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 bmr18935_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 -3.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.11 _LACS_plot.Line_2_terminator_val_x_2 9.26 _LACS_plot.Line_2_terminator_val_y_2 5.68 _LACS_plot.Y_axis_chem_shift_offset 0.77 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 ASP 0.00 -3.77 0 55 ILE 0.95 -3.54 0 10 ILE 6.07 3.58 1 11 VAL 8.13 5.44 1 12 ASN 4.21 2.87 1 13 HIS 2.67 3.69 1 14 LEU 2.92 1.54 1 15 ARG 5.71 3.88 1 16 SER -0.78 -1.06 1 17 ARG -0.61 0.32 1 18 LEU -1.05 -0.40 1 19 ALA -5.45 -1.70 1 20 PHE -4.23 -2.10 1 21 GLU -2.08 -1.64 1 22 TYR -3.67 -2.61 1 23 ASN 2.59 -0.05 1 25 GLN -3.87 -2.47 1 26 LEU 0.48 -1.11 1 27 ILE 1.12 -2.13 1 28 LYS 1.89 0.61 1 29 ILE 1.08 -0.69 1 30 LEU 0.90 -0.66 1 31 SER 4.58 2.88 1 32 LYS 3.92 1.09 1 33 ASN -0.45 -1.01 1 34 ILE -0.62 -0.55 1 35 VAL -3.52 -2.19 1 36 ALA 1.38 -0.10 1 37 VAL -2.37 -2.88 1 39 SER 4.02 1.74 1 40 LEU 3.79 3.27 1 41 ARG 5.15 2.45 1 42 ARG 2.93 0.38 1 43 GLU 4.45 -0.15 1 44 GLU 0.87 -0.47 1 45 LYS 3.92 2.85 1 46 MET -3.99 -2.92 1 47 LEU -3.41 -2.90 1 48 ASN 2.47 2.40 1 49 ASP -1.98 -3.00 1 50 VAL -0.36 -0.29 1 51 ASP -3.90 -1.17 1 52 LEU -4.08 -2.23 1 53 LEU -5.38 -2.77 1 54 ILE -2.26 -2.50 1 56 VAL -3.45 -3.57 1 58 GLU -4.50 -2.30 1 59 LYS 5.59 3.57 1 60 LYS 4.53 2.01 1 61 LEU 1.46 -0.08 1 62 LEU 4.77 3.10 1 63 LYS 3.30 1.16 1 64 HIS -2.60 0.77 1 65 VAL 7.67 4.13 1 66 LEU 9.09 2.75 1 68 ASN -3.70 -2.29 1 69 ILE -0.43 -1.19 1 70 ARG -4.39 -2.84 1 71 ILE -0.49 -1.32 1 72 LYS 2.96 1.23 1 74 LEU -3.09 -1.44 1 75 SER 0.13 -0.60 1 76 PHE -4.53 -2.29 1 77 SER -3.72 -2.30 1 78 VAL 0.50 -0.11 1 79 LYS 2.08 1.45 1 80 VAL -4.28 -3.10 1 83 GLU 1.06 1.07 1 84 ARG -2.15 -1.50 1 85 LYS -2.08 -0.97 1 87 VAL -1.31 -0.87 1 88 LEU -5.15 -3.01 1 89 PHE -1.06 -1.82 1 90 ILE -3.81 -2.43 1 91 GLU -1.89 -2.13 1 92 TRP -2.29 -1.31 1 93 GLU 4.13 0.17 1 94 LYS 5.69 1.23 1 95 LYS -3.21 -1.85 1 96 THR -0.15 -0.60 1 97 TYR -4.36 -2.02 1 98 GLN 0.47 -0.53 1 99 LEU -5.40 -3.05 1 101 LEU -5.21 -3.44 1 102 PHE -6.64 -4.42 1 103 THR -5.35 -4.11 1 104 ALA -6.02 -2.69 1 105 LEU -0.91 -1.98 1 106 ALA 5.63 3.85 1 107 GLU 3.85 1.79 1 108 GLU -1.77 -1.67 1 109 LYS 9.26 6.70 1 111 TYR 3.94 1.10 1 112 ALA 2.76 2.47 1 113 ILE 6.86 5.30 1 114 PHE 2.62 2.08 1 115 HIS 2.05 4.12 1 116 PHE 6.07 3.73 1 117 THR 7.05 5.20 1 120 VAL 7.79 4.74 1 121 SER 6.06 2.51 1 122 TYR 1.31 0.65 1 123 LEU 3.44 1.68 1 124 ILE 5.58 3.33 1 125 ARG 6.28 2.46 1 126 ILE 4.16 -0.17 1 127 ARG 7.33 4.22 1 128 ALA 2.97 2.21 1 129 ALA 4.45 2.21 1 130 LEU 3.91 2.08 1 131 LYS 3.59 2.69 1 132 LYS 3.42 1.75 1 133 LYS 0.34 -1.12 1 134 ASN 4.37 1.52 1 135 TYR -4.27 -1.15 1 136 LYS -1.99 -1.02 1 137 LEU -4.85 -2.27 1 140 TYR -0.95 -1.45 1 142 LEU -4.74 -2.60 1 143 PHE -4.14 -1.67 1 144 LYS -1.42 -0.84 1 145 ASN 4.13 1.66 1 146 GLN 4.23 1.20 1 147 THR -0.83 -0.35 1 148 LEU 1.04 0.37 1 149 VAL -1.49 -2.93 1 151 LEU -2.32 -1.10 1 152 LYS 2.43 -1.60 1 153 ILE -5.71 -2.71 1 154 THR -0.27 0.34 1 155 THR -5.50 -3.02 1 156 GLU 3.74 2.22 1 157 LYS 5.39 3.57 1 158 GLU 2.50 1.66 1 159 LEU 1.00 -1.86 1 160 ILE 5.75 4.51 1 161 LYS 4.78 2.43 1 162 GLU 3.49 1.38 1 163 LEU 1.22 -0.01 1 165 PHE -3.39 -2.23 1 166 THR 2.75 1.67 1 167 TYR 4.59 2.51 1 168 ARG -3.66 -3.23 1 169 ILE 3.33 -0.82 1 171 LYS 2.47 1.34 1 172 LYS -0.92 -2.20 1 173 ARG 3.24 1.17 1 174 LEU 0.01 1.89 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18935_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 3.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.11 _LACS_plot.Line_2_terminator_val_x_2 9.26 _LACS_plot.Line_2_terminator_val_y_2 -3.58 _LACS_plot.Y_axis_chem_shift_offset 0.77 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 ASP 0.00 -3.77 0 55 ILE 0.95 -4.49 0 10 ILE 6.07 -2.49 1 11 VAL 8.13 -2.69 1 12 ASN 4.21 -1.34 1 13 HIS 2.67 1.02 1 14 LEU 2.92 -1.38 1 15 ARG 5.71 -1.83 1 16 SER -0.78 -0.28 1 17 ARG -0.61 0.93 1 18 LEU -1.05 0.65 1 19 ALA -5.45 3.75 1 20 PHE -4.23 2.13 1 21 GLU -2.08 0.44 1 22 TYR -3.67 1.06 1 23 ASN 2.59 -2.64 1 25 GLN -3.87 1.40 1 26 LEU 0.48 -1.59 1 27 ILE 1.12 -3.25 1 28 LYS 1.89 -1.28 1 29 ILE 1.08 -1.77 1 30 LEU 0.90 -1.56 1 31 SER 4.58 -1.70 1 32 LYS 3.92 -2.83 1 33 ASN -0.45 -0.56 1 34 ILE -0.62 0.07 1 35 VAL -3.52 1.33 1 36 ALA 1.38 -1.48 1 37 VAL -2.37 -0.51 1 39 SER 4.02 -2.28 1 40 LEU 3.79 -0.52 1 41 ARG 5.15 -2.70 1 42 ARG 2.93 -2.55 1 43 GLU 4.45 -4.60 1 44 GLU 0.87 -1.34 1 45 LYS 3.92 -1.07 1 46 MET -3.99 1.07 1 47 LEU -3.41 0.51 1 48 ASN 2.47 -0.07 1 49 ASP -1.98 -1.02 1 50 VAL -0.36 0.07 1 51 ASP -3.90 2.73 1 52 LEU -4.08 1.85 1 53 LEU -5.38 2.61 1 54 ILE -2.26 -0.24 1 56 VAL -3.45 -0.12 1 58 GLU -4.50 2.20 1 59 LYS 5.59 -2.02 1 60 LYS 4.53 -2.52 1 61 LEU 1.46 -1.54 1 62 LEU 4.77 -1.67 1 63 LYS 3.30 -2.14 1 64 HIS -2.60 3.37 1 65 VAL 7.67 -3.54 1 66 LEU 9.09 -6.34 1 68 ASN -3.70 1.41 1 69 ILE -0.43 -0.76 1 70 ARG -4.39 1.55 1 71 ILE -0.49 -0.83 1 72 LYS 2.96 -1.73 1 74 LEU -3.09 1.65 1 75 SER 0.13 -0.73 1 76 PHE -4.53 2.24 1 77 SER -3.72 1.42 1 78 VAL 0.50 -0.61 1 79 LYS 2.08 -0.63 1 80 VAL -4.28 1.18 1 83 GLU 1.06 0.01 1 84 ARG -2.15 0.65 1 85 LYS -2.08 1.11 1 87 VAL -1.31 0.44 1 88 LEU -5.15 2.14 1 89 PHE -1.06 -0.76 1 90 ILE -3.81 1.38 1 91 GLU -1.89 -0.24 1 92 TRP -2.29 0.98 1 93 GLU 4.13 -3.96 1 94 LYS 5.69 -4.46 1 95 LYS -3.21 1.36 1 96 THR -0.15 -0.45 1 97 TYR -4.36 2.34 1 98 GLN 0.47 -1.00 1 99 LEU -5.40 2.35 1 101 LEU -5.21 1.77 1 102 PHE -6.64 2.22 1 103 THR -5.35 1.24 1 104 ALA -6.02 3.33 1 105 LEU -0.91 -1.07 1 106 ALA 5.63 -1.78 1 107 GLU 3.85 -2.06 1 108 GLU -1.77 0.10 1 109 LYS 9.26 -2.56 1 111 TYR 3.94 -2.84 1 112 ALA 2.76 -0.29 1 113 ILE 6.86 -1.56 1 114 PHE 2.62 -0.54 1 115 HIS 2.05 2.07 1 116 PHE 6.07 -2.34 1 117 THR 7.05 -1.85 1 120 VAL 7.79 -3.05 1 121 SER 6.06 -3.55 1 122 TYR 1.31 -0.66 1 123 LEU 3.44 -1.76 1 124 ILE 5.58 -2.25 1 125 ARG 6.28 -3.82 1 126 ILE 4.16 -4.33 1 127 ARG 7.33 -3.11 1 128 ALA 2.97 -0.76 1 129 ALA 4.45 -2.24 1 130 LEU 3.91 -1.83 1 131 LYS 3.59 -0.90 1 132 LYS 3.42 -1.67 1 133 LYS 0.34 -1.46 1 134 ASN 4.37 -2.85 1 135 TYR -4.27 3.12 1 136 LYS -1.99 0.97 1 137 LEU -4.85 2.58 1 140 TYR -0.95 -0.50 1 142 LEU -4.74 2.14 1 143 PHE -4.14 2.47 1 144 LYS -1.42 0.58 1 145 ASN 4.13 -2.47 1 146 GLN 4.23 -3.03 1 147 THR -0.83 0.48 1 148 LEU 1.04 -0.67 1 149 VAL -1.49 -1.44 1 151 LEU -2.32 1.22 1 152 LYS 2.43 -4.03 1 153 ILE -5.71 3.00 1 154 THR -0.27 0.61 1 155 THR -5.50 2.48 1 156 GLU 3.74 -1.52 1 157 LYS 5.39 -1.82 1 158 GLU 2.50 -0.84 1 159 LEU 1.00 -2.86 1 160 ILE 5.75 -1.24 1 161 LYS 4.78 -2.35 1 162 GLU 3.49 -2.11 1 163 LEU 1.22 -1.23 1 165 PHE -3.39 1.16 1 166 THR 2.75 -1.08 1 167 TYR 4.59 -2.08 1 168 ARG -3.66 0.43 1 169 ILE 3.33 -4.15 1 171 LYS 2.47 -1.13 1 172 LYS -0.92 -1.28 1 173 ARG 3.24 -2.07 1 174 LEU 0.01 1.88 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18935_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 -2.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 9.26 _LACS_plot.Line_2_terminator_val_y_2 2.15 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 LYS 9.26 -3.91 0 10 ILE 6.07 1.37 1 11 VAL 8.13 0.31 1 12 ASN 4.21 2.18 1 13 HIS 2.67 3.19 1 14 LEU 2.92 1.49 1 15 ARG 5.71 -0.04 1 16 SER -0.78 1.41 1 17 ARG -0.61 -1.82 1 18 LEU -1.05 -1.32 1 19 ALA -5.45 -4.02 1 20 PHE -4.23 -3.09 1 21 GLU -2.08 -1.77 1 22 TYR -3.67 -1.04 1 23 ASN 2.59 0.21 1 25 GLN -3.87 -2.34 1 26 LEU 0.48 -1.76 1 27 ILE 1.12 -1.31 1 28 LYS 1.89 0.12 1 29 ILE 1.08 -0.71 1 30 LEU 0.90 1.19 1 31 SER 4.58 2.86 1 32 LYS 3.92 -0.36 1 33 ASN -0.45 -2.95 1 34 ILE -0.62 -1.06 1 35 VAL -3.52 -0.76 1 36 ALA 1.38 -0.79 1 37 VAL -2.37 -1.65 1 39 SER 4.02 0.53 1 40 LEU 3.79 2.96 1 41 ARG 5.15 0.66 1 42 ARG 2.93 -3.74 1 43 GLU 4.45 -0.40 1 44 GLU 0.87 -1.40 1 45 LYS 3.92 1.13 1 46 MET -3.99 -2.23 1 47 LEU -3.41 0.07 1 48 ASN 2.47 -0.48 1 49 ASP -1.98 -2.19 1 50 VAL -0.36 -3.97 1 51 ASP -3.90 -2.58 1 52 LEU -4.08 -4.56 1 53 LEU -5.38 -3.85 1 54 ILE -2.26 -1.27 1 55 ILE 0.95 -0.74 1 56 VAL -3.45 0.09 1 58 GLU -4.50 -0.65 1 59 LYS 5.59 2.65 1 60 LYS 4.53 0.60 1 61 LEU 1.46 1.19 1 62 LEU 4.77 0.16 1 63 LYS 3.30 -1.21 1 64 HIS -2.60 1.98 1 65 VAL 7.67 -2.00 1 68 ASN -3.70 -0.32 1 70 ARG -4.39 -1.70 1 71 ILE -0.49 -0.78 1 72 LYS 2.96 1.06 1 74 LEU -3.09 -1.80 1 75 SER 0.13 -1.49 1 76 PHE -4.53 -2.24 1 77 SER -3.72 -1.41 1 78 VAL 0.50 -0.24 1 79 LYS 2.08 -0.16 1 83 GLU 1.06 2.72 1 84 ARG -2.15 0.95 1 85 LYS -2.08 -3.22 1 87 VAL -1.31 -2.54 1 88 LEU -5.15 -2.18 1 89 PHE -1.06 1.27 1 90 ILE -3.81 -2.71 1 91 GLU -1.89 -1.04 1 92 TRP -2.29 -1.03 1 93 GLU 4.13 -0.96 1 94 LYS 5.69 -1.24 1 95 LYS -3.21 -2.23 1 96 THR -0.15 -0.38 1 97 TYR -4.36 -2.58 1 98 GLN 0.47 -3.22 1 99 LEU -5.40 -4.79 1 100 ASP 0.00 -3.67 1 101 LEU -5.21 -3.73 1 102 PHE -6.64 0.05 1 103 THR -5.35 0.45 1 104 ALA -6.02 -1.85 1 105 LEU -0.91 2.03 1 106 ALA 5.63 3.26 1 107 GLU 3.85 1.25 1 108 GLU -1.77 1.40 1 111 TYR 3.94 3.86 1 112 ALA 2.76 1.63 1 113 ILE 6.86 2.25 1 114 PHE 2.62 2.15 1 115 HIS 2.05 2.06 1 116 PHE 6.07 1.48 1 117 THR 7.05 -1.81 1 120 VAL 7.79 -0.02 1 121 SER 6.06 1.06 1 122 TYR 1.31 -1.29 1 123 LEU 3.44 1.29 1 124 ILE 5.58 0.79 1 125 ARG 6.28 2.17 1 126 ILE 4.16 1.77 1 127 ARG 7.33 2.93 1 128 ALA 2.97 2.13 1 129 ALA 4.45 3.54 1 130 LEU 3.91 1.83 1 131 LYS 3.59 4.85 1 132 LYS 3.42 1.01 1 133 LYS 0.34 -1.92 1 134 ASN 4.37 -1.17 1 135 TYR -4.27 -0.78 1 136 LYS -1.99 -2.28 1 137 LEU -4.85 -3.80 1 140 TYR -0.95 -1.19 1 142 LEU -4.74 -3.53 1 143 PHE -4.14 -0.60 1 144 LYS -1.42 0.32 1 145 ASN 4.13 -0.13 1 146 GLN 4.23 -0.80 1 147 THR -0.83 -1.48 1 148 LEU 1.04 -0.90 1 149 VAL -1.49 -1.29 1 151 LEU -2.32 0.08 1 152 LYS 2.43 -1.48 1 153 ILE -5.71 -0.65 1 154 THR -0.27 0.16 1 155 THR -5.50 0.02 1 156 GLU 3.74 0.69 1 157 LYS 5.39 1.64 1 158 GLU 2.50 2.39 1 159 LEU 1.00 -1.25 1 160 ILE 5.75 0.82 1 161 LYS 4.78 4.39 1 162 GLU 3.49 2.19 1 163 LEU 1.22 -1.23 1 165 PHE -3.39 -1.24 1 166 THR 2.75 0.61 1 167 TYR 4.59 -2.60 1 168 ARG -3.66 -1.00 1 169 ILE 3.33 -1.88 1 171 LYS 2.47 0.04 1 172 LYS -0.92 -1.27 1 173 ARG 3.24 -3.47 1 174 LEU 0.01 3.42 1 stop_ save_