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 bmr26570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.89 _LACS_plot.Line_1_terminator_val_y_1 -3.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.05 _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 5.33 _LACS_plot.Line_2_terminator_val_y_2 3.14 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 ILE -3.03 -4.27 0 11 ASP 0.58 0.50 1 14 VAL 3.05 0.83 1 15 GLN -4.70 -1.65 1 17 ILE -1.85 0.19 1 19 ASN -2.31 -0.78 1 20 PHE -6.10 -2.43 1 21 GLU -5.05 -0.45 1 22 GLN -4.62 -1.24 1 23 LYS 3.40 3.54 1 24 GLU -4.88 -2.29 1 25 SER 3.82 2.79 1 26 ASN 0.72 -0.04 1 29 VAL -1.74 -1.09 1 30 LYS -1.60 -0.32 1 31 VAL -2.38 -1.75 1 32 TRP -4.12 -1.34 1 34 SER -2.86 -1.27 1 35 ILE -3.43 -0.95 1 36 LYS -3.88 -1.72 1 38 LEU -3.44 -1.57 1 39 THR -0.36 -0.50 1 40 GLU 0.43 0.99 1 42 LEU -2.14 0.14 1 43 HIS -3.15 -0.38 1 45 PHE -4.76 -2.65 1 46 HIS -7.89 -1.42 1 47 VAL -0.25 -0.66 1 48 HIS -3.42 0.67 1 50 PHE -0.15 0.23 1 52 ASP -0.23 -0.01 1 53 ASN 0.60 0.37 1 54 THR 0.78 0.70 1 55 ALA 0.52 0.44 1 58 THR 0.25 0.20 1 59 SER 0.16 0.13 1 60 ALA -0.57 -0.07 1 67 LEU 0.99 0.26 1 68 SER 0.25 0.21 1 69 ARG 0.25 0.05 1 70 LYS 0.16 0.13 1 71 HIS -0.47 1.08 1 75 LYS 0.66 0.28 1 76 ASP 0.66 0.67 1 77 GLU -0.24 0.20 1 78 GLU -0.49 -0.03 1 79 ARG -0.18 0.01 1 84 LEU 0.70 0.40 1 86 ASN -3.53 -0.46 1 87 VAL -2.92 -3.04 1 88 THR -0.19 -0.02 1 89 ALA -5.13 -2.96 1 90 ASP -2.18 -1.64 1 91 LYS 3.62 2.33 1 92 ASP -0.28 0.17 1 94 VAL -0.63 -0.60 1 95 ALA -4.24 -2.36 1 96 ASP -0.82 -0.09 1 97 VAL -1.03 -0.22 1 98 SER 1.17 -0.03 1 99 ILE -6.25 -0.82 1 100 GLU -3.51 -0.90 1 101 ASP -5.62 -0.13 1 102 SER -0.02 0.31 1 103 VAL 2.64 2.12 1 104 ILE -0.39 0.60 1 105 SER -4.01 -2.35 1 106 LEU 0.42 -1.04 1 107 SER -2.53 -0.72 1 109 ASP 3.15 2.47 1 110 HIS -0.12 -1.08 1 111 SER -1.07 -0.67 1 112 ILE 1.73 0.24 1 113 ILE 5.33 1.17 1 115 ARG 0.33 -0.22 1 116 THR 0.48 1.07 1 117 LEU -2.65 -1.27 1 118 VAL -4.52 -1.39 1 119 VAL -4.25 -2.87 1 120 HIS -2.51 1.34 1 121 GLU 1.05 2.49 1 122 LYS -2.22 -1.19 1 123 ALA -1.58 -0.59 1 124 ASP -0.07 0.15 1 125 ASP -0.31 -0.10 1 126 LEU 1.37 0.56 1 128 LYS 0.40 0.14 1 131 ASN 0.03 0.16 1 132 GLU 0.78 0.79 1 133 GLU 0.63 0.71 1 134 SER 1.07 0.89 1 135 THR 0.94 0.57 1 136 LYS 0.77 0.59 1 137 THR 0.11 0.20 1 139 ASN 0.05 0.25 1 140 ALA 1.08 0.44 1 142 SER 0.55 0.82 1 143 ARG 0.95 0.20 1 144 LEU -0.30 0.84 1 145 ALA -3.62 -0.99 1 148 VAL 1.19 0.70 1 149 ILE 2.36 1.12 1 151 ILE 0.86 0.40 1 152 ALA -2.78 -1.33 1 153 GLN 0.41 1.65 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.89 _LACS_plot.Line_1_terminator_val_y_1 4.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.97 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 -2.19 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 ILE -3.03 -1.24 0 11 ASP 0.58 -0.08 1 14 VAL 3.05 -2.22 1 15 GLN -4.70 3.05 1 17 ILE -1.85 2.04 1 19 ASN -2.31 1.53 1 20 PHE -6.10 3.67 1 21 GLU -5.05 4.60 1 22 GLN -4.62 3.38 1 23 LYS 3.40 0.14 1 24 GLU -4.88 2.59 1 25 SER 3.82 -1.03 1 26 ASN 0.72 -0.76 1 29 VAL -1.74 0.65 1 30 LYS -1.60 1.28 1 31 VAL -2.38 0.63 1 32 TRP -4.12 2.78 1 34 SER -2.86 1.59 1 35 ILE -3.43 2.48 1 36 LYS -3.88 2.16 1 38 LEU -3.44 1.87 1 39 THR -0.36 -0.14 1 40 GLU 0.43 0.56 1 42 LEU -2.14 2.28 1 43 HIS -3.15 2.77 1 45 PHE -4.76 2.11 1 46 HIS -7.89 6.47 1 47 VAL -0.25 -0.41 1 48 HIS -3.42 4.09 1 50 PHE -0.15 0.38 1 52 ASP -0.23 0.22 1 53 ASN 0.60 -0.23 1 54 THR 0.78 -0.08 1 55 ALA 0.52 -0.08 1 58 THR 0.25 -0.05 1 59 SER 0.16 -0.03 1 60 ALA -0.57 0.50 1 67 LEU 0.99 -0.73 1 68 SER 0.25 -0.04 1 69 ARG 0.25 -0.20 1 70 LYS 0.16 -0.03 1 71 HIS -0.47 1.55 1 75 LYS 0.66 -0.38 1 76 ASP 0.66 0.01 1 77 GLU -0.24 0.44 1 78 GLU -0.49 0.46 1 79 ARG -0.18 0.19 1 84 LEU 0.70 -0.30 1 86 ASN -3.53 3.07 1 87 VAL -2.92 -0.12 1 88 THR -0.19 0.17 1 89 ALA -5.13 2.17 1 90 ASP -2.18 0.54 1 91 LYS 3.62 -1.29 1 92 ASP -0.28 0.45 1 94 VAL -0.63 0.03 1 95 ALA -4.24 1.88 1 96 ASP -0.82 0.73 1 97 VAL -1.03 0.81 1 98 SER 1.17 -1.20 1 99 ILE -6.25 5.43 1 100 GLU -3.51 2.61 1 101 ASP -5.62 5.49 1 102 SER -0.02 0.33 1 103 VAL 2.64 -0.52 1 104 ILE -0.39 0.99 1 105 SER -4.01 1.66 1 106 LEU 0.42 -1.46 1 107 SER -2.53 1.81 1 109 ASP 3.15 -0.68 1 110 HIS -0.12 -0.96 1 111 SER -1.07 0.40 1 112 ILE 1.73 -1.49 1 113 ILE 5.33 -4.16 1 115 ARG 0.33 -0.55 1 116 THR 0.48 0.59 1 117 LEU -2.65 1.38 1 118 VAL -4.52 3.13 1 119 VAL -4.25 1.38 1 120 HIS -2.51 3.85 1 121 GLU 1.05 1.44 1 122 LYS -2.22 1.03 1 123 ALA -1.58 0.99 1 124 ASP -0.07 0.22 1 125 ASP -0.31 0.21 1 126 LEU 1.37 -0.81 1 128 LYS 0.40 -0.26 1 131 ASN 0.03 0.13 1 132 GLU 0.78 0.01 1 133 GLU 0.63 0.08 1 134 SER 1.07 -0.18 1 135 THR 0.94 -0.37 1 136 LYS 0.77 -0.18 1 137 THR 0.11 0.09 1 139 ASN 0.05 0.20 1 140 ALA 1.08 -0.64 1 142 SER 0.55 0.27 1 143 ARG 0.95 -0.75 1 144 LEU -0.30 1.14 1 145 ALA -3.62 2.63 1 148 VAL 1.19 -0.49 1 149 ILE 2.36 -1.24 1 151 ILE 0.86 -0.46 1 152 ALA -2.78 1.45 1 153 GLN 0.41 1.24 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.89 _LACS_plot.Line_1_terminator_val_y_1 0.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _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 5.33 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 LEU -3.44 -0.30 0 119 VAL -4.25 1.23 0 43 HIS -3.15 -0.36 0 113 ILE 5.33 -0.91 0 14 VAL 3.05 0.44 0 46 HIS -7.89 0.63 0 11 ASP 0.58 0.09 1 15 GLN -4.70 0.52 1 17 ILE -1.85 0.55 1 18 ILE -3.03 0.08 1 19 ASN -2.31 0.06 1 20 PHE -6.10 1.16 1 21 GLU -5.05 0.97 1 22 GLN -4.62 0.60 1 23 LYS 3.40 -0.22 1 24 GLU -4.88 0.33 1 25 SER 3.82 -0.51 1 26 ASN 0.72 -0.01 1 29 VAL -1.74 0.43 1 30 LYS -1.60 0.64 1 31 VAL -2.38 0.85 1 32 TRP -4.12 0.88 1 34 SER -2.86 1.00 1 35 ILE -3.43 0.40 1 36 LYS -3.88 0.96 1 39 THR -0.36 -0.08 1 40 GLU 0.43 -0.63 1 42 LEU -2.14 0.49 1 45 PHE -4.76 1.16 1 47 VAL -0.25 0.49 1 50 PHE -0.15 0.06 1 52 ASP -0.23 -0.06 1 53 ASN 0.60 0.00 1 54 THR 0.78 0.08 1 55 ALA 0.52 -0.06 1 58 THR 0.25 0.07 1 59 SER 0.16 -0.09 1 60 ALA -0.57 0.02 1 67 LEU 0.99 -0.09 1 68 SER 0.25 -0.14 1 69 ARG 0.25 -0.03 1 71 HIS -0.47 -0.10 1 75 LYS 0.66 -0.05 1 76 ASP 0.66 -0.10 1 77 GLU -0.24 -0.12 1 78 GLU -0.49 -0.15 1 84 LEU 0.70 -0.09 1 86 ASN -3.53 0.70 1 87 VAL -2.92 0.45 1 88 THR -0.19 0.25 1 89 ALA -5.13 0.33 1 90 ASP -2.18 -0.10 1 91 LYS 3.62 -0.33 1 92 ASP -0.28 0.15 1 94 VAL -0.63 0.58 1 95 ALA -4.24 0.75 1 96 ASP -0.82 0.36 1 97 VAL -1.03 0.01 1 98 SER 1.17 0.65 1 99 ILE -6.25 0.54 1 100 GLU -3.51 0.90 1 101 ASP -5.62 0.42 1 102 SER -0.02 0.30 1 103 VAL 2.64 -0.09 1 104 ILE -0.39 0.07 1 105 SER -4.01 0.02 1 106 LEU 0.42 0.18 1 107 SER -2.53 0.20 1 109 ASP 3.15 -0.42 1 110 HIS -0.12 0.00 1 111 SER -1.07 -0.57 1 112 ILE 1.73 -0.08 1 115 ARG 0.33 0.17 1 116 THR 0.48 0.24 1 117 LEU -2.65 0.38 1 118 VAL -4.52 0.72 1 120 HIS -2.51 0.29 1 122 LYS -2.22 0.16 1 123 ALA -1.58 -0.25 1 124 ASP -0.07 -0.14 1 125 ASP -0.31 -0.08 1 126 LEU 1.37 -0.12 1 128 LYS 0.40 0.00 1 131 ASN 0.03 -0.02 1 132 GLU 0.78 -0.12 1 133 GLU 0.63 -0.12 1 134 SER 1.07 -0.06 1 135 THR 0.94 0.01 1 136 LYS 0.77 0.04 1 137 THR 0.11 -0.04 1 139 ASN 0.05 -0.07 1 140 ALA 1.08 -0.14 1 142 SER 0.55 -0.06 1 143 ARG 0.95 -0.38 1 144 LEU -0.30 0.00 1 145 ALA -3.62 0.13 1 148 VAL 1.19 0.13 1 149 ILE 2.36 -0.18 1 151 ILE 0.86 0.02 1 152 ALA -2.78 0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.89 _LACS_plot.Line_1_terminator_val_y_1 -2.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 1.05 _LACS_plot.Y_axis_chem_shift_offset 0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 ASN -3.53 1.75 0 104 ILE -0.39 -3.69 0 20 PHE -6.10 0.54 0 46 HIS -7.89 -0.89 0 11 ASP 0.58 0.39 1 14 VAL 3.05 -0.33 1 15 GLN -4.70 -1.76 1 17 ILE -1.85 -2.32 1 18 ILE -3.03 -3.85 1 19 ASN -2.31 -3.06 1 21 GLU -5.05 -2.93 1 22 GLN -4.62 -1.34 1 23 LYS 3.40 -0.42 1 24 GLU -4.88 0.61 1 25 SER 3.82 -0.01 1 26 ASN 0.72 -0.14 1 29 VAL -1.74 -1.09 1 30 LYS -1.60 -1.30 1 31 VAL -2.38 -0.90 1 32 TRP -4.12 -2.70 1 34 SER -2.86 -1.75 1 35 ILE -3.43 -3.27 1 36 LYS -3.88 -1.04 1 38 LEU -3.44 -0.55 1 39 THR -0.36 1.12 1 40 GLU 0.43 -0.62 1 42 LEU -2.14 -0.18 1 43 HIS -3.15 -0.30 1 45 PHE -4.76 -2.20 1 47 VAL -0.25 -0.72 1 48 HIS -3.42 0.62 1 50 PHE -0.15 0.48 1 52 ASP -0.23 -0.12 1 53 ASN 0.60 0.55 1 54 THR 0.78 0.08 1 55 ALA 0.52 0.38 1 58 THR 0.25 -0.01 1 59 SER 0.16 -0.63 1 60 ALA -0.57 -0.24 1 67 LEU 0.99 0.02 1 68 SER 0.25 -0.04 1 69 ARG 0.25 -0.18 1 70 LYS 0.16 -0.30 1 71 HIS -0.47 1.44 1 75 LYS 0.66 -0.01 1 76 ASP 0.66 0.01 1 77 GLU -0.24 -0.18 1 78 GLU -0.49 -0.38 1 79 ARG -0.18 -0.43 1 84 LEU 0.70 -1.13 1 87 VAL -2.92 -1.67 1 88 THR -0.19 -1.15 1 89 ALA -5.13 -0.25 1 90 ASP -2.18 0.82 1 91 LYS 3.62 0.66 1 92 ASP -0.28 -0.01 1 94 VAL -0.63 0.25 1 95 ALA -4.24 -2.94 1 96 ASP -0.82 -0.71 1 97 VAL -1.03 0.32 1 98 SER 1.17 -1.54 1 99 ILE -6.25 -1.91 1 100 GLU -3.51 -1.76 1 101 ASP -5.62 -1.30 1 102 SER -0.02 -0.96 1 103 VAL 2.64 1.70 1 105 SER -4.01 -1.20 1 106 LEU 0.42 -2.58 1 107 SER -2.53 -0.81 1 109 ASP 3.15 0.94 1 110 HIS -0.12 -0.38 1 111 SER -1.07 2.33 1 112 ILE 1.73 -0.96 1 113 ILE 5.33 1.15 1 115 ARG 0.33 -2.37 1 116 THR 0.48 -1.83 1 117 LEU -2.65 -2.96 1 118 VAL -4.52 -1.68 1 119 VAL -4.25 -1.78 1 120 HIS -2.51 1.45 1 121 GLU 1.05 -0.18 1 122 LYS -2.22 -0.56 1 123 ALA -1.58 -0.53 1 124 ASP -0.07 0.04 1 125 ASP -0.31 0.18 1 126 LEU 1.37 0.53 1 128 LYS 0.40 0.68 1 131 ASN 0.03 0.33 1 132 GLU 0.78 0.31 1 133 GLU 0.63 0.60 1 134 SER 1.07 0.67 1 135 THR 0.94 0.19 1 136 LYS 0.77 0.33 1 137 THR 0.11 0.58 1 139 ASN 0.05 -0.17 1 140 ALA 1.08 -0.09 1 142 SER 0.55 -0.38 1 143 ARG 0.95 -0.76 1 144 LEU -0.30 -0.60 1 145 ALA -3.62 -2.65 1 148 VAL 1.19 -0.17 1 149 ILE 2.36 -0.64 1 151 ILE 0.86 -0.93 1 152 ALA -2.78 -2.40 1 153 GLN 0.41 -3.28 1 stop_ save_