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 bmr25533_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 -2.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 4.35 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 ASP -1.03 -3.23 0 10 MET -1.33 -0.55 1 12 ASN -0.08 -0.75 1 13 ALA 3.15 3.06 1 15 GLN -0.77 -0.08 1 16 ASN 4.76 1.78 1 19 THR -1.04 0.12 1 21 HIS -2.41 -0.19 1 22 ASN 0.83 1.62 1 24 HIS 3.64 3.42 1 27 TYR -1.22 -0.55 1 28 ASN -4.33 -0.78 1 30 VAL 1.09 0.12 1 32 VAL 0.34 0.35 1 33 ASN 2.60 2.31 1 35 TRP -4.43 -1.99 1 36 THR -2.69 -1.96 1 38 GLU 3.63 3.14 1 39 ASP -2.09 -1.98 1 41 SER 0.44 0.99 1 42 GLU -1.46 -0.88 1 43 ASN -0.02 -1.14 1 44 ILE 2.09 1.90 1 45 ASP 1.68 0.17 1 46 ASP 1.49 2.77 1 48 ALA 3.44 2.53 1 49 SER -0.91 -1.18 1 50 ALA 0.28 0.30 1 51 ALA -0.35 -0.93 1 53 PHE 0.05 0.95 1 54 HIS 3.28 3.16 1 56 ALA -3.71 -1.21 1 57 THR -0.43 0.25 1 60 ASP 0.60 2.69 1 61 ARG -1.26 -1.58 1 62 VAL 5.85 2.87 1 63 ALA 2.22 0.02 1 64 SER -0.10 -0.36 1 65 PHE -4.64 -1.81 1 66 TYR -4.55 -1.60 1 68 GLU -2.60 -1.75 1 71 HIS 3.33 3.49 1 73 ARG -4.64 -2.90 1 74 THR -1.38 -1.50 1 76 LEU 3.21 3.82 1 77 LEU -0.63 -1.75 1 79 HIS -0.40 1.82 1 80 LEU -3.44 -2.25 1 81 ASN 0.49 0.17 1 82 ASP -0.16 -0.47 1 83 ALA 0.58 1.05 1 85 ILE 3.59 2.45 1 86 SER 0.15 -0.79 1 87 ASN 2.64 2.04 1 90 ASN 0.18 0.31 1 91 GLU 2.51 1.92 1 93 SER -1.14 0.22 1 94 ASN -1.64 -0.34 1 96 ASP -4.26 -0.62 1 97 THR 1.23 1.35 1 100 VAL 3.06 2.28 1 101 ASN -2.11 -1.23 1 103 LYS -0.66 -0.23 1 104 ALA -0.20 -0.04 1 105 ILE -2.02 -0.56 1 107 THR -3.06 -1.10 1 110 SER 2.46 2.03 1 112 TYR -4.38 -0.39 1 113 THR -1.85 -1.88 1 116 ALA -0.06 -0.90 1 118 SER -1.62 -0.18 1 119 GLN -1.78 -1.19 1 120 ASP -1.57 0.85 1 121 VAL -0.38 0.25 1 123 GLU 6.24 4.52 1 125 SER -1.02 -0.48 1 126 LEU 0.41 0.41 1 128 ALA -1.28 -0.99 1 132 GLU -0.94 -0.61 1 133 HIS 5.66 2.48 1 134 ALA 2.76 0.52 1 136 LYS -1.51 -0.69 1 138 ILE -1.92 -1.05 1 139 ASN 1.22 1.70 1 140 THR -3.64 -2.21 1 141 LEU 3.38 1.21 1 143 SER -1.55 -2.34 1 144 PHE -0.51 -0.34 1 145 GLU -6.21 -2.29 1 147 GLN -0.53 -1.04 1 149 LEU -0.85 -0.24 1 150 GLN 3.18 2.17 1 152 TYR -1.33 0.08 1 153 THR -3.30 -1.38 1 156 ARG -0.41 -1.73 1 158 GLU 1.48 1.58 1 159 ILE 3.45 2.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25533_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 3.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 -1.88 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 ASP -1.03 -2.20 0 10 MET -1.33 0.78 1 12 ASN -0.08 -0.67 1 13 ALA 3.15 -0.09 1 15 GLN -0.77 0.69 1 16 ASN 4.76 -2.98 1 19 THR -1.04 1.16 1 21 HIS -2.41 2.22 1 22 ASN 0.83 0.79 1 24 HIS 3.64 -0.22 1 27 TYR -1.22 0.67 1 28 ASN -4.33 3.55 1 30 VAL 1.09 -0.97 1 32 VAL 0.34 0.01 1 33 ASN 2.60 -0.29 1 35 TRP -4.43 2.44 1 36 THR -2.69 0.73 1 38 GLU 3.63 -0.49 1 39 ASP -2.09 0.11 1 41 SER 0.44 0.55 1 42 GLU -1.46 0.58 1 43 ASN -0.02 -1.12 1 44 ILE 2.09 -0.19 1 45 ASP 1.68 -1.51 1 46 ASP 1.49 1.28 1 48 ALA 3.44 -0.91 1 49 SER -0.91 -0.27 1 50 ALA 0.28 0.02 1 51 ALA -0.35 -0.58 1 53 PHE 0.05 0.90 1 54 HIS 3.28 -0.12 1 56 ALA -3.71 2.50 1 57 THR -0.43 0.68 1 60 ASP 0.60 2.09 1 61 ARG -1.26 -0.32 1 62 VAL 5.85 -2.98 1 63 ALA 2.22 -2.20 1 64 SER -0.10 -0.26 1 65 PHE -4.64 2.83 1 66 TYR -4.55 2.95 1 68 GLU -2.60 0.85 1 71 HIS 3.33 0.16 1 73 ARG -4.64 1.74 1 74 THR -1.38 -0.12 1 76 LEU 3.21 0.61 1 77 LEU -0.63 -1.12 1 79 HIS -0.40 2.22 1 80 LEU -3.44 1.19 1 81 ASN 0.49 -0.32 1 82 ASP -0.16 -0.31 1 83 ALA 0.58 0.47 1 85 ILE 3.59 -1.14 1 86 SER 0.15 -0.94 1 87 ASN 2.64 -0.60 1 90 ASN 0.18 0.13 1 91 GLU 2.51 -0.59 1 93 SER -1.14 1.36 1 94 ASN -1.64 1.30 1 96 ASP -4.26 3.64 1 97 THR 1.23 0.12 1 100 VAL 3.06 -0.78 1 101 ASN -2.11 0.88 1 103 LYS -0.66 0.43 1 104 ALA -0.20 0.16 1 105 ILE -2.02 1.46 1 107 THR -3.06 1.96 1 110 SER 2.46 -0.43 1 112 TYR -4.38 3.99 1 113 THR -1.85 -0.03 1 116 ALA -0.06 -0.84 1 118 SER -1.62 1.44 1 119 GLN -1.78 0.59 1 120 ASP -1.57 2.42 1 121 VAL -0.38 0.63 1 123 GLU 6.24 -1.72 1 125 SER -1.02 0.54 1 126 LEU 0.41 0.00 1 128 ALA -1.28 0.29 1 132 GLU -0.94 0.33 1 133 HIS 5.66 -3.18 1 134 ALA 2.76 -2.24 1 136 LYS -1.51 0.82 1 138 ILE -1.92 0.87 1 139 ASN 1.22 0.48 1 140 THR -3.64 1.43 1 141 LEU 3.38 -2.17 1 143 SER -1.55 -0.79 1 144 PHE -0.51 0.17 1 145 GLU -6.21 3.92 1 147 GLN -0.53 -0.51 1 149 LEU -0.85 0.61 1 150 GLN 3.18 -1.01 1 152 TYR -1.33 1.41 1 153 THR -3.30 1.92 1 156 ARG -0.41 -1.32 1 158 GLU 1.48 0.10 1 159 ILE 3.45 -0.79 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25533_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 0.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 -0.75 _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 43 ASN -0.02 -0.70 0 123 GLU 6.24 -0.87 0 156 ARG -0.41 0.74 0 145 GLU -6.21 0.26 0 10 MET -1.33 0.03 1 12 ASN -0.08 -0.02 1 13 ALA 3.15 -0.52 1 15 GLN -0.77 -0.26 1 16 ASN 4.76 -0.84 1 19 THR -1.04 0.04 1 21 HIS -2.41 0.14 1 22 ASN 0.83 0.14 1 24 HIS 3.64 -0.38 1 27 TYR -1.22 0.62 1 28 ASN -4.33 0.14 1 30 VAL 1.09 0.12 1 32 VAL 0.34 -0.04 1 33 ASN 2.60 -0.30 1 35 TRP -4.43 0.87 1 36 THR -2.69 0.53 1 38 GLU 3.63 -0.31 1 39 ASP -2.09 0.55 1 41 SER 0.44 0.04 1 42 GLU -1.46 0.27 1 44 ILE 2.09 -0.66 1 45 ASP 1.68 -0.25 1 48 ALA 3.44 -0.33 1 49 SER -0.91 -0.04 1 50 ALA 0.28 -0.63 1 51 ALA -0.35 -0.07 1 53 PHE 0.05 -0.34 1 54 HIS 3.28 -0.60 1 56 ALA -3.71 0.38 1 57 THR -0.43 0.43 1 61 ARG -1.26 0.55 1 63 ALA 2.22 0.09 1 64 SER -0.10 -0.11 1 65 PHE -4.64 0.59 1 66 TYR -4.55 0.36 1 68 GLU -2.60 0.02 1 71 HIS 3.33 -0.45 1 73 ARG -4.64 0.92 1 76 LEU 3.21 -0.20 1 77 LEU -0.63 -0.54 1 80 LEU -3.44 0.05 1 81 ASN 0.49 -0.04 1 82 ASP -0.16 0.11 1 83 ALA 0.58 -0.17 1 85 ILE 3.59 -0.28 1 86 SER 0.15 -0.03 1 87 ASN 2.64 -0.50 1 90 ASN 0.18 -0.26 1 91 GLU 2.51 -0.36 1 93 SER -1.14 0.24 1 94 ASN -1.64 0.09 1 96 ASP -4.26 0.29 1 97 THR 1.23 -0.04 1 100 VAL 3.06 -0.20 1 101 ASN -2.11 0.09 1 103 LYS -0.66 -0.04 1 104 ALA -0.20 0.17 1 105 ILE -2.02 0.08 1 107 THR -3.06 0.33 1 110 SER 2.46 -0.32 1 112 TYR -4.38 0.79 1 113 THR -1.85 0.45 1 116 ALA -0.06 0.18 1 118 SER -1.62 0.04 1 119 GLN -1.78 0.27 1 120 ASP -1.57 -0.29 1 121 VAL -0.38 -0.51 1 122 ASP -1.03 0.27 1 125 SER -1.02 0.17 1 126 LEU 0.41 -0.11 1 128 ALA -1.28 -0.09 1 132 GLU -0.94 -0.38 1 133 HIS 5.66 -0.85 1 134 ALA 2.76 -0.56 1 136 LYS -1.51 0.07 1 138 ILE -1.92 0.08 1 139 ASN 1.22 0.13 1 140 THR -3.64 0.28 1 141 LEU 3.38 -0.31 1 143 SER -1.55 -0.16 1 144 PHE -0.51 0.48 1 147 GLN -0.53 0.33 1 149 LEU -0.85 0.12 1 150 GLN 3.18 -0.40 1 152 TYR -1.33 0.48 1 153 THR -3.30 0.39 1 158 GLU 1.48 -0.15 1 159 ILE 3.45 -0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25533_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 -2.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 0.99 _LACS_plot.Y_axis_chem_shift_offset 0.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 159 ILE 3.45 4.34 0 10 MET -1.33 -1.42 1 12 ASN -0.08 -0.79 1 13 ALA 3.15 0.38 1 15 GLN -0.77 0.10 1 16 ASN 4.76 1.49 1 19 THR -1.04 -2.09 1 21 HIS -2.41 -0.65 1 22 ASN 0.83 0.13 1 27 TYR -1.22 -3.12 1 28 ASN -4.33 -1.59 1 30 VAL 1.09 0.24 1 32 VAL 0.34 -1.27 1 33 ASN 2.60 -0.37 1 35 TRP -4.43 -0.80 1 36 THR -2.69 -1.11 1 38 GLU 3.63 -0.04 1 39 ASP -2.09 0.80 1 41 SER 0.44 0.49 1 42 GLU -1.46 -2.35 1 43 ASN -0.02 0.66 1 44 ILE 2.09 -0.71 1 45 ASP 1.68 -0.02 1 46 ASP 1.49 0.81 1 48 ALA 3.44 0.57 1 49 SER -0.91 -0.88 1 50 ALA 0.28 -0.92 1 51 ALA -0.35 -1.66 1 53 PHE 0.05 -0.48 1 54 HIS 3.28 0.89 1 56 ALA -3.71 -1.30 1 57 THR -0.43 -1.94 1 60 ASP 0.60 -0.74 1 61 ARG -1.26 -0.20 1 64 SER -0.10 -3.83 1 65 PHE -4.64 -2.71 1 66 TYR -4.55 -2.11 1 71 HIS 3.33 2.26 1 73 ARG -4.64 -2.07 1 74 THR -1.38 -1.85 1 76 LEU 3.21 -0.02 1 79 HIS -0.40 0.28 1 80 LEU -3.44 -0.81 1 81 ASN 0.49 -0.23 1 82 ASP -0.16 0.09 1 83 ALA 0.58 0.75 1 85 ILE 3.59 0.19 1 86 SER 0.15 -0.93 1 87 ASN 2.64 -0.88 1 90 ASN 0.18 0.32 1 91 GLU 2.51 0.27 1 93 SER -1.14 -0.71 1 94 ASN -1.64 -1.89 1 96 ASP -4.26 -2.09 1 97 THR 1.23 -0.70 1 100 VAL 3.06 0.58 1 101 ASN -2.11 1.62 1 103 LYS -0.66 -0.87 1 104 ALA -0.20 -0.11 1 105 ILE -2.02 -1.02 1 107 THR -3.06 -0.41 1 110 SER 2.46 0.72 1 112 TYR -4.38 -1.25 1 113 THR -1.85 -1.44 1 116 ALA -0.06 -1.47 1 118 SER -1.62 0.17 1 119 GLN -1.78 -1.13 1 120 ASP -1.57 -0.06 1 121 VAL -0.38 -2.44 1 122 ASP -1.03 0.55 1 123 GLU 6.24 0.61 1 125 SER -1.02 -0.40 1 126 LEU 0.41 -0.33 1 128 ALA -1.28 -0.81 1 132 GLU -0.94 -0.41 1 133 HIS 5.66 1.22 1 134 ALA 2.76 -1.35 1 136 LYS -1.51 -2.20 1 138 ILE -1.92 -1.80 1 139 ASN 1.22 0.08 1 140 THR -3.64 -0.82 1 141 LEU 3.38 -1.02 1 143 SER -1.55 -1.32 1 144 PHE -0.51 -3.31 1 145 GLU -6.21 -2.12 1 147 GLN -0.53 0.03 1 149 LEU -0.85 -1.13 1 150 GLN 3.18 0.19 1 152 TYR -1.33 -0.74 1 153 THR -3.30 -1.12 1 156 ARG -0.41 -0.61 1 158 GLU 1.48 -0.70 1 stop_ save_