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 bmr16098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.01 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.36 _LACS_plot.Line_2_terminator_val_x_2 7.71 _LACS_plot.Line_2_terminator_val_y_2 6.30 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 HIS 2.58 4.96 0 110 ASN -0.88 -2.53 0 66 MET -6.21 -0.91 0 72 HIS -5.25 -0.08 0 10 HIS 3.69 4.89 1 11 GLU 3.58 2.23 1 12 GLU -1.06 -1.08 1 14 GLU 4.12 3.27 1 15 GLU 3.49 2.97 1 16 LEU 5.09 2.84 1 17 VAL 5.54 4.59 1 18 ALA 4.65 3.57 1 19 ILE 5.88 5.35 1 20 TRP 7.48 6.38 1 22 ARG 3.46 3.73 1 23 SER 3.70 4.04 1 24 VAL 5.75 3.67 1 25 ASP 4.17 2.85 1 26 ALA 0.83 1.73 1 27 THR -1.74 0.74 1 28 HIS 0.80 -0.80 1 29 ASP 3.11 1.71 1 30 PHE -1.67 -2.32 1 31 LEU -0.77 0.25 1 32 SER -1.00 -0.39 1 33 ALA 3.78 3.14 1 34 GLU 4.01 3.33 1 35 TYR -0.81 -0.66 1 36 ARG 5.13 3.45 1 37 THR 5.86 5.16 1 38 GLU 2.68 3.19 1 39 LEU 2.15 2.64 1 40 GLU 3.70 2.96 1 41 ASP 3.81 3.54 1 42 LEU 3.39 3.15 1 43 VAL 6.46 4.93 1 44 ARG 5.11 4.13 1 45 SER 1.78 2.12 1 46 PHE -1.19 1.57 1 47 LEU 7.72 6.26 1 49 GLU -2.28 -1.59 1 50 ALA -0.54 -0.01 1 52 LEU -1.81 0.01 1 53 TRP -3.03 -0.96 1 54 VAL -4.15 -2.24 1 55 ALA -4.24 -2.70 1 56 VAL -6.98 -4.17 1 57 ASN -2.59 -2.19 1 58 GLU 3.51 2.49 1 59 ARG 0.41 -0.61 1 60 ASP 1.24 1.66 1 61 GLN -1.85 -1.43 1 63 VAL -1.63 -1.12 1 65 PHE -4.05 -0.63 1 67 LEU -4.99 -0.78 1 68 LEU -4.02 -0.61 1 69 SER -1.03 -1.41 1 71 GLN 0.09 -0.06 1 73 MET -2.58 -0.91 1 74 ASP 0.71 2.77 1 75 ALA -5.35 -0.57 1 76 LEU 0.84 1.33 1 77 PHE -3.15 0.09 1 78 ILE -4.51 -2.54 1 79 ASP -1.11 1.32 1 81 ASP 2.84 2.24 1 82 VAL -0.32 -1.78 1 83 ARG 2.56 1.91 1 87 VAL 5.47 4.25 1 89 ARG 5.56 4.42 1 90 VAL 5.49 4.33 1 91 LEU 4.43 3.76 1 92 VAL 6.51 5.39 1 93 GLU 4.32 3.56 1 95 ALA 3.52 3.67 1 96 LEU 1.65 1.62 1 97 SER 3.55 2.78 1 98 MET -1.02 0.77 1 99 ALA -2.40 -0.45 1 101 GLU -0.67 -2.02 1 102 LEU -2.12 0.76 1 103 THR -4.32 -1.91 1 104 THR 1.62 1.01 1 105 ASN -4.80 -1.60 1 106 VAL -5.84 -2.75 1 107 ASN 2.70 3.27 1 108 GLU 0.81 2.49 1 109 GLN 0.19 0.67 1 111 GLU 3.29 3.53 1 112 GLN 3.98 3.66 1 113 ALA 1.29 2.35 1 114 VAL 6.82 6.19 1 116 PHE 3.97 3.52 1 117 TYR 5.50 3.85 1 118 LYS 4.46 3.96 1 119 LYS 3.73 3.10 1 120 VAL 1.55 0.39 1 122 PHE -0.45 0.72 1 123 LYS -5.37 -2.22 1 124 VAL 1.36 0.99 1 125 THR 0.03 -0.05 1 127 ARG -4.05 -0.82 1 128 SER -4.21 -2.27 1 129 GLU 1.54 1.70 1 130 VAL -7.01 -4.46 1 131 ASP -0.62 -1.48 1 132 ASP 3.63 3.30 1 133 LEU 0.02 -0.72 1 135 LYS 1.51 -0.42 1 137 TYR -2.84 -0.97 1 139 LEU -5.73 -1.83 1 140 LEU -2.61 -1.85 1 141 ASN -1.85 -0.14 1 142 LEU -4.73 -1.58 1 143 ALA -5.46 -1.11 1 144 TYR 2.37 2.74 1 145 VAL -1.28 -0.05 1 147 ALA -0.12 1.28 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.01 _LACS_plot.Line_1_terminator_val_y_1 4.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.64 _LACS_plot.Line_2_terminator_val_x_2 7.71 _LACS_plot.Line_2_terminator_val_y_2 -1.41 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 HIS 2.58 2.38 0 110 ASN -0.88 -1.65 0 66 MET -6.21 5.30 0 72 HIS -5.25 5.17 0 10 HIS 3.69 1.20 1 11 GLU 3.58 -1.35 1 12 GLU -1.06 -0.02 1 14 GLU 4.12 -0.85 1 15 GLU 3.49 -0.52 1 16 LEU 5.09 -2.25 1 17 VAL 5.54 -0.95 1 18 ALA 4.65 -1.08 1 19 ILE 5.88 -0.53 1 20 TRP 7.48 -1.10 1 22 ARG 3.46 0.27 1 23 SER 3.70 0.34 1 24 VAL 5.75 -2.08 1 25 ASP 4.17 -1.32 1 26 ALA 0.83 0.90 1 27 THR -1.74 2.48 1 28 HIS 0.80 -1.60 1 29 ASP 3.11 -1.40 1 30 PHE -1.67 -0.65 1 31 LEU -0.77 1.02 1 32 SER -1.00 0.61 1 33 ALA 3.78 -0.64 1 34 GLU 4.01 -0.68 1 35 TYR -0.81 0.15 1 36 ARG 5.13 -1.68 1 37 THR 5.86 -0.70 1 38 GLU 2.68 0.51 1 39 LEU 2.15 0.49 1 40 GLU 3.70 -0.74 1 41 ASP 3.81 -0.27 1 42 LEU 3.39 -0.24 1 43 VAL 6.46 -1.53 1 44 ARG 5.11 -0.98 1 45 SER 1.78 0.34 1 46 PHE -1.19 2.76 1 47 LEU 7.72 -1.46 1 49 GLU -2.28 0.69 1 50 ALA -0.54 0.53 1 52 LEU -1.81 1.82 1 53 TRP -3.03 2.07 1 54 VAL -4.15 1.91 1 55 ALA -4.24 1.54 1 56 VAL -6.98 2.81 1 57 ASN -2.59 0.40 1 58 GLU 3.51 -1.02 1 59 ARG 0.41 -1.02 1 60 ASP 1.24 0.42 1 61 GLN -1.85 0.42 1 63 VAL -1.63 0.51 1 65 PHE -4.05 3.42 1 67 LEU -4.99 4.21 1 68 LEU -4.02 3.41 1 69 SER -1.03 -0.38 1 71 GLN 0.09 -0.15 1 73 MET -2.58 1.67 1 74 ASP 0.71 2.06 1 75 ALA -5.35 4.78 1 76 LEU 0.84 0.49 1 77 PHE -3.15 3.24 1 78 ILE -4.51 1.97 1 79 ASP -1.11 2.43 1 81 ASP 2.84 -0.60 1 82 VAL -0.32 -1.46 1 83 ARG 2.56 -0.65 1 87 VAL 5.47 -1.22 1 89 ARG 5.56 -1.14 1 90 VAL 5.49 -1.16 1 91 LEU 4.43 -0.67 1 92 VAL 6.51 -1.12 1 93 GLU 4.32 -0.76 1 95 ALA 3.52 0.15 1 96 LEU 1.65 -0.03 1 97 SER 3.55 -0.77 1 98 MET -1.02 1.79 1 99 ALA -2.40 1.95 1 101 GLU -0.67 -1.35 1 102 LEU -2.12 2.88 1 103 THR -4.32 2.41 1 104 THR 1.62 -0.61 1 105 ASN -4.80 3.20 1 106 VAL -5.84 3.09 1 107 ASN 2.70 0.57 1 108 GLU 0.81 1.68 1 109 GLN 0.19 0.48 1 111 GLU 3.29 0.24 1 112 GLN 3.98 -0.32 1 113 ALA 1.29 1.06 1 114 VAL 6.82 -0.63 1 116 PHE 3.97 -0.45 1 117 TYR 5.50 -1.65 1 118 LYS 4.46 -0.50 1 119 LYS 3.73 -0.63 1 120 VAL 1.55 -1.16 1 122 PHE -0.45 1.17 1 123 LYS -5.37 3.15 1 124 VAL 1.36 -0.37 1 125 THR 0.03 -0.08 1 127 ARG -4.05 3.23 1 128 SER -4.21 1.94 1 129 GLU 1.54 0.16 1 130 VAL -7.01 2.55 1 131 ASP -0.62 -0.86 1 132 ASP 3.63 -0.33 1 133 LEU 0.02 -0.74 1 135 LYS 1.51 -1.93 1 137 TYR -2.84 1.87 1 139 LEU -5.73 3.90 1 140 LEU -2.61 0.76 1 141 ASN -1.85 1.71 1 142 LEU -4.73 3.15 1 143 ALA -5.46 4.35 1 144 TYR 2.37 0.37 1 145 VAL -1.28 1.23 1 147 ALA -0.12 1.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.01 _LACS_plot.Line_1_terminator_val_y_1 1.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.47 _LACS_plot.Line_2_terminator_val_x_2 7.71 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -4.05 1.51 0 144 TYR 2.37 -0.97 0 10 HIS 3.69 -0.29 1 11 GLU 3.58 0.02 1 12 GLU -1.06 0.69 1 14 GLU 4.12 -0.25 1 15 GLU 3.49 -0.05 1 16 LEU 5.09 -0.15 1 17 VAL 5.54 -0.58 1 18 ALA 4.65 0.00 1 19 ILE 5.88 -0.45 1 20 TRP 7.48 -1.13 1 22 ARG 3.46 -0.24 1 23 SER 3.70 -0.18 1 24 VAL 5.75 -0.56 1 25 ASP 4.17 -0.15 1 26 ALA 0.83 0.26 1 27 THR -1.74 0.57 1 28 HIS 0.80 0.10 1 29 ASP 3.11 -0.22 1 30 PHE -1.67 0.16 1 31 LEU -0.77 -0.08 1 32 SER -1.00 0.22 1 33 ALA 3.78 -0.08 1 34 GLU 4.01 -0.06 1 35 TYR -0.81 0.70 1 36 ARG 5.13 -0.33 1 37 THR 5.86 -0.09 1 38 GLU 2.68 -0.08 1 39 LEU 2.15 -0.29 1 40 GLU 3.70 -0.87 1 41 ASP 3.81 -0.20 1 42 LEU 3.39 -0.14 1 43 VAL 6.46 -0.68 1 44 ARG 5.11 -0.52 1 45 SER 1.78 0.00 1 46 PHE -1.19 0.17 1 47 LEU 7.72 -0.86 1 49 GLU -2.28 0.18 1 50 ALA -0.54 -0.14 1 52 LEU -1.81 0.38 1 53 TRP -3.03 0.46 1 54 VAL -4.15 1.12 1 55 ALA -4.24 1.11 1 56 VAL -6.98 1.41 1 57 ASN -2.59 0.58 1 58 GLU 3.51 -0.01 1 59 ARG 0.41 0.28 1 60 ASP 1.24 -0.14 1 61 GLN -1.85 0.21 1 63 VAL -1.63 0.66 1 66 MET -6.21 1.07 1 67 LEU -4.99 0.93 1 68 LEU -4.02 0.99 1 69 SER -1.03 0.47 1 71 GLN 0.09 0.32 1 72 HIS -5.25 0.59 1 73 MET -2.58 0.59 1 74 ASP 0.71 0.03 1 75 ALA -5.35 0.59 1 76 LEU 0.84 0.61 1 77 PHE -3.15 -0.01 1 78 ILE -4.51 0.44 1 79 ASP -1.11 -0.30 1 81 ASP 2.84 0.06 1 82 VAL -0.32 0.68 1 83 ARG 2.56 -0.11 1 87 VAL 5.47 -0.62 1 89 ARG 5.56 -0.22 1 90 VAL 5.49 -0.18 1 91 LEU 4.43 -0.20 1 92 VAL 6.51 -0.40 1 93 GLU 4.32 -0.41 1 94 HIS 2.58 -0.37 1 95 ALA 3.52 -0.56 1 96 LEU 1.65 -0.19 1 97 SER 3.55 -0.24 1 98 MET -1.02 0.04 1 99 ALA -2.40 0.27 1 101 GLU -0.67 0.49 1 102 LEU -2.12 0.65 1 103 THR -4.32 1.14 1 104 THR 1.62 -0.47 1 105 ASN -4.80 1.46 1 106 VAL -5.84 0.76 1 107 ASN 2.70 0.29 1 108 GLU 0.81 -0.57 1 109 GLN 0.19 -0.24 1 110 ASN -0.88 0.40 1 111 GLU 3.29 -0.32 1 112 GLN 3.98 -0.10 1 113 ALA 1.29 -0.12 1 114 VAL 6.82 -0.56 1 116 PHE 3.97 -0.21 1 117 TYR 5.50 -0.45 1 118 LYS 4.46 0.37 1 119 LYS 3.73 -0.08 1 120 VAL 1.55 0.24 1 122 PHE -0.45 0.46 1 123 LYS -5.37 0.62 1 124 VAL 1.36 0.47 1 125 THR 0.03 0.34 1 127 ARG -4.05 1.08 1 128 SER -4.21 0.54 1 129 GLU 1.54 -0.11 1 130 VAL -7.01 0.92 1 131 ASP -0.62 0.21 1 132 ASP 3.63 -0.07 1 133 LEU 0.02 0.44 1 135 LYS 1.51 -0.04 1 137 TYR -2.84 0.37 1 139 LEU -5.73 0.88 1 140 LEU -2.61 0.77 1 141 ASN -1.85 0.71 1 142 LEU -4.73 1.50 1 143 ALA -5.46 1.02 1 145 VAL -1.28 0.13 1 147 ALA -0.12 -0.10 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.01 _LACS_plot.Line_1_terminator_val_y_1 -2.46 _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 -0.55 _LACS_plot.Line_2_terminator_val_x_2 7.71 _LACS_plot.Line_2_terminator_val_y_2 2.99 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 104 THR 1.62 -4.62 0 47 LEU 7.72 -1.58 0 10 HIS 3.69 4.05 1 11 GLU 3.58 0.45 1 12 GLU -1.06 -0.31 1 14 GLU 4.12 3.03 1 15 GLU 3.49 3.11 1 16 LEU 5.09 1.01 1 17 VAL 5.54 2.19 1 18 ALA 4.65 2.46 1 19 ILE 5.88 0.87 1 20 TRP 7.48 0.41 1 22 ARG 3.46 3.63 1 23 SER 3.70 5.33 1 28 HIS 0.80 2.57 1 29 ASP 3.11 -1.11 1 30 PHE -1.67 0.25 1 31 LEU -0.77 0.22 1 32 SER -1.00 0.02 1 33 ALA 3.78 3.12 1 34 GLU 4.01 2.40 1 35 TYR -0.81 1.50 1 36 ARG 5.13 3.00 1 37 THR 5.86 1.04 1 38 GLU 2.68 3.62 1 39 LEU 2.15 0.41 1 40 GLU 3.70 1.14 1 41 ASP 3.81 2.97 1 42 LEU 3.39 2.54 1 43 VAL 6.46 2.20 1 44 ARG 5.11 1.44 1 46 PHE -1.19 0.46 1 49 GLU -2.28 -0.66 1 50 ALA -0.54 0.69 1 52 LEU -1.81 0.34 1 53 TRP -3.03 -0.68 1 54 VAL -4.15 -1.56 1 55 ALA -4.24 -1.06 1 56 VAL -6.98 -1.10 1 57 ASN -2.59 2.99 1 58 GLU 3.51 0.58 1 59 ARG 0.41 -0.93 1 60 ASP 1.24 -0.93 1 61 GLN -1.85 0.24 1 63 VAL -1.63 -1.46 1 65 PHE -4.05 -4.00 1 66 MET -6.21 -3.22 1 67 LEU -4.99 -3.54 1 68 LEU -4.02 -1.66 1 69 SER -1.03 0.62 1 71 GLN 0.09 -3.57 1 72 HIS -5.25 0.12 1 73 MET -2.58 -1.76 1 74 ASP 0.71 -0.09 1 75 ALA -5.35 -2.92 1 76 LEU 0.84 -3.66 1 77 PHE -3.15 -2.52 1 78 ILE -4.51 -1.74 1 79 ASP -1.11 0.89 1 81 ASP 2.84 1.59 1 82 VAL -0.32 0.22 1 83 ARG 2.56 0.95 1 87 VAL 5.47 1.13 1 89 ARG 5.56 1.31 1 90 VAL 5.49 3.39 1 91 LEU 4.43 0.84 1 92 VAL 6.51 1.25 1 93 GLU 4.32 3.04 1 94 HIS 2.58 4.74 1 95 ALA 3.52 1.67 1 96 LEU 1.65 1.63 1 97 SER 3.55 0.42 1 98 MET -1.02 -0.66 1 99 ALA -2.40 -3.53 1 101 GLU -0.67 -1.51 1 102 LEU -2.12 -1.18 1 103 THR -4.32 -0.40 1 105 ASN -4.80 -1.02 1 106 VAL -5.84 -2.86 1 107 ASN 2.70 0.66 1 108 GLU 0.81 -0.03 1 109 GLN 0.19 -0.50 1 110 ASN -0.88 -1.09 1 111 GLU 3.29 3.27 1 112 GLN 3.98 2.84 1 114 VAL 6.82 2.17 1 116 PHE 3.97 0.87 1 117 TYR 5.50 3.55 1 118 LYS 4.46 3.73 1 119 LYS 3.73 2.31 1 120 VAL 1.55 -0.73 1 122 PHE -0.45 -0.42 1 123 LYS -5.37 -1.18 1 124 VAL 1.36 1.69 1 125 THR 0.03 0.27 1 127 ARG -4.05 -1.39 1 128 SER -4.21 -0.20 1 129 GLU 1.54 -1.26 1 130 VAL -7.01 -0.68 1 131 ASP -0.62 2.47 1 132 ASP 3.63 1.03 1 133 LEU 0.02 0.01 1 135 LYS 1.51 2.02 1 137 TYR -2.84 -2.52 1 139 LEU -5.73 -1.39 1 140 LEU -2.61 -1.37 1 141 ASN -1.85 -1.06 1 142 LEU -4.73 -0.38 1 143 ALA -5.46 -1.28 1 144 TYR 2.37 -0.82 1 145 VAL -1.28 -0.96 1 147 ALA -0.12 4.85 1 stop_ save_