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 bmr10041_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.09 _LACS_plot.Line_1_terminator_val_y_1 -4.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 5.04 _LACS_plot.Line_2_terminator_val_y_2 3.36 _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 29 HIS -6.29 0.52 0 10 GLU -1.18 -0.41 1 11 VAL -0.29 -0.12 1 12 THR -0.60 -0.32 1 13 VAL 1.55 0.57 1 14 GLU -3.77 -2.14 1 15 ILE 3.92 1.44 1 17 GLU -3.11 -1.66 1 18 THR -1.21 -0.62 1 19 TYR -6.49 -1.52 1 20 LEU 0.20 0.89 1 22 ARG 1.05 -0.17 1 23 ARG 4.00 2.41 1 25 ASP 0.59 -1.06 1 26 SER 5.05 3.34 1 27 THR -1.06 -0.18 1 28 TRP -2.39 -0.89 1 30 SER 3.11 2.71 1 31 ALA -4.67 -1.37 1 32 GLU -4.53 -2.32 1 33 VAL 2.64 1.34 1 34 ILE 0.54 1.05 1 35 GLN -4.90 -0.80 1 36 SER -5.36 -1.34 1 37 ARG -2.68 -0.98 1 38 VAL -0.22 -0.03 1 39 ASN -0.60 -0.98 1 40 ASP 2.26 2.21 1 41 GLN 3.54 2.67 1 42 GLU -2.12 -0.91 1 44 ARG -3.60 -1.49 1 45 GLU -2.21 -0.29 1 46 GLU -8.09 -2.62 1 47 PHE -3.08 -0.46 1 48 TYR -0.21 -1.52 1 49 VAL -6.30 -4.38 1 50 HIS -4.40 -2.12 1 51 TYR 2.64 0.96 1 52 VAL 4.54 3.15 1 54 PHE -2.81 -1.87 1 55 ASN 0.11 1.27 1 56 ARG 3.54 2.22 1 57 ARG 3.60 2.30 1 58 LEU 0.79 -0.29 1 59 ASP 3.53 1.49 1 60 GLU -5.03 -1.63 1 61 TRP -1.30 -0.80 1 62 VAL -6.54 -3.57 1 63 ASP -2.86 -0.67 1 64 LYS 3.73 4.24 1 65 ASN 2.96 1.84 1 66 ARG 0.60 0.55 1 67 LEU -3.32 -1.68 1 68 ALA -2.17 -1.62 1 69 LEU 0.05 0.12 1 70 THR -1.64 -1.07 1 71 LYS 1.25 1.06 1 72 THR 1.78 1.55 1 73 VAL 1.91 1.50 1 74 LYS 2.09 1.83 1 75 ASP 1.52 1.19 1 76 ALA 0.93 0.98 1 77 VAL 2.15 1.25 1 81 SER 0.98 0.89 1 82 GLU 0.80 0.91 1 83 LYS 1.21 0.95 1 84 TYR 0.85 0.61 1 85 LEU 0.74 0.64 1 86 SER 1.11 0.98 1 87 GLU 0.64 0.57 1 88 LEU 0.46 0.36 1 89 ALA -0.01 0.16 1 90 GLU -0.57 -0.22 1 91 GLN -0.05 0.07 1 93 GLU 0.58 0.53 1 94 ARG 0.25 0.03 1 95 LYS 0.55 0.32 1 96 ILE -0.00 0.01 1 97 THR 0.13 0.17 1 105 ASP 0.33 0.24 1 106 GLU -0.17 0.20 1 107 ILE 0.37 0.38 1 108 ASN 0.10 0.11 1 109 HIS -0.30 1.55 1 110 VAL 0.48 0.42 1 111 GLN 0.46 0.17 1 112 LYS 0.20 0.27 1 113 THR -0.17 0.00 1 114 TYR 0.31 0.24 1 115 ALA 0.02 0.28 1 116 GLU -0.38 -0.03 1 117 MET -0.44 -0.02 1 118 ASP -0.50 -0.10 1 120 THR 2.14 1.72 1 121 THR 1.48 1.07 1 122 ALA 0.71 0.64 1 123 ALA 0.46 0.31 1 124 LEU 0.47 0.42 1 125 GLU 0.03 0.22 1 126 LYS 0.36 0.35 1 127 GLU -0.10 0.17 1 128 SER -0.09 0.17 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10041_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.09 _LACS_plot.Line_1_terminator_val_y_1 3.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.72 _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 5.04 _LACS_plot.Line_2_terminator_val_y_2 -1.68 _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 29 HIS -6.29 6.81 0 10 GLU -1.18 0.77 1 11 VAL -0.29 0.17 1 12 THR -0.60 0.28 1 13 VAL 1.55 -0.98 1 14 GLU -3.77 1.63 1 15 ILE 3.92 -2.48 1 17 GLU -3.11 1.45 1 18 THR -1.21 0.59 1 19 TYR -6.49 4.97 1 20 LEU 0.20 0.69 1 22 ARG 1.05 -1.22 1 23 ARG 4.00 -1.59 1 25 ASP 0.59 -1.65 1 26 SER 5.05 -1.71 1 27 THR -1.06 0.88 1 28 TRP -2.39 1.50 1 30 SER 3.11 -0.40 1 31 ALA -4.67 3.30 1 32 GLU -4.53 2.21 1 33 VAL 2.64 -1.30 1 34 ILE 0.54 0.51 1 35 GLN -4.90 4.10 1 36 SER -5.36 4.02 1 37 ARG -2.68 1.70 1 38 VAL -0.22 0.19 1 39 ASN -0.60 -0.38 1 40 ASP 2.26 -0.05 1 41 GLN 3.54 -0.87 1 42 GLU -2.12 1.21 1 44 ARG -3.60 2.11 1 45 GLU -2.21 1.92 1 46 GLU -8.09 5.47 1 47 PHE -3.08 2.62 1 48 TYR -0.21 -1.31 1 49 VAL -6.30 1.92 1 50 HIS -4.40 2.28 1 51 TYR 2.64 -1.68 1 52 VAL 4.54 -1.39 1 54 PHE -2.81 0.94 1 55 ASN 0.11 1.16 1 56 ARG 3.54 -1.32 1 57 ARG 3.60 -1.30 1 58 LEU 0.79 -1.08 1 59 ASP 3.53 -2.04 1 60 GLU -5.03 3.40 1 61 TRP -1.30 0.50 1 62 VAL -6.54 2.97 1 63 ASP -2.86 2.19 1 64 LYS 3.73 0.51 1 65 ASN 2.96 -1.12 1 66 ARG 0.60 -0.05 1 67 LEU -3.32 1.64 1 68 ALA -2.17 0.55 1 69 LEU 0.05 0.07 1 70 THR -1.64 0.57 1 71 LYS 1.25 -0.19 1 72 THR 1.78 -0.23 1 73 VAL 1.91 -0.41 1 74 LYS 2.09 -0.26 1 75 ASP 1.52 -0.33 1 76 ALA 0.93 0.05 1 77 VAL 2.15 -0.90 1 81 SER 0.98 -0.09 1 82 GLU 0.80 0.11 1 83 LYS 1.21 -0.26 1 84 TYR 0.85 -0.24 1 85 LEU 0.74 -0.10 1 86 SER 1.11 -0.13 1 87 GLU 0.64 -0.07 1 88 LEU 0.46 -0.10 1 89 ALA -0.01 0.17 1 90 GLU -0.57 0.35 1 91 GLN -0.05 0.12 1 93 GLU 0.58 -0.05 1 94 ARG 0.25 -0.22 1 95 LYS 0.55 -0.23 1 96 ILE -0.00 0.01 1 97 THR 0.13 0.04 1 105 ASP 0.33 -0.09 1 106 GLU -0.17 0.37 1 107 ILE 0.37 0.01 1 108 ASN 0.10 0.01 1 109 HIS -0.30 1.85 1 110 VAL 0.48 -0.06 1 111 GLN 0.46 -0.29 1 112 LYS 0.20 0.07 1 113 THR -0.17 0.17 1 114 TYR 0.31 -0.07 1 115 ALA 0.02 0.26 1 116 GLU -0.38 0.35 1 117 MET -0.44 0.42 1 118 ASP -0.50 0.40 1 120 THR 2.14 -0.42 1 121 THR 1.48 -0.41 1 122 ALA 0.71 -0.07 1 123 ALA 0.46 -0.15 1 124 LEU 0.47 -0.05 1 125 GLU 0.03 0.19 1 126 LYS 0.36 -0.01 1 127 GLU -0.10 0.27 1 128 SER -0.09 0.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10041_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.09 _LACS_plot.Line_1_terminator_val_y_1 0.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 5.04 _LACS_plot.Line_2_terminator_val_y_2 -0.47 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 THR -1.21 0.86 0 29 HIS -6.29 0.12 0 36 SER -5.36 1.24 0 10 GLU -1.18 -0.05 1 11 VAL -0.29 0.06 1 12 THR -0.60 0.00 1 13 VAL 1.55 -0.56 1 14 GLU -3.77 0.23 1 15 ILE 3.92 -0.59 1 17 GLU -3.11 0.14 1 19 TYR -6.49 0.22 1 20 LEU 0.20 0.18 1 22 ARG 1.05 -0.64 1 23 ARG 4.00 -0.32 1 25 ASP 0.59 -0.12 1 26 SER 5.05 -0.79 1 27 THR -1.06 0.24 1 28 TRP -2.39 0.59 1 30 SER 3.11 0.10 1 31 ALA -4.67 0.80 1 32 GLU -4.53 0.44 1 33 VAL 2.64 0.01 1 34 ILE 0.54 0.10 1 35 GLN -4.90 0.48 1 37 ARG -2.68 0.38 1 38 VAL -0.22 0.03 1 39 ASN -0.60 -0.16 1 40 ASP 2.26 -0.29 1 41 GLN 3.54 -0.20 1 42 GLU -2.12 0.03 1 44 ARG -3.60 0.40 1 45 GLU -2.21 0.30 1 46 GLU -8.09 0.68 1 47 PHE -3.08 0.70 1 48 TYR -0.21 -0.23 1 49 VAL -6.30 1.14 1 50 HIS -4.40 0.24 1 51 TYR 2.64 -0.23 1 52 VAL 4.54 -0.65 1 54 PHE -2.81 0.22 1 55 ASN 0.11 -0.08 1 56 ARG 3.54 0.22 1 57 ARG 3.60 -0.06 1 58 LEU 0.79 0.08 1 59 ASP 3.53 -0.05 1 60 GLU -5.03 0.42 1 61 TRP -1.30 0.58 1 62 VAL -6.54 0.84 1 63 ASP -2.86 0.38 1 64 LYS 3.73 -0.41 1 65 ASN 2.96 -0.03 1 66 ARG 0.60 -0.21 1 67 LEU -3.32 1.00 1 68 ALA -2.17 0.34 1 69 LEU 0.05 0.19 1 70 THR -1.64 0.10 1 71 LYS 1.25 -0.11 1 72 THR 1.78 -0.16 1 73 VAL 1.91 -0.18 1 74 LYS 2.09 -0.34 1 75 ASP 1.52 -0.21 1 76 ALA 0.93 -0.10 1 77 VAL 2.15 -0.27 1 81 SER 0.98 -0.05 1 82 GLU 0.80 -0.12 1 83 LYS 1.21 -0.12 1 84 TYR 0.85 -0.02 1 85 LEU 0.74 -0.11 1 86 SER 1.11 -0.12 1 87 GLU 0.64 -0.08 1 88 LEU 0.46 -0.07 1 89 ALA -0.01 -0.04 1 90 GLU -0.57 -0.10 1 91 GLN -0.05 -0.04 1 93 GLU 0.58 -0.15 1 95 LYS 0.55 0.00 1 96 ILE -0.00 0.07 1 105 ASP 0.33 -0.06 1 106 GLU -0.17 -0.11 1 107 ILE 0.37 -0.07 1 108 ASN 0.10 -0.04 1 109 HIS -0.30 -0.15 1 110 VAL 0.48 -0.08 1 111 GLN 0.46 -0.03 1 112 LYS 0.20 0.00 1 113 THR -0.17 -0.05 1 114 TYR 0.31 0.00 1 115 ALA 0.02 -0.04 1 116 GLU -0.38 -0.11 1 117 MET -0.44 -0.05 1 118 ASP -0.50 -0.04 1 120 THR 2.14 -0.07 1 121 THR 1.48 -0.10 1 122 ALA 0.71 -0.07 1 123 ALA 0.46 -0.04 1 124 LEU 0.47 -0.04 1 125 GLU 0.03 -0.11 1 126 LYS 0.36 -0.02 1 127 GLU -0.10 -0.05 1 128 SER -0.09 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10041_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.09 _LACS_plot.Line_1_terminator_val_y_1 -2.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 5.04 _LACS_plot.Line_2_terminator_val_y_2 1.68 _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 29 HIS -6.29 0.86 0 10 GLU -1.18 -0.10 1 11 VAL -0.29 -0.82 1 12 THR -0.60 -1.29 1 13 VAL 1.55 -1.33 1 14 GLU -3.77 -1.02 1 15 ILE 3.92 1.45 1 17 GLU -3.11 -2.37 1 18 THR -1.21 -1.05 1 19 TYR -6.49 -0.38 1 20 LEU 0.20 -1.70 1 22 ARG 1.05 0.16 1 23 ARG 4.00 1.87 1 26 SER 5.05 -1.24 1 27 THR -1.06 -1.57 1 28 TRP -2.39 0.49 1 30 SER 3.11 -0.66 1 31 ALA -4.67 -3.39 1 32 GLU -4.53 0.09 1 33 VAL 2.64 0.32 1 34 ILE 0.54 -0.43 1 35 GLN -4.90 -2.53 1 36 SER -5.36 -1.77 1 37 ARG -2.68 -3.12 1 38 VAL -0.22 -0.75 1 39 ASN -0.60 0.40 1 40 ASP 2.26 1.10 1 41 GLN 3.54 1.44 1 42 GLU -2.12 0.43 1 44 ARG -3.60 -1.81 1 45 GLU -2.21 -1.49 1 46 GLU -8.09 -2.17 1 47 PHE -3.08 -2.82 1 48 TYR -0.21 -0.90 1 49 VAL -6.30 -3.51 1 50 HIS -4.40 0.55 1 51 TYR 2.64 -0.43 1 52 VAL 4.54 1.93 1 54 PHE -2.81 0.14 1 55 ASN 0.11 1.70 1 56 ARG 3.54 1.58 1 57 ARG 3.60 0.74 1 58 LEU 0.79 -1.62 1 59 ASP 3.53 0.22 1 60 GLU -5.03 -2.73 1 61 TRP -1.30 1.16 1 62 VAL -6.54 -1.77 1 63 ASP -2.86 0.22 1 64 LYS 3.73 0.97 1 65 ASN 2.96 1.76 1 66 ARG 0.60 -2.86 1 67 LEU -3.32 -0.81 1 68 ALA -2.17 -1.58 1 69 LEU 0.05 -0.27 1 70 THR -1.64 -0.22 1 71 LYS 1.25 0.30 1 72 THR 1.78 0.76 1 73 VAL 1.91 0.21 1 74 LYS 2.09 0.57 1 75 ASP 1.52 0.41 1 76 ALA 0.93 0.91 1 77 VAL 2.15 0.84 1 81 SER 0.98 0.36 1 82 GLU 0.80 0.55 1 83 LYS 1.21 0.19 1 84 TYR 0.85 0.28 1 85 LEU 0.74 0.27 1 86 SER 1.11 0.52 1 87 GLU 0.64 0.34 1 88 LEU 0.46 -0.23 1 89 ALA -0.01 -0.11 1 90 GLU -0.57 -0.33 1 91 GLN -0.05 -0.19 1 93 GLU 0.58 0.05 1 94 ARG 0.25 -0.22 1 95 LYS 0.55 -0.10 1 96 ILE -0.00 0.11 1 97 THR 0.13 -0.10 1 105 ASP 0.33 -0.09 1 106 GLU -0.17 0.03 1 107 ILE 0.37 -0.49 1 108 ASN 0.10 0.73 1 109 HIS -0.30 1.25 1 110 VAL 0.48 -0.30 1 111 GLN 0.46 -0.11 1 112 LYS 0.20 -0.10 1 113 THR -0.17 -0.50 1 114 TYR 0.31 -0.33 1 115 ALA 0.02 -0.37 1 116 GLU -0.38 -0.25 1 117 MET -0.44 -0.77 1 120 THR 2.14 0.85 1 121 THR 1.48 0.18 1 122 ALA 0.71 0.02 1 123 ALA 0.46 0.20 1 124 LEU 0.47 0.29 1 125 GLU 0.03 0.03 1 126 LYS 0.36 0.11 1 127 GLU -0.10 0.02 1 128 SER -0.09 0.06 1 stop_ save_