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 bmr19013_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 -2.48 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.58 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 5.19 _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 18 TYR -5.77 -4.74 0 77 LEU -3.50 0.20 0 95 ILE 1.49 -1.32 0 92 HIS 2.64 4.45 0 23 THR 6.71 6.47 0 11 ASN -1.21 -0.63 1 12 ALA -4.69 -1.96 1 13 VAL -5.70 -3.44 1 14 VAL -2.38 -0.90 1 15 VAL -2.44 -2.04 1 16 PHE -4.06 -1.57 1 19 ARG -0.89 -1.07 1 20 GLU 2.97 2.93 1 21 ALA 1.87 2.18 1 22 ILE -0.52 -0.87 1 24 LYS 6.17 4.85 1 25 GLN 5.13 3.98 1 26 ILE 4.29 1.08 1 27 LEU 4.52 3.21 1 28 ALA 3.38 2.40 1 29 TYR 3.66 3.24 1 30 PHE 5.76 4.11 1 31 ALA 2.91 1.29 1 32 GLN 1.57 1.26 1 33 PHE 1.04 -0.63 1 35 GLU 0.57 0.78 1 36 ILE -4.04 -1.25 1 37 LEU 2.23 2.01 1 38 GLU 2.38 2.03 1 39 ASP 0.39 -0.33 1 40 LEU 0.69 0.00 1 41 GLU 3.15 2.64 1 42 SER 2.98 2.03 1 43 GLU 0.45 0.99 1 44 LEU -0.14 -0.16 1 46 ASP -0.18 -0.18 1 47 THR 1.22 0.92 1 48 GLU 1.09 0.91 1 49 THR 1.79 1.19 1 50 MET 0.93 0.58 1 51 ARG 0.17 -0.12 1 52 THR 0.33 0.03 1 55 TYR 0.50 0.61 1 56 PHE 0.53 0.44 1 57 PHE 0.20 0.13 1 58 GLN -0.37 -0.29 1 59 GLN -0.42 -0.40 1 60 ALA 0.11 0.18 1 62 ASN 1.08 0.20 1 63 ARG -0.64 -0.45 1 64 ARG 0.42 0.00 1 65 ARG -0.81 -0.55 1 66 ILE -2.24 -0.89 1 67 SER 0.60 0.30 1 68 ARG -2.12 -0.55 1 69 GLU -0.31 -0.41 1 70 HIS -2.55 -0.43 1 72 ARG 4.28 4.20 1 73 THR -2.50 -2.46 1 74 TRP -5.88 -2.62 1 75 THR -0.54 -0.45 1 76 LYS -2.23 -0.16 1 78 THR 2.60 0.70 1 79 TYR 0.46 1.48 1 80 ALA 1.34 1.43 1 81 ASN -4.14 -1.61 1 82 HIS 4.53 4.09 1 83 SER 5.50 3.34 1 84 SER 5.05 3.95 1 85 TYR 3.95 2.77 1 86 LEU 2.88 2.17 1 87 ARG 3.40 1.44 1 88 ALA 3.87 2.91 1 89 LEU 2.83 2.32 1 90 ARG 2.87 1.80 1 91 GLU -1.06 -1.26 1 94 THR 1.39 1.53 1 96 TYR -3.37 -0.44 1 99 ALA -4.37 -1.72 1 100 ALA -0.05 -0.98 1 101 ILE -2.18 -1.14 1 104 VAL -2.89 -2.39 1 106 TYR 2.53 3.12 1 107 LYS -4.24 -1.42 1 108 HIS 5.05 4.60 1 109 GLU 3.92 2.74 1 110 LEU 1.72 1.27 1 111 ILE 5.02 1.64 1 112 SER 4.74 3.13 1 113 GLU 2.44 1.92 1 114 LEU 3.99 1.58 1 115 SER 1.70 1.41 1 116 ARG 1.76 1.02 1 117 GLU 0.58 0.44 1 119 HIS 0.51 0.41 1 120 HIS 0.22 0.32 1 121 HIS 0.13 0.39 1 122 HIS 0.04 0.39 1 123 HIS 0.10 0.56 1 124 HIS 1.55 2.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19013_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 3.40 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.42 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -1.51 _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 18 TYR -5.77 1.03 0 77 LEU -3.50 3.70 0 95 ILE 1.49 -2.81 0 92 HIS 2.64 1.81 0 23 THR 6.71 -0.24 0 11 ASN -1.21 0.58 1 12 ALA -4.69 2.73 1 13 VAL -5.70 2.26 1 14 VAL -2.38 1.48 1 15 VAL -2.44 0.40 1 16 PHE -4.06 2.49 1 19 ARG -0.89 -0.18 1 20 GLU 2.97 -0.04 1 21 ALA 1.87 0.31 1 22 ILE -0.52 -0.35 1 24 LYS 6.17 -1.32 1 25 GLN 5.13 -1.15 1 26 ILE 4.29 -3.21 1 27 LEU 4.52 -1.31 1 28 ALA 3.38 -0.98 1 29 TYR 3.66 -0.42 1 30 PHE 5.76 -1.65 1 31 ALA 2.91 -1.62 1 32 GLN 1.57 -0.31 1 33 PHE 1.04 -1.67 1 35 GLU 0.57 0.21 1 36 ILE -4.04 2.79 1 37 LEU 2.23 -0.22 1 38 GLU 2.38 -0.35 1 39 ASP 0.39 -0.72 1 40 LEU 0.69 -0.69 1 41 GLU 3.15 -0.51 1 42 SER 2.98 -0.95 1 43 GLU 0.45 0.54 1 44 LEU -0.14 -0.02 1 46 ASP -0.18 0.00 1 47 THR 1.22 -0.30 1 48 GLU 1.09 -0.18 1 49 THR 1.79 -0.60 1 50 MET 0.93 -0.35 1 51 ARG 0.17 -0.29 1 52 THR 0.33 -0.30 1 55 TYR 0.50 0.11 1 56 PHE 0.53 -0.09 1 57 PHE 0.20 -0.07 1 58 GLN -0.37 0.08 1 59 GLN -0.42 0.02 1 60 ALA 0.11 0.07 1 62 ASN 1.08 -0.88 1 63 ARG -0.64 0.19 1 64 ARG 0.42 -0.42 1 65 ARG -0.81 0.26 1 66 ILE -2.24 1.35 1 67 SER 0.60 -0.30 1 68 ARG -2.12 1.57 1 69 GLU -0.31 -0.10 1 70 HIS -2.55 2.12 1 72 ARG 4.28 -0.08 1 73 THR -2.50 0.04 1 74 TRP -5.88 3.26 1 75 THR -0.54 0.09 1 76 LYS -2.23 2.07 1 78 THR 2.60 -1.90 1 79 TYR 0.46 1.02 1 80 ALA 1.34 0.09 1 81 ASN -4.14 2.53 1 82 HIS 4.53 -0.44 1 83 SER 5.50 -2.16 1 84 SER 5.05 -1.10 1 85 TYR 3.95 -1.18 1 86 LEU 2.88 -0.71 1 87 ARG 3.40 -1.96 1 88 ALA 3.87 -0.96 1 89 LEU 2.83 -0.51 1 90 ARG 2.87 -1.07 1 91 GLU -1.06 -0.20 1 94 THR 1.39 0.14 1 96 TYR -3.37 2.93 1 99 ALA -4.37 2.65 1 100 ALA -0.05 -0.93 1 101 ILE -2.18 1.04 1 104 VAL -2.89 0.50 1 106 TYR 2.53 0.59 1 107 LYS -4.24 2.82 1 108 HIS 5.05 -0.45 1 109 GLU 3.92 -1.18 1 110 LEU 1.72 -0.45 1 111 ILE 5.02 -3.38 1 112 SER 4.74 -1.61 1 113 GLU 2.44 -0.52 1 114 LEU 3.99 -2.41 1 115 SER 1.70 -0.29 1 116 ARG 1.76 -0.74 1 117 GLU 0.58 -0.14 1 119 HIS 0.51 -0.10 1 120 HIS 0.22 0.10 1 121 HIS 0.13 0.26 1 122 HIS 0.04 0.35 1 123 HIS 0.10 0.46 1 124 HIS 1.55 0.64 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19013_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 0.51 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 70 HIS -2.55 -0.99 0 11 ASN -1.21 -0.47 1 12 ALA -4.69 1.67 1 13 VAL -5.70 1.21 1 14 VAL -2.38 1.12 1 15 VAL -2.44 1.19 1 16 PHE -4.06 1.30 1 18 TYR -5.77 0.32 1 19 ARG -0.89 0.12 1 20 GLU 2.97 -0.29 1 21 ALA 1.87 0.03 1 22 ILE -0.52 1.00 1 23 THR 6.71 -0.97 1 24 LYS 6.17 -0.66 1 25 GLN 5.13 -0.30 1 26 ILE 4.29 -0.40 1 27 LEU 4.52 -0.42 1 28 ALA 3.38 -0.46 1 29 TYR 3.66 -0.63 1 30 PHE 5.76 -0.69 1 31 ALA 2.91 0.14 1 32 GLN 1.57 -0.38 1 33 PHE 1.04 0.03 1 35 GLU 0.57 -0.18 1 36 ILE -4.04 0.39 1 37 LEU 2.23 -0.25 1 38 GLU 2.38 -0.17 1 39 ASP 0.39 -0.14 1 40 LEU 0.69 -0.03 1 41 GLU 3.15 -0.42 1 42 SER 2.98 -0.26 1 43 GLU 0.45 -0.06 1 44 LEU -0.14 0.01 1 46 ASP -0.18 0.05 1 47 THR 1.22 -0.09 1 48 GLU 1.09 -0.11 1 49 THR 1.79 -0.19 1 50 MET 0.93 -0.19 1 51 ARG 0.17 0.00 1 52 THR 0.33 -0.05 1 55 TYR 0.50 -0.19 1 56 PHE 0.53 -0.19 1 57 PHE 0.20 -0.15 1 58 GLN -0.37 -0.11 1 59 GLN -0.42 -0.05 1 60 ALA 0.11 -0.08 1 62 ASN 1.08 -0.14 1 63 ARG -0.64 0.02 1 64 ARG 0.42 -0.04 1 65 ARG -0.81 0.24 1 66 ILE -2.24 0.26 1 67 SER 0.60 -0.04 1 68 ARG -2.12 0.24 1 69 GLU -0.31 0.15 1 72 ARG 4.28 -0.14 1 73 THR -2.50 -0.15 1 74 TRP -5.88 1.05 1 75 THR -0.54 0.24 1 76 LYS -2.23 1.40 1 77 LEU -3.50 -0.05 1 78 THR 2.60 0.08 1 79 TYR 0.46 0.40 1 80 ALA 1.34 -0.26 1 81 ASN -4.14 0.36 1 82 HIS 4.53 -0.44 1 83 SER 5.50 -0.38 1 84 SER 5.05 -0.53 1 85 TYR 3.95 -0.78 1 86 LEU 2.88 -0.80 1 87 ARG 3.40 -0.49 1 88 ALA 3.87 -0.78 1 89 LEU 2.83 -0.42 1 90 ARG 2.87 -0.21 1 91 GLU -1.06 -0.20 1 92 HIS 2.64 -0.46 1 94 THR 1.39 -0.29 1 95 ILE 1.49 0.22 1 96 TYR -3.37 0.01 1 99 ALA -4.37 0.38 1 100 ALA -0.05 0.31 1 101 ILE -2.18 0.29 1 104 VAL -2.89 0.47 1 106 TYR 2.53 -0.72 1 107 LYS -4.24 -0.14 1 108 HIS 5.05 -0.77 1 109 GLU 3.92 -0.44 1 110 LEU 1.72 -0.34 1 111 ILE 5.02 -1.20 1 112 SER 4.74 -0.47 1 113 GLU 2.44 -0.36 1 114 LEU 3.99 -0.62 1 115 SER 1.70 0.15 1 116 ARG 1.76 -0.10 1 117 GLU 0.58 -0.11 1 119 HIS 0.51 -0.07 1 120 HIS 0.22 -0.06 1 121 HIS 0.13 -0.05 1 122 HIS 0.04 -0.04 1 123 HIS 0.10 -0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19013_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 -2.28 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.78 _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 6.70 _LACS_plot.Line_2_terminator_val_y_2 2.37 _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 74 TRP -5.88 0.57 0 124 HIS 1.55 4.82 0 75 THR -0.54 -4.46 0 11 ASN -1.21 -0.85 1 12 ALA -4.69 -0.48 1 13 VAL -5.70 -1.02 1 14 VAL -2.38 -1.58 1 15 VAL -2.44 -0.04 1 16 PHE -4.06 -1.18 1 18 TYR -5.77 -2.05 1 19 ARG -0.89 0.90 1 20 GLU 2.97 4.04 1 21 ALA 1.87 1.49 1 22 ILE -0.52 -0.76 1 23 THR 6.71 0.46 1 24 LYS 6.17 1.82 1 25 GLN 5.13 3.25 1 26 ILE 4.29 1.40 1 27 LEU 4.52 0.57 1 28 ALA 3.38 1.89 1 29 TYR 3.66 2.33 1 30 PHE 5.76 4.23 1 31 ALA 2.91 0.44 1 32 GLN 1.57 1.47 1 33 PHE 1.04 0.05 1 35 GLU 0.57 -0.66 1 36 ILE -4.04 0.13 1 37 LEU 2.23 0.87 1 38 GLU 2.38 -0.98 1 39 ASP 0.39 0.51 1 40 LEU 0.69 0.35 1 41 GLU 3.15 1.75 1 42 SER 2.98 0.62 1 43 GLU 0.45 0.29 1 44 LEU -0.14 0.34 1 46 ASP -0.18 0.33 1 47 THR 1.22 0.58 1 48 GLU 1.09 0.62 1 49 THR 1.79 0.28 1 50 MET 0.93 -0.45 1 51 ARG 0.17 -0.09 1 52 THR 0.33 -0.39 1 55 TYR 0.50 -0.35 1 56 PHE 0.53 -0.45 1 57 PHE 0.20 -0.62 1 58 GLN -0.37 -0.71 1 59 GLN -0.42 -0.68 1 60 ALA 0.11 0.02 1 62 ASN 1.08 -0.26 1 63 ARG -0.64 -0.45 1 64 ARG 0.42 -0.30 1 65 ARG -0.81 -0.21 1 66 ILE -2.24 -0.91 1 67 SER 0.60 -0.57 1 68 ARG -2.12 -0.33 1 69 GLU -0.31 -1.75 1 70 HIS -2.55 -2.64 1 72 ARG 4.28 2.20 1 73 THR -2.50 -3.40 1 76 LYS -2.23 1.33 1 77 LEU -3.50 -3.04 1 78 THR 2.60 -0.63 1 79 TYR 0.46 0.62 1 80 ALA 1.34 -0.55 1 81 ASN -4.14 0.24 1 82 HIS 4.53 2.39 1 83 SER 5.50 3.02 1 84 SER 5.05 -1.13 1 85 TYR 3.95 -0.89 1 86 LEU 2.88 2.34 1 87 ARG 3.40 2.48 1 88 ALA 3.87 1.72 1 89 LEU 2.83 2.49 1 90 ARG 2.87 1.13 1 91 GLU -1.06 -0.30 1 92 HIS 2.64 2.72 1 94 THR 1.39 -2.04 1 95 ILE 1.49 -0.87 1 96 TYR -3.37 -1.36 1 99 ALA -4.37 -2.58 1 100 ALA -0.05 -0.32 1 101 ILE -2.18 -0.44 1 104 VAL -2.89 -2.19 1 106 TYR 2.53 -1.26 1 107 LYS -4.24 -0.16 1 108 HIS 5.05 2.90 1 109 GLU 3.92 1.14 1 110 LEU 1.72 0.27 1 111 ILE 5.02 2.37 1 112 SER 4.74 1.71 1 113 GLU 2.44 2.20 1 114 LEU 3.99 1.58 1 115 SER 1.70 0.39 1 116 ARG 1.76 0.59 1 117 GLU 0.58 0.66 1 119 HIS 0.51 0.34 1 120 HIS 0.22 0.16 1 121 HIS 0.13 0.15 1 122 HIS 0.04 0.00 1 123 HIS 0.10 -0.51 1 stop_ save_