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 bmr19904_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.69 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 5.11 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 MET 0.87 -2.31 0 31 ILE 0.22 -2.73 0 13 HIS -5.36 -0.63 0 10 LEU -7.00 -2.88 1 11 VAL -0.70 -1.08 1 12 LYS -1.54 0.06 1 14 LYS 2.96 1.93 1 15 ASP -0.23 0.44 1 16 VAL -0.24 -1.69 1 17 ARG 3.74 2.50 1 18 ARG -0.28 -0.94 1 20 SER -3.18 -1.67 1 21 SER -0.10 -0.32 1 22 LEU -1.37 -1.77 1 23 ALA -0.34 -0.14 1 25 ARG 3.27 1.99 1 26 ASN 0.94 -1.62 1 27 LYS 3.61 2.73 1 29 GLU 0.91 0.86 1 30 LYS 1.56 0.81 1 32 THR -1.06 -1.17 1 33 ARG 0.11 -0.80 1 34 SER -3.19 -1.23 1 35 ARG 5.77 4.23 1 36 ALA 3.85 2.35 1 37 ASP 2.89 2.45 1 38 ALA 3.72 2.66 1 39 ILE 5.41 4.02 1 40 ASN 4.08 2.77 1 41 LEU 3.53 2.72 1 42 ALA 4.39 2.91 1 43 GLN 4.55 2.93 1 44 ALA 4.11 2.25 1 45 ILE 5.42 4.15 1 46 LEU 3.26 2.49 1 47 ALA 2.87 1.37 1 48 GLN 3.15 1.75 1 49 HIS -0.70 -1.40 1 50 LYS 3.24 2.01 1 51 GLU 2.18 0.67 1 52 ARG -0.92 -0.34 1 53 LYS 0.82 0.38 1 54 THR -2.08 -1.87 1 55 TRP -3.94 -2.43 1 56 SER -3.10 -1.77 1 57 LEU 4.66 3.21 1 58 ASP 3.63 2.84 1 59 GLU 1.67 1.86 1 60 PHE 5.36 4.74 1 61 VAL 5.81 4.25 1 62 GLN 4.75 3.32 1 63 VAL 4.79 2.78 1 64 VAL 6.33 4.67 1 65 ARG 4.79 3.71 1 66 ASP 0.69 1.57 1 67 PHE -1.94 1.24 1 68 SER -0.91 0.61 1 69 GLU -0.78 -1.11 1 72 SER 4.18 3.05 1 73 ALA 3.36 2.62 1 74 LYS 3.46 2.78 1 75 ARG 0.15 -1.95 1 76 ASP 4.51 2.68 1 78 ASP 0.03 0.26 1 79 LEU -0.51 -1.01 1 82 VAL -1.49 -0.41 1 83 GLU -3.80 -2.36 1 84 SER 2.61 1.15 1 86 THR 3.25 2.87 1 87 TYR -0.39 -0.54 1 88 THR -1.08 -0.33 1 89 GLU 3.83 3.25 1 91 PHE 2.65 2.92 1 92 ASP 4.47 3.59 1 93 THR 5.24 4.20 1 94 VAL 3.18 2.49 1 95 ALA 3.89 2.70 1 96 PHE 7.08 3.93 1 97 SER -0.80 0.22 1 98 LEU -0.40 -0.04 1 99 LYS -0.45 -0.76 1 100 SER 3.98 2.52 1 102 GLU -3.73 -1.32 1 103 VAL -4.00 -3.25 1 104 SER -2.38 0.22 1 105 ALA 2.14 0.61 1 107 VAL -3.98 -2.17 1 108 GLU -2.32 -0.57 1 109 THR -3.48 -0.63 1 110 GLU 2.93 1.53 1 111 LEU 0.99 -0.03 1 113 VAL -0.69 -1.08 1 114 HIS -3.02 -1.04 1 115 LEU -1.80 -0.55 1 116 ILE -2.25 -0.69 1 117 TYR -5.87 -3.83 1 118 ARG -1.46 -1.73 1 119 VAL 0.33 0.11 1 120 GLU -0.07 0.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19904_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 4.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 -1.97 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 MET 0.87 -3.18 0 31 ILE 0.22 -2.95 0 13 HIS -5.36 4.73 0 10 LEU -7.00 4.12 1 11 VAL -0.70 -0.38 1 12 LYS -1.54 1.60 1 14 LYS 2.96 -1.03 1 15 ASP -0.23 0.67 1 16 VAL -0.24 -1.45 1 17 ARG 3.74 -1.24 1 18 ARG -0.28 -0.66 1 20 SER -3.18 1.51 1 21 SER -0.10 -0.22 1 22 LEU -1.37 -0.40 1 23 ALA -0.34 0.20 1 25 ARG 3.27 -1.28 1 26 ASN 0.94 -2.56 1 27 LYS 3.61 -0.88 1 29 GLU 0.91 -0.05 1 30 LYS 1.56 -0.75 1 32 THR -1.06 -0.11 1 33 ARG 0.11 -0.91 1 34 SER -3.19 1.96 1 35 ARG 5.77 -1.54 1 36 ALA 3.85 -1.50 1 37 ASP 2.89 -0.44 1 38 ALA 3.72 -1.06 1 39 ILE 5.41 -1.39 1 40 ASN 4.08 -1.31 1 41 LEU 3.53 -0.81 1 42 ALA 4.39 -1.48 1 43 GLN 4.55 -1.62 1 44 ALA 4.11 -1.86 1 45 ILE 5.42 -1.27 1 46 LEU 3.26 -0.77 1 47 ALA 2.87 -1.50 1 48 GLN 3.15 -1.40 1 49 HIS -0.70 -0.70 1 50 LYS 3.24 -1.23 1 51 GLU 2.18 -1.51 1 52 ARG -0.92 0.58 1 53 LYS 0.82 -0.44 1 54 THR -2.08 0.21 1 55 TRP -3.94 1.51 1 56 SER -3.10 1.33 1 57 LEU 4.66 -1.45 1 58 ASP 3.63 -0.79 1 59 GLU 1.67 0.19 1 60 PHE 5.36 -0.62 1 61 VAL 5.81 -1.56 1 62 GLN 4.75 -1.43 1 63 VAL 4.79 -2.01 1 64 VAL 6.33 -1.66 1 65 ARG 4.79 -1.08 1 66 ASP 0.69 0.88 1 67 PHE -1.94 3.18 1 68 SER -0.91 1.52 1 69 GLU -0.78 -0.33 1 72 SER 4.18 -1.13 1 73 ALA 3.36 -0.74 1 74 LYS 3.46 -0.68 1 75 ARG 0.15 -2.10 1 76 ASP 4.51 -1.83 1 78 ASP 0.03 0.23 1 79 LEU -0.51 -0.50 1 82 VAL -1.49 1.08 1 83 GLU -3.80 1.44 1 84 SER 2.61 -1.46 1 86 THR 3.25 -0.38 1 87 TYR -0.39 -0.15 1 88 THR -1.08 0.75 1 89 GLU 3.83 -0.58 1 91 PHE 2.65 0.27 1 92 ASP 4.47 -0.88 1 93 THR 5.24 -1.04 1 94 VAL 3.18 -0.69 1 95 ALA 3.89 -1.19 1 96 PHE 7.08 -3.15 1 97 SER -0.80 1.02 1 98 LEU -0.40 0.36 1 99 LYS -0.45 -0.31 1 100 SER 3.98 -1.46 1 102 GLU -3.73 2.41 1 103 VAL -4.00 0.75 1 104 SER -2.38 2.60 1 105 ALA 2.14 -1.53 1 107 VAL -3.98 1.81 1 108 GLU -2.32 1.75 1 109 THR -3.48 2.85 1 110 GLU 2.93 -1.40 1 111 LEU 0.99 -1.02 1 113 VAL -0.69 -0.39 1 114 HIS -3.02 1.98 1 115 LEU -1.80 1.25 1 116 ILE -2.25 1.56 1 117 TYR -5.87 2.04 1 118 ARG -1.46 -0.27 1 119 VAL 0.33 -0.22 1 120 GLU -0.07 0.87 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19904_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 0.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 -0.74 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 ASP 0.03 -1.56 0 10 LEU -7.00 0.27 1 11 VAL -0.70 -0.03 1 12 LYS -1.54 -0.11 1 13 HIS -5.36 -0.33 1 14 LYS 2.96 -0.25 1 15 ASP -0.23 0.48 1 16 VAL -0.24 0.23 1 17 ARG 3.74 -0.35 1 18 ARG -0.28 -0.01 1 20 SER -3.18 0.70 1 21 SER -0.10 -0.02 1 22 LEU -1.37 0.22 1 23 ALA -0.34 -0.45 1 25 ARG 3.27 -0.34 1 26 ASN 0.94 -0.06 1 27 LYS 3.61 -0.78 1 29 GLU 0.91 -0.36 1 30 LYS 1.56 -0.18 1 31 ILE 0.22 -0.04 1 32 THR -1.06 0.04 1 33 ARG 0.11 0.18 1 34 SER -3.19 0.07 1 35 ARG 5.77 -0.98 1 36 ALA 3.85 -0.46 1 37 ASP 2.89 -0.33 1 38 ALA 3.72 -0.39 1 39 ILE 5.41 -0.69 1 40 ASN 4.08 -0.41 1 41 LEU 3.53 -0.21 1 42 ALA 4.39 -0.56 1 43 GLN 4.55 -0.38 1 44 ALA 4.11 -0.23 1 45 ILE 5.42 -0.85 1 46 LEU 3.26 -0.12 1 47 ALA 2.87 -0.25 1 48 GLN 3.15 -0.39 1 49 HIS -0.70 -0.04 1 50 LYS 3.24 -0.27 1 51 GLU 2.18 -0.25 1 52 ARG -0.92 0.17 1 53 LYS 0.82 0.18 1 54 THR -2.08 0.57 1 55 TRP -3.94 0.33 1 56 SER -3.10 0.21 1 57 LEU 4.66 -0.44 1 58 ASP 3.63 -0.46 1 59 GLU 1.67 -0.44 1 60 PHE 5.36 -0.47 1 61 VAL 5.81 -0.66 1 62 GLN 4.75 -0.58 1 63 VAL 4.79 0.03 1 64 VAL 6.33 -0.81 1 65 ARG 4.79 -0.59 1 66 ASP 0.69 -0.31 1 67 PHE -1.94 0.07 1 68 SER -0.91 -0.16 1 69 GLU -0.78 0.30 1 72 SER 4.18 -0.32 1 73 ALA 3.36 -0.33 1 74 LYS 3.46 -0.17 1 75 ARG 0.15 0.40 1 76 ASP 4.51 -0.33 1 79 LEU -0.51 -0.01 1 81 MET 0.87 0.08 1 82 VAL -1.49 0.14 1 83 GLU -3.80 0.60 1 84 SER 2.61 -0.46 1 86 THR 3.25 -0.32 1 87 TYR -0.39 -0.19 1 88 THR -1.08 -0.05 1 89 GLU 3.83 -0.29 1 91 PHE 2.65 -0.93 1 92 ASP 4.47 -0.17 1 93 THR 5.24 -0.54 1 94 VAL 3.18 -0.43 1 95 ALA 3.89 -1.19 1 96 PHE 7.08 -0.45 1 97 SER -0.80 0.16 1 98 LEU -0.40 -0.21 1 99 LYS -0.45 -0.07 1 100 SER 3.98 -1.18 1 102 GLU -3.73 0.39 1 103 VAL -4.00 0.72 1 104 SER -2.38 -0.43 1 105 ALA 2.14 -0.23 1 107 VAL -3.98 0.29 1 108 GLU -2.32 0.84 1 109 THR -3.48 0.48 1 110 GLU 2.93 0.00 1 111 LEU 0.99 -0.10 1 113 VAL -0.69 0.52 1 114 HIS -3.02 0.94 1 115 LEU -1.80 -0.01 1 116 ILE -2.25 0.22 1 117 TYR -5.87 0.47 1 118 ARG -1.46 0.35 1 119 VAL 0.33 -0.67 1 120 GLU -0.07 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19904_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.61 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 1.73 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 ASP 4.51 -4.32 0 10 LEU -7.00 -3.96 1 11 VAL -0.70 -0.70 1 12 LYS -1.54 -3.51 1 13 HIS -5.36 1.00 1 14 LYS 2.96 -1.29 1 15 ASP -0.23 0.12 1 16 VAL -0.24 -1.21 1 17 ARG 3.74 0.84 1 18 ARG -0.28 -0.72 1 20 SER -3.18 -1.11 1 21 SER -0.10 1.05 1 22 LEU -1.37 -2.56 1 23 ALA -0.34 2.56 1 25 ARG 3.27 -0.77 1 26 ASN 0.94 -1.54 1 27 LYS 3.61 1.16 1 29 GLU 0.91 -0.64 1 30 LYS 1.56 -0.79 1 31 ILE 0.22 -0.98 1 32 THR -1.06 -0.01 1 33 ARG 0.11 -2.83 1 34 SER -3.19 0.50 1 35 ARG 5.77 1.05 1 36 ALA 3.85 2.14 1 37 ASP 2.89 2.70 1 38 ALA 3.72 0.44 1 39 ILE 5.41 1.18 1 40 ASN 4.08 2.86 1 41 LEU 3.53 0.00 1 42 ALA 4.39 1.16 1 43 GLN 4.55 2.64 1 44 ALA 4.11 2.76 1 45 ILE 5.42 2.29 1 46 LEU 3.26 2.72 1 47 ALA 2.87 1.15 1 48 GLN 3.15 0.15 1 49 HIS -0.70 0.54 1 50 LYS 3.24 -0.11 1 51 GLU 2.18 -0.81 1 52 ARG -0.92 -1.03 1 53 LYS 0.82 -0.26 1 54 THR -2.08 -0.63 1 55 TRP -3.94 0.83 1 56 SER -3.10 -0.12 1 57 LEU 4.66 0.58 1 58 ASP 3.63 2.76 1 59 GLU 1.67 2.67 1 60 PHE 5.36 1.10 1 61 VAL 5.81 1.27 1 62 GLN 4.75 -1.19 1 63 VAL 4.79 2.31 1 64 VAL 6.33 3.04 1 65 ARG 4.79 1.23 1 66 ASP 0.69 0.87 1 67 PHE -1.94 0.76 1 68 SER -0.91 2.41 1 69 GLU -0.78 -1.95 1 72 SER 4.18 3.59 1 73 ALA 3.36 1.54 1 74 LYS 3.46 -0.21 1 75 ARG 0.15 -0.58 1 78 ASP 0.03 -0.15 1 79 LEU -0.51 0.16 1 81 MET 0.87 0.08 1 82 VAL -1.49 -1.33 1 83 GLU -3.80 1.18 1 84 SER 2.61 0.19 1 86 THR 3.25 0.17 1 87 TYR -0.39 -1.41 1 88 THR -1.08 -0.12 1 89 GLU 3.83 1.69 1 91 PHE 2.65 0.41 1 92 ASP 4.47 2.26 1 93 THR 5.24 1.23 1 94 VAL 3.18 2.29 1 95 ALA 3.89 1.90 1 96 PHE 7.08 -1.45 1 97 SER -0.80 -0.13 1 98 LEU -0.40 0.60 1 99 LYS -0.45 -0.63 1 100 SER 3.98 0.57 1 102 GLU -3.73 -2.48 1 103 VAL -4.00 -0.24 1 104 SER -2.38 -1.73 1 105 ALA 2.14 -0.86 1 107 VAL -3.98 -2.21 1 108 GLU -2.32 -0.36 1 109 THR -3.48 1.21 1 110 GLU 2.93 0.47 1 111 LEU 0.99 -1.50 1 113 VAL -0.69 -2.33 1 114 HIS -3.02 2.87 1 115 LEU -1.80 -2.37 1 116 ILE -2.25 -4.42 1 117 TYR -5.87 -1.53 1 118 ARG -1.46 -2.80 1 119 VAL 0.33 -2.27 1 120 GLU -0.07 3.88 1 stop_ save_