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 bmr11559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 -3.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 9.49 _LACS_plot.Line_2_terminator_val_y_2 6.86 _LACS_plot.Y_axis_chem_shift_offset -0.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 HIS -8.86 -0.63 0 10 ARG -4.37 -0.92 1 12 SER -4.30 -2.05 1 14 LEU -2.10 0.87 1 15 LEU -5.27 -2.48 1 16 VAL -0.59 -0.33 1 17 LYS -2.36 1.12 1 18 HIS -5.00 -0.14 1 19 SER 3.30 2.78 1 20 GLN -0.59 -0.58 1 21 SER 3.34 3.31 1 22 ARG 4.82 3.39 1 23 ARG -2.47 -0.69 1 25 SER -2.10 -0.14 1 26 SER -6.59 -1.32 1 27 TRP 3.09 0.65 1 28 ARG 1.83 1.01 1 30 GLU 2.75 2.72 1 31 LYS -1.78 -0.87 1 32 ILE 1.18 -0.18 1 33 THR -1.16 -1.02 1 34 ARG -0.15 -0.22 1 35 THR -2.70 -0.78 1 36 LYS 5.33 4.28 1 37 GLU 5.41 4.17 1 38 GLU 2.10 2.42 1 39 ALA 2.80 2.53 1 40 LEU 3.38 2.41 1 41 GLU 3.45 2.93 1 42 LEU 3.40 2.58 1 43 ILE 4.77 1.47 1 44 ASN 4.10 2.92 1 46 TYR 3.58 0.81 1 47 ILE 6.50 6.00 1 48 GLN 4.92 3.52 1 49 LYS 2.91 3.54 1 50 ILE 2.56 2.88 1 51 LYS 4.26 3.66 1 52 SER 0.30 0.63 1 54 GLU 1.37 2.40 1 55 GLU -6.75 -2.33 1 56 ASP -3.75 -1.77 1 57 PHE 4.36 5.02 1 58 GLU 4.30 4.05 1 59 SER 4.12 3.06 1 60 LEU 3.19 2.46 1 61 ALA 5.43 3.06 1 62 SER 2.88 2.60 1 63 GLN -0.10 1.85 1 64 PHE -1.86 -0.15 1 65 SER -3.11 -1.05 1 66 ASP -0.41 2.06 1 68 SER 5.34 4.11 1 69 SER 4.47 3.25 1 70 ALA 2.92 4.14 1 71 LYS 2.88 1.46 1 72 ALA -0.99 -1.63 1 73 ARG 5.85 1.79 1 75 ASP 0.77 1.83 1 76 LEU -2.49 -0.78 1 78 ALA -3.32 -2.11 1 79 PHE -2.90 -1.53 1 80 SER -4.33 -1.64 1 81 ARG 3.69 2.77 1 83 GLN -0.01 2.45 1 84 MET -3.39 -3.03 1 85 GLN 0.49 1.39 1 86 LYS 9.50 7.06 1 88 PHE 2.11 3.06 1 89 GLU 3.06 3.82 1 90 ASP 4.65 3.23 1 91 ALA 1.14 2.07 1 92 SER 5.52 5.24 1 93 PHE 4.28 3.67 1 94 ALA -0.94 -0.37 1 95 LEU -1.05 -0.42 1 96 ARG -0.88 -0.88 1 97 THR 6.88 4.61 1 99 GLU -3.39 -0.94 1 100 MET -7.19 -2.48 1 101 SER -0.65 0.87 1 104 VAL -2.93 -0.51 1 105 PHE -0.07 0.22 1 106 THR -3.71 -1.15 1 107 ASP 2.71 2.16 1 108 SER 3.35 3.01 1 110 ILE -1.54 -1.02 1 111 HIS -4.32 -1.11 1 112 ILE -1.51 1.37 1 113 ILE -3.06 -0.05 1 114 LEU -5.22 -2.10 1 115 ARG 1.48 0.57 1 116 THR 0.60 0.34 1 117 GLU -1.95 1.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 5.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.25 _LACS_plot.Line_2_terminator_val_x_2 9.49 _LACS_plot.Line_2_terminator_val_y_2 -2.63 _LACS_plot.Y_axis_chem_shift_offset -0.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 HIS -8.86 8.23 0 10 ARG -4.37 3.45 1 12 SER -4.30 2.25 1 14 LEU -2.10 2.97 1 15 LEU -5.27 2.79 1 16 VAL -0.59 0.26 1 17 LYS -2.36 3.48 1 18 HIS -5.00 4.86 1 19 SER 3.30 -0.52 1 20 GLN -0.59 0.01 1 21 SER 3.34 -0.03 1 22 ARG 4.82 -1.43 1 23 ARG -2.47 1.78 1 25 SER -2.10 1.96 1 26 SER -6.59 5.27 1 27 TRP 3.09 -2.44 1 28 ARG 1.83 -0.82 1 30 GLU 2.75 -0.03 1 31 LYS -1.78 0.91 1 32 ILE 1.18 -1.36 1 33 THR -1.16 0.14 1 34 ARG -0.15 -0.07 1 35 THR -2.70 1.92 1 36 LYS 5.33 -1.05 1 37 GLU 5.41 -1.24 1 38 GLU 2.10 0.32 1 39 ALA 2.80 -0.27 1 40 LEU 3.38 -0.97 1 41 GLU 3.45 -0.52 1 42 LEU 3.40 -0.82 1 43 ILE 4.77 -3.30 1 44 ASN 4.10 -1.18 1 46 TYR 3.58 -2.77 1 47 ILE 6.50 -0.50 1 48 GLN 4.92 -1.40 1 49 LYS 2.91 0.63 1 50 ILE 2.56 0.32 1 51 LYS 4.26 -0.60 1 52 SER 0.30 0.33 1 54 GLU 1.37 1.03 1 55 GLU -6.75 4.42 1 56 ASP -3.75 1.98 1 57 PHE 4.36 0.66 1 58 GLU 4.30 -0.25 1 59 SER 4.12 -1.06 1 60 LEU 3.19 -0.73 1 61 ALA 5.43 -2.37 1 62 SER 2.88 -0.28 1 63 GLN -0.10 1.95 1 64 PHE -1.86 1.71 1 65 SER -3.11 2.06 1 66 ASP -0.41 2.47 1 68 SER 5.34 -1.23 1 69 SER 4.47 -1.22 1 70 ALA 2.92 1.22 1 71 LYS 2.88 -1.42 1 72 ALA -0.99 -0.64 1 73 ARG 5.85 -4.06 1 75 ASP 0.77 1.06 1 76 LEU -2.49 1.71 1 78 ALA -3.32 1.21 1 79 PHE -2.90 1.37 1 80 SER -4.33 2.69 1 81 ARG 3.69 -0.92 1 83 GLN -0.01 2.46 1 84 MET -3.39 0.36 1 85 GLN 0.49 0.90 1 86 LYS 9.50 -2.44 1 88 PHE 2.11 0.95 1 89 GLU 3.06 0.76 1 90 ASP 4.65 -1.42 1 91 ALA 1.14 0.93 1 92 SER 5.52 -0.28 1 93 PHE 4.28 -0.61 1 94 ALA -0.94 0.57 1 95 LEU -1.05 0.63 1 96 ARG -0.88 0.00 1 97 THR 6.88 -2.27 1 99 GLU -3.39 2.45 1 100 MET -7.19 4.71 1 101 SER -0.65 1.52 1 104 VAL -2.93 2.42 1 105 PHE -0.07 0.29 1 106 THR -3.71 2.56 1 107 ASP 2.71 -0.55 1 108 SER 3.35 -0.34 1 110 ILE -1.54 0.52 1 111 HIS -4.32 3.21 1 112 ILE -1.51 2.88 1 113 ILE -3.06 3.01 1 114 LEU -5.22 3.12 1 115 ARG 1.48 -0.91 1 116 THR 0.60 -0.26 1 117 GLU -1.95 3.65 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 0.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 9.49 _LACS_plot.Line_2_terminator_val_y_2 -0.89 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LYS 9.50 -0.40 0 12 SER -4.30 1.41 0 13 HIS -8.86 1.55 0 10 ARG -4.37 0.50 1 14 LEU -2.10 -0.39 1 15 LEU -5.27 0.35 1 16 VAL -0.59 0.52 1 17 LYS -2.36 -0.17 1 18 HIS -5.00 -0.06 1 19 SER 3.30 -0.37 1 20 GLN -0.59 0.35 1 21 SER 3.34 -0.61 1 22 ARG 4.82 -0.26 1 23 ARG -2.47 0.18 1 25 SER -2.10 -0.06 1 26 SER -6.59 0.55 1 27 TRP 3.09 -0.29 1 28 ARG 1.83 -0.81 1 30 GLU 2.75 -0.31 1 31 LYS -1.78 0.35 1 32 ILE 1.18 -0.32 1 33 THR -1.16 0.00 1 34 ARG -0.15 0.26 1 35 THR -2.70 0.25 1 36 LYS 5.33 -0.89 1 37 GLU 5.41 -0.46 1 38 GLU 2.10 -0.40 1 39 ALA 2.80 -0.33 1 40 LEU 3.38 -0.45 1 41 GLU 3.45 -0.32 1 42 LEU 3.40 -0.72 1 43 ILE 4.77 -0.52 1 44 ASN 4.10 -0.22 1 46 TYR 3.58 -0.14 1 47 ILE 6.50 -0.65 1 48 GLN 4.92 -0.30 1 49 LYS 2.91 -0.22 1 50 ILE 2.56 0.13 1 51 LYS 4.26 -0.22 1 52 SER 0.30 -0.05 1 54 GLU 1.37 -0.32 1 55 GLU -6.75 0.29 1 56 ASP -3.75 0.25 1 57 PHE 4.36 -0.99 1 58 GLU 4.30 -0.52 1 59 SER 4.12 -0.32 1 60 LEU 3.19 -0.35 1 61 ALA 5.43 -0.69 1 62 SER 2.88 0.04 1 63 GLN -0.10 -0.19 1 64 PHE -1.86 0.11 1 65 SER -3.11 0.22 1 66 ASP -0.41 -0.03 1 68 SER 5.34 -0.05 1 69 SER 4.47 -0.22 1 70 ALA 2.92 -0.52 1 71 LYS 2.88 -0.34 1 72 ALA -0.99 0.40 1 73 ARG 5.85 -0.64 1 75 ASP 0.77 0.14 1 76 LEU -2.49 0.13 1 78 ALA -3.32 0.97 1 79 PHE -2.90 0.46 1 80 SER -4.33 0.90 1 81 ARG 3.69 -0.39 1 83 GLN -0.01 0.08 1 84 MET -3.39 0.11 1 85 GLN 0.49 -0.12 1 88 PHE 2.11 -0.97 1 89 GLU 3.06 -0.27 1 90 ASP 4.65 -0.19 1 91 ALA 1.14 -0.16 1 92 SER 5.52 -0.42 1 93 PHE 4.28 -0.75 1 94 ALA -0.94 0.11 1 95 LEU -1.05 -0.09 1 96 ARG -0.88 0.03 1 97 THR 6.88 -1.14 1 99 GLU -3.39 -0.02 1 100 MET -7.19 1.18 1 101 SER -0.65 -0.07 1 104 VAL -2.93 0.21 1 105 PHE -0.07 0.48 1 106 THR -3.71 0.63 1 107 ASP 2.71 0.04 1 108 SER 3.35 0.21 1 110 ILE -1.54 0.88 1 111 HIS -4.32 1.29 1 112 ILE -1.51 0.00 1 113 ILE -3.06 0.53 1 114 LEU -5.22 0.50 1 115 ARG 1.48 0.77 1 116 THR 0.60 0.04 1 117 GLU -1.95 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 -2.09 _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 -0.35 _LACS_plot.Line_2_terminator_val_x_2 9.49 _LACS_plot.Line_2_terminator_val_y_2 3.24 _LACS_plot.Y_axis_chem_shift_offset -0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 117 GLU -1.95 4.71 0 86 LYS 9.50 6.48 0 10 ARG -4.37 -0.42 1 12 SER -4.30 -1.41 1 13 HIS -8.86 -2.26 1 14 LEU -2.10 -4.18 1 15 LEU -5.27 -3.61 1 16 VAL -0.59 0.04 1 17 LYS -2.36 -2.47 1 18 HIS -5.00 2.50 1 19 SER 3.30 1.03 1 20 GLN -0.59 0.32 1 21 SER 3.34 -1.62 1 22 ARG 4.82 0.39 1 23 ARG -2.47 -0.18 1 25 SER -2.10 -2.29 1 26 SER -6.59 -0.04 1 27 TRP 3.09 0.24 1 28 ARG 1.83 0.24 1 30 GLU 2.75 -0.03 1 31 LYS -1.78 -2.13 1 32 ILE 1.18 -0.78 1 33 THR -1.16 0.61 1 34 ARG -0.15 -1.73 1 35 THR -2.70 1.80 1 36 LYS 5.33 1.18 1 37 GLU 5.41 3.24 1 38 GLU 2.10 3.36 1 39 ALA 2.80 0.40 1 40 LEU 3.38 0.21 1 41 GLU 3.45 3.77 1 42 LEU 3.40 1.05 1 43 ILE 4.77 1.10 1 44 ASN 4.10 4.01 1 46 TYR 3.58 2.31 1 47 ILE 6.50 1.60 1 48 GLN 4.92 3.37 1 49 LYS 2.91 1.94 1 50 ILE 2.56 4.88 1 51 LYS 4.26 2.44 1 52 SER 0.30 1.08 1 54 GLU 1.37 0.16 1 55 GLU -6.75 -2.28 1 56 ASP -3.75 -0.65 1 57 PHE 4.36 0.86 1 58 GLU 4.30 2.64 1 59 SER 4.12 3.45 1 60 LEU 3.19 1.30 1 61 ALA 5.43 1.13 1 62 SER 2.88 0.31 1 63 GLN -0.10 1.70 1 64 PHE -1.86 -0.73 1 65 SER -3.11 1.27 1 66 ASP -0.41 -1.33 1 68 SER 5.34 1.75 1 69 SER 4.47 2.58 1 70 ALA 2.92 2.26 1 71 LYS 2.88 0.04 1 72 ALA -0.99 -0.45 1 73 ARG 5.85 -1.39 1 75 ASP 0.77 -0.87 1 76 LEU -2.49 1.23 1 78 ALA -3.32 1.26 1 79 PHE -2.90 -2.95 1 80 SER -4.33 0.50 1 81 ARG 3.69 1.57 1 83 GLN -0.01 0.20 1 84 MET -3.39 -0.67 1 85 GLN 0.49 2.71 1 88 PHE 2.11 2.47 1 89 GLU 3.06 0.94 1 90 ASP 4.65 3.06 1 91 ALA 1.14 1.88 1 92 SER 5.52 0.37 1 93 PHE 4.28 0.09 1 94 ALA -0.94 0.18 1 95 LEU -1.05 0.32 1 96 ARG -0.88 0.75 1 97 THR 6.88 1.14 1 99 GLU -3.39 -3.54 1 100 MET -7.19 0.14 1 101 SER -0.65 0.15 1 104 VAL -2.93 -1.41 1 105 PHE -0.07 0.16 1 106 THR -3.71 0.87 1 107 ASP 2.71 2.28 1 108 SER 3.35 1.14 1 110 ILE -1.54 -2.54 1 111 HIS -4.32 2.88 1 112 ILE -1.51 -1.00 1 113 ILE -3.06 -3.68 1 114 LEU -5.22 -2.11 1 115 ARG 1.48 -0.04 1 116 THR 0.60 0.76 1 stop_ save_