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 bmr19806_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.69 _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 0.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.95 _LACS_plot.Line_2_terminator_val_x_2 8.04 _LACS_plot.Line_2_terminator_val_y_2 6.04 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 MET 0.67 -3.27 0 11 GLU -3.26 -0.09 1 12 ASP -1.52 0.15 1 13 PHE 5.62 4.85 1 14 LYS 5.02 3.26 1 15 SER 4.17 2.80 1 16 PHE 4.50 2.07 1 17 LEU 3.46 1.52 1 18 ASP 2.95 2.20 1 19 LYS 4.03 2.87 1 20 PHE 3.52 4.39 1 22 SER -0.85 -0.08 1 23 SER -2.84 -2.63 1 24 ALA 1.87 2.61 1 25 ALA 3.45 2.70 1 26 PHE 3.35 3.06 1 27 GLN 6.33 4.39 1 28 TYR 4.69 4.46 1 29 THR 2.20 1.97 1 30 ARG -7.39 -3.24 1 31 VAL -0.28 -1.01 1 32 LYS -0.25 -2.24 1 33 PHE -0.61 0.67 1 35 LEU 0.90 -0.26 1 36 LYS 4.32 4.05 1 40 THR 0.37 0.46 1 41 LEU -5.24 -2.46 1 42 LEU -3.36 -1.38 1 43 ALA -2.12 -1.21 1 44 ASP 2.72 1.83 1 45 ASP 0.83 -0.41 1 47 GLU -2.89 0.34 1 48 THR 2.18 1.03 1 49 GLU -2.73 -1.24 1 50 LYS -4.30 -2.09 1 51 THR -4.30 -2.82 1 52 PHE -3.42 -1.47 1 54 PHE 0.38 -2.19 1 55 THR -0.87 -1.22 1 56 LYS 3.03 3.18 1 57 GLU 3.50 0.55 1 58 LYS 0.48 -0.61 1 59 TRP -3.26 -0.12 1 61 LEU 1.37 -0.22 1 62 LEU -3.40 -1.11 1 63 ASP -5.34 -3.10 1 64 SER 4.03 2.61 1 65 GLU 2.75 1.74 1 66 THR 5.35 4.00 1 68 LYS -1.80 -0.72 1 69 GLU -1.18 -0.66 1 70 GLU -4.39 -1.13 1 71 ARG -1.35 -0.55 1 72 ILE -3.88 -1.59 1 73 THR 1.27 0.14 1 74 GLN -1.10 -1.01 1 75 GLU 2.57 2.24 1 76 GLU 1.01 0.18 1 79 ILE -1.18 -0.76 1 80 TYR -1.56 0.26 1 81 VAL -3.84 -1.74 1 82 SER -4.02 -3.04 1 83 LYS -3.85 -1.44 1 84 PHE 2.79 0.71 1 85 THR 2.96 0.86 1 86 LEU -2.12 0.14 1 87 ASN -1.49 -1.80 1 88 GLU -0.43 0.18 1 90 LYS -1.11 -1.22 1 91 HIS -4.49 -1.30 1 92 LYS -6.29 -1.91 1 93 ILE -2.25 0.04 1 95 GLU -7.38 -2.12 1 96 ALA -7.69 -2.96 1 98 TYR 2.17 1.49 1 99 GLU 1.46 1.81 1 100 GLU 3.12 0.80 1 101 SER -3.29 -2.28 1 102 GLU -0.88 -0.80 1 103 VAL 1.14 0.50 1 104 ASP -0.98 0.71 1 105 LEU -4.27 -0.67 1 106 ARG -4.35 -1.33 1 107 VAL -2.98 -0.53 1 108 GLU -4.51 -1.84 1 109 PHE -5.25 -1.75 1 110 GLU -7.08 -1.16 1 111 LEU 0.37 -1.63 1 112 GLN 0.75 0.10 1 113 ALA 2.92 2.02 1 114 ASP 0.75 -1.29 1 116 LYS -3.97 -2.03 1 118 TYR -6.16 -1.68 1 120 VAL -2.56 -2.61 1 121 ASP -3.33 -0.54 1 123 TYR -3.34 -0.73 1 124 THR -3.46 -4.65 1 126 TRP 3.02 3.06 1 127 TYR -4.30 -4.52 1 129 TYR 1.61 1.66 1 130 ASP 1.34 -1.07 1 131 LEU -0.24 0.50 1 133 ILE 4.50 3.76 1 135 GLU -1.49 -1.19 1 136 LEU 5.41 4.02 1 137 LYS 6.15 4.25 1 138 GLN 3.35 2.18 1 139 THR 8.04 6.34 1 140 ILE 4.85 4.16 1 141 GLN 4.72 2.67 1 142 ASN 3.97 2.70 1 143 VAL 6.21 4.30 1 144 LYS 5.14 3.92 1 145 GLU 3.41 2.58 1 146 GLU 4.08 2.52 1 147 ASN 2.58 1.05 1 148 ALA 4.12 2.63 1 149 ALA 3.51 2.15 1 150 PHE 3.85 3.31 1 151 LYS 2.93 2.57 1 152 GLU 2.21 2.06 1 153 ILE -0.54 -0.07 1 154 HIS -1.23 -1.68 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19806_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 5.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.05 _LACS_plot.Line_2_terminator_val_x_2 8.04 _LACS_plot.Line_2_terminator_val_y_2 -2.00 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 MET 0.67 -3.94 0 11 GLU -3.26 3.17 1 12 ASP -1.52 1.67 1 13 PHE 5.62 -0.77 1 14 LYS 5.02 -1.76 1 15 SER 4.17 -1.37 1 16 PHE 4.50 -2.43 1 17 LEU 3.46 -1.94 1 18 ASP 2.95 -0.75 1 19 LYS 4.03 -1.16 1 20 PHE 3.52 0.87 1 22 SER -0.85 0.77 1 23 SER -2.84 0.21 1 24 ALA 1.87 0.74 1 25 ALA 3.45 -0.75 1 26 PHE 3.35 -0.29 1 27 GLN 6.33 -1.94 1 28 TYR 4.69 -0.23 1 29 THR 2.20 -0.23 1 30 ARG -7.39 4.15 1 31 VAL -0.28 -0.73 1 32 LYS -0.25 -1.99 1 33 PHE -0.61 1.28 1 35 LEU 0.90 -1.16 1 36 LYS 4.32 -0.27 1 40 THR 0.37 0.09 1 41 LEU -5.24 2.78 1 42 LEU -3.36 1.98 1 43 ALA -2.12 0.91 1 44 ASP 2.72 -0.89 1 45 ASP 0.83 -1.24 1 47 GLU -2.89 3.23 1 48 THR 2.18 -1.15 1 49 GLU -2.73 1.49 1 50 LYS -4.30 2.21 1 51 THR -4.30 1.48 1 52 PHE -3.42 1.95 1 54 PHE 0.38 -2.57 1 55 THR -0.87 -0.35 1 56 LYS 3.03 0.15 1 57 GLU 3.50 -2.95 1 58 LYS 0.48 -1.09 1 59 TRP -3.26 3.14 1 61 LEU 1.37 -1.59 1 62 LEU -3.40 2.29 1 63 ASP -5.34 2.24 1 64 SER 4.03 -1.42 1 65 GLU 2.75 -1.01 1 66 THR 5.35 -1.35 1 68 LYS -1.80 1.08 1 69 GLU -1.18 0.52 1 70 GLU -4.39 3.26 1 71 ARG -1.35 0.80 1 72 ILE -3.88 2.29 1 73 THR 1.27 -1.13 1 74 GLN -1.10 0.09 1 75 GLU 2.57 -0.33 1 76 GLU 1.01 -0.83 1 79 ILE -1.18 0.42 1 80 TYR -1.56 1.82 1 81 VAL -3.84 2.10 1 82 SER -4.02 0.98 1 83 LYS -3.85 2.41 1 84 PHE 2.79 -2.08 1 85 THR 2.96 -2.10 1 86 LEU -2.12 2.26 1 87 ASN -1.49 -0.31 1 88 GLU -0.43 0.61 1 90 LYS -1.11 -0.11 1 91 HIS -4.49 3.19 1 92 LYS -6.29 4.38 1 93 ILE -2.25 2.29 1 95 GLU -7.38 5.26 1 96 ALA -7.69 4.73 1 98 TYR 2.17 -0.68 1 99 GLU 1.46 0.35 1 100 GLU 3.12 -2.32 1 101 SER -3.29 1.01 1 102 GLU -0.88 0.08 1 103 VAL 1.14 -0.64 1 104 ASP -0.98 1.69 1 105 LEU -4.27 3.60 1 106 ARG -4.35 3.02 1 107 VAL -2.98 2.45 1 108 GLU -4.51 2.67 1 109 PHE -5.25 3.50 1 110 GLU -7.08 5.92 1 111 LEU 0.37 -2.00 1 112 GLN 0.75 -0.65 1 113 ALA 2.92 -0.90 1 114 ASP 0.75 -2.04 1 116 LYS -3.97 1.94 1 118 TYR -6.16 4.48 1 120 VAL -2.56 -0.05 1 121 ASP -3.33 2.79 1 123 TYR -3.34 2.61 1 124 THR -3.46 -1.19 1 126 TRP 3.02 0.04 1 127 TYR -4.30 -0.22 1 129 TYR 1.61 0.05 1 130 ASP 1.34 -2.41 1 131 LEU -0.24 0.74 1 133 ILE 4.50 -0.74 1 135 GLU -1.49 0.30 1 136 LEU 5.41 -1.39 1 137 LYS 6.15 -1.90 1 138 GLN 3.35 -1.17 1 139 THR 8.04 -1.70 1 140 ILE 4.85 -0.69 1 141 GLN 4.72 -2.05 1 142 ASN 3.97 -1.27 1 143 VAL 6.21 -1.91 1 144 LYS 5.14 -1.22 1 145 GLU 3.41 -0.83 1 146 GLU 4.08 -1.56 1 147 ASN 2.58 -1.53 1 148 ALA 4.12 -1.49 1 149 ALA 3.51 -1.36 1 150 PHE 3.85 -0.54 1 151 LYS 2.93 -0.36 1 152 GLU 2.21 -0.15 1 153 ILE -0.54 0.47 1 154 HIS -1.23 -0.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19806_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 0.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 8.04 _LACS_plot.Line_2_terminator_val_y_2 -0.85 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 LYS 3.03 -1.84 0 11 GLU -3.26 -0.16 1 12 ASP -1.52 0.11 1 13 PHE 5.62 -1.21 1 14 LYS 5.02 -0.74 1 15 SER 4.17 -0.30 1 16 PHE 4.50 -0.33 1 17 LEU 3.46 -1.49 1 18 ASP 2.95 -0.52 1 19 LYS 4.03 -0.64 1 20 PHE 3.52 -0.51 1 22 SER -0.85 -0.30 1 23 SER -2.84 0.29 1 24 ALA 1.87 -0.36 1 25 ALA 3.45 0.00 1 26 PHE 3.35 -0.31 1 27 GLN 6.33 -0.95 1 28 TYR 4.69 -0.42 1 29 THR 2.20 0.14 1 30 ARG -7.39 0.36 1 31 VAL -0.28 0.11 1 32 LYS -0.25 -0.14 1 33 PHE -0.61 -0.38 1 35 LEU 0.90 -0.12 1 36 LYS 4.32 -0.34 1 40 THR 0.37 0.71 1 41 LEU -5.24 0.76 1 42 LEU -3.36 0.41 1 43 ALA -2.12 0.11 1 44 ASP 2.72 -0.21 1 45 ASP 0.83 -0.17 1 47 GLU -2.89 0.18 1 48 THR 2.18 -0.11 1 49 GLU -2.73 0.60 1 50 LYS -4.30 0.32 1 51 THR -4.30 1.27 1 52 PHE -3.42 0.07 1 54 PHE 0.38 0.21 1 55 THR -0.87 0.06 1 57 GLU 3.50 -0.08 1 58 LYS 0.48 -0.01 1 59 TRP -3.26 0.11 1 61 LEU 1.37 -0.70 1 62 LEU -3.40 0.02 1 63 ASP -5.34 0.39 1 64 SER 4.03 -0.60 1 65 GLU 2.75 -0.33 1 66 THR 5.35 -0.36 1 67 MET 0.67 -0.21 1 68 LYS -1.80 0.05 1 69 GLU -1.18 0.17 1 70 GLU -4.39 0.35 1 71 ARG -1.35 0.81 1 72 ILE -3.88 0.43 1 73 THR 1.27 0.25 1 74 GLN -1.10 0.24 1 75 GLU 2.57 -0.29 1 76 GLU 1.01 -0.04 1 79 ILE -1.18 0.64 1 80 TYR -1.56 -0.29 1 81 VAL -3.84 0.73 1 82 SER -4.02 0.71 1 83 LYS -3.85 0.46 1 84 PHE 2.79 0.82 1 85 THR 2.96 -0.29 1 86 LEU -2.12 0.26 1 87 ASN -1.49 0.27 1 88 GLU -0.43 0.23 1 90 LYS -1.11 0.36 1 91 HIS -4.49 1.05 1 92 LYS -6.29 0.81 1 93 ILE -2.25 1.14 1 95 GLU -7.38 1.07 1 96 ALA -7.69 1.06 1 98 TYR 2.17 0.27 1 99 GLU 1.46 -0.34 1 100 GLU 3.12 -0.31 1 101 SER -3.29 0.37 1 102 GLU -0.88 0.04 1 103 VAL 1.14 -0.03 1 104 ASP -0.98 0.36 1 105 LEU -4.27 0.95 1 106 ARG -4.35 1.49 1 107 VAL -2.98 0.56 1 108 GLU -4.51 0.92 1 109 PHE -5.25 1.41 1 110 GLU -7.08 0.84 1 111 LEU 0.37 -0.53 1 112 GLN 0.75 0.10 1 113 ALA 2.92 -0.27 1 114 ASP 0.75 -0.24 1 116 LYS -3.97 0.13 1 118 TYR -6.16 0.73 1 120 VAL -2.56 0.62 1 121 ASP -3.33 0.62 1 123 TYR -3.34 0.46 1 124 THR -3.46 0.64 1 126 TRP 3.02 -0.59 1 127 TYR -4.30 0.44 1 129 TYR 1.61 0.11 1 130 ASP 1.34 -0.26 1 131 LEU -0.24 -0.20 1 133 ILE 4.50 -0.44 1 135 GLU -1.49 0.31 1 136 LEU 5.41 -0.30 1 137 LYS 6.15 -0.46 1 138 GLN 3.35 -0.29 1 139 THR 8.04 0.18 1 140 ILE 4.85 -0.44 1 141 GLN 4.72 -0.33 1 142 ASN 3.97 -0.23 1 143 VAL 6.21 -1.40 1 144 LYS 5.14 -0.44 1 145 GLU 3.41 -0.17 1 146 GLU 4.08 -0.07 1 147 ASN 2.58 -0.17 1 148 ALA 4.12 -0.20 1 149 ALA 3.51 -0.06 1 150 PHE 3.85 -0.40 1 151 LYS 2.93 -0.41 1 152 GLU 2.21 -0.30 1 153 ILE -0.54 0.01 1 154 HIS -1.23 0.14 1 stop_ save_