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 bmr25243_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -2.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 5.59 _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 63 ASP -6.00 -0.33 0 77 ILE -4.20 -5.47 0 10 ARG -1.21 -1.28 1 11 ASN 0.99 0.77 1 12 SER -2.47 0.82 1 13 SER 0.75 2.38 1 15 SER 2.09 1.46 1 16 GLN 4.55 1.97 1 17 MET 4.82 4.89 1 18 ALA 6.03 3.45 1 19 GLU 3.72 3.16 1 21 PHE 4.91 4.75 1 22 ALA 2.76 3.38 1 23 LYS 3.85 2.69 1 24 THR 3.78 3.54 1 25 LEU 1.58 1.59 1 27 ALA 2.79 1.70 1 29 LYS -0.92 1.12 1 30 ILE -5.87 -2.13 1 31 ALA -3.40 -1.68 1 32 VAL -3.29 -1.05 1 33 THR -2.49 -0.50 1 34 SER -4.27 -1.09 1 35 SER -2.51 -0.22 1 37 LEU 4.64 3.03 1 38 GLU -5.67 -2.37 1 39 SER -2.78 -1.01 1 40 SER -0.11 -0.71 1 41 ARG -2.89 -1.66 1 42 VAL 4.46 2.59 1 43 HIS 0.00 3.69 1 45 THR 6.50 3.94 1 46 ALA 5.18 3.68 1 47 ILE 5.30 4.50 1 48 ALA 3.86 2.75 1 49 MET -0.84 1.00 1 50 MET 3.54 -0.37 1 51 GLU 3.96 3.25 1 52 GLU 2.21 2.65 1 53 VAL -0.31 -2.71 1 55 ILE -2.78 -0.46 1 56 ASP -1.83 -1.87 1 57 ILE 0.79 0.09 1 58 SER 6.53 4.80 1 60 GLN 1.25 0.46 1 61 THR -1.65 -1.68 1 62 SER -2.41 -2.62 1 65 ILE 3.85 3.56 1 66 GLU 2.98 1.98 1 67 ASN 1.67 -0.05 1 68 PHE -3.72 -0.70 1 69 ASN -2.64 -1.79 1 70 ALA 2.87 2.02 1 71 ASP 1.65 1.06 1 72 ASP 1.61 1.03 1 73 TYR -0.10 1.27 1 74 ASP -2.22 1.76 1 75 VAL -4.04 -1.80 1 76 VAL -3.26 -1.09 1 78 SER -2.76 -2.13 1 79 LEU -1.21 -0.18 1 84 VAL 2.08 0.81 1 85 ASN -0.80 0.49 1 86 LEU 0.91 0.02 1 89 GLU 4.87 2.50 1 90 TRP 2.33 2.58 1 91 VAL -0.05 -1.88 1 92 THR 0.30 -0.95 1 93 GLN 1.22 -1.87 1 94 GLU 4.93 4.39 1 95 ILE -4.11 -0.80 1 96 PHE -3.14 -0.42 1 97 GLU -6.70 -1.85 1 98 ASP -4.45 -2.18 1 99 TRP -3.96 -3.34 1 100 GLN 2.55 0.81 1 101 LEU -3.56 -1.92 1 102 GLU -0.48 -0.19 1 103 ASP -2.12 -1.61 1 105 ASP 2.23 3.01 1 107 GLN -1.55 -1.36 1 108 SER -2.03 -0.53 1 109 LEU 4.34 3.42 1 110 GLU 4.25 3.44 1 111 VAL 6.29 4.42 1 112 PHE 5.58 6.06 1 113 ARG 6.07 5.20 1 114 THR 6.47 5.15 1 115 VAL 5.51 4.52 1 116 ARG 4.66 4.63 1 118 GLN 3.30 2.87 1 119 VAL 6.51 5.00 1 120 LYS 6.04 4.96 1 121 GLU 2.58 2.32 1 122 ARG 6.16 2.74 1 123 VAL 7.52 5.62 1 124 GLU 4.58 4.09 1 125 ASN 3.34 3.06 1 126 LEU 3.16 3.11 1 127 ILE 5.49 4.09 1 128 ALA 3.06 2.11 1 129 LYS 1.53 1.75 1 130 ILE 0.15 0.13 1 131 SER 0.81 2.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25243_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 4.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.19 _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 7.51 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _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 63 ASP -6.00 5.67 0 77 ILE -4.20 -1.27 0 10 ARG -1.21 -0.07 1 11 ASN 0.99 -0.22 1 12 SER -2.47 3.29 1 13 SER 0.75 1.63 1 15 SER 2.09 -0.63 1 16 GLN 4.55 -2.58 1 17 MET 4.82 0.07 1 18 ALA 6.03 -2.58 1 19 GLU 3.72 -0.56 1 21 PHE 4.91 -0.16 1 22 ALA 2.76 0.62 1 23 LYS 3.85 -1.16 1 24 THR 3.78 -0.24 1 25 LEU 1.58 0.01 1 27 ALA 2.79 -1.09 1 29 LYS -0.92 2.04 1 30 ILE -5.87 3.74 1 31 ALA -3.40 1.72 1 32 VAL -3.29 2.24 1 33 THR -2.49 1.99 1 34 SER -4.27 3.18 1 35 SER -2.51 2.29 1 37 LEU 4.64 -1.61 1 38 GLU -5.67 3.30 1 39 SER -2.78 1.77 1 40 SER -0.11 -0.60 1 41 ARG -2.89 1.23 1 42 VAL 4.46 -1.87 1 43 HIS 0.00 3.69 1 45 THR 6.50 -2.56 1 46 ALA 5.18 -1.50 1 47 ILE 5.30 -0.80 1 48 ALA 3.86 -1.11 1 49 MET -0.84 1.84 1 50 MET 3.54 -3.91 1 51 GLU 3.96 -0.71 1 52 GLU 2.21 0.44 1 53 VAL -0.31 -2.40 1 55 ILE -2.78 2.32 1 56 ASP -1.83 -0.04 1 57 ILE 0.79 -0.70 1 58 SER 6.53 -1.73 1 60 GLN 1.25 -0.79 1 61 THR -1.65 -0.03 1 62 SER -2.41 -0.21 1 65 ILE 3.85 -0.29 1 66 GLU 2.98 -1.00 1 67 ASN 1.67 -1.72 1 68 PHE -3.72 3.02 1 69 ASN -2.64 0.85 1 70 ALA 2.87 -0.85 1 71 ASP 1.65 -0.59 1 72 ASP 1.61 -0.58 1 73 TYR -0.10 1.37 1 74 ASP -2.22 3.98 1 75 VAL -4.04 2.24 1 76 VAL -3.26 2.17 1 78 SER -2.76 0.63 1 79 LEU -1.21 1.03 1 84 VAL 2.08 -1.27 1 85 ASN -0.80 1.29 1 86 LEU 0.91 -0.89 1 89 GLU 4.87 -2.37 1 90 TRP 2.33 0.25 1 91 VAL -0.05 -1.83 1 92 THR 0.30 -1.25 1 93 GLN 1.22 -3.09 1 94 GLU 4.93 -0.54 1 95 ILE -4.11 3.31 1 96 PHE -3.14 2.72 1 97 GLU -6.70 4.85 1 98 ASP -4.45 2.27 1 99 TRP -3.96 0.62 1 100 GLN 2.55 -1.74 1 101 LEU -3.56 1.64 1 102 GLU -0.48 0.29 1 103 ASP -2.12 0.51 1 105 ASP 2.23 0.78 1 107 GLN -1.55 0.19 1 108 SER -2.03 1.50 1 109 LEU 4.34 -0.92 1 110 GLU 4.25 -0.81 1 111 VAL 6.29 -1.87 1 112 PHE 5.58 0.48 1 113 ARG 6.07 -0.87 1 114 THR 6.47 -1.32 1 115 VAL 5.51 -0.99 1 116 ARG 4.66 -0.03 1 118 GLN 3.30 -0.43 1 119 VAL 6.51 -1.51 1 120 LYS 6.04 -1.08 1 121 GLU 2.58 -0.26 1 122 ARG 6.16 -3.42 1 123 VAL 7.52 -1.90 1 124 GLU 4.58 -0.49 1 125 ASN 3.34 -0.28 1 126 LEU 3.16 -0.05 1 127 ILE 5.49 -1.40 1 128 ALA 3.06 -0.95 1 129 LYS 1.53 0.22 1 130 ILE 0.15 -0.02 1 131 SER 0.81 1.67 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25243_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 0.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _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 7.51 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 70 ALA 2.87 -2.46 0 10 ARG -1.21 0.63 1 11 ASN 0.99 -0.96 1 12 SER -2.47 0.76 1 13 SER 0.75 -0.14 1 15 SER 2.09 -0.60 1 16 GLN 4.55 -0.20 1 17 MET 4.82 -0.63 1 18 ALA 6.03 -0.73 1 19 GLU 3.72 -0.60 1 21 PHE 4.91 -0.24 1 22 ALA 2.76 -0.41 1 23 LYS 3.85 -0.09 1 24 THR 3.78 -0.10 1 25 LEU 1.58 0.03 1 27 ALA 2.79 -0.03 1 29 LYS -0.92 0.24 1 30 ILE -5.87 0.92 1 31 ALA -3.40 0.61 1 32 VAL -3.29 1.12 1 33 THR -2.49 0.08 1 34 SER -4.27 1.16 1 35 SER -2.51 0.46 1 37 LEU 4.64 -0.28 1 38 GLU -5.67 0.15 1 39 SER -2.78 -0.19 1 40 SER -0.11 -0.09 1 41 ARG -2.89 0.33 1 42 VAL 4.46 -0.35 1 43 HIS 0.00 -0.75 1 45 THR 6.50 -0.42 1 46 ALA 5.18 -0.42 1 47 ILE 5.30 -0.80 1 48 ALA 3.86 -0.06 1 49 MET -0.84 0.05 1 50 MET 3.54 0.33 1 51 GLU 3.96 -0.43 1 52 GLU 2.21 -0.19 1 53 VAL -0.31 0.63 1 55 ILE -2.78 -0.04 1 56 ASP -1.83 0.08 1 57 ILE 0.79 0.28 1 58 SER 6.53 -0.49 1 60 GLN 1.25 0.04 1 61 THR -1.65 0.07 1 62 SER -2.41 0.47 1 63 ASP -6.00 0.49 1 65 ILE 3.85 -0.25 1 66 GLU 2.98 0.05 1 67 ASN 1.67 -0.18 1 68 PHE -3.72 0.28 1 69 ASN -2.64 0.27 1 71 ASP 1.65 -0.42 1 72 ASP 1.61 -0.40 1 73 TYR -0.10 -0.48 1 74 ASP -2.22 0.36 1 75 VAL -4.04 0.38 1 76 VAL -3.26 0.52 1 77 ILE -4.20 0.31 1 78 SER -2.76 0.73 1 79 LEU -1.21 0.72 1 84 VAL 2.08 -0.04 1 85 ASN -0.80 0.05 1 86 LEU 0.91 -0.29 1 89 GLU 4.87 -0.43 1 90 TRP 2.33 -0.53 1 91 VAL -0.05 0.09 1 92 THR 0.30 0.19 1 93 GLN 1.22 0.08 1 94 GLU 4.93 -0.44 1 95 ILE -4.11 0.30 1 96 PHE -3.14 1.27 1 97 GLU -6.70 -0.22 1 98 ASP -4.45 0.58 1 99 TRP -3.96 0.31 1 100 GLN 2.55 -0.46 1 101 LEU -3.56 0.28 1 102 GLU -0.48 -0.45 1 103 ASP -2.12 -0.60 1 105 ASP 2.23 -0.47 1 107 GLN -1.55 0.37 1 108 SER -2.03 0.03 1 109 LEU 4.34 -0.20 1 110 GLU 4.25 -0.28 1 111 VAL 6.29 -0.41 1 112 PHE 5.58 -0.94 1 113 ARG 6.07 -0.53 1 114 THR 6.47 -0.40 1 115 VAL 5.51 -0.27 1 116 ARG 4.66 -0.26 1 118 GLN 3.30 -0.25 1 119 VAL 6.51 -0.73 1 120 LYS 6.04 -1.75 1 121 GLU 2.58 -0.38 1 122 ARG 6.16 -0.78 1 123 VAL 7.52 -0.30 1 124 GLU 4.58 -0.59 1 125 ASN 3.34 -0.33 1 126 LEU 3.16 -0.09 1 127 ILE 5.49 -0.71 1 128 ALA 3.06 -0.14 1 129 LYS 1.53 0.04 1 130 ILE 0.15 0.37 1 131 SER 0.81 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25243_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 5.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 2.44 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 -1.88 _LACS_plot.Y_axis_chem_shift_offset -1.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 THR -2.49 8.07 0 58 SER 6.53 4.12 0 10 ARG -1.21 1.43 1 11 ASN 0.99 4.13 1 12 SER -2.47 3.45 1 16 GLN 4.55 -1.71 1 17 MET 4.82 0.49 1 18 ALA 6.03 -1.37 1 19 GLU 3.72 -0.21 1 21 PHE 4.91 0.15 1 22 ALA 2.76 -4.92 1 23 LYS 3.85 -0.65 1 24 THR 3.78 3.82 1 25 LEU 1.58 -2.35 1 27 ALA 2.79 -2.67 1 29 LYS -0.92 1.06 1 30 ILE -5.87 3.70 1 31 ALA -3.40 -1.17 1 32 VAL -3.29 3.14 1 34 SER -4.27 6.69 1 35 SER -2.51 5.60 1 37 LEU 4.64 -2.36 1 38 GLU -5.67 3.55 1 39 SER -2.78 4.52 1 40 SER -0.11 5.76 1 41 ARG -2.89 2.59 1 42 VAL 4.46 2.10 1 45 THR 6.50 2.30 1 46 ALA 5.18 -3.36 1 47 ILE 5.30 -2.19 1 48 ALA 3.86 -3.55 1 49 MET -0.84 -2.37 1 50 MET 3.54 -1.62 1 51 GLU 3.96 -3.57 1 52 GLU 2.21 -0.94 1 53 VAL -0.31 1.62 1 55 ILE -2.78 3.72 1 56 ASP -1.83 0.01 1 57 ILE 0.79 0.62 1 60 GLN 1.25 3.09 1 61 THR -1.65 3.39 1 62 SER -2.41 4.85 1 65 ILE 3.85 0.95 1 66 GLU 2.98 0.51 1 67 ASN 1.67 4.48 1 68 PHE -3.72 4.79 1 69 ASN -2.64 3.52 1 70 ALA 2.87 -1.56 1 71 ASP 1.65 -0.12 1 72 ASP 1.61 1.88 1 73 TYR -0.10 4.04 1 74 ASP -2.22 2.99 1 75 VAL -4.04 3.92 1 76 VAL -3.26 4.92 1 77 ILE -4.20 0.87 1 78 SER -2.76 3.96 1 79 LEU -1.21 0.15 1 84 VAL 2.08 1.59 1 85 ASN -0.80 3.74 1 89 GLU 4.87 -1.01 1 90 TRP 2.33 1.11 1 91 VAL -0.05 0.41 1 92 THR 0.30 3.44 1 93 GLN 1.22 2.55 1 94 GLU 4.93 -0.44 1 95 ILE -4.11 1.63 1 96 PHE -3.14 2.77 1 97 GLU -6.70 4.93 1 98 ASP -4.45 1.32 1 99 TRP -3.96 1.92 1 100 GLN 2.55 3.30 1 101 LEU -3.56 -0.84 1 102 GLU -0.48 3.09 1 105 ASP 2.23 -0.49 1 107 GLN -1.55 2.65 1 108 SER -2.03 2.74 1 109 LEU 4.34 -2.77 1 110 GLU 4.25 -2.63 1 111 VAL 6.29 -1.13 1 112 PHE 5.58 -1.10 1 113 ARG 6.07 -2.19 1 114 THR 6.47 1.60 1 115 VAL 5.51 0.00 1 116 ARG 4.66 -0.67 1 118 GLN 3.30 -1.75 1 119 VAL 6.51 0.67 1 120 LYS 6.04 -0.26 1 121 GLU 2.58 -1.99 1 122 ARG 6.16 -2.29 1 123 VAL 7.52 0.04 1 124 GLU 4.58 -2.64 1 125 ASN 3.34 1.55 1 126 LEU 3.16 -2.37 1 127 ILE 5.49 -0.94 1 128 ALA 3.06 -3.26 1 129 LYS 1.53 -1.25 1 130 ILE 0.15 2.41 1 stop_ save_