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 bmr6007_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 -3.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 4.76 _LACS_plot.Line_2_terminator_val_y_2 3.85 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 ASN 3.29 5.90 0 24 LYS -8.04 -0.61 0 20 PHE -0.10 0.63 1 21 THR 1.31 0.26 1 22 GLN 1.76 0.48 1 23 THR -0.22 -0.68 1 25 THR -1.46 -0.07 1 26 PHE 3.96 4.19 1 27 HIS 3.95 4.90 1 28 GLU 1.28 2.27 1 29 ALA 3.18 2.61 1 30 SER 4.56 3.09 1 31 GLU 2.88 2.43 1 32 ASP 3.05 3.61 1 34 ILE 4.50 4.23 1 35 SER 4.41 3.39 1 36 ARG -0.27 0.14 1 39 THR -4.85 -1.97 1 40 LEU 0.57 1.68 1 41 SER -0.87 -0.06 1 44 GLN -2.00 0.02 1 45 THR -7.42 -3.58 1 47 SER 4.76 3.15 1 48 GLU 2.43 3.22 1 50 ASP 3.92 3.45 1 51 ALA 2.78 2.44 1 52 LEU 3.22 2.68 1 53 TYR 2.53 2.02 1 54 GLU 3.60 2.89 1 55 TYR 2.70 2.52 1 56 LEU 4.17 3.87 1 57 ARG 4.59 3.77 1 58 GLN 1.42 1.68 1 59 SER 0.53 1.47 1 60 VAL 1.15 1.46 1 62 ASN 3.19 3.07 1 63 GLU -1.10 -1.55 1 64 ALA -1.72 0.01 1 65 GLU -5.76 -2.33 1 66 ILE -8.29 -3.64 1 67 TRP -4.01 -0.38 1 68 LEU -6.16 -2.54 1 70 LEU -6.56 -1.76 1 71 ASN -4.40 0.33 1 72 ASP -0.12 -1.83 1 73 MET 2.68 1.62 1 74 ALA 0.87 0.44 1 75 ALA 2.04 0.71 1 76 GLU -1.44 -0.35 1 78 THR -0.41 -0.43 1 79 TRP -0.87 0.02 1 80 VAL -6.19 -3.42 1 81 ASP -2.21 -1.89 1 82 MET 3.99 1.32 1 83 THR -0.30 0.02 1 85 ALA -1.83 -1.07 1 86 ARG 1.33 0.75 1 87 ILE 0.92 1.06 1 88 ALA -0.98 0.14 1 89 TYR -1.00 0.26 1 90 LYS -4.78 -2.75 1 91 ASN -1.72 -2.65 1 92 TRP -1.19 -1.02 1 93 GLU 2.55 2.41 1 94 THR -0.85 -0.20 1 95 GLU 0.19 0.15 1 96 ILE 0.02 -0.05 1 97 THR 0.06 0.06 1 98 ALA -0.42 -0.18 1 99 GLN -0.27 -0.11 1 101 ASP 0.38 0.23 1 104 LYS -0.23 -0.04 1 105 THR -0.70 -0.31 1 106 GLU -0.98 -0.41 1 110 VAL -7.24 -4.46 1 111 LEU -2.80 -0.59 1 112 SER -2.96 -2.37 1 114 ALA 1.13 0.96 1 115 ALA -1.51 -1.85 1 116 ASN 2.93 1.34 1 118 LYS -1.06 -0.60 1 119 TRP -7.63 -5.03 1 120 PHE -4.65 -0.70 1 121 ASP -1.29 -0.39 1 122 LYS -6.11 -1.44 1 123 ARG 1.67 1.35 1 125 ARG 1.49 0.31 1 126 ASP 1.53 1.26 1 127 GLN -1.54 -0.60 1 128 LEU -2.59 0.14 1 130 TYR -2.27 -1.42 1 131 ILE -2.47 -0.73 1 133 GLN -6.29 -2.45 1 134 PHE -4.63 -1.54 1 136 ILE -0.76 0.12 1 137 VAL 1.07 1.76 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6007_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 4.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.76 _LACS_plot.Line_2_terminator_val_x_2 4.76 _LACS_plot.Line_2_terminator_val_y_2 -0.91 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 ASN 3.29 2.61 0 24 LYS -8.04 7.43 0 20 PHE -0.10 0.73 1 21 THR 1.31 -1.05 1 22 GLN 1.76 -1.28 1 23 THR -0.22 -0.46 1 25 THR -1.46 1.39 1 26 PHE 3.96 0.23 1 27 HIS 3.95 0.95 1 28 GLU 1.28 0.99 1 29 ALA 3.18 -0.57 1 30 SER 4.56 -1.47 1 31 GLU 2.88 -0.45 1 32 ASP 3.05 0.56 1 34 ILE 4.50 -0.27 1 35 SER 4.41 -1.02 1 36 ARG -0.27 0.41 1 39 THR -4.85 2.88 1 40 LEU 0.57 1.11 1 41 SER -0.87 0.81 1 44 GLN -2.00 2.02 1 45 THR -7.42 3.84 1 47 SER 4.76 -1.61 1 48 GLU 2.43 0.79 1 50 ASP 3.92 -0.47 1 51 ALA 2.78 -0.34 1 52 LEU 3.22 -0.54 1 53 TYR 2.53 -0.51 1 54 GLU 3.60 -0.71 1 55 TYR 2.70 -0.18 1 56 LEU 4.17 -0.30 1 57 ARG 4.59 -0.82 1 58 GLN 1.42 0.26 1 59 SER 0.53 0.94 1 60 VAL 1.15 0.31 1 62 ASN 3.19 -0.12 1 63 GLU -1.10 -0.45 1 64 ALA -1.72 1.73 1 65 GLU -5.76 3.43 1 66 ILE -8.29 4.65 1 67 TRP -4.01 3.63 1 68 LEU -6.16 3.62 1 70 LEU -6.56 4.80 1 71 ASN -4.40 4.73 1 72 ASP -0.12 -1.71 1 73 MET 2.68 -1.06 1 74 ALA 0.87 -0.43 1 75 ALA 2.04 -1.33 1 76 GLU -1.44 1.09 1 78 THR -0.41 -0.02 1 79 TRP -0.87 0.89 1 80 VAL -6.19 2.77 1 81 ASP -2.21 0.32 1 82 MET 3.99 -2.67 1 83 THR -0.30 0.32 1 85 ALA -1.83 0.76 1 86 ARG 1.33 -0.58 1 87 ILE 0.92 0.14 1 88 ALA -0.98 1.12 1 89 TYR -1.00 1.26 1 90 LYS -4.78 2.03 1 91 ASN -1.72 -0.93 1 92 TRP -1.19 0.17 1 93 GLU 2.55 -0.14 1 94 THR -0.85 0.65 1 95 GLU 0.19 -0.04 1 96 ILE 0.02 -0.07 1 97 THR 0.06 0.00 1 98 ALA -0.42 0.24 1 99 GLN -0.27 0.16 1 101 ASP 0.38 -0.15 1 104 LYS -0.23 0.19 1 105 THR -0.70 0.39 1 106 GLU -0.98 0.57 1 110 VAL -7.24 2.78 1 111 LEU -2.80 2.21 1 112 SER -2.96 0.59 1 114 ALA 1.13 -0.17 1 115 ALA -1.51 -0.34 1 116 ASN 2.93 -1.59 1 118 LYS -1.06 0.46 1 119 TRP -7.63 2.60 1 120 PHE -4.65 3.95 1 121 ASP -1.29 0.90 1 122 LYS -6.11 4.67 1 123 ARG 1.67 -0.32 1 125 ARG 1.49 -1.18 1 126 ASP 1.53 -0.27 1 127 GLN -1.54 0.94 1 128 LEU -2.59 2.73 1 130 TYR -2.27 0.85 1 131 ILE -2.47 1.74 1 133 GLN -6.29 3.84 1 134 PHE -4.63 3.09 1 136 ILE -0.76 0.88 1 137 VAL 1.07 0.69 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6007_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 1.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 4.76 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 PHE 3.96 -2.49 0 20 PHE -0.10 -0.29 1 21 THR 1.31 -0.18 1 22 GLN 1.76 0.10 1 23 THR -0.22 -0.20 1 24 LYS -8.04 0.76 1 25 THR -1.46 1.53 1 27 HIS 3.95 -1.03 1 28 GLU 1.28 -0.54 1 29 ALA 3.18 -1.37 1 30 SER 4.56 -1.00 1 31 GLU 2.88 -0.52 1 32 ASP 3.05 -0.26 1 34 ILE 4.50 0.03 1 35 SER 4.41 -0.17 1 36 ARG -0.27 0.12 1 39 THR -4.85 0.28 1 40 LEU 0.57 0.29 1 41 SER -0.87 -0.20 1 44 GLN -2.00 0.25 1 45 THR -7.42 -0.34 1 47 SER 4.76 -0.17 1 48 GLU 2.43 -0.33 1 49 ASN 3.29 -0.64 1 50 ASP 3.92 -0.12 1 51 ALA 2.78 -0.16 1 52 LEU 3.22 -0.45 1 53 TYR 2.53 -0.32 1 54 GLU 3.60 -0.66 1 55 TYR 2.70 -0.13 1 56 LEU 4.17 -0.83 1 57 ARG 4.59 -0.72 1 58 GLN 1.42 -0.28 1 59 SER 0.53 -0.26 1 60 VAL 1.15 -0.10 1 62 ASN 3.19 -0.54 1 63 GLU -1.10 -0.04 1 64 ALA -1.72 -0.14 1 65 GLU -5.76 0.90 1 66 ILE -8.29 0.78 1 67 TRP -4.01 0.47 1 68 LEU -6.16 0.68 1 70 LEU -6.56 0.97 1 71 ASN -4.40 0.53 1 72 ASP -0.12 -0.33 1 73 MET 2.68 -0.27 1 74 ALA 0.87 -0.12 1 75 ALA 2.04 -0.35 1 76 GLU -1.44 -0.05 1 78 THR -0.41 0.12 1 79 TRP -0.87 0.12 1 80 VAL -6.19 1.15 1 81 ASP -2.21 0.73 1 82 MET 3.99 0.02 1 83 THR -0.30 0.24 1 85 ALA -1.83 0.13 1 86 ARG 1.33 0.17 1 87 ILE 0.92 0.21 1 88 ALA -0.98 0.25 1 89 TYR -1.00 -0.21 1 90 LYS -4.78 -0.72 1 91 ASN -1.72 -0.49 1 92 TRP -1.19 -0.29 1 93 GLU 2.55 -0.30 1 94 THR -0.85 -0.02 1 95 GLU 0.19 -0.28 1 96 ILE 0.02 -0.02 1 97 THR 0.06 -0.07 1 98 ALA -0.42 -0.03 1 99 GLN -0.27 -0.06 1 101 ASP 0.38 -0.08 1 104 LYS -0.23 0.12 1 105 THR -0.70 0.07 1 106 GLU -0.98 0.09 1 110 VAL -7.24 1.11 1 111 LEU -2.80 0.25 1 112 SER -2.96 0.60 1 114 ALA 1.13 0.06 1 115 ALA -1.51 0.45 1 116 ASN 2.93 -0.61 1 118 LYS -1.06 0.12 1 119 TRP -7.63 1.41 1 120 PHE -4.65 0.49 1 121 ASP -1.29 0.89 1 122 LYS -6.11 0.22 1 123 ARG 1.67 0.26 1 125 ARG 1.49 0.21 1 127 GLN -1.54 0.41 1 128 LEU -2.59 0.09 1 130 TYR -2.27 0.44 1 131 ILE -2.47 0.82 1 133 GLN -6.29 1.29 1 134 PHE -4.63 0.28 1 136 ILE -0.76 0.23 1 137 VAL 1.07 -0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6007_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 -1.87 _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 -0.69 _LACS_plot.Line_2_terminator_val_x_2 4.76 _LACS_plot.Line_2_terminator_val_y_2 1.72 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 TRP -7.63 0.93 0 34 ILE 4.50 4.92 0 24 LYS -8.04 1.24 0 21 THR 1.31 1.20 1 22 GLN 1.76 -1.02 1 23 THR -0.22 0.68 1 25 THR -1.46 -0.26 1 26 PHE 3.96 0.82 1 27 HIS 3.95 3.76 1 28 GLU 1.28 2.57 1 29 ALA 3.18 -0.22 1 30 SER 4.56 2.65 1 31 GLU 2.88 2.27 1 32 ASP 3.05 2.93 1 35 SER 4.41 0.91 1 36 ARG -0.27 -0.10 1 39 THR -4.85 -0.54 1 40 LEU 0.57 0.44 1 41 SER -0.87 1.35 1 44 GLN -2.00 -1.16 1 45 THR -7.42 -0.79 1 47 SER 4.76 1.29 1 48 GLU 2.43 2.04 1 50 ASP 3.92 2.14 1 51 ALA 2.78 2.21 1 52 LEU 3.22 -0.12 1 53 TYR 2.53 0.43 1 54 GLU 3.60 2.56 1 55 TYR 2.70 2.92 1 56 LEU 4.17 1.11 1 57 ARG 4.59 1.17 1 58 GLN 1.42 1.14 1 59 SER 0.53 -0.11 1 60 VAL 1.15 -0.44 1 62 ASN 3.19 0.55 1 63 GLU -1.10 -1.07 1 64 ALA -1.72 -2.63 1 65 GLU -5.76 -1.47 1 66 ILE -8.29 -0.62 1 67 TRP -4.01 0.08 1 68 LEU -6.16 1.00 1 70 LEU -6.56 -1.71 1 72 ASP -0.12 -3.36 1 75 ALA 2.04 -0.95 1 76 GLU -1.44 0.77 1 79 TRP -0.87 0.23 1 83 THR -0.30 0.79 1 85 ALA -1.83 -0.59 1 86 ARG 1.33 1.54 1 87 ILE 0.92 -0.77 1 88 ALA -0.98 -0.93 1 89 TYR -1.00 -3.07 1 90 LYS -4.78 -3.06 1 93 GLU 2.55 -0.07 1 94 THR -0.85 -1.06 1 95 GLU 0.19 -0.41 1 96 ILE 0.02 0.01 1 97 THR 0.06 -0.70 1 98 ALA -0.42 -0.66 1 99 GLN -0.27 0.13 1 101 ASP 0.38 0.63 1 104 LYS -0.23 -0.06 1 105 THR -0.70 -0.51 1 110 VAL -7.24 -1.87 1 111 LEU -2.80 -1.90 1 112 SER -2.96 2.18 1 114 ALA 1.13 0.11 1 115 ALA -1.51 0.12 1 116 ASN 2.93 -0.51 1 118 LYS -1.06 -1.20 1 120 PHE -4.65 -1.41 1 121 ASP -1.29 -1.25 1 122 LYS -6.11 -1.92 1 123 ARG 1.67 1.73 1 125 ARG 1.49 0.15 1 126 ASP 1.53 -3.27 1 127 GLN -1.54 -0.86 1 128 LEU -2.59 -1.07 1 130 TYR -2.27 -4.29 1 131 ILE -2.47 0.34 1 133 GLN -6.29 -2.37 1 134 PHE -4.63 -0.35 1 stop_ save_