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 bmr15278_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.61 _LACS_plot.Line_1_terminator_val_y_1 -3.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 7.95 _LACS_plot.Line_2_terminator_val_y_2 6.36 _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 87 ILE -2.22 -4.04 0 32 PHE 3.37 -0.57 0 131 TRP -5.74 -0.33 0 10 LYS -2.44 -1.11 1 11 LYS -4.61 -0.51 1 12 THR 0.07 0.15 1 13 PHE -5.38 -1.65 1 14 TYR -5.08 -3.43 1 15 SER 0.90 1.66 1 16 ARG -3.75 -3.75 1 18 ASN -1.09 -2.02 1 19 ASN -1.32 -0.68 1 20 HIS -0.15 1.19 1 21 ASP 2.79 0.68 1 22 ASN -0.76 0.19 1 23 ALA 5.13 4.03 1 24 TRP 3.19 1.21 1 25 LEU 2.40 0.66 1 26 ASN 5.40 2.77 1 27 ALA 4.23 3.15 1 28 ILE 6.03 5.11 1 29 LEU 4.51 3.34 1 30 GLN 4.06 1.47 1 31 LEU 4.79 3.20 1 33 ARG 3.12 1.74 1 34 TYR 4.54 5.51 1 35 VAL 0.08 -1.30 1 36 GLU 4.44 0.61 1 37 GLU -3.70 -2.22 1 39 PHE 4.40 5.81 1 40 PHE -3.53 -2.43 1 41 ASP 5.67 4.82 1 42 TRP 3.08 0.31 1 43 VAL 2.08 1.66 1 44 TYR 2.81 4.52 1 45 SER 0.35 0.28 1 46 SER -3.03 -2.59 1 49 ASN 1.32 -0.43 1 50 LEU 0.01 -1.09 1 51 THR 7.95 6.88 1 52 LEU 4.83 3.15 1 53 GLU 4.53 3.47 1 54 ALA 3.68 2.93 1 55 ILE 6.95 6.36 1 56 LYS 4.30 3.29 1 57 GLN 4.54 3.88 1 58 LEU 2.36 3.24 1 59 GLU 4.73 4.31 1 60 ASP 3.73 3.30 1 61 LEU -0.06 2.17 1 64 LEU -1.92 -1.24 1 65 GLU -0.21 -0.31 1 66 LEU -1.71 -0.73 1 67 HIS 4.75 4.82 1 68 GLU -1.08 -1.52 1 73 ALA 3.40 3.09 1 74 LEU 2.02 2.08 1 75 VAL 7.12 5.84 1 76 ILE 5.69 4.71 1 77 TRP 2.84 3.11 1 78 ASN 1.46 2.25 1 79 ILE 0.16 -0.08 1 80 LYS 4.29 3.51 1 81 HIS 2.50 2.69 1 82 LEU -0.93 -1.17 1 83 LEU -1.04 -1.71 1 84 HIS 0.76 1.47 1 85 THR -0.11 1.07 1 89 THR -5.45 -2.60 1 90 ALA 3.62 3.43 1 91 SER 2.96 2.41 1 92 ARG -0.52 -0.58 1 94 SER -2.50 -2.53 1 95 GLU 3.12 3.43 1 96 VAL -2.96 -1.12 1 98 VAL -2.22 -2.10 1 99 VAL 0.86 0.96 1 100 ASP -2.10 -1.21 1 102 THR 1.85 1.54 1 103 ASP 1.47 1.35 1 104 MET -2.83 -2.81 1 106 LEU 2.86 2.11 1 107 ALA 0.80 0.45 1 108 ASP 0.28 1.92 1 109 PHE -4.12 -2.13 1 110 HIS -3.86 -2.51 1 111 ALA -5.34 -1.09 1 113 ILE -2.05 -0.64 1 114 PHE -6.50 -2.30 1 115 LEU -0.47 -0.96 1 116 LYS -0.37 0.40 1 118 GLN 3.80 2.30 1 119 GLU -1.13 0.40 1 120 HIS -1.57 0.33 1 121 ALA -0.73 -0.87 1 122 VAL -6.17 -3.18 1 123 PHE -5.46 -1.87 1 124 ALA -5.04 -1.23 1 126 VAL 3.37 2.35 1 127 THR 3.60 2.53 1 128 SER -1.75 -0.45 1 129 ASN 3.26 3.38 1 132 TYR -4.12 -2.16 1 133 ALA 2.05 1.40 1 134 ILE -4.11 -2.57 1 135 ASP 6.13 4.37 1 136 ASP 0.53 1.30 1 137 GLU -3.33 0.17 1 138 ASP -4.80 -1.92 1 139 PHE 1.09 -0.98 1 140 TYR 0.33 1.78 1 142 TRP -0.19 -0.84 1 143 THR -3.38 -2.03 1 145 ASP 3.52 2.82 1 147 SER -1.07 0.07 1 148 ASP -0.23 -0.08 1 149 VAL -3.26 0.32 1 150 LEU -6.61 -2.73 1 151 VAL -4.42 -2.17 1 152 PHE -0.39 -1.05 1 153 VAL 2.69 3.04 1 155 TYR -0.23 0.24 1 156 ASP -0.89 -0.40 1 157 GLN -0.07 0.44 1 158 GLU 0.55 0.33 1 160 LEU 0.08 0.19 1 161 ASN -0.00 0.05 1 163 GLU 0.30 0.05 1 164 TRP -0.76 -0.39 1 165 LYS -0.14 0.02 1 166 ALA 0.75 1.45 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15278_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.61 _LACS_plot.Line_1_terminator_val_y_1 3.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.58 _LACS_plot.Line_2_terminator_val_x_2 7.95 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _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 87 ILE -2.22 -1.82 0 32 PHE 3.37 -3.94 0 131 TRP -5.74 5.41 0 10 LYS -2.44 1.33 1 11 LYS -4.61 4.10 1 12 THR 0.07 0.08 1 13 PHE -5.38 3.73 1 14 TYR -5.08 1.65 1 15 SER 0.90 0.76 1 16 ARG -3.75 0.00 1 18 ASN -1.09 -0.93 1 19 ASN -1.32 0.64 1 20 HIS -0.15 1.34 1 21 ASP 2.79 -2.11 1 22 ASN -0.76 0.95 1 23 ALA 5.13 -1.10 1 24 TRP 3.19 -1.98 1 25 LEU 2.40 -1.74 1 26 ASN 5.40 -2.63 1 27 ALA 4.23 -1.08 1 28 ILE 6.03 -0.92 1 29 LEU 4.51 -1.17 1 30 GLN 4.06 -2.59 1 31 LEU 4.79 -1.59 1 33 ARG 3.12 -1.38 1 34 TYR 4.54 0.97 1 35 VAL 0.08 -1.38 1 36 GLU 4.44 -3.83 1 37 GLU -3.70 1.48 1 39 PHE 4.40 1.41 1 40 PHE -3.53 1.10 1 41 ASP 5.67 -0.85 1 42 TRP 3.08 -2.77 1 43 VAL 2.08 -0.42 1 44 TYR 2.81 1.71 1 45 SER 0.35 -0.07 1 46 SER -3.03 0.44 1 49 ASN 1.32 -1.75 1 50 LEU 0.01 -1.10 1 51 THR 7.95 -1.07 1 52 LEU 4.83 -1.68 1 53 GLU 4.53 -1.06 1 54 ALA 3.68 -0.75 1 55 ILE 6.95 -0.59 1 56 LYS 4.30 -1.01 1 57 GLN 4.54 -0.66 1 58 LEU 2.36 0.88 1 59 GLU 4.73 -0.42 1 60 ASP 3.73 -0.43 1 61 LEU -0.06 2.23 1 64 LEU -1.92 0.68 1 65 GLU -0.21 -0.10 1 66 LEU -1.71 0.98 1 67 HIS 4.75 0.07 1 68 GLU -1.08 -0.44 1 73 ALA 3.40 -0.31 1 74 LEU 2.02 0.06 1 75 VAL 7.12 -1.28 1 76 ILE 5.69 -0.98 1 77 TRP 2.84 0.27 1 78 ASN 1.46 0.79 1 79 ILE 0.16 -0.24 1 80 LYS 4.29 -0.78 1 81 HIS 2.50 0.19 1 82 LEU -0.93 -0.24 1 83 LEU -1.04 -0.67 1 84 HIS 0.76 0.71 1 85 THR -0.11 1.18 1 89 THR -5.45 2.85 1 90 ALA 3.62 -0.19 1 91 SER 2.96 -0.55 1 92 ARG -0.52 -0.06 1 94 SER -2.50 -0.03 1 95 GLU 3.12 0.31 1 96 VAL -2.96 1.84 1 98 VAL -2.22 0.12 1 99 VAL 0.86 0.10 1 100 ASP -2.10 0.89 1 102 THR 1.85 -0.31 1 103 ASP 1.47 -0.12 1 104 MET -2.83 0.02 1 106 LEU 2.86 -0.75 1 107 ALA 0.80 -0.35 1 108 ASP 0.28 1.64 1 109 PHE -4.12 1.99 1 110 HIS -3.86 1.35 1 111 ALA -5.34 4.25 1 113 ILE -2.05 1.41 1 114 PHE -6.50 4.20 1 115 LEU -0.47 -0.49 1 116 LYS -0.37 0.77 1 118 GLN 3.80 -1.50 1 119 GLU -1.13 1.53 1 120 HIS -1.57 1.90 1 121 ALA -0.73 -0.14 1 122 VAL -6.17 2.99 1 123 PHE -5.46 3.59 1 124 ALA -5.04 3.81 1 126 VAL 3.37 -1.02 1 127 THR 3.60 -1.07 1 128 SER -1.75 1.30 1 129 ASN 3.26 0.12 1 132 TYR -4.12 1.96 1 133 ALA 2.05 -0.65 1 134 ILE -4.11 1.54 1 135 ASP 6.13 -1.76 1 136 ASP 0.53 0.77 1 137 GLU -3.33 3.50 1 138 ASP -4.80 2.88 1 139 PHE 1.09 -2.07 1 140 TYR 0.33 1.45 1 142 TRP -0.19 -0.65 1 143 THR -3.38 1.35 1 145 ASP 3.52 -0.70 1 147 SER -1.07 1.14 1 148 ASP -0.23 0.15 1 149 VAL -3.26 3.58 1 150 LEU -6.61 3.88 1 151 VAL -4.42 2.25 1 152 PHE -0.39 -0.66 1 153 VAL 2.69 0.35 1 155 TYR -0.23 0.47 1 156 ASP -0.89 0.49 1 157 GLN -0.07 0.51 1 158 GLU 0.55 -0.22 1 160 LEU 0.08 0.11 1 161 ASN -0.00 0.05 1 163 GLU 0.30 -0.25 1 164 TRP -0.76 0.37 1 165 LYS -0.14 0.16 1 166 ALA 0.75 0.70 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15278_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.61 _LACS_plot.Line_1_terminator_val_y_1 -2.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 7.95 _LACS_plot.Line_2_terminator_val_y_2 1.84 _LACS_plot.Y_axis_chem_shift_offset 0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 166 ALA 0.75 4.70 0 10 LYS -2.44 0.30 1 11 LYS -4.61 -2.60 1 12 THR 0.07 -1.70 1 13 PHE -5.38 -1.80 1 14 TYR -5.08 -0.50 1 15 SER 0.90 -1.90 1 16 ARG -3.75 -2.70 1 18 ASN -1.09 -1.00 1 19 ASN -1.32 -0.20 1 20 HIS -0.15 0.10 1 21 ASP 2.79 -0.20 1 22 ASN -0.76 0.80 1 23 ALA 5.13 0.50 1 24 TRP 3.19 -1.60 1 25 LEU 2.40 -0.20 1 26 ASN 5.40 1.50 1 27 ALA 4.23 1.60 1 28 ILE 6.03 0.00 1 29 LEU 4.51 2.60 1 30 GLN 4.06 1.80 1 31 LEU 4.79 1.20 1 32 PHE 3.37 2.30 1 33 ARG 3.12 2.20 1 34 TYR 4.54 1.10 1 35 VAL 0.08 -1.40 1 36 GLU 4.44 -1.30 1 37 GLU -3.70 1.70 1 39 PHE 4.40 -0.30 1 40 PHE -3.53 1.70 1 41 ASP 5.67 1.50 1 42 TRP 3.08 0.30 1 43 VAL 2.08 2.10 1 44 TYR 2.81 0.90 1 45 SER 0.35 -0.60 1 46 SER -3.03 0.20 1 49 ASN 1.32 1.10 1 50 LEU 0.01 -1.40 1 51 THR 7.95 0.40 1 52 LEU 4.83 1.70 1 53 GLU 4.53 3.10 1 54 ALA 3.68 1.20 1 55 ILE 6.95 1.10 1 56 LYS 4.30 2.40 1 57 GLN 4.54 3.00 1 58 LEU 2.36 3.60 1 59 GLU 4.73 3.00 1 60 ASP 3.73 2.80 1 61 LEU -0.06 1.60 1 64 LEU -1.92 -1.50 1 65 GLU -0.21 1.00 1 66 LEU -1.71 -0.50 1 67 HIS 4.75 2.10 1 68 GLU -1.08 -0.90 1 73 ALA 3.40 1.10 1 74 LEU 2.02 1.80 1 75 VAL 7.12 0.60 1 76 ILE 5.69 0.80 1 77 TRP 2.84 2.20 1 78 ASN 1.46 1.00 1 79 ILE 0.16 1.20 1 80 LYS 4.29 -0.20 1 81 HIS 2.50 1.90 1 82 LEU -0.93 -1.00 1 83 LEU -1.04 -1.50 1 84 HIS 0.76 0.70 1 85 THR -0.11 -1.20 1 87 ILE -2.22 0.00 1 89 THR -5.45 0.90 1 90 ALA 3.62 0.80 1 91 SER 2.96 -0.40 1 92 ARG -0.52 -1.00 1 94 SER -2.50 -0.20 1 95 GLU 3.12 -0.40 1 96 VAL -2.96 -1.60 1 98 VAL -2.22 -0.60 1 99 VAL 0.86 -0.10 1 100 ASP -2.10 0.20 1 102 THR 1.85 -0.70 1 103 ASP 1.47 -1.10 1 104 MET -2.83 -0.80 1 106 LEU 2.86 -1.10 1 107 ALA 0.80 -0.20 1 108 ASP 0.28 0.60 1 109 PHE -4.12 -4.10 1 110 HIS -3.86 0.20 1 111 ALA -5.34 -1.20 1 113 ILE -2.05 -2.00 1 114 PHE -6.50 -1.20 1 115 LEU -0.47 -2.10 1 116 LYS -0.37 1.00 1 118 GLN 3.80 -0.10 1 119 GLU -1.13 -1.60 1 120 HIS -1.57 -2.00 1 121 ALA -0.73 -2.40 1 122 VAL -6.17 -1.90 1 123 PHE -5.46 -2.90 1 124 ALA -5.04 -3.00 1 126 VAL 3.37 -0.60 1 127 THR 3.60 -0.10 1 128 SER -1.75 -0.90 1 129 ASN 3.26 1.10 1 131 TRP -5.74 -1.90 1 132 TYR -4.12 -1.50 1 133 ALA 2.05 -1.10 1 134 ILE -4.11 -1.20 1 135 ASP 6.13 0.50 1 136 ASP 0.53 -0.60 1 137 GLU -3.33 -3.00 1 138 ASP -4.80 0.10 1 139 PHE 0.33 -3.90 1 142 TRP -0.19 -2.30 1 143 THR -3.38 1.70 1 145 ASP 3.52 0.70 1 147 SER -1.07 -0.60 1 148 ASP -0.23 -3.60 1 149 VAL -3.26 -1.40 1 150 LEU -6.61 -2.30 1 151 VAL -4.42 -3.40 1 152 PHE -0.39 -1.90 1 153 VAL 2.69 0.60 1 155 TYR -0.23 -0.40 1 156 ASP -0.89 -0.40 1 157 GLN -0.07 -0.40 1 158 GLU 0.55 -0.30 1 160 LEU 0.08 0.40 1 161 ASN -0.00 -0.40 1 163 GLU 0.30 -0.20 1 164 TRP -0.76 -1.30 1 165 LYS -0.14 -1.10 1 stop_ save_