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 bmr5570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 -2.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.35 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 5.43 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 ILE -5.30 -7.20 0 10 ASP 1.00 1.30 1 11 LEU -5.10 -2.20 1 12 VAL -7.50 -4.20 1 13 ASN -3.00 -2.80 1 14 GLU 3.80 2.40 1 15 ARG -0.40 -0.90 1 16 ASP 1.90 0.50 1 18 VAL 3.30 2.10 1 19 VAL -2.10 -1.70 1 21 GLN -5.00 -0.10 1 22 ILE -6.00 -1.20 1 23 LEU 0.50 0.60 1 24 ARG 3.10 2.50 1 25 THR 1.30 0.70 1 28 ALA -0.10 -0.60 1 29 LEU 3.30 2.90 1 30 ARG -3.00 -2.20 1 31 TRP 5.00 3.40 1 32 GLU 4.30 1.40 1 33 ARG -1.40 -0.90 1 34 VAL -5.90 -2.80 1 35 ARG -4.40 -1.20 1 36 VAL -5.40 -2.70 1 37 VAL -5.80 -2.80 1 38 ASN -8.10 -0.70 1 39 ALA -7.60 -2.00 1 40 PHE -5.00 -1.10 1 41 LEU -2.80 -0.80 1 42 ARG -5.70 -1.40 1 43 ASN -2.50 -1.80 1 44 SER 3.70 2.80 1 45 GLN -0.10 -0.10 1 47 GLN -1.90 -0.50 1 48 LEU -5.20 -3.20 1 49 TRP 4.90 1.90 1 53 ARG 0.60 0.60 1 54 SER 0.40 0.30 1 56 SER 0.20 0.20 1 62 ASN 1.70 1.60 1 63 ALA -3.90 -1.30 1 64 LEU 0.40 0.50 1 65 ASP -7.50 -2.30 1 66 VAL 0.20 -1.30 1 68 VAL -3.00 -1.70 1 71 ALA 0.10 0.20 1 72 VAL 0.80 0.20 1 73 GLN 0.90 0.40 1 74 SER 2.10 1.20 1 76 GLU -2.90 -0.50 1 77 THR -3.60 -1.80 1 78 TYR 5.70 5.50 1 79 GLU 3.40 3.90 1 80 GLU 2.40 2.80 1 81 ALA 1.40 3.10 1 82 PHE 1.80 0.80 1 83 ARG 4.50 4.00 1 84 ARG 5.50 4.00 1 85 GLU 3.40 2.40 1 86 ALA 5.40 3.60 1 87 ARG 4.50 3.90 1 88 GLU 2.40 2.90 1 89 GLU 0.90 1.40 1 90 LEU -3.30 -1.80 1 91 ASN 2.80 2.00 1 92 VAL -4.00 -1.70 1 93 GLU -2.40 -2.90 1 94 ILE 6.80 4.70 1 95 ASP 2.40 1.90 1 96 ALA -1.10 -0.60 1 97 LEU -6.00 -4.10 1 98 SER -0.10 -0.10 1 99 TRP -5.90 -2.30 1 100 ARG -1.00 -0.30 1 102 LEU -1.10 1.00 1 103 ALA -4.80 -0.60 1 104 SER -2.20 -1.20 1 105 PHE -7.30 -1.60 1 106 SER 1.10 1.60 1 108 PHE 2.70 0.80 1 109 GLN -2.50 -0.10 1 110 THR -4.10 -1.30 1 111 THR 1.70 -1.30 1 112 LEU -1.00 -0.40 1 113 SER 3.60 3.60 1 114 SER -7.60 -0.70 1 115 PHE 3.20 3.80 1 116 MET -5.10 -0.30 1 118 VAL -3.60 -2.70 1 119 TYR -5.60 -0.90 1 120 GLU -6.80 -1.50 1 121 LEU -5.20 -1.30 1 122 ARG -0.70 -1.70 1 123 SER -2.30 -0.80 1 124 ASP -0.90 -0.40 1 125 ALA 0.30 1.00 1 126 THR 1.50 1.70 1 128 ILE 2.60 -1.20 1 129 PHE -4.10 -2.70 1 130 ASN -0.80 -0.40 1 132 ASN 2.30 2.00 1 133 ASP -1.50 1.40 1 134 ILE -5.30 -0.60 1 135 SER -0.80 0.20 1 138 GLU -7.90 -2.30 1 139 TRP -0.70 -1.40 1 140 LEU -6.80 -1.40 1 141 THR 2.70 1.10 1 143 GLU 3.90 3.40 1 144 HIS 0.60 3.00 1 145 LEU 4.30 3.40 1 146 LEU 4.70 3.40 1 147 ALA 3.90 2.60 1 148 ARG 4.00 3.40 1 149 ILE 4.90 4.70 1 150 ALA 3.70 2.30 1 151 ALA 0.40 -0.10 1 153 GLU 0.50 0.90 1 154 ALA 0.30 0.30 1 155 ALA -5.70 -1.70 1 156 LYS 0.70 0.40 1 158 ASP 0.50 1.40 1 159 LEU 4.80 4.90 1 160 ALA 4.90 3.60 1 161 GLU 3.90 2.90 1 162 LEU 1.90 2.90 1 163 VAL 7.00 5.50 1 164 ARG 5.00 4.50 1 165 ARG 3.00 3.90 1 167 TYR 0.80 1.60 1 168 ARG -0.40 -0.40 1 169 GLU 0.00 0.50 1 170 GLU -1.00 0.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 5.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.65 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 ILE -5.30 -1.90 0 10 ASP 1.00 0.30 1 11 LEU -5.10 2.90 1 12 VAL -7.50 3.30 1 13 ASN -3.00 0.20 1 14 GLU 3.80 -1.40 1 15 ARG -0.40 -0.50 1 16 ASP 1.90 -1.40 1 18 VAL 3.30 -1.20 1 19 VAL -2.10 0.40 1 21 GLN -5.00 4.90 1 22 ILE -6.00 4.80 1 23 LEU 0.50 0.10 1 24 ARG 3.10 -0.60 1 25 THR 1.30 -0.60 1 28 ALA -0.10 -0.50 1 29 LEU 3.30 -0.40 1 30 ARG -3.00 0.80 1 31 TRP 5.00 -1.60 1 32 GLU 4.30 -2.90 1 33 ARG -1.40 0.50 1 34 VAL -5.90 3.10 1 35 ARG -4.40 3.20 1 36 VAL -5.40 2.70 1 37 VAL -5.80 3.00 1 38 ASN -8.10 7.40 1 39 ALA -7.60 5.60 1 40 PHE -5.00 3.90 1 41 LEU -2.80 2.00 1 42 ARG -5.70 4.30 1 43 ASN -2.50 0.70 1 44 SER 3.70 -0.90 1 45 GLN -0.10 0.00 1 47 GLN -1.90 1.40 1 48 LEU -5.20 2.00 1 49 TRP 4.90 -3.00 1 53 ARG 0.60 0.00 1 54 SER 0.40 -0.10 1 56 SER 0.20 0.00 1 62 ASN 1.70 -0.10 1 63 ALA -3.90 2.60 1 64 LEU 0.40 0.10 1 65 ASP -7.50 5.20 1 66 VAL 0.20 -1.50 1 68 VAL -3.00 1.30 1 71 ALA 0.10 0.10 1 72 VAL 0.80 -0.60 1 73 GLN 0.90 -0.50 1 74 SER 2.10 -0.90 1 76 GLU -2.90 2.40 1 77 THR -3.60 1.80 1 78 TYR 5.70 -0.20 1 79 GLU 3.40 0.50 1 80 GLU 2.40 0.40 1 81 ALA 1.40 1.70 1 82 PHE 1.80 -1.00 1 83 ARG 4.50 -0.50 1 84 ARG 5.50 -1.50 1 85 GLU 3.40 -1.00 1 86 ALA 5.40 -1.80 1 87 ARG 4.50 -0.60 1 88 GLU 2.40 0.50 1 89 GLU 0.90 0.50 1 90 LEU -3.30 1.50 1 91 ASN 2.80 -0.80 1 92 VAL -4.00 2.30 1 93 GLU -2.40 -0.50 1 94 ILE 6.80 -2.10 1 95 ASP 2.40 -0.50 1 96 ALA -1.10 0.50 1 97 LEU -6.00 1.90 1 98 SER -0.10 0.00 1 99 TRP -5.90 3.60 1 100 ARG -1.00 0.70 1 102 LEU -1.10 2.10 1 103 ALA -4.80 4.20 1 104 SER -2.20 1.00 1 105 PHE -7.30 5.70 1 106 SER 1.10 0.50 1 108 PHE 2.70 -1.90 1 109 GLN -2.50 2.40 1 110 THR -4.10 2.80 1 111 THR 1.70 -3.00 1 112 LEU -1.00 0.60 1 113 SER 3.60 0.00 1 114 SER -7.60 6.90 1 115 PHE 3.20 0.60 1 116 MET -5.10 4.80 1 118 VAL -3.60 0.90 1 119 TYR -5.60 4.70 1 120 GLU -6.80 5.30 1 121 LEU -5.20 3.90 1 122 ARG -0.70 -1.00 1 123 SER -2.30 1.50 1 124 ASP -0.90 0.50 1 125 ALA 0.30 0.70 1 126 THR 1.50 0.20 1 128 ILE 2.60 -3.80 1 129 PHE -4.10 1.40 1 130 ASN -0.80 0.40 1 132 ASN 2.30 -0.30 1 133 ASP -1.50 2.90 1 134 ILE -5.30 4.70 1 135 SER -0.80 1.00 1 138 GLU -7.90 5.60 1 139 TRP -0.70 -0.70 1 140 LEU -6.80 5.40 1 141 THR 2.70 -1.60 1 143 GLU 3.90 -0.50 1 144 HIS 0.60 2.40 1 145 LEU 4.30 -0.90 1 146 LEU 4.70 -1.30 1 147 ALA 3.90 -1.30 1 148 ARG 4.00 -0.60 1 149 ILE 4.90 -0.20 1 150 ALA 3.70 -1.40 1 151 ALA 0.40 -0.50 1 153 GLU 0.50 0.40 1 154 ALA 0.30 0.00 1 155 ALA -5.70 4.00 1 156 LYS 0.70 -0.30 1 158 ASP 0.50 0.90 1 159 LEU 4.80 0.10 1 160 ALA 4.90 -1.30 1 161 GLU 3.90 -1.00 1 162 LEU 1.90 1.00 1 163 VAL 7.00 -1.50 1 164 ARG 5.00 -0.50 1 165 ARG 3.00 0.90 1 167 TYR 0.80 0.80 1 168 ARG -0.40 0.00 1 169 GLU 0.00 0.50 1 170 GLU -1.00 1.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 0.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 116 MET -5.10 1.87 0 10 ASP 1.00 0.58 1 11 LEU -5.10 0.75 1 12 VAL -7.50 1.41 1 13 ASN -3.00 0.09 1 14 GLU 3.80 0.06 1 15 ARG -0.40 0.20 1 16 ASP 1.90 -0.99 1 18 VAL 3.30 0.09 1 19 VAL -2.10 0.52 1 21 GLN -5.00 1.13 1 22 ILE -6.00 0.44 1 23 LEU 0.50 0.38 1 24 ARG 3.10 -0.51 1 25 THR 1.30 -0.42 1 28 ALA -0.10 -0.01 1 29 LEU 3.30 -0.73 1 30 ARG -3.00 0.27 1 31 TRP 5.00 -0.53 1 32 GLU 4.30 0.25 1 33 ARG -1.40 0.27 1 34 VAL -5.90 1.06 1 35 ARG -4.40 1.11 1 36 VAL -5.40 1.02 1 37 VAL -5.80 1.23 1 38 ASN -8.10 0.92 1 39 ALA -7.60 1.18 1 40 PHE -5.00 0.50 1 41 LEU -2.80 1.06 1 42 ARG -5.70 1.70 1 43 ASN -2.50 0.31 1 45 GLN -0.10 0.08 1 47 GLN -1.90 0.27 1 48 LEU -5.20 1.42 1 49 TRP 4.90 -0.67 1 50 ILE -5.30 0.52 1 53 ARG 0.60 0.01 1 54 SER 0.40 -0.25 1 56 SER 0.20 -0.11 1 62 ASN 1.70 -0.26 1 63 ALA -3.90 0.04 1 64 LEU 0.40 0.28 1 65 ASP -7.50 0.32 1 66 VAL 0.20 -0.34 1 68 VAL -3.00 0.24 1 71 ALA 0.10 0.51 1 72 VAL 0.80 -0.39 1 73 GLN 0.90 0.05 1 74 SER 2.10 -0.29 1 76 GLU -2.90 0.23 1 77 THR -3.60 0.26 1 78 TYR 5.70 -0.44 1 79 GLU 3.40 -0.58 1 80 GLU 2.40 -0.49 1 81 ALA 1.40 -0.15 1 82 PHE 1.80 -0.85 1 83 ARG 4.50 -0.58 1 84 ARG 5.50 -0.39 1 85 GLU 3.40 -0.16 1 86 ALA 5.40 -0.61 1 87 ARG 4.50 -0.27 1 88 GLU 2.40 -0.33 1 89 GLU 0.90 0.37 1 90 LEU -3.30 0.36 1 91 ASN 2.80 -0.08 1 92 VAL -4.00 0.19 1 93 GLU -2.40 -0.05 1 94 ILE 6.80 -0.59 1 95 ASP 2.40 0.14 1 96 ALA -1.10 0.23 1 97 LEU -6.00 0.53 1 98 SER -0.10 0.00 1 99 TRP -5.90 1.23 1 100 ARG -1.00 0.32 1 102 LEU -1.10 0.01 1 103 ALA -4.80 -0.21 1 104 SER -2.20 0.41 1 105 PHE -7.30 0.83 1 106 SER 1.10 -0.05 1 108 PHE 2.70 -1.13 1 109 GLN -2.50 0.36 1 110 THR -4.10 0.35 1 111 THR 1.70 0.46 1 112 LEU -1.00 -0.21 1 113 SER 3.60 -0.59 1 114 SER -7.60 0.74 1 115 PHE 3.20 0.05 1 118 VAL -3.60 1.30 1 119 TYR -5.60 0.55 1 120 GLU -6.80 1.42 1 121 LEU -5.20 0.94 1 122 ARG -0.70 1.20 1 123 SER -2.30 0.00 1 124 ASP -0.90 0.16 1 125 ALA 0.30 0.15 1 126 THR 1.50 -0.48 1 128 ILE 2.60 -0.40 1 129 PHE -4.10 0.16 1 130 ASN -0.80 -0.02 1 132 ASN 2.30 -0.18 1 133 ASP -1.50 0.24 1 134 ILE -5.30 0.35 1 135 SER -0.80 0.27 1 138 GLU -7.90 0.21 1 139 TRP -0.70 0.68 1 140 LEU -6.80 0.85 1 141 THR 2.70 0.03 1 143 GLU 3.90 -0.48 1 144 HIS 0.60 -0.21 1 145 LEU 4.30 -0.46 1 146 LEU 4.70 -0.44 1 147 ALA 3.90 -0.14 1 148 ARG 4.00 -0.35 1 149 ILE 4.90 -0.34 1 150 ALA 3.70 -0.18 1 151 ALA 0.40 0.06 1 153 GLU 0.50 -0.28 1 154 ALA 0.30 -0.12 1 155 ALA -5.70 0.59 1 158 ASP 0.50 0.02 1 159 LEU 4.80 -0.55 1 160 ALA 4.90 -0.66 1 161 GLU 3.90 -0.58 1 162 LEU 1.90 -0.44 1 163 VAL 7.00 -0.69 1 164 ARG 5.00 -0.51 1 165 ARG 3.00 -0.24 1 167 TYR 0.80 0.19 1 168 ARG -0.40 0.26 1 169 GLU 0.00 -0.08 1 170 GLU -1.00 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5570_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.82 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 2.04 _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 43 ASN -2.50 3.70 0 13 ASN -3.00 0.60 1 14 GLU 3.80 -0.30 1 16 ASP 1.90 -1.00 1 18 VAL 3.30 2.00 1 19 VAL -2.10 -0.60 1 21 GLN -5.00 -3.30 1 22 ILE -6.00 -3.80 1 23 LEU 0.50 1.10 1 24 ARG 3.10 -0.10 1 25 THR 1.30 1.40 1 28 ALA -0.10 -0.40 1 29 LEU 3.30 -1.80 1 30 ARG -3.00 0.20 1 31 TRP 5.00 1.30 1 32 GLU 4.30 -1.70 1 34 VAL -5.90 -2.90 1 35 ARG -4.40 0.90 1 37 VAL -5.80 -2.10 1 38 ASN -8.10 -1.50 1 39 ALA -7.60 -3.40 1 40 PHE -5.00 -1.50 1 41 LEU -2.80 -3.70 1 42 ARG -5.70 -0.50 1 45 GLN -0.10 -0.10 1 47 GLN -1.90 -1.90 1 48 LEU -5.20 -1.00 1 49 TRP 4.90 -1.80 1 53 ARG 0.60 -0.40 1 56 SER 0.20 0.50 1 62 ASN 1.70 -1.90 1 63 ALA -3.90 -1.10 1 64 LEU 0.40 -2.40 1 65 ASP -7.50 -1.90 1 66 VAL 0.20 -1.30 1 68 VAL -3.00 -3.60 1 71 ALA 0.10 -0.70 1 72 VAL 0.80 1.10 1 73 GLN 0.90 0.20 1 74 SER 2.10 2.50 1 76 GLU -2.90 1.20 1 77 THR -3.60 1.40 1 78 TYR 5.70 1.60 1 79 GLU 3.40 2.10 1 80 GLU 2.40 3.20 1 81 ALA 1.40 0.70 1 83 ARG 4.50 2.40 1 84 ARG 5.50 1.90 1 85 GLU 3.40 2.30 1 86 ALA 5.40 2.10 1 87 ARG 4.50 2.60 1 88 GLU 2.40 2.30 1 89 GLU 0.90 0.80 1 90 LEU -3.30 -3.00 1 91 ASN 2.80 -1.10 1 92 VAL -4.00 -1.80 1 93 GLU -2.40 0.80 1 94 ILE 6.80 0.20 1 95 ASP 2.40 0.30 1 96 ALA -1.10 -0.90 1 97 LEU -6.00 -2.30 1 98 SER -0.10 -1.30 1 99 TRP -5.90 -1.50 1 102 LEU -1.10 -0.60 1 103 ALA -4.80 -3.10 1 104 SER -2.20 -2.00 1 105 PHE -7.30 -1.70 1 108 PHE 2.70 0.10 1 109 GLN -2.50 -1.50 1 110 THR -4.10 -1.40 1 111 THR 1.70 0.10 1 112 LEU -1.00 1.60 1 113 SER 3.60 -0.10 1 114 SER -7.60 -0.80 1 115 PHE 3.20 1.40 1 116 MET -5.10 -1.00 1 118 VAL -3.60 -1.10 1 119 TYR -5.60 -2.50 1 120 GLU -6.80 -1.50 1 121 LEU -5.20 -2.90 1 122 ARG -0.70 -0.90 1 123 SER -2.30 -2.30 1 124 ASP -0.90 -0.10 1 125 ALA 0.30 -0.70 1 128 ILE 2.60 -2.60 1 132 ASN 2.30 0.40 1 133 ASP -1.50 -0.70 1 134 ILE -5.30 -2.90 1 135 SER -0.80 0.30 1 138 GLU -7.90 -3.20 1 139 TRP -0.70 0.20 1 143 GLU 3.90 2.60 1 144 HIS 0.60 4.10 1 145 LEU 4.30 0.60 1 146 LEU 4.70 2.20 1 148 ARG 4.00 2.90 1 150 ALA 3.70 0.80 1 151 ALA 0.40 0.10 1 153 GLU 0.50 -0.90 1 154 ALA 0.30 -0.60 1 155 ALA -5.70 -2.30 1 158 ASP 0.50 -0.50 1 159 LEU 4.80 -1.00 1 160 ALA 4.90 1.30 1 161 GLU 3.90 1.70 1 162 LEU 1.90 1.60 1 163 VAL 7.00 2.00 1 164 ARG 5.00 2.40 1 165 ARG 3.00 3.00 1 167 TYR 0.80 -0.30 1 168 ARG -0.40 -0.80 1 169 GLU 0.00 -0.30 1 stop_ save_