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 bmr17829_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.21 _LACS_plot.Line_1_terminator_val_y_1 -1.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.58 _LACS_plot.Line_2_terminator_val_x_2 8.51 _LACS_plot.Line_2_terminator_val_y_2 5.94 _LACS_plot.Y_axis_chem_shift_offset -0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 146 HIS 8.51 7.76 0 11 MET 2.14 1.79 1 12 GLU 3.01 3.82 1 13 SER 0.51 1.61 1 14 LYS 7.12 3.59 1 15 ALA 2.98 2.94 1 17 SER -0.94 1.14 1 18 ASP 5.40 4.72 1 19 ALA 1.50 1.80 1 20 GLN -0.17 2.18 1 21 ILE -0.75 0.14 1 22 THR -6.15 -1.90 1 23 ALA -6.68 -0.38 1 25 SER -0.52 0.85 1 26 TYR -2.57 -0.55 1 27 PHE -0.05 0.55 1 28 THR -1.58 -0.30 1 29 ASN -1.16 -0.43 1 30 MET 4.35 3.29 1 31 PHE 0.21 1.03 1 32 ALA -2.93 0.58 1 33 THR -1.19 0.41 1 34 TRP 0.76 -1.64 1 35 SER 1.89 1.17 1 37 SER 2.74 1.71 1 38 LYS 0.57 -0.80 1 39 ALA -0.20 -0.17 1 40 ARG -2.16 0.24 1 41 LEU 0.22 1.73 1 42 HIS 4.87 4.42 1 43 LEU 2.44 3.24 1 44 GLN -3.06 -0.85 1 46 ARG 1.19 1.54 1 47 SER 0.43 -1.59 1 48 ASN 4.06 1.02 1 49 ALA -3.11 -0.22 1 50 TRP -0.96 0.28 1 51 ARG -5.52 -1.11 1 53 GLN 3.95 3.79 1 54 VAL -5.26 -2.87 1 55 ASN 0.16 -0.01 1 56 ASN -0.20 1.58 1 58 LYS 1.84 1.00 1 59 GLU -1.43 -0.48 1 60 TRP -4.09 -1.52 1 61 LEU -4.00 -1.06 1 62 GLN -6.89 -1.57 1 63 VAL -3.53 -0.75 1 64 ASP -4.34 -2.38 1 65 PHE 2.55 3.30 1 66 GLN 6.61 3.89 1 67 LYS -2.28 -1.22 1 68 THR 4.54 3.58 1 69 MET -3.82 -2.55 1 70 LYS -0.51 0.00 1 71 VAL 0.00 0.82 1 72 THR -1.46 -0.62 1 74 VAL -4.95 -1.13 1 75 THR -0.83 -0.57 1 76 THR -4.72 -1.10 1 77 GLN 0.60 -0.51 1 79 VAL -2.56 0.88 1 80 LYS -3.24 -0.85 1 81 SER -2.06 -0.62 1 82 LEU 2.62 2.54 1 83 LEU 1.62 1.19 1 84 THR 0.34 1.22 1 85 SER 0.34 1.48 1 86 MET -2.87 0.30 1 87 TYR -1.09 -0.69 1 88 VAL 1.39 1.58 1 89 LYS 0.46 2.32 1 90 GLU -7.61 -1.12 1 91 PHE -3.22 -0.48 1 92 LEU -3.61 -1.99 1 93 ILE -4.29 -1.29 1 94 SER -3.55 0.29 1 95 SER -3.95 -0.40 1 96 SER -1.07 -0.45 1 97 GLN 0.26 0.41 1 98 ASP -2.30 -0.65 1 100 HIS -0.98 2.22 1 101 GLN -0.63 0.05 1 102 TRP -2.69 0.03 1 103 THR -1.67 0.12 1 104 LEU -0.70 1.20 1 105 PHE 3.06 3.40 1 106 PHE -4.47 -1.16 1 107 GLN -3.09 0.84 1 108 ASN 3.59 2.31 1 110 LYS -5.04 -1.71 1 111 VAL 2.86 2.24 1 112 LYS -1.13 -0.07 1 113 VAL 1.85 0.14 1 114 PHE 2.28 1.33 1 115 GLN 0.78 0.41 1 117 ASN -0.04 4.25 1 118 GLN -2.12 -0.33 1 119 ASP -1.21 -0.80 1 120 SER -0.09 1.92 1 121 PHE -2.95 -0.10 1 122 THR 4.79 3.77 1 124 VAL -2.38 0.21 1 125 VAL -0.06 0.36 1 126 ASN -5.01 0.13 1 127 SER -0.27 0.90 1 128 LEU 5.72 6.20 1 132 LEU -5.37 -1.03 1 133 LEU -0.26 -1.08 1 134 THR -1.11 -0.44 1 135 ARG 0.61 1.79 1 136 TYR -6.37 -1.46 1 137 LEU 1.26 -0.34 1 138 ARG -5.31 -0.66 1 139 ILE -3.66 -1.62 1 142 GLN -2.32 0.91 1 143 SER -1.34 0.04 1 144 TRP -1.75 -0.21 1 145 VAL 1.91 1.17 1 147 GLN -4.69 -1.35 1 148 ILE 4.11 2.55 1 149 ALA -5.62 -1.01 1 150 LEU -8.21 -0.15 1 151 ARG -3.98 1.23 1 152 MET -5.12 0.45 1 153 GLU 0.42 -1.61 1 154 VAL -2.07 -0.10 1 155 LEU -4.32 -2.28 1 158 GLU 0.65 1.03 1 159 ALA -0.31 0.68 1 160 GLN -0.41 0.46 1 161 ASP 0.58 0.92 1 162 LEU 0.03 0.48 1 163 TYR 0.46 1.52 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17829_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.21 _LACS_plot.Line_1_terminator_val_y_1 6.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.42 _LACS_plot.Line_2_terminator_val_x_2 8.51 _LACS_plot.Line_2_terminator_val_y_2 -2.57 _LACS_plot.Y_axis_chem_shift_offset -0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 146 HIS 8.51 -0.75 0 11 MET 2.14 -0.35 1 12 GLU 3.01 0.81 1 13 SER 0.51 1.10 1 14 LYS 7.12 -3.53 1 15 ALA 2.98 -0.04 1 17 SER -0.94 2.08 1 18 ASP 5.40 -0.68 1 19 ALA 1.50 0.30 1 20 GLN -0.17 2.35 1 21 ILE -0.75 0.89 1 22 THR -6.15 4.25 1 23 ALA -6.68 6.30 1 25 SER -0.52 1.37 1 26 TYR -2.57 2.02 1 27 PHE -0.05 0.60 1 28 THR -1.58 1.28 1 29 ASN -1.16 0.73 1 30 MET 4.35 -1.06 1 31 PHE 0.21 0.82 1 32 ALA -2.93 3.51 1 33 THR -1.19 1.60 1 34 TRP 0.76 -2.40 1 35 SER 1.89 -0.72 1 37 SER 2.74 -1.03 1 38 LYS 0.57 -1.37 1 39 ALA -0.20 0.03 1 40 ARG -2.16 2.40 1 41 LEU 0.22 1.51 1 42 HIS 4.87 -0.45 1 43 LEU 2.44 0.80 1 44 GLN -3.06 2.21 1 46 ARG 1.19 0.35 1 47 SER 0.43 -2.02 1 48 ASN 4.06 -3.04 1 49 ALA -3.11 2.89 1 50 TRP -0.96 1.24 1 51 ARG -5.52 4.41 1 53 GLN 3.95 -0.16 1 54 VAL -5.26 2.39 1 55 ASN 0.16 -0.17 1 56 ASN -0.20 1.78 1 58 LYS 1.84 -0.84 1 59 GLU -1.43 0.95 1 60 TRP -4.09 2.57 1 61 LEU -4.00 2.94 1 62 GLN -6.89 5.32 1 63 VAL -3.53 2.78 1 64 ASP -4.34 1.96 1 65 PHE 2.55 0.75 1 66 GLN 6.61 -2.72 1 67 LYS -2.28 1.06 1 68 THR 4.54 -0.96 1 69 MET -3.82 1.27 1 70 LYS -0.51 0.51 1 71 VAL 0.00 0.82 1 72 THR -1.46 0.84 1 74 VAL -4.95 3.82 1 75 THR -0.83 0.26 1 76 THR -4.72 3.62 1 77 GLN 0.60 -1.11 1 79 VAL -2.56 3.44 1 80 LYS -3.24 2.39 1 81 SER -2.06 1.44 1 82 LEU 2.62 -0.08 1 83 LEU 1.62 -0.43 1 84 THR 0.34 0.88 1 85 SER 0.34 1.14 1 86 MET -2.87 3.17 1 87 TYR -1.09 0.40 1 88 VAL 1.39 0.19 1 89 LYS 0.46 1.86 1 90 GLU -7.61 6.49 1 91 PHE -3.22 2.74 1 92 LEU -3.61 1.62 1 93 ILE -4.29 3.00 1 94 SER -3.55 3.84 1 95 SER -3.95 3.55 1 96 SER -1.07 0.62 1 97 GLN 0.26 0.15 1 98 ASP -2.30 1.65 1 100 HIS -0.98 3.20 1 101 GLN -0.63 0.68 1 102 TRP -2.69 2.72 1 103 THR -1.67 1.79 1 104 LEU -0.70 1.90 1 105 PHE 3.06 0.34 1 106 PHE -4.47 3.31 1 107 GLN -3.09 3.93 1 108 ASN 3.59 -1.28 1 110 LYS -5.04 3.33 1 111 VAL 2.86 -0.62 1 112 LYS -1.13 1.06 1 113 VAL 1.85 -1.71 1 114 PHE 2.28 -0.95 1 115 GLN 0.78 -0.37 1 117 ASN -0.04 4.29 1 118 GLN -2.12 1.79 1 119 ASP -1.21 0.41 1 120 SER -0.09 2.01 1 121 PHE -2.95 2.85 1 122 THR 4.79 -1.02 1 124 VAL -2.38 2.59 1 125 VAL -0.06 0.42 1 126 ASN -5.01 5.14 1 127 SER -0.27 1.17 1 128 LEU 5.72 0.48 1 132 LEU -5.37 4.34 1 133 LEU -0.26 -0.82 1 134 THR -1.11 0.67 1 135 ARG 0.61 1.18 1 136 TYR -6.37 4.91 1 137 LEU 1.26 -1.60 1 138 ARG -5.31 4.65 1 139 ILE -3.66 2.04 1 142 GLN -2.32 3.23 1 143 SER -1.34 1.38 1 144 TRP -1.75 1.54 1 145 VAL 1.91 -0.74 1 147 GLN -4.69 3.34 1 148 ILE 4.11 -1.56 1 149 ALA -5.62 4.61 1 150 LEU -8.21 8.06 1 151 ARG -3.98 5.21 1 152 MET -5.12 5.57 1 153 GLU 0.42 -2.03 1 154 VAL -2.07 1.97 1 155 LEU -4.32 2.04 1 158 GLU 0.65 0.38 1 159 ALA -0.31 0.99 1 160 GLN -0.41 0.87 1 161 ASP 0.58 0.34 1 162 LEU 0.03 0.45 1 163 TYR 0.46 1.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17829_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.21 _LACS_plot.Line_1_terminator_val_y_1 -2.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.46 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.33 _LACS_plot.Line_2_terminator_val_x_2 8.51 _LACS_plot.Line_2_terminator_val_y_2 0.73 _LACS_plot.Y_axis_chem_shift_offset 0.90 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 LEU 2.62 -6.36 0 11 MET 2.14 2.89 1 12 GLU 3.01 2.62 1 13 SER 0.51 0.99 1 14 LYS 7.12 -1.37 1 15 ALA 2.98 2.88 1 17 SER -0.94 -0.09 1 18 ASP 5.40 1.36 1 19 ALA 1.50 1.20 1 20 GLN -0.17 -1.12 1 21 ILE -0.75 -1.52 1 22 THR -6.15 -2.57 1 23 ALA -6.68 -0.89 1 25 SER -0.52 -2.25 1 26 TYR -2.57 -3.11 1 27 PHE -0.05 -1.30 1 28 THR -1.58 -2.94 1 30 MET 4.35 -0.40 1 31 PHE 0.21 -0.74 1 32 ALA -2.93 -2.47 1 33 THR -1.19 -0.81 1 34 TRP 0.76 -0.20 1 37 SER 2.74 -0.44 1 38 LYS 0.57 0.38 1 39 ALA -0.20 0.15 1 40 ARG -2.16 -1.08 1 41 LEU 0.22 -2.30 1 42 HIS 4.87 1.45 1 43 LEU 2.44 -0.16 1 44 GLN -3.06 -0.28 1 46 ARG 1.19 0.82 1 47 SER 0.43 -0.78 1 48 ASN 4.06 -4.26 1 49 ALA -3.11 -1.35 1 50 TRP -0.96 0.44 1 53 GLN 3.95 -1.15 1 54 VAL -5.26 -2.94 1 55 ASN 0.16 -2.77 1 58 LYS 1.84 0.34 1 59 GLU -1.43 -0.96 1 60 TRP -4.09 -3.65 1 61 LEU -4.00 -3.57 1 63 VAL -3.53 -2.79 1 64 ASP -4.34 0.81 1 65 PHE 2.55 0.95 1 66 GLN 6.61 -3.02 1 67 LYS -2.28 -2.75 1 68 THR 4.54 -1.41 1 70 LYS -0.51 -2.45 1 71 VAL 0.00 -0.40 1 72 THR -1.46 1.71 1 74 VAL -4.95 -3.41 1 75 THR -0.83 -0.02 1 76 THR -4.72 -0.88 1 77 GLN 0.60 -0.59 1 79 VAL -2.56 -4.54 1 81 SER -2.06 -0.26 1 83 LEU 1.62 -0.15 1 84 THR 0.34 1.38 1 85 SER 0.34 -1.57 1 86 MET -2.87 -2.30 1 87 TYR -1.09 -2.96 1 88 VAL 1.39 -1.15 1 89 LYS 0.46 1.20 1 90 GLU -7.61 -0.52 1 91 PHE -3.22 -1.86 1 92 LEU -3.61 -1.05 1 93 ILE -4.29 -1.29 1 94 SER -3.55 -1.63 1 95 SER -3.95 -1.63 1 96 SER -1.07 -1.25 1 97 GLN 0.26 0.25 1 98 ASP -2.30 0.27 1 100 HIS -0.98 -0.19 1 101 GLN -0.63 -0.05 1 102 TRP -2.69 -0.01 1 103 THR -1.67 0.68 1 104 LEU -0.70 -1.78 1 105 PHE 3.06 -0.48 1 106 PHE -4.47 -0.95 1 107 GLN -3.09 -3.38 1 108 ASN 3.59 0.21 1 111 VAL 2.86 -1.05 1 112 LYS -1.13 -2.84 1 113 VAL 1.85 0.01 1 114 PHE 2.28 -0.26 1 115 GLN 0.78 -0.48 1 117 ASN -0.04 -2.67 1 118 GLN -2.12 -2.96 1 119 ASP -1.21 -0.59 1 120 SER -0.09 -2.16 1 121 PHE -2.95 0.23 1 124 VAL -2.38 -1.27 1 125 VAL -0.06 -0.37 1 126 ASN -5.01 -0.83 1 127 SER -0.27 -0.78 1 132 LEU -5.37 -2.02 1 133 LEU -0.26 -0.99 1 134 THR -1.11 -3.48 1 135 ARG 0.61 -3.32 1 136 TYR -6.37 0.69 1 137 LEU 1.26 -3.23 1 138 ARG -5.31 -1.98 1 142 GLN -2.32 -1.12 1 143 SER -1.34 -0.08 1 145 VAL 1.91 -0.51 1 146 HIS 8.51 1.09 1 147 GLN -4.69 -2.69 1 148 ILE 4.11 -2.90 1 149 ALA -5.62 -2.00 1 150 LEU -8.21 -2.78 1 151 ARG -3.98 -1.42 1 152 MET -5.12 -2.39 1 153 GLU 0.42 -3.29 1 154 VAL -2.07 -3.81 1 155 LEU -4.32 -0.64 1 158 GLU 0.65 0.00 1 159 ALA -0.31 -0.91 1 160 GLN -0.41 -0.77 1 161 ASP 0.58 -0.68 1 162 LEU 0.03 -1.70 1 stop_ save_