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 bmr18636_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 -2.84 _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 -1.94 _LACS_plot.Line_2_terminator_val_x_2 8.66 _LACS_plot.Line_2_terminator_val_y_2 6.30 _LACS_plot.Y_axis_chem_shift_offset 0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 74 TYR 8.67 3.15 0 49 HIS -8.85 -1.62 0 10 VAL -2.77 -1.43 1 11 GLU -4.73 -2.50 1 12 SER -5.62 -2.35 1 13 ASN -1.76 -0.93 1 14 ASP 2.44 1.82 1 15 ASN -1.12 -1.19 1 16 MET 3.50 1.25 1 17 GLN -4.11 -1.53 1 18 PHE -4.09 -2.10 1 19 ASN 0.85 -0.10 1 20 THR -2.10 -2.32 1 21 LYS -0.98 -0.30 1 22 ASP -2.50 -0.30 1 23 ILE -1.90 -0.52 1 24 GLN 0.30 -1.04 1 25 VAL -2.06 -1.91 1 26 SER -0.71 -1.12 1 27 LYS 2.31 1.93 1 28 ALA 0.63 0.16 1 30 LYS 2.83 1.79 1 31 GLU -5.05 -1.92 1 32 PHE -6.62 -1.50 1 33 THR -1.06 -0.27 1 34 ILE -2.66 -1.39 1 35 THR -0.48 0.08 1 36 LEU -5.04 -2.19 1 37 LYS -4.35 -1.78 1 38 HIS -3.29 -1.23 1 39 THR 1.07 -0.48 1 41 THR -1.79 -1.27 1 42 GLN 0.72 1.11 1 44 LYS 3.38 1.81 1 45 ALA 1.65 1.37 1 46 SER -0.62 0.19 1 47 MET -1.15 -2.64 1 50 ASN -3.86 -1.76 1 51 LEU -1.04 1.62 1 52 VAL -3.11 -1.55 1 53 ILE -3.08 -1.81 1 54 ALA -5.31 -1.23 1 55 LYS 2.14 1.58 1 56 ALA 4.49 3.39 1 57 GLU 2.85 1.31 1 58 ASP -1.29 0.33 1 59 MET 4.43 2.22 1 60 ASP 4.60 3.74 1 62 VAL 6.61 4.61 1 63 PHE 2.37 0.83 1 64 LYS 4.04 3.26 1 65 ASP 2.42 1.86 1 67 VAL 5.24 4.01 1 69 ALA -0.90 -2.44 1 70 ALA 2.52 2.54 1 71 ASP 2.00 0.81 1 72 THR -0.97 -2.75 1 73 ASP 5.16 2.55 1 75 VAL -3.27 -1.05 1 76 LYS 0.94 0.81 1 78 ASP 2.21 0.38 1 79 ASP 0.12 0.18 1 80 ALA 1.95 1.27 1 81 ARG 0.35 0.27 1 82 VAL 0.96 -0.23 1 83 VAL 2.42 2.39 1 84 ALA -5.82 -1.29 1 85 HIS -4.05 -0.09 1 86 THR -2.03 -0.73 1 87 LYS 0.40 -0.30 1 88 LEU -1.59 -0.43 1 89 ILE -5.01 -1.26 1 93 GLU -4.14 -1.54 1 94 GLU -6.41 -2.05 1 95 SER -1.69 -0.71 1 96 SER -4.12 -1.17 1 97 LEU -4.24 -1.94 1 98 THR -2.69 -0.96 1 99 LEU -5.03 -2.15 1 100 ASP -3.58 -2.46 1 102 ALA 2.97 1.86 1 103 LYS 1.68 0.42 1 104 LEU -0.25 -1.98 1 105 ALA 1.09 1.23 1 106 ASP 0.10 -0.38 1 108 ASP -1.34 -1.22 1 109 TYR -0.11 1.81 1 110 LYS -6.42 -2.00 1 111 PHE -6.87 -3.64 1 112 ALA -4.59 -0.21 1 114 THR 1.80 0.06 1 115 PHE 1.78 1.90 1 118 HIS -1.05 2.47 1 120 ALA 3.52 2.03 1 121 LEU -1.59 0.14 1 122 MET 0.47 -0.41 1 123 ASN -3.79 -0.33 1 125 LYS -2.65 -0.43 1 126 VAL -0.50 -0.99 1 127 THR -1.13 -0.44 1 128 LEU -1.47 -1.10 1 129 VAL -5.00 -3.37 1 130 ASP 3.43 3.49 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18636_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 6.01 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 8.66 _LACS_plot.Line_2_terminator_val_y_2 -2.36 _LACS_plot.Y_axis_chem_shift_offset 0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 74 TYR 8.67 -5.52 0 49 HIS -8.85 7.23 0 10 VAL -2.77 1.34 1 11 GLU -4.73 2.23 1 12 SER -5.62 3.27 1 13 ASN -1.76 0.83 1 14 ASP 2.44 -0.62 1 15 ASN -1.12 -0.07 1 16 MET 3.50 -2.25 1 17 GLN -4.11 2.58 1 18 PHE -4.09 1.99 1 19 ASN 0.85 -0.95 1 20 THR -2.10 -0.22 1 21 LYS -0.98 0.68 1 22 ASP -2.50 2.20 1 23 ILE -1.90 1.38 1 24 GLN 0.30 -1.34 1 25 VAL -2.06 0.15 1 26 SER -0.71 -0.41 1 27 LYS 2.31 -0.38 1 28 ALA 0.63 -0.47 1 30 LYS 2.83 -1.04 1 31 GLU -5.05 3.13 1 32 PHE -6.62 5.12 1 33 THR -1.06 0.79 1 34 ILE -2.66 1.27 1 35 THR -0.48 0.56 1 36 LEU -5.04 2.85 1 37 LYS -4.35 2.57 1 38 HIS -3.29 2.06 1 39 THR 1.07 -1.55 1 41 THR -1.79 0.52 1 42 GLN 0.72 0.39 1 44 LYS 3.38 -1.57 1 45 ALA 1.65 -0.28 1 46 SER -0.62 0.81 1 47 MET -1.15 -1.49 1 50 ASN -3.86 2.10 1 51 LEU -1.04 2.66 1 52 VAL -3.11 1.56 1 53 ILE -3.08 1.27 1 54 ALA -5.31 4.08 1 55 LYS 2.14 -0.56 1 56 ALA 4.49 -1.10 1 57 GLU 2.85 -1.54 1 58 ASP -1.29 1.62 1 59 MET 4.43 -2.21 1 60 ASP 4.60 -0.86 1 62 VAL 6.61 -2.00 1 63 PHE 2.37 -1.54 1 64 LYS 4.04 -0.78 1 65 ASP 2.42 -0.56 1 67 VAL 5.24 -1.23 1 69 ALA -0.90 -1.54 1 70 ALA 2.52 0.02 1 71 ASP 2.00 -1.19 1 72 THR -0.97 -1.78 1 73 ASP 5.16 -2.61 1 75 VAL -3.27 2.22 1 76 LYS 0.94 -0.13 1 78 ASP 2.21 -1.83 1 79 ASP 0.12 0.06 1 80 ALA 1.95 -0.68 1 81 ARG 0.35 -0.08 1 82 VAL 0.96 -1.19 1 83 VAL 2.42 -0.03 1 84 ALA -5.82 4.53 1 85 HIS -4.05 3.96 1 86 THR -2.03 1.30 1 87 LYS 0.40 -0.70 1 88 LEU -1.59 1.16 1 89 ILE -5.01 3.75 1 93 GLU -4.14 2.60 1 94 GLU -6.41 4.36 1 95 SER -1.69 0.98 1 96 SER -4.12 2.95 1 97 LEU -4.24 2.30 1 98 THR -2.69 1.73 1 99 LEU -5.03 2.88 1 100 ASP -3.58 1.12 1 102 ALA 2.97 -1.11 1 103 LYS 1.68 -1.26 1 104 LEU -0.25 -1.73 1 105 ALA 1.09 0.14 1 106 ASP 0.10 -0.48 1 108 ASP -1.34 0.12 1 109 TYR -0.11 1.92 1 110 LYS -6.42 4.42 1 111 PHE -6.87 3.23 1 112 ALA -4.59 4.38 1 114 THR 1.80 -1.74 1 115 PHE 1.78 0.12 1 118 HIS -1.05 3.52 1 120 ALA 3.52 -1.49 1 121 LEU -1.59 1.73 1 122 MET 0.47 -0.88 1 123 ASN -3.79 3.46 1 125 LYS -2.65 2.22 1 126 VAL -0.50 -0.49 1 127 THR -1.13 0.69 1 128 LEU -1.47 0.37 1 129 VAL -5.00 1.63 1 130 ASP 3.43 0.06 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18636_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 1.13 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.33 _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 8.66 _LACS_plot.Line_2_terminator_val_y_2 -1.13 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 70 ALA 2.52 -2.25 0 10 VAL -2.77 -0.12 1 11 GLU -4.73 0.86 1 12 SER -5.62 0.73 1 13 ASN -1.76 0.04 1 14 ASP 2.44 0.22 1 15 ASN -1.12 -0.04 1 16 MET 3.50 -0.99 1 17 GLN -4.11 -0.01 1 18 PHE -4.09 1.07 1 19 ASN 0.85 -0.18 1 20 THR -2.10 0.20 1 21 LYS -0.98 0.30 1 22 ASP -2.50 0.85 1 23 ILE -1.90 -0.29 1 24 GLN 0.30 0.35 1 25 VAL -2.06 -1.41 1 26 SER -0.71 -0.19 1 27 LYS 2.31 -0.66 1 28 ALA 0.63 -0.27 1 30 LYS 2.83 -0.35 1 31 GLU -5.05 0.13 1 32 PHE -6.62 0.43 1 33 THR -1.06 0.75 1 34 ILE -2.66 0.51 1 35 THR -0.48 0.15 1 36 LEU -5.04 0.78 1 37 LYS -4.35 0.44 1 38 HIS -3.29 0.50 1 39 THR 1.07 0.13 1 41 THR -1.79 -0.10 1 42 GLN 0.72 -0.45 1 44 LYS 3.38 -0.86 1 45 ALA 1.65 -0.21 1 46 SER -0.62 0.10 1 47 MET -1.15 -0.44 1 49 HIS -8.85 1.93 1 50 ASN -3.86 -0.36 1 51 LEU -1.04 0.38 1 52 VAL -3.11 0.37 1 53 ILE -3.08 1.07 1 54 ALA -5.31 0.50 1 55 LYS 2.14 -0.77 1 56 ALA 4.49 -0.81 1 57 GLU 2.85 -0.29 1 58 ASP -1.29 0.04 1 59 MET 4.43 -0.90 1 60 ASP 4.60 -0.39 1 62 VAL 6.61 -0.72 1 63 PHE 2.37 -0.24 1 64 LYS 4.04 -0.40 1 65 ASP 2.42 -0.10 1 67 VAL 5.24 -0.52 1 69 ALA -0.90 0.34 1 71 ASP 2.00 -0.36 1 72 THR -0.97 0.04 1 73 ASP 5.16 -0.70 1 74 TYR 8.67 -1.17 1 75 VAL -3.27 -0.22 1 76 LYS 0.94 -0.65 1 78 ASP 2.21 -0.48 1 79 ASP 0.12 -0.52 1 80 ALA 1.95 -0.25 1 81 ARG 0.35 -0.40 1 82 VAL 0.96 -0.06 1 83 VAL 2.42 -0.46 1 84 ALA -5.82 0.23 1 85 HIS -4.05 0.90 1 86 THR -2.03 0.00 1 87 LYS 0.40 -0.02 1 88 LEU -1.59 0.31 1 89 ILE -5.01 0.45 1 93 GLU -4.14 0.24 1 94 GLU -6.41 1.09 1 95 SER -1.69 0.12 1 96 SER -4.12 1.30 1 97 LEU -4.24 0.30 1 98 THR -2.69 0.67 1 99 LEU -5.03 0.30 1 100 ASP -3.58 0.00 1 102 ALA 2.97 -0.41 1 103 LYS 1.68 -0.36 1 104 LEU -0.25 -0.45 1 105 ALA 1.09 -0.34 1 106 ASP 0.10 -0.07 1 108 ASP -1.34 0.24 1 109 TYR -0.11 -0.13 1 110 LYS -6.42 0.70 1 111 PHE -6.87 1.53 1 112 ALA -4.59 0.83 1 114 THR 1.80 0.05 1 115 PHE 1.78 -1.65 1 118 HIS -1.05 -0.08 1 120 ALA 3.52 -0.39 1 121 LEU -1.59 0.07 1 122 MET 0.47 -0.22 1 123 ASN -3.79 0.65 1 125 LYS -2.65 0.38 1 126 VAL -0.50 0.53 1 127 THR -1.13 0.02 1 128 LEU -1.47 0.58 1 129 VAL -5.00 0.38 1 130 ASP 3.43 -0.58 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18636_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 -3.36 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.22 _LACS_plot.Line_2_terminator_val_x_2 8.66 _LACS_plot.Line_2_terminator_val_y_2 2.80 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 ASP 3.43 5.42 0 74 TYR 8.67 -0.84 0 118 HIS -1.05 5.19 0 73 ASP 5.16 -3.94 0 49 HIS -8.85 1.46 0 10 VAL -2.77 -2.94 1 11 GLU -4.73 -1.38 1 12 SER -5.62 -1.85 1 13 ASN -1.76 0.99 1 14 ASP 2.44 -1.20 1 15 ASN -1.12 -1.22 1 16 MET 3.50 -3.97 1 17 GLN -4.11 1.20 1 18 PHE -4.09 1.50 1 19 ASN 0.85 -1.14 1 20 THR -2.10 -2.82 1 21 LYS -0.98 -0.79 1 22 ASP -2.50 -1.88 1 23 ILE -1.90 -2.39 1 24 GLN 0.30 -1.02 1 25 VAL -2.06 -2.20 1 26 SER -0.71 1.30 1 27 LYS 2.31 -0.29 1 28 ALA 0.63 0.66 1 30 LYS 2.83 -0.21 1 31 GLU -5.05 -3.08 1 32 PHE -6.62 -1.62 1 33 THR -1.06 -1.41 1 34 ILE -2.66 -1.89 1 35 THR -0.48 -3.03 1 36 LEU -5.04 -3.38 1 37 LYS -4.35 -1.49 1 38 HIS -3.29 3.71 1 39 THR 1.07 1.77 1 41 THR -1.79 1.76 1 42 GLN 0.72 -1.51 1 44 LYS 3.38 -0.85 1 45 ALA 1.65 0.50 1 46 SER -0.62 -0.64 1 47 MET -1.15 -4.49 1 50 ASN -3.86 -3.84 1 51 LEU -1.04 -1.67 1 52 VAL -3.11 -1.72 1 53 ILE -3.08 -2.03 1 54 ALA -5.31 -2.60 1 55 LYS 2.14 2.05 1 56 ALA 4.49 2.80 1 57 GLU 2.85 -0.47 1 58 ASP -1.29 0.34 1 59 MET 4.43 -0.54 1 60 ASP 4.60 2.74 1 62 VAL 6.61 3.80 1 63 PHE 2.37 3.50 1 64 LYS 4.04 2.99 1 65 ASP 2.42 1.45 1 67 VAL 5.24 0.58 1 69 ALA -0.90 0.11 1 70 ALA 2.52 0.59 1 71 ASP 2.00 0.60 1 72 THR -0.97 -0.09 1 75 VAL -3.27 -0.59 1 76 LYS 0.94 -0.36 1 78 ASP 2.21 -0.89 1 79 ASP 0.12 1.66 1 80 ALA 1.95 0.91 1 81 ARG 0.35 0.64 1 82 VAL 0.96 -0.59 1 83 VAL 2.42 0.02 1 84 ALA -5.82 -3.27 1 85 HIS -4.05 -0.54 1 86 THR -2.03 1.01 1 87 LYS 0.40 -0.25 1 88 LEU -1.59 -0.81 1 89 ILE -5.01 -1.97 1 93 GLU -4.14 -2.18 1 94 GLU -6.41 -1.34 1 95 SER -1.69 -1.85 1 96 SER -4.12 -2.38 1 97 LEU -4.24 -2.96 1 98 THR -2.69 -2.21 1 99 LEU -5.03 -3.59 1 100 ASP -3.58 0.57 1 102 ALA 2.97 2.93 1 103 LYS 1.68 -0.38 1 104 LEU -0.25 -1.43 1 105 ALA 1.09 -0.26 1 106 ASP 0.10 -0.81 1 108 ASP -1.34 -1.04 1 109 TYR -0.11 -0.63 1 110 LYS -6.42 -2.74 1 111 PHE -6.87 -1.62 1 112 ALA -4.59 -3.49 1 114 THR 1.80 -0.66 1 115 PHE 1.78 2.04 1 120 ALA 3.52 0.64 1 121 LEU -1.59 0.57 1 122 MET 0.47 -3.42 1 123 ASN -3.79 -1.83 1 125 LYS -2.65 -2.12 1 126 VAL -0.50 -1.49 1 127 THR -1.13 -1.71 1 128 LEU -1.47 -0.95 1 129 VAL -5.00 -1.95 1 stop_ save_