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 bmr17734_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.26 _LACS_plot.Line_1_terminator_val_y_1 -2.15 _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 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 5.26 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 101 ARG -5.42 -0.77 0 66 LEU -0.59 -2.27 0 10 GLN 0.17 0.27 1 11 ALA -0.06 0.20 1 12 THR 0.58 0.50 1 13 SER -1.37 -0.50 1 15 LYS 4.14 4.02 1 16 THR 5.44 4.11 1 17 ILE 4.10 2.10 1 18 LEU 4.42 3.58 1 19 GLU 3.98 3.35 1 20 TYR 3.61 2.46 1 21 ILE 5.72 4.98 1 22 ILE 5.98 3.31 1 23 ASN 4.03 3.70 1 24 PHE 4.53 3.97 1 25 PHE 2.59 3.70 1 26 THR 0.11 1.07 1 30 ILE 1.00 0.57 1 31 ARG 0.76 0.45 1 32 ARG 1.64 1.17 1 34 ASN 0.36 0.20 1 35 GLU 0.90 1.03 1 36 THR 3.80 3.07 1 37 GLN 3.25 2.21 1 38 TYR 0.70 0.20 1 39 GLN 5.23 4.11 1 40 GLU 3.93 3.05 1 41 LEU 4.03 3.58 1 42 ILE 5.48 4.69 1 43 GLU 3.49 3.07 1 44 THR 5.89 4.75 1 45 MET 4.37 3.61 1 46 ALA 4.56 3.87 1 47 GLU 2.94 2.64 1 48 THR 6.59 5.54 1 49 LEU 4.07 3.30 1 50 LYS 4.12 3.41 1 51 SER 2.26 2.39 1 52 THR -0.27 0.64 1 53 MET -1.87 0.33 1 55 ASP -3.23 -1.28 1 56 ARG 3.23 2.35 1 58 ALA 0.62 0.64 1 60 LEU 1.54 0.65 1 62 GLU 1.86 2.28 1 63 ASN -4.45 -0.86 1 64 ILE -3.60 -0.07 1 65 ILE -2.76 -0.97 1 67 ASP 1.66 2.62 1 68 ASP -0.14 0.33 1 69 MET 0.26 -0.73 1 70 ASP 2.05 0.75 1 73 ARG -1.90 -0.95 1 74 VAL -2.46 -1.21 1 75 GLU -6.26 -2.72 1 76 PHE -3.07 -1.89 1 77 ASN -3.01 -0.51 1 78 LEU 4.31 2.50 1 81 GLU 0.91 1.13 1 82 ASN 1.02 0.45 1 83 ASN -0.40 -0.14 1 84 GLU 1.19 1.20 1 85 ALA 0.19 0.15 1 87 GLN -3.17 -1.47 1 88 VAL -0.06 -0.23 1 89 ILE -0.18 -0.28 1 90 VAL -2.68 -2.51 1 91 ARG -4.86 -1.92 1 92 VAL -2.61 -1.65 1 93 SER -5.04 -1.55 1 94 LYS -1.40 0.72 1 96 ASP 0.88 0.51 1 97 HIS -3.34 0.37 1 98 SER -3.45 -1.15 1 99 GLU -5.69 -1.64 1 100 THR -4.10 -1.69 1 102 GLU -4.13 -1.42 1 103 ILE -4.02 -0.52 1 105 LEU 3.63 3.18 1 106 ALA 4.23 3.27 1 107 SER 3.73 2.92 1 108 PHE 3.37 4.35 1 109 GLU 4.32 3.64 1 110 LYS 4.09 3.63 1 111 ILE 4.57 2.65 1 113 ARG 5.22 2.73 1 114 ALA 3.40 2.50 1 115 LEU 3.03 2.39 1 116 LEU 1.32 1.75 1 117 PHE 1.55 1.31 1 118 ARG 1.70 1.14 1 120 GLU -0.07 0.37 1 121 PHE -0.16 0.06 1 122 SER -0.39 -0.14 1 123 LEU 0.07 0.11 1 125 GLN 0.42 0.49 1 126 ASP 0.38 0.51 1 127 SER 0.26 0.40 1 128 VAL 0.50 0.33 1 129 ILE 0.35 -0.03 1 130 LEU -0.33 -0.18 1 131 THR -0.48 -0.21 1 132 ALA 0.31 1.48 1 133 GLN 0.43 1.74 1 138 LEU -0.15 0.01 1 142 VAL 1.29 1.55 1 144 THR -0.16 0.12 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17734_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.26 _LACS_plot.Line_1_terminator_val_y_1 4.11 _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 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 101 ARG -5.42 4.65 0 66 LEU -0.59 -1.68 0 10 GLN 0.17 0.10 1 11 ALA -0.06 0.26 1 12 THR 0.58 -0.08 1 13 SER -1.37 0.87 1 15 LYS 4.14 -0.12 1 16 THR 5.44 -1.33 1 17 ILE 4.10 -2.00 1 18 LEU 4.42 -0.84 1 19 GLU 3.98 -0.63 1 20 TYR 3.61 -1.15 1 21 ILE 5.72 -0.74 1 22 ILE 5.98 -2.67 1 23 ASN 4.03 -0.33 1 24 PHE 4.53 -0.56 1 25 PHE 2.59 1.11 1 26 THR 0.11 0.96 1 30 ILE 1.00 -0.43 1 31 ARG 0.76 -0.31 1 32 ARG 1.64 -0.47 1 34 ASN 0.36 -0.16 1 35 GLU 0.90 0.13 1 36 THR 3.80 -0.73 1 37 GLN 3.25 -1.04 1 38 TYR 0.70 -0.50 1 39 GLN 5.23 -1.12 1 40 GLU 3.93 -0.88 1 41 LEU 4.03 -0.45 1 42 ILE 5.48 -0.79 1 43 GLU 3.49 -0.42 1 44 THR 5.89 -1.14 1 45 MET 4.37 -0.76 1 46 ALA 4.56 -0.69 1 47 GLU 2.94 -0.30 1 48 THR 6.59 -1.05 1 49 LEU 4.07 -0.77 1 50 LYS 4.12 -0.71 1 51 SER 2.26 0.13 1 52 THR -0.27 0.91 1 53 MET -1.87 2.20 1 55 ASP -3.23 1.95 1 56 ARG 3.23 -0.88 1 58 ALA 0.62 0.02 1 60 LEU 1.54 -0.89 1 62 GLU 1.86 0.42 1 63 ASN -4.45 3.59 1 64 ILE -3.60 3.53 1 65 ILE -2.76 1.79 1 67 ASP 1.66 0.96 1 68 ASP -0.14 0.47 1 69 MET 0.26 -0.99 1 70 ASP 2.05 -1.30 1 73 ARG -1.90 0.95 1 74 VAL -2.46 1.25 1 75 GLU -6.26 3.54 1 76 PHE -3.07 1.18 1 77 ASN -3.01 2.50 1 78 LEU 4.31 -1.81 1 81 GLU 0.91 0.22 1 82 ASN 1.02 -0.57 1 83 ASN -0.40 0.26 1 84 GLU 1.19 0.01 1 85 ALA 0.19 -0.04 1 87 GLN -3.17 1.70 1 88 VAL -0.06 -0.17 1 89 ILE -0.18 -0.10 1 90 VAL -2.68 0.17 1 91 ARG -4.86 2.94 1 92 VAL -2.61 0.96 1 93 SER -5.04 3.49 1 94 LYS -1.40 2.12 1 96 ASP 0.88 -0.37 1 97 HIS -3.34 3.71 1 98 SER -3.45 2.30 1 99 GLU -5.69 4.05 1 100 THR -4.10 2.41 1 102 GLU -4.13 2.71 1 103 ILE -4.02 3.50 1 105 LEU 3.63 -0.45 1 106 ALA 4.23 -0.96 1 107 SER 3.73 -0.81 1 108 PHE 3.37 0.98 1 109 GLU 4.32 -0.68 1 110 LYS 4.09 -0.46 1 111 ILE 4.57 -1.92 1 113 ARG 5.22 -2.49 1 114 ALA 3.40 -0.90 1 115 LEU 3.03 -0.64 1 116 LEU 1.32 0.43 1 117 PHE 1.55 -0.24 1 118 ARG 1.70 -0.56 1 120 GLU -0.07 0.44 1 121 PHE -0.16 0.22 1 122 SER -0.39 0.25 1 123 LEU 0.07 0.04 1 125 GLN 0.42 0.07 1 126 ASP 0.38 0.13 1 127 SER 0.26 0.14 1 128 VAL 0.50 -0.17 1 129 ILE 0.35 -0.38 1 130 LEU -0.33 0.15 1 131 THR -0.48 0.27 1 132 ALA 0.31 1.17 1 133 GLN 0.43 1.31 1 138 LEU -0.15 0.16 1 142 VAL 1.29 0.26 1 144 THR -0.16 0.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17734_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.26 _LACS_plot.Line_1_terminator_val_y_1 0.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 -0.56 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 THR -4.10 1.43 0 10 GLN 0.17 -0.08 1 11 ALA -0.06 0.02 1 12 THR 0.58 -0.12 1 13 SER -1.37 0.02 1 15 LYS 4.14 -0.58 1 16 THR 5.44 -0.43 1 17 ILE 4.10 -0.55 1 18 LEU 4.42 -0.48 1 19 GLU 3.98 -0.44 1 20 TYR 3.61 0.10 1 21 ILE 5.72 -0.42 1 22 ILE 5.98 -0.33 1 23 ASN 4.03 -0.30 1 24 PHE 4.53 -0.94 1 25 PHE 2.59 -0.47 1 26 THR 0.11 0.26 1 30 ILE 1.00 -0.16 1 31 ARG 0.76 -0.03 1 32 ARG 1.64 -0.16 1 34 ASN 0.36 0.01 1 35 GLU 0.90 -0.03 1 36 THR 3.80 -0.30 1 37 GLN 3.25 -0.30 1 38 TYR 0.70 -0.08 1 39 GLN 5.23 -0.50 1 40 GLU 3.93 -0.26 1 41 LEU 4.03 -0.34 1 42 ILE 5.48 -0.91 1 43 GLU 3.49 -0.34 1 44 THR 5.89 -0.21 1 45 MET 4.37 -0.33 1 46 ALA 4.56 -0.51 1 47 GLU 2.94 -0.34 1 48 THR 6.59 -0.30 1 49 LEU 4.07 -0.38 1 50 LYS 4.12 -0.41 1 51 SER 2.26 -0.10 1 52 THR -0.27 0.19 1 53 MET -1.87 0.10 1 55 ASP -3.23 -0.12 1 56 ARG 3.23 -0.47 1 58 ALA 0.62 -0.13 1 60 LEU 1.54 -0.24 1 62 GLU 1.86 -0.39 1 63 ASN -4.45 0.93 1 64 ILE -3.60 0.12 1 65 ILE -2.76 0.76 1 66 LEU -0.59 0.41 1 67 ASP 1.66 -0.33 1 68 ASP -0.14 -0.33 1 69 MET 0.26 0.13 1 70 ASP 2.05 -0.42 1 73 ARG -1.90 0.44 1 74 VAL -2.46 0.60 1 75 GLU -6.26 0.79 1 76 PHE -3.07 0.63 1 77 ASN -3.01 0.78 1 78 LEU 4.31 -0.35 1 81 GLU 0.91 -0.24 1 82 ASN 1.02 -0.08 1 83 ASN -0.40 0.02 1 84 GLU 1.19 -0.17 1 85 ALA 0.19 0.06 1 87 GLN -3.17 0.41 1 88 VAL -0.06 -0.12 1 89 ILE -0.18 0.08 1 90 VAL -2.68 0.59 1 91 ARG -4.86 0.87 1 92 VAL -2.61 0.97 1 93 SER -5.04 1.08 1 94 LYS -1.40 0.16 1 96 ASP 0.88 -0.06 1 97 HIS -3.34 0.17 1 98 SER -3.45 0.84 1 99 GLU -5.69 0.33 1 101 ARG -5.42 0.17 1 102 GLU -4.13 1.11 1 103 ILE -4.02 0.30 1 105 LEU 3.63 -0.26 1 106 ALA 4.23 -0.08 1 107 SER 3.73 -0.09 1 108 PHE 3.37 -0.48 1 109 GLU 4.32 -0.68 1 110 LYS 4.09 -0.38 1 111 ILE 4.57 -0.45 1 113 ARG 5.22 -0.39 1 114 ALA 3.40 -0.10 1 115 LEU 3.03 -0.23 1 116 LEU 1.32 -0.28 1 117 PHE 1.55 -0.16 1 118 ARG 1.70 -0.09 1 120 GLU -0.07 -0.15 1 121 PHE -0.16 -0.01 1 122 SER -0.39 -0.05 1 123 LEU 0.07 -0.08 1 125 GLN 0.42 -0.08 1 126 ASP 0.38 -0.06 1 127 SER 0.26 -0.05 1 128 VAL 0.50 -0.04 1 129 ILE 0.35 -0.04 1 130 LEU -0.33 0.10 1 131 THR -0.48 -0.04 1 132 ALA 0.31 -0.21 1 133 GLN 0.43 -0.23 1 138 LEU -0.15 0.11 1 142 VAL 1.29 -0.09 1 144 THR -0.16 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17734_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.26 _LACS_plot.Line_1_terminator_val_y_1 -2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.00 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 2.31 _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 93 SER -5.04 0.85 0 10 GLN 0.17 -0.22 1 11 ALA -0.06 -0.19 1 12 THR 0.58 -0.81 1 15 LYS 4.14 1.36 1 16 THR 5.44 1.98 1 17 ILE 4.10 1.07 1 18 LEU 4.42 0.31 1 19 GLU 3.98 2.32 1 20 TYR 3.61 2.47 1 21 ILE 5.72 1.65 1 22 ILE 5.98 3.86 1 23 ASN 4.03 2.08 1 24 PHE 4.53 0.87 1 25 PHE 2.59 0.46 1 26 THR 0.11 0.61 1 30 ILE 1.00 -0.10 1 31 ARG 0.76 0.41 1 34 ASN 0.36 0.30 1 36 THR 3.80 1.49 1 37 GLN 3.25 0.57 1 38 TYR 0.70 -0.12 1 39 GLN 5.23 1.52 1 40 GLU 3.93 2.57 1 41 LEU 4.03 -0.02 1 42 ILE 5.48 1.26 1 43 GLU 3.49 3.24 1 44 THR 5.89 3.24 1 45 MET 4.37 1.39 1 46 ALA 4.56 1.64 1 47 GLU 2.94 2.92 1 48 THR 6.59 2.96 1 49 LEU 4.07 0.61 1 50 LYS 4.12 1.86 1 51 SER 2.26 0.91 1 52 THR -0.27 -0.32 1 55 ASP -3.23 -0.17 1 56 ARG 3.23 -0.56 1 62 GLU 1.86 -0.61 1 63 ASN -4.45 -1.39 1 64 ILE -3.60 -2.32 1 65 ILE -2.76 -1.12 1 66 LEU -0.59 -2.21 1 67 ASP 1.66 -0.28 1 68 ASP -0.14 -2.11 1 69 MET 0.26 -1.64 1 70 ASP 2.05 -0.52 1 73 ARG -1.90 -0.36 1 74 VAL -2.46 -3.01 1 75 GLU -6.26 -2.57 1 76 PHE -3.07 -0.43 1 77 ASN -3.01 -1.39 1 81 GLU 0.91 0.22 1 82 ASN 1.02 -0.74 1 83 ASN -0.40 0.25 1 84 GLU 1.19 0.05 1 85 ALA 0.19 0.70 1 87 GLN -3.17 -1.40 1 88 VAL -0.06 -1.21 1 89 ILE -0.18 -1.39 1 90 VAL -2.68 -2.79 1 91 ARG -4.86 -0.93 1 92 VAL -2.61 -1.40 1 96 ASP 0.88 -1.07 1 97 HIS -3.34 -0.07 1 98 SER -3.45 -1.78 1 99 GLU -5.69 -1.86 1 100 THR -4.10 -0.24 1 101 ARG -5.42 -2.74 1 102 GLU -4.13 -0.36 1 105 LEU 3.63 0.36 1 106 ALA 4.23 3.32 1 107 SER 3.73 0.38 1 108 PHE 3.37 1.48 1 109 GLU 4.32 1.12 1 110 LYS 4.09 3.31 1 111 ILE 4.57 1.89 1 113 ARG 5.22 2.16 1 114 ALA 3.40 2.84 1 115 LEU 3.03 1.24 1 116 LEU 1.32 0.42 1 117 PHE 1.55 0.25 1 120 GLU -0.07 -0.58 1 121 PHE -0.16 -0.38 1 122 SER -0.39 -0.82 1 125 GLN 0.42 -0.09 1 126 ASP 0.38 -0.06 1 127 SER 0.26 -0.19 1 128 VAL 0.50 -0.50 1 129 ILE 0.35 -0.38 1 130 LEU -0.33 -0.35 1 131 THR -0.48 -1.44 1 138 LEU -0.15 -1.09 1 144 THR -0.16 -0.50 1 stop_ save_