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 bmr25918_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.10 _LACS_plot.Line_1_terminator_val_y_1 -2.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 6.25 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 LEU 3.99 -0.17 0 10 ILE -1.43 0.01 1 11 ILE -0.79 -1.28 1 12 GLU 0.16 1.12 1 13 ASP -0.76 0.25 1 14 GLU 0.27 0.62 1 16 LEU 3.93 3.25 1 17 ILE 3.77 1.77 1 18 SER 5.94 4.36 1 19 MET 3.51 3.74 1 20 GLN 4.30 3.40 1 21 LEU 3.09 2.85 1 22 GLU 3.77 3.77 1 23 ASP 3.81 3.26 1 24 LEU 3.26 3.49 1 25 VAL 6.62 5.53 1 26 ARG 4.60 3.77 1 27 SER 4.46 3.23 1 28 LEU -1.52 -0.34 1 30 HIS -3.36 0.26 1 31 ASP -4.58 -1.65 1 32 ILE -1.33 -2.88 1 33 ALA -0.44 0.17 1 35 THR -2.77 -2.02 1 36 ALA -5.07 -1.76 1 37 ALA -3.54 -1.11 1 38 THR -6.10 -2.48 1 39 ARG 3.14 3.85 1 40 THR 5.88 4.92 1 41 GLN 3.62 3.14 1 42 ALA 4.50 3.14 1 43 GLN 4.53 3.10 1 44 GLU 2.54 2.35 1 45 ALA 3.38 2.80 1 46 VAL 2.92 1.64 1 47 ALA 1.96 1.38 1 48 LYS 1.11 1.79 1 49 GLU -3.98 -1.05 1 50 LYS -0.06 -0.17 1 53 LEU -2.47 -0.17 1 54 VAL -3.53 -1.42 1 55 LEU -1.13 -1.87 1 56 ALA -3.69 -0.61 1 57 ASP -5.10 -2.16 1 58 ILE 4.14 4.45 1 59 GLN 1.40 0.37 1 61 ALA 3.02 4.25 1 62 ASP -1.11 -1.95 1 64 SER 0.45 0.66 1 65 SER -5.11 -3.92 1 67 ILE 5.60 5.02 1 68 ASP 4.37 2.94 1 69 ALA 2.47 1.90 1 70 VAL 6.58 5.38 1 71 GLU 4.46 3.54 1 72 ASP 3.72 3.05 1 73 ILE 5.01 4.97 1 74 LEU 2.15 1.05 1 76 GLN -1.30 1.04 1 77 PHE -3.57 -2.06 1 78 ASP -0.31 -0.06 1 79 VAL -4.40 -2.09 1 81 VAL -5.39 -2.34 1 82 ILE -3.27 -1.59 1 83 PHE -1.64 0.74 1 84 ILE 0.48 -0.35 1 85 THR -3.02 -2.91 1 86 ALA -1.05 -0.47 1 87 TYR -1.03 -0.50 1 89 GLU 5.01 2.55 1 90 ARG 2.96 2.12 1 91 LEU -0.63 0.11 1 92 LEU 0.30 -1.04 1 93 THR -0.02 0.07 1 95 ASP 0.47 0.13 1 96 ARG -0.89 -0.16 1 98 GLU 1.50 1.21 1 100 THR 3.86 3.44 1 101 TYR -3.63 -1.30 1 102 LEU -3.57 -0.71 1 103 VAL -2.42 -1.02 1 104 THR -0.80 -1.12 1 105 LYS -2.49 -0.29 1 107 PHE -5.60 -3.27 1 108 GLN -2.70 -1.97 1 109 GLU 5.04 4.64 1 110 SER 5.77 3.41 1 111 THR 5.01 3.79 1 112 VAL 7.05 5.44 1 113 ARG 5.32 5.17 1 114 THR 5.30 4.43 1 115 THR 7.85 5.94 1 116 ILE 6.69 5.59 1 117 SER 6.01 4.43 1 118 GLN 3.77 3.21 1 119 ALA 2.56 1.84 1 120 LEU 0.77 0.14 1 121 PHE 2.46 2.27 1 122 PHE 1.59 1.04 1 123 GLN 0.65 0.71 1 124 ASN -0.29 0.19 1 125 SER 0.05 0.10 1 127 THR -0.01 0.06 1 128 ALA -0.28 0.07 1 129 VAL 0.90 1.34 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25918_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.10 _LACS_plot.Line_1_terminator_val_y_1 3.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 LEU 3.99 -4.16 0 10 ILE -1.43 1.44 1 11 ILE -0.79 -0.49 1 12 GLU 0.16 0.96 1 13 ASP -0.76 1.01 1 14 GLU 0.27 0.35 1 16 LEU 3.93 -0.68 1 17 ILE 3.77 -2.00 1 18 SER 5.94 -1.58 1 19 MET 3.51 0.23 1 20 GLN 4.30 -0.90 1 21 LEU 3.09 -0.24 1 22 GLU 3.77 0.00 1 23 ASP 3.81 -0.55 1 24 LEU 3.26 0.23 1 25 VAL 6.62 -1.09 1 26 ARG 4.60 -0.83 1 27 SER 4.46 -1.23 1 28 LEU -1.52 1.18 1 30 HIS -3.36 3.62 1 31 ASP -4.58 2.93 1 32 ILE -1.33 -1.55 1 33 ALA -0.44 0.61 1 35 THR -2.77 0.75 1 36 ALA -5.07 3.31 1 37 ALA -3.54 2.43 1 38 THR -6.10 3.62 1 39 ARG 3.14 0.71 1 40 THR 5.88 -0.96 1 41 GLN 3.62 -0.48 1 42 ALA 4.50 -1.36 1 43 GLN 4.53 -1.43 1 44 GLU 2.54 -0.19 1 45 ALA 3.38 -0.58 1 46 VAL 2.92 -1.28 1 47 ALA 1.96 -0.58 1 48 LYS 1.11 0.68 1 49 GLU -3.98 2.93 1 50 LYS -0.06 -0.11 1 53 LEU -2.47 2.30 1 54 VAL -3.53 2.11 1 55 LEU -1.13 -0.74 1 56 ALA -3.69 3.08 1 57 ASP -5.10 2.94 1 58 ILE 4.14 0.31 1 59 GLN 1.40 -1.03 1 61 ALA 3.02 1.23 1 62 ASP -1.11 -0.84 1 64 SER 0.45 0.21 1 65 SER -5.11 1.19 1 67 ILE 5.60 -0.58 1 68 ASP 4.37 -1.43 1 69 ALA 2.47 -0.57 1 70 VAL 6.58 -1.20 1 71 GLU 4.46 -0.92 1 72 ASP 3.72 -0.67 1 73 ILE 5.01 -0.04 1 74 LEU 2.15 -1.10 1 76 GLN -1.30 2.34 1 77 PHE -3.57 1.51 1 78 ASP -0.31 0.25 1 79 VAL -4.40 2.31 1 81 VAL -5.39 3.05 1 82 ILE -3.27 1.68 1 83 PHE -1.64 2.38 1 84 ILE 0.48 -0.83 1 85 THR -3.02 0.11 1 86 ALA -1.05 0.58 1 87 TYR -1.03 0.53 1 89 GLU 5.01 -2.46 1 90 ARG 2.96 -0.84 1 91 LEU -0.63 0.74 1 92 LEU 0.30 -1.34 1 93 THR -0.02 0.09 1 95 ASP 0.47 -0.34 1 96 ARG -0.89 0.73 1 98 GLU 1.50 -0.29 1 100 THR 3.86 -0.42 1 101 TYR -3.63 2.33 1 102 LEU -3.57 2.86 1 103 VAL -2.42 1.40 1 104 THR -0.80 -0.32 1 105 LYS -2.49 2.20 1 107 PHE -5.60 2.33 1 108 GLN -2.70 0.73 1 109 GLU 5.04 -0.40 1 110 SER 5.77 -2.36 1 111 THR 5.01 -1.22 1 112 VAL 7.05 -1.61 1 113 ARG 5.32 -0.15 1 114 THR 5.30 -0.87 1 115 THR 7.85 -1.91 1 116 ILE 6.69 -1.10 1 117 SER 6.01 -1.58 1 118 GLN 3.77 -0.56 1 119 ALA 2.56 -0.72 1 120 LEU 0.77 -0.63 1 121 PHE 2.46 -0.19 1 122 PHE 1.59 -0.55 1 123 GLN 0.65 0.06 1 124 ASN -0.29 0.48 1 125 SER 0.05 0.05 1 127 THR -0.01 0.07 1 128 ALA -0.28 0.35 1 129 VAL 0.90 0.44 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25918_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.10 _LACS_plot.Line_1_terminator_val_y_1 0.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _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 85 THR -3.02 1.37 0 84 ILE 0.48 1.19 0 10 ILE -1.43 0.33 1 11 ILE -0.79 0.79 1 12 GLU 0.16 -0.15 1 13 ASP -0.76 0.06 1 14 GLU 0.27 0.17 1 16 LEU 3.93 -0.18 1 17 ILE 3.77 -0.09 1 18 SER 5.94 -0.65 1 19 MET 3.51 -0.26 1 20 GLN 4.30 -0.13 1 21 LEU 3.09 -0.33 1 22 GLU 3.77 -0.70 1 23 ASP 3.81 -0.30 1 24 LEU 3.26 -0.22 1 25 VAL 6.62 -0.67 1 26 ARG 4.60 0.19 1 27 SER 4.46 -0.14 1 28 LEU -1.52 -0.05 1 30 HIS -3.36 0.31 1 31 ASP -4.58 0.39 1 32 ILE -1.33 0.46 1 33 ALA -0.44 -0.09 1 35 THR -2.77 1.02 1 36 ALA -5.07 0.42 1 37 ALA -3.54 -0.01 1 38 THR -6.10 0.09 1 39 ARG 3.14 -0.54 1 40 THR 5.88 -0.42 1 41 GLN 3.62 -0.16 1 42 ALA 4.50 -0.48 1 43 GLN 4.53 -0.37 1 44 GLU 2.54 -0.33 1 45 ALA 3.38 -0.14 1 46 VAL 2.92 0.22 1 47 ALA 1.96 -0.13 1 48 LYS 1.11 -0.09 1 49 GLU -3.98 -0.05 1 50 LYS -0.06 -0.50 1 53 LEU -2.47 0.11 1 54 VAL -3.53 0.77 1 55 LEU -1.13 0.77 1 56 ALA -3.69 0.81 1 57 ASP -5.10 0.75 1 58 ILE 4.14 -0.10 1 59 GLN 1.40 0.21 1 60 LEU 3.99 0.32 1 61 ALA 3.02 -0.21 1 62 ASP -1.11 0.11 1 64 SER 0.45 -0.14 1 65 SER -5.11 1.06 1 67 ILE 5.60 -0.42 1 68 ASP 4.37 -0.25 1 69 ALA 2.47 0.07 1 70 VAL 6.58 -0.67 1 71 GLU 4.46 -0.39 1 72 ASP 3.72 -0.42 1 73 ILE 5.01 -0.69 1 74 LEU 2.15 0.57 1 76 GLN -1.30 -0.08 1 77 PHE -3.57 0.16 1 78 ASP -0.31 0.10 1 79 VAL -4.40 0.28 1 81 VAL -5.39 0.70 1 82 ILE -3.27 0.27 1 83 PHE -1.64 0.70 1 86 ALA -1.05 0.18 1 87 TYR -1.03 0.41 1 89 GLU 5.01 -0.25 1 90 ARG 2.96 -0.24 1 91 LEU -0.63 -0.21 1 92 LEU 0.30 0.21 1 93 THR -0.02 -0.03 1 95 ASP 0.47 -0.08 1 96 ARG -0.89 0.02 1 98 GLU 1.50 -0.41 1 100 THR 3.86 -0.54 1 101 TYR -3.63 0.43 1 102 LEU -3.57 0.88 1 103 VAL -2.42 0.21 1 104 THR -0.80 0.69 1 105 LYS -2.49 -0.19 1 107 PHE -5.60 0.67 1 108 GLN -2.70 0.38 1 109 GLU 5.04 -0.52 1 110 SER 5.77 -0.42 1 111 THR 5.01 -0.26 1 112 VAL 7.05 -0.85 1 113 ARG 5.32 -0.58 1 114 THR 5.30 -0.40 1 115 THR 7.85 -0.41 1 116 ILE 6.69 -0.96 1 117 SER 6.01 -0.47 1 118 GLN 3.77 -0.31 1 119 ALA 2.56 -0.34 1 120 LEU 0.77 -0.10 1 121 PHE 2.46 -0.27 1 122 PHE 1.59 -0.17 1 123 GLN 0.65 -0.14 1 124 ASN -0.29 -0.03 1 125 SER 0.05 -0.08 1 127 THR -0.01 -0.04 1 128 ALA -0.28 0.09 1 129 VAL 0.90 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25918_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.10 _LACS_plot.Line_1_terminator_val_y_1 -3.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.26 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 3.08 _LACS_plot.Y_axis_chem_shift_offset 0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 SER -5.11 3.39 0 10 ILE -1.43 -2.17 1 11 ILE -0.79 -1.73 1 12 GLU 0.16 -3.13 1 13 ASP -0.76 -0.60 1 16 LEU 3.93 2.62 1 17 ILE 3.77 1.50 1 18 SER 5.94 2.29 1 19 MET 3.51 1.70 1 20 GLN 4.30 3.83 1 21 LEU 3.09 0.58 1 22 GLU 3.77 1.66 1 23 ASP 3.81 3.14 1 24 LEU 3.26 2.64 1 25 VAL 6.62 2.37 1 26 ARG 4.60 5.55 1 27 SER 4.46 1.03 1 28 LEU -1.52 -1.09 1 30 HIS -3.36 -0.03 1 31 ASP -4.58 -1.14 1 32 ILE -1.33 0.04 1 33 ALA -0.44 -0.57 1 35 THR -2.77 -1.30 1 36 ALA -5.07 -2.98 1 37 ALA -3.54 -2.77 1 38 THR -6.10 -1.11 1 39 ARG 3.14 1.53 1 40 THR 5.88 2.01 1 41 GLN 3.62 3.35 1 42 ALA 4.50 0.07 1 43 GLN 4.53 3.87 1 44 GLU 2.54 2.53 1 45 ALA 3.38 3.28 1 46 VAL 2.92 -0.09 1 47 ALA 1.96 1.43 1 48 LYS 1.11 0.14 1 49 GLU -3.98 -3.59 1 53 LEU -2.47 -3.96 1 54 VAL -3.53 -3.15 1 55 LEU -1.13 -2.52 1 56 ALA -3.69 -2.88 1 57 ASP -5.10 -2.63 1 58 ILE 4.14 0.35 1 59 GLN 1.40 -1.56 1 60 LEU 3.99 2.57 1 61 ALA 3.02 0.47 1 62 ASP -1.11 0.77 1 64 SER 0.45 -2.40 1 67 ILE 5.60 1.59 1 68 ASP 4.37 1.38 1 69 ALA 2.47 1.36 1 70 VAL 6.58 1.26 1 71 GLU 4.46 3.65 1 72 ASP 3.72 3.42 1 73 ILE 5.01 1.20 1 74 LEU 2.15 -3.16 1 76 GLN -1.30 -0.56 1 77 PHE -3.57 -3.42 1 78 ASP -0.31 -0.71 1 81 VAL -5.39 -1.42 1 82 ILE -3.27 -0.71 1 83 PHE -1.64 -0.54 1 84 ILE 0.48 -0.94 1 85 THR -3.02 -2.11 1 86 ALA -1.05 -1.74 1 89 GLU 5.01 2.04 1 90 ARG 2.96 0.50 1 91 LEU -0.63 -0.40 1 92 LEU 0.30 -0.74 1 93 THR -0.02 0.86 1 95 ASP 0.47 -1.18 1 100 THR 3.86 -0.54 1 101 TYR -3.63 -2.15 1 102 LEU -3.57 -3.15 1 103 VAL -2.42 -1.87 1 104 THR -0.80 0.39 1 107 PHE -5.60 -0.44 1 108 GLN -2.70 1.79 1 109 GLU 5.04 1.98 1 110 SER 5.77 2.11 1 111 THR 5.01 2.67 1 112 VAL 7.05 0.57 1 113 ARG 5.32 2.31 1 114 THR 5.30 1.64 1 115 THR 7.85 0.63 1 116 ILE 6.69 0.08 1 117 SER 6.01 2.28 1 118 GLN 3.77 1.84 1 119 ALA 2.56 1.81 1 120 LEU 0.77 0.37 1 121 PHE 2.46 0.87 1 122 PHE 1.59 0.12 1 123 GLN 0.65 -0.40 1 124 ASN -0.29 -0.38 1 127 THR -0.01 -0.56 1 128 ALA -0.28 -1.22 1 stop_ save_