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 bmr30004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.04 _LACS_plot.Line_1_terminator_val_y_1 -1.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 6.56 _LACS_plot.Line_2_terminator_val_y_2 5.24 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 LYS 0.56 -1.22 0 86 HIS 3.05 4.43 0 10 ILE 5.80 4.88 1 11 GLN 4.62 3.49 1 12 ARG 4.18 3.19 1 14 ILE 5.34 3.48 1 15 GLN 5.09 3.49 1 16 SER 4.80 3.70 1 17 LEU 3.93 3.39 1 18 VAL 6.30 5.19 1 19 HIS 6.56 5.13 1 20 ALA 1.74 2.71 1 22 GLN -1.47 -0.49 1 24 ARG -0.50 -1.49 1 25 ASN -1.32 -1.17 1 26 ALA 3.34 2.67 1 27 ASN -1.08 -1.17 1 29 SER -0.82 -0.51 1 30 LEU 1.72 1.17 1 32 SER 3.40 2.30 1 34 GLN 5.32 3.96 1 35 LYS 3.61 3.23 1 36 MET 3.04 1.22 1 37 LYS 5.01 5.10 1 38 ARG 4.41 3.66 1 39 VAL 6.31 4.96 1 40 VAL 6.53 5.42 1 41 GLN 3.91 3.02 1 42 HIS 6.32 4.66 1 43 THR 5.43 4.89 1 44 LYS 1.73 1.12 1 47 LYS 0.32 0.18 1 48 ARG 3.01 2.49 1 49 LYS 1.26 0.18 1 50 THR 1.67 0.90 1 51 ASN 0.33 0.24 1 56 VAL 4.43 4.25 1 58 LYS 4.07 3.69 1 60 LEU 4.87 3.62 1 62 ALA 4.32 3.65 1 63 LEU 3.46 3.62 1 66 TYR 5.03 4.57 1 67 HIS 5.86 4.66 1 68 ALA 1.50 2.71 1 69 LYS 2.67 2.29 1 70 HIS -1.17 0.21 1 72 GLN -1.23 -1.19 1 73 GLU -1.87 -0.92 1 74 ASN 1.73 1.64 1 78 VAL 3.25 2.44 1 80 PHE 1.81 -0.15 1 82 LEU 4.40 3.39 1 84 ILE 5.34 4.65 1 85 LYS 5.94 5.33 1 87 LYS 1.96 1.35 1 88 LEU 2.76 1.98 1 89 ARG 2.54 1.79 1 90 GLN 1.58 1.15 1 91 GLN 0.17 0.45 1 92 GLN 0.64 0.68 1 99 GLU -3.04 -2.09 1 100 GLU -0.88 0.07 1 102 GLN -0.77 -0.26 1 103 SER -0.59 -0.28 1 104 ASP -1.23 -0.27 1 106 SER 0.81 0.89 1 107 VAL -0.96 -0.67 1 108 GLU -0.41 0.07 1 111 LEU -0.05 -0.36 1 112 SER -0.12 -0.04 1 113 GLN 1.57 0.68 1 114 GLU 1.40 1.19 1 115 THR 4.95 4.18 1 116 PHE 2.28 0.79 1 117 SER 0.11 0.19 1 118 ASP 2.60 2.65 1 119 LEU 2.53 2.22 1 120 TRP 2.32 1.93 1 121 LYS 2.43 1.59 1 122 LEU 0.65 0.11 1 123 LEU 0.31 -0.70 1 125 GLU 1.40 1.19 1 126 ASN 0.79 0.47 1 127 ASN 0.32 0.70 1 128 VAL 0.92 0.74 1 129 LEU 0.19 -0.12 1 130 SER -0.83 -0.49 1 132 LEU -0.39 0.00 1 134 SER 0.82 0.66 1 135 GLN 0.87 0.68 1 136 ALA 0.56 0.60 1 137 MET 0.93 0.75 1 138 ASP 1.19 1.24 1 139 ASP 0.96 1.01 1 140 LEU 0.65 0.81 1 141 MET 0.93 0.75 1 142 LEU -0.98 -0.59 1 143 SER -0.83 -0.49 1 145 ASP 0.96 1.01 1 146 ASP 0.49 0.54 1 148 GLU 2.58 2.12 1 149 GLN 1.34 0.68 1 150 TRP 0.45 0.29 1 151 PHE 1.58 0.09 1 152 THR 0.73 0.90 1 153 GLU -0.93 -0.45 1 154 ASP -0.53 -0.04 1 158 ASP 0.72 1.95 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.04 _LACS_plot.Line_1_terminator_val_y_1 1.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 6.56 _LACS_plot.Line_2_terminator_val_y_2 -1.32 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 LYS 0.56 -1.78 0 86 HIS 3.05 1.38 0 10 ILE 5.80 -0.92 1 11 GLN 4.62 -1.13 1 12 ARG 4.18 -0.99 1 14 ILE 5.34 -1.86 1 15 GLN 5.09 -1.60 1 16 SER 4.80 -1.10 1 17 LEU 3.93 -0.54 1 18 VAL 6.30 -1.11 1 19 HIS 6.56 -1.43 1 20 ALA 1.74 0.97 1 22 GLN -1.47 0.98 1 24 ARG -0.50 -0.99 1 25 ASN -1.32 0.15 1 26 ALA 3.34 -0.67 1 27 ASN -1.08 -0.09 1 29 SER -0.82 0.31 1 30 LEU 1.72 -0.55 1 32 SER 3.40 -1.10 1 34 GLN 5.32 -1.36 1 35 LYS 3.61 -0.38 1 36 MET 3.04 -1.82 1 37 LYS 5.01 0.09 1 38 ARG 4.41 -0.75 1 39 VAL 6.31 -1.35 1 40 VAL 6.53 -1.11 1 41 GLN 3.91 -0.89 1 42 HIS 6.32 -1.66 1 43 THR 5.43 -0.54 1 44 LYS 1.73 -0.61 1 47 LYS 0.32 -0.14 1 48 ARG 3.01 -0.52 1 49 LYS 1.26 -1.08 1 50 THR 1.67 -0.77 1 51 ASN 0.33 -0.09 1 56 VAL 4.43 -0.18 1 58 LYS 4.07 -0.38 1 60 LEU 4.87 -1.25 1 62 ALA 4.32 -0.67 1 63 LEU 3.46 0.16 1 66 TYR 5.03 -0.46 1 67 HIS 5.86 -1.20 1 68 ALA 1.50 1.21 1 69 LYS 2.67 -0.38 1 70 HIS -1.17 1.38 1 72 GLN -1.23 0.04 1 73 GLU -1.87 0.95 1 74 ASN 1.73 -0.09 1 78 VAL 3.25 -0.81 1 80 PHE 1.81 -1.96 1 82 LEU 4.40 -1.01 1 84 ILE 5.34 -0.69 1 85 LYS 5.94 -0.61 1 87 LYS 1.96 -0.61 1 88 LEU 2.76 -0.78 1 89 ARG 2.54 -0.75 1 90 GLN 1.58 -0.43 1 91 GLN 0.17 0.28 1 92 GLN 0.64 0.04 1 99 GLU -3.04 0.95 1 100 GLU -0.88 0.95 1 102 GLN -0.77 0.51 1 103 SER -0.59 0.31 1 104 ASP -1.23 0.96 1 106 SER 0.81 0.08 1 107 VAL -0.96 0.29 1 108 GLU -0.41 0.48 1 111 LEU -0.05 -0.31 1 112 SER -0.12 0.08 1 113 GLN 1.57 -0.89 1 114 GLU 1.40 -0.21 1 115 THR 4.95 -0.77 1 116 PHE 2.28 -1.49 1 117 SER 0.11 0.08 1 118 ASP 2.60 0.05 1 119 LEU 2.53 -0.31 1 120 TRP 2.32 -0.39 1 121 LYS 2.43 -0.84 1 122 LEU 0.65 -0.54 1 123 LEU 0.31 -1.01 1 125 GLU 1.40 -0.21 1 126 ASN 0.79 -0.32 1 127 ASN 0.32 0.38 1 128 VAL 0.92 -0.18 1 129 LEU 0.19 -0.31 1 130 SER -0.83 0.34 1 132 LEU -0.39 0.39 1 134 SER 0.82 -0.16 1 135 GLN 0.87 -0.19 1 136 ALA 0.56 0.04 1 137 MET 0.93 -0.18 1 138 ASP 1.19 0.05 1 139 ASP 0.96 0.05 1 140 LEU 0.65 0.16 1 141 MET 0.93 -0.18 1 142 LEU -0.98 0.39 1 143 SER -0.83 0.34 1 145 ASP 0.96 0.05 1 146 ASP 0.49 0.05 1 148 GLU 2.58 -0.46 1 149 GLN 1.34 -0.66 1 150 TRP 0.45 -0.16 1 151 PHE 1.58 -1.49 1 152 THR 0.73 0.17 1 153 GLU -0.93 0.48 1 154 ASP -0.53 0.49 1 158 ASP 0.72 1.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.04 _LACS_plot.Line_1_terminator_val_y_1 0.18 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 6.56 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 LEU 4.87 0.02 0 120 TRP 2.32 -0.70 0 10 ILE 5.80 -0.66 1 11 GLN 4.62 -0.22 1 12 ARG 4.18 -0.22 1 14 ILE 5.34 -0.45 1 15 GLN 5.09 -0.29 1 16 SER 4.80 -0.08 1 17 LEU 3.93 -0.27 1 18 VAL 6.30 -0.78 1 19 HIS 6.56 -0.56 1 20 ALA 1.74 -0.04 1 22 GLN -1.47 0.11 1 24 ARG -0.50 0.27 1 25 ASN -1.32 0.10 1 26 ALA 3.34 -0.22 1 27 ASN -1.08 0.10 1 29 SER -0.82 0.14 1 30 LEU 1.72 -0.18 1 32 SER 3.40 -0.24 1 34 GLN 5.32 -0.38 1 35 LYS 3.61 -0.28 1 36 MET 3.04 0.02 1 37 LYS 5.01 -0.45 1 38 ARG 4.41 -0.19 1 39 VAL 6.31 -0.52 1 40 VAL 6.53 -0.63 1 41 GLN 3.91 -0.36 1 42 HIS 6.32 -0.48 1 43 THR 5.43 -0.50 1 44 LYS 1.73 -0.37 1 47 LYS 0.32 0.21 1 48 ARG 3.01 -0.07 1 49 LYS 1.26 0.22 1 50 THR 1.67 -0.09 1 51 ASN 0.33 0.11 1 56 VAL 4.43 -0.42 1 58 LYS 4.07 -0.52 1 62 ALA 4.32 -0.23 1 63 LEU 3.46 -0.17 1 66 TYR 5.03 -0.45 1 67 HIS 5.86 -0.48 1 68 ALA 1.50 -0.21 1 69 LYS 2.67 -0.55 1 70 HIS -1.17 -0.09 1 72 GLN -1.23 0.32 1 73 GLU -1.87 0.03 1 74 ASN 1.73 -0.18 1 75 LYS 0.56 0.05 1 78 VAL 3.25 -0.69 1 80 PHE 1.81 -0.16 1 82 LEU 4.40 -0.37 1 84 ILE 5.34 -0.82 1 85 LYS 5.94 -0.51 1 86 HIS 3.05 -0.40 1 87 LYS 1.96 -0.35 1 88 LEU 2.76 -0.17 1 89 ARG 2.54 -0.15 1 90 GLN 1.58 -0.06 1 91 GLN 0.17 0.01 1 92 GLN 0.64 0.00 1 99 GLU -3.04 0.31 1 100 GLU -0.88 -0.06 1 102 GLN -0.77 0.01 1 103 SER -0.59 -0.10 1 104 ASP -1.23 -0.02 1 106 SER 0.81 -0.11 1 107 VAL -0.96 0.06 1 108 GLU -0.41 -0.16 1 111 LEU -0.05 0.29 1 112 SER -0.12 0.01 1 113 GLN 1.57 -0.04 1 114 GLU 1.40 -0.32 1 115 THR 4.95 -0.26 1 116 PHE 2.28 -0.36 1 117 SER 0.11 0.02 1 118 ASP 2.60 -0.21 1 119 LEU 2.53 -0.39 1 121 LYS 2.43 -0.30 1 122 LEU 0.65 -0.19 1 123 LEU 0.31 -0.26 1 125 GLU 1.40 -0.27 1 126 ASN 0.79 -0.12 1 127 ASN 0.32 -0.03 1 128 VAL 0.92 -0.04 1 129 LEU 0.19 0.00 1 130 SER -0.83 -0.04 1 132 LEU -0.39 -0.06 1 134 SER 0.82 -0.11 1 135 GLN 0.87 -0.02 1 136 ALA 0.56 -0.02 1 137 MET 0.93 -0.07 1 138 ASP 1.19 -0.10 1 139 ASP 0.96 -0.10 1 140 LEU 0.65 -0.12 1 141 MET 0.93 -0.07 1 142 LEU -0.98 0.04 1 143 SER -0.83 -0.04 1 145 ASP 0.96 -0.19 1 146 ASP 0.49 -0.14 1 148 GLU 2.58 -0.33 1 149 GLN 1.34 -0.09 1 150 TRP 0.45 -0.23 1 151 PHE 1.58 -0.10 1 152 THR 0.73 -0.08 1 153 GLU -0.93 -0.04 1 154 ASP -0.53 -0.13 1 158 ASP 0.72 -0.25 1 stop_ save_