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 bmr4417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 -2.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 5.66 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ILE 3.00 -1.50 0 79 PHE 2.00 -2.50 0 10 THR -1.90 -0.60 1 11 SER -4.00 -2.30 1 12 VAL 0.70 -0.40 1 13 ILE -1.10 -3.50 1 15 ALA 3.30 3.30 1 16 ALA 3.50 2.70 1 17 ARG 3.20 3.00 1 18 LEU 3.50 2.40 1 19 PHE 4.80 4.70 1 20 LYS 3.70 3.90 1 21 ALA -0.70 1.70 1 22 PHE 0.30 2.20 1 24 LEU 5.10 2.30 1 25 ASP -4.00 -1.60 1 27 ASP 4.10 2.80 1 28 ASN -0.20 0.90 1 29 LEU 0.80 1.90 1 30 PHE 8.20 4.40 1 32 LYS 1.40 1.90 1 33 VAL -0.40 -1.10 1 34 ALA -0.80 -0.20 1 36 GLN 3.20 0.50 1 37 ALA -2.50 0.00 1 38 ILE -4.10 -2.20 1 39 SER -0.50 -0.40 1 40 SER -1.50 -0.30 1 41 VAL -1.30 0.30 1 42 GLU -6.70 -2.50 1 43 ASN 1.20 0.50 1 44 ILE 1.80 0.80 1 45 GLU -3.70 -0.40 1 47 ASN -1.30 -0.60 1 52 THR 2.80 2.70 1 53 ILE -2.60 -1.90 1 54 LYS -5.00 -2.30 1 55 LYS -4.10 -1.30 1 56 ILE -0.10 -0.10 1 57 SER -0.90 -0.20 1 58 PHE -0.20 0.40 1 60 GLU 1.70 1.50 1 62 PHE 1.10 1.60 1 64 PHE -5.90 -4.80 1 65 LYS 1.50 2.00 1 66 TYR -2.90 -1.20 1 67 VAL -4.90 -1.20 1 68 LYS -3.70 -1.00 1 70 ARG -5.80 -2.90 1 71 VAL 3.00 2.30 1 72 ASP 0.20 2.00 1 73 GLU -3.70 0.50 1 74 VAL -0.90 0.40 1 75 ASP -3.20 -1.90 1 76 HIS 2.60 5.00 1 77 THR 4.10 3.10 1 78 ASN -1.10 -0.70 1 80 LYS -5.20 -0.50 1 81 TYR -7.30 -2.40 1 82 ASN -3.00 -1.00 1 83 TYR -3.20 -1.40 1 84 SER -3.40 -1.00 1 85 VAL 1.00 0.30 1 86 ILE -2.30 -0.20 1 87 GLU -4.70 0.10 1 91 ILE 4.10 -0.30 1 93 ASP 2.70 2.30 1 94 THR -0.10 0.20 1 95 LEU -2.20 -0.40 1 96 GLU -0.60 1.40 1 97 LYS -1.60 0.00 1 98 ILE -3.30 -0.70 1 99 SER -0.60 -0.20 1 100 ASN -4.40 -0.70 1 101 GLU -5.50 -1.00 1 102 ILE -2.50 -0.30 1 103 LYS -4.50 -1.20 1 104 ILE 0.10 0.10 1 105 VAL -3.70 -1.80 1 106 ALA -1.20 0.10 1 107 THR 0.60 -0.90 1 109 ASP 0.30 -0.40 1 112 SER -3.20 0.50 1 113 ILE -3.90 -0.70 1 114 LEU -0.40 0.10 1 115 LYS -0.80 -0.80 1 116 ILE -2.30 -0.30 1 117 SER -2.50 -1.80 1 118 ASN -4.40 -0.70 1 119 LYS -1.40 -0.90 1 120 TYR -1.00 0.50 1 121 HIS -0.50 0.00 1 122 THR -2.90 -1.70 1 123 LYS -0.90 -0.40 1 125 ASP -0.20 -0.70 1 126 HIS 1.10 3.50 1 127 GLU -3.50 -1.80 1 128 VAL -0.10 -0.70 1 129 LYS 0.40 -0.40 1 130 ALA 3.80 2.90 1 131 GLU 4.20 3.00 1 132 GLN 4.00 2.50 1 133 VAL 4.40 3.20 1 134 LYS 3.60 3.30 1 135 ALA 3.70 2.60 1 136 SER 4.20 3.40 1 137 LYS 3.70 3.20 1 138 GLU 3.40 2.80 1 139 LEU 4.10 3.10 1 141 GLU 3.60 3.10 1 142 THR 6.20 5.10 1 143 LEU 4.60 3.00 1 144 LEU 4.70 3.10 1 145 ARG 4.60 2.20 1 146 ALA 3.20 2.60 1 147 VAL 6.60 5.30 1 148 GLU 2.90 4.40 1 149 SER 5.50 4.00 1 150 TYR 4.40 4.40 1 151 LEU 3.50 2.30 1 152 LEU 2.50 2.00 1 153 ALA 0.30 0.30 1 154 HIS 0.60 -0.90 1 155 SER 4.00 3.30 1 156 ASP 0.30 -0.40 1 157 ALA -0.70 0.10 1 158 TYR 6.20 2.30 1 159 ASN -0.30 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 4.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.11 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 -2.54 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ILE 3.00 -4.50 0 79 PHE 2.00 -4.50 0 10 THR -1.90 1.30 1 11 SER -4.00 1.70 1 12 VAL 0.70 -1.10 1 13 ILE -1.10 -2.40 1 15 ALA 3.30 0.00 1 16 ALA 3.50 -0.80 1 17 ARG 3.20 -0.20 1 18 LEU 3.50 -1.10 1 19 PHE 4.80 -0.10 1 20 LYS 3.70 0.20 1 21 ALA -0.70 2.40 1 22 PHE 0.30 1.90 1 24 LEU 5.10 -2.80 1 25 ASP -4.00 2.40 1 27 ASP 4.10 -1.30 1 28 ASN -0.20 1.10 1 29 LEU 0.80 1.10 1 30 PHE 8.20 -3.80 1 32 LYS 1.40 0.50 1 33 VAL -0.40 -0.70 1 34 ALA -0.80 0.60 1 36 GLN 3.20 -2.70 1 37 ALA -2.50 2.50 1 38 ILE -4.10 1.90 1 39 SER -0.50 0.10 1 40 SER -1.50 1.20 1 41 VAL -1.30 1.60 1 42 GLU -6.70 4.20 1 43 ASN 1.20 -0.70 1 44 ILE 1.80 -1.00 1 45 GLU -3.70 3.30 1 47 ASN -1.30 0.70 1 52 THR 2.80 -0.10 1 53 ILE -2.60 0.70 1 54 LYS -5.00 2.70 1 55 LYS -4.10 2.80 1 56 ILE -0.10 0.00 1 57 SER -0.90 0.70 1 58 PHE -0.20 0.60 1 60 GLU 1.70 -0.20 1 62 PHE 1.10 0.50 1 64 PHE -5.90 1.10 1 65 LYS 1.50 0.50 1 66 TYR -2.90 1.70 1 67 VAL -4.90 3.70 1 68 LYS -3.70 2.70 1 70 ARG -5.80 2.90 1 71 VAL 3.00 -0.70 1 72 ASP 0.20 1.80 1 73 GLU -3.70 4.20 1 74 VAL -0.90 1.30 1 75 ASP -3.20 1.30 1 76 HIS 2.60 2.40 1 77 THR 4.10 -1.00 1 78 ASN -1.10 0.40 1 80 LYS -5.20 4.70 1 81 TYR -7.30 4.90 1 82 ASN -3.00 2.00 1 83 TYR -3.20 1.80 1 84 SER -3.40 2.40 1 85 VAL 1.00 -0.70 1 86 ILE -2.30 2.10 1 87 GLU -4.70 4.80 1 91 ILE 4.10 -4.40 1 93 ASP 2.70 -0.40 1 94 THR -0.10 0.30 1 95 LEU -2.20 1.80 1 96 GLU -0.60 2.00 1 97 LYS -1.60 1.60 1 98 ILE -3.30 2.60 1 99 SER -0.60 0.40 1 100 ASN -4.40 3.70 1 101 GLU -5.50 4.50 1 102 ILE -2.50 2.20 1 103 LYS -4.50 3.30 1 104 ILE 0.10 0.00 1 105 VAL -3.70 1.90 1 106 ALA -1.20 1.30 1 107 THR 0.60 -1.50 1 109 ASP 0.30 -0.70 1 112 SER -3.20 3.70 1 113 ILE -3.90 3.20 1 114 LEU -0.40 0.50 1 115 LYS -0.80 0.00 1 116 ILE -2.30 2.00 1 117 SER -2.50 0.70 1 118 ASN -4.40 3.70 1 119 LYS -1.40 0.50 1 120 TYR -1.00 1.50 1 121 HIS -0.50 0.50 1 122 THR -2.90 1.20 1 123 LYS -0.90 0.50 1 125 ASP -0.20 -0.50 1 126 HIS 1.10 2.40 1 127 GLU -3.50 1.70 1 128 VAL -0.10 -0.60 1 129 LYS 0.40 -0.80 1 130 ALA 3.80 -0.90 1 131 GLU 4.20 -1.20 1 132 GLN 4.00 -1.50 1 133 VAL 4.40 -1.20 1 134 LYS 3.60 -0.30 1 135 ALA 3.70 -1.10 1 136 SER 4.20 -0.80 1 137 LYS 3.70 -0.50 1 138 GLU 3.40 -0.60 1 139 LEU 4.10 -1.00 1 141 GLU 3.60 -0.50 1 142 THR 6.20 -1.10 1 143 LEU 4.60 -1.60 1 144 LEU 4.70 -1.60 1 145 ARG 4.60 -2.40 1 146 ALA 3.20 -0.60 1 147 VAL 6.60 -1.30 1 148 GLU 2.90 1.50 1 149 SER 5.50 -1.50 1 150 TYR 4.40 0.00 1 151 LEU 3.50 -1.20 1 152 LEU 2.50 -0.50 1 153 ALA 0.30 0.00 1 154 HIS 0.60 -1.50 1 155 SER 4.00 -0.70 1 156 ASP 0.30 -0.70 1 157 ALA -0.70 0.80 1 158 TYR 6.20 -3.90 1 159 ASN -0.30 1.60 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 1.15 _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 0.44 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 -0.94 _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 79 PHE 2.00 -1.52 0 21 ALA -0.70 -1.19 0 10 THR -1.90 0.57 1 11 SER -4.00 0.52 1 12 VAL 0.70 0.25 1 13 ILE -1.10 -0.04 1 15 ALA 3.30 -0.59 1 16 ALA 3.50 -0.91 1 17 ARG 3.20 -0.21 1 18 LEU 3.50 -0.56 1 19 PHE 4.80 -0.85 1 20 LYS 3.70 -0.71 1 22 PHE 0.30 -0.86 1 23 ILE 3.00 -0.54 1 24 LEU 5.10 -0.63 1 25 ASP -4.00 0.76 1 27 ASP 4.10 -0.94 1 28 ASN -0.20 -0.29 1 29 LEU 0.80 -0.38 1 30 PHE 8.20 -0.39 1 32 LYS 1.40 -0.12 1 33 VAL -0.40 0.36 1 34 ALA -0.80 0.49 1 36 GLN 3.20 -0.05 1 37 ALA -2.50 0.23 1 38 ILE -4.10 -0.05 1 39 SER -0.50 0.12 1 40 SER -1.50 -0.07 1 41 VAL -1.30 0.51 1 42 GLU -6.70 0.28 1 43 ASN 1.20 0.08 1 44 ILE 1.80 -0.02 1 45 GLU -3.70 0.19 1 47 ASN -1.30 0.19 1 52 THR 2.80 0.20 1 53 ILE -2.60 0.99 1 54 LYS -5.00 0.93 1 55 LYS -4.10 0.81 1 56 ILE -0.10 0.32 1 57 SER -0.90 0.54 1 58 PHE -0.20 -0.04 1 60 GLU 1.70 -0.22 1 62 PHE 1.10 -0.29 1 64 PHE -5.90 0.47 1 65 LYS 1.50 0.44 1 66 TYR -2.90 1.31 1 67 VAL -4.90 0.53 1 68 LYS -3.70 1.66 1 70 ARG -5.80 1.19 1 71 VAL 3.00 -0.46 1 72 ASP 0.20 0.42 1 73 GLU -3.70 0.21 1 74 VAL -0.90 0.59 1 75 ASP -3.20 0.53 1 76 HIS 2.60 -0.44 1 77 THR 4.10 -0.49 1 78 ASN -1.10 -0.40 1 80 LYS -5.20 1.34 1 81 TYR -7.30 0.96 1 82 ASN -3.00 1.14 1 83 TYR -3.20 0.74 1 84 SER -3.40 1.08 1 85 VAL 1.00 0.64 1 86 ILE -2.30 0.72 1 87 GLU -4.70 -0.10 1 91 ILE 4.10 -0.45 1 93 ASP 2.70 -0.24 1 94 THR -0.10 -0.09 1 95 LEU -2.20 0.46 1 96 GLU -0.60 -0.01 1 97 LYS -1.60 0.36 1 98 ILE -3.30 0.81 1 99 SER -0.60 0.45 1 100 ASN -4.40 1.08 1 101 GLU -5.50 0.93 1 102 ILE -2.50 0.88 1 103 LYS -4.50 1.19 1 104 ILE 0.10 0.89 1 105 VAL -3.70 0.28 1 106 ALA -1.20 0.44 1 107 THR 0.60 0.27 1 109 ASP 0.30 -0.06 1 112 SER -3.20 1.10 1 113 ILE -3.90 0.40 1 114 LEU -0.40 0.69 1 115 LYS -0.80 0.59 1 116 ILE -2.30 0.88 1 117 SER -2.50 0.91 1 118 ASN -4.40 0.76 1 119 LYS -1.40 0.97 1 120 TYR -1.00 -0.04 1 121 HIS -0.50 0.55 1 122 THR -2.90 0.76 1 123 LYS -0.90 0.18 1 126 HIS 1.10 -0.33 1 127 GLU -3.50 -0.09 1 128 VAL -0.10 -0.37 1 129 LYS 0.40 -0.07 1 130 ALA 3.80 -0.54 1 132 GLN 4.00 -0.21 1 133 VAL 4.40 -0.60 1 134 LYS 3.60 -0.17 1 135 ALA 3.70 -0.17 1 136 SER 4.20 -0.18 1 137 LYS 3.70 -0.15 1 138 GLU 3.40 -0.26 1 139 LEU 4.10 -0.13 1 141 GLU 3.60 -0.19 1 142 THR 6.20 -0.51 1 143 LEU 4.60 -0.54 1 144 LEU 4.70 -0.48 1 145 ARG 4.60 -0.19 1 146 ALA 3.20 0.04 1 147 VAL 6.60 -0.47 1 148 GLU 2.90 -0.64 1 149 SER 5.50 -0.30 1 150 TYR 4.40 -0.16 1 151 LEU 3.50 -0.31 1 152 LEU 2.50 -0.21 1 153 ALA 0.30 -0.12 1 154 HIS 0.60 0.00 1 155 SER 4.00 -0.28 1 156 ASP 0.30 -0.06 1 157 ALA -0.70 -0.12 1 158 TYR 6.20 -0.56 1 159 ASN -0.30 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 -2.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 2.26 _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 158 TYR 6.20 -2.60 0 10 THR -1.90 -1.10 1 11 SER -4.00 0.20 1 12 VAL 0.70 -0.30 1 15 ALA 3.30 0.30 1 16 ALA 3.50 2.10 1 17 ARG 3.20 1.00 1 18 LEU 3.50 1.30 1 19 PHE 4.80 1.60 1 20 LYS 3.70 0.00 1 21 ALA -0.70 -2.80 1 22 PHE 0.30 -1.50 1 23 ILE 3.00 1.70 1 24 LEU 5.10 1.00 1 25 ASP -4.00 1.30 1 27 ASP 4.10 0.40 1 28 ASN -0.20 1.50 1 29 LEU 0.80 1.70 1 32 LYS 1.40 2.10 1 33 VAL -0.40 0.40 1 36 GLN 3.20 -1.10 1 37 ALA -2.50 -3.50 1 38 ILE -4.10 -2.40 1 39 SER -0.50 0.70 1 40 SER -1.50 -2.80 1 41 VAL -1.30 -1.80 1 43 ASN 1.20 -0.10 1 44 ILE 1.80 -0.20 1 45 GLU -3.70 -1.30 1 47 ASN -1.30 0.70 1 52 THR 2.80 -1.60 1 53 ILE -2.60 -1.70 1 54 LYS -5.00 -2.40 1 55 LYS -4.10 -1.30 1 56 ILE -0.10 -1.60 1 57 SER -0.90 -1.70 1 60 GLU 1.70 0.70 1 64 PHE -5.90 -0.70 1 65 LYS 1.50 1.30 1 70 ARG -5.80 -0.10 1 71 VAL 3.00 -1.40 1 72 ASP 0.20 -0.20 1 73 GLU -3.70 -2.60 1 74 VAL -0.90 -2.50 1 76 HIS 2.60 2.40 1 77 THR 4.10 -0.30 1 78 ASN -1.10 -2.40 1 79 PHE 2.00 -2.70 1 80 LYS -5.20 -2.20 1 81 TYR -7.30 -3.50 1 82 ASN -3.00 -1.40 1 83 TYR -3.20 -2.90 1 84 SER -3.40 -1.70 1 85 VAL 1.00 1.10 1 86 ILE -2.30 -0.30 1 87 GLU -4.70 -2.70 1 91 ILE 4.10 0.40 1 93 ASP 2.70 0.00 1 94 THR -0.10 -0.40 1 96 GLU -0.60 -0.60 1 97 LYS -1.60 -2.80 1 98 ILE -3.30 -0.30 1 99 SER -0.60 -0.40 1 100 ASN -4.40 -0.30 1 101 GLU -5.50 -2.00 1 102 ILE -2.50 -1.70 1 103 LYS -4.50 -2.10 1 104 ILE 0.10 -1.50 1 105 VAL -3.70 -1.30 1 106 ALA -1.20 0.70 1 109 ASP 0.30 0.20 1 112 SER -3.20 -0.60 1 113 ILE -3.90 -2.10 1 114 LEU -0.40 -2.50 1 115 LYS -0.80 -0.90 1 116 ILE -2.30 -1.10 1 117 SER -2.50 -0.70 1 118 ASN -4.40 -2.20 1 119 LYS -1.40 -1.90 1 120 TYR -1.00 -1.20 1 121 HIS -0.50 1.40 1 122 THR -2.90 0.50 1 123 LYS -0.90 0.10 1 125 ASP -0.20 0.20 1 126 HIS 1.10 1.80 1 127 GLU -3.50 -0.40 1 128 VAL -0.10 -0.50 1 129 LYS 0.40 1.10 1 130 ALA 3.80 2.60 1 131 GLU 4.20 2.50 1 132 GLN 4.00 2.20 1 133 VAL 4.40 2.50 1 134 LYS 3.60 1.40 1 135 ALA 3.70 3.20 1 136 SER 4.20 2.70 1 137 LYS 3.70 3.10 1 138 GLU 3.40 2.70 1 139 LEU 4.10 0.80 1 141 GLU 3.60 1.50 1 142 THR 6.20 2.90 1 143 LEU 4.60 0.80 1 144 LEU 4.70 1.20 1 145 ARG 4.60 3.30 1 146 ALA 3.20 3.30 1 147 VAL 6.60 0.90 1 148 GLU 2.90 0.90 1 149 SER 5.50 2.70 1 150 TYR 4.40 2.50 1 151 LEU 3.50 2.30 1 152 LEU 2.50 0.90 1 153 ALA 0.30 -0.80 1 154 HIS 0.60 1.10 1 155 SER 4.00 -0.60 1 156 ASP 0.30 -0.10 1 157 ALA -0.70 0.00 1 stop_ save_