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 bmr11434_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.04 _LACS_plot.Line_1_terminator_val_y_1 -2.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 9.62 _LACS_plot.Line_2_terminator_val_y_2 7.17 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 TRP 0.36 -3.50 0 10 ASN 2.49 1.73 1 11 ARG -1.03 -1.05 1 13 ASP -1.01 -0.61 1 14 THR -2.24 -3.17 1 15 THR 0.69 -0.52 1 17 ALA 0.36 -0.59 1 18 SER -1.45 -0.26 1 20 LYS 3.68 3.01 1 21 SER 4.86 3.65 1 22 ALA 0.56 2.29 1 23 LYS 0.39 -2.16 1 25 GLU 5.83 0.72 1 26 LYS -3.68 -2.09 1 27 LEU -0.03 -0.95 1 28 ASN -4.10 -3.75 1 29 TYR 6.64 5.42 1 32 VAL 3.65 2.90 1 33 ALA 3.19 2.30 1 34 ALA 4.37 4.11 1 36 ARG 3.64 0.65 1 37 LYS 4.87 4.51 1 38 ILE 2.44 1.73 1 39 ALA 2.84 2.53 1 40 GLU 3.60 3.07 1 41 ARG 0.09 0.34 1 42 ASP 3.95 4.67 1 43 LEU 5.48 4.17 1 44 GLN 4.08 3.94 1 45 SER 4.42 1.67 1 46 MET 3.23 2.42 1 47 ASP 3.87 2.53 1 48 ARG -1.50 -1.63 1 49 TYR 5.48 5.17 1 50 LYS 4.52 2.97 1 51 ALA 2.09 2.57 1 52 LEU 5.51 5.56 1 53 ILE 5.17 4.16 1 54 LYS 3.54 3.75 1 55 LYS 6.09 4.82 1 56 VAL 4.67 3.40 1 58 GLN 3.49 2.78 1 59 LYS -0.39 -0.91 1 60 LEU -5.04 -1.53 1 62 VAL -0.94 0.36 1 63 ASP 3.35 2.95 1 65 ALA 6.13 4.36 1 66 VAL 6.60 5.25 1 67 ILE 3.90 2.70 1 68 ALA 5.53 4.47 1 70 ILE 5.68 4.33 1 71 ILE 3.52 3.39 1 72 SER 1.57 1.42 1 73 ARG 2.10 1.54 1 74 GLU -4.10 -0.44 1 75 SER 4.40 2.71 1 76 HIS 3.09 0.56 1 77 ALA 3.94 3.16 1 79 LYS -1.28 -0.58 1 80 ALA -2.15 -1.83 1 81 LEU -1.01 -1.12 1 82 ARG 2.12 1.06 1 83 ASN -3.77 -1.31 1 85 TRP 3.37 2.63 1 87 ASP 1.26 0.10 1 88 ASN -0.33 1.34 1 90 ASN -3.71 -1.07 1 92 PHE 1.10 2.62 1 94 LEU 1.41 1.80 1 95 MET 1.67 -0.14 1 96 GLN 1.33 1.47 1 97 VAL -1.26 0.00 1 98 ASP 2.61 1.11 1 99 ARG 3.12 1.86 1 100 ARG -1.25 -0.13 1 101 SER -3.88 -0.84 1 102 HIS 0.38 -0.27 1 103 LYS -4.23 -2.16 1 105 VAL -0.46 -0.13 1 107 GLU 1.74 1.19 1 109 ASN 2.83 3.64 1 111 GLU 5.01 4.02 1 112 ARG 4.96 4.43 1 113 HIS 1.44 1.90 1 114 LEU 4.57 2.37 1 115 MET 5.40 3.93 1 116 GLN 9.62 6.35 1 118 THR 4.59 3.69 1 119 GLU 5.93 4.75 1 120 ILE 6.67 4.49 1 121 LEU 6.06 5.20 1 122 ILE 0.79 1.83 1 124 MET 5.81 5.47 1 125 ILE 4.82 3.88 1 126 LYS 4.13 2.59 1 127 ALA 4.54 0.30 1 128 ILE 4.87 3.36 1 129 GLN 2.25 1.79 1 130 LYS 0.82 2.50 1 131 LYS 0.98 -0.73 1 132 PHE 1.09 -0.20 1 134 ARG -3.43 -1.58 1 135 TRP -2.55 -0.85 1 136 THR 4.81 3.44 1 137 LYS 6.05 5.56 1 138 GLU 2.81 3.20 1 139 GLN 4.68 2.79 1 140 GLN 6.08 3.42 1 141 LEU 4.91 5.10 1 142 LYS 5.68 5.03 1 145 ILE 4.81 5.66 1 146 SER 0.95 0.59 1 147 ALA 4.53 4.65 1 148 TYR 0.46 2.94 1 149 ASN -3.15 0.00 1 150 ALA -0.30 0.67 1 156 ARG -2.89 -1.62 1 157 SER 5.38 1.32 1 163 ILE -2.21 -0.32 1 165 THR 4.59 3.75 1 166 THR 2.79 0.40 1 167 HIS 2.68 1.47 1 168 ASP -0.81 0.25 1 169 ASP 1.79 3.06 1 171 ALA 4.79 5.96 1 172 ASN 3.79 3.00 1 173 ASP 8.60 6.47 1 174 VAL 6.68 5.27 1 175 VAL 3.60 2.97 1 176 ALA 4.94 4.23 1 177 ARG 1.44 2.57 1 178 ALA 5.78 3.66 1 179 GLN 6.21 4.69 1 180 TYR 9.30 5.80 1 181 TYR 3.41 1.98 1 182 LYS 0.93 0.35 1 183 GLN 1.23 0.94 1 184 HIS 3.97 3.75 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11434_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.04 _LACS_plot.Line_1_terminator_val_y_1 2.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.84 _LACS_plot.Line_2_terminator_val_x_2 9.62 _LACS_plot.Line_2_terminator_val_y_2 -2.45 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 TRP 0.36 -3.86 0 10 ASN 2.49 -0.76 1 11 ARG -1.03 -0.02 1 13 ASP -1.01 0.40 1 14 THR -2.24 -0.93 1 15 THR 0.69 -1.21 1 17 ALA 0.36 -0.95 1 18 SER -1.45 1.19 1 20 LYS 3.68 -0.67 1 21 SER 4.86 -1.21 1 22 ALA 0.56 1.73 1 23 LYS 0.39 -2.55 1 25 GLU 5.83 -5.11 1 26 LYS -3.68 1.59 1 27 LEU -0.03 -0.92 1 28 ASN -4.10 0.35 1 29 TYR 6.64 -1.22 1 32 VAL 3.65 -0.75 1 33 ALA 3.19 -0.89 1 34 ALA 4.37 -0.26 1 36 ARG 3.64 -2.99 1 37 LYS 4.87 -0.36 1 38 ILE 2.44 -0.71 1 39 ALA 2.84 -0.31 1 40 GLU 3.60 -0.53 1 41 ARG 0.09 0.25 1 42 ASP 3.95 0.72 1 43 LEU 5.48 -1.31 1 44 GLN 4.08 -0.14 1 45 SER 4.42 -2.75 1 46 MET 3.23 -0.81 1 47 ASP 3.87 -1.34 1 48 ARG -1.50 -0.13 1 49 TYR 5.48 -0.31 1 50 LYS 4.52 -1.55 1 51 ALA 2.09 0.48 1 52 LEU 5.51 0.05 1 53 ILE 5.17 -1.01 1 54 LYS 3.54 0.21 1 55 LYS 6.09 -1.27 1 56 VAL 4.67 -1.27 1 58 GLN 3.49 -0.71 1 59 LYS -0.39 -0.52 1 60 LEU -5.04 3.51 1 62 VAL -0.94 1.30 1 63 ASP 3.35 -0.40 1 65 ALA 6.13 -1.77 1 66 VAL 6.60 -1.35 1 67 ILE 3.90 -1.20 1 68 ALA 5.53 -1.06 1 70 ILE 5.68 -1.35 1 71 ILE 3.52 -0.13 1 72 SER 1.57 -0.15 1 73 ARG 2.10 -0.56 1 74 GLU -4.10 3.66 1 75 SER 4.40 -1.69 1 76 HIS 3.09 -2.53 1 77 ALA 3.94 -0.78 1 79 LYS -1.28 0.70 1 80 ALA -2.15 0.32 1 81 LEU -1.01 -0.11 1 82 ARG 2.12 -1.06 1 83 ASN -3.77 2.46 1 85 TRP 3.37 -0.74 1 87 ASP 1.26 -1.16 1 88 ASN -0.33 1.67 1 90 ASN -3.71 2.64 1 92 PHE 1.10 1.52 1 94 LEU 1.41 0.39 1 95 MET 1.67 -1.81 1 96 GLN 1.33 0.14 1 97 VAL -1.26 1.26 1 98 ASP 2.61 -1.50 1 99 ARG 3.12 -1.26 1 100 ARG -1.25 1.12 1 101 SER -3.88 3.04 1 102 HIS 0.38 -0.65 1 103 LYS -4.23 2.07 1 105 VAL -0.46 0.33 1 107 GLU 1.74 -0.55 1 109 ASN 2.83 0.81 1 111 GLU 5.01 -0.99 1 112 ARG 4.96 -0.53 1 113 HIS 1.44 0.46 1 114 LEU 4.57 -2.20 1 115 MET 5.40 -1.47 1 116 GLN 9.62 -3.27 1 118 THR 4.59 -0.90 1 119 GLU 5.93 -1.18 1 120 ILE 6.67 -2.18 1 121 LEU 6.06 -0.86 1 122 ILE 0.79 1.04 1 124 MET 5.81 -0.34 1 125 ILE 4.82 -0.94 1 126 LYS 4.13 -1.54 1 127 ALA 4.54 -4.24 1 128 ILE 4.87 -1.51 1 129 GLN 2.25 -0.46 1 130 LYS 0.82 1.68 1 131 LYS 0.98 -1.71 1 132 PHE 1.09 -1.29 1 134 ARG -3.43 1.85 1 135 TRP -2.55 1.70 1 136 THR 4.81 -1.37 1 137 LYS 6.05 -0.49 1 138 GLU 2.81 0.39 1 139 GLN 4.68 -1.89 1 140 GLN 6.08 -2.66 1 141 LEU 4.91 0.19 1 142 LYS 5.68 -0.65 1 145 ILE 4.81 0.85 1 146 SER 0.95 -0.36 1 147 ALA 4.53 0.12 1 148 TYR 0.46 2.48 1 149 ASN -3.15 3.15 1 150 ALA -0.30 0.97 1 156 ARG -2.89 1.27 1 157 SER 5.38 -4.06 1 163 ILE -2.21 1.89 1 165 THR 4.59 -0.84 1 166 THR 2.79 -2.39 1 167 HIS 2.68 -1.21 1 168 ASP -0.81 1.06 1 169 ASP 1.79 1.27 1 171 ALA 4.79 1.17 1 172 ASN 3.79 -0.79 1 173 ASP 8.60 -2.13 1 174 VAL 6.68 -1.41 1 175 VAL 3.60 -0.63 1 176 ALA 4.94 -0.71 1 177 ARG 1.44 1.13 1 178 ALA 5.78 -2.12 1 179 GLN 6.21 -1.52 1 180 TYR 9.30 -3.50 1 181 TYR 3.41 -1.43 1 182 LYS 0.93 -0.58 1 183 GLN 1.23 -0.29 1 184 HIS 3.97 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11434_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.04 _LACS_plot.Line_1_terminator_val_y_1 -3.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.54 _LACS_plot.Line_2_terminator_val_x_2 9.62 _LACS_plot.Line_2_terminator_val_y_2 0.01 _LACS_plot.Y_axis_chem_shift_offset 2.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 TRP 1.74 -5.72 0 29 TYR -4.10 -5.89 0 77 ALA 3.09 -5.77 0 10 ASN 2.49 -1.10 1 11 ARG -1.03 -4.13 1 13 ASP -1.01 -3.55 1 15 THR 0.69 -1.57 1 17 ALA 0.36 -1.08 1 18 SER -1.45 0.50 1 20 LYS 3.68 -1.38 1 21 SER 4.86 -2.48 1 22 ALA 0.56 -2.13 1 25 GLU 0.39 -4.24 1 26 LYS 5.83 -3.64 1 27 LEU -3.68 -3.15 1 28 ASN -0.03 -4.62 1 32 VAL 6.64 -1.27 1 33 ALA 3.65 0.66 1 34 ALA 3.19 -2.37 1 37 LYS 3.64 -1.20 1 38 ILE 4.87 -1.17 1 39 ALA 2.44 0.98 1 40 GLU 2.84 0.12 1 41 ARG 3.60 -0.75 1 42 ASP 0.09 -2.88 1 43 LEU 3.95 -3.43 1 44 GLN 5.48 0.87 1 45 SER 4.08 -1.23 1 47 ASP 3.23 0.29 1 48 ARG 3.87 -1.65 1 49 TYR -1.50 -3.00 1 50 LYS 5.48 -2.74 1 51 ALA 4.52 0.50 1 53 ILE 5.51 -0.65 1 54 LYS 5.17 -0.63 1 55 LYS 3.54 0.02 1 56 VAL 6.09 -1.22 1 58 GLN 4.67 0.33 1 59 LYS 3.49 -0.75 1 60 LEU -0.39 -4.75 1 62 VAL -5.04 -4.47 1 65 ALA 3.35 0.16 1 66 VAL 6.13 -2.52 1 67 ILE 6.60 -1.64 1 68 ALA 3.90 -1.64 1 70 ILE 5.53 -1.86 1 71 ILE 5.68 0.32 1 72 SER 3.52 -0.72 1 73 ARG 1.57 -1.53 1 74 GLU 2.10 -0.75 1 75 SER -4.10 -0.93 1 76 HIS 4.40 -1.01 1 79 LYS 3.94 -1.92 1 80 ALA -1.28 -3.84 1 82 ARG -1.01 -2.61 1 83 ASN 2.12 -3.53 1 85 TRP -3.77 -1.14 1 87 ASP 3.37 -1.60 1 88 ASN 1.26 -1.34 1 90 ASN -0.33 -2.78 1 92 PHE -3.71 -1.96 1 94 LEU 1.10 -1.69 1 95 MET 1.41 -4.54 1 96 GLN 1.67 -2.82 1 97 VAL 1.33 -2.58 1 98 ASP -1.26 -1.18 1 99 ARG 2.61 -2.31 1 100 ARG 3.12 -1.29 1 101 SER -1.25 -4.12 1 102 HIS -3.88 -4.52 1 105 VAL -4.23 -2.92 1 107 GLU -0.46 0.96 1 109 ASN 0.36 -3.58 1 111 GLU 2.83 -1.36 1 113 HIS 4.96 -0.40 1 114 LEU 1.44 0.46 1 115 MET 4.57 -2.09 1 116 GLN 5.40 0.70 1 118 THR 9.62 -0.98 1 119 GLU 4.59 1.24 1 121 LEU 6.67 -2.05 1 124 MET 0.79 -0.61 1 125 ILE 5.81 -0.24 1 126 LYS 4.82 0.31 1 127 ALA 4.13 0.64 1 128 ILE 4.54 -1.53 1 129 GLN 4.87 -0.32 1 130 LYS 2.25 -1.50 1 131 LYS 0.82 -3.28 1 134 ARG 1.09 -0.90 1 135 TRP -3.43 -2.57 1 136 THR -2.55 -1.26 1 137 LYS 4.81 -0.07 1 138 GLU 6.05 -1.63 1 139 GLN 2.81 0.41 1 140 GLN 4.68 -0.79 1 141 LEU 6.08 -2.42 1 142 LYS 4.91 -0.87 1 145 ILE 5.68 -1.75 1 146 SER 4.81 1.71 1 147 ALA 0.95 -1.64 1 148 TYR 4.53 -2.75 1 149 ASN 0.46 -1.77 1 150 ALA -3.15 -3.05 1 156 ARG -0.30 -2.62 1 163 ILE 5.38 -1.33 1 165 THR -2.21 -0.51 1 166 THR 4.59 -2.46 1 167 HIS 2.79 -4.47 1 168 ASP 2.68 -1.96 1 169 ASP -0.81 -1.54 1 171 ALA 1.79 0.63 1 172 ASN 4.79 1.30 1 173 ASP 3.79 -1.95 1 174 VAL 8.60 -0.43 1 175 VAL 6.68 -1.73 1 176 ALA 3.60 0.70 1 177 ARG 4.94 -1.71 1 178 ALA 1.44 -0.73 1 179 GLN 5.78 0.34 1 180 TYR 6.21 0.56 1 181 TYR 9.30 0.21 1 182 LYS 3.41 -0.66 1 183 GLN 0.93 -2.78 1 184 HIS 1.23 -2.34 1 stop_ save_