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 bmr15020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.43 _LACS_plot.Line_1_terminator_val_y_1 -3.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 9.59 _LACS_plot.Line_2_terminator_val_y_2 7.33 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 LEU 3.58 -0.94 0 90 ASN 9.60 8.24 0 11 ILE 1.97 2.12 1 12 SER 3.03 2.13 1 13 ASP -0.32 0.77 1 14 LEU 2.20 -0.55 1 20 TYR -2.35 0.02 1 21 VAL -2.03 -1.24 1 22 GLN 1.61 0.60 1 23 THR -3.35 -1.57 1 24 THR 2.34 1.62 1 25 LYS -2.58 -1.07 1 26 SER -2.63 -1.92 1 27 TYR -0.03 0.52 1 29 SER 4.85 2.98 1 30 LYS 0.53 0.31 1 31 LEU 1.21 1.33 1 32 ALA 0.85 0.73 1 53 LEU -1.31 0.52 1 58 VAL -2.85 -0.52 1 59 THR 3.64 2.39 1 60 MET -0.36 1.51 1 61 SER -0.22 0.83 1 62 SER -4.79 -0.84 1 63 ALA -4.67 0.05 1 64 VAL 3.74 2.63 1 65 VAL -6.55 -2.21 1 66 GLN -3.96 -0.89 1 67 LEU -3.00 -0.94 1 68 TYR -5.61 -1.47 1 69 ALA -6.02 -1.78 1 70 ALA -1.44 -1.58 1 71 ASP -1.26 -0.49 1 72 ARG 1.21 1.20 1 73 ASN 0.61 0.74 1 75 MET -3.93 -1.60 1 76 TRP -3.39 -0.51 1 77 SER -2.26 -0.99 1 78 LYS 3.11 1.85 1 79 LYS -1.22 -0.61 1 81 SER -3.35 -1.43 1 83 VAL -1.55 -0.92 1 84 ALA -2.95 -1.62 1 86 LEU -0.81 -0.61 1 87 VAL -4.32 -0.76 1 88 LYS -1.69 -0.14 1 89 ASP -4.04 -2.02 1 92 GLN 0.53 0.99 1 94 SER -3.52 -2.81 1 95 TYR -5.55 -1.19 1 96 PHE -6.88 -1.48 1 97 LEU -2.24 -0.98 1 98 ARG -6.06 -0.59 1 99 ILE -2.43 -1.40 1 100 PHE -4.79 -1.88 1 101 ASP -2.10 0.93 1 102 ILE 1.96 3.41 1 103 LYS 2.13 2.08 1 106 LYS 0.99 1.24 1 107 LEU 1.78 1.49 1 108 LEU -2.06 0.43 1 109 TRP -1.50 0.74 1 110 GLU -7.93 -1.79 1 111 GLN -7.10 -1.86 1 112 GLU 0.54 0.54 1 114 TYR -0.98 -2.44 1 115 ASN 3.35 2.76 1 116 ASN 4.57 2.36 1 117 PHE 2.50 2.40 1 118 VAL -1.39 0.05 1 119 TYR -2.86 0.15 1 120 ASN -2.50 -0.28 1 121 SER -2.93 -2.36 1 123 ARG -6.70 -3.50 1 125 TYR -3.67 -3.62 1 126 PHE -4.13 -0.03 1 127 HIS -8.18 -2.53 1 128 THR -5.38 -2.46 1 129 PHE -2.40 -0.83 1 130 ALA 1.58 0.37 1 133 THR -1.73 0.02 1 135 GLN 2.83 1.71 1 136 VAL -3.40 -1.03 1 137 ALA -9.43 -2.65 1 138 LEU -4.61 -2.23 1 139 ASN -4.99 -1.65 1 140 PHE -0.04 1.03 1 141 ALA 1.21 0.69 1 142 ASN -3.20 -0.23 1 143 GLU 3.56 3.71 1 144 GLU 4.73 3.71 1 145 GLU 2.42 3.06 1 146 ALA 2.73 3.05 1 147 LYS 4.09 3.95 1 148 LYS 3.95 3.66 1 149 PHE 2.62 4.14 1 150 ARG 4.41 3.66 1 151 LYS 4.08 3.14 1 152 ALA 3.68 2.67 1 153 VAL 5.28 4.61 1 154 THR 5.33 4.61 1 155 ASP 3.87 3.07 1 156 LEU 3.71 2.82 1 157 LEU 3.52 2.34 1 159 ARG 2.58 2.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.43 _LACS_plot.Line_1_terminator_val_y_1 6.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.88 _LACS_plot.Line_2_terminator_val_x_2 9.59 _LACS_plot.Line_2_terminator_val_y_2 -2.26 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 LEU 3.58 -4.52 0 90 ASN 9.60 -1.36 0 11 ILE 1.97 0.15 1 12 SER 3.03 -0.90 1 13 ASP -0.32 1.09 1 14 LEU 2.20 -2.75 1 20 TYR -2.35 2.37 1 21 VAL -2.03 0.79 1 22 GLN 1.61 -1.01 1 23 THR -3.35 1.78 1 24 THR 2.34 -0.72 1 25 LYS -2.58 1.51 1 26 SER -2.63 0.71 1 27 TYR -0.03 0.55 1 29 SER 4.85 -1.87 1 30 LYS 0.53 -0.22 1 31 LEU 1.21 0.12 1 32 ALA 0.85 -0.12 1 53 LEU -1.31 1.83 1 58 VAL -2.85 2.33 1 59 THR 3.64 -1.25 1 60 MET -0.36 1.87 1 61 SER -0.22 1.05 1 62 SER -4.79 3.95 1 63 ALA -4.67 4.72 1 64 VAL 3.74 -1.11 1 65 VAL -6.55 4.34 1 66 GLN -3.96 3.07 1 67 LEU -3.00 2.06 1 68 TYR -5.61 4.14 1 69 ALA -6.02 4.24 1 70 ALA -1.44 -0.14 1 71 ASP -1.26 0.77 1 72 ARG 1.21 -0.01 1 73 ASN 0.61 0.13 1 75 MET -3.93 2.33 1 76 TRP -3.39 2.88 1 77 SER -2.26 1.27 1 78 LYS 3.11 -1.26 1 79 LYS -1.22 0.61 1 81 SER -3.35 1.92 1 83 VAL -1.55 0.63 1 84 ALA -2.95 1.33 1 86 LEU -0.81 0.20 1 87 VAL -4.32 3.56 1 88 LYS -1.69 1.55 1 89 ASP -4.04 2.02 1 92 GLN 0.53 0.46 1 94 SER -3.52 0.71 1 95 TYR -5.55 4.36 1 96 PHE -6.88 5.40 1 97 LEU -2.24 1.26 1 98 ARG -6.06 5.47 1 99 ILE -2.43 1.03 1 100 PHE -4.79 2.91 1 101 ASP -2.10 3.03 1 102 ILE 1.96 1.45 1 103 LYS 2.13 -0.05 1 106 LYS 0.99 0.25 1 107 LEU 1.78 -0.29 1 108 LEU -2.06 2.49 1 109 TRP -1.50 2.24 1 110 GLU -7.93 6.14 1 111 GLN -7.10 5.24 1 112 GLU 0.54 0.00 1 114 TYR -0.98 -1.46 1 115 ASN 3.35 -0.59 1 116 ASN 4.57 -2.21 1 117 PHE 2.50 -0.10 1 118 VAL -1.39 1.44 1 119 TYR -2.86 3.01 1 120 ASN -2.50 2.22 1 121 SER -2.93 0.57 1 123 ARG -6.70 3.20 1 125 TYR -3.67 0.05 1 126 PHE -4.13 4.10 1 127 HIS -8.18 5.65 1 128 THR -5.38 2.92 1 129 PHE -2.40 1.57 1 130 ALA 1.58 -1.21 1 133 THR -1.73 1.75 1 135 GLN 2.83 -1.12 1 136 VAL -3.40 2.37 1 137 ALA -9.43 6.78 1 138 LEU -4.61 2.38 1 139 ASN -4.99 3.34 1 140 PHE -0.04 1.07 1 141 ALA 1.21 -0.52 1 142 ASN -3.20 2.97 1 143 GLU 3.56 0.15 1 144 GLU 4.73 -1.02 1 145 GLU 2.42 0.64 1 146 ALA 2.73 0.32 1 147 LYS 4.09 -0.14 1 148 LYS 3.95 -0.29 1 149 PHE 2.62 1.52 1 150 ARG 4.41 -0.75 1 151 LYS 4.08 -0.94 1 152 ALA 3.68 -1.01 1 153 VAL 5.28 -0.67 1 154 THR 5.33 -0.72 1 155 ASP 3.87 -0.80 1 156 LEU 3.71 -0.89 1 157 LEU 3.52 -1.18 1 159 ARG 2.58 -0.36 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.43 _LACS_plot.Line_1_terminator_val_y_1 0.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 9.59 _LACS_plot.Line_2_terminator_val_y_2 -0.95 _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 62 SER -4.79 1.94 0 11 ILE 1.97 -0.50 1 12 SER 3.03 -0.30 1 13 ASP -0.32 0.15 1 14 LEU 2.20 -0.67 1 20 TYR -2.35 -0.01 1 21 VAL -2.03 -0.13 1 22 GLN 1.61 -0.26 1 23 THR -3.35 0.14 1 24 THR 2.34 -0.15 1 25 LYS -2.58 0.01 1 26 SER -2.63 0.36 1 27 TYR -0.03 -0.28 1 29 SER 4.85 -0.23 1 30 LYS 0.53 -0.02 1 31 LEU 1.21 -0.08 1 32 ALA 0.85 -0.07 1 58 VAL -2.85 0.15 1 59 THR 3.64 0.10 1 60 MET -0.36 -0.11 1 61 SER -0.22 0.08 1 63 ALA -4.67 0.38 1 64 VAL 3.74 0.33 1 65 VAL -6.55 1.42 1 66 GLN -3.96 0.03 1 67 LEU -3.00 0.45 1 68 TYR -5.61 0.46 1 69 ALA -6.02 1.11 1 70 ALA -1.44 0.54 1 71 ASP -1.26 -0.08 1 72 ARG 1.21 -0.06 1 73 ASN 0.61 -0.03 1 75 MET -3.93 -0.05 1 76 TRP -3.39 0.14 1 77 SER -2.26 0.40 1 78 LYS 3.11 -0.97 1 79 LYS -1.22 0.12 1 81 SER -3.35 0.47 1 83 VAL -1.55 0.43 1 84 ALA -2.95 0.86 1 86 LEU -0.81 0.76 1 87 VAL -4.32 0.89 1 88 LYS -1.69 -0.31 1 89 ASP -4.04 0.43 1 90 ASN 9.60 -0.32 1 92 GLN 0.53 -0.26 1 94 SER -3.52 -0.28 1 95 TYR -5.55 1.07 1 96 PHE -6.88 0.35 1 97 LEU -2.24 1.07 1 98 ARG -6.06 0.80 1 99 ILE -2.43 1.01 1 100 PHE -4.79 0.76 1 101 ASP -2.10 0.12 1 102 ILE 1.96 -0.25 1 103 LYS 2.13 -0.03 1 106 LYS 0.99 -0.07 1 107 LEU 1.78 -0.20 1 108 LEU -2.06 0.15 1 109 TRP -1.50 -0.23 1 110 GLU -7.93 0.65 1 111 GLN -7.10 0.16 1 112 GLU 0.54 -0.66 1 113 LEU 3.58 -0.84 1 114 TYR -0.98 -0.28 1 115 ASN 3.35 -0.27 1 116 ASN 4.57 -0.38 1 117 PHE 2.50 -0.85 1 118 VAL -1.39 -0.01 1 119 TYR -2.86 0.12 1 120 ASN -2.50 0.26 1 121 SER -2.93 0.51 1 123 ARG -6.70 0.31 1 125 TYR -3.67 -0.06 1 126 PHE -4.13 1.28 1 127 HIS -8.18 0.94 1 128 THR -5.38 0.70 1 129 PHE -2.40 0.10 1 130 ALA 1.58 0.39 1 133 THR -1.73 0.39 1 135 GLN 2.83 0.42 1 136 VAL -3.40 0.88 1 137 ALA -9.43 0.27 1 138 LEU -4.61 0.25 1 139 ASN -4.99 1.31 1 140 PHE -0.04 -0.17 1 141 ALA 1.21 -0.57 1 142 ASN -3.20 0.28 1 143 GLU 3.56 -0.46 1 144 GLU 4.73 -0.17 1 145 GLU 2.42 -0.16 1 146 ALA 2.73 -1.14 1 147 LYS 4.09 -0.28 1 148 LYS 3.95 -0.25 1 149 PHE 2.62 -0.36 1 150 ARG 4.41 -0.51 1 151 LYS 4.08 -0.44 1 152 ALA 3.68 -0.32 1 153 VAL 5.28 -1.04 1 154 THR 5.33 -0.52 1 155 ASP 3.87 -0.26 1 156 LEU 3.71 -0.47 1 157 LEU 3.52 -0.47 1 159 ARG 2.58 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15020_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.43 _LACS_plot.Line_1_terminator_val_y_1 -3.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.02 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 1.92 _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 113 LEU 3.58 -3.00 0 127 HIS -8.18 0.61 0 11 ILE 1.97 1.02 1 12 SER 3.03 0.78 1 13 ASP -0.32 -0.40 1 20 TYR -2.35 -1.10 1 21 VAL -2.03 -1.71 1 22 GLN 1.61 -0.39 1 24 THR 2.34 -0.11 1 25 LYS -2.58 -1.72 1 26 SER -2.63 -1.22 1 29 SER 4.85 2.25 1 30 LYS 0.53 1.75 1 31 LEU 1.21 0.79 1 32 ALA 0.85 0.76 1 53 LEU -1.31 -0.42 1 58 VAL -2.85 -0.55 1 59 THR 3.64 0.10 1 60 MET -0.36 0.00 1 61 SER -0.22 -1.18 1 62 SER -4.79 -1.05 1 63 ALA -4.67 -2.23 1 64 VAL 3.74 1.07 1 65 VAL -6.55 -0.32 1 66 GLN -3.96 -1.85 1 67 LEU -3.00 -2.56 1 68 TYR -5.61 -2.49 1 69 ALA -6.02 -0.54 1 70 ALA -1.44 -0.50 1 71 ASP -1.26 1.26 1 72 ARG 1.21 0.02 1 73 ASN 0.61 -0.88 1 75 MET -3.93 -0.76 1 76 TRP -3.39 0.79 1 77 SER -2.26 -0.48 1 78 LYS 3.11 -0.05 1 79 LYS -1.22 -0.04 1 81 SER -3.35 -1.92 1 83 VAL -1.55 -0.49 1 84 ALA -2.95 -0.59 1 86 LEU -0.81 -2.42 1 87 VAL -4.32 -1.04 1 88 LYS -1.69 -2.94 1 89 ASP -4.04 -1.37 1 92 GLN 0.53 -2.12 1 94 SER -3.52 -2.16 1 95 TYR -5.55 -1.03 1 96 PHE -6.88 -0.87 1 97 LEU -2.24 -1.56 1 98 ARG -6.06 -1.74 1 99 ILE -2.43 -2.12 1 100 PHE -4.79 -0.23 1 102 ILE 1.96 -0.46 1 103 LYS 2.13 -0.13 1 106 LYS 0.99 -0.04 1 107 LEU 1.78 -0.67 1 108 LEU -2.06 0.05 1 109 TRP -1.50 -3.28 1 110 GLU -7.93 -4.23 1 111 GLN -7.10 -1.65 1 112 GLU 0.54 0.49 1 114 TYR -0.98 -1.43 1 116 ASN 4.57 -1.39 1 117 PHE 2.50 -1.35 1 118 VAL -1.39 -3.36 1 119 TYR -2.86 -1.35 1 125 TYR -3.67 -2.88 1 126 PHE -4.13 -3.36 1 128 THR -5.38 -1.85 1 129 PHE -2.40 -2.63 1 130 ALA 1.58 0.40 1 133 THR -1.73 -1.40 1 135 GLN 2.83 -0.50 1 136 VAL -3.40 -3.28 1 137 ALA -9.43 -2.38 1 138 LEU -4.61 -4.13 1 139 ASN -4.99 0.53 1 140 PHE -0.04 0.97 1 141 ALA 1.21 -0.92 1 142 ASN -3.20 0.23 1 143 GLU 3.56 1.39 1 144 GLU 4.73 3.74 1 145 GLU 2.42 3.42 1 146 ALA 2.73 2.07 1 147 LYS 4.09 3.83 1 148 LYS 3.95 2.31 1 149 PHE 2.62 1.57 1 150 ARG 4.41 2.89 1 151 LYS 4.08 0.27 1 152 ALA 3.68 2.74 1 153 VAL 5.28 1.47 1 154 THR 5.33 4.09 1 155 ASP 3.87 2.49 1 156 LEU 3.71 1.41 1 157 LEU 3.52 2.75 1 159 ARG 2.58 0.82 1 stop_ save_