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 bmr6271_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -3.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.85 _LACS_plot.Line_2_terminator_val_x_2 8.22 _LACS_plot.Line_2_terminator_val_y_2 5.88 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 TYR 3.15 -2.25 0 39 LEU -6.54 -0.56 0 10 LEU 4.36 2.94 1 11 GLU 1.93 1.90 1 12 ARG 0.88 0.07 1 13 SER 1.03 1.76 1 14 SER 0.29 0.25 1 16 LYS 4.53 4.05 1 17 LEU 5.50 3.30 1 18 GLU 3.59 3.00 1 19 TRP 4.96 4.95 1 20 SER 3.59 2.77 1 21 ALA 4.06 2.40 1 22 ILE 4.92 3.20 1 23 LEU 5.05 2.84 1 24 GLN 4.35 3.66 1 25 LYS 4.42 2.67 1 26 MET 4.42 4.11 1 27 ALA 3.67 2.78 1 28 SER 4.30 2.87 1 29 ASP 4.50 2.82 1 30 LEU 0.30 0.82 1 32 PHE 2.09 1.53 1 33 SER 1.51 0.93 1 34 LYS -5.50 -2.67 1 35 ILE -5.32 -3.34 1 36 LEU -1.11 -0.38 1 37 PHE -3.27 -1.50 1 40 LEU -4.30 -1.51 1 42 LYS 1.62 0.64 1 43 ASP 3.70 1.63 1 44 SER -0.85 -0.90 1 45 GLN -0.37 -1.63 1 46 ASP 0.48 -1.86 1 47 TYR 3.57 2.44 1 48 GLU 3.91 2.36 1 49 ASN -0.71 -0.77 1 50 ALA 0.22 -0.08 1 51 PHE 0.44 -0.12 1 52 ILE -3.21 -1.41 1 53 VAL -5.97 -3.15 1 55 ASN -0.99 -1.69 1 56 TYR 4.57 3.52 1 58 ALA 4.25 3.14 1 59 ALA 3.79 2.32 1 60 TRP 0.04 0.72 1 61 ARG 5.76 3.97 1 63 HIS 2.31 3.13 1 64 TYR 2.64 1.70 1 65 ASP 4.80 2.92 1 66 ARG 4.26 2.87 1 67 ALA 1.15 -1.09 1 70 ALA 3.80 2.50 1 71 ARG 1.86 0.47 1 72 VAL -1.75 -0.48 1 73 ASP -2.49 -1.81 1 75 THR 5.56 3.60 1 76 VAL 6.15 4.30 1 77 SER 4.27 2.67 1 78 HIS 3.46 5.71 1 80 THR 2.06 1.85 1 81 GLN -2.43 -0.88 1 82 SER -2.88 -2.93 1 83 VAL 0.14 -1.31 1 84 LEU 1.12 -0.95 1 86 ILE -3.98 -3.06 1 87 PHE 0.07 -0.31 1 88 TRP 0.05 -2.78 1 89 GLU -1.18 -0.30 1 91 SER 3.36 1.76 1 92 ILE 3.16 1.45 1 93 TYR 2.33 -1.15 1 94 GLN 0.41 2.06 1 95 THR -2.44 -1.46 1 97 LYS 4.00 2.05 1 98 GLN 5.29 3.25 1 99 HIS 5.73 5.06 1 100 GLU 3.89 2.91 1 101 PHE 4.73 3.38 1 102 PHE 2.58 -1.78 1 103 GLU 4.11 2.61 1 104 GLU 3.52 2.73 1 105 ALA 4.48 1.64 1 106 SER 4.46 2.87 1 107 ALA 3.73 1.66 1 108 ALA 0.83 -0.84 1 110 LEU 1.63 -2.12 1 111 VAL 1.31 2.19 1 112 TYR -4.09 -3.27 1 114 LEU -1.63 -1.10 1 115 THR -1.76 0.56 1 116 MET -4.23 -4.91 1 118 LEU -2.25 -2.66 1 119 HIS -0.55 -0.55 1 121 ALA 2.13 0.84 1 122 ARG 1.31 -1.83 1 124 GLU 3.07 1.90 1 125 LEU -3.79 -1.91 1 127 ALA -5.33 -1.73 1 128 LEU -3.06 -1.75 1 129 SER -5.08 -1.65 1 130 LEU -4.09 -1.42 1 131 SER -5.13 -2.84 1 132 VAL -6.06 -3.24 1 133 GLU -0.52 -1.51 1 134 ALA -4.94 -1.74 1 135 GLU 0.61 1.07 1 136 ASN -2.12 -1.41 1 137 ARG 4.15 3.14 1 138 ALA 4.74 2.68 1 139 GLU 2.59 1.81 1 140 ALA 4.54 2.68 1 141 ASN 4.53 2.91 1 142 ARG 4.60 3.33 1 143 PHE 4.77 3.01 1 144 MET 4.19 5.31 1 145 GLU 4.06 3.28 1 146 SER 3.70 2.87 1 147 VAL -1.60 -1.82 1 148 LEU 8.23 6.34 1 150 THR 6.39 4.71 1 151 LEU 2.86 1.84 1 152 TRP 6.36 4.12 1 153 MET 1.68 2.17 1 154 LEU 4.36 3.12 1 155 LYS 7.21 3.22 1 156 ASP 4.28 3.38 1 157 TYR 6.76 6.03 1 158 ALA 4.62 2.59 1 159 LEU 4.34 3.50 1 160 GLN 5.11 3.08 1 161 SER 2.22 1.39 1 163 ALA 4.45 2.41 1 165 LEU -0.05 -0.11 1 166 ALA 3.34 1.67 1 167 PHE -2.52 -2.89 1 168 GLU -0.27 -0.40 1 169 HIS -1.74 0.51 1 171 VAL 0.37 -0.11 1 172 SER 0.11 -0.19 1 173 LYS 1.49 1.39 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6271_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 3.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 8.22 _LACS_plot.Line_2_terminator_val_y_2 -2.34 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 TYR 3.15 -5.40 0 39 LEU -6.54 5.98 0 10 LEU 4.36 -1.42 1 11 GLU 1.93 -0.03 1 12 ARG 0.88 -0.81 1 13 SER 1.03 0.73 1 14 SER 0.29 -0.04 1 16 LYS 4.53 -0.48 1 17 LEU 5.50 -2.20 1 18 GLU 3.59 -0.59 1 19 TRP 4.96 -0.01 1 20 SER 3.59 -0.82 1 21 ALA 4.06 -1.66 1 22 ILE 4.92 -1.72 1 23 LEU 5.05 -2.21 1 24 GLN 4.35 -0.69 1 25 LYS 4.42 -1.75 1 26 MET 4.42 -0.31 1 27 ALA 3.67 -0.89 1 28 SER 4.30 -1.43 1 29 ASP 4.50 -1.68 1 30 LEU 0.30 0.52 1 32 PHE 2.09 -0.56 1 33 SER 1.51 -0.58 1 34 LYS -5.50 2.83 1 35 ILE -5.32 1.98 1 36 LEU -1.11 0.73 1 37 PHE -3.27 1.77 1 40 LEU -4.30 2.79 1 42 LYS 1.62 -0.98 1 43 ASP 3.70 -2.07 1 44 SER -0.85 -0.05 1 45 GLN -0.37 -1.26 1 46 ASP 0.48 -2.34 1 47 TYR 3.57 -1.13 1 48 GLU 3.91 -1.55 1 49 ASN -0.71 -0.06 1 50 ALA 0.22 -0.30 1 51 PHE 0.44 -0.56 1 52 ILE -3.21 1.80 1 53 VAL -5.97 2.82 1 55 ASN -0.99 -0.70 1 56 TYR 4.57 -1.05 1 58 ALA 4.25 -1.11 1 59 ALA 3.79 -1.47 1 60 TRP 0.04 0.68 1 61 ARG 5.76 -1.79 1 63 HIS 2.31 0.82 1 64 TYR 2.64 -0.94 1 65 ASP 4.80 -1.88 1 66 ARG 4.26 -1.39 1 67 ALA 1.15 -2.24 1 70 ALA 3.80 -1.30 1 71 ARG 1.86 -1.39 1 72 VAL -1.75 1.27 1 73 ASP -2.49 0.68 1 75 THR 5.56 -1.96 1 76 VAL 6.15 -1.85 1 77 SER 4.27 -1.60 1 78 HIS 3.46 2.25 1 80 THR 2.06 -0.21 1 81 GLN -2.43 1.55 1 82 SER -2.88 -0.05 1 83 VAL 0.14 -1.45 1 84 LEU 1.12 -2.07 1 86 ILE -3.98 0.92 1 87 PHE 0.07 -0.38 1 88 TRP 0.05 -2.83 1 89 GLU -1.18 0.88 1 91 SER 3.36 -1.60 1 92 ILE 3.16 -1.71 1 93 TYR 2.33 -3.48 1 94 GLN 0.41 1.65 1 95 THR -2.44 0.98 1 97 LYS 4.00 -1.95 1 98 GLN 5.29 -2.04 1 99 HIS 5.73 -0.67 1 100 GLU 3.89 -0.98 1 101 PHE 4.73 -1.35 1 102 PHE 2.58 -4.36 1 103 GLU 4.11 -1.50 1 104 GLU 3.52 -0.79 1 105 ALA 4.48 -2.84 1 106 SER 4.46 -1.59 1 107 ALA 3.73 -2.07 1 108 ALA 0.83 -1.67 1 110 LEU 1.63 -3.75 1 111 VAL 1.31 0.88 1 112 TYR -4.09 0.82 1 114 LEU -1.63 0.53 1 115 THR -1.76 2.32 1 116 MET -4.23 -0.68 1 118 LEU -2.25 -0.41 1 119 HIS -0.55 0.00 1 121 ALA 2.13 -1.29 1 122 ARG 1.31 -3.14 1 124 GLU 3.07 -1.17 1 125 LEU -3.79 1.88 1 127 ALA -5.33 3.60 1 128 LEU -3.06 1.31 1 129 SER -5.08 3.43 1 130 LEU -4.09 2.67 1 131 SER -5.13 2.29 1 132 VAL -6.06 2.82 1 133 GLU -0.52 -0.99 1 134 ALA -4.94 3.20 1 135 GLU 0.61 0.46 1 136 ASN -2.12 0.71 1 137 ARG 4.15 -1.01 1 138 ALA 4.74 -2.06 1 139 GLU 2.59 -0.78 1 140 ALA 4.54 -1.86 1 141 ASN 4.53 -1.62 1 142 ARG 4.60 -1.27 1 143 PHE 4.77 -1.76 1 144 MET 4.19 1.12 1 145 GLU 4.06 -0.78 1 146 SER 3.70 -0.83 1 147 VAL -1.60 -0.22 1 148 LEU 8.23 -1.89 1 150 THR 6.39 -1.68 1 151 LEU 2.86 -1.02 1 152 TRP 6.36 -2.24 1 153 MET 1.68 0.49 1 154 LEU 4.36 -1.24 1 155 LYS 7.21 -3.99 1 156 ASP 4.28 -0.90 1 157 TYR 6.76 -0.73 1 158 ALA 4.62 -2.03 1 159 LEU 4.34 -0.84 1 160 GLN 5.11 -2.03 1 161 SER 2.22 -0.83 1 163 ALA 4.45 -2.04 1 165 LEU -0.05 -0.06 1 166 ALA 3.34 -1.67 1 167 PHE -2.52 -0.37 1 168 GLU -0.27 -0.13 1 169 HIS -1.74 2.25 1 171 VAL 0.37 -0.48 1 172 SER 0.11 -0.30 1 173 LYS 1.49 -0.10 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6271_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -3.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.35 _LACS_plot.Line_2_terminator_val_x_2 8.22 _LACS_plot.Line_2_terminator_val_y_2 3.10 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 110 LEU 1.63 -4.76 0 148 LEU 8.23 -1.60 0 10 LEU 4.36 1.41 1 11 GLU 1.93 0.86 1 12 ARG 0.88 -0.28 1 13 SER 1.03 -0.25 1 14 SER 0.29 -0.53 1 16 LYS 4.53 1.28 1 17 LEU 5.50 2.08 1 18 GLU 3.59 1.22 1 19 TRP 4.96 0.95 1 20 SER 3.59 1.80 1 21 ALA 4.06 2.97 1 22 ILE 4.92 1.33 1 23 LEU 5.05 0.43 1 24 GLN 4.35 2.05 1 25 LYS 4.42 0.94 1 26 MET 4.42 2.56 1 27 ALA 3.67 1.27 1 28 SER 4.30 4.58 1 29 ASP 4.50 2.15 1 30 LEU 0.30 -1.01 1 32 PHE 2.09 -1.44 1 33 SER 1.51 0.12 1 34 LYS -5.50 -2.09 1 35 ILE -5.32 -4.57 1 36 LEU -1.11 -4.48 1 37 PHE -3.27 -3.05 1 39 LEU -6.54 -3.92 1 40 LEU -4.30 -1.56 1 42 LYS 1.62 -0.72 1 43 ASP 3.70 -1.70 1 44 SER -0.85 -0.26 1 45 GLN -0.37 -1.61 1 46 ASP 0.48 -0.21 1 47 TYR 3.57 1.21 1 48 GLU 3.91 -0.21 1 49 ASN -0.71 -0.91 1 50 ALA 0.22 -1.48 1 51 PHE 0.44 -2.03 1 52 ILE -3.21 -0.54 1 53 VAL -5.97 -2.41 1 55 ASN -0.99 1.46 1 56 TYR 4.57 2.96 1 58 ALA 4.25 2.25 1 59 ALA 3.79 3.13 1 60 TRP 0.04 0.03 1 61 ARG 5.76 0.80 1 63 HIS 2.31 0.68 1 64 TYR 2.64 2.37 1 65 ASP 4.80 2.56 1 66 ARG 4.26 1.77 1 67 ALA 1.15 -0.38 1 69 TYR 3.15 1.10 1 70 ALA 3.80 -0.38 1 71 ARG 1.86 -0.70 1 72 VAL -1.75 -2.49 1 73 ASP -2.49 0.74 1 75 THR 5.56 1.36 1 76 VAL 6.15 1.32 1 77 SER 4.27 4.08 1 78 HIS 3.46 3.10 1 80 THR 2.06 -0.40 1 81 GLN -2.43 -0.86 1 82 SER -2.88 -1.36 1 83 VAL 0.14 -1.24 1 84 LEU 1.12 -1.67 1 86 ILE -3.98 -2.74 1 87 PHE 0.07 1.44 1 88 TRP 0.05 -0.45 1 89 GLU -1.18 -0.76 1 91 SER 3.36 1.29 1 92 ILE 3.16 -1.17 1 93 TYR 2.33 -1.90 1 94 GLN 0.41 1.00 1 95 THR -2.44 0.37 1 97 LYS 4.00 3.20 1 98 GLN 5.29 2.08 1 99 HIS 5.73 2.97 1 100 GLU 3.89 1.95 1 101 PHE 4.73 -0.42 1 102 PHE 2.58 1.92 1 103 GLU 4.11 2.90 1 104 GLU 3.52 1.81 1 105 ALA 4.48 2.00 1 106 SER 4.46 3.16 1 107 ALA 3.73 0.57 1 108 ALA 0.83 -1.43 1 111 VAL 1.31 -0.35 1 112 TYR -4.09 -0.25 1 114 LEU -1.63 -4.10 1 115 THR -1.76 -1.94 1 116 MET -4.23 -3.75 1 118 LEU -2.25 -2.66 1 119 HIS -0.55 -0.20 1 121 ALA 2.13 -0.14 1 122 ARG 1.31 0.31 1 124 GLU 3.07 -0.63 1 125 LEU -3.79 -3.09 1 127 ALA -5.33 -3.68 1 128 LEU -3.06 -3.08 1 129 SER -5.08 -2.13 1 130 LEU -4.09 -3.89 1 131 SER -5.13 -0.91 1 132 VAL -6.06 -2.62 1 133 GLU -0.52 -1.70 1 134 ALA -4.94 -1.82 1 135 GLU 0.61 -0.30 1 136 ASN -2.12 -1.43 1 137 ARG 4.15 0.41 1 138 ALA 4.74 3.34 1 139 GLU 2.59 2.56 1 140 ALA 4.54 1.00 1 141 ASN 4.53 2.28 1 142 ARG 4.60 3.05 1 143 PHE 4.77 2.55 1 144 MET 4.19 1.01 1 145 GLU 4.06 1.74 1 146 SER 3.70 0.63 1 147 VAL -1.60 -0.24 1 150 THR 6.39 1.78 1 151 LEU 2.86 -1.04 1 152 TRP 6.36 0.86 1 153 MET 1.68 1.42 1 154 LEU 4.36 0.54 1 155 LYS 7.21 0.09 1 156 ASP 4.28 2.05 1 157 TYR 6.76 4.81 1 158 ALA 4.62 0.33 1 159 LEU 4.34 -0.91 1 160 GLN 5.11 2.35 1 161 SER 2.22 2.61 1 163 ALA 4.45 1.58 1 165 LEU -0.05 0.13 1 166 ALA 3.34 -0.44 1 167 PHE -2.52 -0.66 1 168 GLU -0.27 -1.67 1 169 HIS -1.74 0.55 1 171 VAL 0.37 -0.30 1 172 SER 0.11 -1.42 1 173 LYS 1.49 4.38 1 stop_ save_