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 bmr10030_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.76 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.52 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 5.78 _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 29 ILE -4.76 -1.59 0 55 ILE -1.14 -3.50 0 10 ASP 3.24 2.72 1 11 ILE 4.19 3.47 1 12 ILE 3.74 3.85 1 13 VAL 6.44 5.41 1 14 ASN 4.03 3.16 1 15 TRP 6.44 5.51 1 16 VAL 5.86 4.85 1 17 ASN 4.40 2.77 1 18 ARG 4.43 3.30 1 19 THR 7.36 5.17 1 20 LEU 3.59 3.35 1 21 SER 4.22 3.30 1 22 GLU 3.33 2.56 1 23 ALA -1.61 -0.77 1 25 LYS -2.67 -3.36 1 26 SER 0.13 0.40 1 27 THR -3.77 -1.96 1 28 SER -1.79 -0.70 1 30 GLN 0.10 0.88 1 31 SER -0.58 -1.23 1 32 PHE 2.40 -0.17 1 33 LYS -1.95 -1.57 1 34 ASP -1.38 -0.14 1 35 LYS 3.65 2.57 1 36 THR 3.14 2.81 1 37 ILE 4.63 3.36 1 38 SER 0.44 1.78 1 39 SER -0.35 0.99 1 40 SER 6.76 5.32 1 41 LEU 5.81 3.74 1 42 ALA 3.60 2.41 1 43 VAL 5.89 4.39 1 44 VAL 6.19 5.02 1 45 ASP 3.51 2.55 1 46 LEU 2.33 2.18 1 47 ILE 6.28 5.43 1 48 ASP 0.59 3.05 1 49 ALA 1.67 1.61 1 50 ILE 2.86 2.89 1 51 GLN -2.16 -0.80 1 56 ASN -1.01 -2.36 1 57 TYR 6.86 5.36 1 58 ASP 3.68 2.41 1 59 LEU 1.17 -0.87 1 60 VAL -2.23 -1.09 1 61 LYS -1.80 -1.50 1 62 SER -2.75 -1.12 1 64 ASN 1.42 0.01 1 65 LEU -0.96 0.13 1 66 THR -2.98 -1.38 1 67 GLU 4.62 3.69 1 68 ASP 3.88 3.47 1 69 ASP 2.19 3.38 1 70 LYS 5.19 4.62 1 71 HIS 5.24 6.34 1 72 ASN 4.55 3.86 1 73 ASN 4.01 2.80 1 74 ALA 1.86 2.59 1 75 LYS 4.13 3.91 1 76 TYR 3.49 2.97 1 77 ALA 4.25 3.33 1 78 VAL 6.76 5.12 1 79 SER 4.22 3.33 1 80 MET 3.23 -0.06 1 81 ALA 4.70 2.62 1 82 ARG 4.17 3.23 1 83 ARG 4.27 3.29 1 84 ILE 0.98 0.76 1 86 ALA -2.11 -1.83 1 87 ARG 2.39 -0.30 1 88 VAL -1.70 -0.87 1 89 TYR -0.50 -0.93 1 90 ALA -1.42 -0.66 1 91 LEU -0.27 -0.83 1 93 GLU 4.44 3.41 1 94 ASP 3.58 3.75 1 95 LEU 3.62 2.25 1 96 VAL 5.02 4.37 1 97 GLU -0.35 -0.44 1 98 VAL 5.01 1.34 1 99 LYS 0.34 -0.42 1 101 LYS 4.65 3.38 1 102 MET 1.17 0.04 1 103 VAL 6.12 5.21 1 104 MET 6.28 4.23 1 105 THR 4.82 4.04 1 106 VAL 6.41 4.56 1 107 PHE 6.51 5.88 1 108 ALA 3.86 3.18 1 110 LEU 4.58 3.33 1 111 MET 4.43 3.48 1 113 ARG 2.05 0.68 1 115 MET 1.07 0.82 1 116 LYS 0.62 0.34 1 117 ARG 0.12 0.15 1 118 VAL -0.09 0.00 1 119 SER -0.21 -0.03 1 122 SER 0.03 0.15 1 123 SER -0.10 0.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10030_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.76 _LACS_plot.Line_1_terminator_val_y_1 2.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.48 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 -1.58 _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 29 ILE -4.76 3.17 0 55 ILE -1.14 -2.36 0 10 ASP 3.24 -0.52 1 11 ILE 4.19 -0.72 1 12 ILE 3.74 0.11 1 13 VAL 6.44 -1.03 1 14 ASN 4.03 -0.87 1 15 TRP 6.44 -0.93 1 16 VAL 5.86 -1.01 1 17 ASN 4.40 -1.63 1 18 ARG 4.43 -1.13 1 19 THR 7.36 -2.19 1 20 LEU 3.59 -0.24 1 21 SER 4.22 -0.92 1 22 GLU 3.33 -0.77 1 23 ALA -1.61 0.84 1 25 LYS -2.67 -0.69 1 26 SER 0.13 0.27 1 27 THR -3.77 1.81 1 28 SER -1.79 1.09 1 30 GLN 0.10 0.78 1 31 SER -0.58 -0.65 1 32 PHE 2.40 -2.57 1 33 LYS -1.95 0.38 1 34 ASP -1.38 1.24 1 35 LYS 3.65 -1.08 1 36 THR 3.14 -0.33 1 37 ILE 4.63 -1.27 1 38 SER 0.44 1.34 1 39 SER -0.35 1.34 1 40 SER 6.76 -1.44 1 41 LEU 5.81 -2.07 1 42 ALA 3.60 -1.19 1 43 VAL 5.89 -1.50 1 44 VAL 6.19 -1.17 1 45 ASP 3.51 -0.96 1 46 LEU 2.33 -0.15 1 47 ILE 6.28 -0.85 1 48 ASP 0.59 2.46 1 49 ALA 1.67 -0.06 1 50 ILE 2.86 0.03 1 51 GLN -2.16 1.36 1 56 ASN -1.01 -1.35 1 57 TYR 6.86 -1.50 1 58 ASP 3.68 -1.27 1 59 LEU 1.17 -2.04 1 60 VAL -2.23 1.14 1 61 LYS -1.80 0.30 1 62 SER -2.75 1.63 1 64 ASN 1.42 -1.41 1 65 LEU -0.96 1.09 1 66 THR -2.98 1.60 1 67 GLU 4.62 -0.93 1 68 ASP 3.88 -0.41 1 69 ASP 2.19 1.19 1 70 LYS 5.19 -0.57 1 71 HIS 5.24 1.10 1 72 ASN 4.55 -0.69 1 73 ASN 4.01 -1.21 1 74 ALA 1.86 0.73 1 75 LYS 4.13 -0.22 1 76 TYR 3.49 -0.52 1 77 ALA 4.25 -0.92 1 78 VAL 6.76 -1.64 1 79 SER 4.22 -0.89 1 80 MET 3.23 -3.29 1 81 ALA 4.70 -2.08 1 82 ARG 4.17 -0.94 1 83 ARG 4.27 -0.98 1 84 ILE 0.98 -0.22 1 86 ALA -2.11 0.28 1 87 ARG 2.39 -2.69 1 88 VAL -1.70 0.83 1 89 TYR -0.50 -0.43 1 90 ALA -1.42 0.76 1 91 LEU -0.27 -0.56 1 93 GLU 4.44 -1.03 1 94 ASP 3.58 0.17 1 95 LEU 3.62 -1.37 1 96 VAL 5.02 -0.65 1 97 GLU -0.35 -0.09 1 98 VAL 5.01 -3.67 1 99 LYS 0.34 -0.76 1 101 LYS 4.65 -1.27 1 102 MET 1.17 -1.13 1 103 VAL 6.12 -0.91 1 104 MET 6.28 -2.05 1 105 THR 4.82 -0.78 1 106 VAL 6.41 -1.85 1 107 PHE 6.51 -0.63 1 108 ALA 3.86 -0.68 1 110 LEU 4.58 -1.25 1 111 MET 4.43 -0.95 1 113 ARG 2.05 -1.37 1 115 MET 1.07 -0.25 1 116 LYS 0.62 -0.28 1 117 ARG 0.12 0.03 1 118 VAL -0.09 0.09 1 119 SER -0.21 0.18 1 122 SER 0.03 0.12 1 123 SER -0.10 0.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10030_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.76 _LACS_plot.Line_1_terminator_val_y_1 0.35 _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 0.18 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 111 MET 4.43 -1.69 0 104 MET 6.28 -1.94 0 10 ASP 3.24 -0.40 1 11 ILE 4.19 -0.34 1 12 ILE 3.74 0.04 1 13 VAL 6.44 -1.12 1 14 ASN 4.03 -0.32 1 15 TRP 6.44 -0.60 1 16 VAL 5.86 -1.09 1 17 ASN 4.40 -0.25 1 18 ARG 4.43 -0.31 1 19 THR 7.36 -0.91 1 20 LEU 3.59 -0.71 1 21 SER 4.22 -0.29 1 22 GLU 3.33 -0.32 1 23 ALA -1.61 0.24 1 25 LYS -2.67 0.19 1 26 SER 0.13 0.07 1 27 THR -3.77 -0.07 1 28 SER -1.79 -0.04 1 29 ILE -4.76 0.66 1 30 GLN 0.10 -0.08 1 31 SER -0.58 -0.55 1 32 PHE 2.40 0.19 1 33 LYS -1.95 0.27 1 34 ASP -1.38 -0.35 1 35 LYS 3.65 -0.14 1 36 THR 3.14 0.04 1 37 ILE 4.63 -0.14 1 38 SER 0.44 0.24 1 39 SER -0.35 -0.23 1 40 SER 6.76 -0.32 1 41 LEU 5.81 -0.32 1 42 ALA 3.60 -0.02 1 43 VAL 5.89 -0.67 1 44 VAL 6.19 -0.68 1 45 ASP 3.51 -0.26 1 46 LEU 2.33 -0.37 1 47 ILE 6.28 -0.80 1 48 ASP 0.59 -0.13 1 49 ALA 1.67 -0.26 1 50 ILE 2.86 -0.26 1 51 GLN -2.16 0.09 1 55 ILE -1.14 -0.20 1 56 ASN -1.01 0.17 1 57 TYR 6.86 -0.75 1 58 ASP 3.68 -0.10 1 59 LEU 1.17 -0.23 1 60 VAL -2.23 -0.28 1 61 LYS -1.80 0.27 1 62 SER -2.75 0.28 1 64 ASN 1.42 -0.10 1 65 LEU -0.96 0.34 1 66 THR -2.98 0.24 1 67 GLU 4.62 -0.37 1 68 ASP 3.88 -0.16 1 69 ASP 2.19 -0.26 1 70 LYS 5.19 -0.42 1 71 HIS 5.24 -0.73 1 72 ASN 4.55 -0.21 1 73 ASN 4.01 -0.32 1 74 ALA 1.86 0.01 1 75 LYS 4.13 -0.47 1 76 TYR 3.49 -0.19 1 77 ALA 4.25 -0.88 1 78 VAL 6.76 -0.77 1 79 SER 4.22 -0.32 1 80 MET 3.23 0.03 1 81 ALA 4.70 -0.52 1 82 ARG 4.17 -0.10 1 83 ARG 4.27 -0.27 1 84 ILE 0.98 0.40 1 86 ALA -2.11 0.11 1 87 ARG 2.39 -0.25 1 88 VAL -1.70 -0.12 1 89 TYR -0.50 0.10 1 90 ALA -1.42 -0.11 1 91 LEU -0.27 0.03 1 93 GLU 4.44 -0.47 1 94 ASP 3.58 -0.41 1 95 LEU 3.62 -0.34 1 96 VAL 5.02 -0.47 1 97 GLU -0.35 -0.19 1 98 VAL 5.01 -1.05 1 99 LYS 0.34 0.12 1 101 LYS 4.65 -0.29 1 102 MET 1.17 0.19 1 103 VAL 6.12 -0.87 1 105 THR 4.82 -0.39 1 106 VAL 6.41 -0.66 1 107 PHE 6.51 -0.44 1 108 ALA 3.86 -0.39 1 110 LEU 4.58 -0.39 1 113 ARG 2.05 0.04 1 115 MET 1.07 0.08 1 116 LYS 0.62 0.02 1 117 ARG 0.12 0.09 1 118 VAL -0.09 0.12 1 119 SER -0.21 0.05 1 122 SER 0.03 0.10 1 123 SER -0.10 0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10030_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.76 _LACS_plot.Line_1_terminator_val_y_1 -1.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.51 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 2.44 _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 51 GLN -2.16 -4.15 0 98 VAL 5.01 -2.66 0 32 PHE 2.40 -3.81 0 10 ASP 3.24 1.44 1 11 ILE 4.19 2.55 1 12 ILE 3.74 1.45 1 13 VAL 6.44 0.84 1 14 ASN 4.03 2.77 1 15 TRP 6.44 3.36 1 16 VAL 5.86 0.74 1 17 ASN 4.40 4.13 1 18 ARG 4.43 1.20 1 19 THR 7.36 2.49 1 20 LEU 3.59 0.69 1 21 SER 4.22 5.44 1 22 GLU 3.33 0.98 1 23 ALA -1.61 -0.60 1 25 LYS -2.67 0.97 1 26 SER 0.13 -0.20 1 27 THR -3.77 -1.97 1 28 SER -1.79 -1.26 1 29 ILE -4.76 -0.74 1 30 GLN 0.10 0.47 1 31 SER -0.58 -1.69 1 33 LYS -1.95 -0.03 1 34 ASP -1.38 0.63 1 35 LYS 3.65 2.99 1 36 THR 3.14 2.90 1 37 ILE 4.63 -0.08 1 38 SER 0.44 0.84 1 39 SER -0.35 -0.10 1 40 SER 6.76 -0.43 1 41 LEU 5.81 1.30 1 42 ALA 3.60 0.97 1 43 VAL 5.89 0.85 1 44 VAL 6.19 0.89 1 45 ASP 3.51 1.46 1 46 LEU 2.33 0.49 1 47 ILE 6.28 0.75 1 48 ASP 0.59 1.11 1 49 ALA 1.67 2.12 1 50 ILE 2.86 -0.06 1 55 ILE -1.14 -0.91 1 56 ASN -1.01 0.94 1 57 TYR 6.86 1.30 1 58 ASP 3.68 1.36 1 59 LEU 1.17 -2.08 1 60 VAL -2.23 -1.38 1 61 LYS -1.80 -1.15 1 62 SER -2.75 -1.06 1 64 ASN 1.42 -0.39 1 65 LEU -0.96 1.04 1 66 THR -2.98 1.08 1 67 GLU 4.62 2.85 1 68 ASP 3.88 2.17 1 69 ASP 2.19 2.54 1 70 LYS 5.19 3.54 1 71 HIS 5.24 3.20 1 72 ASN 4.55 3.60 1 73 ASN 4.01 1.61 1 74 ALA 1.86 2.05 1 75 LYS 4.13 3.02 1 76 TYR 3.49 1.20 1 77 ALA 4.25 1.23 1 78 VAL 6.76 1.51 1 79 SER 4.22 3.46 1 80 MET 3.23 1.79 1 81 ALA 4.70 0.95 1 82 ARG 4.17 4.80 1 83 ARG 4.27 2.51 1 84 ILE 0.98 -0.38 1 86 ALA -2.11 -1.89 1 87 ARG 2.39 -1.61 1 88 VAL -1.70 -1.02 1 89 TYR -0.50 -0.90 1 90 ALA -1.42 -2.76 1 91 LEU -0.27 1.36 1 93 GLU 4.44 0.53 1 94 ASP 3.58 1.52 1 95 LEU 3.62 0.13 1 96 VAL 5.02 1.56 1 97 GLU -0.35 -0.88 1 99 LYS 0.34 0.92 1 101 LYS 4.65 2.56 1 102 MET 1.17 3.52 1 103 VAL 6.12 1.33 1 104 MET 6.28 1.00 1 105 THR 4.82 2.15 1 106 VAL 6.41 1.31 1 107 PHE 6.51 1.85 1 108 ALA 3.86 3.08 1 110 LEU 4.58 -0.16 1 111 MET 4.43 1.33 1 113 ARG 2.05 2.33 1 115 MET 1.07 -0.06 1 116 LYS 0.62 -0.33 1 117 ARG 0.12 0.06 1 118 VAL -0.09 -0.18 1 119 SER -0.21 -0.15 1 122 SER 0.03 -0.16 1 123 SER -0.10 -0.69 1 stop_ save_