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 bmr19235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.65 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 4.91 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 THR -1.81 -4.31 0 146 SER 4.82 -0.73 0 10 ILE -3.27 -1.30 1 11 LYS 2.92 -1.10 1 12 ALA -4.67 -1.74 1 13 SER 0.39 -0.25 1 15 GLU 4.36 3.06 1 16 LYS 3.71 2.53 1 17 ILE 5.18 3.95 1 18 TYR 4.37 4.78 1 19 GLN 5.13 3.91 1 20 ALA 2.73 1.57 1 21 LEU -2.41 -0.60 1 22 THR -2.67 -0.72 1 23 THR -6.50 -3.46 1 24 ASP 5.39 4.07 1 25 ASP 3.60 2.90 1 27 LEU 1.15 3.06 1 28 LYS 0.20 0.75 1 29 LYS 1.88 1.63 1 30 TRP -3.76 -1.91 1 31 TRP -0.20 -0.81 1 33 ASN 2.11 1.09 1 34 ASP -0.84 -1.50 1 35 ILE -3.98 -0.67 1 36 SER -3.12 -1.36 1 38 ALA 3.63 1.80 1 40 VAL -1.05 -1.07 1 41 VAL 5.71 4.00 1 43 SER 1.48 1.61 1 44 THR 0.78 0.64 1 45 ILE 0.59 -0.68 1 46 LYS 0.58 -0.57 1 47 PHE -0.59 -0.55 1 48 ARG -5.08 -3.42 1 49 PHE 0.10 -2.39 1 50 ASN 3.00 1.22 1 55 ASP -2.99 -2.62 1 56 PHE -4.04 -0.34 1 57 LYS -2.72 -1.89 1 58 VAL 2.73 1.56 1 59 THR 1.09 0.82 1 60 LYS -0.51 1.72 1 61 LEU -3.12 -0.75 1 62 ILE -0.33 -0.74 1 64 ASN 4.30 2.27 1 65 LYS -0.51 2.83 1 66 THR -2.71 0.93 1 67 VAL -3.52 -0.24 1 69 TRP -4.69 -0.81 1 70 GLN 3.76 5.99 1 71 HIS -4.27 -2.00 1 72 ALA -1.19 -0.47 1 74 ASN -4.02 -1.10 1 75 MET 4.48 3.75 1 77 GLU 2.14 1.88 1 78 SER -0.20 -2.84 1 79 TRP 3.77 3.01 1 80 MET -2.44 -0.13 1 82 THR -5.65 -1.77 1 83 GLU -4.64 -1.97 1 84 ILE -5.28 -2.68 1 85 SER -3.04 -1.55 1 86 PHE -3.05 -1.75 1 87 GLN -0.38 -0.81 1 88 LEU -3.86 -1.14 1 89 GLU 1.77 1.60 1 90 THR -1.61 -1.01 1 91 VAL -1.42 -1.04 1 94 GLN -0.44 -0.17 1 95 THR -0.01 0.48 1 96 PHE -0.32 -0.84 1 97 VAL 0.20 -1.20 1 98 ARG -4.94 -1.97 1 99 PHE -3.16 -1.83 1 100 THR -5.43 -2.09 1 101 HIS -3.80 -1.04 1 102 SER 3.66 1.29 1 103 ASN 2.70 0.82 1 104 TRP 2.41 4.43 1 105 HIS -4.67 -2.25 1 106 GLU 3.39 1.66 1 107 THR -5.92 -2.44 1 108 THR 4.19 3.26 1 109 ASP 4.18 3.01 1 110 PHE 5.80 4.49 1 111 MET 3.23 2.29 1 112 ALA 4.36 5.20 1 113 HIS 4.97 4.99 1 115 ASN 6.79 5.35 1 116 THR 3.51 0.90 1 117 LYS 1.35 2.27 1 118 TRP 3.73 3.02 1 119 ALA 5.77 3.97 1 121 PHE 5.21 2.48 1 122 LEU 4.96 2.79 1 123 LEU 3.56 2.36 1 124 SER 6.10 3.42 1 125 LEU 3.97 3.97 1 126 LYS 4.81 3.55 1 127 ASP 4.97 3.02 1 128 ALA 1.43 0.55 1 129 LEU 1.38 2.28 1 130 GLU -0.89 -0.11 1 131 ILE -1.31 -0.44 1 133 LYS -0.06 -1.51 1 135 THR 1.49 1.68 1 137 PHE 0.06 0.18 1 139 ASN -0.24 0.53 1 143 ILE -1.99 -1.43 1 144 ASP -3.79 -0.96 1 147 LEU 4.20 1.87 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 4.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.35 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -1.88 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 THR -1.81 -2.50 0 146 SER 4.82 -5.55 0 10 ILE -3.27 1.97 1 11 LYS 2.92 -4.02 1 12 ALA -4.67 2.93 1 13 SER 0.39 -0.64 1 15 GLU 4.36 -1.30 1 16 LYS 3.71 -1.18 1 17 ILE 5.18 -1.23 1 18 TYR 4.37 0.41 1 19 GLN 5.13 -1.22 1 20 ALA 2.73 -1.16 1 21 LEU -2.41 1.81 1 22 THR -2.67 1.95 1 23 THR -6.50 3.04 1 24 ASP 5.39 -1.32 1 25 ASP 3.60 -0.70 1 27 LEU 1.15 1.91 1 28 LYS 0.20 0.55 1 29 LYS 1.88 -0.25 1 30 TRP -3.76 1.85 1 31 TRP -0.20 -0.61 1 33 ASN 2.11 -1.02 1 34 ASP -0.84 -0.66 1 35 ILE -3.98 3.31 1 36 SER -3.12 1.76 1 38 ALA 3.63 -1.83 1 40 VAL -1.05 -0.02 1 41 VAL 5.71 -1.71 1 43 SER 1.48 0.13 1 44 THR 0.78 -0.14 1 45 ILE 0.59 -1.27 1 46 LYS 0.58 -1.15 1 47 PHE -0.59 0.04 1 48 ARG -5.08 1.66 1 49 PHE 0.10 -2.49 1 50 ASN 3.00 -1.78 1 55 ASP -2.99 0.37 1 56 PHE -4.04 3.70 1 57 LYS -2.72 0.83 1 58 VAL 2.73 -1.17 1 59 THR 1.09 -0.27 1 60 LYS -0.51 2.23 1 61 LEU -3.12 2.37 1 62 ILE -0.33 -0.41 1 64 ASN 4.30 -2.03 1 65 LYS -0.51 3.34 1 66 THR -2.71 3.64 1 67 VAL -3.52 3.28 1 69 TRP -4.69 3.88 1 70 GLN 3.76 2.23 1 71 HIS -4.27 2.27 1 72 ALA -1.19 0.72 1 74 ASN -4.02 2.92 1 75 MET 4.48 -0.73 1 77 GLU 2.14 -0.26 1 78 SER -0.20 -2.64 1 79 TRP 3.77 -0.76 1 80 MET -2.44 2.31 1 82 THR -5.65 3.88 1 83 GLU -4.64 2.67 1 84 ILE -5.28 2.60 1 85 SER -3.04 1.49 1 86 PHE -3.05 1.30 1 87 GLN -0.38 -0.43 1 88 LEU -3.86 2.72 1 89 GLU 1.77 -0.17 1 90 THR -1.61 0.60 1 91 VAL -1.42 0.38 1 94 GLN -0.44 0.27 1 95 THR -0.01 0.49 1 96 PHE -0.32 -0.52 1 97 VAL 0.20 -1.40 1 98 ARG -4.94 2.97 1 99 PHE -3.16 1.33 1 100 THR -5.43 3.34 1 101 HIS -3.80 2.76 1 102 SER 3.66 -2.37 1 103 ASN 2.70 -1.88 1 104 TRP 2.41 2.02 1 105 HIS -4.67 2.42 1 106 GLU 3.39 -1.73 1 107 THR -5.92 3.48 1 108 THR 4.19 -0.93 1 109 ASP 4.18 -1.17 1 110 PHE 5.80 -1.31 1 111 MET 3.23 -0.94 1 112 ALA 4.36 0.84 1 113 HIS 4.97 0.02 1 115 ASN 6.79 -1.44 1 116 THR 3.51 -2.61 1 117 LYS 1.35 0.92 1 118 TRP 3.73 -0.71 1 119 ALA 5.77 -1.80 1 121 PHE 5.21 -2.73 1 122 LEU 4.96 -2.17 1 123 LEU 3.56 -1.20 1 124 SER 6.10 -2.68 1 125 LEU 3.97 0.00 1 126 LYS 4.81 -1.26 1 127 ASP 4.97 -1.95 1 128 ALA 1.43 -0.88 1 129 LEU 1.38 0.90 1 130 GLU -0.89 0.78 1 131 ILE -1.31 0.87 1 133 LYS -0.06 -1.45 1 135 THR 1.49 0.19 1 137 PHE 0.06 0.12 1 139 ASN -0.24 0.77 1 143 ILE -1.99 0.56 1 144 ASP -3.79 2.83 1 147 LEU 4.20 -2.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 ALA 5.77 0.45 0 64 ASN 4.30 -1.28 0 110 PHE 5.80 -1.42 0 10 ILE -3.27 -0.49 1 11 LYS 2.92 0.17 1 12 ALA -4.67 0.20 1 13 SER 0.39 -0.19 1 15 GLU 4.36 -0.08 1 16 LYS 3.71 -0.29 1 17 ILE 5.18 -0.74 1 18 TYR 4.37 -0.79 1 19 GLN 5.13 -0.46 1 20 ALA 2.73 -0.19 1 21 LEU -2.41 -0.52 1 22 THR -2.67 0.21 1 23 THR -6.50 0.54 1 24 ASP 5.39 -0.40 1 25 ASP 3.60 -0.37 1 27 LEU 1.15 0.21 1 28 LYS 0.20 -0.06 1 29 LYS 1.88 -0.12 1 30 TRP -3.76 0.60 1 31 TRP -0.20 0.57 1 32 THR -1.81 0.71 1 33 ASN 2.11 -0.03 1 34 ASP -0.84 0.09 1 35 ILE -3.98 0.39 1 36 SER -3.12 0.13 1 38 ALA 3.63 -0.67 1 40 VAL -1.05 0.16 1 41 VAL 5.71 -0.55 1 43 SER 1.48 -0.09 1 44 THR 0.78 0.47 1 45 ILE 0.59 -0.33 1 46 LYS 0.58 0.20 1 47 PHE -0.59 -0.22 1 48 ARG -5.08 0.22 1 49 PHE 0.10 -0.82 1 50 ASN 3.00 -0.33 1 55 ASP -2.99 1.14 1 56 PHE -4.04 0.46 1 57 LYS -2.72 0.92 1 58 VAL 2.73 0.55 1 59 THR 1.09 0.37 1 60 LYS -0.51 0.11 1 61 LEU -3.12 0.87 1 62 ILE -0.33 0.32 1 65 LYS -0.51 0.49 1 66 THR -2.71 1.11 1 67 VAL -3.52 0.59 1 69 TRP -4.69 0.94 1 70 GLN 3.76 -0.74 1 71 HIS -4.27 0.39 1 72 ALA -1.19 0.52 1 74 ASN -4.02 0.23 1 75 MET 4.48 -0.55 1 77 GLU 2.14 -0.14 1 78 SER -0.20 -0.34 1 79 TRP 3.77 0.20 1 80 MET -2.44 0.57 1 82 THR -5.65 0.95 1 83 GLU -4.64 0.67 1 84 ILE -5.28 0.80 1 85 SER -3.04 0.19 1 86 PHE -3.05 1.08 1 87 GLN -0.38 1.11 1 88 LEU -3.86 0.44 1 89 GLU 1.77 0.48 1 90 THR -1.61 0.38 1 91 VAL -1.42 0.28 1 94 GLN -0.44 0.54 1 95 THR -0.01 0.11 1 96 PHE -0.32 0.40 1 97 VAL 0.20 -0.15 1 98 ARG -4.94 0.25 1 99 PHE -3.16 0.71 1 100 THR -5.43 0.31 1 101 HIS -3.80 0.55 1 102 SER 3.66 -0.35 1 103 ASN 2.70 -0.38 1 104 TRP 2.41 -0.26 1 105 HIS -4.67 0.18 1 106 GLU 3.39 -0.09 1 107 THR -5.92 0.37 1 108 THR 4.18 -0.07 1 111 MET 3.23 -0.48 1 112 ALA 4.36 -0.40 1 113 HIS 4.97 -0.03 1 115 ASN 6.79 -0.12 1 116 THR 3.51 -0.04 1 117 LYS 1.35 0.22 1 118 TRP 3.73 -0.90 1 121 PHE 5.21 -0.34 1 122 LEU 4.96 -0.33 1 123 LEU 3.56 0.12 1 124 SER 6.10 -0.67 1 125 LEU 3.97 0.25 1 126 LYS 4.81 -0.11 1 127 ASP 4.97 -0.59 1 128 ALA 1.43 -0.13 1 129 LEU 1.38 -0.05 1 130 GLU -0.89 0.54 1 131 ILE -1.31 0.33 1 133 LYS -0.06 -0.05 1 135 THR 1.49 0.19 1 137 PHE 0.06 0.23 1 139 ASN -0.24 -0.32 1 143 ILE -3.79 0.04 1 146 SER 4.82 0.10 1 147 LEU 4.20 -0.10 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.50 _LACS_plot.Line_1_terminator_val_y_1 -1.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 3.07 _LACS_plot.Y_axis_chem_shift_offset -0.88 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 ASN 4.30 -1.15 0 107 THR -5.92 1.68 0 32 THR -1.81 -3.63 0 100 THR -5.43 2.34 0 18 TYR 4.37 5.95 0 10 ILE -3.27 0.68 1 11 LYS 2.92 -1.66 1 12 ALA -4.67 -1.62 1 13 SER 0.39 1.10 1 15 GLU 4.36 3.97 1 16 LYS 3.71 4.68 1 17 ILE 5.18 1.47 1 19 GLN 5.13 2.87 1 20 ALA 2.73 -0.74 1 21 LEU -2.41 1.31 1 22 THR -2.67 1.09 1 23 THR -6.50 -0.25 1 24 ASP 5.39 2.76 1 25 ASP 3.60 3.15 1 27 LEU 1.15 3.40 1 28 LYS 0.20 2.67 1 29 LYS 1.88 2.27 1 30 TRP -3.76 0.87 1 31 TRP -0.20 -0.19 1 33 ASN 2.11 1.22 1 34 ASP -0.84 -2.14 1 35 ILE -3.98 -0.89 1 36 SER -3.12 -0.09 1 38 ALA 3.63 1.77 1 40 VAL -1.05 1.49 1 41 VAL 5.71 1.49 1 43 SER 1.48 -1.30 1 44 THR 0.78 -1.25 1 45 ILE 0.59 -0.24 1 46 LYS 0.58 -0.03 1 47 PHE -0.59 1.31 1 48 ARG -5.08 -1.26 1 49 PHE 0.10 -0.22 1 50 ASN 3.00 2.08 1 55 ASP -2.99 -0.16 1 56 PHE -4.04 -0.71 1 57 LYS -2.72 1.38 1 58 VAL 2.73 2.44 1 59 THR 1.09 2.30 1 60 LYS -0.51 -2.38 1 61 LEU -3.12 -0.09 1 62 ILE -0.33 0.20 1 65 LYS -0.51 -0.25 1 66 THR -2.71 -0.93 1 67 VAL -3.52 -0.21 1 69 TRP -4.69 0.29 1 70 GLN 3.76 1.15 1 71 HIS -4.27 -1.53 1 72 ALA -1.19 0.66 1 74 ASN -4.02 1.83 1 75 MET 4.48 4.43 1 77 GLU 2.14 0.26 1 78 SER -0.20 2.03 1 79 TRP 3.77 2.73 1 80 MET -2.44 0.53 1 82 THR -5.65 -1.29 1 83 GLU -4.64 -0.67 1 84 ILE -5.28 -1.46 1 85 SER -3.04 0.08 1 86 PHE -3.05 0.56 1 87 GLN -0.38 0.41 1 88 LEU -3.86 -0.59 1 89 GLU 1.77 0.87 1 90 THR -1.61 0.36 1 91 VAL -1.42 -2.19 1 94 GLN -0.44 0.90 1 95 THR -0.01 1.06 1 96 PHE -0.32 -0.42 1 97 VAL 0.20 -0.11 1 98 ARG -4.94 -1.01 1 99 PHE -3.16 -1.60 1 101 HIS -3.80 0.96 1 102 SER 3.66 1.43 1 103 ASN 2.70 3.22 1 104 TRP 2.41 2.77 1 105 HIS -4.67 -1.12 1 106 GLU 3.39 0.82 1 108 THR 4.19 2.80 1 109 ASP 4.18 3.25 1 110 PHE 5.80 2.36 1 111 MET 3.23 1.40 1 112 ALA 4.36 4.05 1 113 HIS 4.97 4.32 1 115 ASN 6.79 2.71 1 116 THR 3.51 3.65 1 117 LYS 1.35 4.02 1 118 TRP 3.73 1.93 1 119 ALA 5.77 3.01 1 121 PHE 5.21 2.55 1 122 LEU 4.96 2.10 1 123 LEU 3.56 3.15 1 124 SER 6.10 0.34 1 125 LEU 3.97 2.28 1 126 LYS 4.81 4.56 1 127 ASP 4.97 3.54 1 128 ALA 1.43 1.88 1 129 LEU 1.38 2.97 1 130 GLU -0.89 1.83 1 131 ILE -1.31 -0.74 1 133 LYS -0.06 -0.37 1 135 THR 0.06 -1.58 1 139 ASN -0.24 -0.67 1 143 ILE -1.99 -2.31 1 144 ASP -3.79 1.01 1 146 SER 4.82 -0.20 1 stop_ save_