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 bmr17809_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -2.86 _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 -1.24 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 5.26 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 LEU -6.70 -1.20 0 10 GLU 2.00 -0.80 0 11 GLN -5.40 -1.10 1 12 GLU -0.90 0.10 1 13 ILE 5.70 5.20 1 14 GLU 6.10 4.60 1 15 ALA 3.00 2.30 1 16 VAL 6.70 5.40 1 17 TRP 4.50 3.40 1 18 TRP 5.10 3.70 1 19 ALA 1.70 2.10 1 20 TRP 2.10 1.60 1 21 ASN -2.70 0.40 1 22 ASP -2.60 -0.40 1 24 ASP 3.90 3.20 1 27 ALA 2.80 1.60 1 28 ARG 0.90 0.90 1 29 TRP -2.30 -0.70 1 31 ALA -2.50 -0.30 1 32 ALA 0.20 0.30 1 33 SER -2.30 -1.40 1 34 SER 2.40 1.80 1 35 ASP 0.60 0.30 1 36 TRP -3.60 -0.40 1 37 HIS -4.20 -0.80 1 38 THR 1.10 0.90 1 39 THR 0.80 -0.20 1 41 SER -1.40 0.20 1 42 ARG -2.80 -0.70 1 43 VAL -3.40 0.60 1 44 ASP -0.90 -1.50 1 45 LEU 0.60 -1.00 1 46 VAL -5.90 -2.90 1 47 VAL 6.90 4.80 1 50 ARG -4.30 -2.30 1 51 PHE -6.30 -3.10 1 53 HIS -5.10 -1.40 1 54 HIS 1.50 0.60 1 55 MET -1.30 -0.90 1 56 ALA -5.20 -1.20 1 57 ALA -1.40 -1.30 1 58 LYS 4.20 3.30 1 59 ASP 0.50 -0.90 1 61 SER 2.00 1.90 1 62 ALA -3.50 -0.40 1 64 PHE -2.10 -0.90 1 65 ASP -1.90 -0.70 1 66 PHE -2.50 -2.00 1 67 THR -5.20 -3.20 1 69 THR -2.70 -1.10 1 70 PHE 3.10 2.90 1 71 THR 0.00 -0.10 1 72 ARG -1.40 1.40 1 73 VAL -0.50 1.00 1 74 GLU -3.60 -3.50 1 75 ALA 0.30 -0.20 1 77 THR -0.50 1.10 1 78 ARG -3.40 0.50 1 80 SER -2.40 -1.20 1 81 PHE -4.70 -1.50 1 82 VAL -5.00 -3.00 1 83 MET 0.10 1.00 1 84 ASP 4.60 3.10 1 85 ASP -0.00 -0.90 1 87 ARG 1.10 2.10 1 88 GLU -3.20 -0.80 1 89 VAL -1.80 -0.80 1 90 ASP -5.10 -0.80 1 91 VAL -0.90 -0.70 1 92 GLN -4.80 -1.80 1 93 PHE -4.30 -2.30 1 94 ALA -5.50 -1.60 1 95 SER 2.00 1.90 1 96 GLU -0.90 -0.70 1 100 THR -2.00 1.20 1 101 TRP -3.70 -3.10 1 102 VAL -2.80 -1.70 1 103 GLN -5.80 -1.70 1 104 GLU -5.10 -2.50 1 105 THR -2.50 -1.00 1 106 PHE -7.80 -3.70 1 107 ASP -0.60 0.50 1 108 ALA -0.90 -0.50 1 109 GLU -1.80 -2.00 1 110 THR 1.60 0.90 1 111 SER 1.80 1.70 1 112 HIS -2.40 0.10 1 113 THR 2.70 1.20 1 115 ALA 3.50 2.90 1 116 GLN 4.00 3.20 1 117 GLN 2.60 3.40 1 118 GLN 5.90 5.10 1 119 ALA 3.50 2.50 1 121 TRP 5.40 3.90 1 122 GLN 2.80 3.00 1 124 ILE 4.70 3.90 1 125 LEU 3.90 3.00 1 126 ASP 4.30 3.00 1 127 ASN 3.20 3.20 1 128 PHE 6.20 3.90 1 129 LYS 3.80 3.70 1 130 ARG 3.50 3.20 1 131 TYR 3.60 3.70 1 132 VAL 4.30 3.00 1 133 GLU 2.80 1.90 1 134 ALA 0.50 0.50 1 135 ALA 1.50 1.00 1 137 LEU 0.90 0.50 1 138 GLU 0.70 0.60 1 139 HIS 0.20 1.00 1 143 HIS -0.30 0.70 1 144 HIS 1.10 2.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17809_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 4.94 _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 0.76 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 LEU -6.70 5.50 0 10 GLU 2.00 -2.80 0 11 GLN -5.40 4.30 1 12 GLU -0.90 1.00 1 13 ILE 5.70 -0.50 1 14 GLU 6.10 -1.50 1 15 ALA 3.00 -0.70 1 16 VAL 6.70 -1.30 1 17 TRP 4.50 -1.10 1 18 TRP 5.10 -1.40 1 19 ALA 1.70 0.40 1 20 TRP 2.10 -0.50 1 21 ASN -2.70 3.10 1 22 ASP -2.60 2.20 1 24 ASP 3.90 -0.70 1 27 ALA 2.80 -1.20 1 28 ARG 0.90 0.00 1 29 TRP -2.30 1.60 1 31 ALA -2.50 2.20 1 32 ALA 0.20 0.10 1 33 SER -2.30 0.90 1 34 SER 2.40 -0.60 1 35 ASP 0.60 -0.30 1 36 TRP -3.60 3.20 1 37 HIS -4.20 3.40 1 38 THR 1.10 -0.20 1 39 THR 0.80 -1.00 1 41 SER -1.40 1.60 1 42 ARG -2.80 2.10 1 43 VAL -3.40 4.00 1 44 ASP -0.90 -0.60 1 45 LEU 0.60 -1.60 1 46 VAL -5.90 3.00 1 47 VAL 6.90 -2.10 1 50 ARG -4.30 2.00 1 51 PHE -6.30 3.20 1 53 HIS -5.10 3.70 1 54 HIS 1.50 -0.90 1 55 MET -1.30 0.40 1 56 ALA -5.20 4.00 1 57 ALA -1.40 0.10 1 58 LYS 4.20 -0.90 1 59 ASP 0.50 -1.40 1 61 SER 2.00 -0.10 1 62 ALA -3.50 3.10 1 64 PHE -2.10 1.20 1 65 ASP -1.90 1.20 1 66 PHE -2.50 0.50 1 67 THR -5.20 2.00 1 69 THR -2.70 1.60 1 70 PHE 3.10 -0.20 1 71 THR 0.00 -0.10 1 72 ARG -1.40 2.80 1 73 VAL -0.50 1.50 1 74 GLU -3.60 0.10 1 75 ALA 0.30 -0.50 1 77 THR -0.50 1.60 1 78 ARG -3.40 3.90 1 80 SER -2.40 1.20 1 81 PHE -4.70 3.20 1 82 VAL -5.00 2.00 1 83 MET 0.10 0.90 1 84 ASP 4.60 -1.50 1 85 ASP -0.00 -0.90 1 87 ARG 1.10 1.00 1 88 GLU -3.20 2.40 1 89 VAL -1.80 1.00 1 90 ASP -5.10 4.30 1 91 VAL -0.90 0.20 1 92 GLN -4.80 3.00 1 93 PHE -4.30 2.00 1 94 ALA -5.50 3.90 1 95 SER 2.00 -0.10 1 96 GLU -0.90 0.20 1 100 THR -2.00 3.20 1 101 TRP -3.70 0.60 1 102 VAL -2.80 1.10 1 103 GLN -5.80 4.10 1 104 GLU -5.10 2.60 1 105 THR -2.50 1.50 1 106 PHE -7.80 4.10 1 107 ASP -0.60 1.10 1 108 ALA -0.90 0.40 1 109 GLU -1.80 -0.20 1 110 THR 1.60 -0.70 1 111 SER 1.80 -0.10 1 112 HIS -2.40 2.50 1 113 THR 2.70 -1.50 1 115 ALA 3.50 -0.60 1 116 GLN 4.00 -0.80 1 117 GLN 2.60 0.80 1 118 GLN 5.90 -0.80 1 119 ALA 3.50 -1.00 1 121 TRP 5.40 -1.50 1 122 GLN 2.80 0.20 1 124 ILE 4.70 -0.80 1 125 LEU 3.90 -0.90 1 126 ASP 4.30 -1.30 1 127 ASN 3.20 0.00 1 128 PHE 6.20 -2.30 1 129 LYS 3.80 -0.10 1 130 ARG 3.50 -0.30 1 131 TYR 3.60 0.10 1 132 VAL 4.30 -1.30 1 133 GLU 2.80 -0.90 1 134 ALA 0.50 0.00 1 135 ALA 1.50 -0.50 1 137 LEU 0.90 -0.40 1 138 GLU 0.70 -0.10 1 139 HIS 0.20 0.80 1 143 HIS -0.30 1.00 1 144 HIS 1.10 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17809_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 0.89 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 ALA 0.30 -2.52 0 10 GLU 2.00 0.58 1 11 GLN -5.40 0.21 1 12 GLU -0.90 -0.05 1 13 ILE 5.70 -0.04 1 14 GLU 6.10 -0.41 1 15 ALA 3.00 0.00 1 16 VAL 6.70 -0.47 1 17 TRP 4.50 -1.17 1 18 TRP 5.10 -0.47 1 19 ALA 1.70 -0.34 1 20 TRP 2.10 -0.87 1 21 ASN -2.70 -0.17 1 22 ASP -2.60 -0.20 1 24 ASP 3.90 -0.28 1 27 ALA 2.80 -0.72 1 28 ARG 0.90 -0.12 1 29 TRP -2.30 0.01 1 31 ALA -2.50 -0.20 1 32 ALA 0.20 -0.34 1 33 SER -2.30 0.11 1 34 SER 2.40 -0.02 1 35 ASP 0.60 0.05 1 36 TRP -3.60 0.41 1 37 HIS -4.20 0.21 1 38 THR 1.10 0.77 1 39 THR 0.80 -0.15 1 41 SER -1.40 0.93 1 42 ARG -2.80 0.22 1 43 VAL -3.40 0.08 1 44 ASP -0.90 0.38 1 45 LEU 0.60 -0.40 1 46 VAL -5.90 0.35 1 47 VAL 6.90 -0.68 1 50 ARG -4.30 0.92 1 51 PHE -6.30 0.70 1 53 HIS -5.10 0.67 1 54 HIS 1.50 0.32 1 55 MET -1.30 0.40 1 56 ALA -5.20 0.27 1 57 ALA -1.40 -0.96 1 58 LYS 4.20 -0.76 1 59 ASP 0.50 -0.21 1 61 SER 2.00 -0.39 1 62 ALA -3.50 0.29 1 64 PHE -2.10 0.26 1 65 ASP -1.90 0.69 1 66 PHE -2.50 0.53 1 67 THR -5.20 -0.04 1 69 THR -2.70 0.64 1 70 PHE 3.10 0.51 1 71 THR 0.00 0.28 1 72 ARG -1.40 0.21 1 73 VAL -0.50 0.33 1 74 GLU -3.60 0.29 1 77 THR -0.50 0.63 1 78 ARG -3.40 1.21 1 79 LEU -6.70 0.93 1 80 SER -2.40 1.47 1 81 PHE -4.70 1.04 1 82 VAL -5.00 1.12 1 83 MET 0.10 0.42 1 84 ASP 4.60 -0.16 1 85 ASP -0.00 -0.04 1 87 ARG 1.10 0.01 1 88 GLU -3.20 0.53 1 89 VAL -1.80 0.47 1 90 ASP -5.10 0.67 1 91 VAL -0.90 0.42 1 92 GLN -4.80 0.74 1 93 PHE -4.30 0.60 1 94 ALA -5.50 0.67 1 95 SER 2.00 0.38 1 96 GLU -0.90 0.41 1 100 THR -2.00 0.83 1 101 TRP -3.70 0.48 1 102 VAL -2.80 0.43 1 103 GLN -5.80 0.44 1 104 GLU -5.10 0.98 1 105 THR -2.50 1.11 1 106 PHE -7.80 0.94 1 107 ASP -0.60 0.23 1 108 ALA -0.90 0.16 1 109 GLU -1.80 0.59 1 110 THR 1.60 0.17 1 111 SER 1.80 -0.11 1 112 HIS -2.40 0.25 1 113 THR 2.70 0.02 1 115 ALA 3.50 -0.13 1 116 GLN 4.00 -0.24 1 117 GLN 2.60 0.04 1 118 GLN 5.90 -0.43 1 119 ALA 3.50 0.02 1 121 TRP 5.40 -0.57 1 122 GLN 2.80 -0.35 1 124 ILE 4.70 -0.24 1 125 LEU 3.90 -0.12 1 126 ASP 4.30 -0.14 1 127 ASN 3.20 0.01 1 128 PHE 6.20 -0.80 1 129 LYS 3.80 -0.84 1 130 ARG 3.50 -0.29 1 131 TYR 3.60 -0.43 1 132 VAL 4.30 -0.81 1 133 GLU 2.80 -0.43 1 134 ALA 0.50 0.06 1 135 ALA 1.50 -0.21 1 137 LEU 0.90 -0.12 1 138 GLU 0.70 -0.23 1 139 HIS 0.20 -0.29 1 143 HIS -0.30 -0.14 1 144 HIS 1.10 -0.29 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17809_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -2.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.88 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 2.13 _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 106 PHE -7.80 -2.00 0 53 HIS -5.10 0.80 0 16 VAL 6.70 0.10 0 45 LEU 0.60 -3.60 0 10 GLU 2.00 -1.80 1 11 GLN -5.40 -2.30 1 12 GLU -0.90 1.70 1 13 ILE 5.70 0.00 1 14 GLU 6.10 3.00 1 15 ALA 3.00 1.60 1 17 TRP 4.50 2.00 1 18 TRP 5.10 1.90 1 19 ALA 1.70 0.80 1 20 TRP 2.10 -1.60 1 21 ASN -2.70 -0.80 1 24 ASP 3.90 2.20 1 27 ALA 2.80 0.50 1 28 ARG 0.90 1.60 1 29 TRP -2.30 -2.40 1 31 ALA -2.50 -1.50 1 32 ALA 0.20 -1.30 1 33 SER -2.30 0.20 1 34 SER 2.40 -0.70 1 35 ASP 0.60 -1.20 1 36 TRP -3.60 -2.40 1 38 THR 1.10 0.10 1 39 THR 0.80 0.30 1 41 SER -1.40 -1.40 1 42 ARG -2.80 -1.70 1 43 VAL -3.40 -2.80 1 44 ASP -0.90 -1.50 1 46 VAL -5.90 -0.90 1 50 ARG -4.30 1.10 1 51 PHE -6.30 -1.60 1 54 HIS 1.50 -1.30 1 55 MET -1.30 -2.00 1 56 ALA -5.20 -2.10 1 57 ALA -1.40 2.30 1 58 LYS 4.20 0.20 1 59 ASP 0.50 1.30 1 61 SER 2.00 -0.80 1 62 ALA -3.50 -1.30 1 64 PHE -2.10 -3.70 1 65 ASP -1.90 -1.70 1 66 PHE -2.50 -1.90 1 67 THR -5.20 -3.40 1 69 THR -2.70 0.30 1 70 PHE 3.10 2.00 1 71 THR 0.00 0.50 1 72 ARG -1.40 -1.70 1 73 VAL -0.50 -2.50 1 74 GLU -3.60 -2.90 1 77 THR -0.50 2.30 1 78 ARG -3.40 -3.40 1 79 LEU -6.70 -2.70 1 80 SER -2.40 -0.50 1 82 VAL -5.00 0.70 1 83 MET 0.10 1.60 1 84 ASP 4.60 -0.40 1 85 ASP -0.00 1.00 1 87 ARG 1.10 -1.00 1 88 GLU -3.20 -0.40 1 89 VAL -1.80 -2.70 1 90 ASP -5.10 -2.30 1 91 VAL -0.90 -2.30 1 92 GLN -4.80 -2.60 1 93 PHE -4.30 -0.30 1 94 ALA -5.50 -1.20 1 95 SER 2.00 -1.50 1 100 THR -2.00 -3.20 1 101 TRP -3.70 -1.20 1 102 VAL -2.80 -2.80 1 103 GLN -5.80 -1.90 1 104 GLU -5.10 -2.90 1 105 THR -2.50 -1.50 1 107 ASP -0.60 -0.80 1 108 ALA -0.90 1.20 1 109 GLU -1.80 1.50 1 110 THR 1.60 1.20 1 111 SER 1.80 -0.80 1 112 HIS -2.40 0.90 1 115 ALA 3.50 3.40 1 116 GLN 4.00 3.80 1 117 GLN 2.60 1.70 1 118 GLN 5.90 1.00 1 119 ALA 3.50 3.70 1 121 TRP 5.40 3.80 1 122 GLN 2.80 1.50 1 124 ILE 4.70 1.00 1 125 LEU 3.90 1.00 1 126 ASP 4.30 3.20 1 127 ASN 3.20 3.30 1 128 PHE 6.20 0.10 1 129 LYS 3.80 0.00 1 130 ARG 3.50 2.90 1 131 TYR 3.60 1.80 1 132 VAL 4.30 1.80 1 133 GLU 2.80 0.90 1 134 ALA 0.50 0.80 1 135 ALA 1.50 0.90 1 137 LEU 0.90 0.10 1 138 GLU 0.70 -0.10 1 143 HIS -0.30 -0.30 1 stop_ save_