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 bmr11457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.33 _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 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.44 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 5.24 _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 66 ILE -0.25 -2.78 0 75 ALA -7.83 -1.01 0 10 SER 0.09 0.19 1 11 GLU -0.27 0.10 1 12 GLU 0.06 0.24 1 13 VAL 0.69 0.61 1 14 ASP 0.21 -0.04 1 15 LEU 1.71 1.21 1 16 ASN 0.45 0.36 1 17 ALA 2.95 2.77 1 19 LEU 1.12 0.51 1 20 HIS -2.84 -0.81 1 22 ASN 3.38 1.36 1 23 TRP -0.98 -0.64 1 24 THR -4.82 -1.79 1 25 LEU 2.94 3.04 1 26 GLU 2.28 2.26 1 27 ASN -0.50 -0.48 1 28 ALA 4.26 3.96 1 29 LYS 5.67 4.65 1 30 ALA 3.40 2.38 1 31 ARG 2.16 0.30 1 32 LEU 3.63 1.76 1 33 ASN 4.29 3.23 1 34 GLN 4.06 3.34 1 35 TYR 4.60 3.82 1 36 PHE 3.53 0.64 1 37 GLN 3.86 3.14 1 38 LYS 3.21 2.72 1 39 GLU -1.03 -1.00 1 40 LYS 5.28 0.86 1 41 ILE -3.93 -1.23 1 42 GLN -1.69 -1.31 1 44 GLU -4.53 -2.00 1 45 TYR -0.03 0.81 1 46 LYS -2.09 -1.31 1 47 TYR -3.21 -0.48 1 48 THR -1.79 0.21 1 49 GLN -0.46 0.19 1 50 VAL -3.06 -1.42 1 53 ASP 4.24 3.46 1 54 HIS 0.53 1.16 1 55 ASN 0.30 -0.43 1 56 ARG -0.86 -0.72 1 57 SER -0.86 -0.34 1 58 PHE -4.70 0.26 1 59 ILE -3.10 -1.36 1 60 ALA -5.09 -2.38 1 61 GLU -8.33 -2.73 1 62 MET -4.18 0.94 1 63 THR -2.16 -1.32 1 64 ILE -5.15 -1.32 1 65 TYR -0.51 -0.16 1 67 LYS 5.21 4.13 1 68 GLN 4.64 3.36 1 69 LEU -3.37 -1.27 1 71 ARG -5.04 -2.03 1 72 ARG -2.64 -1.09 1 73 ILE -3.25 -1.21 1 74 PHE -5.58 -1.42 1 76 ARG -1.96 -0.23 1 77 GLU -7.99 -2.75 1 78 HIS -3.30 -0.09 1 80 SER 3.61 2.89 1 81 ASN -3.14 -1.77 1 82 LYS 6.32 5.24 1 83 LYS 4.39 3.38 1 84 LEU 2.57 2.32 1 85 ALA 3.90 3.06 1 86 ALA 4.89 2.97 1 87 GLN 4.25 4.10 1 88 SER 4.57 3.76 1 90 ALA 4.40 2.81 1 91 LEU 4.05 2.93 1 92 SER 3.23 2.30 1 93 LEU 3.66 3.33 1 94 VAL 6.59 5.24 1 95 ARG 6.32 5.48 1 96 GLN 3.30 4.65 1 97 LEU 4.01 3.04 1 98 TYR 3.80 2.76 1 99 HIS 5.34 4.58 1 100 LEU -0.48 0.20 1 102 VAL 1.62 1.32 1 103 ILE -4.09 -1.42 1 104 GLU -0.61 -0.56 1 105 ALA 0.05 -0.07 1 106 TYR 4.45 1.53 1 107 SER -1.99 -1.43 1 108 SER -0.15 -0.11 1 111 SER 0.01 -0.01 1 112 SER -0.18 0.05 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.33 _LACS_plot.Line_1_terminator_val_y_1 5.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.56 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 -1.34 _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 66 ILE -0.25 -2.53 0 75 ALA -7.83 6.82 0 10 SER 0.09 0.10 1 11 GLU -0.27 0.37 1 12 GLU 0.06 0.18 1 13 VAL 0.69 -0.08 1 14 ASP 0.21 -0.25 1 15 LEU 1.71 -0.50 1 16 ASN 0.45 -0.09 1 17 ALA 2.95 -0.18 1 19 LEU 1.12 -0.61 1 20 HIS -2.84 2.03 1 22 ASN 3.38 -2.02 1 23 TRP -0.98 0.34 1 24 THR -4.82 3.03 1 25 LEU 2.94 0.10 1 26 GLU 2.28 -0.02 1 27 ASN -0.50 0.02 1 28 ALA 4.26 -0.30 1 29 LYS 5.67 -1.02 1 30 ALA 3.40 -1.02 1 31 ARG 2.16 -1.86 1 32 LEU 3.63 -1.87 1 33 ASN 4.29 -1.06 1 34 GLN 4.06 -0.72 1 35 TYR 4.60 -0.78 1 36 PHE 3.53 -2.89 1 37 GLN 3.86 -0.72 1 38 LYS 3.21 -0.49 1 39 GLU -1.03 0.03 1 40 LYS 5.28 -4.42 1 41 ILE -3.93 2.70 1 42 GLN -1.69 0.38 1 44 GLU -4.53 2.53 1 45 TYR -0.03 0.84 1 46 LYS -2.09 0.78 1 47 TYR -3.21 2.73 1 48 THR -1.79 2.00 1 49 GLN -0.46 0.65 1 50 VAL -3.06 1.64 1 53 ASP 4.24 -0.78 1 54 HIS 0.53 0.63 1 55 ASN 0.30 -0.73 1 56 ARG -0.86 0.14 1 57 SER -0.86 0.52 1 58 PHE -4.70 4.96 1 59 ILE -3.10 1.74 1 60 ALA -5.09 2.71 1 61 GLU -8.33 5.60 1 62 MET -4.18 5.12 1 63 THR -2.16 0.84 1 64 ILE -5.15 3.83 1 65 TYR -0.51 0.35 1 67 LYS 5.21 -1.08 1 68 GLN 4.64 -1.28 1 69 LEU -3.37 2.10 1 71 ARG -5.04 3.01 1 72 ARG -2.64 1.55 1 73 ILE -3.25 2.04 1 74 PHE -5.58 4.16 1 76 ARG -1.96 1.73 1 77 GLU -7.99 5.24 1 78 HIS -3.30 3.21 1 80 SER 3.61 -0.72 1 81 ASN -3.14 1.37 1 82 LYS 6.32 -1.08 1 83 LYS 4.39 -1.01 1 84 LEU 2.57 -0.25 1 85 ALA 3.90 -0.84 1 86 ALA 4.89 -1.92 1 87 GLN 4.25 -0.15 1 88 SER 4.57 -0.81 1 90 ALA 4.40 -1.59 1 91 LEU 4.05 -1.12 1 92 SER 3.23 -0.93 1 93 LEU 3.66 -0.33 1 94 VAL 6.59 -1.35 1 95 ARG 6.32 -0.84 1 96 GLN 3.30 1.35 1 97 LEU 4.01 -0.97 1 98 TYR 3.80 -1.04 1 99 HIS 5.34 -0.76 1 100 LEU -0.48 0.68 1 102 VAL 1.62 -0.30 1 103 ILE -4.09 2.67 1 104 GLU -0.61 0.05 1 105 ALA 0.05 -0.12 1 106 TYR 4.45 -2.92 1 107 SER -1.99 0.56 1 108 SER -0.15 0.04 1 111 SER 0.01 -0.02 1 112 SER -0.18 0.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.33 _LACS_plot.Line_1_terminator_val_y_1 0.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _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 6.58 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 ALA -7.83 0.14 0 47 TYR -3.21 1.36 0 10 SER 0.09 -0.06 1 11 GLU -0.27 -0.05 1 12 GLU 0.06 -0.07 1 13 VAL 0.69 -0.09 1 14 ASP 0.21 0.03 1 15 LEU 1.71 -0.13 1 16 ASN 0.45 0.02 1 17 ALA 2.95 -0.27 1 19 LEU 1.12 -0.04 1 20 HIS -2.84 0.21 1 22 ASN 3.38 -1.01 1 23 TRP -0.98 0.13 1 24 THR -4.82 0.23 1 25 LEU 2.94 -0.47 1 26 GLU 2.28 -0.31 1 27 ASN -0.50 0.23 1 28 ALA 4.26 -0.26 1 29 LYS 5.67 -0.76 1 30 ALA 3.40 -0.18 1 31 ARG 2.16 0.03 1 32 LEU 3.63 -0.73 1 33 ASN 4.29 -0.34 1 34 GLN 4.06 -0.22 1 35 TYR 4.60 -0.04 1 36 PHE 3.53 -0.32 1 37 GLN 3.86 -0.22 1 38 LYS 3.21 -0.29 1 39 GLU -1.03 -0.20 1 40 LYS 5.28 -0.44 1 41 ILE -3.93 0.09 1 42 GLN -1.69 -0.17 1 44 GLU -4.53 0.13 1 45 TYR -0.03 -0.19 1 46 LYS -2.09 0.27 1 48 THR -1.79 0.19 1 49 GLN -0.46 -0.07 1 50 VAL -3.06 0.22 1 53 ASP 4.24 -0.64 1 54 HIS 0.53 -0.15 1 55 ASN 0.30 0.03 1 56 ARG -0.86 0.30 1 57 SER -0.86 0.10 1 58 PHE -4.70 0.84 1 59 ILE -3.10 0.54 1 60 ALA -5.09 0.95 1 61 GLU -8.33 1.22 1 62 MET -4.18 0.04 1 63 THR -2.16 0.95 1 64 ILE -5.15 0.39 1 65 TYR -0.51 0.00 1 66 ILE -0.25 0.04 1 67 LYS 5.21 -0.62 1 68 GLN 4.64 -0.28 1 69 LEU -3.37 0.20 1 71 ARG -5.04 0.42 1 72 ARG -2.64 0.89 1 73 ILE -3.25 0.53 1 74 PHE -5.58 0.82 1 76 ARG -1.96 0.67 1 77 GLU -7.99 0.66 1 78 HIS -3.30 0.88 1 80 SER 3.61 -0.21 1 81 ASN -3.14 -0.05 1 82 LYS 6.32 -1.19 1 83 LYS 4.39 -0.40 1 84 LEU 2.57 -0.23 1 85 ALA 3.90 -0.51 1 86 ALA 4.89 -0.97 1 87 GLN 4.25 -0.53 1 88 SER 4.57 -0.39 1 90 ALA 4.40 -0.36 1 91 LEU 4.05 -0.57 1 92 SER 3.23 -0.29 1 93 LEU 3.66 -0.51 1 94 VAL 6.59 -1.09 1 95 ARG 6.32 -0.38 1 96 GLN 3.30 -0.16 1 97 LEU 4.01 -0.65 1 98 TYR 3.80 0.05 1 99 HIS 5.34 -0.68 1 100 LEU -0.48 -0.05 1 102 VAL 1.62 -0.26 1 103 ILE -4.09 0.20 1 104 GLU -0.61 0.23 1 105 ALA 0.05 -0.22 1 106 TYR 4.45 -0.90 1 107 SER -1.99 -0.40 1 108 SER -0.15 -0.26 1 111 SER 0.01 -0.01 1 112 SER -0.18 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.33 _LACS_plot.Line_1_terminator_val_y_1 -3.14 _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 -0.83 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 2.34 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 GLU -7.99 -2.51 0 22 ASN 3.38 -1.72 0 40 LYS 5.28 -0.87 0 61 GLU -8.33 -1.99 0 27 ASN -0.50 3.13 0 10 SER 0.09 -0.08 1 11 GLU -0.27 -0.08 1 12 GLU 0.06 0.18 1 13 VAL 0.69 -0.38 1 14 ASP 0.21 0.95 1 15 LEU 1.71 0.41 1 16 ASN 0.45 0.85 1 17 ALA 2.95 2.30 1 19 LEU 1.12 -0.10 1 20 HIS -2.84 1.00 1 23 TRP -0.98 0.05 1 24 THR -4.82 -0.12 1 25 LEU 2.94 1.18 1 26 GLU 2.28 0.81 1 28 ALA 4.26 1.14 1 29 LYS 5.67 1.79 1 30 ALA 3.40 2.86 1 31 ARG 2.16 3.23 1 32 LEU 3.63 -0.02 1 33 ASN 4.29 3.17 1 34 GLN 4.06 2.17 1 35 TYR 4.60 1.04 1 36 PHE 3.53 3.36 1 37 GLN 3.86 2.82 1 38 LYS 3.21 1.93 1 39 GLU -1.03 -1.21 1 41 ILE -3.93 -1.61 1 42 GLN -1.69 -1.05 1 44 GLU -4.53 -1.68 1 45 TYR -0.03 -0.65 1 46 LYS -2.09 -0.06 1 47 TYR -3.21 0.69 1 48 THR -1.79 -1.86 1 49 GLN -0.46 -1.44 1 50 VAL -3.06 -1.05 1 53 ASP 4.24 0.77 1 54 HIS 0.53 0.58 1 55 ASN 0.30 -2.74 1 56 ARG -0.86 -0.12 1 57 SER -0.86 -2.49 1 58 PHE -4.70 -1.32 1 59 ILE -3.10 -0.92 1 60 ALA -5.09 -2.63 1 62 MET -4.18 -3.14 1 63 THR -2.16 -1.12 1 64 ILE -5.15 -2.79 1 65 TYR -0.51 -1.94 1 66 ILE -0.25 -0.17 1 67 LYS 5.21 2.34 1 68 GLN 4.64 0.14 1 69 LEU -3.37 -0.57 1 71 ARG -5.04 -3.18 1 72 ARG -2.64 0.00 1 73 ILE -3.25 -2.71 1 74 PHE -5.58 -1.63 1 75 ALA -7.83 -3.07 1 76 ARG -1.96 -1.57 1 78 HIS -3.30 1.37 1 80 SER 3.61 -1.25 1 81 ASN -3.14 -0.82 1 82 LYS 6.32 0.71 1 83 LYS 4.39 3.26 1 84 LEU 2.57 2.59 1 85 ALA 3.90 1.09 1 86 ALA 4.89 1.69 1 87 GLN 4.25 2.78 1 88 SER 4.57 1.98 1 90 ALA 4.40 1.12 1 91 LEU 4.05 -0.10 1 92 SER 3.23 3.83 1 93 LEU 3.66 0.50 1 94 VAL 6.59 1.26 1 95 ARG 6.32 2.25 1 96 GLN 3.30 2.91 1 97 LEU 4.01 1.46 1 98 TYR 3.80 3.56 1 99 HIS 5.34 2.68 1 100 LEU -0.48 -0.50 1 102 VAL 1.62 -0.76 1 103 ILE -4.09 -2.78 1 104 GLU -0.61 -1.00 1 105 ALA 0.05 -0.55 1 106 TYR 4.45 -0.21 1 107 SER -1.99 -1.46 1 108 SER -0.15 -0.21 1 111 SER 0.01 0.03 1 112 SER -0.18 -0.70 1 stop_ save_