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 bmr4255_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -2.66 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.46 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 5.23 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 HIS -3.60 1.66 0 11 THR -0.38 -0.11 1 12 ASP -0.10 0.30 1 14 MET 1.01 0.43 1 15 SER 0.65 0.67 1 16 ALA 0.27 0.53 1 17 ILE 0.70 0.49 1 18 GLN 0.47 0.63 1 19 ASN 0.14 0.20 1 20 LEU 0.51 0.54 1 21 HIS 0.21 0.62 1 22 SER -0.06 0.09 1 23 PHE -0.40 -0.11 1 24 ASP -2.07 -1.02 1 26 PHE 0.61 -0.16 1 27 ALA 0.13 0.58 1 28 ASP -0.14 0.20 1 29 ALA 0.15 0.41 1 30 SER 0.35 0.50 1 31 LYS 0.20 0.29 1 33 ASP -0.11 0.29 1 34 ASP 0.20 0.29 1 35 LEU -0.04 -0.01 1 36 LEU -0.29 -0.22 1 38 ALA -0.28 0.17 1 40 THR 0.23 0.27 1 41 GLU -0.48 -0.04 1 42 ASP -0.67 -0.33 1 43 TYR -1.61 -0.58 1 44 ILE -1.61 -0.77 1 45 HIS -3.77 0.61 1 46 ILE -1.58 -1.36 1 47 ARG -4.11 -1.39 1 48 ILE -5.25 -2.36 1 49 GLN -4.17 -1.06 1 50 GLN -2.01 -0.54 1 51 ARG -2.36 -0.69 1 52 ASN 1.97 1.41 1 54 ARG -1.67 -0.74 1 55 LYS -0.08 -0.11 1 56 THR 1.14 1.38 1 57 LEU -5.27 -1.08 1 58 THR -1.13 -0.27 1 59 THR -3.54 -1.58 1 60 VAL -1.67 -0.76 1 61 GLN -4.17 -1.06 1 63 ILE 2.49 0.91 1 64 ALA 0.07 0.89 1 65 ASP 2.54 2.51 1 66 ASP 1.21 0.68 1 67 TYR -0.93 0.16 1 68 ASP -0.59 -0.62 1 69 LYS 3.94 4.46 1 70 LYS 5.36 3.84 1 71 LYS 3.67 3.45 1 72 LEU 3.46 3.49 1 73 VAL 6.26 4.87 1 74 LYS 4.44 4.10 1 75 ALA 2.95 2.53 1 76 PHE 4.31 3.92 1 77 LYS 4.06 3.59 1 78 LYS 2.77 2.30 1 79 LYS 2.06 2.21 1 80 PHE 0.53 0.20 1 81 ALA 2.99 0.52 1 83 ASN -1.42 -0.31 1 85 THR -2.04 -1.57 1 86 VAL -0.66 -0.37 1 87 ILE -6.02 -2.20 1 88 GLU -0.42 -1.13 1 91 GLU -1.36 0.50 1 92 TYR -2.39 -1.61 1 94 GLU 0.07 0.94 1 95 VAL -5.89 -2.62 1 96 ILE -1.68 0.09 1 97 GLN -5.08 -1.10 1 98 LEU -1.00 -2.27 1 99 GLN 1.09 1.52 1 101 ASP -0.15 -1.80 1 102 GLN -2.24 -3.22 1 103 ARG 4.96 5.14 1 104 LYS 4.77 3.56 1 105 ASN 4.09 2.35 1 106 ILE 1.67 0.15 1 108 GLN 4.05 3.38 1 109 PHE 1.93 3.64 1 110 LEU 3.41 2.82 1 111 VAL 2.66 2.36 1 112 GLU 3.74 3.34 1 113 ILE 1.77 0.69 1 115 LEU 0.73 2.19 1 116 ALA -6.95 -2.66 1 117 LYS -3.00 -1.67 1 118 ASP 3.85 3.94 1 119 ASP 1.92 0.96 1 120 GLN -1.60 0.39 1 121 LEU -0.83 -0.92 1 122 LYS -2.12 -2.53 1 123 VAL 0.04 -0.60 1 124 HIS -1.96 0.18 1 126 PHE 0.95 1.72 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4255_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 4.29 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.54 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 -1.02 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 HIS -3.60 5.26 0 11 THR -0.38 0.27 1 12 ASP -0.10 0.40 1 14 MET 1.01 -0.58 1 15 SER 0.65 0.02 1 16 ALA 0.27 0.26 1 17 ILE 0.70 -0.21 1 18 GLN 0.47 0.16 1 19 ASN 0.14 0.06 1 20 LEU 0.51 0.03 1 21 HIS 0.21 0.41 1 22 SER -0.06 0.15 1 23 PHE -0.40 0.29 1 24 ASP -2.07 1.05 1 26 PHE 0.61 -0.77 1 27 ALA 0.13 0.45 1 28 ASP -0.14 0.34 1 29 ALA 0.15 0.26 1 30 SER 0.35 0.15 1 31 LYS 0.20 0.09 1 33 ASP -0.11 0.40 1 34 ASP 0.20 0.09 1 35 LEU -0.04 0.03 1 36 LEU -0.29 0.07 1 38 ALA -0.28 0.45 1 40 THR 0.23 0.04 1 41 GLU -0.48 0.44 1 42 ASP -0.67 0.34 1 43 TYR -1.61 1.03 1 44 ILE -1.61 0.84 1 45 HIS -3.77 4.38 1 46 ILE -1.58 0.22 1 47 ARG -4.11 2.72 1 48 ILE -5.25 2.89 1 49 GLN -4.17 3.11 1 50 GLN -2.01 1.47 1 51 ARG -2.36 1.67 1 52 ASN 1.97 -0.56 1 54 ARG -1.67 0.93 1 55 LYS -0.08 -0.03 1 56 THR 1.14 0.24 1 57 LEU -5.27 4.19 1 58 THR -1.13 0.86 1 59 THR -3.54 1.96 1 60 VAL -1.67 0.91 1 61 GLN -4.17 3.11 1 63 ILE 2.49 -1.58 1 64 ALA 0.07 0.82 1 65 ASP 2.54 -0.03 1 66 ASP 1.21 -0.53 1 67 TYR -0.93 1.09 1 68 ASP -0.59 -0.03 1 69 LYS 3.94 0.52 1 70 LYS 5.36 -1.52 1 71 LYS 3.67 -0.22 1 72 LEU 3.46 0.03 1 73 VAL 6.26 -1.39 1 74 LYS 4.44 -0.34 1 75 ALA 2.95 -0.42 1 76 PHE 4.31 -0.39 1 77 LYS 4.06 -0.47 1 78 LYS 2.77 -0.47 1 79 LYS 2.06 0.15 1 80 PHE 0.53 -0.33 1 81 ALA 2.99 -2.47 1 83 ASN -1.42 1.11 1 85 THR -2.04 0.47 1 86 VAL -0.66 0.29 1 87 ILE -6.02 3.82 1 88 GLU -0.42 -0.71 1 91 GLU -1.36 1.86 1 92 TYR -2.39 0.78 1 94 GLU 0.07 0.87 1 95 VAL -5.89 3.27 1 96 ILE -1.68 1.77 1 97 GLN -5.08 3.98 1 98 LEU -1.00 -1.27 1 99 GLN 1.09 0.43 1 101 ASP -0.15 -1.65 1 102 GLN -2.24 -0.98 1 103 ARG 4.96 0.18 1 104 LYS 4.77 -1.21 1 105 ASN 4.09 -1.74 1 106 ILE 1.67 -1.52 1 108 GLN 4.05 -0.67 1 109 PHE 1.93 1.71 1 110 LEU 3.41 -0.59 1 111 VAL 2.66 -0.30 1 112 GLU 3.74 -0.40 1 113 ILE 1.77 -1.08 1 115 LEU 0.73 1.46 1 116 ALA -6.95 4.29 1 117 LYS -3.00 1.33 1 118 ASP 3.85 0.09 1 119 ASP 1.92 -0.96 1 120 GLN -1.60 1.99 1 121 LEU -0.83 -0.09 1 122 LYS -2.12 -0.41 1 123 VAL 0.04 -0.64 1 124 HIS -1.96 2.14 1 126 PHE 0.95 0.77 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4255_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 0.79 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 PHE 4.31 -1.28 0 11 THR -0.38 -0.02 1 12 ASP -0.10 0.00 1 14 MET 1.01 0.01 1 15 SER 0.65 -0.06 1 16 ALA 0.27 0.03 1 17 ILE 0.70 -0.03 1 18 GLN 0.47 -0.02 1 19 ASN 0.14 0.00 1 20 LEU 0.51 -0.04 1 21 HIS 0.21 0.00 1 22 SER -0.06 -0.03 1 23 PHE -0.40 0.02 1 24 ASP -2.07 -0.04 1 26 PHE 0.61 0.01 1 27 ALA 0.13 -0.07 1 28 ASP -0.14 -0.01 1 29 ALA 0.15 0.06 1 30 SER 0.35 -0.03 1 31 LYS 0.20 0.07 1 33 ASP -0.11 0.01 1 34 ASP 0.20 -0.01 1 35 LEU -0.04 0.01 1 36 LEU -0.29 -0.03 1 38 ALA -0.28 0.05 1 40 THR 0.23 -0.07 1 41 GLU -0.48 -0.03 1 42 ASP -0.67 0.04 1 43 TYR -1.61 0.31 1 44 ILE -1.61 0.39 1 45 HIS -3.77 0.60 1 46 ILE -1.58 0.87 1 47 ARG -4.11 0.62 1 48 ILE -5.25 1.23 1 49 GLN -4.17 0.44 1 50 GLN -2.01 0.53 1 51 ARG -2.36 0.22 1 52 ASN 1.97 -0.21 1 54 ARG -1.67 0.22 1 55 LYS -0.08 0.17 1 56 THR 1.14 0.40 1 57 LEU -5.27 0.99 1 58 THR -1.13 1.05 1 59 THR -3.54 1.21 1 60 VAL -1.67 0.62 1 61 GLN -4.17 0.51 1 63 ILE 2.49 -0.28 1 64 ALA 0.07 0.03 1 65 ASP 2.54 -0.13 1 66 ASP 1.21 -0.26 1 67 TYR -0.93 -0.09 1 68 ASP -0.59 0.10 1 69 LYS 3.94 -0.38 1 70 LYS 5.36 -0.34 1 71 LYS 3.67 -0.25 1 72 LEU 3.46 -0.04 1 73 VAL 6.26 -0.57 1 74 LYS 4.44 -0.25 1 75 ALA 2.95 -0.04 1 77 LYS 4.06 -0.19 1 78 LYS 2.77 -0.24 1 79 LYS 2.06 -0.38 1 80 PHE 0.53 -0.18 1 81 ALA 2.99 -0.10 1 83 ASN -1.42 0.26 1 85 THR -2.04 0.43 1 86 VAL -0.66 0.76 1 87 ILE -6.02 0.61 1 88 GLU -0.42 0.14 1 89 HIS -3.60 -0.26 1 91 GLU -1.36 0.14 1 92 TYR -2.39 0.17 1 94 GLU 0.07 0.56 1 95 VAL -5.89 0.74 1 96 ILE -1.68 0.41 1 97 GLN -5.08 1.02 1 98 LEU -1.00 0.79 1 99 GLN 1.09 0.03 1 101 ASP -0.15 -0.21 1 102 GLN -2.24 0.64 1 103 ARG 4.96 -0.75 1 104 LYS 4.77 -0.30 1 105 ASN 4.09 -0.49 1 106 ILE 1.67 0.08 1 108 GLN 4.05 -0.30 1 109 PHE 1.93 -0.01 1 110 LEU 3.41 -0.49 1 111 VAL 2.66 0.26 1 112 GLU 3.74 -0.28 1 113 ILE 1.77 0.17 1 115 LEU 0.73 -0.22 1 116 ALA -6.95 0.41 1 117 LYS -3.00 0.31 1 118 ASP 3.85 -0.50 1 119 ASP 1.92 -0.14 1 120 GLN -1.60 0.05 1 121 LEU -0.83 0.26 1 122 LYS -2.12 0.08 1 123 VAL 0.04 0.37 1 124 HIS -1.96 0.01 1 126 PHE 0.95 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4255_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -2.82 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 2.20 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 PHE 0.95 5.01 0 11 THR -0.38 -0.97 1 12 ASP -0.10 -0.13 1 14 MET 1.01 0.67 1 15 SER 0.65 -0.01 1 16 ALA 0.27 0.23 1 17 ILE 0.70 0.10 1 18 GLN 0.47 -0.25 1 19 ASN 0.14 -0.06 1 20 LEU 0.51 -0.36 1 21 HIS 0.21 0.55 1 22 SER -0.06 -0.77 1 23 PHE -0.40 -1.36 1 24 ASP -2.07 -0.36 1 26 PHE 0.61 0.10 1 27 ALA 0.13 -0.22 1 28 ASP -0.14 0.00 1 29 ALA 0.15 0.23 1 30 SER 0.35 0.16 1 31 LYS 0.20 0.40 1 33 ASP -0.11 -0.27 1 34 ASP 0.20 -0.40 1 35 LEU -0.04 -0.61 1 36 LEU -0.29 -0.63 1 38 ALA -0.28 0.57 1 40 THR 0.23 -0.04 1 41 GLU -0.48 -1.05 1 42 ASP -0.67 -0.74 1 43 TYR -1.61 -0.65 1 44 ILE -1.61 -1.33 1 45 HIS -3.77 0.99 1 46 ILE -1.58 -2.07 1 47 ARG -4.11 -1.69 1 48 ILE -5.25 -1.82 1 49 GLN -4.17 -1.82 1 50 GLN -2.01 -0.81 1 51 ARG -2.36 -0.74 1 52 ASN 1.97 0.52 1 54 ARG -1.67 -0.64 1 55 LYS -0.08 -0.39 1 56 THR 1.14 -1.22 1 57 LEU -5.27 -1.29 1 58 THR -1.13 -0.94 1 59 THR -3.54 -0.62 1 60 VAL -1.67 -1.97 1 61 GLN -4.17 -1.36 1 63 ILE 2.49 -0.33 1 64 ALA 0.07 0.07 1 65 ASP 2.54 -0.18 1 66 ASP 1.21 -0.46 1 67 TYR -0.93 -0.91 1 68 ASP -0.59 0.70 1 69 LYS 3.94 1.43 1 70 LYS 5.36 3.35 1 71 LYS 3.67 3.10 1 72 LEU 3.46 0.88 1 73 VAL 6.26 1.01 1 74 LYS 4.44 2.32 1 75 ALA 2.95 2.35 1 76 PHE 4.31 1.21 1 77 LYS 4.06 2.77 1 78 LYS 2.77 1.30 1 79 LYS 2.06 0.78 1 80 PHE 0.53 -1.12 1 81 ALA 2.99 -2.32 1 83 ASN -1.42 -0.42 1 85 THR -2.04 -3.04 1 86 VAL -0.66 -0.70 1 87 ILE -6.02 -2.54 1 88 GLU -0.42 -1.94 1 89 HIS -3.60 2.48 1 91 GLU -1.36 1.66 1 92 TYR -2.39 0.18 1 94 GLU 0.07 0.12 1 95 VAL -5.89 -1.28 1 96 ILE -1.68 -2.12 1 97 GLN -5.08 -2.12 1 98 LEU -1.00 -2.77 1 99 GLN 1.09 0.24 1 101 ASP -0.15 -1.38 1 102 GLN -2.24 0.60 1 103 ARG 4.96 0.49 1 104 LYS 4.77 2.55 1 105 ASN 4.09 2.54 1 106 ILE 1.67 0.17 1 108 GLN 4.05 2.38 1 109 PHE 1.93 0.66 1 110 LEU 3.41 1.07 1 111 VAL 2.66 4.08 1 112 GLU 3.74 2.60 1 113 ILE 1.77 0.39 1 115 LEU 0.73 -2.00 1 116 ALA -6.95 -1.87 1 117 LYS -3.00 1.29 1 118 ASP 3.85 1.57 1 119 ASP 1.92 0.35 1 120 GLN -1.60 -1.19 1 121 LEU -0.83 -1.75 1 122 LYS -2.12 -2.62 1 123 VAL 0.04 -0.50 1 124 HIS -1.96 0.71 1 stop_ save_