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 bmr4056_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 -2.47 _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 -1.81 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 5.14 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -0.28 -3.67 0 10 ALA 4.10 2.94 1 11 GLU 3.43 2.90 1 12 PHE 3.73 2.04 1 13 LYS 5.05 3.82 1 14 GLU 3.55 2.92 1 15 ALA 3.63 2.91 1 16 PHE 4.10 4.45 1 17 SER 3.49 3.11 1 18 LEU 3.13 2.15 1 19 PHE -0.53 1.46 1 20 ASP -0.08 -1.87 1 21 LYS 2.49 1.94 1 22 ASP 0.21 -1.34 1 24 ASP 0.40 -0.26 1 26 THR -5.12 -2.15 1 27 ILE -1.52 -0.29 1 28 THR -5.23 -2.50 1 29 THR 6.33 4.58 1 30 LYS 3.62 2.96 1 31 GLU 3.60 3.14 1 32 LEU 3.34 3.21 1 34 THR 6.13 5.30 1 35 VAL 5.90 4.49 1 36 MET 5.16 4.04 1 37 ARG 3.82 3.04 1 38 SER 5.50 4.38 1 39 LEU -0.24 -0.88 1 41 GLN -2.88 -2.13 1 42 ASN -0.54 -0.11 1 44 THR -2.61 -1.34 1 45 GLU 4.39 3.41 1 46 ALA 3.42 2.51 1 47 GLU 2.54 2.42 1 48 LEU 2.66 2.74 1 49 GLN 3.89 3.07 1 50 ASP 3.94 3.41 1 51 MET 3.27 4.22 1 52 ILE 5.21 3.29 1 53 ASN 3.57 2.88 1 54 GLU 1.82 2.28 1 55 VAL -1.44 -1.24 1 56 ASP 0.05 -0.43 1 57 ALA 1.19 1.94 1 58 ASP -0.22 -1.41 1 60 ASN 1.00 -0.33 1 62 THR -4.90 -2.45 1 63 ILE -2.63 -2.41 1 64 ASP -3.31 -2.14 1 67 GLU 2.75 2.58 1 68 PHE 2.54 3.69 1 69 LEU 3.71 2.66 1 70 THR 5.98 4.86 1 71 MET 3.50 4.22 1 72 MET 3.30 0.86 1 73 ALA 2.90 1.98 1 74 ARG 3.26 2.46 1 85 ILE 5.54 4.15 1 86 ARG 5.27 4.13 1 87 GLU 3.24 2.65 1 88 ALA 4.02 2.90 1 89 PHE 4.85 4.58 1 90 ARG 3.44 2.91 1 91 VAL 4.98 3.47 1 92 PHE 0.77 2.65 1 93 ASP 0.51 -1.92 1 94 LYS 3.28 2.56 1 95 ASP 0.23 -1.22 1 97 ASN 0.45 -0.29 1 99 TYR -5.62 -1.65 1 100 ILE -0.12 0.33 1 101 SER -5.80 -2.57 1 102 ALA 4.38 3.34 1 103 ALA 3.37 2.67 1 104 GLU 3.92 2.98 1 105 LEU 3.74 3.46 1 106 ARG 4.37 4.01 1 107 HIS 3.44 5.07 1 108 VAL 5.81 4.83 1 109 MET 4.30 2.35 1 110 THR 5.18 4.81 1 111 ASN 3.91 2.86 1 112 LEU 0.20 0.29 1 114 GLU -2.47 -1.79 1 115 LYS 0.52 -0.67 1 116 LEU -3.90 -1.30 1 117 THR -2.55 -1.30 1 118 ASP 5.06 3.74 1 119 GLU 4.11 3.30 1 120 GLU 2.03 2.68 1 121 VAL 5.86 4.34 1 122 ASP 3.94 3.41 1 123 GLU 3.42 2.94 1 124 MET 3.50 4.22 1 125 ILE 5.15 2.43 1 126 ARG 4.31 3.65 1 127 GLU 2.23 2.19 1 128 ALA -4.06 -0.91 1 129 ASP 0.36 0.15 1 130 ILE 2.32 2.22 1 131 ASP 0.92 -0.25 1 133 ASP 0.40 -0.57 1 135 GLN -5.70 -2.41 1 136 VAL -1.55 -0.45 1 137 ASN -1.57 -1.94 1 138 TYR 5.64 4.55 1 139 GLU 4.66 3.66 1 140 GLU 2.34 2.16 1 141 PHE 3.67 4.20 1 142 VAL 6.18 4.84 1 143 GLN 4.56 3.21 1 144 MET 3.91 2.37 1 145 MET 0.98 0.41 1 146 THR -0.40 0.07 1 147 ALA 0.22 0.41 1 148 LYS 0.90 1.35 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4056_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 3.33 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 -1.19 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -0.28 -3.39 0 10 ALA 4.10 -1.16 1 11 GLU 3.43 -0.53 1 12 PHE 3.73 -1.69 1 13 LYS 5.05 -1.23 1 14 GLU 3.55 -0.63 1 15 ALA 3.63 -0.72 1 16 PHE 4.10 0.35 1 17 SER 3.49 -0.38 1 18 LEU 3.13 -0.98 1 19 PHE -0.53 1.99 1 20 ASP -0.08 -1.79 1 21 LYS 2.49 -0.55 1 22 ASP 0.21 -1.55 1 24 ASP 0.40 -0.66 1 26 THR -5.12 2.97 1 27 ILE -1.52 1.23 1 28 THR -5.23 2.73 1 29 THR 6.33 -1.75 1 30 LYS 3.62 -0.66 1 31 GLU 3.60 -0.46 1 32 LEU 3.34 -0.13 1 34 THR 6.13 -0.83 1 35 VAL 5.90 -1.41 1 36 MET 5.16 -1.12 1 37 ARG 3.82 -0.78 1 38 SER 5.50 -1.12 1 39 LEU -0.24 -0.64 1 41 GLN -2.88 0.75 1 42 ASN -0.54 0.43 1 44 THR -2.61 1.27 1 45 GLU 4.39 -0.98 1 46 ALA 3.42 -0.91 1 47 GLU 2.54 -0.12 1 48 LEU 2.66 0.08 1 49 GLN 3.89 -0.82 1 50 ASP 3.94 -0.53 1 51 MET 3.27 0.95 1 52 ILE 5.21 -1.92 1 53 ASN 3.57 -0.69 1 54 GLU 1.82 0.46 1 55 VAL -1.44 0.20 1 56 ASP 0.05 -0.48 1 57 ALA 1.19 0.75 1 58 ASP -0.22 -1.19 1 60 ASN 1.00 -1.33 1 62 THR -4.90 2.45 1 63 ILE -2.63 0.22 1 64 ASP -3.31 1.17 1 67 GLU 2.75 -0.17 1 68 PHE 2.54 1.15 1 69 LEU 3.71 -1.05 1 70 THR 5.98 -1.12 1 71 MET 3.50 0.72 1 72 MET 3.30 -2.44 1 73 ALA 2.90 -0.92 1 74 ARG 3.26 -0.80 1 85 ILE 5.54 -1.39 1 86 ARG 5.27 -1.14 1 87 GLU 3.24 -0.59 1 88 ALA 4.02 -1.12 1 89 PHE 4.85 -0.27 1 90 ARG 3.44 -0.53 1 91 VAL 4.98 -1.51 1 92 PHE 0.77 1.88 1 93 ASP 0.51 -2.43 1 94 LYS 3.28 -0.72 1 95 ASP 0.23 -1.45 1 97 ASN 0.45 -0.74 1 99 TYR -5.62 3.97 1 100 ILE -0.12 0.45 1 101 SER -5.80 3.23 1 102 ALA 4.38 -1.04 1 103 ALA 3.37 -0.70 1 104 GLU 3.92 -0.94 1 105 LEU 3.74 -0.28 1 106 ARG 4.37 -0.36 1 107 HIS 3.44 1.63 1 108 VAL 5.81 -0.98 1 109 MET 4.30 -1.95 1 110 THR 5.18 -0.37 1 111 ASN 3.91 -1.05 1 112 LEU 0.20 0.09 1 114 GLU -2.47 0.68 1 115 LYS 0.52 -1.19 1 116 LEU -3.90 2.60 1 117 THR -2.55 1.25 1 118 ASP 5.06 -1.32 1 119 GLU 4.11 -0.81 1 120 GLU 2.03 0.65 1 121 VAL 5.86 -1.52 1 122 ASP 3.94 -0.53 1 123 GLU 3.42 -0.48 1 124 MET 3.50 0.72 1 125 ILE 5.15 -2.72 1 126 ARG 4.31 -0.66 1 127 GLU 2.23 -0.04 1 128 ALA -4.06 3.15 1 129 ASP 0.36 -0.21 1 130 ILE 2.32 -0.10 1 131 ASP 0.92 -1.17 1 133 ASP 0.40 -0.97 1 135 GLN -5.70 3.29 1 136 VAL -1.55 1.10 1 137 ASN -1.57 -0.37 1 138 TYR 5.64 -1.09 1 139 GLU 4.66 -1.00 1 140 GLU 2.34 -0.18 1 141 PHE 3.67 0.53 1 142 VAL 6.18 -1.34 1 143 GLN 4.56 -1.35 1 144 MET 3.91 -1.54 1 145 MET 0.98 -0.57 1 146 THR -0.40 0.47 1 147 ALA 0.22 0.19 1 148 LYS 0.90 0.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4056_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.80 _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 -0.16 _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 6.33 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _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 65 PHE -0.28 -0.83 0 63 ILE -2.63 1.18 0 136 VAL -1.55 1.16 0 10 ALA 4.10 -0.14 1 11 GLU 3.43 -0.09 1 12 PHE 3.73 0.41 1 13 LYS 5.05 -0.26 1 14 GLU 3.55 -0.14 1 15 ALA 3.63 -0.06 1 16 PHE 4.10 -1.19 1 17 SER 3.49 -0.32 1 18 LEU 3.13 -0.31 1 19 PHE -0.53 -0.35 1 20 ASP -0.08 0.02 1 21 LYS 2.49 -0.27 1 22 ASP 0.21 0.02 1 24 ASP 0.40 -0.07 1 26 THR -5.12 1.14 1 27 ILE -1.52 0.75 1 28 THR -5.23 0.61 1 29 THR 6.33 -0.55 1 30 LYS 3.62 -0.16 1 31 GLU 3.60 -0.30 1 32 LEU 3.34 -0.16 1 34 THR 6.13 -0.37 1 35 VAL 5.90 -0.47 1 36 MET 5.16 -0.56 1 37 ARG 3.82 0.42 1 38 SER 5.50 -0.08 1 39 LEU -0.24 0.07 1 41 GLN -2.88 0.09 1 42 ASN -0.54 0.14 1 44 THR -2.61 0.13 1 45 GLU 4.39 -0.34 1 46 ALA 3.42 -0.18 1 47 GLU 2.54 -0.31 1 48 LEU 2.66 -0.37 1 49 GLN 3.89 -0.47 1 50 ASP 3.94 -0.17 1 51 MET 3.27 -0.29 1 52 ILE 5.21 -0.33 1 53 ASN 3.57 -0.23 1 54 GLU 1.82 -0.22 1 55 VAL -1.44 0.18 1 56 ASP 0.05 -0.10 1 57 ALA 1.19 -0.04 1 58 ASP -0.22 0.05 1 60 ASN 1.00 -0.06 1 62 THR -4.90 0.54 1 64 ASP -3.31 0.93 1 67 GLU 2.75 -0.29 1 68 PHE 2.54 -0.80 1 69 LEU 3.71 -0.98 1 70 THR 5.98 -0.62 1 71 MET 3.50 -0.65 1 72 MET 3.30 -0.63 1 73 ALA 2.90 -0.30 1 74 ARG 3.26 -0.29 1 85 ILE 5.54 -0.29 1 86 ARG 5.27 -0.13 1 87 GLU 3.24 -0.14 1 88 ALA 4.02 -0.01 1 89 PHE 4.85 -1.30 1 90 ARG 3.44 -0.47 1 91 VAL 4.98 -0.53 1 92 PHE 0.77 -0.31 1 93 ASP 0.51 0.04 1 94 LYS 3.28 -0.34 1 95 ASP 0.23 -0.03 1 97 ASN 0.45 -0.04 1 99 TYR -5.62 0.57 1 100 ILE -0.12 0.59 1 101 SER -5.80 0.51 1 102 ALA 4.38 -0.35 1 103 ALA 3.37 -0.23 1 104 GLU 3.92 -0.27 1 105 LEU 3.74 -0.13 1 106 ARG 4.37 -0.62 1 107 HIS 3.44 -0.40 1 108 VAL 5.81 -0.53 1 109 MET 4.30 -0.16 1 110 THR 5.18 -0.22 1 111 ASN 3.91 -0.26 1 112 LEU 0.20 -0.03 1 114 GLU -2.47 0.11 1 115 LYS 0.52 0.09 1 116 LEU -3.90 0.49 1 117 THR -2.55 0.14 1 118 ASP 5.06 -0.40 1 119 GLU 4.11 -0.23 1 120 GLU 2.03 -0.35 1 121 VAL 5.86 -0.49 1 122 ASP 3.94 -0.25 1 123 GLU 3.42 -0.28 1 124 MET 3.50 -0.33 1 125 ILE 5.15 -0.46 1 126 ARG 4.31 -0.22 1 127 GLU 2.23 -0.27 1 128 ALA -4.06 0.25 1 129 ASP 0.36 -0.08 1 130 ILE 2.32 -0.19 1 131 ASP 0.92 -0.05 1 133 ASP 0.40 -0.11 1 135 GLN -5.70 0.66 1 137 ASN -1.57 0.68 1 138 TYR 5.64 -1.08 1 139 GLU 4.66 -0.66 1 140 GLU 2.34 -0.39 1 141 PHE 3.67 -0.81 1 142 VAL 6.18 -1.00 1 143 GLN 4.56 -0.47 1 144 MET 3.91 -0.44 1 145 MET 0.98 -0.47 1 146 THR -0.40 -0.01 1 147 ALA 0.22 0.00 1 148 LYS 0.90 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4056_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 -1.04 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 2.79 _LACS_plot.Y_axis_chem_shift_offset -0.79 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 28 THR -5.23 2.07 0 10 ALA 4.10 3.43 1 11 GLU 3.43 3.69 1 12 PHE 3.73 3.19 1 13 LYS 5.05 2.79 1 14 GLU 3.55 3.17 1 15 ALA 3.63 0.45 1 16 PHE 4.10 2.20 1 17 SER 3.49 0.03 1 18 LEU 3.13 -1.01 1 20 ASP -0.08 1.06 1 21 LYS 2.49 1.82 1 22 ASP 0.21 1.59 1 26 THR -5.12 -1.33 1 27 ILE -1.52 -0.10 1 29 THR 6.33 2.70 1 30 LYS 3.62 3.48 1 31 GLU 3.60 2.62 1 32 LEU 3.34 1.35 1 34 THR 6.13 2.47 1 35 VAL 5.90 2.25 1 36 MET 5.16 2.79 1 37 ARG 3.82 2.91 1 38 SER 5.50 0.24 1 39 LEU -0.24 -0.80 1 44 THR -2.61 0.64 1 45 GLU 4.39 1.71 1 46 ALA 3.42 0.14 1 47 GLU 2.54 3.40 1 48 LEU 2.66 1.17 1 49 GLN 3.89 2.53 1 50 ASP 3.94 2.79 1 51 MET 3.27 2.75 1 52 ILE 5.21 2.04 1 53 ASN 3.57 2.22 1 54 GLU 1.82 0.80 1 55 VAL -1.44 -1.02 1 56 ASP 0.05 -0.22 1 57 ALA 1.19 1.07 1 58 ASP -0.22 1.81 1 62 THR -4.90 -1.33 1 63 ILE -2.63 -0.63 1 64 ASP -3.31 -0.14 1 67 GLU 2.75 2.95 1 68 PHE 2.54 0.75 1 70 THR 5.98 1.67 1 71 MET 3.50 1.56 1 72 MET 3.30 2.76 1 73 ALA 2.90 2.16 1 85 ILE 5.54 1.84 1 86 ARG 5.27 1.42 1 87 GLU 3.24 2.47 1 88 ALA 4.02 1.03 1 89 PHE 4.85 1.58 1 90 ARG 3.44 1.64 1 91 VAL 4.98 0.91 1 92 PHE 0.77 0.78 1 93 ASP 0.51 1.42 1 94 LYS 3.28 2.27 1 95 ASP 0.23 2.13 1 99 TYR -5.62 -0.96 1 100 ILE -0.12 -0.82 1 101 SER -5.80 0.82 1 102 ALA 4.38 1.62 1 103 ALA 3.37 3.75 1 104 GLU 3.92 2.49 1 106 ARG 4.37 2.03 1 107 HIS 3.44 4.43 1 108 VAL 5.81 1.94 1 109 MET 4.30 2.74 1 110 THR 5.18 3.92 1 111 ASN 3.91 1.72 1 112 LEU 0.20 -0.86 1 114 GLU -2.47 -1.35 1 115 LYS 0.52 -1.05 1 116 LEU -3.90 0.39 1 117 THR -2.55 0.91 1 118 ASP 5.06 2.38 1 119 GLU 4.11 -0.30 1 120 GLU 2.03 3.19 1 121 VAL 5.86 5.25 1 122 ASP 3.94 3.48 1 124 MET 3.50 1.21 1 125 ILE 5.15 1.75 1 126 ARG 4.31 2.56 1 127 GLU 2.23 0.78 1 128 ALA -4.06 -0.29 1 129 ASP 0.36 -0.35 1 130 ILE 2.32 1.57 1 131 ASP 0.92 2.14 1 133 ASP 0.40 1.41 1 135 GLN -5.70 -0.83 1 136 VAL -1.55 -0.30 1 137 ASN -1.57 -0.19 1 138 TYR 5.64 3.07 1 139 GLU 4.66 3.83 1 140 GLU 2.34 2.96 1 141 PHE 3.67 0.92 1 142 VAL 6.18 3.26 1 143 GLN 4.56 1.94 1 144 MET 3.91 1.33 1 145 MET 0.98 0.72 1 146 THR -0.40 -0.39 1 147 ALA 0.22 -1.00 1 stop_ save_