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 bmr15949_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.92 _LACS_plot.Line_1_terminator_val_y_1 -2.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 6.13 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 GLU -4.87 3.06 0 10 VAL -3.31 -1.47 1 11 GLU -3.91 -1.76 1 12 VAL -2.45 -0.46 1 13 THR -2.09 -1.27 1 14 TYR -2.55 0.05 1 15 LYS 5.82 1.99 1 16 ASN 2.15 0.32 1 17 MET -2.75 -0.49 1 18 ARG -2.08 0.64 1 19 PHE -6.65 -2.18 1 20 LEU -6.92 -2.41 1 21 ILE -0.31 -0.97 1 22 THR -3.40 -2.75 1 23 HIS -3.07 -0.27 1 24 ASN -1.83 -0.93 1 26 THR -5.21 -2.76 1 27 ASN -2.81 0.71 1 28 ALA 1.45 1.38 1 29 THR -0.55 -1.23 1 30 LEU 2.35 2.74 1 31 ASN 6.24 4.25 1 32 LYS 3.27 1.94 1 33 PHE 3.11 3.19 1 34 ILE 5.55 4.69 1 35 GLU 3.51 3.19 1 37 LEU 5.15 3.19 1 38 LYS 4.56 3.57 1 39 LYS 4.43 3.07 1 40 TYR 0.59 2.09 1 42 VAL 0.62 0.05 1 43 THR -0.92 -0.75 1 44 THR -3.22 0.59 1 45 ILE -6.16 -2.62 1 46 VAL -0.71 -0.98 1 47 ARG -1.07 -0.39 1 48 VAL 0.92 -2.33 1 50 GLU 0.83 0.24 1 51 ALA -0.94 -2.03 1 52 THR -0.04 -0.39 1 53 TYR -3.11 -2.43 1 54 ASP -0.67 -0.27 1 55 THR 3.29 2.30 1 56 THR 6.52 5.21 1 57 LEU 3.02 2.58 1 58 VAL 4.24 3.60 1 59 GLU 2.85 2.12 1 60 LYS 3.44 2.59 1 61 GLU -0.15 -1.25 1 63 ILE -1.10 -0.88 1 64 HIS -1.93 -0.44 1 65 VAL -0.87 -0.87 1 66 LEU -2.00 -2.29 1 67 ASP 0.92 -1.01 1 68 TRP -2.87 -1.72 1 70 PHE -1.32 -1.94 1 71 ASP 1.50 1.48 1 72 ASP 1.85 1.57 1 74 ALA -3.07 -0.65 1 77 SER -2.49 -1.80 1 78 ASN 4.68 3.28 1 79 GLN 4.07 3.11 1 80 ILE 4.62 3.72 1 81 VAL 8.17 6.64 1 82 ASP 4.46 3.74 1 83 ASP 5.90 3.39 1 84 TRP 1.31 2.05 1 85 LEU 4.11 2.71 1 86 SER 4.57 3.77 1 87 LEU 3.41 3.21 1 88 VAL 5.34 4.08 1 89 LYS 3.69 3.31 1 90 ILE 3.04 2.93 1 91 LYS 4.52 1.92 1 92 PHE 4.06 1.65 1 93 ARG 1.90 2.05 1 94 GLU 0.95 1.67 1 95 GLU -1.69 -0.91 1 100 ILE -2.34 -0.26 1 101 ALA -5.71 -2.64 1 102 VAL -4.74 -2.66 1 103 HIS -3.78 0.77 1 105 VAL 1.46 0.42 1 108 LEU 2.14 -1.40 1 113 VAL 7.61 5.60 1 114 LEU 6.58 3.42 1 115 VAL 7.46 5.60 1 116 ALA 4.27 3.38 1 117 LEU 2.53 3.20 1 118 ALA 3.14 2.94 1 119 LEU 5.92 3.35 1 120 ILE 2.35 2.72 1 121 GLU 4.39 3.01 1 124 MET 0.31 1.34 1 125 LYS 0.77 0.55 1 126 TYR 4.30 3.51 1 127 GLU 4.70 3.53 1 128 ASP 3.29 2.45 1 129 ALA 4.11 3.17 1 130 VAL 5.76 4.58 1 131 GLN 4.18 3.23 1 132 PHE 2.49 2.66 1 133 ILE 4.87 3.37 1 134 ARG 3.79 3.28 1 135 GLN 3.69 2.63 1 136 LYS -0.28 0.14 1 138 ARG 3.57 2.36 1 140 ALA 1.51 0.62 1 142 ASN 0.44 0.36 1 143 SER 0.33 0.37 1 144 LYS 4.29 3.39 1 145 GLN 5.88 3.57 1 146 LEU 4.20 3.39 1 147 LEU 3.37 2.78 1 148 TYR 3.92 3.22 1 149 LEU 2.58 2.38 1 150 GLU 2.35 1.74 1 151 LYS -0.26 -0.82 1 152 TYR 2.92 2.02 1 153 ARG -2.70 -2.69 1 155 LYS 0.12 0.26 1 156 MET 3.33 0.50 1 157 ARG 1.55 1.23 1 158 LEU 0.03 -0.94 1 159 ARG -0.11 -0.04 1 160 PHE -0.29 -0.09 1 161 LYS 0.25 0.29 1 162 ASP -0.13 0.16 1 163 SER -0.45 -0.06 1 164 ASN -0.00 2.06 1 166 HIS 0.08 1.08 1 169 ASN -1.42 1.15 1 170 SER 0.32 0.40 1 171 SER 0.16 0.26 1 172 ILE 0.36 0.24 1 173 GLN 0.60 1.67 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15949_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.92 _LACS_plot.Line_1_terminator_val_y_1 4.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 -2.03 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 GLU -4.87 7.93 0 10 VAL -3.31 1.84 1 11 GLU -3.91 2.15 1 12 VAL -2.45 1.99 1 13 THR -2.09 0.82 1 14 TYR -2.55 2.60 1 15 LYS 5.82 -3.83 1 16 ASN 2.15 -1.83 1 17 MET -2.75 2.26 1 18 ARG -2.08 2.72 1 19 PHE -6.65 4.47 1 20 LEU -6.92 4.51 1 21 ILE -0.31 -0.66 1 22 THR -3.40 0.65 1 23 HIS -3.07 2.80 1 24 ASN -1.83 0.90 1 26 THR -5.21 2.45 1 27 ASN -2.81 3.52 1 28 ALA 1.45 -0.07 1 29 THR -0.55 -0.68 1 30 LEU 2.35 0.39 1 31 ASN 6.24 -1.99 1 32 LYS 3.27 -1.33 1 33 PHE 3.11 0.08 1 34 ILE 5.55 -0.86 1 35 GLU 3.51 -0.32 1 37 LEU 5.15 -1.96 1 38 LYS 4.56 -0.99 1 39 LYS 4.43 -1.36 1 40 TYR 0.59 1.50 1 42 VAL 0.62 -0.57 1 43 THR -0.92 0.17 1 44 THR -3.22 3.81 1 45 ILE -6.16 3.54 1 46 VAL -0.71 -0.27 1 47 ARG -1.07 0.68 1 48 VAL 0.92 -3.25 1 50 GLU 0.83 -0.59 1 51 ALA -0.94 -1.09 1 52 THR -0.04 -0.35 1 53 TYR -3.11 0.68 1 54 ASP -0.67 0.40 1 55 THR 3.29 -0.99 1 56 THR 6.52 -1.31 1 57 LEU 3.02 -0.44 1 58 VAL 4.24 -0.64 1 59 GLU 2.85 -0.73 1 60 LYS 3.44 -0.85 1 61 GLU -0.15 -1.10 1 63 ILE -1.10 0.22 1 64 HIS -1.93 1.49 1 65 VAL -0.87 0.00 1 66 LEU -2.00 -0.29 1 67 ASP 0.92 -1.93 1 68 TRP -2.87 1.15 1 70 PHE -1.32 -0.62 1 71 ASP 1.50 -0.02 1 72 ASP 1.85 -0.28 1 74 ALA -3.07 2.42 1 77 SER -2.49 0.69 1 78 ASN 4.68 -1.40 1 79 GLN 4.07 -0.96 1 80 ILE 4.62 -0.90 1 81 VAL 8.17 -1.53 1 82 ASP 4.46 -0.72 1 83 ASP 5.90 -2.51 1 84 TRP 1.31 0.74 1 85 LEU 4.11 -1.40 1 86 SER 4.57 -0.80 1 87 LEU 3.41 -0.20 1 88 VAL 5.34 -1.26 1 89 LYS 3.69 -0.38 1 90 ILE 3.04 -0.11 1 91 LYS 4.52 -2.60 1 92 PHE 4.06 -2.41 1 93 ARG 1.90 0.15 1 94 GLU 0.95 0.72 1 95 GLU -1.69 0.78 1 100 ILE -2.34 2.08 1 101 ALA -5.71 3.07 1 102 VAL -4.74 2.08 1 103 HIS -3.78 4.55 1 105 VAL 1.46 -1.04 1 108 LEU 2.14 -3.54 1 113 VAL 7.61 -2.01 1 114 LEU 6.58 -3.16 1 115 VAL 7.46 -1.86 1 116 ALA 4.27 -0.89 1 117 LEU 2.53 0.67 1 118 ALA 3.14 -0.20 1 119 LEU 5.92 -2.57 1 120 ILE 2.35 0.37 1 121 GLU 4.39 -1.38 1 124 MET 0.31 1.03 1 125 LYS 0.77 -0.22 1 126 TYR 4.30 -0.79 1 127 GLU 4.70 -1.17 1 128 ASP 3.29 -0.84 1 129 ALA 4.11 -0.94 1 130 VAL 5.76 -1.18 1 131 GLN 4.18 -0.95 1 132 PHE 2.49 0.17 1 133 ILE 4.87 -1.50 1 134 ARG 3.79 -0.51 1 135 GLN 3.69 -1.06 1 136 LYS -0.28 0.42 1 138 ARG 3.57 -1.21 1 140 ALA 1.51 -0.89 1 142 ASN 0.44 -0.08 1 143 SER 0.33 0.04 1 144 LYS 4.29 -0.90 1 145 GLN 5.88 -2.31 1 146 LEU 4.20 -0.81 1 147 LEU 3.37 -0.59 1 148 TYR 3.92 -0.70 1 149 LEU 2.58 -0.20 1 150 GLU 2.35 -0.61 1 151 LYS -0.26 -0.56 1 152 TYR 2.92 -0.90 1 153 ARG -2.70 0.01 1 155 LYS 0.12 0.14 1 156 MET 3.33 -2.83 1 157 ARG 1.55 -0.32 1 158 LEU 0.03 -0.97 1 159 ARG -0.11 0.07 1 160 PHE -0.29 0.20 1 161 LYS 0.25 0.04 1 162 ASP -0.13 0.29 1 163 SER -0.45 0.39 1 164 ASN -0.00 2.06 1 166 HIS 0.08 1.00 1 169 ASN -1.42 2.57 1 170 SER 0.32 0.08 1 171 SER 0.16 0.10 1 172 ILE 0.36 -0.12 1 173 GLN 0.60 1.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15949_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.92 _LACS_plot.Line_1_terminator_val_y_1 9.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 4.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 6.37 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 0.97 _LACS_plot.Y_axis_chem_shift_offset -5.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 SER 4.57 9.69 0 20 LEU -6.92 3.95 0 10 VAL -3.31 7.56 1 11 GLU -3.91 5.01 1 12 VAL -2.45 6.68 1 13 THR -2.09 9.02 1 14 TYR -2.55 8.03 1 15 LYS 5.82 5.17 1 16 ASN 2.15 8.36 1 17 MET -2.75 6.33 1 18 ARG -2.08 7.66 1 19 PHE -6.65 7.20 1 21 ILE -0.31 1.47 1 22 THR -3.40 10.51 1 23 HIS -3.07 10.10 1 27 ASN -2.81 9.07 1 28 ALA 1.45 0.25 1 29 THR -0.55 6.97 1 30 LEU 2.35 1.64 1 31 ASN 6.24 3.93 1 32 LYS 3.27 2.19 1 33 PHE 3.11 4.59 1 34 ILE 5.55 3.58 1 36 GLU -4.87 2.60 1 37 LEU 5.15 -0.72 1 38 LYS 4.56 -0.26 1 39 LYS 4.43 2.57 1 40 TYR 0.59 5.41 1 42 VAL 0.62 4.33 1 43 THR -0.92 7.65 1 44 THR -3.22 11.22 1 45 ILE -6.16 8.35 1 46 VAL -0.71 7.25 1 47 ARG -1.07 5.21 1 48 VAL 0.92 7.54 1 50 GLU 0.83 4.74 1 52 THR -0.04 8.96 1 53 TYR -3.11 7.38 1 54 ASP -0.67 3.86 1 55 THR 3.29 6.02 1 56 THR 6.52 5.49 1 57 LEU 3.02 1.53 1 59 GLU 2.85 -1.29 1 60 LYS 3.44 2.78 1 61 GLU -0.15 4.43 1 63 ILE -1.10 5.91 1 64 HIS -1.93 8.90 1 65 VAL -0.87 5.87 1 66 LEU -2.00 5.92 1 67 ASP 0.92 6.51 1 70 PHE -1.32 7.48 1 71 ASP 1.50 5.45 1 72 ASP 1.85 5.36 1 77 SER -2.49 8.41 1 78 ASN 4.68 5.11 1 79 GLN 4.07 4.34 1 80 ILE 4.62 4.04 1 81 VAL 8.17 3.64 1 82 ASP 4.46 1.39 1 83 ASP 5.90 2.04 1 84 TRP 1.31 4.78 1 85 LEU 4.11 -0.30 1 87 LEU 3.41 1.75 1 88 VAL 5.34 4.13 1 89 LYS 3.69 1.89 1 90 ILE 3.04 2.08 1 91 LYS 4.52 1.98 1 92 PHE 4.06 4.64 1 93 ARG 1.90 3.49 1 94 GLU 0.95 3.46 1 100 ILE -2.34 4.98 1 101 ALA -5.71 3.88 1 102 VAL -4.74 6.38 1 103 HIS -3.78 6.85 1 105 VAL 1.46 6.81 1 108 LEU 2.14 3.88 1 113 VAL 7.61 4.44 1 114 LEU 6.58 -0.32 1 115 VAL 7.46 4.16 1 116 ALA 4.27 0.66 1 117 LEU 2.53 0.74 1 118 ALA 3.14 0.22 1 120 ILE 2.35 -0.94 1 121 GLU 4.39 2.56 1 124 MET 0.31 4.81 1 125 LYS 0.77 2.07 1 126 TYR 4.30 5.56 1 127 GLU 4.70 1.51 1 128 ASP 3.29 3.10 1 129 ALA 4.11 0.29 1 130 VAL 5.76 2.67 1 131 GLN 4.18 3.39 1 132 PHE 2.49 3.34 1 133 ILE 4.87 2.63 1 134 ARG 3.79 2.98 1 135 GLN 3.69 3.61 1 138 ARG 3.57 3.09 1 140 ALA 1.51 2.39 1 142 ASN 0.44 6.74 1 144 LYS 4.29 0.52 1 145 GLN 5.88 3.34 1 146 LEU 4.20 0.86 1 147 LEU 3.37 0.93 1 148 TYR 3.92 3.47 1 149 LEU 2.58 2.64 1 150 GLU 2.35 2.80 1 151 LYS -0.26 4.53 1 152 TYR 2.92 6.08 1 155 LYS 0.12 3.64 1 156 MET 3.33 3.80 1 157 ARG 1.55 4.18 1 158 LEU 0.03 3.53 1 159 ARG -0.11 5.28 1 160 PHE -0.29 5.93 1 161 LYS 0.25 4.75 1 162 ASP -0.13 5.00 1 163 SER -0.45 9.22 1 164 ASN -0.00 5.53 1 170 SER 0.32 8.07 1 171 SER 0.16 8.40 1 172 ILE 0.36 5.55 1 stop_ save_