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 bmr6346_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.53 _LACS_plot.Line_1_terminator_val_y_1 -3.49 _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 -2.12 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 5.90 _LACS_plot.Y_axis_chem_shift_offset 0.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 ILE 8.59 1.80 0 10 THR 1.43 0.01 1 11 LEU -2.60 -3.04 1 12 ASN -0.65 -0.63 1 13 ALA -4.22 -2.01 1 14 LEU -3.58 -1.75 1 15 LEU -1.14 -1.75 1 16 ALA -0.63 -1.64 1 17 VAL -1.78 -1.54 1 21 ALA 1.08 0.50 1 23 GLU -0.44 -0.88 1 24 ALA -0.29 -0.50 1 25 GLN -0.87 -0.95 1 27 VAL -2.85 -1.98 1 29 VAL -3.17 -1.87 1 30 LYS 1.67 -0.27 1 31 VAL -4.21 -3.50 1 32 LEU -4.28 -2.34 1 33 ASP 5.07 2.26 1 35 ASP 1.95 0.72 1 36 THR -0.68 -1.26 1 38 SER 3.14 3.01 1 39 GLN 4.35 2.82 1 40 ALA 5.25 2.45 1 41 LYS 5.60 3.61 1 42 GLU 4.56 3.21 1 43 LYS 4.82 3.52 1 44 MET 3.64 4.15 1 45 LEU 5.04 3.60 1 46 ASP 3.36 2.38 1 47 GLN 1.59 0.85 1 48 LEU 2.90 1.78 1 49 TYR 3.12 -0.24 1 50 LYS 4.43 2.49 1 52 VAL 0.13 -0.28 1 54 LEU 5.12 3.30 1 55 THR 6.68 5.02 1 56 GLN -0.53 -1.05 1 57 ARG -0.27 -0.37 1 59 ASP -1.46 -1.18 1 61 ARG 3.83 1.76 1 62 THR 0.84 0.16 1 63 LEU -4.57 -2.10 1 64 ASP -5.82 -2.29 1 65 VAL 0.83 -0.58 1 66 GLU -6.53 -2.83 1 67 TRP -3.03 -3.35 1 68 ARG 1.77 -1.08 1 69 SER 0.52 -0.25 1 71 VAL 2.47 1.13 1 72 ALA -0.13 -0.79 1 74 HIS -1.14 -0.74 1 75 LEU -3.24 -1.24 1 76 ILE 1.39 -2.21 1 77 LEU -0.82 -2.42 1 78 SER -2.79 -1.37 1 79 ASP 3.59 2.89 1 80 GLU -3.90 -1.78 1 81 ASP -1.30 -1.34 1 82 VAL 3.41 1.57 1 83 THR 0.30 0.11 1 84 SER 2.15 1.73 1 85 GLU -0.18 -0.30 1 86 VAL 0.04 -0.54 1 87 GLN -0.60 -1.00 1 89 LEU 1.04 -0.36 1 90 PHE -1.49 -1.14 1 91 ARG -0.66 -1.30 1 92 ARG -0.61 -1.25 1 93 LEU 1.17 -0.37 1 94 ASN 1.99 0.26 1 95 THR -6.33 -3.56 1 96 LEU 6.40 3.28 1 97 GLN 4.44 2.65 1 98 HIS 4.94 4.50 1 99 TYR 0.16 1.34 1 100 LYS 5.54 0.13 1 101 VAL 2.19 0.60 1 103 ASP 2.23 1.46 1 105 ALA -0.40 0.05 1 106 THR 1.53 0.40 1 107 VAL -4.90 -3.71 1 108 ALA -6.09 -3.81 1 109 LEU -0.91 -2.32 1 110 VAL -2.90 -3.20 1 113 LEU 1.13 -0.08 1 114 THR 0.75 0.08 1 115 LYS 0.50 -0.55 1 116 HIS -0.10 0.49 1 117 VAL 0.62 -0.32 1 118 LEU 0.72 -0.47 1 119 ARG 0.66 -0.28 1 120 GLU 0.29 -0.12 1 121 ASN 0.53 -0.07 1 122 GLN 1.17 1.26 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6346_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.53 _LACS_plot.Line_1_terminator_val_y_1 3.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.12 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -2.69 _LACS_plot.Y_axis_chem_shift_offset 0.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 ILE 8.59 -6.79 0 10 THR 1.43 -1.42 1 11 LEU -2.60 -0.44 1 12 ASN -0.65 0.02 1 13 ALA -4.22 2.21 1 14 LEU -3.58 1.83 1 15 LEU -1.14 -0.61 1 16 ALA -0.63 -1.01 1 17 VAL -1.78 0.24 1 21 ALA 1.08 -0.58 1 23 GLU -0.44 -0.44 1 24 ALA -0.29 -0.21 1 25 GLN -0.87 -0.08 1 27 VAL -2.85 0.87 1 29 VAL -3.17 1.30 1 30 LYS 1.67 -1.94 1 31 VAL -4.21 0.71 1 32 LEU -4.28 1.94 1 33 ASP 5.07 -2.81 1 35 ASP 1.95 -1.23 1 36 THR -0.68 -0.58 1 38 SER 3.14 -0.13 1 39 GLN 4.35 -1.53 1 40 ALA 5.25 -2.80 1 41 LYS 5.60 -1.99 1 42 GLU 4.56 -1.35 1 43 LYS 4.82 -1.30 1 44 MET 3.64 0.51 1 45 LEU 5.04 -1.44 1 46 ASP 3.36 -0.98 1 47 GLN 1.59 -0.74 1 48 LEU 2.90 -1.12 1 49 TYR 3.12 -3.36 1 50 LYS 4.43 -1.94 1 52 VAL 0.13 -0.41 1 54 LEU 5.12 -1.82 1 55 THR 6.68 -1.66 1 56 GLN -0.53 -0.52 1 57 ARG -0.27 -0.10 1 59 ASP -1.46 0.28 1 61 ARG 3.83 -2.07 1 62 THR 0.84 -0.68 1 63 LEU -4.57 2.47 1 64 ASP -5.82 3.53 1 65 VAL 0.83 -1.41 1 66 GLU -6.53 3.70 1 67 TRP -3.03 -0.32 1 68 ARG 1.77 -2.85 1 69 SER 0.52 -0.77 1 71 VAL 2.47 -1.34 1 72 ALA -0.13 -0.66 1 74 HIS -1.14 0.40 1 75 LEU -3.24 2.00 1 76 ILE 1.39 -3.60 1 77 LEU -0.82 -1.60 1 78 SER -2.79 1.42 1 79 ASP 3.59 -0.70 1 80 GLU -3.90 2.12 1 81 ASP -1.30 -0.04 1 82 VAL 3.41 -1.84 1 83 THR 0.30 -0.19 1 84 SER 2.15 -0.42 1 85 GLU -0.18 -0.12 1 86 VAL 0.04 -0.58 1 87 GLN -0.60 -0.40 1 89 LEU 1.04 -1.40 1 90 PHE -1.49 0.35 1 91 ARG -0.66 -0.64 1 92 ARG -0.61 -0.64 1 93 LEU 1.17 -1.54 1 94 ASN 1.99 -1.73 1 95 THR -6.33 2.77 1 96 LEU 6.40 -3.12 1 97 GLN 4.44 -1.79 1 98 HIS 4.94 -0.44 1 99 TYR 0.16 1.18 1 100 LYS 5.54 -5.41 1 101 VAL 2.19 -1.59 1 103 ASP 2.23 -0.77 1 105 ALA -0.40 0.45 1 106 THR 1.53 -1.13 1 107 VAL -4.90 1.19 1 108 ALA -6.09 2.28 1 109 LEU -0.91 -1.41 1 110 VAL -2.90 -0.30 1 113 LEU 1.13 -1.21 1 114 THR 0.75 -0.67 1 115 LYS 0.50 -1.05 1 116 HIS -0.10 0.59 1 117 VAL 0.62 -0.94 1 118 LEU 0.72 -1.19 1 119 ARG 0.66 -0.94 1 120 GLU 0.29 -0.41 1 121 ASN 0.53 -0.60 1 122 GLN 1.17 0.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6346_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.53 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _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 101 VAL 2.19 -1.52 0 10 THR 1.43 0.64 1 11 LEU -2.60 0.45 1 12 ASN -0.65 0.07 1 13 ALA -4.22 1.25 1 14 LEU -3.58 0.42 1 15 LEU -1.14 0.30 1 16 ALA -0.63 0.40 1 17 VAL -1.78 0.20 1 21 ALA 1.08 -0.09 1 23 GLU -0.44 0.05 1 24 ALA -0.29 -0.01 1 25 GLN -0.87 0.08 1 27 VAL -2.85 0.34 1 29 VAL -3.17 0.25 1 30 LYS 1.67 0.70 1 31 VAL -4.21 0.52 1 32 LEU -4.28 0.81 1 33 ASP 5.07 -0.48 1 35 ASP 1.95 0.09 1 36 THR -0.68 0.58 1 37 ILE 8.59 -0.54 1 38 SER 3.14 -0.59 1 39 GLN 4.35 -0.24 1 40 ALA 5.25 -0.32 1 41 LYS 5.60 -0.42 1 42 GLU 4.56 -0.43 1 43 LYS 4.82 -0.14 1 44 MET 3.64 -0.54 1 45 LEU 5.04 -0.34 1 46 ASP 3.36 -0.22 1 47 GLN 1.59 0.02 1 48 LEU 2.90 -0.29 1 49 TYR 3.12 -0.08 1 50 LYS 4.43 -0.21 1 52 VAL 0.13 0.12 1 54 LEU 5.12 0.29 1 55 THR 6.68 -0.20 1 56 GLN -0.53 0.12 1 57 ARG -0.27 -0.65 1 59 ASP -1.46 -0.26 1 61 ARG 3.83 -0.13 1 62 THR 0.84 0.10 1 63 LEU -4.57 0.91 1 64 ASP -5.82 0.65 1 65 VAL 0.83 0.30 1 66 GLU -6.53 0.76 1 67 TRP -3.03 0.63 1 68 ARG 1.77 0.14 1 69 SER 0.52 -0.30 1 71 VAL 2.47 -0.06 1 72 ALA -0.13 0.01 1 74 HIS -1.14 0.36 1 75 LEU -3.24 0.40 1 76 ILE 1.39 0.56 1 77 LEU -0.82 -0.06 1 78 SER -2.79 0.25 1 79 ASP 3.59 0.07 1 80 GLU -3.90 0.30 1 81 ASP -1.30 0.08 1 82 VAL 3.41 0.13 1 83 THR 0.30 0.17 1 84 SER 2.15 -0.59 1 85 GLU -0.18 0.02 1 86 VAL 0.04 0.21 1 87 GLN -0.60 0.16 1 89 LEU 1.04 -0.13 1 90 PHE -1.49 0.21 1 91 ARG -0.66 0.23 1 92 ARG -0.61 0.06 1 93 LEU 1.17 0.08 1 94 ASN 1.99 -0.63 1 95 THR -6.33 0.93 1 96 LEU 6.40 -0.27 1 97 GLN 4.44 -0.15 1 98 HIS 4.94 -0.58 1 99 TYR 0.16 -0.27 1 100 LYS 5.54 -0.50 1 103 ASP 2.23 -0.32 1 105 ALA -0.40 -0.07 1 106 THR 1.53 1.03 1 107 VAL -4.90 1.13 1 108 ALA -6.09 1.17 1 109 LEU -0.91 1.11 1 110 VAL -2.90 0.50 1 113 LEU 1.13 0.08 1 114 THR 0.75 -0.07 1 115 LYS 0.50 0.00 1 116 HIS -0.10 -0.05 1 117 VAL 0.62 -0.02 1 118 LEU 0.72 0.06 1 119 ARG 0.66 0.03 1 120 GLU 0.29 -0.03 1 121 ASN 0.53 -0.02 1 122 GLN 1.17 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6346_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.53 _LACS_plot.Line_1_terminator_val_y_1 -2.50 _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 -1.13 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 2.76 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 THR -6.33 1.78 0 10 THR 1.43 -0.20 1 11 LEU -2.60 -2.11 1 12 ASN -0.65 -2.24 1 13 ALA -4.22 -1.25 1 14 LEU -3.58 -2.41 1 15 LEU -1.14 -2.21 1 16 ALA -0.63 -1.77 1 17 VAL -1.78 -0.60 1 21 ALA 1.08 0.65 1 23 GLU -0.44 -0.44 1 24 ALA -0.29 -0.81 1 25 GLN -0.87 0.18 1 27 VAL -2.85 -1.32 1 29 VAL -3.17 -1.89 1 30 LYS 1.67 0.05 1 31 VAL -4.21 -2.38 1 32 LEU -4.28 0.53 1 33 ASP 5.07 -0.60 1 35 ASP 1.95 1.06 1 36 THR -0.68 0.19 1 37 ILE 8.59 3.16 1 38 SER 3.14 2.98 1 39 GLN 4.35 3.67 1 40 ALA 5.25 1.24 1 41 LYS 5.60 1.43 1 42 GLU 4.56 2.27 1 43 LYS 4.82 3.96 1 44 MET 3.64 1.83 1 45 LEU 5.04 0.65 1 46 ASP 3.36 1.81 1 47 GLN 1.59 2.63 1 48 LEU 2.90 0.13 1 49 TYR 3.12 -1.27 1 50 LYS 4.43 1.56 1 52 VAL 0.13 -0.96 1 54 LEU 5.12 1.86 1 55 THR 6.68 0.89 1 56 GLN -0.53 -0.81 1 57 ARG -0.27 0.69 1 59 ASP -1.46 0.26 1 61 ARG 3.83 1.55 1 62 THR 0.84 -0.96 1 63 LEU -4.57 -2.23 1 64 ASP -5.82 -1.04 1 65 VAL 0.83 -2.84 1 66 GLU -6.53 -1.31 1 67 TRP -3.03 -0.39 1 68 ARG 1.77 -1.28 1 69 SER 0.52 0.38 1 71 VAL 2.47 0.27 1 72 ALA -0.13 -0.59 1 74 HIS -1.14 0.29 1 75 LEU -3.24 -2.23 1 76 ILE 1.39 -0.12 1 77 LEU -0.82 -2.71 1 78 SER -2.79 -1.36 1 79 ASP 3.59 0.63 1 80 GLU -3.90 -2.31 1 81 ASP -1.30 1.00 1 82 VAL 3.41 0.32 1 83 THR 0.30 0.87 1 84 SER 2.15 -0.52 1 85 GLU -0.18 -0.76 1 86 VAL 0.04 -0.32 1 87 GLN -0.60 -0.14 1 89 LEU 1.04 -0.80 1 90 PHE -1.49 -1.21 1 91 ARG -0.66 -0.81 1 92 ARG -0.61 0.51 1 93 LEU 1.17 0.03 1 94 ASN 1.99 -1.23 1 96 LEU 6.40 2.29 1 97 GLN 4.44 3.34 1 98 HIS 4.94 2.39 1 99 TYR 0.16 -2.42 1 100 LYS 5.54 -0.45 1 101 VAL 2.19 1.25 1 103 ASP 2.23 2.15 1 105 ALA -0.40 -1.59 1 106 THR 1.53 -0.59 1 107 VAL -4.90 -3.48 1 108 ALA -6.09 -1.45 1 109 LEU -0.91 -2.20 1 110 VAL -2.90 0.50 1 113 LEU 1.13 0.10 1 114 THR 0.75 -0.53 1 115 LYS 0.50 -0.49 1 116 HIS -0.10 0.88 1 117 VAL 0.62 -0.51 1 118 LEU 0.72 -0.53 1 119 ARG 0.66 -0.13 1 120 GLU 0.29 -0.39 1 121 ASN 0.53 -1.02 1 stop_ save_