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 bmr5126_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _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 -0.79 _LACS_plot.Line_2_terminator_val_x_2 5.71 _LACS_plot.Line_2_terminator_val_y_2 3.90 _LACS_plot.Y_axis_chem_shift_offset -0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 THR 0.01 -2.61 0 69 HIS -4.49 2.36 0 12 GLU -6.70 -2.08 1 13 ASN 2.81 1.34 1 14 VAL 2.84 1.02 1 15 VAL -3.42 -0.28 1 16 ALA -7.93 -2.97 1 17 ARG -4.20 -1.20 1 19 VAL -2.35 -0.35 1 21 SER 5.71 3.38 1 22 ASN -2.56 -0.72 1 24 ARG -0.59 -0.53 1 25 ARG -6.17 -1.76 1 26 LEU -6.56 -0.86 1 27 GLU -2.33 -1.11 1 28 VAL -2.62 -1.17 1 29 THR -4.24 -1.03 1 30 TRP -2.22 -0.38 1 31 GLN -5.06 -1.90 1 32 THR 2.50 2.05 1 34 SER 4.15 3.42 1 35 THR -0.39 -0.70 1 36 TRP -2.45 -1.01 1 38 ASP -0.20 0.45 1 40 GLU 2.55 2.33 1 41 SER 2.08 1.91 1 42 PHE -0.25 -0.12 1 44 LEU -3.79 -1.55 1 45 LYS -4.04 -1.75 1 46 PHE -3.90 -0.29 1 47 PHE -5.25 -2.52 1 48 LEU -5.29 -0.97 1 49 ARG -5.66 -2.79 1 50 TYR -6.58 -2.15 1 51 ARG 0.81 0.36 1 53 LEU 2.91 2.79 1 54 ILE 1.37 1.47 1 55 LEU -4.02 -1.43 1 56 ASP 0.00 0.22 1 57 GLN -1.67 -0.51 1 58 TRP -1.83 -0.02 1 59 GLN -1.55 -0.45 1 60 HIS -3.40 1.23 1 61 VAL -3.58 -0.48 1 62 GLU -1.08 0.02 1 63 LEU -2.10 -0.94 1 64 SER -0.20 -0.42 1 65 ASN -0.16 0.89 1 68 ALA -5.75 -1.61 1 70 THR -0.37 -0.27 1 71 ILE -0.65 0.39 1 72 THR -0.06 -0.14 1 73 ASP -1.13 -1.83 1 74 ALA 0.88 -0.08 1 75 TYR 0.31 0.09 1 76 ALA 0.98 0.88 1 78 LYS -2.57 -2.01 1 79 GLU -0.25 0.63 1 80 TYR -3.92 0.45 1 81 ILE -4.26 -1.46 1 82 ILE -5.14 -0.22 1 83 GLN -8.70 -0.66 1 84 VAL -4.34 -1.65 1 85 ALA -4.42 -1.72 1 86 ALA -7.83 -2.32 1 87 LYS -4.53 -1.49 1 88 ASP -1.34 0.05 1 89 ASN 1.12 2.50 1 90 GLU 0.51 1.73 1 91 ILE -0.74 -0.02 1 93 THR -1.87 -1.05 1 94 TRP -1.24 0.13 1 95 SER -3.67 -0.18 1 96 ASP 0.64 0.65 1 97 TRP -0.57 0.97 1 98 SER -2.30 0.55 1 99 VAL 3.56 2.90 1 100 ALA -0.13 0.62 1 101 ALA -4.26 -1.76 1 102 HIS -3.76 -0.53 1 103 ALA -5.15 0.44 1 104 THR -2.30 -0.28 1 106 TRP 1.57 2.00 1 107 THR -3.44 -1.67 1 108 GLU -0.47 0.27 1 109 GLU 0.02 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5126_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 6.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.21 _LACS_plot.Line_2_terminator_val_x_2 5.71 _LACS_plot.Line_2_terminator_val_y_2 -1.81 _LACS_plot.Y_axis_chem_shift_offset -0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 THR 0.01 -2.62 0 69 HIS -4.49 6.85 0 12 GLU -6.70 4.62 1 13 ASN 2.81 -1.47 1 14 VAL 2.84 -1.82 1 15 VAL -3.42 3.14 1 16 ALA -7.93 4.96 1 17 ARG -4.20 3.00 1 19 VAL -2.35 2.00 1 21 SER 5.71 -2.33 1 22 ASN -2.56 1.84 1 24 ARG -0.59 0.06 1 25 ARG -6.17 4.41 1 26 LEU -6.56 5.70 1 27 GLU -2.33 1.22 1 28 VAL -2.62 1.45 1 29 THR -4.24 3.21 1 30 TRP -2.22 1.84 1 31 GLN -5.06 3.16 1 32 THR 2.50 -0.45 1 34 SER 4.15 -0.73 1 35 THR -0.39 -0.31 1 36 TRP -2.45 1.44 1 38 ASP -0.20 0.65 1 40 GLU 2.55 -0.22 1 41 SER 2.08 -0.17 1 42 PHE -0.25 0.13 1 44 LEU -3.79 2.24 1 45 LYS -4.04 2.29 1 46 PHE -3.90 3.61 1 47 PHE -5.25 2.73 1 48 LEU -5.29 4.32 1 49 ARG -5.66 2.87 1 50 TYR -6.58 4.43 1 51 ARG 0.81 -0.45 1 53 LEU 2.91 -0.12 1 54 ILE 1.37 0.10 1 55 LEU -4.02 2.59 1 56 ASP 0.00 0.22 1 57 GLN -1.67 1.16 1 58 TRP -1.83 1.81 1 59 GLN -1.55 1.10 1 60 HIS -3.40 4.63 1 61 VAL -3.58 3.10 1 62 GLU -1.08 1.10 1 63 LEU -2.10 1.16 1 64 SER -0.20 -0.22 1 65 ASN -0.16 1.05 1 68 ALA -5.75 4.14 1 70 THR -0.37 0.10 1 71 ILE -0.65 1.04 1 72 THR -0.06 -0.08 1 73 ASP -1.13 -0.70 1 74 ALA 0.88 -0.96 1 75 TYR 0.31 -0.22 1 76 ALA 0.98 -0.10 1 78 LYS -2.57 0.56 1 79 GLU -0.25 0.88 1 80 TYR -3.92 4.37 1 81 ILE -4.26 2.80 1 82 ILE -5.14 4.92 1 83 GLN -8.70 8.04 1 84 VAL -4.34 2.69 1 85 ALA -4.42 2.70 1 86 ALA -7.83 5.51 1 87 LYS -4.53 3.04 1 88 ASP -1.34 1.39 1 89 ASN 1.12 1.38 1 90 GLU 0.51 1.22 1 91 ILE -0.74 0.72 1 93 THR -1.87 0.82 1 94 TRP -1.24 1.37 1 95 SER -3.67 3.49 1 96 ASP 0.64 0.01 1 97 TRP -0.57 1.54 1 98 SER -2.30 2.85 1 99 VAL 3.56 -0.66 1 100 ALA -0.13 0.75 1 101 ALA -4.26 2.50 1 102 HIS -3.76 3.23 1 103 ALA -5.15 5.59 1 104 THR -2.30 2.02 1 106 TRP 1.57 0.43 1 107 THR -3.44 1.77 1 108 GLU -0.47 0.74 1 109 GLU 0.02 1.61 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5126_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 0.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 5.71 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 67 THR 0.01 -1.19 0 14 VAL 2.84 0.58 0 50 TYR -6.58 1.72 0 83 GLN -8.70 0.19 0 12 GLU -6.70 0.30 1 13 ASN 2.81 -0.47 1 15 VAL -3.42 0.12 1 16 ALA -7.93 1.30 1 17 ARG -4.20 0.39 1 19 VAL -2.35 -0.08 1 21 SER 5.71 -0.76 1 22 ASN -2.56 0.19 1 24 ARG -0.59 0.29 1 25 ARG -6.17 1.13 1 26 LEU -6.56 0.30 1 27 GLU -2.33 0.47 1 28 VAL -2.62 1.18 1 29 THR -4.24 0.54 1 30 TRP -2.22 0.37 1 31 GLN -5.06 0.54 1 32 THR 2.50 -0.33 1 34 SER 4.15 -0.27 1 35 THR -0.39 -0.18 1 36 TRP -2.45 0.02 1 38 ASP -0.20 -0.07 1 40 GLU 2.55 -0.18 1 41 SER 2.08 -0.30 1 42 PHE -0.25 0.16 1 44 LEU -3.79 0.02 1 45 LYS -4.04 0.10 1 46 PHE -3.90 1.17 1 47 PHE -5.25 0.36 1 48 LEU -5.29 0.88 1 49 ARG -5.66 1.50 1 51 ARG 0.81 0.20 1 53 LEU 2.91 -0.71 1 54 ILE 1.37 -0.20 1 55 LEU -4.02 0.29 1 56 ASP 0.00 -0.45 1 57 GLN -1.67 -0.09 1 58 TRP -1.83 -0.47 1 59 GLN -1.55 0.09 1 60 HIS -3.40 0.76 1 61 VAL -3.58 0.25 1 62 GLU -1.08 0.17 1 63 LEU -2.10 0.51 1 64 SER -0.20 0.27 1 65 ASN -0.16 0.44 1 68 ALA -5.75 0.22 1 69 HIS -4.49 0.03 1 70 THR -0.37 0.34 1 71 ILE -0.65 -0.29 1 72 THR -0.06 0.13 1 73 ASP -1.13 0.03 1 74 ALA 0.88 -0.32 1 75 TYR 0.31 -0.11 1 76 ALA 0.98 -0.18 1 78 LYS -2.57 0.28 1 79 GLU -0.25 0.26 1 80 TYR -3.92 0.33 1 81 ILE -4.26 0.74 1 82 ILE -5.14 1.03 1 84 VAL -4.34 1.08 1 85 ALA -4.42 0.06 1 86 ALA -7.83 1.09 1 87 LYS -4.53 -0.07 1 88 ASP -1.34 -0.30 1 89 ASN 1.12 -0.55 1 90 GLU 0.51 -0.13 1 91 ILE -0.74 0.11 1 93 THR -1.87 -0.08 1 94 TRP -1.24 -0.16 1 95 SER -3.67 -0.19 1 96 ASP 0.64 -0.21 1 97 TRP -0.57 -0.48 1 98 SER -2.30 -0.22 1 99 VAL 3.56 -0.17 1 100 ALA -0.13 0.14 1 101 ALA -4.26 0.55 1 102 HIS -3.76 1.21 1 103 ALA -5.15 0.32 1 104 THR -2.30 0.63 1 106 TRP 1.57 -0.51 1 107 THR -3.44 -0.32 1 108 GLU -0.47 -0.72 1 109 GLU 0.02 -0.36 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5126_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 -2.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.52 _LACS_plot.Line_2_terminator_val_x_2 5.71 _LACS_plot.Line_2_terminator_val_y_2 1.44 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 GLU 0.02 -5.05 0 12 GLU -6.70 -0.90 1 13 ASN 2.81 -1.30 1 14 VAL 2.84 0.90 1 15 VAL -3.42 -2.30 1 16 ALA -7.93 -1.90 1 17 ARG -4.20 -0.93 1 19 VAL -2.35 -1.66 1 21 SER 5.71 -1.30 1 22 ASN -2.56 0.21 1 24 ARG -0.59 -1.00 1 25 ARG -6.17 0.60 1 26 LEU -6.56 -2.20 1 27 GLU -2.33 -0.10 1 28 VAL -2.62 -0.30 1 29 THR -4.24 -1.10 1 30 TRP -2.22 -2.40 1 31 GLN -5.06 1.00 1 32 THR 2.50 -1.17 1 34 SER 4.15 1.00 1 35 THR -0.39 0.40 1 36 TRP -2.45 0.22 1 38 ASP -0.20 -0.54 1 40 GLU 2.55 2.20 1 41 SER 2.08 -0.60 1 42 PHE -0.25 -2.21 1 44 LEU -3.79 -0.90 1 45 LYS -4.04 -1.00 1 46 PHE -3.90 -1.60 1 47 PHE -5.25 -2.40 1 48 LEU -5.29 -2.50 1 49 ARG -5.66 -2.20 1 50 TYR -6.58 -1.20 1 51 ARG 0.81 -2.55 1 53 LEU 2.91 1.70 1 54 ILE 1.37 -0.40 1 55 LEU -4.02 -1.60 1 56 ASP 0.00 0.10 1 57 GLN -1.67 -0.90 1 58 TRP -1.83 1.20 1 59 GLN -1.55 -0.70 1 60 HIS -3.40 2.20 1 61 VAL -3.58 -2.00 1 62 GLU -1.08 -0.60 1 63 LEU -2.10 -0.70 1 64 SER -0.20 0.00 1 65 ASN -0.16 0.60 1 67 THR 0.01 -2.70 1 68 ALA -5.75 -0.70 1 69 HIS -4.49 -0.70 1 70 THR -0.37 -0.90 1 71 ILE -0.65 0.70 1 72 THR -0.06 0.20 1 73 ASP -1.13 0.70 1 74 ALA 0.88 -0.10 1 75 TYR 0.31 0.10 1 76 ALA 0.98 3.10 1 78 LYS -2.57 -2.30 1 79 GLU -0.25 0.60 1 80 TYR -3.92 -0.70 1 81 ILE -4.26 -1.10 1 82 ILE -5.14 -0.10 1 83 GLN -8.70 -3.00 1 84 VAL -4.34 -2.10 1 85 ALA -4.42 -2.40 1 86 ALA -7.83 -2.30 1 87 LYS -4.53 -1.80 1 88 ASP -1.34 0.60 1 89 ASN 1.12 1.50 1 90 GLU 0.51 1.20 1 91 ILE -0.74 1.30 1 93 THR -1.87 -0.60 1 94 TRP -1.24 1.90 1 95 SER -3.67 -0.20 1 96 ASP 0.64 1.20 1 97 TRP -0.57 2.00 1 98 SER -2.30 -0.20 1 99 VAL 3.56 2.90 1 100 ALA -0.13 -0.10 1 101 ALA -4.26 -1.10 1 102 HIS -3.76 2.00 1 103 ALA -5.15 -2.30 1 104 THR -2.30 -0.60 1 106 TRP 1.57 -0.10 1 107 THR -3.44 -2.00 1 108 GLU -0.47 -0.60 1 stop_ save_