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 bmr27830_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.39 _LACS_plot.Line_1_terminator_val_y_1 -2.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.18 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 5.10 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 SER 7.52 5.31 0 122 LEU 1.71 -1.90 0 10 VAL 0.02 0.67 1 11 GLU -4.07 -1.45 1 13 LEU -3.42 -0.89 1 15 ILE 2.46 -0.71 1 17 LEU -3.41 -1.53 1 18 ALA 0.53 -0.07 1 19 VAL -3.36 -1.28 1 20 ALA 3.00 2.01 1 22 HIS 2.32 1.34 1 23 HIS 1.79 3.43 1 24 GLN -1.54 -0.84 1 26 ALA -2.33 -1.02 1 28 PHE 0.65 1.28 1 29 TYR -0.55 1.82 1 30 LEU -3.49 -1.50 1 31 THR -3.31 -2.41 1 32 ALA 2.46 2.05 1 33 ASP -0.51 -0.98 1 34 MET 2.28 2.61 1 35 PHE 3.14 -0.19 1 38 LEU -6.54 -1.88 1 40 VAL -7.21 -4.60 1 41 GLN -5.47 -0.97 1 42 LEU -4.02 1.08 1 43 ALA -4.20 -2.69 1 46 GLU -0.47 -0.62 1 47 LEU -0.45 0.82 1 49 THR 0.99 0.30 1 50 LEU -1.27 -0.90 1 51 VAL 5.11 3.22 1 53 LYS -4.08 -3.59 1 55 VAL 1.09 -0.29 1 56 ALA -0.31 -0.13 1 57 ALA 0.75 -0.02 1 59 HIS -2.57 -0.05 1 60 THR -4.17 -2.90 1 61 HIS -2.55 -0.11 1 64 ASP 5.44 4.11 1 67 TYR -0.37 -0.12 1 68 LEU -3.93 -1.55 1 69 LEU -5.43 -1.97 1 70 VAL -5.96 -2.76 1 71 SER 1.11 1.90 1 73 ASN -3.09 -1.04 1 74 LYS 3.65 2.65 1 77 ALA -4.84 -2.07 1 78 ARG -6.00 -1.28 1 79 ILE -5.13 -2.50 1 80 GLU -6.16 -2.49 1 81 VAL -2.71 -0.76 1 82 GLN -1.58 -1.22 1 83 LEU -3.56 -0.73 1 84 ASP 2.56 1.95 1 86 ARG -2.89 -1.22 1 87 ARG -2.28 -0.78 1 88 HIS -4.95 0.19 1 89 GLU -3.16 -0.76 1 90 LEU -4.70 -1.24 1 91 LEU -5.31 -2.12 1 92 SER 0.42 -0.10 1 94 ALA -5.58 -0.14 1 95 VAL -5.93 -2.78 1 96 MET -7.39 -1.77 1 97 ARG 1.24 1.33 1 100 ALA 1.45 1.05 1 102 SER 0.09 0.31 1 103 GLU -4.74 -3.05 1 106 PHE -4.02 -2.29 1 108 THR 6.42 4.15 1 109 LEU 0.55 0.63 1 110 GLU -4.27 -0.64 1 111 ALA -2.04 0.65 1 112 GLU -3.09 -2.65 1 113 VAL 4.48 2.98 1 115 SER -0.70 0.03 1 116 TYR -5.56 -0.64 1 118 PHE -3.38 -1.95 1 120 ILE -0.12 -0.12 1 124 ASP -0.24 -0.57 1 125 ARG -3.54 -1.05 1 126 LEU -1.98 1.05 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27830_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.39 _LACS_plot.Line_1_terminator_val_y_1 4.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.82 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 -2.41 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 SER 7.52 -2.21 0 122 LEU 1.71 -3.61 0 10 VAL 0.02 0.65 1 11 GLU -4.07 2.62 1 13 LEU -3.42 2.53 1 15 ILE 2.46 -3.17 1 17 LEU -3.41 1.88 1 18 ALA 0.53 -0.60 1 19 VAL -3.36 2.08 1 20 ALA 3.00 -0.99 1 22 HIS 2.32 -0.98 1 23 HIS 1.79 1.64 1 24 GLN -1.54 0.70 1 26 ALA -2.33 1.31 1 28 PHE 0.65 0.63 1 29 TYR -0.55 2.37 1 30 LEU -3.49 1.99 1 31 THR -3.31 0.90 1 32 ALA 2.46 -0.41 1 33 ASP -0.51 -0.47 1 34 MET 2.28 0.33 1 35 PHE 3.14 -3.33 1 38 LEU -6.54 4.66 1 40 VAL -7.21 2.61 1 41 GLN -5.47 4.50 1 42 LEU -4.02 5.10 1 43 ALA -4.20 1.51 1 46 GLU -0.47 -0.15 1 47 LEU -0.45 1.27 1 49 THR 0.99 -0.69 1 50 LEU -1.27 0.37 1 51 VAL 5.11 -1.89 1 53 LYS -4.08 0.49 1 55 VAL 1.09 -1.38 1 56 ALA -0.31 0.18 1 57 ALA 0.75 -0.77 1 59 HIS -2.57 2.52 1 60 THR -4.17 1.27 1 61 HIS -2.55 2.44 1 64 ASP 5.44 -1.33 1 67 TYR -0.37 0.25 1 68 LEU -3.93 2.38 1 69 LEU -5.43 3.46 1 70 VAL -5.96 3.20 1 71 SER 1.11 0.79 1 73 ASN -3.09 2.05 1 74 LYS 3.65 -1.00 1 77 ALA -4.84 2.77 1 78 ARG -6.00 4.72 1 79 ILE -5.13 2.63 1 80 GLU -6.16 3.67 1 81 VAL -2.71 1.95 1 82 GLN -1.58 0.36 1 83 LEU -3.56 2.83 1 84 ASP 2.56 -0.61 1 86 ARG -2.89 1.67 1 87 ARG -2.28 1.50 1 88 HIS -4.95 5.14 1 89 GLU -3.16 2.40 1 90 LEU -4.70 3.46 1 91 LEU -5.31 3.19 1 92 SER 0.42 -0.52 1 94 ALA -5.58 5.44 1 95 VAL -5.93 3.15 1 96 MET -7.39 5.62 1 97 ARG 1.24 0.09 1 100 ALA 1.45 -0.40 1 102 SER 0.09 0.22 1 103 GLU -4.74 1.69 1 106 PHE -4.02 1.73 1 108 THR 6.42 -2.27 1 109 LEU 0.55 0.08 1 110 GLU -4.27 3.63 1 111 ALA -2.04 2.69 1 112 GLU -3.09 0.44 1 113 VAL 4.48 -1.50 1 115 SER -0.70 0.73 1 116 TYR -5.56 4.92 1 118 PHE -3.38 1.43 1 120 ILE -0.12 0.00 1 124 ASP -0.24 -0.33 1 125 ARG -3.54 2.49 1 126 LEU -1.98 3.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27830_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.39 _LACS_plot.Line_1_terminator_val_y_1 0.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 THR 6.42 -0.24 0 48 SER 7.52 -0.52 0 13 LEU -3.42 -0.50 0 95 VAL -5.93 1.68 0 10 VAL 0.02 0.21 1 11 GLU -4.07 0.55 1 15 ILE 2.46 0.13 1 17 LEU -3.41 0.40 1 18 ALA 0.53 0.12 1 19 VAL -3.36 -0.01 1 20 ALA 3.00 -0.15 1 26 ALA -2.33 0.44 1 28 PHE 0.65 0.01 1 29 TYR -0.55 -0.09 1 30 LEU -3.49 0.85 1 31 THR -3.31 0.69 1 32 ALA 2.46 -0.26 1 33 ASP -0.51 -0.21 1 34 MET 2.28 -0.85 1 35 PHE 3.14 -0.30 1 38 LEU -6.54 0.38 1 40 VAL -7.21 0.96 1 41 GLN -5.47 0.22 1 42 LEU -4.02 0.88 1 43 ALA -4.20 0.74 1 46 GLU -0.47 -0.31 1 47 LEU -0.45 -0.10 1 49 THR 0.99 0.22 1 50 LEU -1.27 0.18 1 51 VAL 5.11 -0.87 1 55 VAL 1.09 0.04 1 56 ALA -0.31 -0.17 1 57 ALA 0.75 -0.09 1 59 HIS -2.57 0.34 1 60 THR -4.17 0.53 1 61 HIS -2.55 0.39 1 67 TYR -0.37 -0.20 1 68 LEU -3.93 0.66 1 69 LEU -5.43 0.98 1 70 VAL -5.96 0.63 1 73 ASN -3.09 0.25 1 74 LYS 3.65 -0.24 1 77 ALA -4.84 0.61 1 78 ARG -6.00 1.16 1 79 ILE -5.13 1.17 1 80 GLU -6.16 0.90 1 81 VAL -2.71 0.81 1 82 GLN -1.58 0.79 1 83 LEU -3.56 0.71 1 84 ASP 2.56 -0.19 1 86 ARG -2.89 0.24 1 87 ARG -2.28 0.61 1 89 GLU -3.16 0.90 1 90 LEU -4.70 0.41 1 91 LEU -5.31 0.82 1 92 SER 0.42 -0.58 1 94 ALA -5.58 0.74 1 96 MET -7.39 1.07 1 97 ARG 1.24 0.27 1 100 ALA 1.45 -0.36 1 102 SER 0.09 0.03 1 109 LEU 0.55 0.19 1 110 GLU -4.27 -0.02 1 111 ALA -2.04 0.44 1 112 GLU -3.09 0.27 1 113 VAL 4.48 -0.28 1 115 SER -0.70 0.64 1 116 TYR -5.56 0.33 1 118 PHE -3.38 0.89 1 120 ILE -0.12 0.40 1 122 LEU 1.71 0.21 1 124 ASP -0.24 -0.35 1 125 ARG -3.54 0.16 1 126 LEU -1.98 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27830_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.39 _LACS_plot.Line_1_terminator_val_y_1 -2.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 1.64 _LACS_plot.Y_axis_chem_shift_offset 0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 LEU -6.54 1.13 0 48 SER 7.52 2.47 0 108 THR 6.42 -0.99 0 46 GLU -0.47 3.46 0 10 VAL 0.02 -1.42 1 11 GLU -4.07 -0.20 1 13 LEU -3.42 -1.29 1 17 LEU -3.41 -1.89 1 18 ALA 0.53 -0.55 1 19 VAL -3.36 -1.03 1 22 HIS 2.32 1.68 1 23 HIS 1.79 1.21 1 28 PHE 0.65 0.05 1 29 TYR -0.55 -3.13 1 30 LEU -3.49 -0.26 1 31 THR -3.31 0.77 1 32 ALA 2.46 -0.99 1 33 ASP -0.51 0.33 1 34 MET 2.28 -0.02 1 35 PHE 3.14 0.35 1 40 VAL -7.21 -3.54 1 41 GLN -5.47 -1.75 1 42 LEU -4.02 -4.43 1 43 ALA -4.20 -1.84 1 47 LEU -0.45 1.70 1 49 THR 0.99 0.53 1 50 LEU -1.27 -0.59 1 51 VAL 5.11 1.88 1 55 VAL 1.09 0.15 1 56 ALA -0.31 -0.42 1 60 THR -4.17 -1.35 1 61 HIS -2.55 1.73 1 67 TYR -0.37 -1.44 1 68 LEU -3.93 -4.91 1 69 LEU -5.43 -2.97 1 70 VAL -5.96 -3.54 1 73 ASN -3.09 0.16 1 74 LYS 3.65 1.21 1 77 ALA -4.84 -3.43 1 78 ARG -6.00 -0.27 1 79 ILE -5.13 -3.64 1 80 GLU -6.16 -0.76 1 81 VAL -2.71 -0.62 1 82 GLN -1.58 -0.93 1 83 LEU -3.56 -1.72 1 84 ASP 2.56 -0.53 1 86 ARG -2.89 -1.81 1 87 ARG -2.28 -1.21 1 88 HIS -4.95 0.00 1 89 GLU -3.16 -1.46 1 90 LEU -4.70 -3.65 1 91 LEU -5.31 -0.91 1 92 SER 0.42 -0.09 1 94 ALA -5.58 -2.76 1 95 VAL -5.93 -2.75 1 96 MET -7.39 -2.67 1 97 ARG 1.24 -1.44 1 102 SER 0.09 -0.52 1 109 LEU 0.55 -0.72 1 110 GLU -4.27 -2.57 1 111 ALA -2.04 -3.51 1 112 GLU -3.09 -0.32 1 113 VAL 4.48 0.97 1 115 SER -0.70 -1.30 1 116 TYR -5.56 -1.19 1 118 PHE -3.38 -1.06 1 120 ILE -0.12 -1.90 1 122 LEU 1.71 -2.10 1 124 ASP -0.24 -1.25 1 125 ARG -3.54 -2.40 1 stop_ save_