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 bmr34428_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.32 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 5.07 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 ILE -4.10 1.20 0 14 HIS -3.95 1.64 0 11 ARG -1.12 -0.60 1 12 VAL 0.21 -0.39 1 13 VAL -2.13 -0.48 1 15 ILE -4.06 -1.13 1 17 ASN 2.79 1.01 1 18 LEU 0.49 0.47 1 20 GLU 2.32 1.85 1 22 SER 0.04 0.33 1 24 THR -4.98 -2.32 1 25 GLU 6.59 4.85 1 26 ASN 4.61 3.55 1 27 ASP 2.91 3.54 1 28 VAL 5.10 4.02 1 29 ILE 6.48 4.49 1 30 ASN 2.88 3.01 1 31 LEU 1.73 1.98 1 33 LEU 6.56 5.02 1 35 PHE 0.80 0.97 1 37 LYS 0.42 0.60 1 38 VAL -1.23 -0.51 1 39 THR 1.79 0.61 1 40 ASN -5.21 -0.19 1 41 TYR -3.39 -1.03 1 43 LEU -0.41 -1.22 1 44 MET -0.04 -1.40 1 45 LYS 4.62 4.43 1 46 SER 4.29 3.22 1 47 THR -0.42 -1.46 1 48 ASN 4.52 2.32 1 49 GLN -6.07 -1.77 1 50 ALA -6.13 -0.61 1 51 PHE -7.32 -2.40 1 52 LEU -5.72 -1.14 1 53 GLU -6.16 -2.16 1 54 MET -3.29 -3.67 1 55 ALA 2.95 2.73 1 56 TYR -4.83 -2.30 1 57 THR 4.54 3.44 1 58 GLU 6.26 4.66 1 59 ALA 0.97 2.09 1 60 ALA 4.25 2.90 1 61 GLN 3.92 3.45 1 62 ALA 3.33 2.55 1 63 MET 3.67 3.16 1 64 VAL 5.85 4.80 1 65 GLN 4.34 3.31 1 66 TYR 4.40 4.41 1 67 TYR 2.52 1.57 1 68 GLN 3.51 2.72 1 69 GLU 0.31 0.88 1 70 LYS -0.62 -1.14 1 72 ALA -0.96 -0.69 1 73 ILE -2.83 -2.04 1 74 ILE -2.40 -0.65 1 75 ASN 2.36 0.74 1 77 GLU -2.70 -1.88 1 78 LYS -0.31 -0.19 1 79 LEU -0.60 -0.45 1 80 LEU -0.78 -0.29 1 81 ILE -0.56 0.17 1 82 ARG -5.98 -1.39 1 83 MET 1.84 -0.82 1 84 SER -1.14 -0.78 1 85 THR 1.43 0.22 1 86 ARG -1.62 0.92 1 87 TYR -2.01 -0.87 1 88 LYS 0.25 1.01 1 89 GLU -4.20 -1.71 1 90 LEU -3.65 -1.98 1 91 GLN -1.53 -1.26 1 92 LEU 3.29 2.04 1 93 LYS 0.48 1.11 1 94 LYS -1.63 -1.13 1 97 LYS 0.01 0.46 1 98 ASN 0.61 0.71 1 99 VAL 1.07 0.06 1 100 ALA 3.25 2.35 1 101 ALA 2.52 1.79 1 102 ILE 3.57 2.85 1 103 ILE -1.15 -1.69 1 104 GLN 3.39 2.44 1 105 ASP 2.19 2.35 1 106 ILE 3.43 3.22 1 107 HIS 1.85 2.13 1 108 SER 1.70 1.59 1 109 GLN 1.17 0.68 1 110 ARG 0.13 0.34 1 111 GLU -0.23 0.06 1 112 ARG 1.08 1.54 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34428_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.32 _LACS_plot.Line_1_terminator_val_y_1 4.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.58 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 -1.52 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 ILE -4.10 5.30 0 14 HIS -3.95 5.59 0 11 ARG -1.12 0.52 1 12 VAL 0.21 -0.60 1 13 VAL -2.13 1.65 1 15 ILE -4.06 2.93 1 17 ASN 2.79 -1.78 1 18 LEU 0.49 -0.02 1 20 GLU 2.32 -0.47 1 22 SER 0.04 0.29 1 24 THR -4.98 2.66 1 25 GLU 6.59 -1.74 1 26 ASN 4.61 -1.06 1 27 ASP 2.91 0.63 1 28 VAL 5.10 -1.08 1 29 ILE 6.48 -1.99 1 30 ASN 2.88 0.13 1 31 LEU 1.73 0.25 1 33 LEU 6.56 -1.54 1 35 PHE 0.80 0.17 1 37 LYS 0.42 0.18 1 38 VAL -1.23 0.72 1 39 THR 1.79 -1.18 1 40 ASN -5.21 5.02 1 41 TYR -3.39 2.36 1 43 LEU -0.41 -0.81 1 44 MET -0.04 -1.36 1 45 LYS 4.62 -0.19 1 46 SER 4.29 -1.07 1 47 THR -0.42 -1.04 1 48 ASN 4.52 -2.20 1 49 GLN -6.07 4.30 1 50 ALA -6.13 5.52 1 51 PHE -7.32 4.92 1 52 LEU -5.72 4.58 1 53 GLU -6.16 4.00 1 54 MET -3.29 -0.38 1 55 ALA 2.95 -0.22 1 56 TYR -4.83 2.53 1 57 THR 4.54 -1.10 1 58 GLU 6.26 -1.60 1 59 ALA 0.97 1.12 1 60 ALA 4.25 -1.35 1 61 GLN 3.92 -0.47 1 62 ALA 3.33 -0.78 1 63 MET 3.67 -0.51 1 64 VAL 5.85 -1.05 1 65 GLN 4.34 -1.03 1 66 TYR 4.40 0.01 1 67 TYR 2.52 -0.95 1 68 GLN 3.51 -0.79 1 69 GLU 0.31 0.57 1 70 LYS -0.62 -0.52 1 72 ALA -0.96 0.27 1 73 ILE -2.83 0.79 1 74 ILE -2.40 1.75 1 75 ASN 2.36 -1.62 1 77 GLU -2.70 0.82 1 78 LYS -0.31 0.12 1 79 LEU -0.60 0.15 1 80 LEU -0.78 0.49 1 81 ILE -0.56 0.73 1 82 ARG -5.98 4.59 1 83 MET 1.84 -2.66 1 84 SER -1.14 0.36 1 85 THR 1.43 -1.21 1 86 ARG -1.62 2.54 1 87 TYR -2.01 1.14 1 88 LYS 0.25 0.76 1 89 GLU -4.20 2.49 1 90 LEU -3.65 1.67 1 91 GLN -1.53 0.27 1 92 LEU 3.29 -1.25 1 93 LYS 0.48 0.63 1 94 LYS -1.63 0.50 1 97 LYS 0.01 0.45 1 98 ASN 0.61 0.10 1 99 VAL 1.07 -1.01 1 100 ALA 3.25 -0.90 1 101 ALA 2.52 -0.73 1 102 ILE 3.57 -0.72 1 103 ILE -1.15 -0.54 1 104 GLN 3.39 -0.95 1 105 ASP 2.19 0.16 1 106 ILE 3.43 -0.21 1 107 HIS 1.85 0.28 1 108 SER 1.70 -0.11 1 109 GLN 1.17 -0.49 1 110 ARG 0.13 0.21 1 111 GLU -0.23 0.29 1 112 ARG 1.08 0.46 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34428_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.32 _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 -0.16 _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 6.59 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _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 63 MET 3.67 -2.42 0 11 ARG -1.12 0.11 1 12 VAL 0.21 0.62 1 13 VAL -2.13 0.28 1 14 HIS -3.95 0.42 1 15 ILE -4.06 0.43 1 17 ASN 2.79 -0.40 1 18 LEU 0.49 -0.72 1 20 GLU 2.32 -0.34 1 22 SER 0.04 0.29 1 24 THR -4.98 0.23 1 25 GLU 6.59 -1.00 1 26 ASN 4.61 -0.76 1 27 ASP 2.91 -0.39 1 28 VAL 5.10 -0.52 1 29 ILE 6.48 -0.52 1 30 ASN 2.88 -0.30 1 31 LEU 1.73 -0.09 1 33 LEU 6.56 -0.09 1 35 PHE 0.80 -0.38 1 37 LYS 0.42 -0.06 1 38 VAL -1.23 0.52 1 39 THR 1.79 0.06 1 40 ASN -5.21 0.23 1 41 TYR -3.39 0.40 1 42 ILE -4.10 -0.33 1 43 LEU -0.41 0.21 1 44 MET -0.04 0.15 1 45 LYS 4.62 -0.15 1 46 SER 4.29 -0.28 1 47 THR -0.42 0.24 1 48 ASN 4.52 -0.52 1 49 GLN -6.07 0.86 1 50 ALA -6.13 0.49 1 51 PHE -7.32 1.29 1 52 LEU -5.72 0.47 1 53 GLU -6.16 0.66 1 54 MET -3.29 1.04 1 55 ALA 2.95 -0.52 1 56 TYR -4.83 0.52 1 57 THR 4.54 -0.19 1 58 GLU 6.26 -0.35 1 59 ALA 0.97 0.13 1 60 ALA 4.25 -0.47 1 61 GLN 3.92 -0.37 1 62 ALA 3.33 -0.24 1 64 VAL 5.85 -0.70 1 65 GLN 4.34 -0.37 1 66 TYR 4.40 -0.53 1 67 TYR 2.52 0.26 1 68 GLN 3.51 -0.20 1 69 GLU 0.31 -0.13 1 70 LYS -0.62 -0.01 1 72 ALA -0.96 0.11 1 73 ILE -2.83 0.75 1 74 ILE -2.40 0.10 1 75 ASN 2.36 -0.42 1 77 GLU -2.70 0.21 1 78 LYS -0.31 0.42 1 79 LEU -0.60 0.10 1 80 LEU -0.78 0.34 1 81 ILE -0.56 0.82 1 82 ARG -5.98 0.56 1 83 MET 1.84 0.36 1 84 SER -1.14 1.32 1 85 THR 1.43 -0.08 1 86 ARG -1.62 -0.22 1 87 TYR -2.01 0.26 1 88 LYS 0.25 0.06 1 89 GLU -4.20 -0.05 1 90 LEU -3.65 0.30 1 91 GLN -1.53 0.12 1 92 LEU 3.29 -0.32 1 93 LYS 0.48 -0.03 1 94 LYS -1.63 0.13 1 97 LYS 0.01 0.06 1 98 ASN 0.61 -0.01 1 99 VAL 1.07 -0.45 1 100 ALA 3.25 -0.23 1 101 ALA 2.52 -0.12 1 102 ILE 3.57 -0.35 1 103 ILE -1.15 -0.05 1 104 GLN 3.39 -0.20 1 105 ASP 2.19 -0.14 1 106 ILE 3.43 0.03 1 107 HIS 1.85 -0.20 1 108 SER 1.70 -0.09 1 109 GLN 1.17 -0.02 1 110 ARG 0.13 0.00 1 111 GLU -0.23 -0.06 1 112 ARG 1.08 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34428_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.32 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 6.59 _LACS_plot.Line_2_terminator_val_y_2 2.36 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 ASN 4.52 -2.15 0 51 PHE -7.32 0.07 0 112 ARG 1.08 4.60 0 11 ARG -1.12 -2.33 1 12 VAL 0.21 -1.84 1 13 VAL -2.13 -2.69 1 14 HIS -3.95 -1.41 1 15 ILE -4.06 -2.39 1 17 ASN 2.79 -0.34 1 20 GLU 2.32 1.41 1 22 SER 0.04 -1.98 1 24 THR -4.98 -1.24 1 25 GLU 6.59 0.55 1 26 ASN 4.61 1.90 1 27 ASP 2.91 1.74 1 28 VAL 5.10 1.14 1 29 ILE 6.48 2.55 1 30 ASN 2.88 1.86 1 31 LEU 1.73 2.21 1 33 LEU 6.56 -0.06 1 35 PHE 0.80 -0.91 1 37 LYS 0.42 -0.46 1 38 VAL -1.23 -0.11 1 39 THR 1.79 1.10 1 40 ASN -5.21 -2.22 1 41 TYR -3.39 -3.63 1 42 ILE -4.10 -2.01 1 43 LEU -0.41 -2.50 1 44 MET -0.04 -0.67 1 45 LYS 4.62 3.48 1 46 SER 4.29 0.92 1 47 THR -0.42 -0.56 1 49 GLN -6.07 -2.39 1 50 ALA -6.13 -2.93 1 52 LEU -5.72 -3.96 1 53 GLU -6.16 -2.17 1 54 MET -3.29 1.67 1 55 ALA 2.95 -1.14 1 56 TYR -4.83 1.13 1 57 THR 4.54 1.74 1 58 GLU 6.26 2.26 1 59 ALA 0.97 0.99 1 60 ALA 4.25 0.08 1 61 GLN 3.92 3.00 1 62 ALA 3.33 2.05 1 63 MET 3.67 0.18 1 64 VAL 5.85 2.39 1 65 GLN 4.34 2.21 1 66 TYR 4.40 2.24 1 67 TYR 2.52 0.90 1 68 GLN 3.51 1.71 1 69 GLU 0.31 0.30 1 70 LYS -0.62 -3.20 1 72 ALA -0.96 -2.03 1 73 ILE -2.83 0.36 1 74 ILE -2.40 -1.09 1 75 ASN 2.36 0.15 1 77 GLU -2.70 -2.54 1 78 LYS -0.31 0.26 1 79 LEU -0.60 -0.83 1 80 LEU -0.78 -2.50 1 81 ILE -0.56 -1.44 1 82 ARG -5.98 -1.17 1 83 MET 1.84 2.37 1 84 SER -1.14 2.66 1 85 THR 1.43 0.05 1 86 ARG -1.62 -1.44 1 87 TYR -2.01 -0.91 1 88 LYS 0.25 -0.82 1 89 GLU -4.20 -2.69 1 90 LEU -3.65 -1.05 1 91 GLN -1.53 0.13 1 92 LEU 3.29 0.13 1 93 LYS 0.48 -0.36 1 97 LYS 0.01 0.06 1 98 ASN 0.61 0.98 1 100 ALA 3.25 2.08 1 101 ALA 2.52 1.86 1 102 ILE 3.57 1.31 1 103 ILE -1.15 1.00 1 104 GLN 3.39 1.37 1 105 ASP 2.19 2.03 1 106 ILE 3.43 1.75 1 107 HIS 1.85 2.08 1 108 SER 1.70 0.43 1 109 GLN 1.17 0.24 1 110 ARG 0.13 0.02 1 111 GLU -0.23 -1.10 1 stop_ save_