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 bmr25210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 -2.21 _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 -1.43 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 4.67 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 HIS -4.10 2.13 0 10 LYS -0.78 -0.84 1 11 LEU -1.39 0.10 1 12 THR 2.71 1.26 1 14 GLU 5.13 3.89 1 15 GLU 1.60 2.41 1 16 ARG 5.87 4.15 1 17 SER 4.56 3.48 1 18 ALA 3.62 2.86 1 19 VAL 6.19 4.83 1 20 GLU 4.65 3.85 1 21 ASN 3.86 3.51 1 22 TYR 4.25 3.96 1 23 LEU 4.59 2.92 1 24 GLU 3.15 2.54 1 25 SER 3.28 2.59 1 26 LEU 2.11 1.47 1 27 THR 2.04 1.74 1 28 GLN 1.06 0.72 1 29 VAL 1.02 0.71 1 30 LEU 0.23 0.18 1 31 GLN -0.07 0.02 1 32 VAL -0.04 -0.01 1 36 THR 0.48 0.34 1 38 ALA -0.50 -0.01 1 39 SER -0.35 -0.03 1 40 ALA -1.14 -0.49 1 41 ALA -0.29 -0.09 1 43 ILE -0.57 -0.20 1 44 SER -1.14 -0.98 1 45 LEU -1.95 -0.73 1 46 ALA -3.30 -1.14 1 47 LEU -0.29 -1.03 1 48 ASN -2.46 -1.26 1 49 ALA 3.36 2.76 1 50 GLU 1.04 0.43 1 51 SER 2.35 2.37 1 52 ASN 0.80 0.95 1 53 ASN -1.31 -0.50 1 54 VAL -0.36 -0.45 1 55 MET -2.83 -0.75 1 56 MET -2.09 -0.42 1 57 LEU -3.17 0.07 1 58 THR -1.52 -1.20 1 60 ALA 0.00 0.61 1 61 ILE -1.73 0.06 1 62 THR -1.32 -0.35 1 63 ARG -3.52 -1.52 1 64 TYR -3.53 -0.60 1 66 ILE 0.01 0.25 1 67 SER 0.76 0.64 1 68 THR 1.45 0.58 1 69 ASP -0.08 0.25 1 70 ASP -1.36 -0.32 1 72 ASN 1.02 0.52 1 73 LYS -0.68 -0.56 1 74 TRP -3.29 -1.45 1 75 ARG -4.29 -0.91 1 76 TYR -2.97 0.06 1 77 TYR -5.12 -1.03 1 78 LEU -1.55 -1.03 1 79 ASP 3.79 2.47 1 80 SER 1.13 0.85 1 81 VAL -0.04 0.08 1 82 GLU 0.59 -0.50 1 83 VAL -5.68 -3.57 1 84 HIS 0.16 0.61 1 85 LEU -6.05 -2.73 1 88 PHE 1.35 -1.66 1 89 TRP -2.87 -2.92 1 90 GLU 4.76 3.50 1 91 GLN 2.48 0.99 1 92 TYR -1.42 -2.25 1 93 ILE 3.38 2.84 1 94 ASN -4.83 -1.84 1 95 ASP 4.68 3.83 1 96 GLU -3.20 -0.98 1 97 ASN -4.31 -0.47 1 98 THR 0.86 0.13 1 99 VAL -4.81 -1.89 1 100 GLU -4.27 -1.92 1 101 LEU -6.60 -1.35 1 102 ILE -4.91 -1.78 1 103 HIS 0.08 2.63 1 104 THR -2.27 -0.69 1 105 ASP 2.15 1.73 1 106 SER -0.84 -1.37 1 107 LEU -0.89 0.34 1 109 LEU -4.94 -1.52 1 110 VAL 1.64 0.85 1 111 ILE -0.77 -0.20 1 112 SER -1.38 -0.40 1 113 LEU -4.54 -1.60 1 114 ASN 2.87 1.65 1 116 HIS 1.87 0.21 1 117 THR -3.62 -1.67 1 118 LEU 1.45 1.43 1 119 GLN -0.24 0.33 1 120 GLU 1.07 1.89 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 4.39 _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 0.57 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -1.52 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 HIS -4.10 6.23 0 10 LYS -0.78 -0.06 1 11 LEU -1.39 1.49 1 12 THR 2.71 -1.45 1 14 GLU 5.13 -1.24 1 15 GLU 1.60 0.81 1 16 ARG 5.87 -1.72 1 17 SER 4.56 -1.08 1 18 ALA 3.62 -0.76 1 19 VAL 6.19 -1.36 1 20 GLU 4.65 -0.80 1 21 ASN 3.86 -0.35 1 22 TYR 4.25 -0.29 1 23 LEU 4.59 -1.67 1 24 GLU 3.15 -0.61 1 25 SER 3.28 -0.69 1 26 LEU 2.11 -0.64 1 27 THR 2.04 -0.30 1 28 GLN 1.06 -0.34 1 29 VAL 1.02 -0.31 1 30 LEU 0.23 -0.05 1 31 GLN -0.07 0.09 1 32 VAL -0.04 0.03 1 36 THR 0.48 -0.14 1 38 ALA -0.50 0.49 1 39 SER -0.35 0.32 1 40 ALA -1.14 0.65 1 41 ALA -0.29 0.20 1 43 ILE -0.57 0.37 1 44 SER -1.14 0.16 1 45 LEU -1.95 1.22 1 46 ALA -3.30 2.16 1 47 LEU -0.29 -0.74 1 48 ASN -2.46 1.20 1 49 ALA 3.36 -0.60 1 50 GLU 1.04 -0.61 1 51 SER 2.35 0.02 1 52 ASN 0.80 0.15 1 53 ASN -1.31 0.81 1 54 VAL -0.36 -0.09 1 55 MET -2.83 2.08 1 56 MET -2.09 1.67 1 57 LEU -3.17 3.24 1 58 THR -1.52 0.32 1 60 ALA 0.00 0.61 1 61 ILE -1.73 1.79 1 62 THR -1.32 0.97 1 63 ARG -3.52 2.00 1 64 TYR -3.53 2.93 1 66 ILE 0.01 0.24 1 67 SER 0.76 -0.12 1 68 THR 1.45 -0.87 1 69 ASP -0.08 0.33 1 70 ASP -1.36 1.04 1 72 ASN 1.02 -0.50 1 73 LYS -0.68 0.12 1 74 TRP -3.29 1.84 1 75 ARG -4.29 3.38 1 76 TYR -2.97 3.03 1 77 TYR -5.12 4.09 1 78 LEU -1.55 0.52 1 79 ASP 3.79 -1.32 1 80 SER 1.13 -0.28 1 81 VAL -0.04 0.12 1 82 GLU 0.59 -1.09 1 83 VAL -5.68 2.11 1 84 HIS 0.16 0.45 1 85 LEU -6.05 3.32 1 88 PHE 1.35 -3.01 1 89 TRP -2.87 -0.05 1 90 GLU 4.76 -1.26 1 91 GLN 2.48 -1.49 1 92 TYR -1.42 -0.83 1 93 ILE 3.38 -0.54 1 94 ASN -4.83 2.99 1 95 ASP 4.68 -0.85 1 96 GLU -3.20 2.22 1 97 ASN -4.31 3.84 1 98 THR 0.86 -0.73 1 99 VAL -4.81 2.92 1 100 GLU -4.27 2.35 1 101 LEU -6.60 5.25 1 102 ILE -4.91 3.13 1 103 HIS 0.08 2.55 1 104 THR -2.27 1.58 1 105 ASP 2.15 -0.42 1 106 SER -0.84 -0.53 1 107 LEU -0.89 1.23 1 109 LEU -4.94 3.42 1 110 VAL 1.64 -0.79 1 111 ILE -0.77 0.57 1 112 SER -1.38 0.98 1 113 LEU -4.54 2.94 1 114 ASN 2.87 -1.22 1 116 HIS 1.87 -1.66 1 117 THR -3.62 1.95 1 118 LEU 1.45 -0.02 1 119 GLN -0.24 0.57 1 120 GLU 1.07 0.82 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 0.75 _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 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 85 LEU -6.05 -0.10 0 58 THR -1.52 1.26 0 10 LYS -0.78 0.65 1 11 LEU -1.39 -0.11 1 12 THR 2.71 0.06 1 14 GLU 5.13 -0.30 1 15 GLU 1.60 -0.40 1 16 ARG 5.87 -0.64 1 17 SER 4.56 -0.22 1 18 ALA 3.62 -0.08 1 19 VAL 6.19 -0.52 1 20 GLU 4.65 -0.45 1 21 ASN 3.86 -0.28 1 22 TYR 4.25 -0.27 1 23 LEU 4.59 -0.64 1 24 GLU 3.15 -0.29 1 25 SER 3.28 -0.22 1 26 LEU 2.11 -0.24 1 27 THR 2.04 -0.23 1 28 GLN 1.06 -0.08 1 29 VAL 1.02 -0.09 1 30 LEU 0.23 -0.02 1 31 GLN -0.07 -0.01 1 32 VAL -0.04 -0.04 1 36 THR 0.48 -0.01 1 38 ALA -0.50 0.05 1 39 SER -0.35 -0.05 1 40 ALA -1.14 0.01 1 41 ALA -0.29 -0.08 1 43 ILE -0.57 -0.04 1 44 SER -1.14 -0.01 1 45 LEU -1.95 0.23 1 46 ALA -3.30 0.06 1 47 LEU -0.29 -0.04 1 48 ASN -2.46 0.09 1 49 ALA 3.36 -0.22 1 50 GLU 1.04 0.00 1 51 SER 2.35 0.19 1 52 ASN 0.80 -0.03 1 53 ASN -1.31 0.40 1 54 VAL -0.36 0.20 1 55 MET -2.83 0.30 1 56 MET -2.09 0.57 1 57 LEU -3.17 0.49 1 59 HIS -4.10 -0.11 1 60 ALA 0.00 0.13 1 61 ILE -1.73 0.61 1 62 THR -1.32 0.15 1 63 ARG -3.52 0.80 1 64 TYR -3.53 0.22 1 66 ILE 0.01 -0.04 1 67 SER 0.76 -0.05 1 68 THR 1.45 -0.12 1 69 ASP -0.08 -0.02 1 70 ASP -1.36 -0.21 1 72 ASN 1.02 -0.21 1 73 LYS -0.68 -0.02 1 74 TRP -3.29 0.34 1 75 ARG -4.29 0.29 1 76 TYR -2.97 0.72 1 77 TYR -5.12 0.66 1 78 LEU -1.55 0.34 1 79 ASP 3.79 -0.47 1 80 SER 1.13 -0.08 1 81 VAL -0.04 -0.10 1 82 GLU 0.59 -0.44 1 83 VAL -5.68 0.77 1 84 HIS 0.16 0.12 1 88 PHE 1.35 0.01 1 89 TRP -2.87 0.41 1 90 GLU 4.76 -0.74 1 91 GLN 2.48 -0.24 1 92 TYR -1.42 0.36 1 93 ILE 3.38 -0.54 1 94 ASN -4.83 0.39 1 95 ASP 4.68 -0.36 1 96 GLU -3.20 -0.17 1 97 ASN -4.31 0.88 1 98 THR 0.86 0.27 1 99 VAL -4.81 0.66 1 100 GLU -4.27 1.20 1 101 LEU -6.60 1.35 1 102 ILE -4.91 0.74 1 103 HIS 0.08 -0.08 1 104 THR -2.27 0.05 1 105 ASP 2.15 -0.18 1 106 SER -0.84 -0.05 1 107 LEU -0.89 -0.11 1 109 LEU -4.94 0.52 1 110 VAL 1.64 0.15 1 111 ILE -0.77 0.51 1 112 SER -1.38 0.39 1 113 LEU -4.54 0.51 1 114 ASN 2.87 -0.26 1 116 HIS 1.87 -0.28 1 117 THR -3.62 0.70 1 118 LEU 1.45 0.15 1 119 GLN -0.24 0.00 1 120 GLU 1.07 -0.31 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 -2.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 1.97 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 SER 2.35 7.81 0 10 LYS -0.78 0.69 1 11 LEU -1.39 0.14 1 12 THR 2.71 0.46 1 14 GLU 5.13 3.73 1 15 GLU 1.60 2.33 1 16 ARG 5.87 1.80 1 17 SER 4.56 1.97 1 18 ALA 3.62 3.44 1 19 VAL 6.19 1.56 1 20 GLU 4.65 3.22 1 21 ASN 3.86 2.71 1 22 TYR 4.25 2.80 1 23 LEU 4.59 2.79 1 24 GLU 3.15 2.41 1 25 SER 3.28 1.32 1 26 LEU 2.11 0.91 1 27 THR 2.04 0.58 1 28 GLN 1.06 0.38 1 29 VAL 1.02 -0.02 1 30 LEU 0.23 -0.45 1 31 GLN -0.07 -0.37 1 32 VAL -0.04 -0.55 1 36 THR 0.48 0.68 1 38 ALA -0.50 -0.06 1 39 SER -0.35 -0.65 1 40 ALA -1.14 -1.03 1 41 ALA -0.29 -0.45 1 43 ILE -0.57 -1.08 1 44 SER -1.14 -0.53 1 45 LEU -1.95 -3.20 1 46 ALA -3.30 -1.67 1 47 LEU -0.29 -0.34 1 48 ASN -2.46 2.16 1 49 ALA 3.36 2.03 1 50 GLU 1.04 3.01 1 52 ASN 0.80 -0.54 1 53 ASN -1.31 -2.35 1 54 VAL -0.36 -0.53 1 55 MET -2.83 -1.43 1 56 MET -2.09 -1.53 1 57 LEU -3.17 -2.65 1 58 THR -1.52 0.32 1 59 HIS -4.10 0.85 1 60 ALA 0.00 0.59 1 61 ILE -1.73 -1.21 1 62 THR -1.32 -1.74 1 63 ARG -3.52 -1.21 1 64 TYR -3.53 -0.78 1 66 ILE 0.01 0.53 1 67 SER 0.76 0.33 1 68 THR 1.45 -0.12 1 69 ASP -0.08 -0.84 1 70 ASP -1.36 -0.71 1 72 ASN 1.02 -0.29 1 73 LYS -0.68 -0.84 1 74 TRP -3.29 -0.58 1 75 ARG -4.29 -1.91 1 76 TYR -2.97 -1.61 1 77 TYR -5.12 -0.46 1 78 LEU -1.55 -1.49 1 79 ASP 3.79 -0.84 1 80 SER 1.13 -0.83 1 81 VAL -0.04 -2.01 1 82 GLU 0.59 -0.65 1 83 VAL -5.68 -2.13 1 84 HIS 0.16 -1.23 1 85 LEU -6.05 -3.45 1 88 PHE 1.35 0.27 1 89 TRP -2.87 1.13 1 90 GLU 4.76 1.77 1 91 GLN 2.48 -0.11 1 92 TYR -1.42 -0.44 1 93 ILE 3.38 -1.02 1 94 ASN -4.83 -0.21 1 95 ASP 4.68 0.36 1 96 GLU -3.20 -2.17 1 97 ASN -4.31 -1.09 1 98 THR 0.86 -0.51 1 99 VAL -4.81 -2.01 1 100 GLU -4.27 -0.82 1 101 LEU -6.60 -2.61 1 102 ILE -4.91 -1.21 1 103 HIS 0.08 2.07 1 104 THR -2.27 -0.53 1 105 ASP 2.15 0.51 1 106 SER -0.84 -0.17 1 107 LEU -0.89 -1.32 1 109 LEU -4.94 -1.96 1 110 VAL 1.64 -2.41 1 111 ILE -0.77 0.18 1 112 SER -1.38 -2.78 1 113 LEU -4.54 -2.04 1 114 ASN 2.87 -0.77 1 116 HIS 1.87 -0.32 1 117 THR -3.62 1.09 1 118 LEU 1.45 -0.10 1 119 GLN -0.24 -0.91 1 120 GLU 1.07 4.48 1 stop_ save_