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 bmr6940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 -3.60 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.38 _LACS_plot.Line_2_terminator_val_x_2 8.51 _LACS_plot.Line_2_terminator_val_y_2 4.78 _LACS_plot.Y_axis_chem_shift_offset 1.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 HIS 4.45 5.51 0 172 ILE 1.49 -3.89 0 10 LEU 5.92 2.69 1 11 ARG 5.66 2.34 1 12 GLN 4.70 2.72 1 13 GLN 5.01 1.52 1 14 ILE 5.45 0.38 1 15 ARG 5.90 3.25 1 16 ARG 5.93 2.88 1 17 LEU 4.71 2.26 1 18 ARG 5.21 2.29 1 19 MET 4.63 2.20 1 20 GLU 0.82 -0.39 1 22 LYS -0.07 -1.64 1 23 ARG 0.37 -0.91 1 24 VAL -2.05 -1.27 1 25 ALA -6.63 -4.05 1 26 LEU -5.51 -3.13 1 27 VAL -0.74 -1.26 1 29 THR -3.49 -1.57 1 30 MET -0.05 -1.08 1 32 ASN 3.11 -0.29 1 33 LEU 0.15 -1.71 1 34 HIS -3.89 -1.42 1 38 MET 3.88 0.44 1 39 LYS 5.25 2.39 1 40 LEU 4.60 2.49 1 41 VAL 7.27 3.85 1 42 ASP 5.67 2.79 1 43 GLU 4.03 1.43 1 44 ALA 4.19 2.43 1 45 LYS 3.54 0.72 1 46 ALA 2.25 0.20 1 47 ARG -1.28 -0.82 1 48 ALA -4.12 -2.22 1 49 ASP 0.88 1.93 1 50 VAL -3.85 -2.72 1 51 VAL -1.09 -1.32 1 52 ALA -4.20 -4.51 1 53 VAL -2.90 -2.72 1 54 SER -3.35 -2.59 1 55 ILE -0.15 -0.16 1 56 PHE 1.37 -0.47 1 57 VAL 4.30 -0.56 1 58 ASN -1.16 -1.58 1 60 MET 1.22 1.52 1 61 GLN -1.23 -1.41 1 62 PHE -0.64 -0.93 1 63 ASP 1.88 0.76 1 64 ARG -0.76 -1.79 1 66 GLU 5.29 2.24 1 67 ASP 3.68 1.90 1 68 LEU 4.43 1.41 1 69 ALA 3.53 1.13 1 70 ARG 1.07 -0.70 1 71 TYR 2.47 1.42 1 73 ARG 0.95 -1.01 1 74 THR -1.80 -3.66 1 75 LEU 5.84 3.38 1 76 GLN 6.97 3.63 1 77 GLU 5.25 2.80 1 78 ASP 4.93 3.36 1 80 GLU 4.90 2.42 1 81 LYS 5.26 3.23 1 82 LEU 5.10 1.53 1 83 ASN 4.40 3.04 1 84 LYS 4.56 2.02 1 85 ARG -1.61 -2.27 1 86 LYS 6.27 -0.20 1 87 VAL 4.14 1.69 1 88 ASP 1.77 2.93 1 89 LEU -2.87 -1.15 1 90 VAL -2.50 -2.57 1 91 PHE -4.31 -5.06 1 92 ALA -1.75 -2.39 1 94 SER -1.81 -2.05 1 95 VAL 7.55 4.54 1 96 LYS 4.18 1.38 1 97 GLU 0.29 -0.88 1 98 ILE 1.18 -0.84 1 99 TYR -0.99 -2.99 1 101 ASN -1.48 -1.82 1 104 GLU 0.58 -0.63 1 105 THR 1.22 0.81 1 106 HIS 2.51 2.56 1 107 THR 1.19 0.78 1 108 TYR 4.38 2.33 1 109 VAL 1.33 -0.54 1 110 ASP -5.18 -2.75 1 111 VAL 0.52 -1.45 1 114 LEU 0.81 -0.86 1 115 SER 1.67 0.08 1 116 THR 1.63 -0.32 1 117 MET 1.44 -0.16 1 118 LEU 1.14 -0.42 1 119 GLU 1.82 -0.11 1 121 ALA 0.15 -0.88 1 122 SER 1.20 -0.39 1 123 ARG 0.82 -0.72 1 126 HIS 1.99 4.01 1 127 PHE 5.00 1.97 1 128 ARG 3.97 2.40 1 130 VAL 5.96 3.05 1 131 SER 5.21 2.42 1 132 THR 0.99 -0.30 1 134 VAL 3.32 0.68 1 135 SER 1.48 1.08 1 136 LYS 8.51 2.07 1 137 LEU 5.79 1.34 1 138 PHE -3.70 -2.42 1 140 LEU 2.07 1.18 1 141 VAL 2.23 0.15 1 142 GLN 3.99 1.54 1 144 ASP 0.91 1.73 1 145 ILE -5.26 -3.29 1 146 ALA -4.75 -2.31 1 148 PHE -5.04 -1.78 1 150 GLU 1.80 0.82 1 151 LYS 4.89 1.91 1 153 PHE 5.50 3.03 1 154 GLN 0.57 0.06 1 157 ALA -2.67 -3.10 1 159 ILE 5.99 1.80 1 160 ARG 7.56 4.69 1 161 LYS 5.64 2.77 1 162 MET 3.64 3.25 1 163 VAL 7.10 4.45 1 164 ALA 4.03 1.76 1 165 ASP 4.44 3.54 1 166 MET -1.23 0.50 1 168 PHE 1.36 0.69 1 169 ASP 1.34 -2.66 1 170 ILE -4.53 -1.82 1 171 GLU -0.22 -1.36 1 173 VAL -0.48 -1.12 1 175 VAL -2.84 -3.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 3.03 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -2.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.38 _LACS_plot.Line_2_terminator_val_x_2 8.51 _LACS_plot.Line_2_terminator_val_y_2 -3.73 _LACS_plot.Y_axis_chem_shift_offset 1.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 HIS 4.45 1.06 0 172 ILE 1.49 -5.38 0 10 LEU 5.92 -3.23 1 11 ARG 5.66 -3.32 1 12 GLN 4.70 -1.98 1 13 GLN 5.01 -3.49 1 14 ILE 5.45 -5.07 1 15 ARG 5.90 -2.65 1 16 ARG 5.93 -3.05 1 17 LEU 4.71 -2.45 1 18 ARG 5.21 -2.92 1 19 MET 4.63 -2.43 1 20 GLU 0.82 -1.21 1 22 LYS -0.07 -1.57 1 23 ARG 0.37 -1.28 1 24 VAL -2.05 0.78 1 25 ALA -6.63 2.58 1 26 LEU -5.51 2.38 1 27 VAL -0.74 -0.52 1 29 THR -3.49 1.92 1 30 MET -0.05 -1.03 1 32 ASN 3.11 -3.40 1 33 LEU 0.15 -1.86 1 34 HIS -3.89 2.47 1 38 MET 3.88 -3.44 1 39 LYS 5.25 -2.86 1 40 LEU 4.60 -2.11 1 41 VAL 7.27 -3.42 1 42 ASP 5.67 -2.88 1 43 GLU 4.03 -2.60 1 44 ALA 4.19 -1.76 1 45 LYS 3.54 -2.82 1 46 ALA 2.25 -2.05 1 47 ARG -1.28 0.46 1 48 ALA -4.12 1.90 1 49 ASP 0.88 1.05 1 50 VAL -3.85 1.13 1 51 VAL -1.09 -0.23 1 52 ALA -4.20 -0.31 1 53 VAL -2.90 0.18 1 54 SER -3.35 0.76 1 55 ILE -0.15 -0.01 1 56 PHE 1.37 -1.84 1 57 VAL 4.30 -4.86 1 58 ASN -1.16 -0.42 1 60 MET 1.22 0.30 1 61 GLN -1.23 -0.18 1 62 PHE -0.64 -0.29 1 63 ASP 1.88 -1.12 1 64 ARG -0.76 -1.03 1 66 GLU 5.29 -3.05 1 67 ASP 3.68 -1.78 1 68 LEU 4.43 -3.02 1 69 ALA 3.53 -2.40 1 70 ARG 1.07 -1.77 1 71 TYR 2.47 -1.05 1 73 ARG 0.95 -1.96 1 74 THR -1.80 -1.86 1 75 LEU 5.84 -2.46 1 76 GLN 6.97 -3.34 1 77 GLU 5.25 -2.45 1 78 ASP 4.93 -1.57 1 80 GLU 4.90 -2.48 1 81 LYS 5.26 -2.03 1 82 LEU 5.10 -3.57 1 83 ASN 4.40 -1.36 1 84 LYS 4.56 -2.54 1 85 ARG -1.61 -0.66 1 86 LYS 6.27 -6.47 1 87 VAL 4.14 -2.45 1 88 ASP 1.77 1.16 1 89 LEU -2.87 1.72 1 90 VAL -2.50 -0.07 1 91 PHE -4.31 -0.75 1 92 ALA -1.75 -0.64 1 94 SER -1.81 -0.24 1 95 VAL 7.55 -3.01 1 96 LYS 4.18 -2.80 1 97 GLU 0.29 -1.17 1 98 ILE 1.18 -2.02 1 99 TYR -0.99 -2.00 1 101 ASN -1.48 -0.34 1 104 GLU 0.58 -1.21 1 105 THR 1.22 -0.41 1 106 HIS 2.51 0.05 1 107 THR 1.19 -0.41 1 108 TYR 4.38 -2.05 1 109 VAL 1.33 -1.87 1 110 ASP -5.18 2.43 1 111 VAL 0.52 -1.97 1 114 LEU 0.81 -1.67 1 115 SER 1.67 -1.59 1 116 THR 1.63 -1.95 1 117 MET 1.44 -1.60 1 118 LEU 1.14 -1.56 1 119 GLU 1.82 -1.93 1 121 ALA 0.15 -1.03 1 122 SER 1.20 -1.59 1 123 ARG 0.82 -1.54 1 126 HIS 1.99 2.02 1 127 PHE 5.00 -3.03 1 128 ARG 3.97 -1.57 1 130 VAL 5.96 -2.91 1 131 SER 5.21 -2.79 1 132 THR 0.99 -1.29 1 134 VAL 3.32 -2.64 1 135 SER 1.48 -0.40 1 136 LYS 8.51 -6.44 1 137 LEU 5.79 -4.45 1 138 PHE -3.70 1.28 1 140 LEU 2.07 -0.89 1 141 VAL 2.23 -2.08 1 142 GLN 3.99 -2.45 1 144 ASP 0.91 0.82 1 145 ILE -5.26 1.97 1 146 ALA -4.75 2.44 1 148 PHE -5.04 3.26 1 150 GLU 1.80 -0.98 1 151 LYS 4.89 -2.98 1 153 PHE 5.50 -2.47 1 154 GLN 0.57 -0.51 1 157 ALA -2.67 -0.43 1 159 ILE 5.99 -4.19 1 160 ARG 7.56 -2.87 1 161 LYS 5.64 -2.87 1 162 MET 3.64 -0.39 1 163 VAL 7.10 -2.65 1 164 ALA 4.03 -2.27 1 165 ASP 4.44 -0.90 1 166 MET -1.23 1.73 1 168 PHE 1.36 -0.67 1 169 ASP 1.34 -4.00 1 170 ILE -4.53 2.71 1 171 GLU -0.22 -1.14 1 173 VAL -0.48 -0.64 1 175 VAL -2.84 -0.82 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 -0.99 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.86 _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 7.55 _LACS_plot.Line_2_terminator_val_y_2 1.94 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 HIS 4.45 3.96 0 137 LEU 5.79 -1.13 0 10 LEU 5.92 0.40 1 11 ARG 5.66 2.03 1 12 GLN 4.70 2.44 1 13 GLN 5.01 1.85 1 14 ILE 5.45 1.76 1 15 ARG 5.90 2.20 1 16 ARG 5.93 1.84 1 17 LEU 4.71 0.95 1 18 ARG 5.21 2.99 1 20 GLU 0.82 0.87 1 22 LYS -0.07 0.14 1 23 ARG 0.37 1.08 1 24 VAL -2.05 0.27 1 25 ALA -6.63 -1.43 1 26 LEU -5.51 -1.20 1 30 MET -0.05 0.27 1 32 ASN 3.11 1.62 1 33 LEU 0.15 0.28 1 38 MET 3.88 1.70 1 39 LYS 5.25 2.08 1 40 LEU 4.60 0.61 1 41 VAL 7.27 1.14 1 42 ASP 5.67 2.36 1 43 GLU 4.03 1.41 1 44 ALA 4.19 0.57 1 45 LYS 3.54 1.27 1 46 ALA 2.25 0.68 1 47 ARG -1.28 -0.03 1 48 ALA -4.12 -1.67 1 49 ASP 0.88 0.66 1 50 VAL -3.85 -0.57 1 51 VAL -1.09 -0.76 1 52 ALA -4.20 -1.12 1 53 VAL -2.90 0.53 1 54 SER -3.35 1.63 1 55 ILE -0.15 -0.27 1 56 PHE 1.37 -0.40 1 57 VAL 4.30 -0.51 1 60 MET 1.22 0.48 1 61 GLN -1.23 -0.48 1 62 PHE -0.64 0.51 1 63 ASP 1.88 0.69 1 66 GLU 5.29 1.47 1 67 ASP 3.68 1.72 1 68 LEU 4.43 0.64 1 69 ALA 3.53 0.43 1 70 ARG 1.07 0.51 1 73 ARG 0.95 0.61 1 74 THR -1.80 1.98 1 75 LEU 5.84 0.72 1 76 GLN 6.97 2.42 1 77 GLU 5.25 2.06 1 78 ASP 4.93 2.02 1 80 GLU 4.90 2.05 1 81 LYS 5.26 2.32 1 82 LEU 5.10 0.64 1 83 ASN 4.40 3.76 1 84 LYS 4.56 1.05 1 85 ARG -1.61 0.20 1 86 LYS 6.27 0.63 1 87 VAL 4.14 0.30 1 88 ASP 1.77 1.12 1 89 LEU -2.87 -1.98 1 90 VAL -2.50 -0.44 1 91 PHE -4.31 -0.69 1 94 SER -1.81 2.15 1 95 VAL 7.55 1.23 1 97 GLU 0.29 0.31 1 98 ILE 1.18 0.17 1 101 ASN -1.48 1.67 1 104 GLU 0.58 0.07 1 106 HIS 2.51 1.75 1 108 TYR 4.38 1.05 1 109 VAL 1.33 0.27 1 110 ASP -5.18 -0.58 1 115 SER 1.67 1.93 1 116 THR 1.63 1.60 1 117 MET 1.44 0.69 1 118 LEU 1.14 -0.13 1 119 GLU 1.82 0.86 1 121 ALA 0.15 -0.16 1 122 SER 1.20 1.47 1 127 PHE 5.00 1.60 1 128 ARG 3.97 2.39 1 130 VAL 5.96 1.09 1 132 THR 0.99 1.06 1 134 VAL 3.32 0.62 1 135 SER 1.48 3.12 1 138 PHE -3.70 1.78 1 140 LEU 2.07 0.02 1 141 VAL 2.23 -1.30 1 144 ASP 0.91 1.11 1 145 ILE -5.26 -0.70 1 146 ALA -4.75 -1.20 1 148 PHE -5.04 0.49 1 150 GLU 1.80 1.12 1 153 PHE 5.50 0.98 1 159 ILE 5.99 1.58 1 160 ARG 7.56 2.32 1 161 LYS 5.64 0.79 1 162 MET 3.64 1.99 1 163 VAL 7.10 1.53 1 164 ALA 4.03 1.47 1 165 ASP 4.44 2.43 1 166 MET -1.23 1.75 1 168 PHE 1.36 1.30 1 169 ASP 1.34 -0.09 1 170 ILE -4.53 -0.15 1 171 GLU -0.22 -0.35 1 172 ILE 1.49 0.32 1 173 VAL -0.48 0.07 1 stop_ save_