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 bmr6460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 -3.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 6.50 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 ASN -3.40 2.24 0 10 ASN 0.41 2.20 1 11 THR 0.15 1.13 1 14 SER 3.49 5.10 1 16 MET 4.25 2.18 1 17 ALA 2.26 2.83 1 18 GLU 2.35 2.67 1 19 ALA 1.34 2.86 1 20 LEU 4.13 3.86 1 21 PHE 5.12 4.81 1 22 LYS 3.66 3.07 1 23 SER 3.27 4.14 1 24 ILE 4.66 3.18 1 25 ALA 3.44 2.99 1 26 GLU 3.94 3.07 1 27 ARG -1.07 -0.85 1 28 GLU -2.93 -1.20 1 30 LEU 0.77 -0.27 1 31 ASN -5.42 -2.86 1 32 VAL -1.57 -0.57 1 33 ASN -3.20 -1.47 1 34 VAL -6.29 -1.73 1 35 ARG -3.53 -0.52 1 36 SER -4.69 -1.18 1 37 ALA 2.64 1.70 1 39 VAL -1.12 -1.72 1 40 PHE -1.63 -0.46 1 41 ALA -1.01 -0.43 1 42 SER 1.56 0.80 1 44 ASN -3.37 -1.37 1 46 LYS -0.22 -0.26 1 47 ALA -0.26 -1.26 1 48 THR 1.68 2.13 1 50 HIS 4.09 3.34 1 51 ALA 4.96 4.21 1 52 VAL 2.91 2.85 1 53 GLU 4.47 2.67 1 54 ALA 6.02 2.96 1 55 LEU 4.67 3.85 1 56 PHE 1.88 2.19 1 57 GLU -0.84 -2.57 1 58 LYS 3.98 1.50 1 59 HIS -2.56 -1.10 1 60 ILE -1.32 -1.00 1 61 ALA -1.45 -0.64 1 62 LEU -0.54 -0.66 1 64 HIS -2.67 -1.67 1 65 VAL -0.49 0.77 1 66 SER -3.55 -0.83 1 67 SER 0.49 0.47 1 69 LEU -5.65 -2.60 1 70 THR 3.83 3.40 1 71 GLU 4.38 3.50 1 72 GLU 2.42 2.40 1 73 LEU 3.60 -0.20 1 74 MET 2.99 2.56 1 75 GLU 1.08 1.32 1 76 SER -0.12 0.02 1 77 ALA -0.12 2.36 1 78 ASP -4.97 -0.55 1 79 LEU -1.09 -1.20 1 80 VAL -3.94 -3.04 1 81 LEU -4.64 -2.84 1 82 ALA 0.54 2.10 1 83 MET -5.64 -3.19 1 84 THR 5.89 6.09 1 85 HIS 5.13 3.73 1 86 GLN 0.01 4.16 1 87 HIS 4.19 3.97 1 88 LYS 4.12 3.09 1 89 GLN 4.34 4.14 1 90 ILE 4.99 5.07 1 91 ILE 3.56 2.60 1 92 ALA 2.85 2.43 1 93 SER 1.45 2.08 1 94 GLN -1.96 -2.32 1 95 PHE 3.15 2.00 1 97 ARG -2.32 -1.60 1 98 TYR 4.21 3.34 1 99 ARG 2.72 1.73 1 100 ASP -0.79 -0.08 1 101 LYS -0.90 -1.38 1 102 VAL -7.49 -2.04 1 103 PHE -0.15 -0.43 1 104 THR 3.57 3.64 1 105 LEU 7.50 5.72 1 106 LYS 3.91 2.38 1 107 GLU 2.84 4.21 1 108 TYR 1.03 1.75 1 109 VAL -2.23 0.22 1 110 THR -2.61 -1.17 1 112 SER -0.56 1.67 1 113 HIS -2.96 -0.76 1 115 ASP 0.39 0.37 1 116 VAL 1.04 1.39 1 117 LEU -2.40 -1.15 1 118 ASP 4.18 3.92 1 120 PHE -2.79 -0.98 1 123 SER 2.32 1.00 1 124 ILE 4.46 3.71 1 125 ASP 4.16 1.84 1 126 ILE 5.89 6.43 1 127 TYR 6.09 5.28 1 128 LYS 4.76 3.73 1 129 GLN 8.20 6.67 1 130 THR 5.14 3.80 1 131 ARG 4.97 3.39 1 132 ASP 2.80 3.02 1 133 GLU 2.31 2.94 1 134 LEU 4.93 4.77 1 135 GLU 3.45 3.02 1 136 GLU 1.86 2.86 1 137 LEU 2.54 1.92 1 138 LEU 5.15 4.55 1 139 ARG 4.39 3.36 1 140 GLN 3.76 2.91 1 141 LEU 3.67 3.07 1 142 ALA 3.82 3.24 1 143 LYS 3.75 3.18 1 144 GLN 1.89 1.57 1 145 LEU 2.06 1.76 1 146 LYS 1.78 1.38 1 147 LYS 0.36 0.63 1 148 ASP 0.72 0.12 1 149 ARG 0.95 1.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 4.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.93 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 ASN -3.40 5.64 0 10 ASN 0.41 1.79 1 11 THR 0.15 0.98 1 14 SER 3.49 1.61 1 16 MET 4.25 -2.07 1 17 ALA 2.26 0.57 1 18 GLU 2.35 0.32 1 19 ALA 1.34 1.52 1 20 LEU 4.13 -0.27 1 21 PHE 5.12 -0.31 1 22 LYS 3.66 -0.59 1 23 SER 3.27 0.87 1 24 ILE 4.66 -1.48 1 25 ALA 3.44 -0.45 1 26 GLU 3.94 -0.87 1 27 ARG -1.07 0.22 1 28 GLU -2.93 1.73 1 30 LEU 0.77 -1.04 1 31 ASN -5.42 2.56 1 32 VAL -1.57 1.00 1 33 ASN -3.20 1.73 1 34 VAL -6.29 4.56 1 35 ARG -3.53 3.01 1 36 SER -4.69 3.51 1 37 ALA 2.64 -0.94 1 39 VAL -1.12 -0.60 1 40 PHE -1.63 1.17 1 41 ALA -1.01 0.58 1 42 SER 1.56 -0.76 1 44 ASN -3.37 2.00 1 46 LYS -0.22 -0.04 1 47 ALA -0.26 -1.00 1 48 THR 1.68 0.45 1 50 HIS 4.09 -0.75 1 51 ALA 4.96 -0.75 1 52 VAL 2.91 -0.06 1 53 GLU 4.47 -1.80 1 54 ALA 6.02 -3.06 1 55 LEU 4.67 -0.82 1 56 PHE 1.88 0.31 1 57 GLU -0.84 -1.73 1 58 LYS 3.98 -2.48 1 59 HIS -2.56 1.46 1 60 ILE -1.32 0.32 1 61 ALA -1.45 0.81 1 62 LEU -0.54 -0.12 1 64 HIS -2.67 1.00 1 65 VAL -0.49 1.26 1 66 SER -3.55 2.72 1 67 SER 0.49 -0.02 1 69 LEU -5.65 3.05 1 70 THR 3.83 -0.43 1 71 GLU 4.38 -0.88 1 72 GLU 2.42 -0.02 1 73 LEU 3.60 -3.80 1 74 MET 2.99 -0.43 1 75 GLU 1.08 0.24 1 76 SER -0.12 0.14 1 77 ALA -0.12 2.48 1 78 ASP -4.97 4.42 1 79 LEU -1.09 -0.11 1 80 VAL -3.94 0.90 1 81 LEU -4.64 1.80 1 82 ALA 0.54 1.56 1 83 MET -5.64 2.45 1 84 THR 5.89 0.20 1 85 HIS 5.13 -1.40 1 86 GLN 0.01 4.15 1 87 HIS 4.19 -0.22 1 88 LYS 4.12 -1.03 1 89 GLN 4.34 -0.20 1 90 ILE 4.99 0.08 1 91 ILE 3.56 -0.96 1 92 ALA 2.85 -0.42 1 93 SER 1.45 0.63 1 94 GLN -1.96 -0.36 1 95 PHE 3.15 -1.15 1 97 ARG -2.32 0.72 1 98 TYR 4.21 -0.87 1 99 ARG 2.72 -0.99 1 100 ASP -0.79 0.71 1 101 LYS -0.90 -0.48 1 102 VAL -7.49 5.45 1 103 PHE -0.15 -0.28 1 104 THR 3.57 0.07 1 105 LEU 7.50 -1.78 1 106 LYS 3.91 -1.53 1 107 GLU 2.84 1.37 1 108 TYR 1.03 0.72 1 109 VAL -2.23 2.45 1 110 THR -2.61 1.44 1 112 SER -0.56 2.23 1 113 HIS -2.96 2.20 1 115 ASP 0.39 -0.02 1 116 VAL 1.04 0.35 1 117 LEU -2.40 1.25 1 118 ASP 4.18 -0.26 1 120 PHE -2.79 1.81 1 123 SER 2.32 -1.32 1 124 ILE 4.46 -0.75 1 125 ASP 4.16 -2.32 1 126 ILE 5.89 0.54 1 127 TYR 6.09 -0.81 1 128 LYS 4.76 -1.03 1 129 GLN 8.20 -1.53 1 130 THR 5.14 -1.34 1 131 ARG 4.97 -1.58 1 132 ASP 2.80 0.22 1 133 GLU 2.31 0.63 1 134 LEU 4.93 -0.16 1 135 GLU 3.45 -0.43 1 136 GLU 1.86 1.00 1 137 LEU 2.54 -0.62 1 138 LEU 5.15 -0.60 1 139 ARG 4.39 -1.03 1 140 GLN 3.76 -0.85 1 141 LEU 3.67 -0.60 1 142 ALA 3.82 -0.58 1 143 LYS 3.75 -0.57 1 144 GLN 1.89 -0.32 1 145 LEU 2.06 -0.30 1 146 LYS 1.78 -0.40 1 147 LYS 0.36 0.27 1 148 ASP 0.72 -0.60 1 149 ARG 0.95 0.55 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 0.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _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 102 VAL -7.49 0.33 0 35 ARG -3.53 1.27 0 10 ASN 0.41 -0.77 1 11 THR 0.15 0.10 1 14 SER 3.49 -0.56 1 16 MET 4.25 -0.76 1 17 ALA 2.26 -0.53 1 18 GLU 2.35 -0.20 1 19 ALA 1.34 -0.32 1 20 LEU 4.13 -0.25 1 21 PHE 5.12 -0.49 1 22 LYS 3.66 -0.16 1 23 SER 3.27 -0.59 1 24 ILE 4.66 -0.78 1 25 ALA 3.44 -0.25 1 26 GLU 3.94 -0.23 1 27 ARG -1.07 -0.02 1 28 GLU -2.93 0.06 1 30 LEU 0.77 0.12 1 31 ASN -5.42 0.73 1 32 VAL -1.57 0.37 1 33 ASN -3.20 0.97 1 34 VAL -6.29 0.67 1 36 SER -4.69 0.37 1 37 ALA 2.64 0.00 1 39 VAL -1.12 0.36 1 40 PHE -1.63 -0.03 1 41 ALA -1.01 0.06 1 42 SER 1.56 -0.22 1 44 ASN -3.37 0.59 1 46 LYS -0.22 0.48 1 47 ALA -0.26 0.04 1 48 THR 1.68 -0.26 1 50 HIS 4.09 -0.14 1 51 ALA 4.96 -0.59 1 52 VAL 2.91 -0.22 1 53 GLU 4.47 -0.34 1 54 ALA 6.02 -0.29 1 55 LEU 4.67 -0.43 1 56 PHE 1.88 -0.42 1 57 GLU -0.84 -0.09 1 58 LYS 3.98 -0.75 1 59 HIS -2.56 0.04 1 60 ILE -1.32 -0.06 1 61 ALA -1.45 0.14 1 62 LEU -0.54 0.20 1 63 ASN -3.40 0.06 1 64 HIS -2.67 0.26 1 65 VAL -0.49 0.08 1 66 SER -3.55 0.26 1 67 SER 0.49 -0.43 1 69 LEU -5.65 0.48 1 70 THR 3.83 -0.85 1 71 GLU 4.38 -0.40 1 72 GLU 2.42 -0.51 1 73 LEU 3.60 -0.72 1 74 MET 2.99 -1.10 1 75 GLU 1.08 -0.40 1 76 SER -0.12 -0.37 1 77 ALA -0.12 0.20 1 78 ASP -4.97 0.34 1 79 LEU -1.09 0.34 1 80 VAL -3.94 1.03 1 81 LEU -4.64 0.71 1 82 ALA 0.54 0.41 1 83 MET -5.64 0.99 1 84 THR 5.89 -0.90 1 85 HIS 5.13 -0.26 1 86 GLN 0.01 -0.52 1 87 HIS 4.19 -0.78 1 88 LYS 4.12 -0.34 1 89 GLN 4.34 -0.41 1 90 ILE 4.99 -0.64 1 91 ILE 3.56 -0.52 1 92 ALA 2.85 -0.21 1 93 SER 1.45 -0.35 1 94 GLN -1.96 0.55 1 95 PHE 3.15 -0.31 1 97 ARG -2.32 0.43 1 98 TYR 4.21 -0.53 1 99 ARG 2.72 -0.21 1 100 ASP -0.79 0.37 1 101 LYS -0.90 0.81 1 103 PHE -0.15 0.71 1 104 THR 3.57 -0.14 1 105 LEU 7.50 -0.35 1 106 LYS 3.91 -0.11 1 107 GLU 2.84 -0.81 1 108 TYR 1.03 0.20 1 109 VAL -2.23 0.32 1 110 THR -2.61 0.22 1 112 SER -0.56 -0.25 1 113 HIS -2.96 0.66 1 115 ASP 0.39 0.04 1 116 VAL 1.04 -0.38 1 117 LEU -2.40 -0.38 1 118 ASP 4.18 -0.26 1 120 PHE -2.79 0.14 1 123 SER 2.32 -0.43 1 124 ILE 4.46 -0.32 1 125 ASP 4.16 -0.11 1 126 ILE 5.89 -0.77 1 127 TYR 6.09 -0.61 1 128 LYS 4.76 -0.22 1 129 GLN 8.20 -0.51 1 130 THR 5.14 -0.65 1 131 ARG 4.97 -0.17 1 132 ASP 2.80 -0.21 1 133 GLU 2.31 -0.44 1 134 LEU 4.93 -0.70 1 135 GLU 3.45 -0.21 1 136 GLU 1.86 -0.21 1 137 LEU 2.54 -0.13 1 138 LEU 5.15 -0.19 1 139 ARG 4.39 -0.20 1 140 GLN 3.76 -0.06 1 141 LEU 3.67 -0.25 1 142 ALA 3.82 -0.36 1 143 LYS 3.75 -0.28 1 144 GLN 1.89 -0.09 1 145 LEU 2.06 -0.23 1 146 LYS 1.78 -0.10 1 147 LYS 0.36 -0.01 1 148 ASP 0.72 0.02 1 149 ARG 0.95 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 -2.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.67 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 3.34 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 103 PHE -7.49 1.12 0 16 MET 3.49 0.63 1 17 ALA 4.25 -0.54 1 18 GLU 2.26 0.15 1 19 ALA 2.35 3.61 1 20 LEU 1.34 1.69 1 21 PHE 4.13 0.96 1 22 LYS 5.12 2.40 1 23 SER 3.66 2.77 1 24 ILE 3.27 1.18 1 25 ALA 4.66 1.78 1 26 GLU 3.44 3.41 1 27 ARG 3.94 2.22 1 28 GLU -1.07 -0.05 1 30 LEU -2.93 -1.97 1 32 VAL -5.42 -2.78 1 33 ASN -1.57 -1.24 1 34 VAL -3.20 -2.18 1 35 ARG -6.29 -1.53 1 36 SER -3.53 -2.65 1 37 ALA -4.69 -2.55 1 39 VAL 2.64 -0.54 1 40 PHE -1.12 -0.84 1 41 ALA -1.63 -0.65 1 42 SER -1.01 0.44 1 44 ASN 1.56 0.04 1 46 LYS -3.37 -0.03 1 47 ALA -0.22 -0.12 1 48 THR -0.26 -0.61 1 50 HIS 1.68 3.31 1 51 ALA 4.09 1.07 1 52 VAL 4.96 4.04 1 53 GLU 2.91 2.63 1 54 ALA 4.47 2.40 1 55 LEU 6.02 1.20 1 56 PHE 4.67 3.82 1 57 GLU 1.88 0.36 1 58 LYS -0.84 -2.06 1 59 HIS 3.98 0.14 1 60 ILE -2.56 -1.90 1 61 ALA -1.32 -2.10 1 62 LEU -1.45 -3.23 1 64 HIS -3.40 -0.28 1 65 VAL -2.67 -1.52 1 66 SER -0.49 -0.40 1 67 SER -3.55 -1.24 1 69 LEU 0.49 -2.47 1 70 THR -5.65 -0.26 1 71 GLU 3.83 0.66 1 72 GLU 4.38 3.10 1 73 LEU 2.42 1.04 1 74 MET 3.60 1.62 1 75 GLU 2.99 0.83 1 76 SER 1.08 -0.03 1 77 ALA -0.12 -0.73 1 78 ASP -0.12 -0.22 1 79 LEU -4.97 -4.23 1 80 VAL -1.09 -2.72 1 81 LEU -3.94 -2.12 1 82 ALA -4.64 0.66 1 83 MET 0.54 1.67 1 84 THR -5.64 0.31 1 85 HIS 5.89 3.59 1 86 GLN 5.13 2.73 1 87 HIS 0.01 3.32 1 88 LYS 4.19 -0.13 1 89 GLN 4.12 3.37 1 90 ILE 4.34 2.49 1 91 ILE 4.99 1.32 1 92 ALA 3.56 0.84 1 93 SER 2.85 1.61 1 94 GLN 1.45 0.62 1 95 PHE -1.96 1.00 1 97 ARG 3.15 0.66 1 98 TYR -2.32 0.13 1 99 ARG 4.21 0.54 1 100 ASP 2.72 -0.07 1 101 LYS -0.79 -2.99 1 102 VAL -0.90 -2.16 1 104 THR -0.15 1.15 1 107 GLU 3.91 1.94 1 108 TYR 2.84 1.12 1 109 VAL 1.03 1.03 1 110 THR -2.23 1.58 1 112 SER -2.61 -2.13 1 113 HIS -0.56 2.52 1 115 ASP -2.96 0.73 1 116 VAL 0.39 -0.85 1 117 LEU 1.04 -1.70 1 118 ASP -2.40 0.63 1 120 PHE 4.18 1.86 1 123 SER -2.79 1.23 1 124 ILE 2.32 -0.44 1 125 ASP 4.46 2.51 1 126 ILE 4.16 2.95 1 127 TYR 5.89 3.06 1 128 LYS 6.09 0.86 1 129 GLN 4.76 3.78 1 130 THR 8.20 0.98 1 131 ARG 5.14 0.31 1 132 ASP 4.97 2.65 1 133 GLU 2.80 2.95 1 134 LEU 2.31 0.75 1 135 GLU 4.93 1.10 1 136 GLU 3.45 3.41 1 137 LEU 1.86 1.58 1 138 LEU 2.54 1.88 1 139 ARG 5.15 3.53 1 140 GLN 4.39 2.84 1 141 LEU 3.76 0.37 1 142 ALA 3.67 0.90 1 143 LYS 3.82 3.04 1 144 GLN 3.75 2.87 1 145 LEU 1.89 1.17 1 146 LYS 2.06 0.82 1 147 LYS 1.78 0.13 1 148 ASP 0.36 -0.35 1 149 ARG 0.72 -0.86 1 150 ARG 0.95 4.91 1 stop_ save_