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 bmr19621_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.25 _LACS_plot.Line_1_terminator_val_y_1 -2.49 _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 -1.14 _LACS_plot.Line_2_terminator_val_x_2 5.93 _LACS_plot.Line_2_terminator_val_y_2 4.35 _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 130 TYR -1.86 1.54 0 49 PHE -7.25 -2.07 0 58 LEU -5.91 -0.90 0 10 LEU 1.43 2.11 1 11 PHE 0.55 0.51 1 12 GLU 3.10 2.94 1 13 SER 0.67 0.46 1 14 ALA 0.86 -0.05 1 15 SER -2.58 -1.15 1 16 ARG 5.15 3.82 1 19 LEU 3.99 2.98 1 20 ARG 4.90 3.39 1 22 LEU 2.26 2.31 1 23 SER 4.67 3.55 1 24 LEU 1.08 1.53 1 25 ILE 0.33 0.01 1 26 ILE 1.85 1.19 1 27 LYS -4.17 -2.68 1 28 THR -3.21 -1.47 1 29 SER -2.98 -1.15 1 30 PHE -4.07 -1.71 1 32 ALA -0.33 -0.48 1 35 GLU -1.69 -0.48 1 36 PHE 1.30 0.42 1 37 LEU 1.36 3.04 1 38 ILE -6.36 -2.11 1 39 ARG -2.49 -2.44 1 40 GLN 1.95 1.62 1 42 ASP -0.87 -0.39 1 43 ALA -0.37 -0.95 1 44 LEU -0.08 0.19 1 45 GLN -1.40 -0.20 1 46 ALA -3.85 -0.59 1 47 ILE -2.17 -1.07 1 48 TYR -4.39 -0.56 1 50 VAL 2.61 0.43 1 52 SER -1.17 -0.23 1 54 SER -4.29 -1.85 1 55 MET -5.82 -1.17 1 56 GLU -5.69 -2.37 1 57 VAL 0.50 -0.90 1 59 LYS -3.04 -0.57 1 60 ASP 4.38 2.48 1 61 ASN 1.29 0.99 1 62 THR -0.57 0.37 1 63 VAL 2.36 1.01 1 64 LEU -0.50 0.19 1 65 ALA -2.70 -0.66 1 66 ILE -1.44 -1.67 1 67 LEU -4.71 -2.70 1 69 LYS 1.74 1.25 1 71 ASP 0.04 1.12 1 72 LEU -6.05 -1.59 1 73 ILE -4.11 -1.57 1 75 SER -3.89 -2.43 1 76 ASP -1.07 -0.97 1 77 SER 1.61 0.04 1 78 LEU 0.79 1.25 1 79 THR 2.27 1.00 1 80 LYS -0.18 0.04 1 81 GLU 0.46 -0.11 1 82 GLN -0.91 -0.04 1 83 VAL 1.27 0.91 1 84 ILE -1.90 -0.81 1 85 LYS -1.83 -1.47 1 86 THR -1.44 -0.39 1 87 ASN -0.93 -0.41 1 88 ALA -3.34 -0.89 1 89 ASN -4.59 -1.19 1 90 VAL -0.88 -0.07 1 91 LYS -6.10 -2.07 1 92 ALA 0.67 1.16 1 93 LEU -0.20 0.87 1 94 THR -5.39 -2.57 1 95 TYR 3.62 2.99 1 97 ASP -2.20 -0.08 1 98 LEU -4.35 -0.78 1 99 GLN -5.34 -1.39 1 100 TYR -5.69 -2.02 1 101 ILE -4.23 -1.09 1 102 SER -0.05 -0.02 1 103 LEU 5.31 3.14 1 104 LYS 4.22 3.80 1 106 LEU 3.26 3.00 1 107 ARG 4.85 4.42 1 108 GLU 3.27 2.59 1 109 VAL 5.93 4.95 1 110 LEU 5.04 2.78 1 111 ARG 3.38 2.82 1 112 LEU 0.34 0.74 1 113 TYR -0.30 0.17 1 115 GLU 4.63 3.18 1 116 TYR 2.60 2.68 1 117 ALA 3.09 3.17 1 118 GLN 3.87 3.02 1 119 LYS 3.30 2.24 1 120 PHE 4.69 4.14 1 121 VAL 4.66 3.52 1 122 SER 2.59 2.25 1 123 GLU 0.90 1.11 1 124 ILE 4.86 2.35 1 125 GLN 4.29 3.18 1 126 HIS 2.09 1.79 1 127 ASP 0.36 0.58 1 128 LEU 0.87 0.55 1 129 THR 5.20 3.81 1 131 ASN -2.19 -2.10 1 132 LEU -2.28 -0.01 1 133 ARG 2.68 2.33 1 134 GLU 0.72 0.96 1 136 LEU 0.43 -0.06 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19621_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.25 _LACS_plot.Line_1_terminator_val_y_1 4.76 _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 0.86 _LACS_plot.Line_2_terminator_val_x_2 5.93 _LACS_plot.Line_2_terminator_val_y_2 -1.58 _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 130 TYR -1.86 3.40 0 49 PHE -7.25 5.18 0 58 LEU -5.91 5.01 0 10 LEU 1.43 0.68 1 11 PHE 0.55 -0.04 1 12 GLU 3.10 -0.16 1 13 SER 0.67 -0.21 1 14 ALA 0.86 -0.91 1 15 SER -2.58 1.43 1 16 ARG 5.15 -1.33 1 19 LEU 3.99 -1.01 1 20 ARG 4.90 -1.51 1 22 LEU 2.26 0.05 1 23 SER 4.67 -1.12 1 24 LEU 1.08 0.45 1 25 ILE 0.33 -0.32 1 26 ILE 1.85 -0.66 1 27 LYS -4.17 1.49 1 28 THR -3.21 1.74 1 29 SER -2.98 1.83 1 30 PHE -4.07 2.36 1 32 ALA -0.33 -0.15 1 35 GLU -1.69 1.21 1 36 PHE 1.30 -0.88 1 37 LEU 1.36 1.68 1 38 ILE -6.36 4.25 1 39 ARG -2.49 0.05 1 40 GLN 1.95 -0.33 1 42 ASP -0.87 0.48 1 43 ALA -0.37 -0.58 1 44 LEU -0.08 0.27 1 45 GLN -1.40 1.20 1 46 ALA -3.85 3.26 1 47 ILE -2.17 1.10 1 48 TYR -4.39 3.83 1 50 VAL 2.61 -2.18 1 52 SER -1.17 0.94 1 54 SER -4.29 2.44 1 55 MET -5.82 4.65 1 56 GLU -5.69 3.32 1 57 VAL 0.50 -1.40 1 59 LYS -3.04 2.47 1 60 ASP 4.38 -1.90 1 61 ASN 1.29 -0.30 1 62 THR -0.57 0.94 1 63 VAL 2.36 -1.35 1 64 LEU -0.50 0.69 1 65 ALA -2.70 2.04 1 66 ILE -1.44 -0.23 1 67 LEU -4.71 2.01 1 69 LYS 1.74 -0.49 1 71 ASP 0.04 1.08 1 72 LEU -6.05 4.46 1 73 ILE -4.11 2.54 1 75 SER -3.89 1.46 1 76 ASP -1.07 0.10 1 77 SER 1.61 -1.57 1 78 LEU 0.79 0.46 1 79 THR 2.27 -1.27 1 80 LYS -0.18 0.22 1 81 GLU 0.46 -0.57 1 82 GLN -0.91 0.87 1 83 VAL 1.27 -0.36 1 84 ILE -1.90 1.09 1 85 LYS -1.83 0.36 1 86 THR -1.44 1.05 1 87 ASN -0.93 0.52 1 88 ALA -3.34 2.45 1 89 ASN -4.59 3.40 1 90 VAL -0.88 0.81 1 91 LYS -6.10 4.03 1 92 ALA 0.67 0.49 1 93 LEU -0.20 1.07 1 94 THR -5.39 2.82 1 95 TYR 3.62 -0.63 1 97 ASP -2.20 2.12 1 98 LEU -4.35 3.57 1 99 GLN -5.34 3.95 1 100 TYR -5.69 3.67 1 101 ILE -4.23 3.14 1 102 SER -0.05 0.03 1 103 LEU 5.31 -2.17 1 104 LYS 4.22 -0.42 1 106 LEU 3.26 -0.26 1 107 ARG 4.85 -0.43 1 108 GLU 3.27 -0.68 1 109 VAL 5.93 -0.98 1 110 LEU 5.04 -2.26 1 111 ARG 3.38 -0.56 1 112 LEU 0.34 0.40 1 113 TYR -0.30 0.47 1 115 GLU 4.63 -1.45 1 116 TYR 2.60 0.08 1 117 ALA 3.09 0.08 1 118 GLN 3.87 -0.85 1 119 LYS 3.30 -1.06 1 120 PHE 4.69 -0.55 1 121 VAL 4.66 -1.14 1 122 SER 2.59 -0.34 1 123 GLU 0.90 0.21 1 124 ILE 4.86 -2.51 1 125 GLN 4.29 -1.11 1 126 HIS 2.09 -0.30 1 127 ASP 0.36 0.22 1 128 LEU 0.87 -0.32 1 129 THR 5.20 -1.39 1 131 ASN -2.19 0.09 1 132 LEU -2.28 2.27 1 133 ARG 2.68 -0.35 1 134 GLU 0.72 0.24 1 136 LEU 0.43 -0.49 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19621_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.25 _LACS_plot.Line_1_terminator_val_y_1 0.89 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 5.93 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _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 98 LEU -4.35 1.35 0 119 LYS 3.30 0.50 0 38 ILE -6.36 0.14 0 10 LEU 1.43 -0.45 1 11 PHE 0.55 0.00 1 12 GLU 3.10 -0.29 1 13 SER 0.67 -0.01 1 14 ALA 0.86 -0.62 1 15 SER -2.58 -0.12 1 16 ARG 5.15 -0.43 1 19 LEU 3.99 -0.59 1 20 ARG 4.90 -0.19 1 22 LEU 2.26 -0.43 1 23 SER 4.67 -0.55 1 24 LEU 1.08 -0.15 1 25 ILE 0.33 0.42 1 26 ILE 1.85 -0.08 1 27 LYS -4.17 0.32 1 28 THR -3.21 1.03 1 29 SER -2.98 0.36 1 30 PHE -4.07 1.10 1 32 ALA -0.33 -0.15 1 35 GLU -1.69 -0.06 1 36 PHE 1.30 0.03 1 37 LEU 1.36 -0.21 1 39 ARG -2.49 0.83 1 40 GLN 1.95 -0.81 1 42 ASP -0.87 0.04 1 43 ALA -0.37 0.38 1 44 LEU -0.08 0.01 1 45 GLN -1.40 0.34 1 46 ALA -3.85 0.56 1 47 ILE -2.17 0.75 1 48 TYR -4.39 0.79 1 49 PHE -7.25 1.02 1 50 VAL 2.61 -0.24 1 52 SER -1.17 -0.13 1 54 SER -4.29 1.00 1 55 MET -5.82 0.57 1 56 GLU -5.69 0.68 1 57 VAL 0.50 0.59 1 58 LEU -5.91 0.94 1 59 LYS -3.04 0.39 1 60 ASP 4.38 -0.43 1 61 ASN 1.29 -0.28 1 62 THR -0.57 0.09 1 63 VAL 2.36 0.05 1 64 LEU -0.50 0.10 1 65 ALA -2.70 0.14 1 66 ILE -1.44 0.66 1 67 LEU -4.71 0.56 1 69 LYS 1.74 -0.73 1 71 ASP 0.04 0.13 1 72 LEU -6.05 1.24 1 73 ILE -4.11 1.02 1 75 SER -3.89 0.48 1 76 ASP -1.07 -0.10 1 77 SER 1.61 -0.13 1 78 LEU 0.79 -0.14 1 79 THR 2.27 -0.01 1 80 LYS -0.18 0.04 1 81 GLU 0.46 -0.20 1 82 GLN -0.91 0.03 1 83 VAL 1.27 -0.20 1 84 ILE -1.90 0.01 1 85 LYS -1.83 0.54 1 86 THR -1.44 0.37 1 87 ASN -0.93 -0.19 1 88 ALA -3.34 0.23 1 89 ASN -4.59 0.30 1 90 VAL -0.88 0.79 1 91 LYS -6.10 0.42 1 92 ALA 0.67 -0.12 1 93 LEU -0.20 0.22 1 94 THR -5.39 0.37 1 95 TYR 3.62 0.14 1 97 ASP -2.20 0.62 1 99 GLN -5.34 1.26 1 100 TYR -5.69 1.05 1 101 ILE -4.23 0.22 1 102 SER -0.05 0.23 1 103 LEU 5.31 -0.33 1 104 LYS 4.22 -0.40 1 106 LEU 3.26 -0.59 1 107 ARG 4.85 -0.57 1 108 GLU 3.27 -0.24 1 109 VAL 5.93 -0.34 1 110 LEU 5.04 -0.32 1 111 ARG 3.38 -0.32 1 112 LEU 0.34 -0.31 1 113 TYR -0.30 0.19 1 115 GLU 4.63 -0.07 1 116 TYR 2.60 -0.08 1 117 ALA 3.09 -0.54 1 118 GLN 3.87 -0.25 1 120 PHE 4.69 -0.90 1 121 VAL 4.66 -0.43 1 122 SER 2.59 -0.08 1 123 GLU 0.90 -0.17 1 124 ILE 4.86 -0.56 1 125 GLN 4.29 -0.55 1 126 HIS 2.09 -0.18 1 127 ASP 0.36 0.09 1 128 LEU 0.87 -0.34 1 129 THR 5.20 -0.22 1 130 TYR -1.86 -0.24 1 131 ASN -2.19 0.06 1 132 LEU -2.28 0.05 1 133 ARG 2.68 -0.34 1 134 GLU 0.72 -0.08 1 136 LEU 0.43 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19621_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.25 _LACS_plot.Line_1_terminator_val_y_1 -2.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 5.93 _LACS_plot.Line_2_terminator_val_y_2 1.89 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 THR -1.44 3.27 0 10 LEU 1.43 0.75 1 11 PHE 0.55 0.34 1 12 GLU 3.10 0.88 1 13 SER 0.67 -0.11 1 14 ALA 0.86 -1.14 1 15 SER -2.58 -0.28 1 16 ARG 5.15 3.36 1 19 LEU 3.99 1.94 1 20 ARG 4.90 2.94 1 22 LEU 2.26 0.78 1 23 SER 4.67 1.75 1 24 LEU 1.08 1.10 1 25 ILE 0.33 -1.42 1 26 ILE 1.85 -0.88 1 27 LYS -4.17 -1.63 1 28 THR -3.21 -0.07 1 29 SER -2.98 -2.19 1 30 PHE -4.07 -0.84 1 32 ALA -0.33 -2.31 1 35 GLU -1.69 -0.54 1 36 PHE 1.30 0.19 1 37 LEU 1.36 -1.73 1 38 ILE -6.36 -1.68 1 40 GLN 1.95 0.16 1 42 ASP -0.87 -0.67 1 43 ALA -0.37 0.63 1 44 LEU -0.08 -0.27 1 45 GLN -1.40 0.85 1 46 ALA -3.85 -3.90 1 47 ILE -2.17 -1.89 1 48 TYR -4.39 -2.66 1 49 PHE -7.25 -1.68 1 50 VAL 2.61 -1.81 1 52 SER -1.17 -2.79 1 54 SER -4.29 -0.60 1 55 MET -5.82 -3.45 1 56 GLU -5.69 -2.34 1 57 VAL 0.50 -0.88 1 58 LEU -5.91 -2.12 1 59 LYS -3.04 -0.59 1 60 ASP 4.38 -1.19 1 61 ASN 1.29 -0.85 1 62 THR -0.57 -1.76 1 63 VAL 2.36 0.14 1 64 LEU -0.50 -0.43 1 65 ALA -2.70 -3.71 1 66 ILE -1.44 -0.63 1 67 LEU -4.71 -0.84 1 69 LYS 1.74 0.95 1 71 ASP 0.04 -2.95 1 72 LEU -6.05 -1.63 1 73 ILE -4.11 -1.41 1 75 SER -3.89 -2.91 1 76 ASP -1.07 -1.04 1 77 SER 1.61 1.00 1 79 THR 2.27 0.01 1 80 LYS -0.18 -0.21 1 81 GLU 0.46 -1.27 1 82 GLN -0.91 -0.62 1 83 VAL 1.27 -0.94 1 84 ILE -1.90 -1.76 1 85 LYS -1.83 0.24 1 87 ASN -0.93 -0.51 1 88 ALA -3.34 -3.37 1 89 ASN -4.59 0.30 1 90 VAL -0.88 -2.01 1 91 LYS -6.10 -1.49 1 92 ALA 0.67 0.13 1 93 LEU -0.20 -0.48 1 94 THR -5.39 -1.42 1 95 TYR 3.62 2.45 1 97 ASP -2.20 -1.51 1 98 LEU -4.35 -0.01 1 99 GLN -5.34 -0.91 1 100 TYR -5.69 -3.32 1 101 ILE -4.23 -1.06 1 102 SER -0.05 0.11 1 103 LEU 5.31 1.31 1 104 LYS 4.22 2.50 1 106 LEU 3.26 0.61 1 107 ARG 4.85 2.68 1 108 GLU 3.27 2.11 1 109 VAL 5.93 1.93 1 110 LEU 5.04 1.81 1 111 ARG 3.38 1.57 1 112 LEU 0.34 -1.07 1 113 TYR -0.30 -1.48 1 115 GLU 4.63 2.64 1 116 TYR 2.60 1.53 1 117 ALA 3.09 0.91 1 118 GLN 3.87 2.38 1 119 LYS 3.30 0.96 1 120 PHE 4.69 1.05 1 121 VAL 4.66 1.63 1 122 SER 2.59 1.43 1 123 GLU 0.90 2.41 1 124 ILE 4.86 -1.21 1 125 GLN 4.29 1.12 1 126 HIS 2.09 1.48 1 127 ASP 0.36 -0.15 1 128 LEU 0.87 -1.08 1 129 THR 5.20 0.26 1 130 TYR -1.86 -4.08 1 131 ASN -2.19 -0.76 1 132 LEU -2.28 -1.16 1 133 ARG 2.68 0.59 1 134 GLU 0.72 -0.21 1 stop_ save_