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 bmr17750_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 -2.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _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 4.88 _LACS_plot.Line_2_terminator_val_y_2 3.64 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 ILE -2.26 -3.81 0 63 ASP -5.58 0.63 0 58 ILE -1.66 -3.81 0 19 LEU 0.30 0.25 1 20 GLN 0.39 0.28 1 21 ARG -0.26 -0.08 1 22 ALA -0.21 0.09 1 23 ASN 0.15 0.26 1 24 SER 0.04 0.19 1 25 ASP 0.64 0.49 1 26 THR 0.41 0.26 1 27 ASP 0.41 0.33 1 28 LEU 0.27 0.22 1 29 VAL 0.84 0.44 1 30 THR -0.16 -0.12 1 31 SER 0.42 0.35 1 32 GLU -0.36 0.00 1 33 SER 0.08 -0.21 1 34 ARG -2.36 -1.06 1 35 SER 1.90 1.61 1 36 SER -4.46 -1.37 1 37 LEU -5.78 -1.47 1 38 THR -5.38 -2.06 1 39 ALA -8.20 -3.07 1 40 SER 2.74 1.55 1 41 MET -3.19 -0.54 1 42 TYR 2.02 1.24 1 43 GLU -4.48 -1.28 1 44 TYR -4.83 -0.70 1 45 THR 0.03 -0.36 1 46 LEU 2.30 1.94 1 48 GLN 0.12 -0.24 1 49 ALA 2.06 1.81 1 50 GLN 0.37 0.28 1 51 ASN -0.47 0.07 1 52 LEU -1.65 0.14 1 53 ILE -2.32 -1.06 1 55 PHE -2.43 -1.67 1 56 TRP -5.46 -1.74 1 57 ASP -0.02 -0.22 1 59 LYS 0.30 -1.23 1 60 GLU 0.92 0.47 1 61 GLU 0.95 0.93 1 62 VAL -6.05 -2.69 1 65 SER 1.30 1.28 1 66 ASP 1.85 1.29 1 67 TRP -4.21 -2.89 1 68 ILE -6.78 -2.69 1 70 LEU -2.50 -0.02 1 71 TYR -5.38 -1.71 1 73 ILE 0.49 0.68 1 74 ASP -0.16 0.14 1 75 GLU -1.92 -0.46 1 76 ASN -1.59 0.04 1 77 SER -1.19 -0.95 1 79 ALA 1.40 0.88 1 80 ASN 1.11 -1.27 1 81 PHE -0.09 -1.92 1 82 TRP -3.43 -2.51 1 83 ASP -3.93 -1.12 1 84 SER -1.38 0.19 1 85 LYS -2.71 0.90 1 86 ASN -1.50 0.51 1 87 ARG 4.88 3.50 1 89 VAL 3.68 0.35 1 90 THR 2.02 2.12 1 92 THR -2.26 -1.89 1 93 GLN 4.79 3.91 1 94 LYS -5.46 -2.62 1 96 GLN -5.28 -2.32 1 97 ILE -5.62 -1.44 1 98 VAL 0.37 -0.19 1 99 TRP -3.17 -0.21 1 100 ARG -0.34 -0.13 1 101 ILE 1.14 0.06 1 102 GLU -1.28 -0.47 1 106 TYR 2.48 -0.75 1 107 PHE -2.62 -2.62 1 108 MET -0.12 0.03 1 109 GLU 0.14 0.88 1 111 GLU -5.08 -1.44 1 112 ILE -3.85 -0.05 1 113 LYS -1.17 -0.33 1 114 ILE -6.58 -2.53 1 116 PHE -3.14 -1.89 1 118 TYR -4.04 -2.20 1 119 TYR -3.75 -0.94 1 122 ILE 1.32 -0.31 1 123 SER 0.26 0.41 1 125 ALA -0.13 0.50 1 126 LEU 0.28 -0.27 1 127 ARG -3.21 -1.28 1 128 ALA -3.45 -0.34 1 129 THR -2.98 -0.53 1 130 THR 0.74 1.22 1 133 ILE -3.03 -0.81 1 134 THR 1.83 1.41 1 135 VAL -0.31 -1.20 1 136 LYS -2.95 -1.40 1 137 ASN -2.10 -0.93 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17750_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 5.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _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 4.88 _LACS_plot.Line_2_terminator_val_y_2 -1.24 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 ILE -2.26 -1.55 0 63 ASP -5.58 6.21 0 58 ILE -1.66 -2.15 0 19 LEU 0.30 -0.05 1 20 GLN 0.39 -0.11 1 21 ARG -0.26 0.18 1 22 ALA -0.21 0.30 1 23 ASN 0.15 0.11 1 24 SER 0.04 0.15 1 25 ASP 0.64 -0.15 1 26 THR 0.41 -0.15 1 27 ASP 0.41 -0.08 1 28 LEU 0.27 -0.05 1 29 VAL 0.84 -0.40 1 30 THR -0.16 0.04 1 31 SER 0.42 -0.07 1 32 GLU -0.36 0.36 1 33 SER 0.08 -0.29 1 34 ARG -2.36 1.30 1 35 SER 1.90 -0.29 1 36 SER -4.46 3.09 1 37 LEU -5.78 4.31 1 38 THR -5.38 3.32 1 39 ALA -8.20 5.13 1 40 SER 2.74 -1.19 1 41 MET -3.19 2.65 1 42 TYR 2.02 -0.78 1 43 GLU -4.48 3.20 1 44 TYR -4.83 4.13 1 45 THR 0.03 -0.39 1 46 LEU 2.30 -0.36 1 48 GLN 0.12 -0.36 1 49 ALA 2.06 -0.25 1 50 GLN 0.37 -0.09 1 51 ASN -0.47 0.54 1 52 LEU -1.65 1.79 1 53 ILE -2.32 1.26 1 55 PHE -2.43 0.76 1 56 TRP -5.46 3.72 1 57 ASP -0.02 -0.20 1 59 LYS 0.30 -1.53 1 60 GLU 0.92 -0.45 1 61 GLU 0.95 -0.02 1 62 VAL -6.05 3.36 1 65 SER 1.30 -0.02 1 66 ASP 1.85 -0.56 1 67 TRP -4.21 1.32 1 68 ILE -6.78 4.09 1 70 LEU -2.50 2.48 1 71 TYR -5.38 3.67 1 73 ILE 0.49 0.19 1 74 ASP -0.16 0.30 1 75 GLU -1.92 1.46 1 76 ASN -1.59 1.63 1 77 SER -1.19 0.24 1 79 ALA 1.40 -0.52 1 80 ASN 1.11 -2.38 1 81 PHE -0.09 -1.83 1 82 TRP -3.43 0.92 1 83 ASP -3.93 2.81 1 84 SER -1.38 1.57 1 85 LYS -2.71 3.61 1 86 ASN -1.50 2.01 1 87 ARG 4.88 -1.38 1 89 VAL 3.68 -3.33 1 90 THR 2.02 0.10 1 92 THR -2.26 0.37 1 93 GLN 4.79 -0.88 1 94 LYS -5.46 2.84 1 96 GLN -5.28 2.96 1 97 ILE -5.62 4.18 1 98 VAL 0.37 -0.56 1 99 TRP -3.17 2.96 1 100 ARG -0.34 0.21 1 101 ILE 1.14 -1.08 1 102 GLU -1.28 0.81 1 106 TYR 2.48 -3.23 1 107 PHE -2.62 0.00 1 108 MET -0.12 0.15 1 109 GLU 0.14 0.74 1 111 GLU -5.08 3.64 1 112 ILE -3.85 3.80 1 113 LYS -1.17 0.84 1 114 ILE -6.58 4.05 1 116 PHE -3.14 1.25 1 118 TYR -4.04 1.84 1 119 TYR -3.75 2.81 1 122 ILE 1.32 -1.63 1 123 SER 0.26 0.15 1 125 ALA -0.13 0.63 1 126 LEU 0.28 -0.55 1 127 ARG -3.21 1.93 1 128 ALA -3.45 3.11 1 129 THR -2.98 2.45 1 130 THR 0.74 0.48 1 133 ILE -3.03 2.22 1 134 THR 1.83 -0.42 1 135 VAL -0.31 -0.89 1 136 LYS -2.95 1.55 1 137 ASN -2.10 1.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17750_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 0.85 _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 0.15 _LACS_plot.Line_2_terminator_val_x_2 4.88 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 PHE -0.09 -0.94 0 84 SER -1.38 1.15 0 39 ALA -8.20 1.40 0 71 TYR -5.38 -0.37 0 19 LEU 0.30 -0.13 1 20 GLN 0.39 -0.16 1 21 ARG -0.26 -0.15 1 22 ALA -0.21 -0.13 1 23 ASN 0.15 -0.15 1 24 SER 0.04 -0.11 1 25 ASP 0.64 -0.08 1 26 THR 0.41 -0.16 1 27 ASP 0.41 -0.13 1 28 LEU 0.27 -0.12 1 29 VAL 0.84 -0.08 1 30 THR -0.16 -0.06 1 31 SER 0.42 -0.13 1 32 GLU -0.36 -0.13 1 33 SER 0.08 -0.12 1 34 ARG -2.36 0.13 1 35 SER 1.90 0.28 1 36 SER -4.46 0.18 1 37 LEU -5.78 0.94 1 38 THR -5.38 0.43 1 40 SER 2.74 -0.32 1 41 MET -3.19 -0.03 1 42 TYR 2.02 0.16 1 43 GLU -4.48 0.83 1 44 TYR -4.83 -0.05 1 45 THR 0.03 0.41 1 46 LEU 2.30 -0.40 1 48 GLN 0.12 -0.10 1 49 ALA 2.06 -0.29 1 50 GLN 0.37 -0.14 1 51 ASN -0.47 0.13 1 52 LEU -1.65 -0.24 1 53 ILE -2.32 0.20 1 54 ILE -2.26 0.55 1 55 PHE -2.43 0.38 1 56 TRP -5.46 0.95 1 57 ASP -0.02 0.22 1 58 ILE -1.66 0.07 1 59 LYS 0.30 -0.18 1 60 GLU 0.92 -0.24 1 61 GLU 0.95 -0.24 1 62 VAL -6.05 0.70 1 63 ASP -5.58 0.36 1 65 SER 1.30 -0.07 1 66 ASP 1.85 -0.15 1 67 TRP -4.21 0.18 1 68 ILE -6.78 1.16 1 70 LEU -2.50 -0.43 1 73 ILE 0.49 -0.40 1 74 ASP -0.16 0.03 1 75 GLU -1.92 -0.30 1 76 ASN -1.59 -0.18 1 77 SER -1.19 0.12 1 79 ALA 1.40 -0.06 1 80 ASN 1.11 0.04 1 82 TRP -3.43 0.05 1 83 ASP -3.93 0.57 1 85 LYS -2.71 0.05 1 86 ASN -1.50 0.11 1 87 ARG 4.88 -0.41 1 89 VAL 3.68 -0.06 1 90 THR 2.02 -0.17 1 92 THR -2.26 0.22 1 93 GLN 4.79 -0.27 1 94 LYS -5.46 0.71 1 96 GLN -5.28 0.92 1 97 ILE -5.62 0.42 1 98 VAL 0.37 0.25 1 99 TRP -3.17 -0.33 1 100 ARG -0.34 0.19 1 101 ILE 1.14 -0.02 1 102 GLU -1.28 0.08 1 106 TYR 2.48 -0.78 1 107 PHE -2.62 0.24 1 108 MET -0.12 0.06 1 109 GLU 0.14 -0.09 1 111 GLU -5.08 0.93 1 112 ILE -3.85 0.38 1 113 LYS -1.17 0.61 1 114 ILE -6.58 0.89 1 116 PHE -3.14 1.19 1 118 TYR -4.04 0.03 1 119 TYR -3.75 0.25 1 122 ILE 1.32 -0.42 1 123 SER 0.26 -0.08 1 125 ALA -0.13 -0.20 1 126 LEU 0.28 -0.49 1 127 ARG -3.21 -0.05 1 128 ALA -3.45 0.02 1 129 THR -2.98 0.88 1 130 THR 0.74 0.70 1 133 ILE -3.03 0.56 1 134 THR 1.83 0.19 1 135 VAL -0.31 0.88 1 136 LYS -2.95 0.71 1 137 ASN -2.10 0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17750_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 -2.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.20 _LACS_plot.Line_2_terminator_val_x_2 4.88 _LACS_plot.Line_2_terminator_val_y_2 0.59 _LACS_plot.Y_axis_chem_shift_offset 0.67 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 ALA -8.20 -0.05 0 19 LEU 0.30 -0.18 1 20 GLN 0.39 -0.08 1 21 ARG -0.26 -0.34 1 22 ALA -0.21 -0.31 1 23 ASN 0.15 0.08 1 24 SER 0.04 -0.17 1 25 ASP 0.64 0.30 1 26 THR 0.41 -0.32 1 27 ASP 0.41 -0.24 1 28 LEU 0.27 -0.22 1 29 VAL 0.84 0.25 1 30 THR -0.16 0.01 1 31 SER 0.42 0.01 1 32 GLU -0.36 -0.30 1 33 SER 0.08 -0.54 1 34 ARG -2.36 -0.24 1 35 SER 1.90 -1.14 1 36 SER -4.46 -3.63 1 37 LEU -5.78 -2.44 1 38 THR -5.38 -2.56 1 40 SER 2.74 -0.70 1 41 MET -3.19 -3.80 1 42 TYR 2.02 -1.37 1 43 GLU -4.48 -2.59 1 44 TYR -4.83 -2.42 1 45 THR 0.03 -1.58 1 46 LEU 2.30 0.09 1 48 GLN 0.12 -0.37 1 49 ALA 2.06 0.95 1 50 GLN 0.37 0.04 1 51 ASN -0.47 -0.18 1 52 LEU -1.65 -3.19 1 53 ILE -2.32 -2.30 1 54 ILE -2.26 -1.84 1 55 PHE -2.43 0.44 1 56 TRP -5.46 -1.49 1 57 ASP -0.02 -1.93 1 58 ILE -1.66 0.56 1 59 LYS 0.30 1.41 1 60 GLU 0.92 -3.44 1 61 GLU 0.95 0.15 1 65 SER 1.30 -0.86 1 66 ASP 1.85 -2.70 1 67 TRP -4.21 -4.12 1 68 ILE -6.78 -0.49 1 70 LEU -2.50 -2.80 1 71 TYR -5.38 -1.21 1 74 ASP -0.16 -0.35 1 75 GLU -1.92 -1.58 1 76 ASN -1.59 0.77 1 79 ALA 1.40 0.36 1 80 ASN 1.11 -1.34 1 81 PHE -0.09 0.28 1 82 TRP -3.43 0.04 1 83 ASP -3.93 -1.93 1 84 SER -1.38 -2.68 1 85 LYS -2.71 -3.10 1 87 ARG 4.88 -0.16 1 89 VAL 3.68 1.04 1 90 THR 2.02 1.19 1 92 THR -2.26 1.37 1 93 GLN 4.79 -1.51 1 94 LYS -5.46 -0.02 1 96 GLN -5.28 -2.37 1 97 ILE -5.62 -4.46 1 98 VAL 0.37 -1.25 1 99 TRP -3.17 -1.78 1 100 ARG -0.34 -1.24 1 101 ILE 1.14 -1.75 1 106 TYR 2.48 -0.60 1 107 PHE -2.62 -0.56 1 108 MET -0.12 0.75 1 111 GLU -5.08 -1.70 1 112 ILE -3.85 -2.58 1 113 LYS -1.17 -1.32 1 114 ILE -6.58 -2.01 1 116 PHE -3.14 -0.70 1 118 TYR -4.04 -1.93 1 119 TYR -3.75 -1.97 1 123 SER 0.26 0.47 1 125 ALA -0.13 -0.64 1 126 LEU 0.28 0.15 1 127 ARG -3.21 0.37 1 128 ALA -3.45 -4.02 1 129 THR -2.98 0.63 1 133 ILE -3.03 -1.38 1 134 THR 1.83 -1.51 1 135 VAL -0.31 -0.91 1 136 LYS -2.95 -1.31 1 stop_ save_