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 bmr10059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 -2.71 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 8.79 _LACS_plot.Line_2_terminator_val_y_2 7.03 _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 75 HIS 2.66 4.91 0 119 ILE 0.76 -2.01 0 10 ILE -0.33 -0.06 1 11 SER -0.42 -0.28 1 12 LEU 0.16 -0.19 1 13 GLU -1.26 -0.29 1 14 ILE 0.33 0.43 1 15 MET -4.02 -0.76 1 16 THR 0.81 0.59 1 17 LEU -5.80 -2.11 1 18 GLN -1.46 -0.68 1 20 ARG -4.17 -1.02 1 22 GLU -3.32 -1.44 1 23 ASP 3.26 1.36 1 24 VAL -0.55 -0.67 1 25 GLU -0.59 0.36 1 26 THR -0.47 0.08 1 27 ALA 3.76 3.03 1 28 GLU -0.59 -1.09 1 30 VAL 0.39 -0.14 1 31 ALA -0.90 -1.16 1 32 LEU -5.97 -1.48 1 33 THR -1.26 0.13 1 34 VAL -5.29 -2.06 1 35 THR -3.10 -1.93 1 37 VAL -2.67 -0.76 1 38 ALA -7.17 -2.91 1 39 GLN -2.42 -0.87 1 40 VAL -5.95 -4.00 1 41 LYS -5.10 -1.39 1 42 ILE 1.06 0.56 1 43 MET 0.28 1.40 1 44 THR -0.54 -0.02 1 45 GLU 2.07 1.92 1 46 LYS 3.39 2.59 1 48 LEU 2.40 1.53 1 49 LEU 1.97 1.55 1 50 ALA 1.65 1.43 1 51 VAL 1.30 1.02 1 52 ALA 1.10 0.89 1 54 GLU 2.20 1.92 1 55 GLN 2.57 1.80 1 56 PHE 0.15 -0.12 1 57 LEU 1.67 1.24 1 59 LYS -0.99 -0.56 1 60 ASN -1.00 -0.53 1 61 VAL 4.68 3.56 1 62 GLN 3.90 2.79 1 63 ASP 2.51 2.42 1 64 ILE 4.07 3.25 1 65 LYS 5.58 4.85 1 66 ASN 3.91 3.22 1 67 VAL 5.11 4.02 1 68 VAL 7.24 5.30 1 69 LEU 4.17 4.14 1 70 GLN 4.50 3.69 1 71 THR 6.50 5.13 1 72 LEU 3.83 3.65 1 73 GLU 4.74 3.87 1 76 LEU 3.78 3.87 1 77 ARG 4.29 4.14 1 78 SER 4.00 3.19 1 79 ILE 3.71 1.14 1 80 LEU 4.85 4.74 1 82 THR -1.10 -0.20 1 83 LEU -4.52 -1.66 1 84 THR -3.48 -2.20 1 85 VAL 6.52 5.22 1 86 GLU 3.84 3.54 1 87 GLN 2.82 3.36 1 88 ILE 4.64 4.14 1 89 TYR 3.64 3.32 1 90 GLN 2.21 1.92 1 91 ASP -0.65 -1.09 1 92 ARG 4.32 3.69 1 93 ASP 4.12 3.30 1 94 GLN 3.90 2.59 1 95 PHE 2.73 1.07 1 96 ALA 3.51 3.30 1 97 LYS 4.22 3.75 1 98 LEU 2.57 2.77 1 99 VAL 5.72 3.85 1 100 ARG 5.01 4.59 1 101 GLU 2.92 2.75 1 102 VAL 2.62 1.47 1 103 ALA 0.47 0.80 1 104 ALA 8.79 6.54 1 106 ASP 1.73 2.43 1 107 VAL 3.90 2.02 1 109 ARG 3.08 2.39 1 110 MET -0.81 -0.26 1 112 ILE -3.43 -2.80 1 113 GLU -5.58 -2.57 1 114 ILE 1.08 0.29 1 115 LEU 1.36 1.22 1 116 SER -1.64 -0.85 1 117 PHE -1.93 0.55 1 118 THR -3.80 -1.87 1 120 LYS 0.15 0.81 1 121 ASP -4.09 -0.33 1 122 VAL -2.87 -0.71 1 123 TYR -3.36 -1.49 1 124 ASP -3.47 -1.43 1 125 LYS 1.30 1.30 1 126 VAL 1.55 0.62 1 127 ASP 1.43 0.84 1 128 TYR 2.96 2.72 1 129 LEU 2.70 1.75 1 130 SER 2.31 1.60 1 131 SER 1.52 1.25 1 132 LEU 1.16 0.79 1 134 LYS 0.00 0.08 1 135 THR 0.22 0.27 1 136 GLN -0.02 0.25 1 137 THR -0.06 -0.04 1 138 SER -0.24 0.01 1 141 SER -0.06 0.07 1 142 SER 0.19 0.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 4.46 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.51 _LACS_plot.Line_2_terminator_val_x_2 8.79 _LACS_plot.Line_2_terminator_val_y_2 -1.76 _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 75 HIS 2.66 2.25 0 119 ILE 0.76 -2.77 0 10 ILE -0.33 0.27 1 11 SER -0.42 0.14 1 12 LEU 0.16 -0.35 1 13 GLU -1.26 0.97 1 14 ILE 0.33 0.10 1 15 MET -4.02 3.26 1 16 THR 0.81 -0.22 1 17 LEU -5.80 3.69 1 18 GLN -1.46 0.78 1 20 ARG -4.17 3.15 1 22 GLU -3.32 1.88 1 23 ASP 3.26 -1.90 1 24 VAL -0.55 -0.12 1 25 GLU -0.59 0.95 1 26 THR -0.47 0.55 1 27 ALA 3.76 -0.73 1 28 GLU -0.59 -0.50 1 30 VAL 0.39 -0.53 1 31 ALA -0.90 -0.26 1 32 LEU -5.97 4.49 1 33 THR -1.26 1.39 1 34 VAL -5.29 3.23 1 35 THR -3.10 1.17 1 37 VAL -2.67 1.91 1 38 ALA -7.17 4.26 1 39 GLN -2.42 1.55 1 40 VAL -5.95 1.95 1 41 LYS -5.10 3.71 1 42 ILE 1.06 -0.50 1 43 MET 0.28 1.12 1 44 THR -0.54 0.52 1 45 GLU 2.07 -0.15 1 46 LYS 3.39 -0.80 1 48 LEU 2.40 -0.87 1 49 LEU 1.97 -0.42 1 50 ALA 1.65 -0.22 1 51 VAL 1.30 -0.28 1 52 ALA 1.10 -0.21 1 54 GLU 2.20 -0.28 1 55 GLN 2.57 -0.77 1 56 PHE 0.15 -0.27 1 57 LEU 1.67 -0.43 1 59 LYS -0.99 0.43 1 60 ASN -1.00 0.47 1 61 VAL 4.68 -1.12 1 62 GLN 3.90 -1.11 1 63 ASP 2.51 -0.09 1 64 ILE 4.07 -0.82 1 65 LYS 5.58 -0.73 1 66 ASN 3.91 -0.69 1 67 VAL 5.11 -1.09 1 68 VAL 7.24 -1.94 1 69 LEU 4.17 -0.03 1 70 GLN 4.50 -0.81 1 71 THR 6.50 -1.37 1 72 LEU 3.83 -0.18 1 73 GLU 4.74 -0.87 1 76 LEU 3.78 0.09 1 77 ARG 4.29 -0.15 1 78 SER 4.00 -0.81 1 79 ILE 3.71 -2.57 1 80 LEU 4.85 -0.11 1 82 THR -1.10 0.90 1 83 LEU -4.52 2.86 1 84 THR -3.48 1.28 1 85 VAL 6.52 -1.30 1 86 GLU 3.84 -0.30 1 87 GLN 2.82 0.54 1 88 ILE 4.64 -0.50 1 89 TYR 3.64 -0.32 1 90 GLN 2.21 -0.29 1 91 ASP -0.65 -0.44 1 92 ARG 4.32 -0.63 1 93 ASP 4.12 -0.82 1 94 GLN 3.90 -1.31 1 95 PHE 2.73 -1.66 1 96 ALA 3.51 -0.21 1 97 LYS 4.22 -0.47 1 98 LEU 2.57 0.20 1 99 VAL 5.72 -1.87 1 100 ARG 5.01 -0.42 1 101 GLU 2.92 -0.17 1 102 VAL 2.62 -1.15 1 103 ALA 0.47 0.33 1 104 ALA 8.79 -2.25 1 106 ASP 1.73 0.70 1 107 VAL 3.90 -1.88 1 109 ARG 3.08 -0.69 1 110 MET -0.81 0.55 1 112 ILE -3.43 0.63 1 113 GLU -5.58 3.01 1 114 ILE 1.08 -0.79 1 115 LEU 1.36 -0.14 1 116 SER -1.64 0.79 1 117 PHE -1.93 2.48 1 118 THR -3.80 1.93 1 120 LYS 0.15 0.66 1 121 ASP -4.09 3.76 1 122 VAL -2.87 2.16 1 123 TYR -3.36 1.87 1 124 ASP -3.47 2.04 1 125 LYS 1.30 0.00 1 126 VAL 1.55 -0.93 1 127 ASP 1.43 -0.59 1 128 TYR 2.96 -0.24 1 129 LEU 2.70 -0.95 1 130 SER 2.31 -0.71 1 131 SER 1.52 -0.27 1 132 LEU 1.16 -0.37 1 134 LYS 0.00 0.08 1 135 THR 0.22 0.05 1 136 GLN -0.02 0.27 1 137 THR -0.06 0.02 1 138 SER -0.24 0.25 1 141 SER -0.06 0.13 1 142 SER 0.19 0.11 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 0.94 _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 8.79 _LACS_plot.Line_2_terminator_val_y_2 -0.85 _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 103 ALA 0.47 -0.84 0 10 ILE -0.33 0.04 1 11 SER -0.42 0.03 1 12 LEU 0.16 0.15 1 13 GLU -1.26 -0.05 1 14 ILE 0.33 0.21 1 15 MET -4.02 0.20 1 16 THR 0.81 0.77 1 17 LEU -5.80 0.52 1 18 GLN -1.46 0.91 1 20 ARG -4.17 0.87 1 22 GLU -3.32 0.36 1 23 ASP 3.26 -0.76 1 24 VAL -0.55 0.05 1 25 GLU -0.59 0.09 1 26 THR -0.47 0.31 1 27 ALA 3.76 -0.24 1 28 GLU -0.59 0.36 1 30 VAL 0.39 -0.16 1 31 ALA -0.90 0.22 1 32 LEU -5.97 0.67 1 33 THR -1.26 0.84 1 34 VAL -5.29 0.97 1 35 THR -3.10 0.84 1 37 VAL -2.67 0.71 1 38 ALA -7.17 1.13 1 39 GLN -2.42 1.11 1 40 VAL -5.95 1.35 1 41 LYS -5.10 0.59 1 42 ILE 1.06 0.12 1 43 MET 0.28 -0.11 1 44 THR -0.54 0.00 1 45 GLU 2.07 -0.20 1 46 LYS 3.39 -0.24 1 48 LEU 2.40 -0.13 1 49 LEU 1.97 -0.13 1 50 ALA 1.65 -0.06 1 51 VAL 1.30 -0.03 1 52 ALA 1.10 0.02 1 54 GLU 2.20 -0.23 1 55 GLN 2.57 -0.23 1 56 PHE 0.15 0.05 1 57 LEU 1.67 -0.10 1 59 LYS -0.99 0.17 1 60 ASN -1.00 0.04 1 61 VAL 4.68 -0.37 1 62 GLN 3.90 -0.32 1 63 ASP 2.51 -0.08 1 64 ILE 4.07 -0.52 1 65 LYS 5.58 -0.70 1 66 ASN 3.91 -0.21 1 67 VAL 5.11 -0.22 1 68 VAL 7.24 -0.71 1 69 LEU 4.17 -0.52 1 70 GLN 4.50 -0.21 1 71 THR 6.50 -0.35 1 72 LEU 3.83 -0.47 1 73 GLU 4.74 -0.63 1 75 HIS 2.66 -0.14 1 76 LEU 3.78 -0.34 1 77 ARG 4.29 -0.41 1 78 SER 4.00 -0.28 1 79 ILE 3.71 -0.24 1 80 LEU 4.85 -0.69 1 82 THR -1.10 0.20 1 83 LEU -4.52 0.51 1 84 THR -3.48 0.77 1 85 VAL 6.52 -0.64 1 86 GLU 3.84 -0.31 1 87 GLN 2.82 -0.30 1 88 ILE 4.64 -0.80 1 89 TYR 3.64 -0.32 1 90 GLN 2.21 -0.01 1 91 ASP -0.65 0.44 1 92 ARG 4.32 -0.09 1 93 ASP 4.12 -0.08 1 94 GLN 3.90 -0.14 1 95 PHE 2.73 -0.09 1 96 ALA 3.51 -0.61 1 97 LYS 4.22 -0.37 1 98 LEU 2.57 -0.22 1 99 VAL 5.72 -0.78 1 100 ARG 5.01 -0.91 1 101 GLU 2.92 -0.37 1 102 VAL 2.62 -0.03 1 104 ALA 8.79 -0.52 1 106 ASP 1.73 -0.07 1 107 VAL 3.90 0.09 1 109 ARG 3.08 -0.08 1 110 MET -0.81 -0.10 1 112 ILE -3.43 0.51 1 113 GLU -5.58 0.18 1 114 ILE 1.08 0.09 1 115 LEU 1.36 -0.03 1 116 SER -1.64 0.06 1 117 PHE -1.93 0.66 1 118 THR -3.80 -0.02 1 119 ILE 0.76 -0.19 1 120 LYS 0.15 0.00 1 121 ASP -4.09 0.31 1 122 VAL -2.87 0.61 1 123 TYR -3.36 0.60 1 124 ASP -3.47 0.40 1 125 LYS 1.30 0.07 1 126 VAL 1.55 0.03 1 127 ASP 1.43 -0.11 1 128 TYR 2.96 -0.33 1 129 LEU 2.70 -0.35 1 130 SER 2.31 -0.17 1 131 SER 1.52 -0.10 1 132 LEU 1.16 -0.13 1 134 LYS 0.00 0.09 1 135 THR 0.22 -0.01 1 136 GLN -0.02 0.12 1 137 THR -0.06 0.07 1 138 SER -0.24 0.07 1 141 SER -0.06 0.09 1 142 SER 0.19 0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 -3.01 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 8.79 _LACS_plot.Line_2_terminator_val_y_2 3.25 _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 26 THR -0.47 2.75 0 84 THR -3.48 1.46 0 23 ASP 3.26 -2.01 0 104 ALA 8.79 1.34 0 10 ILE -0.33 -0.85 1 11 SER -0.42 -0.15 1 12 LEU 0.16 -0.86 1 13 GLU -1.26 -0.87 1 14 ILE 0.33 0.06 1 15 MET -4.02 -1.73 1 16 THR 0.81 -0.91 1 17 LEU -5.80 -1.94 1 18 GLN -1.46 -2.05 1 20 ARG -4.17 -1.43 1 22 GLU -3.32 -1.72 1 24 VAL -0.55 -0.87 1 25 GLU -0.59 0.91 1 27 ALA 3.76 1.33 1 28 GLU -0.59 0.28 1 30 VAL 0.39 -1.23 1 31 ALA -0.90 -1.28 1 32 LEU -5.97 -1.56 1 33 THR -1.26 -1.25 1 34 VAL -5.29 -2.33 1 35 THR -3.10 -0.21 1 37 VAL -2.67 -1.26 1 38 ALA -7.17 -2.53 1 39 GLN -2.42 -0.08 1 40 VAL -5.95 -3.56 1 41 LYS -5.10 -2.14 1 42 ILE 1.06 -0.46 1 43 MET 0.28 -0.78 1 44 THR -0.54 0.39 1 45 GLU 2.07 1.05 1 46 LYS 3.39 1.57 1 48 LEU 2.40 0.76 1 49 LEU 1.97 0.84 1 50 ALA 1.65 1.15 1 51 VAL 1.30 0.25 1 52 ALA 1.10 0.40 1 54 GLU 2.20 1.04 1 55 GLN 2.57 0.62 1 56 PHE 0.15 0.05 1 57 LEU 1.67 0.41 1 59 LYS -0.99 -0.57 1 60 ASN -1.00 0.91 1 61 VAL 4.68 0.50 1 62 GLN 3.90 1.68 1 63 ASP 2.51 2.22 1 64 ILE 4.07 0.92 1 65 LYS 5.58 1.34 1 66 ASN 3.91 2.79 1 67 VAL 5.11 3.35 1 68 VAL 7.24 1.43 1 69 LEU 4.17 0.60 1 71 THR 6.50 2.44 1 72 LEU 3.83 0.80 1 73 GLU 4.74 2.03 1 75 HIS 2.66 3.03 1 76 LEU 3.78 -0.06 1 78 SER 4.00 2.89 1 79 ILE 3.71 3.64 1 80 LEU 4.85 -0.06 1 82 THR -1.10 -0.32 1 83 LEU -4.52 -1.73 1 85 VAL 6.52 1.29 1 86 GLU 3.84 2.21 1 87 GLN 2.82 2.97 1 88 ILE 4.64 -0.30 1 89 TYR 3.64 3.65 1 90 GLN 2.21 0.74 1 91 ASP -0.65 -0.20 1 92 ARG 4.32 2.45 1 93 ASP 4.12 2.52 1 94 GLN 3.90 1.85 1 95 PHE 2.73 0.64 1 96 ALA 3.51 1.30 1 97 LYS 4.22 1.81 1 98 LEU 2.57 2.14 1 99 VAL 5.72 0.67 1 100 ARG 5.01 1.06 1 101 GLU 2.92 2.83 1 102 VAL 2.62 0.51 1 103 ALA 0.47 1.15 1 106 ASP 1.73 2.58 1 107 VAL 3.90 2.71 1 110 MET -0.81 -1.60 1 112 ILE -3.43 -2.44 1 113 GLU -5.58 -1.02 1 114 ILE 1.08 -1.07 1 115 LEU 1.36 -0.04 1 116 SER -1.64 -1.77 1 117 PHE -1.93 -3.12 1 118 THR -3.80 -2.54 1 119 ILE 0.76 -1.66 1 120 LYS 0.15 -1.60 1 121 ASP -4.09 -2.65 1 122 VAL -2.87 -2.01 1 123 TYR -3.36 -2.48 1 124 ASP -3.47 -0.27 1 125 LYS 1.30 0.73 1 126 VAL 1.55 0.16 1 127 ASP 1.43 0.75 1 128 TYR 2.96 1.76 1 129 LEU 2.70 1.53 1 130 SER 2.31 1.27 1 131 SER 1.52 0.47 1 132 LEU 1.16 0.59 1 134 LYS 0.00 0.32 1 135 THR 0.22 -0.13 1 136 GLN -0.02 0.16 1 137 THR -0.06 -0.09 1 138 SER -0.24 -0.12 1 141 SER -0.06 0.14 1 142 SER 0.19 0.55 1 stop_ save_