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 bmr11089_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 -2.77 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.09 _LACS_plot.Line_2_terminator_val_x_2 5.65 _LACS_plot.Line_2_terminator_val_y_2 4.20 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 MET 4.12 4.76 0 59 GLU 3.98 0.18 0 10 ARG 0.07 0.03 1 12 HIS -0.89 1.38 1 13 SER -0.08 -0.04 1 14 MET -0.18 0.01 1 15 LYS -1.79 -0.82 1 16 ARG -0.66 -0.97 1 17 ASN -0.55 -0.74 1 19 ASN -0.43 -0.08 1 20 ALA -1.37 -0.47 1 22 VAL 0.38 0.55 1 23 THR 4.65 3.85 1 24 LYS -1.79 0.23 1 25 ALA -6.41 -2.26 1 27 TRP -1.88 -0.29 1 28 LEU -5.60 -0.46 1 29 PHE -1.24 -0.14 1 30 LYS -4.88 -2.12 1 31 GLN 1.31 0.78 1 32 ALA -0.31 0.52 1 36 VAL 0.91 0.11 1 37 LYS 3.18 0.62 1 38 GLN -1.63 -0.36 1 39 TRP -2.54 -1.42 1 40 ASN -3.49 -0.91 1 41 LYS 1.51 1.01 1 42 ARG -5.96 -2.59 1 43 TRP -1.66 -1.49 1 44 PHE -3.92 -0.56 1 45 VAL -3.70 -0.49 1 46 LEU -3.06 -1.27 1 47 VAL -3.39 -1.25 1 48 ASP 3.05 1.78 1 51 LEU -4.19 -2.16 1 52 PHE -3.07 -0.21 1 53 TYR -3.76 -3.09 1 54 TYR -6.52 -1.08 1 55 LYS 3.13 3.65 1 56 ASP -1.25 -1.00 1 57 GLU 3.13 0.18 1 58 LYS 3.24 1.25 1 60 GLU 2.03 2.82 1 61 SER -1.91 -1.23 1 62 ILE 1.53 1.69 1 63 LEU -0.08 -0.11 1 65 SER -5.10 -2.46 1 66 ILE -3.49 -0.15 1 68 LEU -0.34 0.63 1 69 LEU 3.47 2.95 1 70 SER 4.01 3.06 1 71 PHE 1.25 1.23 1 72 ARG -1.75 -0.80 1 73 VAL -1.33 -1.23 1 74 ALA -5.35 -1.03 1 75 ALA 0.69 0.48 1 76 VAL 0.38 0.29 1 77 GLN -1.34 -0.29 1 79 SER 2.14 1.19 1 80 ASP 1.87 2.16 1 81 ASN 2.55 1.12 1 82 ILE -2.03 -1.82 1 83 SER 0.17 0.03 1 84 ARG 0.87 0.28 1 85 LYS 1.15 0.48 1 86 HIS 1.84 0.03 1 87 THR 0.61 0.30 1 88 PHE -3.71 -1.67 1 89 LYS -7.34 -3.00 1 90 ALA -4.02 -2.12 1 91 GLU -6.56 -1.86 1 92 HIS -2.48 -0.99 1 93 ALA 3.14 2.03 1 95 VAL -0.75 0.85 1 96 ARG -0.45 0.34 1 97 THR 0.15 0.72 1 98 TYR -4.25 -1.16 1 99 PHE -3.48 -0.39 1 100 PHE -7.02 -3.20 1 101 SER -2.66 -1.27 1 102 ALA -5.59 -2.40 1 103 GLU -0.19 0.96 1 104 SER -1.90 -1.20 1 106 GLU 5.61 4.06 1 107 GLU 0.78 1.91 1 108 GLN 5.03 4.18 1 109 GLU 3.33 2.65 1 110 ALA 3.13 2.35 1 111 TRP 2.90 3.90 1 112 ILE 5.66 4.90 1 113 GLN 4.65 3.20 1 114 ALA 3.32 2.53 1 117 GLU 2.90 2.26 1 118 ALA 0.69 1.44 1 119 ALA -1.53 0.56 1 120 ARG 0.59 1.01 1 121 VAL 0.96 0.71 1 122 GLN 0.51 1.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11089_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 4.57 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.91 _LACS_plot.Line_2_terminator_val_x_2 5.65 _LACS_plot.Line_2_terminator_val_y_2 -1.45 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 MET 4.12 0.64 0 59 GLU 3.98 -3.80 0 10 ARG 0.07 -0.04 1 12 HIS -0.89 2.27 1 13 SER -0.08 0.04 1 14 MET -0.18 0.19 1 15 LYS -1.79 0.97 1 16 ARG -0.66 -0.31 1 17 ASN -0.55 -0.19 1 19 ASN -0.43 0.35 1 20 ALA -1.37 0.90 1 22 VAL 0.38 0.17 1 23 THR 4.65 -0.80 1 24 LYS -1.79 2.02 1 25 ALA -6.41 4.15 1 27 TRP -1.88 1.59 1 28 LEU -5.60 5.14 1 29 PHE -1.24 1.10 1 30 LYS -4.88 2.76 1 31 GLN 1.31 -0.53 1 32 ALA -0.31 0.83 1 36 VAL 0.91 -0.80 1 37 LYS 3.18 -2.56 1 38 GLN -1.63 1.27 1 39 TRP -2.54 1.12 1 40 ASN -3.49 2.58 1 41 LYS 1.51 -0.50 1 42 ARG -5.96 3.37 1 43 TRP -1.66 0.17 1 44 PHE -3.92 3.36 1 45 VAL -3.70 3.21 1 46 LEU -3.06 1.79 1 47 VAL -3.39 2.14 1 48 ASP 3.05 -1.27 1 51 LEU -4.19 2.03 1 52 PHE -3.07 2.86 1 53 TYR -3.76 0.67 1 54 TYR -6.52 5.44 1 55 LYS 3.13 0.52 1 56 ASP -1.25 0.25 1 57 GLU 3.13 -2.95 1 58 LYS 3.24 -1.99 1 60 GLU 2.03 0.79 1 61 SER -1.91 0.68 1 62 ILE 1.53 0.16 1 63 LEU -0.08 -0.03 1 65 SER -5.10 2.64 1 66 ILE -3.49 3.34 1 68 LEU -0.34 0.97 1 69 LEU 3.47 -0.52 1 70 SER 4.01 -0.95 1 71 PHE 1.25 -0.02 1 72 ARG -1.75 0.95 1 73 VAL -1.33 0.10 1 74 ALA -5.35 4.32 1 75 ALA 0.69 -0.21 1 76 VAL 0.38 -0.09 1 77 GLN -1.34 1.05 1 79 SER 2.14 -0.95 1 80 ASP 1.87 0.29 1 81 ASN 2.55 -1.43 1 82 ILE -2.03 0.21 1 83 SER 0.17 -0.14 1 84 ARG 0.87 -0.59 1 85 LYS 1.15 -0.67 1 86 HIS 1.84 -1.81 1 87 THR 0.61 -0.31 1 88 PHE -3.71 2.04 1 89 LYS -7.34 4.34 1 90 ALA -4.02 1.90 1 91 GLU -6.56 4.70 1 92 HIS -2.48 1.49 1 93 ALA 3.14 -1.11 1 95 VAL -0.75 1.60 1 96 ARG -0.45 0.79 1 97 THR 0.15 0.57 1 98 TYR -4.25 3.09 1 99 PHE -3.48 3.09 1 100 PHE -7.02 3.82 1 101 SER -2.66 1.39 1 102 ALA -5.59 3.19 1 103 GLU -0.19 1.15 1 104 SER -1.90 0.70 1 106 GLU 5.61 -1.55 1 107 GLU 0.78 1.13 1 108 GLN 5.03 -0.85 1 109 GLU 3.33 -0.68 1 110 ALA 3.13 -0.78 1 111 TRP 2.90 1.00 1 112 ILE 5.66 -0.76 1 113 GLN 4.65 -1.45 1 114 ALA 3.32 -0.79 1 117 GLU 2.90 -0.64 1 118 ALA 0.69 0.75 1 119 ALA -1.53 2.09 1 120 ARG 0.59 0.42 1 121 VAL 0.96 -0.25 1 122 GLN 0.51 1.22 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11089_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 0.84 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 5.65 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 57 GLU 3.13 -2.62 0 10 ARG 0.07 0.03 1 12 HIS -0.89 -0.06 1 13 SER -0.08 -0.06 1 14 MET -0.18 0.03 1 15 LYS -1.79 0.06 1 16 ARG -0.66 -0.35 1 17 ASN -0.55 -0.24 1 19 ASN -0.43 -0.03 1 20 ALA -1.37 -0.01 1 22 VAL 0.38 -0.20 1 23 THR 4.65 -0.31 1 24 LYS -1.79 -0.27 1 25 ALA -6.41 1.19 1 27 TRP -1.88 0.80 1 28 LEU -5.60 0.41 1 29 PHE -1.24 0.80 1 30 LYS -4.88 0.92 1 31 GLN 1.31 -0.78 1 32 ALA -0.31 0.01 1 36 VAL 0.91 -0.09 1 37 LYS 3.18 -0.29 1 38 GLN -1.63 0.16 1 39 TRP -2.54 0.24 1 40 ASN -3.49 0.59 1 41 LYS 1.51 -0.12 1 42 ARG -5.96 0.74 1 43 TRP -1.66 -0.25 1 44 PHE -3.92 0.33 1 45 VAL -3.70 0.42 1 46 LEU -3.06 0.99 1 47 VAL -3.39 0.44 1 48 ASP 3.05 -0.37 1 51 LEU -4.19 0.67 1 52 PHE -3.07 0.20 1 53 TYR -3.76 1.21 1 54 TYR -6.52 0.32 1 55 LYS 3.13 -0.14 1 56 ASP -1.25 0.06 1 58 LYS 3.24 -0.49 1 59 GLU 3.98 -1.36 1 60 GLU 2.03 -0.36 1 61 SER -1.91 0.24 1 62 ILE 1.53 -0.95 1 63 LEU -0.08 -0.10 1 65 SER -5.10 0.61 1 66 ILE -3.49 -0.13 1 68 LEU -0.34 -0.51 1 69 LEU 3.47 -0.18 1 70 SER 4.01 -0.33 1 71 PHE 1.25 -0.06 1 72 ARG -1.75 0.40 1 73 VAL -1.33 1.40 1 74 ALA -5.35 0.39 1 75 ALA 0.69 0.14 1 76 VAL 0.38 0.19 1 77 GLN -1.34 0.17 1 79 SER 2.14 -0.23 1 80 ASP 1.87 -0.09 1 81 ASN 2.55 -0.39 1 82 ILE -2.03 0.10 1 83 SER 0.17 -0.10 1 84 ARG 0.87 -0.49 1 85 LYS 1.15 -0.45 1 86 HIS 1.84 -0.36 1 87 THR 0.61 1.18 1 88 PHE -3.71 0.66 1 89 LYS -7.34 1.23 1 90 ALA -4.02 1.07 1 91 GLU -6.56 0.58 1 92 HIS -2.48 -0.28 1 93 ALA 3.14 -0.31 1 95 VAL -0.75 -0.03 1 96 ARG -0.45 -0.02 1 97 THR 0.15 0.15 1 98 TYR -4.25 -0.18 1 99 PHE -3.48 0.27 1 100 PHE -7.02 1.02 1 101 SER -2.66 0.81 1 102 ALA -5.59 0.91 1 103 GLU -0.19 0.13 1 104 SER -1.90 -0.49 1 106 GLU 5.61 -0.32 1 107 GLU 0.78 0.04 1 108 GLN 5.03 -0.64 1 109 GLU 3.33 -0.49 1 110 ALA 3.13 -0.28 1 111 TRP 2.90 -0.60 1 112 ILE 5.66 -0.91 1 113 GLN 4.65 -0.37 1 114 ALA 3.32 -0.28 1 115 MET 4.12 -0.62 1 117 GLU 2.90 -0.23 1 118 ALA 0.69 -0.16 1 119 ALA -1.53 -0.09 1 120 ARG 0.59 -0.09 1 121 VAL 0.96 -0.05 1 122 GLN 0.51 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11089_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 -2.66 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 5.65 _LACS_plot.Line_2_terminator_val_y_2 1.70 _LACS_plot.Y_axis_chem_shift_offset 0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 GLN 0.51 4.28 0 24 LYS -1.79 -5.21 0 10 ARG 0.07 0.06 1 13 SER -0.08 -0.38 1 14 MET -0.18 -0.86 1 15 LYS -1.79 -1.17 1 16 ARG -0.66 -0.81 1 17 ASN -0.55 1.89 1 19 ASN -0.43 -0.44 1 20 ALA -1.37 -0.78 1 22 VAL 0.38 1.06 1 23 THR 4.65 -0.72 1 25 ALA -6.41 -1.10 1 27 TRP -1.88 1.68 1 28 LEU -5.60 -1.43 1 29 PHE -1.24 -0.25 1 30 LYS -4.88 -0.77 1 31 GLN 1.31 0.01 1 32 ALA -0.31 -0.01 1 36 VAL 0.91 0.04 1 37 LYS 3.18 -1.00 1 38 GLN -1.63 -1.78 1 39 TRP -2.54 -0.65 1 40 ASN -3.49 -1.38 1 41 LYS 1.51 -0.24 1 42 ARG -5.96 -3.89 1 43 TRP -1.66 -1.69 1 44 PHE -3.92 -1.33 1 45 VAL -3.70 -1.98 1 46 LEU -3.06 -3.13 1 51 LEU -4.19 -2.49 1 52 PHE -3.07 -1.27 1 53 TYR -3.76 -2.39 1 54 TYR -6.52 -0.36 1 55 LYS 3.13 -0.40 1 56 ASP -1.25 -2.27 1 57 GLU 3.13 0.35 1 58 LYS 3.24 0.45 1 59 GLU 3.98 -0.58 1 60 GLU 2.03 1.10 1 61 SER -1.91 -1.06 1 62 ILE 1.53 -0.02 1 63 LEU -0.08 -0.63 1 65 SER -5.10 -0.89 1 66 ILE -3.49 -2.28 1 68 LEU -0.34 -0.78 1 69 LEU 3.47 1.21 1 70 SER 4.01 -0.25 1 71 PHE 1.25 -0.49 1 72 ARG -1.75 -0.11 1 73 VAL -1.33 -1.15 1 74 ALA -5.35 -2.23 1 75 ALA 0.69 -0.14 1 76 VAL 0.38 -1.00 1 77 GLN -1.34 1.64 1 79 SER 2.14 0.48 1 80 ASP 1.87 -0.62 1 81 ASN 2.55 -1.23 1 82 ILE -2.03 -0.50 1 83 SER 0.17 -0.44 1 84 ARG 0.87 -0.14 1 85 LYS 1.15 -0.70 1 86 HIS 1.84 2.17 1 87 THR 0.61 0.26 1 88 PHE -3.71 -5.02 1 89 LYS -7.34 -3.02 1 90 ALA -4.02 -2.71 1 91 GLU -6.56 -2.30 1 92 HIS -2.48 0.43 1 93 ALA 3.14 0.69 1 95 VAL -0.75 -1.01 1 96 ARG -0.45 -2.39 1 97 THR 0.15 -1.79 1 98 TYR -4.25 -2.34 1 99 PHE -3.48 -2.06 1 100 PHE -7.02 -1.38 1 101 SER -2.66 -1.05 1 102 ALA -5.59 -1.24 1 103 GLU -0.19 -0.89 1 104 SER -1.90 -1.42 1 106 GLU 5.61 3.66 1 107 GLU 0.78 1.43 1 108 GLN 5.03 0.62 1 109 GLU 3.33 2.01 1 110 ALA 3.13 3.94 1 111 TRP 2.90 2.33 1 112 ILE 5.66 3.08 1 113 GLN 4.65 2.39 1 114 ALA 3.32 3.19 1 115 MET 4.12 1.30 1 117 GLU 2.90 2.04 1 118 ALA 0.69 0.04 1 119 ALA -1.53 0.87 1 120 ARG 0.59 -0.38 1 121 VAL 0.96 -0.76 1 stop_ save_