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 bmr19928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 6.31 _LACS_plot.Line_2_terminator_val_y_2 4.87 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 LYS 5.03 0.59 0 60 TYR 3.63 -0.54 0 10 LYS -1.49 -0.28 1 11 LEU -1.75 -0.75 1 12 SER -0.14 0.17 1 14 VAL -3.03 -1.25 1 15 GLU -5.12 -2.07 1 16 VAL -1.21 -1.26 1 17 SER -4.02 -1.48 1 19 ASN -0.93 -1.22 1 20 LEU 1.62 -0.83 1 21 ALA 2.86 0.28 1 23 HIS 2.03 0.23 1 24 SER 6.31 4.09 1 25 ALA 4.68 3.23 1 26 GLU 1.21 2.61 1 27 ILE 5.42 4.07 1 28 GLU 3.65 2.88 1 29 GLN 3.81 2.66 1 30 LEU 0.69 1.24 1 31 THR -0.38 -0.99 1 32 LYS 1.23 0.75 1 33 ILE -4.15 -2.01 1 34 GLU -1.12 -0.64 1 37 GLU -0.16 0.82 1 38 LEU -0.65 -0.47 1 39 TYR 1.19 1.18 1 40 ASN -2.47 -0.57 1 42 THR 5.38 3.97 1 43 LYS 3.56 2.51 1 44 VAL 6.20 4.86 1 45 THR 5.81 4.77 1 46 LYS 4.14 3.17 1 47 MET 4.07 4.19 1 48 GLU 3.73 3.68 1 49 ASP 4.05 3.47 1 50 ASP 4.49 3.43 1 51 ILE 5.94 5.16 1 52 LYS 6.13 5.08 1 53 LYS 3.91 3.19 1 54 LEU 4.47 3.19 1 55 LEU 4.97 3.05 1 57 ARG 4.44 3.27 1 58 TYR -0.55 -0.06 1 61 ALA 0.50 1.15 1 62 TYR -1.54 -0.66 1 64 ARG -2.51 -0.97 1 65 VAL -2.91 -0.98 1 66 GLN -4.24 -1.06 1 67 SER -0.70 0.10 1 68 MET -3.18 -0.97 1 70 GLU -1.96 -1.25 1 71 ILE 0.49 1.06 1 72 ASN -0.88 -1.27 1 73 ASP 2.22 2.73 1 74 ALA 3.24 2.32 1 75 ASP -1.36 -1.33 1 77 THR -6.10 -2.37 1 78 VAL -5.00 -1.81 1 79 LYS -3.10 -1.94 1 80 LEU -4.05 -1.37 1 81 ARG -0.12 -0.66 1 82 VAL -1.92 -0.83 1 83 ASN -3.34 -1.06 1 84 VAL -3.56 -1.78 1 85 ASP -2.41 -1.03 1 86 ALA 2.61 2.66 1 88 ASN -0.57 -0.37 1 89 ARG -0.85 -0.63 1 90 PHE -2.97 -0.08 1 91 TYR -3.42 -1.36 1 92 VAL 0.19 -0.37 1 93 ARG 3.43 2.19 1 94 LYS -5.66 -2.65 1 95 ILE -1.15 -0.93 1 96 ARG -5.88 -2.22 1 97 PHE -3.12 -1.19 1 98 GLU -4.98 -1.45 1 102 THR 1.87 1.84 1 103 SER 1.03 0.67 1 105 ASP 3.50 4.46 1 106 ALA 3.55 3.14 1 107 VAL 4.08 3.13 1 108 LEU 5.72 2.23 1 109 ARG 4.55 3.92 1 110 ARG 2.75 2.01 1 116 GLU 1.30 1.10 1 118 ALA -6.31 -2.83 1 119 TRP -0.90 -0.27 1 120 LEU 0.49 0.71 1 123 ASP 4.81 2.45 1 124 LEU 4.07 2.01 1 125 VAL 5.08 4.16 1 126 ASP 4.66 3.64 1 127 GLN 4.27 3.50 1 129 LYS 5.00 4.00 1 130 GLU 3.46 2.58 1 131 ARG 4.86 3.91 1 132 LEU 3.88 2.89 1 133 ASN 3.43 3.07 1 134 ARG 2.36 1.78 1 135 LEU 2.09 1.56 1 137 PHE -1.17 -2.53 1 138 PHE -2.60 -1.27 1 139 GLU 0.08 1.58 1 140 THR -3.66 -1.39 1 141 VAL -2.30 0.00 1 142 ASP -6.02 -1.54 1 143 THR -4.14 -2.56 1 144 ASP -4.82 -1.08 1 145 THR -0.36 -0.45 1 146 GLN -3.98 -1.91 1 147 ARG 2.01 1.33 1 148 VAL 0.17 0.39 1 151 SER -3.76 -2.11 1 153 ASP -0.33 -0.53 1 154 GLN -4.87 -1.35 1 155 VAL -5.84 -3.38 1 156 ASP -2.94 -1.56 1 157 VAL -1.72 -0.78 1 158 VAL -3.41 -2.18 1 159 TYR -2.18 -0.97 1 160 LYS -1.58 -1.55 1 161 VAL -5.19 -4.13 1 162 LYS -3.49 -1.73 1 163 GLU 0.77 1.13 1 164 ARG 0.51 0.63 1 165 ASN 0.22 0.26 1 166 THR -0.13 -0.15 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 3.67 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 6.31 _LACS_plot.Line_2_terminator_val_y_2 -1.44 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 LYS 5.03 -4.44 0 60 TYR 3.63 -4.17 0 10 LYS -1.49 1.21 1 11 LEU -1.75 1.00 1 12 SER -0.14 0.31 1 14 VAL -3.03 1.78 1 15 GLU -5.12 3.05 1 16 VAL -1.21 -0.05 1 17 SER -4.02 2.54 1 19 ASN -0.93 -0.29 1 20 LEU 1.62 -2.45 1 21 ALA 2.86 -2.58 1 23 HIS 2.03 -1.80 1 24 SER 6.31 -2.22 1 25 ALA 4.68 -1.45 1 26 GLU 1.21 1.40 1 27 ILE 5.42 -1.35 1 28 GLU 3.65 -0.77 1 29 GLN 3.81 -1.15 1 30 LEU 0.69 0.55 1 31 THR -0.38 -0.61 1 32 LYS 1.23 -0.48 1 33 ILE -4.15 2.14 1 34 GLU -1.12 0.48 1 37 GLU -0.16 0.98 1 38 LEU -0.65 0.18 1 39 TYR 1.19 -0.01 1 40 ASN -2.47 1.90 1 42 THR 5.38 -1.41 1 43 LYS 3.56 -1.05 1 44 VAL 6.20 -1.34 1 45 THR 5.81 -1.04 1 46 LYS 4.14 -0.97 1 47 MET 4.07 0.12 1 48 GLU 3.73 -0.05 1 49 ASP 4.05 -0.58 1 50 ASP 4.49 -1.06 1 51 ILE 5.94 -0.78 1 52 LYS 6.13 -1.05 1 53 LYS 3.91 -0.72 1 54 LEU 4.47 -1.28 1 55 LEU 4.97 -1.92 1 57 ARG 4.44 -1.17 1 58 TYR -0.55 0.49 1 61 ALA 0.50 0.65 1 62 TYR -1.54 0.88 1 64 ARG -2.51 1.54 1 65 VAL -2.91 1.93 1 66 GLN -4.24 3.18 1 67 SER -0.70 0.80 1 68 MET -3.18 2.21 1 70 GLU -1.96 0.71 1 71 ILE 0.49 0.57 1 72 ASN -0.88 -0.39 1 73 ASP 2.22 0.51 1 74 ALA 3.24 -0.92 1 75 ASP -1.36 0.03 1 77 THR -6.10 3.73 1 78 VAL -5.00 3.19 1 79 LYS -3.10 1.16 1 80 LEU -4.05 2.68 1 81 ARG -0.12 -0.54 1 82 VAL -1.92 1.09 1 83 ASN -3.34 2.28 1 84 VAL -3.56 1.78 1 85 ASP -2.41 1.38 1 86 ALA 2.61 0.05 1 88 ASN -0.57 0.20 1 89 ARG -0.85 0.22 1 90 PHE -2.97 2.89 1 91 TYR -3.42 2.06 1 92 VAL 0.19 -0.56 1 93 ARG 3.43 -1.24 1 94 LYS -5.66 3.01 1 95 ILE -1.15 0.22 1 96 ARG -5.88 3.66 1 97 PHE -3.12 1.93 1 98 GLU -4.98 3.53 1 102 THR 1.87 -0.03 1 103 SER 1.03 -0.36 1 105 ASP 3.50 0.96 1 106 ALA 3.55 -0.41 1 107 VAL 4.08 -0.95 1 108 LEU 5.72 -3.49 1 109 ARG 4.55 -0.63 1 110 ARG 2.75 -0.74 1 116 GLU 1.30 -0.20 1 118 ALA -6.31 3.48 1 119 TRP -0.90 0.63 1 120 LEU 0.49 0.22 1 123 ASP 4.81 -2.36 1 124 LEU 4.07 -2.06 1 125 VAL 5.08 -0.92 1 126 ASP 4.66 -1.02 1 127 GLN 4.27 -0.77 1 129 LYS 5.00 -1.00 1 130 GLU 3.46 -0.88 1 131 ARG 4.86 -0.95 1 132 LEU 3.88 -0.99 1 133 ASN 3.43 -0.36 1 134 ARG 2.36 -0.58 1 135 LEU 2.09 -0.53 1 137 PHE -1.17 -1.36 1 138 PHE -2.60 1.33 1 139 GLU 0.08 1.50 1 140 THR -3.66 2.27 1 141 VAL -2.30 2.30 1 142 ASP -6.02 4.48 1 143 THR -4.14 1.58 1 144 ASP -4.82 3.74 1 145 THR -0.36 -0.09 1 146 GLN -3.98 2.07 1 147 ARG 2.01 -0.68 1 148 VAL 0.17 0.22 1 151 SER -3.76 1.65 1 153 ASP -0.33 -0.20 1 154 GLN -4.87 3.52 1 155 VAL -5.84 2.46 1 156 ASP -2.94 1.38 1 157 VAL -1.72 0.94 1 158 VAL -3.41 1.23 1 159 TYR -2.18 1.21 1 160 LYS -1.58 0.03 1 161 VAL -5.19 1.06 1 162 LYS -3.49 1.76 1 163 GLU 0.77 0.36 1 164 ARG 0.51 0.12 1 165 ASN 0.22 0.04 1 166 THR -0.13 -0.02 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 0.65 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.31 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _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 60 TYR 3.63 0.33 0 77 THR -6.10 1.22 0 40 ASN -2.47 -0.48 0 89 ARG -0.85 -0.70 0 16 VAL -1.21 0.97 0 10 LYS -1.49 0.26 1 11 LEU -1.75 0.63 1 12 SER -0.14 0.01 1 14 VAL -3.03 0.87 1 15 GLU -5.12 0.33 1 17 SER -4.02 0.27 1 19 ASN -0.93 0.16 1 20 LEU 1.62 -0.44 1 21 ALA 2.86 -0.49 1 23 HIS 2.03 0.24 1 24 SER 6.31 -0.66 1 25 ALA 4.68 -0.21 1 26 GLU 1.21 -0.33 1 27 ILE 5.42 -0.56 1 28 GLU 3.65 -0.43 1 29 GLN 3.81 -0.32 1 30 LEU 0.69 -0.07 1 31 THR -0.38 0.00 1 32 LYS 1.23 -0.15 1 33 ILE -4.15 0.32 1 34 GLU -1.12 0.02 1 37 GLU -0.16 -0.25 1 38 LEU -0.65 0.26 1 39 TYR 1.19 -0.44 1 42 THR 5.38 -0.35 1 43 LYS 3.56 -0.30 1 44 VAL 6.20 -0.65 1 45 THR 5.81 -0.56 1 46 LYS 4.14 -0.26 1 47 MET 4.07 -0.35 1 48 GLU 3.73 -0.78 1 49 ASP 4.05 -0.36 1 50 ASP 4.49 -0.29 1 51 ILE 5.94 -0.78 1 52 LYS 6.13 -0.70 1 53 LYS 3.91 -0.40 1 54 LEU 4.47 -0.38 1 55 LEU 4.97 -0.36 1 57 ARG 4.44 -0.28 1 58 TYR -0.55 0.18 1 61 ALA 0.50 -0.69 1 62 TYR -1.54 0.04 1 64 ARG -2.51 0.32 1 65 VAL -2.91 0.64 1 66 GLN -4.24 0.41 1 67 SER -0.70 0.83 1 68 MET -3.18 0.31 1 70 GLU -1.96 0.16 1 71 ILE 0.49 -0.13 1 72 ASN -0.88 0.16 1 73 ASP 2.22 -0.10 1 74 ALA 3.24 -0.19 1 75 ASP -1.36 -0.09 1 76 LYS 5.03 -0.98 1 78 VAL -5.00 0.48 1 79 LYS -3.10 0.46 1 80 LEU -4.05 0.23 1 81 ARG -0.12 0.61 1 82 VAL -1.92 0.40 1 83 ASN -3.34 0.53 1 84 VAL -3.56 0.50 1 85 ASP -2.41 0.33 1 86 ALA 2.61 -0.78 1 88 ASN -0.57 -0.03 1 90 PHE -2.97 0.41 1 92 VAL 0.19 0.40 1 93 ARG 3.43 -0.01 1 94 LYS -5.66 0.44 1 96 ARG -5.88 0.19 1 97 PHE -3.12 0.80 1 98 GLU -4.98 0.40 1 102 THR 1.87 -0.10 1 103 SER 1.03 -0.22 1 105 ASP 3.50 -0.86 1 106 ALA 3.55 -0.40 1 107 VAL 4.08 -0.58 1 108 LEU 5.72 -0.70 1 109 ARG 4.55 -0.51 1 110 ARG 2.75 -0.22 1 116 GLU 1.30 -0.56 1 118 ALA -6.31 0.26 1 119 TRP -0.90 0.01 1 120 LEU 0.49 -0.36 1 123 ASP 4.81 -0.28 1 124 LEU 4.07 -0.42 1 125 VAL 5.08 -0.47 1 126 ASP 4.66 -0.16 1 127 GLN 4.27 -0.21 1 129 LYS 5.00 -0.49 1 130 GLU 3.46 -0.19 1 131 ARG 4.86 -0.50 1 132 LEU 3.88 -0.28 1 133 ASN 3.43 -0.20 1 134 ARG 2.36 -0.29 1 135 LEU 2.09 -0.59 1 137 PHE -1.17 -0.12 1 138 PHE -2.60 0.69 1 139 GLU 0.08 -0.12 1 140 THR -3.66 0.27 1 141 VAL -2.30 0.24 1 142 ASP -6.02 0.49 1 143 THR -4.14 0.82 1 144 ASP -4.82 0.14 1 145 THR -0.36 0.42 1 146 GLN -3.98 0.27 1 147 ARG 2.01 -0.14 1 148 VAL 0.17 -0.24 1 151 SER -3.76 0.32 1 153 ASP -0.33 -0.55 1 155 VAL -5.84 1.01 1 156 ASP -2.94 0.98 1 157 VAL -1.72 0.19 1 158 VAL -3.41 0.48 1 159 TYR -2.18 0.14 1 160 LYS -1.58 0.61 1 161 VAL -5.19 0.90 1 162 LYS -3.49 0.60 1 163 GLU 0.77 0.27 1 164 ARG 0.51 -0.04 1 165 ASN 0.22 0.01 1 166 THR -0.13 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.41 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.87 _LACS_plot.Line_2_terminator_val_x_2 6.31 _LACS_plot.Line_2_terminator_val_y_2 2.33 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 151 SER -3.76 1.38 0 21 ALA 2.86 -2.02 0 125 VAL 5.08 4.44 0 76 LYS 5.03 -1.29 0 10 LYS -1.49 -0.53 1 11 LEU -1.75 -0.98 1 12 SER -0.14 0.59 1 14 VAL -3.03 -1.61 1 15 GLU -5.12 -1.87 1 16 VAL -1.21 -1.18 1 17 SER -4.02 -2.75 1 19 ASN -0.93 -1.41 1 20 LEU 1.62 -1.34 1 23 HIS 2.03 0.81 1 24 SER 6.31 1.15 1 25 ALA 4.68 3.11 1 26 GLU 1.21 3.06 1 27 ILE 5.42 1.53 1 28 GLU 3.65 2.59 1 29 GLN 3.81 1.98 1 30 LEU 0.69 0.47 1 31 THR -0.38 -1.72 1 32 LYS 1.23 -0.24 1 33 ILE -4.15 -0.33 1 34 GLU -1.12 -0.80 1 37 GLU -0.16 -0.79 1 38 LEU -0.65 -0.04 1 39 TYR 1.19 -1.44 1 40 ASN -2.47 -0.29 1 42 THR 5.38 1.83 1 43 LYS 3.56 1.97 1 44 VAL 6.20 1.14 1 45 THR 5.81 1.24 1 46 LYS 4.14 1.02 1 47 MET 4.07 2.17 1 48 GLU 3.73 2.18 1 49 ASP 4.05 2.73 1 50 ASP 4.49 3.60 1 51 ILE 5.94 0.89 1 52 LYS 6.13 3.31 1 53 LYS 3.91 2.49 1 54 LEU 4.47 1.38 1 55 LEU 4.97 2.64 1 57 ARG 4.44 1.24 1 58 TYR -0.55 -1.33 1 60 TYR 3.63 -0.53 1 61 ALA 0.50 -1.73 1 62 TYR -1.54 -2.07 1 64 ARG -2.51 -1.12 1 65 VAL -2.91 -2.32 1 66 GLN -4.24 -1.76 1 67 SER -0.70 -0.45 1 68 MET -3.18 -1.02 1 70 GLU -1.96 -1.00 1 71 ILE 0.49 -1.40 1 72 ASN -0.88 0.26 1 73 ASP 2.22 0.71 1 74 ALA 3.24 1.22 1 75 ASP -1.36 -0.99 1 77 THR -6.10 -1.19 1 78 VAL -5.00 -2.18 1 79 LYS -3.10 -1.59 1 80 LEU -4.05 -3.15 1 81 ARG -0.12 -1.35 1 82 VAL -1.92 -2.52 1 83 ASN -3.34 -1.11 1 84 VAL -3.56 -2.36 1 85 ASP -2.41 -0.24 1 86 ALA 2.61 -1.48 1 88 ASN -0.57 -1.43 1 89 ARG -0.85 -0.45 1 90 PHE -2.97 -0.30 1 91 TYR -3.42 -0.52 1 92 VAL 0.19 -0.39 1 93 ARG 3.43 -1.39 1 94 LYS -5.66 -1.63 1 95 ILE -1.15 -0.60 1 96 ARG -5.88 -3.47 1 97 PHE -3.12 -0.41 1 98 GLU -4.98 -1.06 1 102 THR 1.87 1.07 1 105 ASP 3.50 0.88 1 106 ALA 3.55 2.52 1 107 VAL 4.08 1.18 1 108 LEU 5.72 1.56 1 109 ARG 4.55 2.93 1 110 ARG 2.75 0.68 1 116 GLU 1.30 0.93 1 118 ALA -6.31 -0.93 1 119 TRP -0.90 1.39 1 123 ASP 4.81 2.02 1 126 ASP 4.66 2.62 1 127 GLN 4.27 3.88 1 129 LYS 5.00 0.58 1 130 GLU 3.46 2.90 1 131 ARG 4.86 3.85 1 132 LEU 3.88 2.45 1 133 ASN 3.43 3.16 1 134 ARG 2.36 1.05 1 135 LEU 2.09 0.89 1 137 PHE -1.17 0.51 1 138 PHE -2.60 -0.12 1 139 GLU 0.08 0.10 1 140 THR -3.66 -2.05 1 141 VAL -2.30 -2.99 1 142 ASP -6.02 -1.45 1 143 THR -4.14 -1.12 1 144 ASP -4.82 -1.63 1 145 THR -0.36 -0.81 1 146 GLN -3.98 -0.74 1 147 ARG 2.01 0.06 1 148 VAL 0.17 -0.44 1 153 ASP -0.33 -1.68 1 154 GLN -4.87 0.66 1 155 VAL -5.84 -1.80 1 156 ASP -2.94 -0.43 1 157 VAL -1.72 -2.99 1 158 VAL -3.41 -0.82 1 159 TYR -2.18 -1.92 1 160 LYS -1.58 -0.09 1 161 VAL -5.19 -2.38 1 162 LYS -3.49 0.55 1 163 GLU 0.77 -0.30 1 164 ARG 0.51 -0.49 1 165 ASN 0.22 0.21 1 166 THR -0.13 -0.44 1 stop_ save_