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 bmr10031_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.45 _LACS_plot.Line_1_terminator_val_y_1 -2.93 _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 -1.44 _LACS_plot.Line_2_terminator_val_x_2 7.86 _LACS_plot.Line_2_terminator_val_y_2 6.10 _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 29 TYR -6.37 -0.77 0 36 GLU -6.90 -1.21 0 76 LYS 5.77 0.92 0 10 ASP 1.52 1.20 1 11 LEU 0.25 0.08 1 12 ILE 2.46 0.23 1 13 THR -2.39 -1.88 1 14 VAL 4.53 3.16 1 16 SER 2.00 2.44 1 17 LEU -3.02 -1.32 1 18 ILE -4.19 0.34 1 19 GLU -0.82 0.49 1 20 LEU -6.40 -2.39 1 21 GLN -0.44 0.78 1 22 ASP -0.59 1.46 1 23 SER 2.95 2.59 1 24 GLN -0.53 0.55 1 25 ASN -2.90 -1.94 1 27 PHE -0.82 -2.48 1 28 GLN -4.57 -1.98 1 30 TRP -7.45 -3.10 1 31 ILE -1.17 -0.30 1 32 VAL -7.05 -4.40 1 33 SER -5.65 -2.94 1 34 VAL 1.63 0.79 1 35 ILE 0.86 -1.13 1 37 ASN -1.25 -0.99 1 38 VAL -0.22 -1.32 1 41 ARG 2.09 0.98 1 42 LEU -2.66 -2.07 1 43 ARG -1.41 -1.22 1 44 LEU -3.84 -1.73 1 45 ARG -5.49 -1.85 1 46 TYR 2.11 1.52 1 47 VAL 3.19 1.75 1 49 LEU 0.30 -1.50 1 50 GLU 5.04 4.07 1 51 ASP 0.22 -0.20 1 52 THR -1.23 -0.92 1 53 GLU -1.80 -0.68 1 54 SER 3.66 3.03 1 55 TYR -0.65 -1.09 1 56 ASP 2.41 1.39 1 57 GLN -5.91 -2.44 1 58 TRP -2.88 -1.36 1 59 LEU -5.52 -0.90 1 60 PHE -0.10 0.48 1 61 TYR 4.32 2.45 1 62 LEU -0.95 -1.63 1 63 ASP -0.70 2.03 1 64 TYR 2.43 1.57 1 65 ARG 0.75 1.88 1 66 LEU -0.75 -0.98 1 67 ARG -6.23 -2.72 1 69 VAL 4.94 2.38 1 71 TRP 3.28 3.27 1 73 GLN 4.02 2.93 1 74 GLU 2.97 2.31 1 75 ASN 0.17 0.64 1 77 TYR -2.42 -3.07 1 78 ARG -2.02 -0.27 1 79 MET -1.71 -1.70 1 80 ASP -3.35 1.20 1 83 SER 4.78 3.69 1 84 GLU 2.62 2.40 1 85 ILE -1.62 -1.40 1 86 TYR 7.87 6.42 1 88 LEU 1.98 1.81 1 89 LYS -4.13 -2.37 1 90 MET -1.30 -0.11 1 91 ALA 5.02 4.42 1 92 SER 4.92 2.80 1 93 GLU 2.01 1.99 1 94 TRP 2.77 3.01 1 95 LYS 4.35 3.65 1 97 THR 6.21 5.46 1 98 LEU 4.40 3.49 1 99 GLU 3.80 3.34 1 100 LYS 3.82 3.28 1 101 SER 5.04 4.57 1 102 LEU 3.80 2.73 1 103 ILE 4.39 3.45 1 104 ASP 4.21 3.40 1 105 ALA 2.18 2.05 1 106 ALA 1.53 0.86 1 107 LYS 1.95 2.05 1 108 PHE -1.03 -0.76 1 110 LEU -1.13 -0.17 1 112 MET 3.06 1.92 1 113 GLU 3.12 2.62 1 114 VAL 3.99 2.84 1 115 PHE -0.13 -0.14 1 116 LYS 1.08 1.22 1 117 ASP 0.44 0.44 1 118 HIS 0.42 1.72 1 119 ALA 0.12 0.50 1 120 ASP 0.28 0.23 1 121 LEU 0.36 0.15 1 122 SER 0.04 0.30 1 125 SER -0.04 0.06 1 126 SER -0.11 0.11 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10031_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.45 _LACS_plot.Line_1_terminator_val_y_1 4.52 _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 0.56 _LACS_plot.Line_2_terminator_val_x_2 7.86 _LACS_plot.Line_2_terminator_val_y_2 -1.76 _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 29 TYR -6.37 5.60 0 36 GLU -6.90 5.69 0 76 LYS 5.77 -4.85 0 10 ASP 1.52 -0.32 1 11 LEU 0.25 -0.17 1 12 ILE 2.46 -2.23 1 13 THR -2.39 0.51 1 14 VAL 4.53 -1.37 1 16 SER 2.00 0.44 1 17 LEU -3.02 1.70 1 18 ILE -4.19 4.53 1 19 GLU -0.82 1.31 1 20 LEU -6.40 4.01 1 21 GLN -0.44 1.22 1 22 ASP -0.59 2.05 1 23 SER 2.95 -0.36 1 24 GLN -0.53 1.08 1 25 ASN -2.90 0.96 1 27 PHE -0.82 -1.66 1 28 GLN -4.57 2.59 1 30 TRP -7.45 4.35 1 31 ILE -1.17 0.87 1 32 VAL -7.05 2.65 1 33 SER -5.65 2.71 1 34 VAL 1.63 -0.84 1 35 ILE 0.86 -1.99 1 37 ASN -1.25 0.26 1 38 VAL -0.22 -1.10 1 41 ARG 2.09 -1.11 1 42 LEU -2.66 0.59 1 43 ARG -1.41 0.19 1 44 LEU -3.84 2.11 1 45 ARG -5.49 3.64 1 46 TYR 2.11 -0.59 1 47 VAL 3.19 -1.44 1 49 LEU 0.30 -1.80 1 50 GLU 5.04 -0.97 1 51 ASP 0.22 -0.42 1 52 THR -1.23 0.31 1 53 GLU -1.80 1.12 1 54 SER 3.66 -0.63 1 55 TYR -0.65 -0.44 1 56 ASP 2.41 -1.02 1 57 GLN -5.91 3.47 1 58 TRP -2.88 1.52 1 59 LEU -5.52 4.62 1 60 PHE -0.10 0.58 1 61 TYR 4.32 -1.87 1 62 LEU -0.95 -0.68 1 63 ASP -0.70 2.73 1 64 TYR 2.43 -0.86 1 65 ARG 0.75 1.13 1 66 LEU -0.75 -0.23 1 67 ARG -6.23 3.51 1 69 VAL 4.94 -2.56 1 71 TRP 3.28 -0.01 1 73 GLN 4.02 -1.09 1 74 GLU 2.97 -0.66 1 75 ASN 0.17 0.47 1 77 TYR -2.42 -0.65 1 78 ARG -2.02 1.75 1 79 MET -1.71 0.01 1 80 ASP -3.35 4.55 1 83 SER 4.78 -1.09 1 84 GLU 2.62 -0.22 1 85 ILE -1.62 0.22 1 86 TYR 7.87 -1.45 1 88 LEU 1.98 -0.17 1 89 LYS -4.13 1.76 1 90 MET -1.30 1.19 1 91 ALA 5.02 -0.60 1 92 SER 4.92 -2.12 1 93 GLU 2.01 -0.02 1 94 TRP 2.77 0.24 1 95 LYS 4.35 -0.70 1 97 THR 6.21 -0.75 1 98 LEU 4.40 -0.91 1 99 GLU 3.80 -0.46 1 100 LYS 3.82 -0.54 1 101 SER 5.04 -0.47 1 102 LEU 3.80 -1.07 1 103 ILE 4.39 -0.94 1 104 ASP 4.21 -0.81 1 105 ALA 2.18 -0.13 1 106 ALA 1.53 -0.67 1 107 LYS 1.95 0.10 1 108 PHE -1.03 0.27 1 110 LEU -1.13 0.96 1 112 MET 3.06 -1.14 1 113 GLU 3.12 -0.50 1 114 VAL 3.99 -1.15 1 115 PHE -0.13 -0.01 1 116 LYS 1.08 0.14 1 117 ASP 0.44 0.00 1 118 HIS 0.42 1.30 1 119 ALA 0.12 0.38 1 120 ASP 0.28 -0.05 1 121 LEU 0.36 -0.21 1 122 SER 0.04 0.26 1 125 SER -0.04 0.10 1 126 SER -0.11 0.22 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10031_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.45 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 7.86 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 ARG -6.23 -0.51 0 21 GLN -0.44 -1.29 0 10 ASP 1.52 -0.33 1 11 LEU 0.25 -0.21 1 12 ILE 2.46 -0.21 1 13 THR -2.39 0.05 1 14 VAL 4.53 -0.65 1 16 SER 2.00 -0.05 1 17 LEU -3.02 1.21 1 18 ILE -4.19 0.10 1 19 GLU -0.82 0.45 1 20 LEU -6.40 0.92 1 22 ASP -0.59 -0.42 1 23 SER 2.95 -0.44 1 24 GLN -0.53 0.12 1 25 ASN -2.90 -0.01 1 27 PHE -0.82 -0.14 1 28 GLN -4.57 1.58 1 29 TYR -6.37 0.70 1 30 TRP -7.45 0.68 1 31 ILE -1.17 0.75 1 32 VAL -7.05 1.16 1 33 SER -5.65 1.06 1 34 VAL 1.63 -0.12 1 35 ILE 0.86 -0.09 1 36 GLU -6.90 0.12 1 37 ASN -1.25 0.29 1 38 VAL -0.22 0.28 1 41 ARG 2.09 0.23 1 42 LEU -2.66 0.76 1 43 ARG -1.41 -0.40 1 44 LEU -3.84 0.81 1 45 ARG -5.49 0.54 1 46 TYR 2.11 0.34 1 47 VAL 3.19 0.29 1 49 LEU 0.30 0.41 1 50 GLU 5.04 -0.58 1 51 ASP 0.22 -0.04 1 52 THR -1.23 0.38 1 53 GLU -1.80 0.34 1 54 SER 3.66 -0.51 1 55 TYR -0.65 0.32 1 56 ASP 2.41 0.14 1 57 GLN -5.91 0.48 1 58 TRP -2.88 1.30 1 59 LEU -5.52 0.54 1 60 PHE -0.10 0.52 1 61 TYR 4.32 -0.54 1 62 LEU -0.95 -0.35 1 63 ASP -0.70 -0.37 1 64 TYR 2.43 -0.23 1 65 ARG 0.75 -0.46 1 66 LEU -0.75 0.84 1 69 VAL 4.94 -0.20 1 71 TRP 3.28 -0.63 1 73 GLN 4.02 -0.26 1 74 GLU 2.97 -0.50 1 75 ASN 0.17 -0.74 1 76 LYS 5.77 -0.44 1 77 TYR -2.42 0.64 1 78 ARG -2.02 0.21 1 79 MET -1.71 1.31 1 80 ASP -3.35 0.15 1 83 SER 4.78 -0.59 1 84 GLU 2.62 -0.27 1 85 ILE -1.62 0.17 1 86 TYR 7.87 -1.06 1 88 LEU 1.98 -0.30 1 89 LYS -4.13 0.06 1 90 MET -1.30 -0.03 1 91 ALA 5.02 0.00 1 92 SER 4.92 -0.23 1 93 GLU 2.01 -0.08 1 94 TRP 2.77 0.16 1 95 LYS 4.35 0.05 1 97 THR 6.21 -0.28 1 98 LEU 4.40 -0.50 1 99 GLU 3.80 -0.44 1 100 LYS 3.82 -0.22 1 101 SER 5.04 -0.17 1 102 LEU 3.80 -0.34 1 103 ILE 4.39 -0.36 1 104 ASP 4.21 -0.20 1 105 ALA 2.18 -0.15 1 106 ALA 1.53 -0.14 1 107 LYS 1.95 -0.36 1 108 PHE -1.03 0.18 1 110 LEU -1.13 0.11 1 112 MET 3.06 -0.01 1 113 GLU 3.12 -0.28 1 114 VAL 3.99 -0.52 1 115 PHE -0.13 0.01 1 116 LYS 1.08 -0.08 1 117 ASP 0.44 0.04 1 118 HIS 0.42 -0.20 1 119 ALA 0.12 -0.01 1 120 ASP 0.28 0.04 1 121 LEU 0.36 0.08 1 122 SER 0.04 0.08 1 125 SER -0.04 0.05 1 126 SER -0.11 0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10031_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.45 _LACS_plot.Line_1_terminator_val_y_1 -2.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 7.86 _LACS_plot.Line_2_terminator_val_y_2 2.39 _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 61 TYR 4.32 -3.07 0 86 TYR 7.87 -1.46 0 10 ASP 1.52 0.72 1 11 LEU 0.25 -0.79 1 12 ILE 2.46 -1.27 1 13 THR -2.39 1.56 1 14 VAL 4.53 0.93 1 16 SER 2.00 -2.92 1 17 LEU -3.02 -1.32 1 18 ILE -4.19 -1.97 1 19 GLU -0.82 -1.55 1 20 LEU -6.40 -1.23 1 21 GLN -0.44 -1.43 1 22 ASP -0.59 0.03 1 23 SER 2.95 0.18 1 24 GLN -0.53 -0.22 1 25 ASN -2.90 -1.07 1 27 PHE -0.82 -2.41 1 28 GLN -4.57 -3.51 1 29 TYR -6.37 -2.14 1 30 TRP -7.45 -2.08 1 31 ILE -1.17 -1.81 1 32 VAL -7.05 -2.65 1 33 SER -5.65 0.46 1 34 VAL 1.63 -0.17 1 35 ILE 0.86 -0.38 1 36 GLU -6.90 -2.81 1 37 ASN -1.25 -0.52 1 38 VAL -0.22 1.48 1 41 ARG 2.09 -1.93 1 42 LEU -2.66 -2.77 1 43 ARG -1.41 -1.46 1 44 LEU -3.84 -2.45 1 45 ARG -5.49 0.31 1 46 TYR 2.11 1.19 1 47 VAL 3.19 0.90 1 49 LEU 0.30 -1.22 1 50 GLU 5.04 0.22 1 51 ASP 0.22 -0.83 1 52 THR -1.23 -1.76 1 53 GLU -1.80 2.59 1 54 SER 3.66 -1.11 1 55 TYR -0.65 1.03 1 56 ASP 2.41 -0.79 1 57 GLN -5.91 -2.38 1 58 TRP -2.88 0.54 1 59 LEU -5.52 -1.85 1 60 PHE -0.10 2.45 1 62 LEU -0.95 -1.03 1 63 ASP -0.70 1.42 1 64 TYR 2.43 0.51 1 65 ARG 0.75 0.00 1 69 VAL 4.94 1.60 1 77 TYR -2.42 -1.43 1 78 ARG -2.02 -2.25 1 79 MET -1.71 -0.91 1 80 ASP -3.35 -2.30 1 83 SER 4.78 1.90 1 84 GLU 2.62 0.10 1 85 ILE -1.62 -1.32 1 88 LEU 1.98 -0.37 1 89 LYS -4.13 -1.92 1 90 MET -1.30 1.84 1 91 ALA 5.02 3.13 1 92 SER 4.92 2.56 1 93 GLU 2.01 3.76 1 94 TRP 2.77 2.75 1 95 LYS 4.35 1.99 1 97 THR 6.21 2.25 1 98 LEU 4.40 0.30 1 99 GLU 3.80 3.00 1 100 LYS 3.82 2.29 1 101 SER 5.04 0.85 1 102 LEU 3.80 2.99 1 103 ILE 4.39 2.53 1 104 ASP 4.21 2.79 1 105 ALA 2.18 1.01 1 106 ALA 1.53 1.49 1 107 LYS 1.95 0.05 1 108 PHE -1.03 -2.16 1 110 LEU -1.13 -0.11 1 112 MET 3.06 2.26 1 113 GLU 3.12 0.83 1 114 VAL 3.99 -1.14 1 115 PHE -0.13 0.43 1 116 LYS 1.08 -0.29 1 117 ASP 0.44 -0.07 1 118 HIS 0.42 1.18 1 119 ALA 0.12 -0.28 1 120 ASP 0.28 0.16 1 121 LEU 0.36 0.00 1 122 SER 0.04 -0.05 1 125 SER -0.04 0.14 1 126 SER -0.11 -0.63 1 stop_ save_