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 bmr17959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 -2.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.10 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 5.19 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 MET 6.16 1.28 0 10 SER -0.09 0.22 1 11 VAL 0.36 0.38 1 12 GLN 0.14 0.17 1 13 LEU -0.19 0.15 1 14 LYS 0.01 0.07 1 16 GLU 0.03 -0.30 1 17 VAL -0.01 0.03 1 18 SER -0.58 0.02 1 20 THR -0.17 0.25 1 21 GLN -0.41 0.28 1 22 ASP 0.25 -0.19 1 23 ILE -5.76 -1.79 1 24 ARG -0.04 -0.71 1 25 LEU -6.09 -1.44 1 26 TRP -0.57 -0.79 1 27 VAL -2.90 -1.51 1 28 SER -1.12 -1.38 1 29 VAL -0.49 -1.21 1 30 GLU -4.17 -2.49 1 31 ASP -3.68 -2.01 1 32 ALA 2.56 1.82 1 33 GLN 0.78 0.00 1 35 HIS 0.94 0.59 1 36 THR -1.82 -0.52 1 37 VAL -4.26 -1.44 1 38 THR -2.26 -1.17 1 39 ILE -5.20 -1.23 1 40 TRP -3.49 -1.57 1 41 LEU -6.52 -1.93 1 42 THR 2.26 1.26 1 43 VAL -6.80 -3.81 1 44 ARG -3.48 -0.76 1 46 ASP 1.40 -0.49 1 47 MET -0.63 1.25 1 48 THR -3.29 -1.54 1 49 VAL 6.41 4.30 1 50 ALA 4.60 3.68 1 51 SER 4.72 4.10 1 52 LEU 3.97 3.62 1 53 LYS 1.75 2.98 1 54 ASP 4.66 3.19 1 55 MET 3.71 4.42 1 56 VAL 6.91 5.52 1 57 PHE 3.54 2.78 1 58 LEU 3.32 2.92 1 59 ASP 3.20 1.11 1 60 TYR -0.77 1.07 1 65 VAL 3.24 1.90 1 66 LEU -0.09 -1.10 1 67 GLN -1.51 0.52 1 68 GLN -2.49 -0.60 1 69 TRP -1.65 -0.21 1 70 VAL -0.20 0.61 1 71 ILE -3.08 -0.24 1 73 GLN 3.90 1.82 1 74 ARG -4.73 -1.23 1 75 LEU 1.47 1.36 1 76 ALA -3.67 -1.77 1 77 ARG -2.17 -0.78 1 78 ASP 3.78 4.06 1 79 GLN 2.22 0.91 1 80 GLU -1.55 -0.95 1 81 THR -4.23 -1.66 1 82 LEU 7.39 4.25 1 83 HIS 4.61 4.25 1 84 SER 3.29 3.40 1 85 HIS 0.53 0.92 1 87 VAL 3.98 1.86 1 88 ARG -2.80 0.68 1 89 GLN -3.94 -1.09 1 90 ASN 1.88 1.65 1 92 ASP 1.54 1.82 1 93 SER -4.72 -0.55 1 94 ALA -6.45 -1.11 1 95 TYR -2.41 -0.12 1 96 LEU -2.76 -2.43 1 97 TYR -1.77 -1.28 1 98 LEU -2.26 -2.46 1 99 LEU -1.19 -0.81 1 100 SER -0.82 -0.07 1 101 ALA -0.15 0.30 1 102 ARG 0.99 0.84 1 103 ASN 0.86 0.63 1 104 THR 0.09 0.50 1 105 SER 0.23 0.37 1 106 LEU -0.52 -0.09 1 107 ASN 0.51 0.31 1 109 GLN 4.30 3.19 1 110 GLU -3.18 -0.16 1 111 LEU 3.43 3.21 1 112 GLN 2.98 2.25 1 113 ARG 4.03 3.20 1 114 GLU 3.87 2.28 1 115 ARG 7.36 3.11 1 116 GLN 3.34 2.57 1 117 LEU 3.08 2.71 1 119 MET 7.23 2.80 1 120 LEU 0.87 0.76 1 121 GLN 4.43 3.42 1 123 LEU 0.56 0.87 1 125 PHE -4.70 -2.05 1 126 LYS -0.44 0.33 1 127 ASP 1.17 -0.20 1 128 LEU 0.24 0.41 1 129 THR -0.42 1.12 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 4.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.90 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 -2.20 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 MET 6.16 -4.88 0 10 SER -0.09 0.31 1 11 VAL 0.36 0.02 1 12 GLN 0.14 0.03 1 13 LEU -0.19 0.34 1 14 LYS 0.01 0.06 1 16 GLU 0.03 -0.33 1 17 VAL -0.01 0.04 1 18 SER -0.58 0.60 1 20 THR -0.17 0.42 1 21 GLN -0.41 0.69 1 22 ASP 0.25 -0.44 1 23 ILE -5.76 3.97 1 24 ARG -0.04 -0.67 1 25 LEU -6.09 4.65 1 26 TRP -0.57 -0.22 1 27 VAL -2.90 1.39 1 28 SER -1.12 -0.26 1 29 VAL -0.49 -0.72 1 30 GLU -4.17 1.68 1 31 ASP -3.68 1.67 1 32 ALA 2.56 -0.74 1 33 GLN 0.78 -0.78 1 35 HIS 0.94 -0.35 1 36 THR -1.82 1.30 1 37 VAL -4.26 2.82 1 38 THR -2.26 1.09 1 39 ILE -5.20 3.97 1 40 TRP -3.49 1.92 1 41 LEU -6.52 4.59 1 42 THR 2.26 -1.00 1 43 VAL -6.80 2.99 1 44 ARG -3.48 2.72 1 46 ASP 1.40 -1.89 1 47 MET -0.63 1.88 1 48 THR -3.29 1.75 1 49 VAL 6.41 -2.11 1 50 ALA 4.60 -0.92 1 51 SER 4.72 -0.62 1 52 LEU 3.97 -0.35 1 53 LYS 1.75 1.23 1 54 ASP 4.66 -1.47 1 55 MET 3.71 0.71 1 56 VAL 6.91 -1.39 1 57 PHE 3.54 -0.76 1 58 LEU 3.32 -0.40 1 59 ASP 3.20 -2.09 1 60 TYR -0.77 1.84 1 65 VAL 3.24 -1.34 1 66 LEU -0.09 -1.01 1 67 GLN -1.51 2.03 1 68 GLN -2.49 1.89 1 69 TRP -1.65 1.44 1 70 VAL -0.20 0.81 1 71 ILE -3.08 2.84 1 73 GLN 3.90 -2.08 1 74 ARG -4.73 3.50 1 75 LEU 1.47 -0.11 1 76 ALA -3.67 1.90 1 77 ARG -2.17 1.39 1 78 ASP 3.78 0.28 1 79 GLN 2.22 -1.31 1 80 GLU -1.55 0.60 1 81 THR -4.23 2.57 1 82 LEU 7.39 -3.14 1 83 HIS 4.61 -0.36 1 84 SER 3.29 0.11 1 85 HIS 0.53 0.39 1 87 VAL 3.98 -2.12 1 88 ARG -2.80 3.48 1 89 GLN -3.94 2.85 1 90 ASN 1.88 -0.23 1 92 ASP 1.54 0.28 1 93 SER -4.72 4.17 1 94 ALA -6.45 5.34 1 95 TYR -2.41 2.29 1 96 LEU -2.76 0.33 1 97 TYR -1.77 0.49 1 98 LEU -2.26 -0.20 1 99 LEU -1.19 0.38 1 100 SER -0.82 0.75 1 101 ALA -0.15 0.45 1 102 ARG 0.99 -0.15 1 103 ASN 0.86 -0.23 1 104 THR 0.09 0.41 1 105 SER 0.23 0.14 1 106 LEU -0.52 0.43 1 107 ASN 0.51 -0.20 1 109 GLN 4.30 -1.11 1 110 GLU -3.18 3.02 1 111 LEU 3.43 -0.22 1 112 GLN 2.98 -0.73 1 113 ARG 4.03 -0.83 1 114 GLU 3.87 -1.59 1 115 ARG 7.36 -4.25 1 116 GLN 3.34 -0.77 1 117 LEU 3.08 -0.37 1 119 MET 7.23 -4.43 1 120 LEU 0.87 -0.11 1 121 GLN 4.43 -1.01 1 123 LEU 0.56 0.31 1 125 PHE -4.70 2.65 1 126 LYS -0.44 0.77 1 127 ASP 1.17 -1.37 1 128 LEU 0.24 0.17 1 129 THR -0.42 1.54 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 0.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _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 36 THR -1.82 1.14 0 93 SER -4.72 1.38 0 10 SER -0.09 -0.05 1 11 VAL 0.36 -0.01 1 12 GLN 0.14 -0.03 1 13 LEU -0.19 -0.02 1 14 LYS 0.01 -0.03 1 16 GLU 0.03 -0.03 1 17 VAL -0.01 0.01 1 18 SER -0.58 -0.03 1 20 THR -0.17 -0.06 1 21 GLN -0.41 -0.03 1 22 ASP 0.25 0.23 1 23 ILE -5.76 0.48 1 24 ARG -0.04 0.65 1 25 LEU -6.09 0.38 1 26 TRP -0.57 -0.53 1 27 VAL -2.90 0.42 1 28 SER -1.12 -0.09 1 29 VAL -0.49 0.39 1 30 GLU -4.17 0.84 1 32 ALA 2.56 -0.14 1 33 GLN 0.78 -0.05 1 34 MET 6.16 -0.46 1 35 HIS 0.94 0.14 1 37 VAL -4.26 0.32 1 38 THR -2.26 0.75 1 39 ILE -5.20 0.41 1 40 TRP -3.49 0.90 1 41 LEU -6.52 0.58 1 42 THR 2.26 0.70 1 43 VAL -6.80 0.62 1 44 ARG -3.48 0.49 1 46 ASP 1.40 -0.05 1 47 MET -0.63 -0.14 1 48 THR -3.29 0.48 1 49 VAL 6.41 -0.91 1 50 ALA 4.60 -0.45 1 51 SER 4.72 -0.17 1 52 LEU 3.97 -0.40 1 53 LYS 1.75 0.73 1 54 ASP 4.66 -0.01 1 55 MET 3.71 -0.39 1 56 VAL 6.91 -0.21 1 57 PHE 3.54 -0.08 1 58 LEU 3.32 -0.75 1 59 ASP 3.20 -0.03 1 60 TYR -0.77 -0.24 1 65 VAL 3.24 -0.05 1 66 LEU -0.09 0.17 1 67 GLN -1.51 -0.20 1 68 GLN -2.49 0.34 1 69 TRP -1.65 0.50 1 70 VAL -0.20 0.48 1 71 ILE -3.08 0.57 1 73 GLN 3.90 -0.69 1 74 ARG -4.73 0.45 1 75 LEU 1.47 0.19 1 76 ALA -3.67 0.40 1 77 ARG -2.17 0.23 1 78 ASP 3.78 -0.48 1 79 GLN 2.22 0.07 1 80 GLU -1.55 0.11 1 81 THR -4.23 0.69 1 82 LEU 7.39 -0.46 1 83 HIS 4.61 -0.14 1 84 SER 3.29 -0.27 1 85 HIS 0.53 0.03 1 87 VAL 3.98 -0.17 1 88 ARG -2.80 0.18 1 89 GLN -3.94 0.45 1 90 ASN 1.88 0.08 1 92 ASP 1.54 0.24 1 94 ALA -6.45 0.47 1 95 TYR -2.41 -0.22 1 96 LEU -2.76 -0.31 1 97 TYR -1.77 -0.04 1 98 LEU -2.26 0.57 1 99 LEU -1.19 -0.04 1 100 SER -0.82 -0.10 1 101 ALA -0.15 -0.06 1 102 ARG 0.99 -0.13 1 103 ASN 0.86 0.01 1 104 THR 0.09 -0.13 1 105 SER 0.23 -0.01 1 106 LEU -0.52 0.01 1 107 ASN 0.51 -0.14 1 109 GLN 4.30 -0.53 1 110 GLU -3.18 -0.08 1 112 GLN 2.98 -0.26 1 114 GLU 3.87 -0.31 1 115 ARG 7.36 -0.27 1 116 GLN 3.34 -0.21 1 117 LEU 3.08 -0.30 1 119 MET 7.23 -0.43 1 123 LEU 0.56 -0.08 1 125 PHE -4.70 -0.33 1 127 ASP 1.17 -0.02 1 128 LEU 0.24 0.04 1 129 THR -0.42 0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 -2.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.70 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 1.99 _LACS_plot.Y_axis_chem_shift_offset 0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 THR -4.23 4.13 0 10 SER -0.09 0.12 1 11 VAL 0.36 -0.25 1 12 GLN 0.14 -0.14 1 13 LEU -0.19 -0.48 1 14 LYS 0.01 -0.36 1 16 GLU 0.03 -0.25 1 17 VAL -0.01 -0.23 1 18 SER -0.58 0.19 1 20 THR -0.17 -0.26 1 21 GLN -0.41 -1.00 1 22 ASP 0.25 -0.43 1 23 ILE -5.76 -1.79 1 24 ARG -0.04 -2.25 1 25 LEU -6.09 -2.80 1 26 TRP -0.57 -0.97 1 27 VAL -2.90 -1.45 1 28 SER -1.12 -1.22 1 29 VAL -0.49 -1.22 1 30 GLU -4.17 -1.53 1 31 ASP -3.68 1.13 1 32 ALA 2.56 0.61 1 33 GLN 0.78 -1.07 1 34 MET 6.16 -0.16 1 35 HIS 0.94 0.90 1 36 THR -1.82 -0.22 1 37 VAL -4.26 -2.68 1 38 THR -2.26 -0.25 1 39 ILE -5.20 -3.25 1 40 TRP -3.49 0.38 1 41 LEU -6.52 -1.47 1 42 THR 2.26 -0.02 1 43 VAL -6.80 -2.60 1 44 ARG -3.48 1.58 1 46 ASP 1.40 -0.61 1 47 MET -0.63 -0.52 1 48 THR -3.29 2.08 1 49 VAL 6.41 1.83 1 50 ALA 4.60 2.50 1 51 SER 4.72 2.72 1 52 LEU 3.97 0.42 1 53 LYS 1.75 4.80 1 54 ASP 4.66 1.35 1 55 MET 3.71 2.13 1 56 VAL 6.91 2.33 1 57 PHE 3.54 2.74 1 58 LEU 3.32 1.56 1 59 ASP 3.20 0.05 1 60 TYR -0.77 0.13 1 65 VAL 3.24 -0.24 1 66 LEU -0.09 -1.94 1 67 GLN -1.51 -0.47 1 68 GLN -2.49 -2.21 1 69 TRP -1.65 -0.20 1 70 VAL -0.20 -0.39 1 71 ILE -3.08 0.82 1 73 GLN 3.90 -1.48 1 74 ARG -4.73 -0.85 1 75 LEU 1.47 -1.16 1 76 ALA -3.67 -1.99 1 77 ARG -2.17 1.01 1 78 ASP 3.78 0.64 1 79 GLN 2.22 -1.48 1 80 GLU -1.55 0.03 1 82 LEU 7.39 3.80 1 83 HIS 4.61 4.53 1 84 SER 3.29 0.50 1 85 HIS 0.53 -0.38 1 87 VAL 3.98 -0.97 1 88 ARG -2.80 -1.51 1 89 GLN -3.94 -2.26 1 90 ASN 1.88 2.24 1 92 ASP 1.54 -2.05 1 93 SER -4.72 -0.15 1 94 ALA -6.45 -3.83 1 95 TYR -2.41 -3.34 1 96 LEU -2.76 -4.21 1 97 TYR -1.77 -1.28 1 98 LEU -2.26 -0.23 1 99 LEU -1.19 -1.09 1 100 SER -0.82 0.42 1 101 ALA -0.15 0.03 1 102 ARG 0.99 0.13 1 103 ASN 0.86 0.26 1 104 THR 0.09 -0.13 1 105 SER 0.23 -0.22 1 106 LEU -0.52 -1.05 1 109 GLN 4.30 -1.45 1 110 GLU -3.18 1.39 1 111 LEU 3.43 1.39 1 112 GLN 2.98 2.49 1 113 ARG 4.03 2.20 1 114 GLU 3.87 1.56 1 115 ARG 7.36 2.15 1 116 GLN 3.34 2.41 1 117 LEU 3.08 1.61 1 119 MET 7.23 0.49 1 120 LEU 0.87 1.18 1 121 GLN 4.43 2.59 1 123 LEU 0.56 0.20 1 125 PHE -4.70 0.41 1 126 LYS -0.44 -0.60 1 127 ASP 1.17 -0.91 1 128 LEU 0.24 -0.63 1 129 THR -0.42 3.77 1 stop_ save_