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 bmr27265_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 -2.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.69 _LACS_plot.Line_2_terminator_val_x_2 6.83 _LACS_plot.Line_2_terminator_val_y_2 5.05 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 SER -6.92 -1.22 0 25 PHE 0.50 -3.00 0 10 ILE -2.03 -3.06 1 11 ALA -5.26 -1.55 1 12 VAL -2.09 -1.69 1 13 ASP 2.81 1.62 1 15 GLU -2.54 -1.27 1 17 LEU -1.95 -0.10 1 19 ARG -3.54 -0.85 1 20 VAL -4.25 -2.12 1 21 SER -5.74 -2.90 1 22 PHE -4.90 -1.82 1 23 GLU -3.64 -1.48 1 24 LEU -3.85 -3.03 1 26 ALA 2.02 1.92 1 27 ASP 3.49 1.21 1 28 LYS -2.83 0.08 1 29 VAL -0.93 -1.45 1 31 LYS 4.97 4.34 1 32 THR 6.83 5.73 1 33 ALA 4.17 3.49 1 34 GLU 3.23 1.41 1 35 ASN 2.90 3.64 1 36 PHE 3.49 3.84 1 37 ARG 5.54 4.52 1 38 ALA 2.67 1.98 1 39 LEU 3.39 2.17 1 40 SER 5.35 4.62 1 41 THR 0.86 0.72 1 44 LYS 0.83 -1.79 1 46 PHE -3.68 -3.62 1 48 TYR -0.64 -0.61 1 49 LYS 6.61 4.99 1 51 SER 0.93 0.91 1 53 PHE 0.44 0.37 1 54 HIS -0.18 2.32 1 55 ARG -4.07 -1.09 1 56 ILE -2.30 0.57 1 57 ILE -2.36 -0.82 1 60 PHE -1.07 -0.83 1 61 MET -2.31 -0.34 1 63 GLN -2.13 -1.00 1 66 ASP -0.44 -2.61 1 67 PHE -1.93 -2.02 1 68 THR 0.92 0.04 1 69 ARG -1.56 -0.73 1 70 HIS 2.60 2.19 1 71 ASN -0.81 -0.67 1 73 THR -0.34 0.54 1 76 LYS -1.67 -0.12 1 78 ILE 3.94 2.57 1 79 TYR -2.10 -1.99 1 81 GLU 4.18 4.21 1 82 LYS -6.09 -2.44 1 83 PHE -3.35 -1.69 1 84 GLU 0.46 -0.11 1 85 ASP 0.41 0.29 1 86 GLU 1.77 3.75 1 87 ASN -0.86 -0.27 1 88 PHE -1.13 -1.85 1 89 ILE 3.64 3.94 1 90 LEU -0.56 -0.90 1 91 LYS -3.11 -1.51 1 92 HIS 4.94 2.00 1 93 THR 3.90 3.52 1 97 ILE -0.78 -1.72 1 98 LEU -3.03 -1.73 1 99 SER -4.94 -3.29 1 101 ALA -1.28 -0.76 1 102 ASN -0.59 1.09 1 103 ALA -2.29 -2.12 1 106 ASN 3.00 1.22 1 107 THR -0.69 -1.46 1 108 ASN 2.28 2.42 1 110 SER -3.15 -0.77 1 111 GLN 0.30 2.46 1 112 PHE -5.85 -2.15 1 113 PHE -6.34 -3.11 1 114 ILE -2.35 -0.83 1 116 THR 2.11 -0.96 1 117 ALA -5.54 -1.85 1 118 LYS 2.10 1.71 1 119 THR -3.54 -4.62 1 120 GLU 3.48 2.79 1 121 TRP 4.90 2.25 1 122 LEU 2.78 -0.56 1 123 ASP 3.27 1.69 1 125 LYS -2.24 0.16 1 126 HIS -2.77 -0.08 1 127 VAL 1.04 1.69 1 128 VAL 2.18 0.89 1 129 PHE -4.71 -1.73 1 131 LYS -4.28 -1.30 1 132 VAL 2.06 1.87 1 133 LYS -0.15 0.78 1 134 GLU -4.44 -1.37 1 136 MET 4.12 1.43 1 137 ASN 5.22 2.38 1 138 ILE 4.72 0.40 1 139 VAL 5.63 3.93 1 140 GLU 2.40 2.70 1 141 ALA 3.17 2.27 1 142 MET 3.72 4.32 1 143 GLU 2.17 2.74 1 144 ARG 3.10 1.72 1 145 PHE 0.62 0.02 1 147 SER -2.14 -0.14 1 148 ARG 4.81 3.81 1 149 ASN -0.38 -0.80 1 151 LYS 1.55 0.89 1 152 THR -3.22 -1.70 1 153 SER -0.53 -0.34 1 154 LYS -7.03 -1.62 1 155 LYS 1.18 0.22 1 156 ILE -0.06 -1.69 1 157 THR -5.18 -2.26 1 158 ILE 1.86 -0.11 1 159 ALA 2.08 1.78 1 160 ASP -3.85 -1.33 1 163 GLN -2.28 -0.91 1 164 LEU -1.36 -0.31 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27265_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 4.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 6.83 _LACS_plot.Line_2_terminator_val_y_2 -1.78 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 SER -6.92 5.70 0 25 PHE 0.50 -3.50 0 10 ILE -2.03 -1.03 1 11 ALA -5.26 3.71 1 12 VAL -2.09 0.40 1 13 ASP 2.81 -1.19 1 15 GLU -2.54 1.27 1 17 LEU -1.95 1.85 1 19 ARG -3.54 2.69 1 20 VAL -4.25 2.13 1 21 SER -5.74 2.84 1 22 PHE -4.90 3.08 1 23 GLU -3.64 2.16 1 24 LEU -3.85 0.82 1 26 ALA 2.02 -0.10 1 27 ASP 3.49 -2.28 1 28 LYS -2.83 2.91 1 29 VAL -0.93 -0.52 1 31 LYS 4.97 -0.63 1 32 THR 6.83 -1.10 1 33 ALA 4.17 -0.68 1 34 GLU 3.23 -1.82 1 35 ASN 2.90 0.74 1 36 PHE 3.49 0.35 1 37 ARG 5.54 -1.02 1 38 ALA 2.67 -0.69 1 39 LEU 3.39 -1.22 1 40 SER 5.35 -0.73 1 41 THR 0.86 -0.14 1 44 LYS 0.83 -2.62 1 46 PHE -3.68 0.06 1 48 TYR -0.64 0.03 1 49 LYS 6.61 -1.62 1 51 SER 0.93 -0.02 1 53 PHE 0.44 -0.07 1 54 HIS -0.18 2.50 1 55 ARG -4.07 2.98 1 56 ILE -2.30 2.87 1 57 ILE -2.36 1.54 1 60 PHE -1.07 0.24 1 61 MET -2.31 1.97 1 63 GLN -2.13 1.13 1 66 ASP -0.44 -2.17 1 67 PHE -1.93 -0.09 1 68 THR 0.92 -0.88 1 69 ARG -1.56 0.83 1 70 HIS 2.60 -0.41 1 71 ASN -0.81 0.14 1 73 THR -0.34 0.88 1 76 LYS -1.67 1.55 1 78 ILE 3.94 -1.37 1 79 TYR -2.10 0.11 1 81 GLU 4.18 0.03 1 82 LYS -6.09 3.65 1 83 PHE -3.35 1.66 1 84 GLU 0.46 -0.57 1 85 ASP 0.41 -0.12 1 86 GLU 1.77 1.98 1 87 ASN -0.86 0.59 1 88 PHE -1.13 -0.72 1 89 ILE 3.64 0.30 1 90 LEU -0.56 -0.34 1 91 LYS -3.11 1.60 1 92 HIS 4.94 -2.94 1 93 THR 3.90 -0.38 1 97 ILE -0.78 -0.94 1 98 LEU -3.03 1.30 1 99 SER -4.94 1.65 1 101 ALA -1.28 0.52 1 102 ASN -0.59 1.68 1 103 ALA -2.29 0.17 1 106 ASN 3.00 -1.78 1 107 THR -0.69 -0.77 1 108 ASN 2.28 0.14 1 110 SER -3.15 2.38 1 111 GLN 0.30 2.16 1 112 PHE -5.85 3.70 1 113 PHE -6.34 3.23 1 114 ILE -2.35 1.52 1 116 THR 2.11 -3.07 1 117 ALA -5.54 3.69 1 118 LYS 2.10 -0.39 1 119 THR -3.54 -1.08 1 120 GLU 3.48 -0.69 1 121 TRP 4.90 -2.65 1 122 LEU 2.78 -3.34 1 123 ASP 3.27 -1.58 1 125 LYS -2.24 2.40 1 126 HIS -2.77 2.69 1 127 VAL 1.04 0.65 1 128 VAL 2.18 -1.29 1 129 PHE -4.71 2.98 1 131 LYS -4.28 2.98 1 132 VAL 2.06 -0.19 1 133 LYS -0.15 0.93 1 134 GLU -4.44 3.07 1 136 MET 4.12 -2.69 1 137 ASN 5.22 -2.84 1 138 ILE 4.72 -4.32 1 139 VAL 5.63 -1.70 1 140 GLU 2.40 0.30 1 141 ALA 3.17 -0.90 1 142 MET 3.72 0.60 1 143 GLU 2.17 0.57 1 144 ARG 3.10 -1.38 1 145 PHE 0.62 -0.60 1 147 SER -2.14 2.00 1 148 ARG 4.81 -1.00 1 149 ASN -0.38 -0.42 1 151 LYS 1.55 -0.66 1 152 THR -3.22 1.52 1 153 SER -0.53 0.19 1 154 LYS -7.03 5.41 1 155 LYS 1.18 -0.96 1 156 ILE -0.06 -1.63 1 157 THR -5.18 2.92 1 158 ILE 1.86 -1.97 1 159 ALA 2.08 -0.30 1 160 ASP -3.85 2.52 1 163 GLN -2.28 1.37 1 164 LEU -1.36 1.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27265_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 0.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.35 _LACS_plot.Line_2_terminator_val_x_2 6.83 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _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 119 THR -3.54 -0.67 0 10 ILE -2.03 1.05 1 11 ALA -5.26 0.90 1 12 VAL -2.09 0.44 1 13 ASP 2.81 -0.27 1 15 GLU -2.54 0.26 1 17 LEU -1.95 0.39 1 19 ARG -3.54 1.34 1 20 VAL -4.25 0.53 1 21 SER -5.74 1.10 1 22 PHE -4.90 0.66 1 23 GLU -3.64 0.45 1 24 LEU -3.85 0.41 1 25 PHE 0.50 0.55 1 26 ALA 2.02 -0.50 1 27 ASP 3.49 -0.44 1 28 LYS -2.83 0.31 1 29 VAL -0.93 0.08 1 31 LYS 4.97 -0.26 1 32 THR 6.83 -0.31 1 33 ALA 4.17 -0.23 1 34 GLU 3.23 0.21 1 35 ASN 2.90 -0.64 1 36 PHE 3.49 -0.43 1 37 ARG 5.54 -0.65 1 38 ALA 2.67 -0.19 1 39 LEU 3.39 -0.54 1 40 SER 5.35 -0.13 1 41 THR 0.86 0.14 1 44 LYS 0.83 0.02 1 46 PHE -3.68 0.06 1 48 TYR -0.64 -0.28 1 49 LYS 6.61 -0.67 1 51 SER 0.93 0.04 1 53 PHE 0.44 0.26 1 54 HIS -0.18 0.03 1 55 ARG -4.07 0.78 1 56 ILE -2.30 0.47 1 57 ILE -2.36 0.79 1 60 PHE -1.07 0.53 1 61 MET -2.31 0.89 1 63 GLN -2.13 1.08 1 66 ASP -0.44 -0.30 1 67 PHE -1.93 0.04 1 68 THR 0.92 0.34 1 69 ARG -1.56 0.08 1 70 HIS 2.60 -0.28 1 71 ASN -0.81 -0.09 1 73 THR -0.34 0.19 1 76 LYS -1.67 0.34 1 77 SER -6.92 0.77 1 78 ILE 3.94 0.04 1 79 TYR -2.10 0.18 1 81 GLU 4.18 -0.37 1 82 LYS -6.09 1.29 1 83 PHE -3.35 0.37 1 84 GLU 0.46 -0.50 1 85 ASP 0.41 -0.35 1 86 GLU 1.77 -0.50 1 87 ASN -0.86 -0.56 1 88 PHE -1.13 1.34 1 89 ILE 3.64 -0.46 1 90 LEU -0.56 0.18 1 91 LYS -3.11 0.31 1 92 HIS 4.94 -0.33 1 93 THR 3.90 -0.55 1 97 ILE -0.78 0.00 1 98 LEU -3.03 0.70 1 99 SER -4.94 0.88 1 101 ALA -1.28 0.04 1 102 ASN -0.59 -0.10 1 103 ALA -2.29 0.55 1 106 ASN 3.00 -0.69 1 107 THR -0.69 0.15 1 108 ASN 2.28 -0.46 1 110 SER -3.15 0.28 1 111 GLN 0.30 -0.12 1 112 PHE -5.85 1.15 1 113 PHE -6.34 1.10 1 114 ILE -2.35 0.67 1 116 THR 2.11 0.03 1 117 ALA -5.54 0.09 1 118 LYS 2.10 -0.49 1 120 GLU 3.48 -0.19 1 121 TRP 4.90 0.06 1 122 LEU 2.78 -0.02 1 123 ASP 3.27 0.58 1 125 LYS -2.24 -0.16 1 126 HIS -2.77 0.13 1 127 VAL 1.04 0.19 1 128 VAL 2.18 0.08 1 129 PHE -4.71 0.69 1 131 LYS -4.28 0.94 1 132 VAL 2.06 -0.18 1 133 LYS -0.15 0.16 1 134 GLU -4.44 0.29 1 136 MET 4.12 0.02 1 137 ASN 5.22 -0.22 1 138 ILE 4.72 -0.36 1 139 VAL 5.63 -0.22 1 140 GLU 2.40 -0.25 1 141 ALA 3.17 -0.20 1 142 MET 3.72 -0.49 1 143 GLU 2.17 -0.58 1 144 ARG 3.10 -0.37 1 145 PHE 0.62 0.23 1 147 SER -2.14 0.34 1 148 ARG 4.81 -0.12 1 149 ASN -0.38 0.16 1 151 LYS 1.55 0.15 1 152 THR -3.22 1.24 1 153 SER -0.53 0.15 1 154 LYS -7.03 0.27 1 155 LYS 1.18 0.04 1 156 ILE -0.06 0.98 1 157 THR -5.18 0.98 1 158 ILE 1.86 0.12 1 159 ALA 2.08 -0.15 1 160 ASP -3.85 0.30 1 163 GLN -2.28 0.81 1 164 LEU -1.36 0.33 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27265_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 -1.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 6.83 _LACS_plot.Line_2_terminator_val_y_2 3.01 _LACS_plot.Y_axis_chem_shift_offset -0.78 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 LEU 2.78 -4.30 0 10 ILE -2.03 0.63 1 11 ALA -5.26 -1.87 1 12 VAL -2.09 1.05 1 13 ASP 2.81 0.49 1 17 LEU -1.95 -0.63 1 19 ARG -3.54 -0.29 1 20 VAL -4.25 -1.46 1 21 SER -5.74 0.09 1 22 PHE -4.90 0.39 1 23 GLU -3.64 -0.93 1 24 LEU -3.85 0.63 1 25 PHE 0.50 1.69 1 26 ALA 2.02 -0.51 1 27 ASP 3.49 1.68 1 28 LYS -2.83 1.24 1 31 LYS 4.97 6.15 1 32 THR 6.83 3.97 1 33 ALA 4.17 1.37 1 34 GLU 3.23 1.82 1 35 ASN 2.90 0.37 1 36 PHE 3.49 3.91 1 37 ARG 5.54 2.70 1 38 ALA 2.67 5.57 1 39 LEU 3.39 2.88 1 40 SER 5.35 0.78 1 41 THR 0.86 4.39 1 44 LYS 0.83 0.99 1 46 PHE -3.68 -2.12 1 48 TYR -0.64 3.02 1 49 LYS 6.61 1.79 1 51 SER 0.93 -1.79 1 53 PHE 0.44 0.09 1 54 HIS -0.18 2.31 1 55 ARG -4.07 -1.79 1 56 ILE -2.30 -1.77 1 60 PHE -1.07 -1.40 1 61 MET -2.31 -1.14 1 63 GLN -2.13 -0.98 1 66 ASP -0.44 0.80 1 67 PHE -1.93 -0.56 1 68 THR 0.92 1.81 1 70 HIS 2.60 1.21 1 71 ASN -0.81 1.55 1 73 THR -0.34 2.21 1 76 LYS -1.67 -3.09 1 77 SER -6.92 2.15 1 78 ILE 3.94 0.57 1 79 TYR -2.10 0.42 1 81 GLU 4.18 0.13 1 82 LYS -6.09 -0.10 1 83 PHE -3.35 -1.30 1 84 GLU 0.46 0.65 1 85 ASP 0.41 0.80 1 86 GLU 1.77 0.67 1 87 ASN -0.86 -3.45 1 88 PHE -1.13 2.89 1 89 ILE 3.64 2.20 1 90 LEU -0.56 -0.26 1 91 LYS -3.11 0.70 1 92 HIS 4.94 4.69 1 93 THR 3.90 3.26 1 97 ILE -0.78 -2.20 1 98 LEU -3.03 -2.28 1 99 SER -4.94 1.13 1 101 ALA -1.28 -1.33 1 102 ASN -0.59 -0.46 1 103 ALA -2.29 0.02 1 106 ASN 3.00 0.66 1 107 THR -0.69 0.01 1 108 ASN 2.28 -0.12 1 110 SER -3.15 2.47 1 111 GLN 0.30 3.17 1 112 PHE -5.85 -2.96 1 113 PHE -6.34 -0.45 1 114 ILE -2.35 2.01 1 116 THR 2.11 3.80 1 117 ALA -5.54 -1.69 1 118 LYS 2.10 0.61 1 119 THR -3.54 3.23 1 120 GLU 3.48 1.59 1 121 TRP 4.90 1.14 1 123 ASP 3.27 2.98 1 125 LYS -2.24 -0.25 1 126 HIS -2.77 0.68 1 127 VAL 1.04 0.14 1 128 VAL 2.18 -0.19 1 129 PHE -4.71 -2.08 1 131 LYS -4.28 -0.49 1 132 VAL 2.06 0.19 1 133 LYS -0.15 -0.32 1 134 GLU -4.44 -0.67 1 136 MET 4.12 2.35 1 137 ASN 5.22 3.24 1 138 ILE 4.72 2.19 1 139 VAL 5.63 2.75 1 140 GLU 2.40 3.89 1 141 ALA 3.17 3.72 1 142 MET 3.72 2.56 1 143 GLU 2.17 2.45 1 144 ARG 3.10 1.92 1 145 PHE 0.62 1.07 1 147 SER -2.14 1.78 1 148 ARG 4.81 1.41 1 149 ASN -0.38 2.51 1 151 LYS 1.55 2.93 1 152 THR -3.22 2.27 1 153 SER -0.53 1.14 1 154 LYS -7.03 -1.16 1 155 LYS 1.18 0.35 1 156 ILE -0.06 1.05 1 157 THR -5.18 -0.13 1 158 ILE 1.86 -0.77 1 159 ALA 2.08 1.69 1 160 ASP -3.85 -2.38 1 163 GLN -2.28 0.55 1 164 LEU -1.36 -0.49 1 stop_ save_