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 bmr16958_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 -3.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.72 _LACS_plot.Line_2_terminator_val_x_2 6.29 _LACS_plot.Line_2_terminator_val_y_2 4.63 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 ARG 6.29 0.52 0 10 LYS 3.31 2.50 1 11 THR 0.34 -0.14 1 12 LEU -1.05 -0.25 1 13 LYS -3.88 -2.69 1 15 GLU -5.80 -2.29 1 16 THR -1.04 -1.58 1 17 THR -5.46 -2.25 1 18 THR 0.29 0.24 1 19 GLU -2.51 -2.55 1 20 ALA -6.37 -2.02 1 21 VAL 2.15 0.93 1 22 ASP -4.75 -3.81 1 23 ALA 3.39 1.82 1 24 ALA 3.45 2.21 1 25 THR 4.57 4.76 1 26 ALA 3.87 2.01 1 27 GLU 3.59 2.72 1 28 LYS 4.40 3.34 1 29 VAL 4.77 3.46 1 30 PHE 1.47 -1.65 1 31 LYS 5.07 3.36 1 32 GLN 4.14 2.63 1 33 TYR 4.04 3.69 1 34 ALA 4.91 3.52 1 35 ASN 3.71 3.44 1 36 ASP 3.75 2.43 1 37 ASN -0.53 0.34 1 39 VAL -0.72 -0.61 1 40 ASP -4.13 -2.17 1 42 GLU -2.40 -1.32 1 43 TRP -0.83 -0.12 1 44 THR -3.84 -1.72 1 45 TYR -3.54 -1.27 1 46 ASP -4.43 -2.78 1 47 ASP 0.96 1.74 1 48 ALA 3.20 2.21 1 49 THR -1.64 -1.71 1 50 LYS 4.10 -0.01 1 51 THR -1.84 0.08 1 52 PHE -3.79 -0.88 1 53 THR -1.52 -0.59 1 54 VAL -3.76 -4.57 1 55 THR -1.82 -1.24 1 56 GLU -2.20 -0.59 1 58 SER -0.28 -0.39 1 59 ASN -0.82 -1.26 1 60 ALA -0.30 -0.57 1 61 MET -0.01 -0.25 1 62 VAL -3.15 -1.97 1 64 PHE 1.99 1.81 1 65 HIS 1.35 3.76 1 68 LYS 2.12 -0.98 1 71 HIS -0.85 0.32 1 73 ILE 3.46 3.00 1 74 ALA 1.83 1.32 1 75 ASP -2.95 -1.79 1 78 ALA 0.35 0.28 1 79 ALA 1.63 0.74 1 80 LEU 0.96 0.42 1 81 GLU 0.36 0.13 1 82 ASN 0.49 0.06 1 83 GLN 0.60 0.10 1 84 ASP 1.14 2.43 1 85 MET 3.44 2.93 1 87 THR -0.01 -0.28 1 89 ILE -4.91 -2.32 1 91 TYR 0.73 0.18 1 92 ARG 3.44 2.81 1 95 SER -0.57 0.00 1 96 THR 0.78 -0.40 1 97 GLU -0.92 -0.26 1 98 HIS -2.45 -0.58 1 99 GLU -4.13 -2.67 1 100 ILE 3.50 3.18 1 101 THR 3.81 2.08 1 102 LYS -1.32 -2.13 1 104 LYS -0.52 -1.51 1 105 ALA -0.19 0.02 1 106 LYS -0.55 -1.17 1 107 VAL 0.81 -0.47 1 108 ASP -2.31 -1.72 1 110 ALA 1.67 0.97 1 111 LEU -0.83 -0.63 1 113 GLU 0.74 1.54 1 114 PHE -5.22 -2.69 1 116 PHE 1.71 0.10 1 117 ALA -0.72 -0.67 1 118 LYS -3.62 -1.81 1 120 PHE 2.06 0.82 1 121 VAL 5.05 3.31 1 124 GLU -1.64 -0.90 1 125 MET -0.91 -2.75 1 127 HIS -0.16 -0.23 1 128 LEU -3.79 -2.74 1 129 SER 3.63 3.24 1 130 ARG 0.49 0.16 1 131 SER 0.18 -0.06 1 134 ASP 0.75 -0.31 1 135 ASN -2.02 -2.21 1 137 LYS 0.55 -0.35 1 139 LEU 0.47 0.24 1 140 TYR -0.37 -0.95 1 141 ALA 0.20 0.02 1 142 ASP 1.55 -0.14 1 147 LYS 2.06 1.37 1 148 LEU 1.09 1.48 1 151 SER -0.42 -0.08 1 152 VAL 1.60 -0.77 1 153 GLU -0.39 -0.22 1 154 HIS -2.58 -0.79 1 155 LEU -3.27 -2.14 1 156 LYS 4.70 3.59 1 158 ASP -1.90 -1.22 1 161 GLU 1.02 -0.44 1 162 SER 1.05 0.64 1 163 GLN -3.54 -2.73 1 164 ASN 1.42 2.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16958_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 3.15 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 6.29 _LACS_plot.Line_2_terminator_val_y_2 -1.66 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 ARG 6.29 -5.77 0 10 LYS 3.31 -0.81 1 11 THR 0.34 -0.48 1 12 LEU -1.05 0.80 1 13 LYS -3.88 1.19 1 15 GLU -5.80 3.51 1 16 THR -1.04 -0.54 1 17 THR -5.46 3.21 1 18 THR 0.29 -0.05 1 19 GLU -2.51 -0.04 1 20 ALA -6.37 4.35 1 21 VAL 2.15 -1.22 1 22 ASP -4.75 0.94 1 23 ALA 3.39 -1.57 1 24 ALA 3.45 -1.24 1 25 THR 4.57 0.19 1 26 ALA 3.87 -1.86 1 27 GLU 3.59 -0.87 1 28 LYS 4.40 -1.06 1 29 VAL 4.77 -1.31 1 30 PHE 1.47 -3.12 1 31 LYS 5.07 -1.71 1 32 GLN 4.14 -1.51 1 33 TYR 4.04 -0.35 1 34 ALA 4.91 -1.39 1 35 ASN 3.71 -0.27 1 36 ASP 3.75 -1.32 1 37 ASN -0.53 0.87 1 39 VAL -0.72 0.11 1 40 ASP -4.13 1.96 1 42 GLU -2.40 1.08 1 43 TRP -0.83 0.71 1 44 THR -3.84 2.12 1 45 TYR -3.54 2.27 1 46 ASP -4.43 1.65 1 47 ASP 0.96 0.78 1 48 ALA 3.20 -0.99 1 49 THR -1.64 -0.07 1 50 LYS 4.10 -4.11 1 51 THR -1.84 1.92 1 52 PHE -3.79 2.91 1 53 THR -1.52 0.93 1 54 VAL -3.76 -0.81 1 55 THR -1.82 0.58 1 56 GLU -2.20 1.61 1 58 SER -0.28 -0.11 1 59 ASN -0.82 -0.44 1 60 ALA -0.30 -0.27 1 61 MET -0.01 -0.24 1 62 VAL -3.15 1.18 1 64 PHE 1.99 -0.18 1 65 HIS 1.35 2.41 1 68 LYS 2.12 -3.10 1 71 HIS -0.85 1.17 1 73 ILE 3.46 -0.46 1 74 ALA 1.83 -0.51 1 75 ASP -2.95 1.16 1 78 ALA 0.35 -0.07 1 79 ALA 1.63 -0.89 1 80 LEU 0.96 -0.54 1 81 GLU 0.36 -0.23 1 82 ASN 0.49 -0.43 1 83 GLN 0.60 -0.50 1 84 ASP 1.14 1.29 1 85 MET 3.44 -0.51 1 87 THR -0.01 -0.27 1 89 ILE -4.91 2.59 1 91 TYR 0.73 -0.55 1 92 ARG 3.44 -0.63 1 95 SER -0.57 0.57 1 96 THR 0.78 -1.18 1 97 GLU -0.92 0.66 1 98 HIS -2.45 1.87 1 99 GLU -4.13 1.46 1 100 ILE 3.50 -0.32 1 101 THR 3.81 -1.73 1 102 LYS -1.32 -0.81 1 104 LYS -0.52 -0.99 1 105 ALA -0.19 0.21 1 106 LYS -0.55 -0.62 1 107 VAL 0.81 -1.28 1 108 ASP -2.31 0.59 1 110 ALA 1.67 -0.70 1 111 LEU -0.83 0.20 1 113 GLU 0.74 0.80 1 114 PHE -5.22 2.53 1 116 PHE 1.71 -1.61 1 117 ALA -0.72 0.05 1 118 LYS -3.62 1.81 1 120 PHE 2.06 -1.24 1 121 VAL 5.05 -1.74 1 124 GLU -1.64 0.74 1 125 MET -0.91 -1.84 1 127 HIS -0.16 -0.07 1 128 LEU -3.79 1.05 1 129 SER 3.63 -0.39 1 130 ARG 0.49 -0.33 1 131 SER 0.18 -0.24 1 134 ASP 0.75 -1.06 1 135 ASN -2.02 -0.19 1 137 LYS 0.55 -0.90 1 139 LEU 0.47 -0.23 1 140 TYR -0.37 -0.58 1 141 ALA 0.20 -0.18 1 142 ASP 1.55 -1.69 1 147 LYS 2.06 -0.69 1 148 LEU 1.09 0.39 1 151 SER -0.42 0.34 1 152 VAL 1.60 -2.37 1 153 GLU -0.39 0.17 1 154 HIS -2.58 1.79 1 155 LEU -3.27 1.13 1 156 LYS 4.70 -1.11 1 158 ASP -1.90 0.68 1 161 GLU 1.02 -1.46 1 162 SER 1.05 -0.41 1 163 GLN -3.54 0.81 1 164 ASN 1.42 1.04 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16958_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 0.27 _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 0.01 _LACS_plot.Line_2_terminator_val_x_2 5.07 _LACS_plot.Line_2_terminator_val_y_2 -0.37 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 GLU 3.59 -1.84 0 10 LYS 3.31 -0.36 1 11 THR 0.34 -0.08 1 12 LEU -1.05 0.00 1 13 LYS -3.88 0.70 1 15 GLU -5.80 1.15 1 16 THR -1.04 0.27 1 17 THR -5.46 1.36 1 18 THR 0.29 0.21 1 19 GLU -2.51 0.72 1 20 ALA -6.37 0.52 1 21 VAL 2.15 -0.12 1 22 ASP -4.75 0.02 1 23 ALA 3.39 -0.30 1 24 ALA 3.45 -0.26 1 25 THR 4.57 -0.75 1 26 ALA 3.87 -1.34 1 28 LYS 4.40 -0.70 1 29 VAL 4.77 -0.61 1 30 PHE 1.47 0.02 1 31 LYS 5.07 -0.25 1 32 GLN 4.14 -0.38 1 33 TYR 4.04 -0.38 1 34 ALA 4.91 -0.60 1 35 ASN 3.71 -0.39 1 36 ASP 3.75 -0.38 1 37 ASN -0.53 -0.25 1 39 VAL -0.72 -0.07 1 40 ASP -4.13 0.17 1 42 GLU -2.40 0.24 1 43 TRP -0.83 0.61 1 44 THR -3.84 0.38 1 45 TYR -3.54 0.30 1 46 ASP -4.43 -0.14 1 47 ASP 0.96 -0.62 1 48 ALA 3.20 -0.29 1 49 THR -1.64 -0.05 1 50 LYS 4.10 -0.23 1 51 THR -1.84 1.05 1 52 PHE -3.79 0.97 1 53 THR -1.52 0.75 1 54 VAL -3.76 0.26 1 55 THR -1.82 0.26 1 56 GLU -2.20 0.08 1 58 SER -0.28 -0.10 1 60 ALA -0.30 -0.14 1 61 MET -0.01 -0.21 1 62 VAL -3.15 -0.06 1 64 PHE 1.99 -0.25 1 65 HIS 1.35 -0.06 1 68 LYS 2.12 0.04 1 71 HIS -0.85 -0.01 1 73 ILE 3.46 0.17 1 74 ALA 1.83 -0.10 1 75 ASP -2.95 0.11 1 78 ALA 0.35 -0.13 1 79 ALA 1.63 -0.20 1 80 LEU 0.96 -0.28 1 81 GLU 0.36 -0.25 1 82 ASN 0.49 0.20 1 83 GLN 0.60 -0.18 1 85 MET 3.44 0.45 1 87 THR -0.01 -0.07 1 89 ILE -4.91 0.21 1 91 TYR 0.73 -0.19 1 92 ARG 3.44 0.23 1 95 SER -0.57 0.11 1 96 THR 0.78 0.14 1 97 GLU -0.92 -0.25 1 98 HIS -2.45 -0.06 1 99 GLU -4.13 0.14 1 101 THR 3.81 -0.31 1 102 LYS -1.32 0.07 1 104 LYS -0.52 0.10 1 105 ALA -0.19 -0.19 1 106 LYS -0.55 -0.08 1 107 VAL 0.81 -0.22 1 108 ASP -2.31 -0.10 1 110 ALA 1.67 -0.24 1 111 LEU -0.83 -0.07 1 113 GLU 0.74 -0.31 1 114 PHE -5.22 -0.11 1 116 PHE 1.71 -0.29 1 117 ALA -0.72 -0.59 1 118 LYS -3.62 0.16 1 120 PHE 2.06 0.17 1 121 VAL 5.05 -0.33 1 124 GLU -1.64 -0.17 1 125 MET -0.91 0.66 1 127 HIS -0.16 -0.30 1 128 LEU -3.79 0.00 1 129 SER 3.63 0.12 1 131 SER 0.18 -0.40 1 134 ASP 0.75 -0.05 1 135 ASN -2.02 0.03 1 137 LYS 0.55 -0.14 1 139 LEU 0.47 -0.03 1 140 TYR -0.37 -0.46 1 141 ALA 0.20 -0.19 1 142 ASP 1.55 -0.15 1 147 LYS 2.06 -0.30 1 148 LEU 1.09 -0.01 1 151 SER -0.42 -0.31 1 152 VAL 1.60 0.21 1 153 GLU -0.39 -0.19 1 154 HIS -2.58 -0.02 1 155 LEU -3.27 0.05 1 158 ASP -1.90 -0.50 1 161 GLU 1.02 -0.10 1 162 SER 1.05 -0.32 1 164 ASN 1.42 0.27 1 stop_ save_