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 bmr17076_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.46 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 5.84 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ILE -4.05 -5.20 0 10 VAL -4.44 -1.81 1 13 ARG -1.09 -1.17 1 17 ARG 6.16 6.76 1 19 GLN 4.64 2.04 1 20 MET 4.00 4.85 1 21 ALA 5.88 3.60 1 22 GLU 3.81 3.19 1 24 PHE 5.25 5.06 1 25 ALA 2.78 3.51 1 26 LYS 3.82 2.73 1 27 THR 3.89 3.67 1 28 LEU 1.94 1.77 1 30 ALA 2.73 1.79 1 32 LYS -0.94 1.27 1 33 ILE -5.69 -1.96 1 34 ALA -3.37 -1.61 1 35 VAL -2.72 -0.64 1 36 THR -2.98 -0.74 1 37 SER -3.58 -0.67 1 40 LEU 5.24 2.96 1 41 GLU -6.13 -2.17 1 42 SER -2.82 -1.02 1 43 SER -0.35 -0.81 1 44 ARG -3.01 -1.48 1 45 VAL 4.64 2.84 1 46 HIS -0.81 3.13 1 48 THR 6.21 3.97 1 49 ALA 4.89 3.71 1 50 ILE 5.33 4.58 1 51 ALA 3.84 2.90 1 52 MET -1.03 1.06 1 53 MET 3.77 -0.11 1 54 GLU 4.17 3.43 1 55 GLU 2.40 2.82 1 56 VAL -0.03 -2.49 1 58 ILE -2.71 -0.44 1 59 ASP -1.75 -1.82 1 60 ILE 0.48 0.02 1 61 SER 4.50 3.76 1 63 GLN 1.44 0.58 1 64 THR -1.49 -1.46 1 65 SER -2.72 -2.80 1 66 ASP -0.16 -0.23 1 68 ILE 3.46 3.81 1 69 GLU 3.57 2.23 1 70 ASN 1.53 -0.20 1 71 PHE -3.94 -0.57 1 72 ASN -2.53 -1.75 1 73 ALA 3.23 2.28 1 74 ASP 1.60 1.03 1 75 ASP 1.78 1.18 1 76 TYR 0.26 1.58 1 77 ASP -1.80 1.99 1 78 VAL -4.19 -1.93 1 79 VAL -3.70 -1.24 1 81 SER -3.39 -2.24 1 82 LEU -0.38 0.35 1 87 VAL -0.77 -0.40 1 88 ASN -2.90 -1.01 1 89 LEU 1.67 0.11 1 92 GLU 4.67 2.55 1 93 TRP 1.88 2.22 1 94 VAL 0.21 -1.81 1 95 THR 0.21 -0.95 1 96 GLN 1.45 -1.66 1 97 GLU 5.21 4.62 1 98 ILE -3.48 -0.68 1 99 PHE -3.84 -0.94 1 100 GLU -6.31 -1.65 1 101 ASP -3.41 -1.83 1 102 TRP -3.48 -3.58 1 103 GLN 2.86 0.62 1 104 LEU -5.19 -2.28 1 105 GLU 0.12 0.25 1 106 ASP -2.49 -1.94 1 108 ASP 2.09 2.50 1 110 GLN -1.57 -1.25 1 111 SER -1.85 -0.49 1 112 LEU 4.44 3.25 1 113 GLU 4.34 3.63 1 114 VAL 6.20 4.30 1 115 PHE 5.48 5.97 1 116 ARG 6.31 5.21 1 117 THR 6.49 5.24 1 118 VAL 5.50 4.38 1 119 ARG 4.42 4.65 1 121 GLN 3.60 3.06 1 122 VAL 6.72 5.11 1 123 LYS 6.39 5.03 1 124 GLU 2.67 2.50 1 125 ARG 7.27 2.99 1 126 VAL 7.50 5.65 1 127 GLU 4.38 4.06 1 128 ASN 3.40 2.98 1 129 LEU 3.12 3.20 1 130 ILE 5.71 4.46 1 131 ALA 3.12 2.28 1 132 LYS 1.87 2.08 1 133 ILE 0.31 0.29 1 134 SER 0.74 2.51 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17076_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 3.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.54 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 -1.65 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ILE -4.05 -1.15 0 10 VAL -4.44 2.63 1 13 ARG -1.09 -0.08 1 17 ARG 6.16 0.60 1 19 GLN 4.64 -2.60 1 20 MET 4.00 0.85 1 21 ALA 5.88 -2.28 1 22 GLU 3.81 -0.62 1 24 PHE 5.25 -0.19 1 25 ALA 2.78 0.73 1 26 LYS 3.82 -1.09 1 27 THR 3.89 -0.22 1 28 LEU 1.94 -0.17 1 30 ALA 2.73 -0.94 1 32 LYS -0.94 2.21 1 33 ILE -5.69 3.73 1 34 ALA -3.37 1.76 1 35 VAL -2.72 2.08 1 36 THR -2.98 2.24 1 37 SER -3.58 2.91 1 40 LEU 5.24 -2.28 1 41 GLU -6.13 3.96 1 42 SER -2.82 1.80 1 43 SER -0.35 -0.46 1 44 ARG -3.01 1.53 1 45 VAL 4.64 -1.80 1 46 HIS -0.81 3.94 1 48 THR 6.21 -2.24 1 49 ALA 4.89 -1.18 1 50 ILE 5.33 -0.75 1 51 ALA 3.84 -0.94 1 52 MET -1.03 2.09 1 53 MET 3.77 -3.88 1 54 GLU 4.17 -0.74 1 55 GLU 2.40 0.42 1 56 VAL -0.03 -2.46 1 58 ILE -2.71 2.27 1 59 ASP -1.75 -0.07 1 60 ILE 0.48 -0.46 1 61 SER 4.50 -0.74 1 63 GLN 1.44 -0.86 1 64 THR -1.49 0.03 1 65 SER -2.72 -0.08 1 66 ASP -0.16 -0.07 1 68 ILE 3.46 0.35 1 69 GLU 3.57 -1.34 1 70 ASN 1.53 -1.73 1 71 PHE -3.94 3.37 1 72 ASN -2.53 0.78 1 73 ALA 3.23 -0.95 1 74 ASP 1.60 -0.57 1 75 ASP 1.78 -0.60 1 76 TYR 0.26 1.32 1 77 ASP -1.80 3.79 1 78 VAL -4.19 2.26 1 79 VAL -3.70 2.46 1 81 SER -3.39 1.15 1 82 LEU -0.38 0.73 1 87 VAL -0.77 0.37 1 88 ASN -2.90 1.89 1 89 LEU 1.67 -1.56 1 92 GLU 4.67 -2.12 1 93 TRP 1.88 0.34 1 94 VAL 0.21 -2.02 1 95 THR 0.21 -1.16 1 96 GLN 1.45 -3.11 1 97 GLU 5.21 -0.59 1 98 ILE -3.48 2.80 1 99 PHE -3.84 2.90 1 100 GLU -6.31 4.66 1 101 ASP -3.41 1.58 1 102 TRP -3.48 -0.10 1 103 GLN 2.86 -2.24 1 104 LEU -5.19 2.91 1 105 GLU 0.12 0.13 1 106 ASP -2.49 0.55 1 108 ASP 2.09 0.41 1 110 GLN -1.57 0.32 1 111 SER -1.85 1.36 1 112 LEU 4.44 -1.19 1 113 GLU 4.34 -0.71 1 114 VAL 6.20 -1.90 1 115 PHE 5.48 0.49 1 116 ARG 6.31 -1.10 1 117 THR 6.49 -1.25 1 118 VAL 5.50 -1.12 1 119 ARG 4.42 0.23 1 121 GLN 3.60 -0.54 1 122 VAL 6.72 -1.61 1 123 LYS 6.39 -1.36 1 124 GLU 2.67 -0.17 1 125 ARG 7.27 -4.28 1 126 VAL 7.50 -1.85 1 127 GLU 4.38 -0.32 1 128 ASN 3.40 -0.42 1 129 LEU 3.12 0.08 1 130 ILE 5.71 -1.25 1 131 ALA 3.12 -0.84 1 132 LYS 1.87 0.21 1 133 ILE 0.31 -0.02 1 134 SER 0.74 1.77 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17076_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ALA 3.23 -2.43 0 10 VAL -4.44 1.22 1 13 ARG -1.09 0.95 1 17 ARG 6.16 -0.51 1 19 GLN 4.64 -0.29 1 20 MET 4.00 -0.62 1 21 ALA 5.88 -0.74 1 22 GLU 3.81 -0.67 1 24 PHE 5.25 -0.23 1 25 ALA 2.78 -0.41 1 26 LYS 3.82 -0.10 1 27 THR 3.89 -0.09 1 28 LEU 1.94 0.01 1 30 ALA 2.73 -0.01 1 32 LYS -0.94 0.27 1 33 ILE -5.69 0.84 1 34 ALA -3.37 0.61 1 35 VAL -2.72 1.08 1 36 THR -2.98 0.16 1 37 SER -3.58 1.18 1 40 LEU 5.24 -0.30 1 41 GLU -6.13 0.12 1 42 SER -2.82 -0.21 1 43 SER -0.35 -0.06 1 44 ARG -3.01 0.31 1 45 VAL 4.64 -0.35 1 46 HIS -0.81 -0.66 1 48 THR 6.21 -0.36 1 49 ALA 4.89 -0.41 1 50 ILE 5.33 -0.78 1 51 ALA 3.84 -0.06 1 52 MET -1.03 0.03 1 53 MET 3.77 0.30 1 54 GLU 4.17 -0.43 1 55 GLU 2.40 -0.19 1 56 VAL -0.03 0.63 1 58 ILE -2.71 -0.03 1 59 ASP -1.75 0.09 1 60 ILE 0.48 0.30 1 61 SER 4.50 -0.51 1 63 GLN 1.44 0.05 1 64 THR -1.49 0.06 1 65 SER -2.72 0.57 1 66 ASP -0.16 0.15 1 68 ILE 3.46 -0.05 1 69 GLU 3.57 0.04 1 70 ASN 1.53 -0.19 1 71 PHE -3.94 0.26 1 72 ASN -2.53 0.27 1 74 ASP 1.60 -0.41 1 75 ASP 1.78 -0.41 1 76 TYR 0.26 -0.46 1 77 ASP -1.80 0.31 1 78 VAL -4.19 0.50 1 79 VAL -3.70 0.54 1 80 ILE -4.05 0.28 1 81 SER -3.39 0.55 1 82 LEU -0.38 0.73 1 87 VAL -0.77 0.03 1 88 ASN -2.90 0.34 1 89 LEU 1.67 -0.31 1 92 GLU 4.67 -0.46 1 93 TRP 1.88 -0.56 1 94 VAL 0.21 0.08 1 95 THR 0.21 0.16 1 96 GLN 1.45 0.07 1 97 GLU 5.21 -0.46 1 98 ILE -3.48 0.30 1 99 PHE -3.84 1.28 1 100 GLU -6.31 -0.15 1 101 ASP -3.41 0.24 1 102 TRP -3.48 0.39 1 103 GLN 2.86 -0.08 1 104 LEU -5.19 0.33 1 105 GLU 0.12 -0.41 1 106 ASP -2.49 -0.43 1 108 ASP 2.09 -0.41 1 110 GLN -1.57 0.39 1 111 SER -1.85 0.04 1 112 LEU 4.44 -0.12 1 113 GLU 4.34 -0.25 1 114 VAL 6.20 -0.40 1 115 PHE 5.48 -0.96 1 116 ARG 6.31 -0.54 1 117 THR 6.49 -0.41 1 118 VAL 5.50 -0.24 1 119 ARG 4.42 -0.29 1 121 GLN 3.60 -0.25 1 122 VAL 6.72 -0.78 1 123 LYS 6.39 -1.72 1 124 GLU 2.67 -0.37 1 125 ARG 7.27 -0.79 1 126 VAL 7.50 -0.30 1 127 GLU 4.38 -0.57 1 128 ASN 3.40 -0.33 1 129 LEU 3.12 -0.05 1 130 ILE 5.71 -0.71 1 131 ALA 3.12 -0.13 1 132 LYS 1.87 0.03 1 133 ILE 0.31 0.39 1 134 SER 0.74 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17076_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 2.43 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 LEU 1.67 -4.39 0 10 VAL -4.44 -1.32 1 20 MET 4.00 0.62 1 21 ALA 5.88 -0.26 1 22 GLU 3.81 0.94 1 24 PHE 5.25 2.01 1 25 ALA 2.78 1.66 1 26 LYS 3.82 1.13 1 27 THR 3.89 1.73 1 28 LEU 1.94 0.90 1 30 ALA 2.73 0.86 1 32 LYS -0.94 -0.79 1 33 ILE -5.69 -2.90 1 34 ALA -3.37 -0.68 1 35 VAL -2.72 -1.76 1 36 THR -2.98 -3.39 1 37 SER -3.58 -1.72 1 40 LEU 5.24 1.13 1 41 GLU -6.13 -2.87 1 42 SER -2.82 0.02 1 43 SER -0.35 -1.18 1 44 ARG -3.01 -1.38 1 45 VAL 4.64 -0.99 1 46 HIS -0.81 3.13 1 48 THR 6.21 2.22 1 49 ALA 4.89 1.16 1 50 ILE 5.33 3.10 1 51 ALA 3.84 3.01 1 52 MET -1.03 3.43 1 53 MET 3.77 2.78 1 54 GLU 4.17 4.06 1 55 GLU 2.40 1.52 1 56 VAL -0.03 -0.49 1 58 ILE -2.71 -2.86 1 59 ASP -1.75 1.12 1 60 ILE 0.48 0.45 1 61 SER 4.50 0.44 1 63 GLN 1.44 -1.12 1 64 THR -1.49 0.88 1 65 SER -2.72 -0.29 1 66 ASP -0.16 -2.23 1 68 ILE 3.46 -0.13 1 69 GLU 3.57 0.25 1 70 ASN 1.53 -1.28 1 71 PHE -3.94 -2.72 1 72 ASN -2.53 -0.24 1 73 ALA 3.23 -0.49 1 74 ASP 1.60 1.24 1 75 ASP 1.78 -0.72 1 76 TYR 0.26 -2.06 1 77 ASP -1.80 -1.99 1 78 VAL -4.19 -2.69 1 79 VAL -3.70 -3.76 1 80 ILE -4.05 -0.17 1 81 SER -3.39 0.02 1 82 LEU -0.38 -1.06 1 87 VAL -0.77 -2.15 1 88 ASN -2.90 -0.78 1 92 GLU 4.67 0.94 1 93 TRP 1.88 0.28 1 94 VAL 0.21 0.70 1 95 THR 0.21 0.88 1 96 GLN 1.45 -0.81 1 97 GLU 5.21 0.90 1 98 ILE -3.48 -1.05 1 99 PHE -3.84 -0.42 1 100 GLU -6.31 -4.91 1 101 ASP -3.41 -0.80 1 102 TRP -3.48 -0.68 1 103 GLN 2.86 -2.27 1 104 LEU -5.19 -1.06 1 105 GLU 0.12 -2.18 1 106 ASP -2.49 1.27 1 108 ASP 2.09 1.62 1 110 GLN -1.57 -1.12 1 111 SER -1.85 0.75 1 112 LEU 4.44 1.44 1 113 GLU 4.34 3.06 1 114 VAL 6.20 2.43 1 115 PHE 5.48 3.28 1 116 ARG 6.31 3.28 1 117 THR 6.49 2.69 1 118 VAL 5.50 1.20 1 119 ARG 4.42 1.55 1 121 GLN 3.60 3.58 1 122 VAL 6.72 0.51 1 123 LYS 6.39 0.79 1 124 GLU 2.67 2.36 1 125 ARG 7.27 3.09 1 126 VAL 7.50 1.09 1 127 GLU 4.38 3.33 1 128 ASN 3.40 1.96 1 129 LEU 3.12 0.90 1 130 ILE 5.71 1.99 1 131 ALA 3.12 1.47 1 132 LYS 1.87 1.90 1 133 ILE 0.31 -1.40 1 134 SER 0.74 3.67 1 stop_ save_