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 bmr25001_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -2.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _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 6.90 _LACS_plot.Line_2_terminator_val_y_2 4.19 _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 33 GLN 6.91 4.87 0 10 ALA -0.72 -0.74 1 11 THR 2.10 1.75 1 12 ASN 1.69 0.90 1 13 ARG -3.38 -1.10 1 14 ASP -1.31 -1.40 1 15 VAL 4.61 3.83 1 16 ASN -2.93 -0.37 1 17 VAL -5.23 -2.75 1 18 ASP -0.49 -1.10 1 19 ARG -2.23 -0.71 1 20 SER -1.29 -0.49 1 21 ALA -5.12 -1.86 1 22 ASN 0.28 0.16 1 23 ILE -2.82 -1.80 1 24 ASP -0.79 -0.05 1 25 LEU -2.40 -1.25 1 26 SER -1.96 -1.24 1 27 PHE -5.45 -1.57 1 28 THR -1.17 0.04 1 29 ILE -2.25 0.21 1 30 ARG -5.98 -1.38 1 31 GLN -3.10 -1.10 1 34 ARG 4.37 2.55 1 36 ALA 2.34 2.02 1 37 ASP 4.06 3.01 1 38 ALA 0.17 -0.22 1 40 MET 2.45 0.49 1 41 ARG -5.77 -2.07 1 42 ILE 0.30 0.88 1 43 LYS -5.90 -2.26 1 44 ALA -6.24 -1.04 1 45 TRP -1.93 1.20 1 47 GLU -1.56 0.83 1 48 ALA -3.85 -1.48 1 49 ASN 3.12 2.10 1 50 HIS 2.13 0.64 1 52 GLN 0.26 0.24 1 53 LEU -0.50 0.70 1 54 LEU -7.22 -1.44 1 55 ILE -5.71 -2.79 1 56 LYS -3.62 -1.32 1 58 GLN 2.13 2.18 1 61 ASN -1.67 -0.37 1 62 LYS 4.43 3.32 1 63 SER 3.10 1.64 1 64 ALA -1.39 -0.96 1 66 PHE -4.07 -1.31 1 67 THR 3.14 2.26 1 68 LEU 2.97 0.62 1 69 ALA -4.52 -1.48 1 70 SER 1.75 0.96 1 72 ARG -4.73 -1.25 1 73 PHE -5.16 -1.72 1 74 SER -3.92 -1.96 1 75 TYR -6.07 -1.56 1 76 ILE -0.84 0.08 1 78 ASN 2.37 0.23 1 79 ASN -1.63 -1.55 1 81 ALA -3.48 -1.41 1 82 ASN -1.14 -0.44 1 83 ILE 1.58 0.44 1 84 MET -0.86 -0.28 1 85 ASN 1.02 0.30 1 87 PHE -1.91 -1.91 1 88 VAL -1.43 -0.55 1 89 LEU -5.31 -1.92 1 90 THR 0.79 0.70 1 91 ASN 1.35 0.16 1 94 VAL 2.11 1.65 1 95 TYR -2.54 -2.26 1 96 GLN -3.08 -0.27 1 97 LEU -7.10 -2.44 1 99 MET -4.72 -0.06 1 100 GLN -7.05 -2.52 1 102 SER -1.09 0.25 1 103 ILE -0.21 0.14 1 104 THR 2.02 0.10 1 106 ALA -0.30 0.02 1 107 ILE 1.88 0.74 1 109 LEU 0.34 -0.12 1 110 ARG -1.19 -1.03 1 113 LEU -1.80 -0.12 1 114 TYR -4.53 -1.06 1 115 GLU -7.16 -2.47 1 116 VAL -2.82 -0.51 1 117 VAL -1.99 -0.51 1 118 LEU -5.26 -1.84 1 119 ASN -4.26 -1.84 1 120 ALA -5.79 -0.96 1 121 GLU -7.26 -2.32 1 122 LEU -3.05 -1.25 1 123 VAL -4.30 -2.38 1 124 THR -2.08 -1.31 1 125 ASN 0.95 0.98 1 126 ASP -0.64 -0.50 1 127 ASN 1.43 0.79 1 128 LYS 1.52 1.01 1 130 ASN 0.57 0.45 1 131 ALA 0.02 0.60 1 132 THR 0.09 -0.04 1 133 ALA -0.79 0.23 1 134 VAL -1.91 -0.96 1 135 ALA -0.94 0.16 1 136 LYS -4.45 -0.93 1 137 THR -3.57 -1.31 1 138 ALA -5.87 -1.34 1 139 THR -2.29 -0.26 1 140 SER -0.84 0.40 1 141 THR 0.24 0.41 1 142 ILE -4.31 -3.29 1 143 THR 1.51 0.93 1 144 VAL 0.16 -1.48 1 145 VAL -0.66 0.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25001_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 4.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.93 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -2.71 _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 33 GLN 6.91 -2.04 0 10 ALA -0.72 -0.02 1 11 THR 2.10 -0.35 1 12 ASN 1.69 -0.79 1 13 ARG -3.38 2.28 1 14 ASP -1.31 -0.09 1 15 VAL 4.61 -0.78 1 16 ASN -2.93 2.56 1 17 VAL -5.23 2.48 1 18 ASP -0.49 -0.61 1 19 ARG -2.23 1.52 1 20 SER -1.29 0.80 1 21 ALA -5.12 3.26 1 22 ASN 0.28 -0.12 1 23 ILE -2.82 1.02 1 24 ASP -0.79 0.74 1 25 LEU -2.40 1.15 1 26 SER -1.96 0.72 1 27 PHE -5.45 3.88 1 28 THR -1.17 1.21 1 29 ILE -2.25 2.46 1 30 ARG -5.98 4.60 1 31 GLN -3.10 2.00 1 34 ARG 4.37 -1.82 1 36 ALA 2.34 -0.32 1 37 ASP 4.06 -1.05 1 38 ALA 0.17 -0.39 1 40 MET 2.45 -1.96 1 41 ARG -5.77 3.70 1 42 ILE 0.30 0.58 1 43 LYS -5.90 3.64 1 44 ALA -6.24 5.20 1 45 TRP -1.93 3.13 1 47 GLU -1.56 2.39 1 48 ALA -3.85 2.37 1 49 ASN 3.12 -1.02 1 50 HIS 2.13 -1.49 1 52 GLN 0.26 -0.02 1 53 LEU -0.50 1.20 1 54 LEU -7.22 5.78 1 55 ILE -5.71 2.92 1 56 LYS -3.62 2.30 1 58 GLN 2.13 0.05 1 61 ASN -1.67 1.30 1 62 LYS 4.43 -1.11 1 63 SER 3.10 -1.46 1 64 ALA -1.39 0.43 1 66 PHE -4.07 2.76 1 67 THR 3.14 -0.88 1 68 LEU 2.97 -2.35 1 69 ALA -4.52 3.04 1 70 SER 1.75 -0.79 1 72 ARG -4.73 3.48 1 73 PHE -5.16 3.44 1 74 SER -3.92 1.96 1 75 TYR -6.07 4.51 1 76 ILE -0.84 0.92 1 78 ASN 2.37 -2.14 1 79 ASN -1.63 0.08 1 81 ALA -3.48 2.07 1 82 ASN -1.14 0.70 1 83 ILE 1.58 -1.14 1 84 MET -0.86 0.58 1 85 ASN 1.02 -0.72 1 87 PHE -1.91 0.00 1 88 VAL -1.43 0.88 1 89 LEU -5.31 3.39 1 90 THR 0.79 -0.09 1 91 ASN 1.35 -1.19 1 94 VAL 2.11 -0.46 1 95 TYR -2.54 0.28 1 96 GLN -3.08 2.81 1 97 LEU -7.10 4.66 1 99 MET -4.72 4.66 1 100 GLN -7.05 4.53 1 102 SER -1.09 1.34 1 103 ILE -0.21 0.35 1 104 THR 2.02 -1.92 1 106 ALA -0.30 0.32 1 107 ILE 1.88 -1.14 1 109 LEU 0.34 -0.46 1 110 ARG -1.19 0.16 1 113 LEU -1.80 1.68 1 114 TYR -4.53 3.47 1 115 GLU -7.16 4.69 1 116 VAL -2.82 2.31 1 117 VAL -1.99 1.48 1 118 LEU -5.26 3.42 1 119 ASN -4.26 2.42 1 120 ALA -5.79 4.83 1 121 GLU -7.26 4.94 1 122 LEU -3.05 1.80 1 123 VAL -4.30 1.92 1 124 THR -2.08 0.77 1 125 ASN 0.95 0.03 1 126 ASP -0.64 0.14 1 127 ASN 1.43 -0.64 1 128 LYS 1.52 -0.51 1 130 ASN 0.57 -0.12 1 131 ALA 0.02 0.58 1 132 THR 0.09 -0.13 1 133 ALA -0.79 1.02 1 134 VAL -1.91 0.95 1 135 ALA -0.94 1.10 1 136 LYS -4.45 3.52 1 137 THR -3.57 2.26 1 138 ALA -5.87 4.53 1 139 THR -2.29 2.03 1 140 SER -0.84 1.24 1 141 THR 0.24 0.17 1 142 ILE -4.31 1.02 1 143 THR 1.51 -0.58 1 144 VAL 0.16 -1.64 1 145 VAL -0.66 1.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25001_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 0.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.33 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 SER -1.09 1.22 0 33 GLN 6.91 -0.85 0 10 ALA -0.72 -0.21 1 11 THR 2.10 -0.43 1 12 ASN 1.69 0.02 1 13 ARG -3.38 0.47 1 14 ASP -1.31 0.16 1 15 VAL 4.61 -0.76 1 16 ASN -2.93 1.02 1 17 VAL -5.23 0.33 1 18 ASP -0.49 0.15 1 19 ARG -2.23 0.26 1 20 SER -1.29 0.11 1 21 ALA -5.12 0.32 1 22 ASN 0.28 -0.04 1 23 ILE -2.82 0.10 1 24 ASP -0.79 0.33 1 25 LEU -2.40 0.24 1 26 SER -1.96 0.66 1 27 PHE -5.45 0.25 1 28 THR -1.17 0.84 1 29 ILE -2.25 0.74 1 30 ARG -5.98 1.31 1 31 GLN -3.10 0.88 1 34 ARG 4.37 -0.13 1 36 ALA 2.34 0.25 1 37 ASP 4.06 -0.17 1 38 ALA 0.17 0.14 1 40 MET 2.45 0.26 1 41 ARG -5.77 0.79 1 42 ILE 0.30 0.07 1 43 LYS -5.90 1.53 1 44 ALA -6.24 1.36 1 45 TRP -1.93 0.43 1 47 GLU -1.56 0.06 1 48 ALA -3.85 0.15 1 49 ASN 3.12 -0.31 1 50 HIS 2.13 0.37 1 52 GLN 0.26 -0.04 1 53 LEU -0.50 -0.04 1 54 LEU -7.22 0.56 1 55 ILE -5.71 1.23 1 56 LYS -3.62 0.68 1 58 GLN 2.13 -0.52 1 61 ASN -1.67 0.06 1 62 LYS 4.43 -0.55 1 63 SER 3.10 -0.30 1 64 ALA -1.39 0.13 1 66 PHE -4.07 0.35 1 67 THR 3.14 -0.06 1 68 LEU 2.97 -0.11 1 69 ALA -4.52 0.18 1 70 SER 1.75 -0.74 1 72 ARG -4.73 0.25 1 73 PHE -5.16 0.82 1 74 SER -3.92 0.11 1 75 TYR -6.07 0.91 1 76 ILE -0.84 -0.19 1 78 ASN 2.37 -0.02 1 79 ASN -1.63 -0.05 1 81 ALA -3.48 -0.04 1 82 ASN -1.14 -0.06 1 83 ILE 1.58 -0.07 1 84 MET -0.86 0.07 1 85 ASN 1.02 -0.17 1 87 PHE -1.91 0.43 1 88 VAL -1.43 0.21 1 89 LEU -5.31 1.46 1 90 THR 0.79 -0.18 1 91 ASN 1.35 -0.33 1 94 VAL 2.11 0.35 1 95 TYR -2.54 0.54 1 96 GLN -3.08 1.02 1 97 LEU -7.10 0.87 1 99 MET -4.72 0.33 1 100 GLN -7.05 1.50 1 103 ILE -0.21 -0.08 1 104 THR 2.02 0.52 1 106 ALA -0.30 -0.18 1 107 ILE 1.88 -0.66 1 109 LEU 0.34 -0.26 1 110 ARG -1.19 0.04 1 113 LEU -1.80 0.84 1 114 TYR -4.53 0.54 1 115 GLU -7.16 1.35 1 116 VAL -2.82 0.66 1 117 VAL -1.99 0.65 1 118 LEU -5.26 0.00 1 119 ASN -4.26 0.24 1 120 ALA -5.79 1.04 1 121 GLU -7.26 0.64 1 122 LEU -3.05 0.86 1 123 VAL -4.30 0.61 1 124 THR -2.08 0.36 1 125 ASN 0.95 -0.04 1 126 ASP -0.64 -0.02 1 127 ASN 1.43 -0.23 1 128 LYS 1.52 -0.06 1 130 ASN 0.57 -0.03 1 131 ALA 0.02 0.01 1 132 THR 0.09 -0.03 1 133 ALA -0.79 0.03 1 134 VAL -1.91 0.13 1 135 ALA -0.94 0.48 1 136 LYS -4.45 0.41 1 137 THR -3.57 0.81 1 138 ALA -5.87 0.52 1 139 THR -2.29 1.02 1 140 SER -0.84 0.42 1 141 THR 0.24 0.76 1 142 ILE -4.31 0.77 1 143 THR 1.51 0.43 1 144 VAL 0.16 0.85 1 145 VAL -0.66 0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25001_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -2.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 1.46 _LACS_plot.Y_axis_chem_shift_offset 0.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 145 VAL -0.66 3.15 0 15 VAL 4.61 -3.02 0 10 ALA -0.72 0.32 1 11 THR 2.10 -0.84 1 12 ASN 1.69 0.27 1 13 ARG -3.38 -2.62 1 14 ASP -1.31 0.08 1 16 ASN -2.93 0.98 1 17 VAL -5.23 -3.02 1 18 ASP -0.49 -2.02 1 19 ARG -2.23 -0.88 1 20 SER -1.29 -1.47 1 21 ALA -5.12 -1.02 1 22 ASN 0.28 -0.15 1 23 ILE -2.82 -1.90 1 24 ASP -0.79 -1.55 1 25 LEU -2.40 -3.06 1 26 SER -1.96 -1.73 1 27 PHE -5.45 0.13 1 28 THR -1.17 -1.99 1 29 ILE -2.25 -2.51 1 30 ARG -5.98 -1.76 1 31 GLN -3.10 -1.63 1 33 GLN 6.91 1.80 1 34 ARG 4.37 2.32 1 37 ASP 4.06 0.36 1 38 ALA 0.17 -0.44 1 40 MET 2.45 0.42 1 41 ARG -5.77 -2.01 1 42 ILE 0.30 -2.87 1 43 LYS -5.90 -1.37 1 44 ALA -6.24 -1.51 1 45 TRP -1.93 -1.76 1 47 GLU -1.56 -0.21 1 48 ALA -3.85 -0.09 1 49 ASN 3.12 1.78 1 50 HIS 2.13 0.03 1 53 LEU -0.50 -1.50 1 54 LEU -7.22 -2.86 1 55 ILE -5.71 -3.42 1 56 LYS -3.62 -3.06 1 58 GLN 2.13 1.23 1 61 ASN -1.67 1.42 1 62 LYS 4.43 1.76 1 63 SER 3.10 -0.09 1 64 ALA -1.39 -1.52 1 66 PHE -4.07 -0.52 1 68 LEU 2.97 -0.79 1 69 ALA -4.52 -0.75 1 72 ARG -4.73 -2.02 1 73 PHE -5.16 -0.97 1 74 SER -3.92 -2.41 1 78 ASN 2.37 -1.13 1 79 ASN -1.63 -1.61 1 81 ALA -3.48 -1.27 1 82 ASN -1.14 -0.57 1 83 ILE 1.58 -0.92 1 84 MET -0.86 -1.10 1 85 ASN 1.02 -0.70 1 87 PHE -1.91 -2.70 1 88 VAL -1.43 -2.59 1 89 LEU -5.31 0.11 1 90 THR 0.79 -0.17 1 91 ASN 1.35 0.05 1 94 VAL 2.11 0.15 1 95 TYR -2.54 -3.01 1 96 GLN -3.08 -3.98 1 97 LEU -7.10 -3.74 1 99 MET -4.72 -2.84 1 100 GLN -7.05 -0.47 1 102 SER -1.09 -0.56 1 103 ILE -0.21 0.82 1 104 THR 2.02 2.63 1 113 LEU -1.80 -0.56 1 114 TYR -4.53 -1.61 1 115 GLU -7.16 -1.46 1 116 VAL -2.82 -1.81 1 117 VAL -1.99 -2.07 1 118 LEU -5.26 -4.35 1 119 ASN -4.26 -2.01 1 120 ALA -5.79 -3.09 1 121 GLU -7.26 -2.91 1 122 LEU -3.05 -0.95 1 123 VAL -4.30 -0.58 1 124 THR -2.08 -0.04 1 125 ASN 0.95 -0.22 1 126 ASP -0.64 -0.49 1 128 LYS 1.52 0.45 1 130 ASN 0.57 0.08 1 131 ALA 0.02 0.12 1 132 THR 0.09 -0.57 1 133 ALA -0.79 -0.87 1 134 VAL -1.91 -1.52 1 135 ALA -0.94 -0.57 1 136 LYS -4.45 -1.79 1 137 THR -3.57 -1.19 1 138 ALA -5.87 -2.85 1 139 THR -2.29 -0.50 1 140 SER -0.84 -1.09 1 141 THR 0.24 -0.86 1 142 ILE -4.31 -1.77 1 143 THR 1.51 -1.78 1 144 VAL 0.16 -0.55 1 stop_ save_