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 bmr16822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 7.75 _LACS_plot.Line_2_terminator_val_y_2 5.53 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 ILE 4.02 -1.09 0 10 ASP -2.86 -2.34 1 11 GLU 1.87 2.20 1 12 ASN -1.38 -0.51 1 13 ARG 5.39 2.45 1 14 VAL 3.53 2.65 1 15 ILE -2.22 -0.86 1 17 LYS -2.93 -0.52 1 18 ASP 3.57 1.65 1 19 ASN 3.98 3.16 1 27 SER 4.81 3.48 1 28 GLU 0.86 2.58 1 29 LEU 3.88 2.53 1 30 GLN 5.25 3.24 1 31 TYR 4.56 3.39 1 32 VAL 5.84 4.38 1 33 LYS 4.88 3.97 1 34 LYS 3.56 2.57 1 35 THR 5.74 4.12 1 36 THR -0.65 -0.02 1 37 MET 4.38 1.75 1 39 HIS -3.10 -1.59 1 41 LEU -4.25 -2.18 1 42 ILE -0.10 -2.16 1 43 MET -8.03 -2.56 1 45 ARG 7.55 5.45 1 47 ASN 3.36 2.89 1 48 TYR 5.78 4.70 1 49 GLU 3.46 2.50 1 50 ALA 2.44 2.01 1 51 ILE 5.09 4.01 1 53 ARG -1.02 -0.48 1 55 LEU 1.70 1.40 1 59 ARG -0.65 0.17 1 60 ASN -2.01 0.63 1 61 ILE -1.66 -0.95 1 62 ILE -3.03 -1.43 1 63 VAL -0.60 -1.39 1 64 THR -1.18 -1.48 1 65 ARG 2.70 0.98 1 66 ASN 0.19 -0.34 1 67 GLU 2.32 1.93 1 69 TYR -0.22 1.52 1 70 HIS -1.85 0.85 1 71 VAL -4.27 -1.40 1 72 GLU 1.59 1.12 1 75 GLU -4.87 -1.57 1 76 VAL -2.96 -1.56 1 77 ALA -8.37 -3.08 1 78 HIS -1.79 -1.77 1 79 SER -3.48 -1.80 1 80 VAL 5.67 4.05 1 81 GLU 5.44 4.24 1 82 GLU 2.15 2.90 1 83 VAL 7.76 5.68 1 84 PHE 4.26 1.40 1 85 GLU 3.22 2.50 1 86 LEU 2.42 2.70 1 88 LYS 3.97 3.14 1 89 ASN 0.19 -0.10 1 90 GLU 2.14 1.77 1 91 GLU 0.92 1.83 1 92 GLU -3.50 -1.00 1 93 ILE -4.26 -2.82 1 94 PHE -2.09 -1.29 1 96 PHE -5.24 -0.64 1 99 ALA 3.65 3.98 1 100 GLN 5.57 3.97 1 101 ILE 3.58 1.57 1 102 TYR 3.98 2.17 1 103 ASP 3.08 3.52 1 104 LEU 1.53 2.13 1 105 PHE -0.38 1.72 1 106 LEU 5.98 4.60 1 108 TYR -3.41 -1.24 1 109 VAL 1.11 0.64 1 110 ASP -2.29 1.97 1 111 LYS -2.70 0.70 1 112 LEU -4.98 -1.45 1 113 TYR 0.64 -1.00 1 114 ILE -5.17 -1.54 1 115 THR 0.34 -1.16 1 116 LYS -1.48 -1.09 1 117 ILE -0.06 -0.49 1 118 HIS 1.53 0.43 1 119 HIS -4.05 0.36 1 120 ALA -3.07 -2.34 1 121 PHE -2.09 -0.72 1 122 GLU -0.63 -0.40 1 124 ASP -2.61 -1.10 1 125 THR -0.66 0.63 1 126 PHE -4.03 -1.04 1 127 PHE -0.87 1.03 1 129 GLU 0.70 0.55 1 130 MET -4.13 -0.77 1 131 ASP 0.07 -0.87 1 132 MET 2.95 -0.69 1 133 THR 6.05 4.78 1 134 ASN 0.81 -0.03 1 135 TRP -2.70 -0.60 1 136 LYS -4.32 -1.90 1 137 GLU -0.65 0.25 1 138 VAL -1.23 -1.53 1 139 PHE -2.58 0.50 1 140 VAL -3.53 -2.78 1 141 GLU -5.96 -1.18 1 142 LYS 1.37 1.19 1 144 LEU 0.79 0.50 1 145 THR -0.74 0.06 1 146 ASP 0.56 -0.96 1 147 GLU 3.88 3.08 1 148 LYS -0.33 0.13 1 149 ASN -5.35 -2.33 1 152 THR 1.50 1.10 1 153 TYR -3.82 -2.38 1 154 TYR -7.09 -1.73 1 155 TYR -1.30 -0.92 1 156 HIS -4.75 -0.13 1 157 VAL -2.64 -0.99 1 158 TYR -6.63 -2.51 1 159 GLU -5.58 -1.81 1 160 LYS 2.18 1.11 1 161 GLN -0.25 -0.39 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 5.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.76 _LACS_plot.Line_2_terminator_val_x_2 7.75 _LACS_plot.Line_2_terminator_val_y_2 -2.22 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 ILE 4.02 -5.11 0 10 ASP -2.86 0.52 1 11 GLU 1.87 0.33 1 12 ASN -1.38 0.87 1 13 ARG 5.39 -2.94 1 14 VAL 3.53 -0.88 1 15 ILE -2.22 1.36 1 17 LYS -2.93 2.41 1 18 ASP 3.57 -1.92 1 19 ASN 3.98 -0.82 1 27 SER 4.81 -1.33 1 28 GLU 0.86 1.72 1 29 LEU 3.88 -1.35 1 30 GLN 5.25 -2.01 1 31 TYR 4.56 -1.17 1 32 VAL 5.84 -1.46 1 33 LYS 4.88 -0.91 1 34 LYS 3.56 -0.99 1 35 THR 5.74 -1.62 1 36 THR -0.65 0.63 1 37 MET 4.38 -2.63 1 39 HIS -3.10 1.51 1 41 LEU -4.25 2.07 1 42 ILE -0.10 -2.06 1 43 MET -8.03 5.47 1 45 ARG 7.55 -2.10 1 47 ASN 3.36 -0.47 1 48 TYR 5.78 -1.08 1 49 GLU 3.46 -0.96 1 50 ALA 2.44 -0.43 1 51 ILE 5.09 -1.08 1 53 ARG -1.02 0.54 1 55 LEU 1.70 -0.30 1 59 ARG -0.65 0.82 1 60 ASN -2.01 2.64 1 61 ILE -1.66 0.71 1 62 ILE -3.03 1.60 1 63 VAL -0.60 -0.79 1 64 THR -1.18 -0.30 1 65 ARG 2.70 -1.72 1 66 ASN 0.19 -0.53 1 67 GLU 2.32 -0.39 1 69 TYR -0.22 1.74 1 70 HIS -1.85 2.70 1 71 VAL -4.27 2.87 1 72 GLU 1.59 -0.47 1 75 GLU -4.87 3.30 1 76 VAL -2.96 1.40 1 77 ALA -8.37 5.29 1 78 HIS -1.79 0.02 1 79 SER -3.48 1.68 1 80 VAL 5.67 -1.62 1 81 GLU 5.44 -1.20 1 82 GLU 2.15 0.75 1 83 VAL 7.76 -2.08 1 84 PHE 4.26 -2.86 1 85 GLU 3.22 -0.72 1 86 LEU 2.42 0.28 1 88 LYS 3.97 -0.83 1 89 ASN 0.19 -0.29 1 90 GLU 2.14 -0.37 1 91 GLU 0.92 0.91 1 92 GLU -3.50 2.50 1 93 ILE -4.26 1.44 1 94 PHE -2.09 0.80 1 96 PHE -5.24 4.60 1 99 ALA 3.65 0.33 1 100 GLN 5.57 -1.60 1 101 ILE 3.58 -2.01 1 102 TYR 3.98 -1.81 1 103 ASP 3.08 0.44 1 104 LEU 1.53 0.60 1 105 PHE -0.38 2.10 1 106 LEU 5.98 -1.38 1 108 TYR -3.41 2.17 1 109 VAL 1.11 -0.47 1 110 ASP -2.29 4.26 1 111 LYS -2.70 3.40 1 112 LEU -4.98 3.53 1 113 TYR 0.64 -1.64 1 114 ILE -5.17 3.63 1 115 THR 0.34 -1.50 1 116 LYS -1.48 0.39 1 117 ILE -0.06 -0.43 1 118 HIS 1.53 -1.10 1 119 HIS -4.05 4.41 1 120 ALA -3.07 0.73 1 121 PHE -2.09 1.37 1 122 GLU -0.63 0.23 1 124 ASP -2.61 1.51 1 125 THR -0.66 1.29 1 126 PHE -4.03 2.99 1 127 PHE -0.87 1.90 1 129 GLU 0.70 -0.15 1 130 MET -4.13 3.36 1 131 ASP 0.07 -0.94 1 132 MET 2.95 -3.64 1 133 THR 6.05 -1.27 1 134 ASN 0.81 -0.84 1 135 TRP -2.70 2.10 1 136 LYS -4.32 2.42 1 137 GLU -0.65 0.90 1 138 VAL -1.23 -0.30 1 139 PHE -2.58 3.08 1 140 VAL -3.53 0.75 1 141 GLU -5.96 4.78 1 142 LYS 1.37 -0.18 1 144 LEU 0.79 -0.29 1 145 THR -0.74 0.80 1 146 ASP 0.56 -1.52 1 147 GLU 3.88 -0.80 1 148 LYS -0.33 0.46 1 149 ASN -5.35 3.02 1 152 THR 1.50 -0.40 1 153 TYR -3.82 1.44 1 154 TYR -7.09 5.36 1 155 TYR -1.30 0.38 1 156 HIS -4.75 4.62 1 157 VAL -2.64 1.65 1 158 TYR -6.63 4.12 1 159 GLU -5.58 3.77 1 160 LYS 2.18 -1.07 1 161 GLN -0.25 -0.14 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 0.99 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 7.75 _LACS_plot.Line_2_terminator_val_y_2 -0.81 _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 77 ALA -8.37 0.20 0 154 TYR -7.09 -0.20 0 10 ASP -2.86 0.71 1 11 GLU 1.87 -0.26 1 12 ASN -1.38 0.38 1 13 ARG 5.39 -0.25 1 14 VAL 3.53 -0.60 1 15 ILE -2.22 0.84 1 17 LYS -2.93 0.04 1 18 ASP 3.57 -0.38 1 19 ASN 3.98 -0.91 1 27 SER 4.81 -0.27 1 28 GLU 0.86 0.66 1 29 LEU 3.88 -0.28 1 30 GLN 5.25 -0.32 1 31 TYR 4.56 -0.44 1 32 VAL 5.84 -1.03 1 33 LYS 4.88 -0.84 1 34 LYS 3.56 -0.38 1 35 THR 5.74 -0.82 1 36 THR -0.65 -0.51 1 37 MET 4.38 -0.60 1 39 HIS -3.10 0.02 1 41 LEU -4.25 0.70 1 42 ILE -0.10 0.59 1 43 MET -8.03 0.87 1 45 ARG 7.55 -0.63 1 47 ASN 3.36 -0.47 1 48 TYR 5.78 -0.69 1 49 GLU 3.46 -0.89 1 50 ALA 2.44 -0.24 1 51 ILE 5.09 -0.97 1 53 ARG -1.02 0.67 1 55 LEU 1.70 0.28 1 59 ARG -0.65 0.00 1 60 ASN -2.01 0.21 1 61 ILE -1.66 0.50 1 62 ILE -3.03 0.47 1 63 VAL -0.60 0.55 1 64 THR -1.18 0.89 1 65 ARG 2.70 0.26 1 66 ASN 0.19 -0.31 1 67 GLU 2.32 -0.71 1 69 TYR -0.22 -0.40 1 70 HIS -1.85 -0.19 1 71 VAL -4.27 -0.25 1 72 GLU 1.59 -0.33 1 75 GLU -4.87 0.23 1 76 VAL -2.96 0.71 1 78 HIS -1.79 1.32 1 79 SER -3.48 0.17 1 80 VAL 5.67 -1.04 1 81 GLU 5.44 -0.53 1 82 GLU 2.15 -0.22 1 83 VAL 7.76 -0.80 1 84 PHE 4.26 -0.43 1 85 GLU 3.22 -0.14 1 86 LEU 2.42 -0.16 1 88 LYS 3.97 -0.23 1 89 ASN 0.19 0.19 1 90 GLU 2.14 0.09 1 91 GLU 0.92 -0.13 1 92 GLU -3.50 0.68 1 93 ILE -4.26 0.64 1 94 PHE -2.09 0.60 1 95 ILE 4.02 -0.12 1 96 PHE -5.24 0.46 1 99 ALA 3.65 -0.19 1 100 GLN 5.57 -0.13 1 101 ILE 3.58 -0.30 1 102 TYR 3.98 -0.42 1 103 ASP 3.08 -0.24 1 104 LEU 1.53 -0.30 1 105 PHE -0.38 0.28 1 106 LEU 5.98 -0.35 1 108 TYR -3.41 0.09 1 109 VAL 1.11 -0.19 1 110 ASP -2.29 0.30 1 111 LYS -2.70 1.11 1 112 LEU -4.98 0.59 1 113 TYR 0.64 0.85 1 114 ILE -5.17 0.91 1 115 THR 0.34 1.18 1 116 LYS -1.48 0.49 1 117 ILE -0.06 0.09 1 118 HIS 1.53 0.01 1 119 HIS -4.05 -0.41 1 120 ALA -3.07 0.64 1 121 PHE -2.09 0.07 1 122 GLU -0.63 0.20 1 124 ASP -2.61 0.27 1 125 THR -0.66 0.31 1 126 PHE -4.03 0.88 1 129 GLU 0.70 -0.50 1 130 MET -4.13 -0.07 1 131 ASP 0.07 -0.11 1 132 MET 2.95 0.31 1 133 THR 6.05 -0.27 1 134 ASN 0.81 0.05 1 135 TRP -2.70 0.13 1 136 LYS -4.32 0.44 1 137 GLU -0.65 -0.03 1 138 VAL -1.23 0.48 1 139 PHE -2.58 0.01 1 140 VAL -3.53 0.89 1 141 GLU -5.96 -0.13 1 142 LYS 1.37 -1.18 1 144 LEU 0.79 -0.30 1 145 THR -0.74 1.01 1 146 ASP 0.56 -0.22 1 147 GLU 3.88 -0.38 1 148 LYS -0.33 -0.04 1 149 ASN -5.35 0.55 1 152 THR 1.50 -0.12 1 153 TYR -3.82 0.78 1 155 TYR -1.30 0.22 1 156 HIS -4.75 0.73 1 157 VAL -2.64 1.30 1 158 TYR -6.63 1.36 1 159 GLU -5.58 0.82 1 160 LYS 2.18 -1.02 1 161 GLN -0.25 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16822_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 -3.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 7.75 _LACS_plot.Line_2_terminator_val_y_2 2.69 _LACS_plot.Y_axis_chem_shift_offset 0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 88 LYS 3.97 -4.62 0 10 ASP -2.86 3.06 1 11 GLU 1.87 0.33 1 12 ASN -1.38 -1.20 1 13 ARG 5.39 -1.09 1 14 VAL 3.53 1.11 1 15 ILE -2.22 -1.27 1 17 LYS -2.93 -1.27 1 18 ASP 3.57 -1.25 1 19 ASN 3.98 4.33 1 27 SER 4.81 2.58 1 28 GLU 0.86 2.57 1 29 LEU 3.88 1.67 1 30 GLN 5.25 2.42 1 31 TYR 4.56 -0.50 1 32 VAL 5.84 3.09 1 33 LYS 4.88 0.90 1 34 LYS 3.56 2.05 1 35 THR 5.74 -0.08 1 36 THR -0.65 -0.33 1 37 MET 4.38 0.65 1 41 LEU -4.25 -0.67 1 42 ILE -0.10 -1.36 1 43 MET -8.03 -0.79 1 45 ARG 7.55 2.53 1 47 ASN 3.36 0.43 1 48 TYR 5.78 1.10 1 49 GLU 3.46 1.64 1 50 ALA 2.44 1.37 1 51 ILE 5.09 3.20 1 59 ARG -0.65 -1.32 1 60 ASN -2.01 -1.67 1 61 ILE -1.66 -3.28 1 62 ILE -3.03 -2.14 1 63 VAL -0.60 -2.60 1 64 THR -1.18 -1.42 1 65 ARG 2.70 1.09 1 66 ASN 0.19 1.44 1 67 GLU 2.32 0.48 1 69 TYR -0.22 -1.25 1 70 HIS -1.85 -1.55 1 71 VAL -4.27 -1.75 1 72 GLU 1.59 0.67 1 75 GLU -4.87 -2.16 1 76 VAL -2.96 -2.46 1 77 ALA -8.37 -1.63 1 78 HIS -1.79 -0.23 1 79 SER -3.48 -0.41 1 80 VAL 5.67 0.49 1 81 GLU 5.44 3.05 1 82 GLU 2.15 2.49 1 83 VAL 7.76 1.37 1 84 PHE 4.26 2.57 1 85 GLU 3.22 3.21 1 86 LEU 2.42 2.47 1 89 ASN 0.19 0.09 1 90 GLU 2.14 -0.14 1 91 GLU 0.92 1.14 1 92 GLU -3.50 -2.39 1 93 ILE -4.26 -4.33 1 94 PHE -2.09 -0.77 1 95 ILE 4.02 -0.74 1 99 ALA 3.65 -2.37 1 100 GLN 5.57 3.75 1 101 ILE 3.58 1.85 1 102 TYR 3.98 1.96 1 103 ASP 3.08 2.69 1 104 LEU 1.53 0.05 1 105 PHE -0.38 0.04 1 108 TYR -3.41 -0.70 1 109 VAL 1.11 -2.62 1 110 ASP -2.29 -0.34 1 111 LYS -2.70 -2.56 1 112 LEU -4.98 -3.24 1 113 TYR 0.64 -0.22 1 114 ILE -5.17 -1.15 1 115 THR 0.34 -1.28 1 116 LYS -1.48 -1.40 1 117 ILE -0.06 1.35 1 118 HIS 1.53 0.39 1 119 HIS -4.05 -3.05 1 120 ALA -3.07 -3.01 1 121 PHE -2.09 0.00 1 124 ASP -2.61 -0.85 1 125 THR -0.66 -1.95 1 126 PHE -4.03 -0.85 1 129 GLU 0.70 -0.95 1 130 MET -4.13 -1.73 1 131 ASP 0.07 1.46 1 132 MET 2.95 2.04 1 133 THR 6.05 1.09 1 134 ASN 0.81 -2.02 1 135 TRP -2.70 -1.50 1 136 LYS -4.32 -1.24 1 137 GLU -0.65 -0.16 1 138 VAL -1.23 -0.79 1 139 PHE -2.58 -3.43 1 140 VAL -3.53 -2.92 1 141 GLU -5.96 -3.19 1 142 LYS 1.37 -0.06 1 144 LEU 0.79 -2.38 1 145 THR -0.74 -1.13 1 146 ASP 0.56 0.45 1 147 GLU 3.88 1.33 1 148 LYS -0.33 -1.39 1 152 THR 1.50 -1.44 1 153 TYR -3.82 -3.94 1 154 TYR -7.09 -2.43 1 155 TYR -1.30 -0.91 1 156 HIS -4.75 2.76 1 157 VAL -2.64 -1.36 1 158 TYR -6.63 -0.47 1 159 GLU -5.58 -1.05 1 160 LYS 2.18 0.12 1 161 GLN -0.25 -0.75 1 stop_ save_