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 bmr25923_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 -2.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.63 _LACS_plot.Line_2_terminator_val_y_2 5.04 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 ILE 1.34 -2.91 0 94 HIS 4.78 7.05 0 10 LEU -2.94 -1.26 1 11 THR -0.25 0.43 1 12 HIS -6.39 -0.80 1 13 VAL -1.41 -0.88 1 15 GLU 2.97 0.72 1 17 PHE -0.35 0.03 1 18 VAL 1.00 -0.11 1 19 ILE -4.28 -2.00 1 21 GLU -6.48 -2.41 1 23 ALA -1.04 -0.05 1 24 GLU -3.05 -1.66 1 28 VAL 0.84 0.27 1 30 ARG -0.02 0.24 1 31 SER 0.08 0.30 1 32 SER 0.45 0.54 1 33 LEU 0.69 0.54 1 34 LEU 0.34 0.11 1 35 VAL 0.39 0.07 1 37 ASN 0.10 0.14 1 38 LEU -0.34 -0.39 1 39 LYS 0.49 0.27 1 41 ASP -0.08 0.16 1 42 LYS 0.47 0.16 1 43 ARG 0.41 0.24 1 44 ILE -0.18 -0.20 1 45 ILE -0.81 -0.61 1 46 THR -0.99 -0.35 1 47 ASP 1.61 1.69 1 48 ASP -0.07 -0.14 1 49 GLU -0.10 0.68 1 50 ILE -2.13 -2.07 1 51 ILE -3.43 -1.88 1 52 SER -3.06 -2.32 1 53 LEU -5.78 -0.82 1 54 SER -5.78 -1.78 1 55 ILE -5.00 -2.72 1 56 GLU -6.62 -2.48 1 57 PHE -0.99 -0.74 1 58 PHE -1.43 -0.52 1 59 ASP -2.11 -1.41 1 60 GLN 1.64 1.31 1 61 ASN 1.05 0.89 1 62 ARG 1.33 0.77 1 63 LEU 0.90 0.63 1 64 ASP 0.42 0.34 1 65 ARG 0.74 0.34 1 66 LYS 0.86 0.45 1 67 VAL 0.33 0.20 1 68 ASN -0.04 0.13 1 69 LYS 0.97 0.67 1 70 ASP 0.59 0.63 1 71 LYS 0.97 0.68 1 72 GLU 0.23 0.32 1 73 LYS 0.60 0.38 1 74 SER 0.09 0.31 1 75 LYS 0.75 0.54 1 76 GLU -0.09 0.17 1 77 GLU -0.55 -0.11 1 78 VAL 0.38 0.25 1 79 ASN -0.35 0.05 1 80 ASP 0.01 0.53 1 81 LYS -1.27 0.13 1 83 TYR -0.90 -0.04 1 84 LEU -6.99 -2.40 1 85 ARG -0.15 1.24 1 88 ALA 2.21 2.17 1 89 ALA -0.38 -0.30 1 90 MET 1.05 1.64 1 91 THR -5.46 -1.35 1 92 VAL 6.63 4.73 1 95 LEU 3.01 2.56 1 96 ARG 6.08 5.00 1 98 PHE 4.42 3.18 1 99 LEU 3.90 2.25 1 100 ARG 5.41 4.10 1 101 SER 2.71 2.27 1 102 LYS 1.82 0.27 1 103 MET -1.06 -0.41 1 104 ASP 1.69 0.10 1 105 ILE -3.54 -3.43 1 107 ASN 3.42 2.44 1 108 THR 1.78 0.56 1 109 PHE -2.32 -1.09 1 110 GLN -3.84 -1.55 1 112 ASP -3.29 -1.21 1 113 VAL -0.14 -0.39 1 122 ASP 1.88 2.88 1 123 TYR -0.98 -2.47 1 124 TYR -0.50 -2.21 1 125 THR -3.60 -1.66 1 126 LEU 4.36 3.13 1 127 MET 2.99 2.95 1 128 ASP 4.46 3.82 1 129 ILE 5.18 3.83 1 130 ALA 2.94 2.61 1 131 TYR 2.81 2.71 1 132 ILE 4.15 3.96 1 133 TYR 3.14 0.70 1 134 THR 2.01 0.29 1 135 TRP 0.16 -0.26 1 138 ASN 1.26 0.14 1 143 LEU -5.01 -2.43 1 145 TYR -5.19 -2.15 1 147 VAL -2.74 -1.87 1 150 THR 0.69 0.75 1 152 LYS 0.13 0.22 1 153 ARG 0.11 0.15 1 154 MET 0.06 0.18 1 155 LYS 1.30 1.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25923_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 4.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.63 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 ILE 1.34 -4.25 0 94 HIS 4.78 2.27 0 10 LEU -2.94 1.68 1 11 THR -0.25 0.68 1 12 HIS -6.39 5.59 1 13 VAL -1.41 0.53 1 15 GLU 2.97 -2.25 1 17 PHE -0.35 0.38 1 18 VAL 1.00 -1.11 1 19 ILE -4.28 2.28 1 21 GLU -6.48 4.07 1 23 ALA -1.04 0.99 1 24 GLU -3.05 1.39 1 28 VAL 0.84 -0.57 1 30 ARG -0.02 0.26 1 31 SER 0.08 0.22 1 32 SER 0.45 0.09 1 33 LEU 0.69 -0.15 1 34 LEU 0.34 -0.23 1 35 VAL 0.39 -0.32 1 37 ASN 0.10 0.04 1 38 LEU -0.34 -0.05 1 39 LYS 0.49 -0.22 1 41 ASP -0.08 0.24 1 42 LYS 0.47 -0.31 1 43 ARG 0.41 -0.17 1 44 ILE -0.18 -0.02 1 45 ILE -0.81 0.20 1 46 THR -0.99 0.64 1 47 ASP 1.61 0.08 1 48 ASP -0.07 -0.07 1 49 GLU -0.10 0.78 1 50 ILE -2.13 0.06 1 51 ILE -3.43 1.55 1 52 SER -3.06 0.74 1 53 LEU -5.78 4.96 1 54 SER -5.78 4.00 1 55 ILE -5.00 2.28 1 56 GLU -6.62 4.14 1 57 PHE -0.99 0.25 1 58 PHE -1.43 0.91 1 59 ASP -2.11 0.70 1 60 GLN 1.64 -0.33 1 61 ASN 1.05 -0.16 1 62 ARG 1.33 -0.56 1 63 LEU 0.90 -0.27 1 64 ASP 0.42 -0.08 1 65 ARG 0.74 -0.40 1 66 LYS 0.86 -0.41 1 67 VAL 0.33 -0.13 1 68 ASN -0.04 0.17 1 69 LYS 0.97 -0.30 1 70 ASP 0.59 0.04 1 71 LYS 0.97 -0.29 1 72 GLU 0.23 0.09 1 73 LYS 0.60 -0.22 1 74 SER 0.09 0.22 1 75 LYS 0.75 -0.21 1 76 GLU -0.09 0.26 1 77 GLU -0.55 0.44 1 78 VAL 0.38 -0.13 1 79 ASN -0.35 0.40 1 80 ASP 0.01 0.52 1 81 LYS -1.27 1.40 1 83 TYR -0.90 0.86 1 84 LEU -6.99 4.59 1 85 ARG -0.15 1.39 1 88 ALA 2.21 -0.04 1 89 ALA -0.38 0.08 1 90 MET 1.05 0.59 1 91 THR -5.46 4.11 1 92 VAL 6.63 -1.90 1 95 LEU 3.01 -0.45 1 96 ARG 6.08 -1.08 1 98 PHE 4.42 -1.24 1 99 LEU 3.90 -1.65 1 100 ARG 5.41 -1.31 1 101 SER 2.71 -0.44 1 102 LYS 1.82 -1.55 1 103 MET -1.06 0.65 1 104 ASP 1.69 -1.59 1 105 ILE -3.54 0.11 1 107 ASN 3.42 -0.98 1 108 THR 1.78 -1.22 1 109 PHE -2.32 1.23 1 110 GLN -3.84 2.29 1 112 ASP -3.29 2.08 1 113 VAL -0.14 -0.25 1 122 ASP 1.88 1.00 1 123 TYR -0.98 -1.49 1 124 TYR -0.50 -1.71 1 125 THR -3.60 1.94 1 126 LEU 4.36 -1.23 1 127 MET 2.99 -0.04 1 128 ASP 4.46 -0.64 1 129 ILE 5.18 -1.35 1 130 ALA 2.94 -0.33 1 131 TYR 2.81 -0.10 1 132 ILE 4.15 -0.19 1 133 TYR 3.14 -2.44 1 134 THR 2.01 -1.72 1 135 TRP 0.16 -0.42 1 138 ASN 1.26 -1.12 1 143 LEU -5.01 2.58 1 145 TYR -5.19 3.04 1 147 VAL -2.74 0.87 1 150 THR 0.69 0.06 1 152 LYS 0.13 0.09 1 153 ARG 0.11 0.04 1 154 MET 0.06 0.12 1 155 LYS 1.30 0.50 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25923_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 0.84 _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 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.63 _LACS_plot.Line_2_terminator_val_y_2 -0.79 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 84 LEU -6.99 1.66 0 90 MET 1.05 -1.35 0 10 LEU -2.94 0.34 1 11 THR -0.25 0.65 1 12 HIS -6.39 0.28 1 13 VAL -1.41 0.92 1 14 ILE 1.34 0.39 1 17 PHE -0.35 0.02 1 18 VAL 1.00 0.45 1 19 ILE -4.28 0.52 1 21 GLU -6.48 0.37 1 23 ALA -1.04 0.37 1 24 GLU -3.05 -0.30 1 28 VAL 0.84 0.08 1 30 ARG -0.02 0.03 1 31 SER 0.08 0.02 1 32 SER 0.45 -0.04 1 33 LEU 0.69 -0.01 1 34 LEU 0.34 -0.07 1 35 VAL 0.39 -0.02 1 37 ASN 0.10 -0.01 1 38 LEU -0.34 0.00 1 39 LYS 0.49 0.00 1 41 ASP -0.08 -0.06 1 42 LYS 0.47 0.01 1 43 ARG 0.41 -0.01 1 44 ILE -0.18 0.01 1 45 ILE -0.81 0.18 1 46 THR -0.99 0.20 1 48 ASP -0.07 0.02 1 49 GLU -0.10 -0.07 1 50 ILE -2.13 0.31 1 51 ILE -3.43 0.33 1 52 SER -3.06 0.70 1 53 LEU -5.78 1.14 1 54 SER -5.78 0.93 1 55 ILE -5.00 0.89 1 56 GLU -6.62 0.39 1 57 PHE -0.99 -0.69 1 58 PHE -1.43 -0.36 1 59 ASP -2.11 -0.47 1 60 GLN 1.64 -0.43 1 61 ASN 1.05 -0.07 1 62 ARG 1.33 -0.13 1 63 LEU 0.90 -0.10 1 64 ASP 0.42 -0.09 1 65 ARG 0.74 -0.04 1 66 LYS 0.86 -0.01 1 67 VAL 0.33 -0.01 1 68 ASN -0.04 -0.02 1 69 LYS 0.97 0.03 1 70 ASP 0.59 -0.06 1 71 LYS 0.97 -0.07 1 72 GLU 0.23 -0.08 1 73 LYS 0.60 0.00 1 74 SER 0.09 -0.03 1 75 LYS 0.75 0.00 1 76 GLU -0.09 -0.06 1 77 GLU -0.55 -0.01 1 78 VAL 0.38 0.04 1 79 ASN -0.35 0.10 1 80 ASP 0.01 0.02 1 81 LYS -1.27 0.47 1 83 TYR -0.90 -0.42 1 85 ARG -0.15 0.40 1 88 ALA 2.21 -0.44 1 89 ALA -0.38 -0.40 1 92 VAL 6.63 -0.75 1 95 LEU 3.01 -0.37 1 96 ARG 6.08 -0.34 1 98 PHE 4.42 -0.06 1 99 LEU 3.90 -1.15 1 101 SER 2.71 -0.16 1 102 LYS 1.82 -0.30 1 103 MET -1.06 -0.11 1 104 ASP 1.69 -0.18 1 105 ILE -3.54 0.21 1 108 THR 1.78 0.16 1 109 PHE -2.32 0.46 1 110 GLN -3.84 0.28 1 112 ASP -3.29 0.39 1 113 VAL -0.14 0.59 1 123 TYR -0.98 0.13 1 124 TYR -0.50 -0.22 1 127 MET 2.99 -0.47 1 128 ASP 4.46 -0.52 1 129 ILE 5.18 -0.77 1 130 ALA 2.94 -0.22 1 131 TYR 2.81 -0.10 1 132 ILE 4.15 -0.87 1 133 TYR 3.14 -0.15 1 134 THR 2.01 -0.60 1 135 TRP 0.16 0.28 1 143 LEU -5.01 0.72 1 145 TYR -5.19 1.37 1 147 VAL -2.74 1.11 1 150 THR 0.69 -0.11 1 153 ARG 0.11 0.01 1 154 MET 0.06 0.01 1 155 LYS 1.30 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25923_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 -4.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.64 _LACS_plot.Line_2_terminator_val_x_2 6.63 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _LACS_plot.Y_axis_chem_shift_offset 3.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 THR -0.25 5.73 0 54 SER -5.78 4.66 0 52 SER -3.06 5.74 0 10 LEU -2.94 -4.38 1 12 HIS -6.39 -3.08 1 13 VAL -1.41 -2.96 1 14 ILE 1.34 -4.80 1 15 GLU 2.97 -3.93 1 17 PHE -0.35 -4.39 1 18 VAL 1.00 -3.60 1 19 ILE -4.28 -3.77 1 21 GLU -6.48 -4.55 1 23 ALA -1.04 -3.90 1 24 GLU -3.05 4.32 1 28 VAL 0.84 -2.11 1 30 ARG -0.02 -2.60 1 31 SER 0.08 -2.45 1 32 SER 0.45 -2.81 1 33 LEU 0.69 -3.24 1 34 LEU 0.34 -3.15 1 35 VAL 0.39 -2.57 1 37 ASN 0.10 -2.63 1 38 LEU -0.34 -3.01 1 39 LYS 0.49 -2.29 1 41 ASP -0.08 -2.77 1 42 LYS 0.47 -3.12 1 43 ARG 0.41 -3.03 1 44 ILE -0.18 -3.39 1 45 ILE -0.81 -3.27 1 46 THR -0.99 -2.50 1 47 ASP 1.61 -2.96 1 48 ASP -0.07 -2.90 1 49 GLU -0.10 -3.85 1 50 ILE -2.13 -3.66 1 51 ILE -3.43 -5.38 1 53 LEU -5.78 -3.45 1 55 ILE -5.00 -5.08 1 56 GLU -6.62 -5.57 1 57 PHE -0.99 -3.59 1 58 PHE -1.43 3.60 1 59 ASP -2.11 -3.32 1 60 GLN 1.64 -2.78 1 61 ASN 1.05 -2.47 1 62 ARG 1.33 -2.41 1 63 LEU 0.90 -3.06 1 64 ASP 0.42 -2.75 1 65 ARG 0.74 -2.74 1 66 LYS 0.86 -2.62 1 67 VAL 0.33 -3.26 1 68 ASN -0.04 -2.65 1 69 LYS 0.97 -2.95 1 70 ASP 0.59 -2.60 1 71 LYS 0.97 -2.52 1 72 GLU 0.23 -2.64 1 73 LYS 0.60 -2.56 1 74 SER 0.09 -2.67 1 75 LYS 0.75 -2.85 1 76 GLU -0.09 -2.93 1 77 GLU -0.55 -2.98 1 78 VAL 0.38 -3.33 1 79 ASN -0.35 -3.25 1 80 ASP 0.01 -3.64 1 81 LYS -1.27 -4.26 1 83 TYR -0.90 -3.89 1 84 LEU -6.99 -5.00 1 85 ARG -0.15 -0.94 1 88 ALA 2.21 -4.12 1 89 ALA -0.38 -3.98 1 90 MET 1.05 -4.37 1 91 THR -5.46 -0.24 1 92 VAL 6.63 -1.65 1 94 HIS 4.78 1.04 1 95 LEU 3.01 -1.89 1 96 ARG 6.08 -1.13 1 98 PHE 4.42 -2.50 1 99 LEU 3.90 -2.04 1 100 ARG 5.41 -0.90 1 101 SER 2.71 -1.21 1 102 LYS 1.82 -2.19 1 103 MET -1.06 -4.47 1 104 ASP 1.69 -4.13 1 105 ILE -3.54 -4.31 1 107 ASN 3.42 -2.53 1 108 THR 1.78 -3.18 1 109 PHE -2.32 -3.54 1 110 GLN -3.84 -4.46 1 112 ASP -3.29 -4.24 1 113 VAL -0.14 -4.59 1 122 ASP 1.88 -2.98 1 123 TYR -0.98 -2.03 1 124 TYR -0.50 -1.77 1 125 THR -3.60 -0.78 1 126 LEU 4.36 -1.54 1 127 MET 2.99 -1.41 1 128 ASP 4.46 -0.75 1 129 ILE 5.18 -2.23 1 130 ALA 2.94 -1.30 1 131 TYR 2.81 0.31 1 132 ILE 4.15 -1.54 1 133 TYR 3.14 -3.85 1 134 THR 2.01 -3.59 1 135 TRP 0.16 -1.30 1 138 ASN 1.26 -3.29 1 143 LEU -5.01 -3.20 1 145 TYR -5.19 2.95 1 147 VAL -2.74 1.58 1 150 THR 0.69 -3.01 1 152 LYS 0.13 -3.32 1 153 ARG 0.11 -2.98 1 154 MET 0.06 -3.95 1 155 LYS 1.30 1.57 1 stop_ save_