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 bmr26543_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.02 _LACS_plot.Line_1_terminator_val_y_1 -3.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.07 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 3.41 _LACS_plot.Y_axis_chem_shift_offset 0.75 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 TYR -6.38 -1.75 0 48 GLU -8.02 -2.63 0 11 LYS 1.08 -0.33 1 13 LEU 0.67 -0.40 1 15 TRP -2.00 -0.56 1 17 LEU -2.30 -1.90 1 18 ARG -2.86 -2.00 1 19 PHE 3.63 -0.39 1 20 VAL 0.45 0.61 1 21 ILE 0.00 -0.43 1 23 SER -3.71 -1.25 1 24 SER -4.49 -1.12 1 25 ASP 0.13 -0.38 1 26 THR -1.61 -1.50 1 27 GLN -0.78 -0.92 1 28 ARG 5.62 3.29 1 29 SER 4.05 1.67 1 30 LEU 3.36 1.32 1 31 LEU 4.15 1.82 1 33 ARG -0.43 -1.33 1 34 ILE 0.11 -1.29 1 36 ILE 3.99 1.68 1 38 ASP 0.89 0.32 1 39 VAL -1.09 -2.00 1 40 LEU -3.07 -3.02 1 42 ILE 3.20 -0.14 1 43 ARG 3.30 1.65 1 44 THR -0.35 -0.87 1 45 SER 0.73 -0.34 1 46 ARG -2.82 -0.99 1 47 ALA 1.97 -0.94 1 49 VAL -1.27 -2.29 1 52 TYR 6.41 2.10 1 53 ALA 0.33 -0.56 1 55 LYS 1.76 -0.84 1 56 LEU -0.86 -0.81 1 58 HIS -2.72 -0.53 1 59 PHE -5.58 -3.00 1 60 ASN -4.23 -1.63 1 61 ARG 0.08 -0.54 1 62 VAL -4.98 -3.56 1 63 GLU 4.03 1.85 1 66 ILE -5.44 -2.12 1 67 ILE -2.39 -1.97 1 68 VAL 2.29 0.01 1 69 GLU 0.33 0.37 1 70 THR -0.93 -0.71 1 71 LEU -3.07 -1.75 1 72 ASP -0.54 -1.85 1 73 ILE 1.58 -0.56 1 74 GLN 2.88 1.37 1 75 HIS 1.74 0.01 1 76 ILE 3.00 1.60 1 77 GLU 0.17 -0.47 1 78 GLU 0.02 -0.57 1 79 GLU -0.09 -0.73 1 80 ASN 0.27 -0.43 1 81 ASN 0.43 -0.33 1 82 THR 0.41 -0.45 1 83 THR 0.38 -0.37 1 84 GLU 0.04 -0.60 1 85 THR 0.03 -0.66 1 86 ALA 0.17 -0.53 1 87 GLU -0.01 -0.54 1 88 THR 0.14 -0.61 1 89 LEU 0.85 -0.38 1 92 LEU 1.82 0.12 1 93 ASN 1.30 0.25 1 94 GLN 0.48 -0.69 1 95 LEU 1.61 0.04 1 97 VAL -1.58 -1.69 1 98 LYS 0.66 -1.28 1 99 LEU -1.48 -2.06 1 100 GLU -5.33 -2.39 1 102 VAL 0.08 0.06 1 103 LEU -0.72 0.75 1 104 TYR -3.62 -1.66 1 105 ARG -3.69 -1.35 1 106 LYS -3.91 -0.69 1 107 ASN -0.42 -1.58 1 108 VAL -4.11 -3.25 1 109 THR -3.08 -1.78 1 110 LEU 5.12 2.68 1 111 ALA 3.97 1.94 1 112 GLU 2.55 1.91 1 113 LEU 4.25 2.49 1 114 GLU 3.78 2.06 1 115 ALA 3.48 1.45 1 116 MET 3.89 2.98 1 118 GLN 0.68 -1.57 1 119 GLN 6.25 1.50 1 120 GLN 0.72 -0.22 1 121 LEU 1.11 0.26 1 122 LEU -0.68 -2.15 1 123 SER 1.44 0.49 1 124 LEU -3.08 -1.97 1 126 THR 3.57 2.08 1 128 ALA 4.93 2.96 1 129 GLU 4.98 2.69 1 130 LEU 1.55 -0.32 1 131 ASN -1.86 -0.80 1 132 VAL 1.57 0.32 1 134 ILE -0.36 -1.19 1 135 MET -5.06 -2.55 1 136 ALA -3.60 -1.81 1 137 ASN 2.53 0.35 1 139 VAL -1.10 -1.50 1 140 LEU 1.54 0.28 1 141 LEU -0.05 -0.95 1 143 ASN -4.12 -0.95 1 145 GLU -7.43 -4.09 1 146 LEU 0.08 -0.14 1 147 VAL -4.57 -3.09 1 148 GLN -0.68 -1.23 1 149 MET -0.78 -1.92 1 150 ASN 4.68 2.10 1 151 ASP 1.72 0.24 1 152 THR -2.40 -1.44 1 153 LEU -3.25 -1.70 1 155 VAL -3.44 -2.70 1 156 GLU -2.25 -2.36 1 157 ILE 3.63 0.81 1 158 HIS -1.99 -0.59 1 160 TRP -4.16 -1.26 1 161 LEU 2.40 0.04 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26543_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.02 _LACS_plot.Line_1_terminator_val_y_1 4.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.07 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 -2.99 _LACS_plot.Y_axis_chem_shift_offset 0.75 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 TYR -6.38 4.63 0 48 GLU -8.02 5.39 0 11 LYS 1.08 -1.41 1 13 LEU 0.67 -1.07 1 15 TRP -2.00 1.44 1 17 LEU -2.30 0.40 1 18 ARG -2.86 0.86 1 19 PHE 3.63 -4.02 1 20 VAL 0.45 0.16 1 21 ILE 0.00 -0.43 1 23 SER -3.71 2.46 1 24 SER -4.49 3.37 1 25 ASP 0.13 -0.51 1 26 THR -1.61 0.11 1 27 GLN -0.78 -0.14 1 28 ARG 5.62 -2.33 1 29 SER 4.05 -2.38 1 30 LEU 3.36 -2.04 1 31 LEU 4.15 -2.33 1 33 ARG -0.43 -0.90 1 34 ILE 0.11 -1.40 1 36 ILE 3.99 -2.31 1 38 ASP 0.89 -0.57 1 39 VAL -1.09 -0.91 1 40 LEU -3.07 0.05 1 42 ILE 3.20 -3.34 1 43 ARG 3.30 -1.65 1 44 THR -0.35 -0.52 1 45 SER 0.73 -1.07 1 46 ARG -2.82 1.83 1 47 ALA 1.97 -2.91 1 49 VAL -1.27 -1.02 1 52 TYR 6.41 -4.31 1 53 ALA 0.33 -0.89 1 55 LYS 1.76 -2.60 1 56 LEU -0.86 0.05 1 58 HIS -2.72 2.19 1 59 PHE -5.58 2.58 1 60 ASN -4.23 2.60 1 61 ARG 0.08 -0.62 1 62 VAL -4.98 1.42 1 63 GLU 4.03 -2.18 1 66 ILE -5.44 3.32 1 67 ILE -2.39 0.42 1 68 VAL 2.29 -2.28 1 69 GLU 0.33 0.04 1 70 THR -0.93 0.22 1 71 LEU -3.07 1.32 1 72 ASP -0.54 -1.31 1 73 ILE 1.58 -2.14 1 74 GLN 2.88 -1.51 1 75 HIS 1.74 -1.73 1 76 ILE 3.00 -1.40 1 77 GLU 0.17 -0.64 1 78 GLU 0.02 -0.59 1 79 GLU -0.09 -0.64 1 80 ASN 0.27 -0.70 1 81 ASN 0.43 -0.76 1 82 THR 0.41 -0.86 1 83 THR 0.38 -0.75 1 84 GLU 0.04 -0.64 1 85 THR 0.03 -0.69 1 86 ALA 0.17 -0.70 1 87 GLU -0.01 -0.53 1 88 THR 0.14 -0.75 1 89 LEU 0.85 -1.23 1 92 LEU 1.82 -1.70 1 93 ASN 1.30 -1.05 1 94 GLN 0.48 -1.17 1 95 LEU 1.61 -1.57 1 97 VAL -1.58 -0.11 1 98 LYS 0.66 -1.94 1 99 LEU -1.48 -0.58 1 100 GLU -5.33 2.94 1 102 VAL 0.08 -0.02 1 103 LEU -0.72 1.47 1 104 TYR -3.62 1.96 1 105 ARG -3.69 2.34 1 106 LYS -3.91 3.22 1 107 ASN -0.42 -1.16 1 108 VAL -4.11 0.86 1 109 THR -3.08 1.30 1 110 LEU 5.12 -2.44 1 111 ALA 3.97 -2.03 1 112 GLU 2.55 -0.64 1 113 LEU 4.25 -1.76 1 114 GLU 3.78 -1.72 1 115 ALA 3.48 -2.03 1 116 MET 3.89 -0.91 1 118 GLN 0.68 -2.25 1 119 GLN 6.25 -4.75 1 120 GLN 0.72 -0.94 1 121 LEU 1.11 -0.85 1 122 LEU -0.68 -1.47 1 123 SER 1.44 -0.95 1 124 LEU -3.08 1.11 1 126 THR 3.57 -1.49 1 128 ALA 4.93 -1.97 1 129 GLU 4.98 -2.29 1 130 LEU 1.55 -1.87 1 131 ASN -1.86 1.06 1 132 VAL 1.57 -1.25 1 134 ILE -0.36 -0.83 1 135 MET -5.06 2.51 1 136 ALA -3.60 1.79 1 137 ASN 2.53 -2.18 1 139 VAL -1.10 -0.40 1 140 LEU 1.54 -1.26 1 141 LEU -0.05 -0.90 1 143 ASN -4.12 3.17 1 145 GLU -7.43 3.34 1 146 LEU 0.08 -0.22 1 147 VAL -4.57 1.48 1 148 GLN -0.68 -0.55 1 149 MET -0.78 -1.14 1 150 ASN 4.68 -2.58 1 151 ASP 1.72 -1.48 1 152 THR -2.40 0.96 1 153 LEU -3.25 1.55 1 155 VAL -3.44 0.74 1 156 GLU -2.25 -0.11 1 157 ILE 3.63 -2.82 1 158 HIS -1.99 1.40 1 160 TRP -4.16 2.90 1 161 LEU 2.40 -2.36 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26543_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.02 _LACS_plot.Line_1_terminator_val_y_1 -2.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 1.17 _LACS_plot.Y_axis_chem_shift_offset 0.70 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 GLN 6.25 -1.36 0 59 PHE -5.58 -5.08 0 111 ALA 3.97 3.89 0 11 LYS 1.08 0.02 1 13 LEU 0.67 -1.20 1 15 TRP -2.00 -0.38 1 17 LEU -2.30 0.40 1 18 ARG -2.86 -2.69 1 19 PHE 3.63 -2.20 1 20 VAL 0.45 -0.76 1 21 ILE 0.00 0.60 1 23 SER -3.71 -1.56 1 24 SER -4.49 -2.42 1 25 ASP 0.13 -0.11 1 26 THR -1.61 -1.89 1 27 GLN -0.78 1.33 1 28 ARG 5.62 2.69 1 30 LEU 3.36 1.74 1 31 LEU 4.15 1.01 1 33 ARG -0.43 -0.48 1 34 ILE 0.11 -2.15 1 36 ILE 3.99 1.49 1 38 ASP 0.89 -2.02 1 39 VAL -1.09 -0.02 1 40 LEU -3.07 -1.87 1 42 ILE 3.20 -1.28 1 43 ARG 3.30 0.96 1 44 THR -0.35 -1.20 1 45 SER 0.73 -0.99 1 46 ARG -2.82 -2.83 1 47 ALA 1.97 -1.41 1 48 GLU -8.02 -2.38 1 49 VAL -1.27 -1.76 1 50 TYR -6.38 -0.68 1 52 TYR 6.41 0.53 1 53 ALA 0.33 -0.61 1 55 LYS 1.76 -0.12 1 56 LEU -0.86 -0.61 1 58 HIS -2.72 -0.96 1 60 ASN -4.23 -1.34 1 61 ARG 0.08 -1.32 1 62 VAL -4.98 -0.21 1 63 GLU 4.03 1.18 1 66 ILE -5.44 -2.86 1 67 ILE -2.39 -0.28 1 68 VAL 2.29 -1.54 1 69 GLU 0.33 -0.97 1 70 THR -0.93 -1.92 1 71 LEU -3.07 -2.01 1 72 ASP -0.54 -0.63 1 73 ILE 1.58 0.45 1 74 GLN 2.88 0.64 1 75 HIS 1.74 1.10 1 76 ILE 3.00 -1.03 1 77 GLU 0.17 -0.07 1 78 GLU 0.02 -0.18 1 79 GLU -0.09 -0.71 1 80 ASN 0.27 -0.60 1 81 ASN 0.43 0.11 1 82 THR 0.41 -0.10 1 83 THR 0.38 -0.24 1 84 GLU 0.04 -0.18 1 85 THR 0.03 -0.61 1 86 ALA 0.17 -0.21 1 87 GLU -0.01 -0.07 1 88 THR 0.14 -0.50 1 89 LEU 0.85 -0.52 1 92 LEU 1.82 -0.04 1 93 ASN 1.30 -0.16 1 94 GLN 0.48 -0.26 1 95 LEU 1.61 -0.54 1 97 VAL -1.58 -2.37 1 98 LYS 0.66 -0.96 1 99 LEU -1.48 -1.48 1 100 GLU -5.33 -2.41 1 102 VAL 0.08 -1.33 1 103 LEU -0.72 -3.86 1 104 TYR -3.62 -3.75 1 105 ARG -3.69 -3.11 1 106 LYS -3.91 -3.29 1 107 ASN -0.42 0.44 1 108 VAL -4.11 -0.56 1 109 THR -3.08 1.03 1 110 LEU 5.12 1.10 1 112 GLU 2.55 3.01 1 113 LEU 4.25 1.35 1 114 GLU 3.78 2.83 1 115 ALA 3.48 2.51 1 116 MET 3.89 2.85 1 118 GLN 0.68 -0.63 1 120 GLN 0.72 -0.25 1 121 LEU 1.11 -1.46 1 122 LEU -0.68 -2.16 1 124 LEU -3.08 -1.05 1 126 THR 3.57 0.06 1 128 ALA 4.93 1.27 1 129 GLU 4.98 -1.35 1 130 LEU 1.55 -1.65 1 131 ASN -1.86 -1.45 1 132 VAL 1.57 -0.17 1 134 ILE -0.36 -1.88 1 135 MET -5.06 -2.02 1 136 ALA -3.60 -0.35 1 137 ASN 2.53 -0.26 1 139 VAL -1.10 -1.28 1 140 LEU 1.54 -2.49 1 141 LEU -0.05 -1.53 1 143 ASN -4.12 -0.04 1 145 GLU -7.43 -1.50 1 146 LEU 0.08 -1.62 1 147 VAL -4.57 -2.65 1 148 GLN -0.68 -0.69 1 149 MET -0.78 -0.89 1 150 ASN 4.68 -0.78 1 151 ASP 1.72 -1.27 1 152 THR -2.40 -2.57 1 153 LEU -3.25 -1.86 1 155 VAL -3.44 -1.84 1 156 GLU -2.25 -0.91 1 157 ILE 3.63 1.02 1 158 HIS -1.99 -0.60 1 160 TRP -4.16 -0.91 1 161 LEU 2.40 -1.60 1 stop_ save_