 MET -4.93 -0.64 1 93 ALA -0.61 -1.62 1 94 ALA -1.19 -1.31 1 97 ALA -0.61 -2.36 1 98 SER -2.07 -2.88 1 99 PHE -4.00 -0.21 1 103 MET -5.87 -2.05 1 104 PHE -5.22 -2.44 1 105 TRP -2.72 -0.63 1 109 ASN -0.05 -1.50 1 110 ALA -1.93 -1.40 1 111 ALA 4.96 1.94 1 112 SER 5.29 2.14 1 113 LEU 4.17 -0.79 1 114 SER 3.46 2.34 1 115 GLU 3.23 2.51 1 119 ALA 3.88 2.32 1 129 LEU 1.35 -0.13 1 130 ASP 0.21 0.16 1 131 ALA 0.96 0.65 1 132 ARG 1.50 0.69 1 133 SER 0.53 0.12 1 stop_ save_