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 bmr17752_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 3.64 _LACS_plot.Line_2_terminator_val_y_2 2.41 _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 54 GLU 3.44 3.56 0 105 ILE 0.33 -2.68 0 68 THR 0.18 -2.84 0 70 PHE -4.81 1.26 0 10 LEU -5.09 -1.18 1 11 GLU 1.93 -0.18 1 12 LEU 1.51 1.13 1 13 ALA -4.04 -1.35 1 14 VAL -5.41 -3.05 1 15 GLU -6.22 -1.38 1 16 VAL 1.41 0.08 1 17 LYS -2.57 -2.68 1 18 GLN -2.22 -0.91 1 20 GLU 1.91 1.66 1 21 ASP 0.67 0.03 1 22 ARG -2.29 -1.19 1 23 LYS 1.41 0.42 1 25 TYR -3.84 -2.25 1 26 LEU -3.63 -1.31 1 27 TRP -4.12 -2.34 1 28 ILE -3.17 -0.95 1 29 LYS -3.91 -1.06 1 30 TRP -0.30 -0.42 1 31 SER -1.65 -1.10 1 34 THR 1.48 1.03 1 35 LEU -0.24 -0.30 1 36 ILE 0.85 0.60 1 37 ASP 0.15 0.15 1 38 LEU 0.83 0.65 1 39 LYS 1.84 0.96 1 40 THR 0.64 0.35 1 42 TRP -0.34 -0.74 1 43 PHE -1.14 -0.59 1 44 THR -0.66 0.03 1 45 LEU -3.27 -1.25 1 46 LEU -5.19 -2.86 1 47 TYR -5.00 -0.60 1 48 GLU -7.81 -1.79 1 49 ILE -6.18 -2.72 1 50 ARG -5.92 -2.55 1 51 LEU -5.01 -0.50 1 52 LYS 0.42 0.63 1 55 LYS 1.31 -0.11 1 56 ALA -2.04 -0.85 1 57 ALA 0.11 0.78 1 58 GLU -4.18 -1.83 1 59 TRP -1.97 -0.51 1 60 GLU -2.57 -0.80 1 61 ILE -1.92 -1.07 1 62 HIS -6.03 -0.09 1 63 PHE 0.81 0.40 1 64 ALA -1.77 -1.17 1 66 GLN -0.47 0.19 1 67 GLN -1.15 0.32 1 69 GLU -6.14 -2.86 1 71 LYS -3.74 -1.50 1 72 ILE -2.51 -2.01 1 73 LEU 0.28 1.07 1 74 SER -0.07 -1.04 1 75 LEU -5.34 -1.82 1 76 HIS -1.69 0.21 1 79 GLN -2.78 -1.38 1 80 LYS -0.89 -0.62 1 81 TYR -3.97 -0.82 1 82 LEU -3.30 -0.41 1 83 VAL -3.60 -1.37 1 84 GLN -7.33 -0.65 1 85 VAL -5.77 -2.70 1 86 ARG -3.82 -1.24 1 88 LYS -1.94 -1.01 1 90 ASP 3.64 2.70 1 91 HIS 1.00 1.06 1 93 TYR -3.64 -1.98 1 94 TRP -0.81 0.12 1 95 SER -3.97 -0.46 1 96 ALA 0.17 -0.11 1 97 TRP 0.23 0.33 1 98 SER 2.54 1.45 1 100 ALA -0.06 -0.19 1 101 THR -1.50 -0.36 1 102 PHE -4.27 -1.82 1 103 ILE -5.88 -3.05 1 104 GLN -1.14 -1.22 1 107 SER 2.76 2.05 1 108 ASP -0.02 -0.97 1 109 PHE 0.53 1.01 1 110 THR -0.33 -0.06 1 111 MET -0.22 0.05 1 112 ASN -0.46 0.24 1 113 ASP 0.69 1.82 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17752_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 4.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.77 _LACS_plot.Line_2_terminator_val_x_2 3.64 _LACS_plot.Line_2_terminator_val_y_2 -1.23 _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 54 GLU 3.44 0.12 0 105 ILE 0.33 -3.01 0 68 THR 0.18 -3.02 0 70 PHE -4.81 6.07 0 10 LEU -5.09 3.91 1 11 GLU 1.93 -2.11 1 12 LEU 1.51 -0.38 1 13 ALA -4.04 2.69 1 14 VAL -5.41 2.36 1 15 GLU -6.22 4.84 1 16 VAL 1.41 -1.33 1 17 LYS -2.57 -0.11 1 18 GLN -2.22 1.31 1 20 GLU 1.91 -0.25 1 21 ASP 0.67 -0.64 1 22 ARG -2.29 1.10 1 23 LYS 1.41 -0.99 1 25 TYR -3.84 1.59 1 26 LEU -3.63 2.32 1 27 TRP -4.12 1.78 1 28 ILE -3.17 2.22 1 29 LYS -3.91 2.85 1 30 TRP -0.30 -0.12 1 31 SER -1.65 0.55 1 34 THR 1.48 -0.45 1 35 LEU -0.24 -0.06 1 36 ILE 0.85 -0.25 1 37 ASP 0.15 0.00 1 38 LEU 0.83 -0.18 1 39 LYS 1.84 -0.88 1 40 THR 0.64 -0.29 1 42 TRP -0.34 -0.40 1 43 PHE -1.14 0.55 1 44 THR -0.66 0.69 1 45 LEU -3.27 2.02 1 46 LEU -5.19 2.33 1 47 TYR -5.00 4.40 1 48 GLU -7.81 6.02 1 49 ILE -6.18 3.46 1 50 ARG -5.92 3.37 1 51 LEU -5.01 4.51 1 52 LYS 0.42 0.21 1 55 LYS 1.31 -1.42 1 56 ALA -2.04 1.19 1 57 ALA 0.11 0.67 1 58 GLU -4.18 2.35 1 59 TRP -1.97 1.46 1 60 GLU -2.57 1.77 1 61 ILE -1.92 0.85 1 62 HIS -6.03 5.94 1 63 PHE 0.81 -0.41 1 64 ALA -1.77 0.60 1 66 GLN -0.47 0.66 1 67 GLN -1.15 1.47 1 69 GLU -6.14 3.28 1 71 LYS -3.74 2.24 1 72 ILE -2.51 0.50 1 73 LEU 0.28 0.79 1 74 SER -0.07 -0.97 1 75 LEU -5.34 3.52 1 76 HIS -1.69 1.90 1 79 GLN -2.78 1.40 1 80 LYS -0.89 0.27 1 81 TYR -3.97 3.15 1 82 LEU -3.30 2.89 1 83 VAL -3.60 2.23 1 84 GLN -7.33 6.68 1 85 VAL -5.77 3.07 1 86 ARG -3.82 2.58 1 88 LYS -1.94 0.93 1 90 ASP 3.64 -0.94 1 91 HIS 1.00 0.06 1 93 TYR -3.64 1.66 1 94 TRP -0.81 0.93 1 95 SER -3.97 3.51 1 96 ALA 0.17 -0.28 1 97 TRP 0.23 0.10 1 98 SER 2.54 -1.09 1 100 ALA -0.06 -0.13 1 101 THR -1.50 1.14 1 102 PHE -4.27 2.45 1 103 ILE -5.88 2.83 1 104 GLN -1.14 -0.08 1 107 SER 2.76 -0.71 1 108 ASP -0.02 -0.95 1 109 PHE 0.53 0.48 1 110 THR -0.33 0.27 1 111 MET -0.22 0.27 1 112 ASN -0.46 0.70 1 113 ASP 0.69 1.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17752_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 0.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 3.64 _LACS_plot.Line_2_terminator_val_y_2 -0.43 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 LEU -5.01 1.86 0 10 LEU -5.09 0.30 1 11 GLU 1.93 -0.54 1 12 LEU 1.51 0.56 1 13 ALA -4.04 0.51 1 14 VAL -5.41 1.17 1 15 GLU -6.22 0.31 1 16 VAL 1.41 0.32 1 17 LYS -2.57 0.08 1 18 GLN -2.22 0.04 1 20 GLU 1.91 -0.27 1 21 ASP 0.67 -0.16 1 22 ARG -2.29 0.15 1 23 LYS 1.41 -0.12 1 25 TYR -3.84 0.58 1 26 LEU -3.63 0.57 1 27 TRP -4.12 0.89 1 28 ILE -3.17 0.64 1 29 LYS -3.91 0.23 1 30 TRP -0.30 0.35 1 31 SER -1.65 0.36 1 34 THR 1.48 -0.20 1 35 LEU -0.24 0.09 1 36 ILE 0.85 -0.10 1 37 ASP 0.15 -0.07 1 38 LEU 0.83 -0.12 1 39 LYS 1.84 -0.10 1 40 THR 0.64 -0.16 1 42 TRP -0.34 -0.03 1 43 PHE -1.14 0.05 1 44 THR -0.66 -0.03 1 45 LEU -3.27 0.18 1 46 LEU -5.19 0.33 1 47 TYR -5.00 1.10 1 48 GLU -7.81 0.48 1 49 ILE -6.18 0.90 1 50 ARG -5.92 1.54 1 52 LYS 0.42 0.34 1 54 GLU 3.44 -0.77 1 55 LYS 1.31 -0.17 1 56 ALA -2.04 -0.07 1 57 ALA 0.11 -0.15 1 58 GLU -4.18 0.21 1 59 TRP -1.97 -0.33 1 60 GLU -2.57 0.34 1 61 ILE -1.92 0.80 1 62 HIS -6.03 0.02 1 63 PHE 0.81 0.28 1 64 ALA -1.77 0.32 1 66 GLN -0.47 0.78 1 67 GLN -1.15 0.03 1 68 THR 0.18 -1.09 1 69 GLU -6.14 0.25 1 70 PHE -4.81 -0.08 1 71 LYS -3.74 1.35 1 72 ILE -2.51 0.16 1 73 LEU 0.28 0.31 1 74 SER -0.07 0.32 1 75 LEU -5.34 0.11 1 76 HIS -1.69 0.00 1 79 GLN -2.78 0.22 1 80 LYS -0.89 0.67 1 81 TYR -3.97 0.53 1 82 LEU -3.30 0.65 1 83 VAL -3.60 1.05 1 84 GLN -7.33 0.03 1 85 VAL -5.77 1.32 1 86 ARG -3.82 0.25 1 88 LYS -1.94 0.04 1 90 ASP 3.64 -0.07 1 91 HIS 1.00 -0.24 1 93 TYR -3.64 0.04 1 94 TRP -0.81 -0.26 1 95 SER -3.97 -0.16 1 96 ALA 0.17 -0.19 1 97 TRP 0.23 -0.35 1 98 SER 2.54 -0.41 1 100 ALA -0.06 0.36 1 101 THR -1.50 0.25 1 102 PHE -4.27 1.25 1 103 ILE -5.88 0.50 1 104 GLN -1.14 0.25 1 105 ILE 0.33 -0.04 1 107 SER 2.76 -0.36 1 108 ASP -0.02 0.02 1 109 PHE 0.53 -0.21 1 110 THR -0.33 -0.06 1 111 MET -0.22 0.07 1 112 ASN -0.46 0.05 1 113 ASP 0.69 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17752_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -2.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 3.64 _LACS_plot.Line_2_terminator_val_y_2 0.22 _LACS_plot.Y_axis_chem_shift_offset 0.84 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 ASP 0.69 -7.53 0 10 LEU -5.09 -1.64 1 11 GLU 1.93 -1.48 1 12 LEU 1.51 -1.36 1 13 ALA -4.04 -2.24 1 14 VAL -5.41 -1.84 1 15 GLU -6.22 -2.02 1 16 VAL 1.41 -0.82 1 17 LYS -2.57 -2.05 1 18 GLN -2.22 -1.81 1 20 GLU 1.91 0.36 1 21 ASP 0.67 -1.03 1 22 ARG -2.29 -1.55 1 23 LYS 1.41 -1.16 1 25 TYR -3.84 -3.23 1 26 LEU -3.63 -3.32 1 27 TRP -4.12 -2.29 1 28 ILE -3.17 -3.40 1 29 LYS -3.91 -2.84 1 30 TRP -0.30 -2.75 1 31 SER -1.65 -1.84 1 34 THR 1.48 -0.12 1 35 LEU -0.24 -0.81 1 36 ILE 0.85 -0.71 1 37 ASP 0.15 -0.29 1 38 LEU 0.83 0.18 1 39 LYS 1.84 0.42 1 40 THR 0.64 0.21 1 42 TRP -0.34 -0.75 1 43 PHE -1.14 -1.14 1 44 THR -0.66 -1.69 1 45 LEU -3.27 -2.95 1 46 LEU -5.19 -1.05 1 47 TYR -5.00 -0.89 1 48 GLU -7.81 -2.98 1 49 ILE -6.18 -1.56 1 50 ARG -5.92 -3.30 1 51 LEU -5.01 -2.06 1 52 LYS 0.42 -2.34 1 54 GLU 3.44 0.31 1 55 LYS 1.31 -0.07 1 56 ALA -2.04 -0.70 1 57 ALA 0.11 -0.08 1 58 GLU -4.18 -1.74 1 59 TRP -1.97 0.13 1 60 GLU -2.57 -1.70 1 61 ILE -1.92 -0.46 1 62 HIS -6.03 -0.40 1 63 PHE 0.81 -1.19 1 64 ALA -1.77 -0.47 1 66 GLN -0.47 0.83 1 67 GLN -1.15 -2.98 1 68 THR 0.18 -2.97 1 69 GLU -6.14 -1.62 1 70 PHE -4.81 -3.18 1 71 LYS -3.74 -1.94 1 72 ILE -2.51 -1.14 1 73 LEU 0.28 -0.62 1 74 SER -0.07 -1.63 1 75 LEU -5.34 -2.43 1 76 HIS -1.69 0.63 1 79 GLN -2.78 -1.79 1 80 LYS -0.89 -1.14 1 81 TYR -3.97 -1.02 1 82 LEU -3.30 -1.23 1 83 VAL -3.60 -1.29 1 84 GLN -7.33 -3.06 1 85 VAL -5.77 -3.46 1 86 ARG -3.82 -2.69 1 88 LYS -1.94 -2.53 1 90 ASP 3.64 0.29 1 91 HIS 1.00 0.78 1 93 TYR -3.64 -1.21 1 94 TRP -0.81 2.42 1 95 SER -3.97 -0.68 1 96 ALA 0.17 0.51 1 97 TRP 0.23 1.84 1 98 SER 2.54 -2.97 1 100 ALA -0.06 0.24 1 101 THR -1.50 -2.46 1 102 PHE -4.27 -0.53 1 103 ILE -5.88 -4.67 1 104 GLN -1.14 -1.64 1 105 ILE 0.33 0.61 1 107 SER 2.76 -0.84 1 108 ASP -0.02 -0.60 1 109 PHE 0.53 -1.02 1 110 THR -0.33 -0.99 1 111 MET -0.22 -0.64 1 112 ASN -0.46 -1.35 1 stop_ save_