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 bmr5772_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 -3.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.33 _LACS_plot.Line_2_terminator_val_x_2 8.11 _LACS_plot.Line_2_terminator_val_y_2 5.38 _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 21 ILE 8.12 1.52 0 31 ASP -7.25 0.29 0 10 ARG -0.39 -0.27 1 11 ALA -0.26 0.00 1 12 SER -0.21 -0.25 1 13 GLU -0.59 0.05 1 16 ALA -0.61 -0.23 1 17 ASP -0.77 -0.14 1 20 GLN -0.39 -0.06 1 22 LYS -4.07 -1.42 1 24 VAL 4.65 3.59 1 26 SER -1.10 0.25 1 28 ARG -2.61 0.24 1 30 LEU 0.99 1.20 1 32 VAL 0.57 0.20 1 34 ASP 2.58 1.15 1 35 ALA 3.29 0.48 1 36 SER -0.63 -0.04 1 37 THR -0.54 -1.58 1 38 SER 0.88 0.09 1 39 ASP 3.28 1.67 1 41 THR 3.10 2.43 1 42 GLN 1.98 0.58 1 43 LEU -1.81 -1.58 1 44 GLN -7.06 -3.21 1 45 LEU -4.48 -1.80 1 46 TRP -5.58 -0.96 1 47 ASP 1.49 2.32 1 49 HIS -2.24 0.25 1 50 SER 1.26 0.74 1 52 THR 4.28 3.11 1 53 ASN 3.15 1.39 1 54 GLN -2.66 -1.18 1 55 GLN -0.89 -1.21 1 56 TRP -4.30 -2.67 1 57 ALA -3.91 -2.03 1 58 ALA -1.80 -1.78 1 59 THR -5.16 -2.68 1 60 ASP 3.40 2.32 1 61 ALA -0.28 -0.63 1 63 GLU -4.69 -2.33 1 64 LEU -1.92 0.19 1 65 ARG -4.38 -0.53 1 66 VAL -3.72 -3.23 1 67 TYR 1.07 -0.56 1 69 ASP -1.02 -0.44 1 70 LYS -2.78 -2.60 1 72 LEU 1.89 1.72 1 73 ASP -5.66 0.67 1 74 ALA -3.99 -1.60 1 75 ALA -0.43 -0.27 1 77 THR -0.93 -1.61 1 78 SER -3.90 -1.93 1 79 ASN 2.26 1.15 1 81 SER 2.09 2.64 1 82 LYS 0.65 1.68 1 83 VAL 0.38 -0.29 1 84 GLN -5.89 -2.21 1 85 ILE -5.26 -1.44 1 86 TYR -6.07 0.51 1 87 SER 3.20 2.94 1 89 TRP -2.40 -1.49 1 92 ASP 4.41 2.92 1 93 ASN 4.68 1.90 1 94 GLN -1.55 -2.12 1 95 LYS -3.11 -1.54 1 96 TRP -4.87 -1.61 1 97 ARG -2.25 -1.33 1 98 LEU 2.26 -0.66 1 99 ASN -1.44 0.08 1 100 SER 3.96 2.90 1 101 ASP 0.59 -0.58 1 103 SER -1.14 0.47 1 104 VAL -0.04 -0.19 1 105 VAL -4.75 -2.16 1 107 VAL 5.62 4.08 1 108 GLN 2.14 2.35 1 109 SER 0.52 1.05 1 111 LEU -2.58 -1.48 1 113 LEU 0.58 1.43 1 114 ASP -6.21 0.36 1 115 ALA 0.12 -0.73 1 116 VAL 3.09 2.30 1 118 ASN 2.29 1.15 1 120 THR -2.60 -2.03 1 121 ALA -2.62 -0.97 1 122 ASN 3.66 0.88 1 124 THR 2.87 3.36 1 125 LEU -0.96 0.01 1 126 ILE -1.26 -3.55 1 127 GLN -5.62 -2.80 1 128 LEU -4.35 -1.92 1 130 THR 2.27 2.95 1 132 SER -2.74 -0.81 1 133 ASN 2.34 1.45 1 135 SER 4.13 2.82 1 136 ASN 2.32 1.17 1 137 GLN -3.09 -1.96 1 138 ARG -3.25 -1.45 1 139 TRP -4.04 -1.78 1 140 THR -2.89 -1.77 1 141 ARG -1.56 -1.39 1 142 THR -0.08 0.74 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5772_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 4.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.67 _LACS_plot.Line_2_terminator_val_x_2 8.11 _LACS_plot.Line_2_terminator_val_y_2 -2.73 _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 21 ILE 8.12 -6.60 0 31 ASP -7.25 7.54 0 10 ARG -0.39 0.12 1 11 ALA -0.26 0.26 1 12 SER -0.21 -0.04 1 13 GLU -0.59 0.64 1 16 ALA -0.61 0.38 1 17 ASP -0.77 0.63 1 20 GLN -0.39 0.33 1 22 LYS -4.07 2.65 1 24 VAL 4.65 -1.06 1 26 SER -1.10 1.35 1 28 ARG -2.61 2.85 1 30 LEU 0.99 0.21 1 32 VAL 0.57 -0.37 1 34 ASP 2.58 -1.43 1 35 ALA 3.29 -2.81 1 36 SER -0.63 0.59 1 37 THR -0.54 -1.04 1 38 SER 0.88 -0.79 1 39 ASP 3.28 -1.61 1 41 THR 3.10 -0.67 1 42 GLN 1.98 -1.40 1 43 LEU -1.81 0.23 1 44 GLN -7.06 3.85 1 45 LEU -4.48 2.68 1 46 TRP -5.58 4.62 1 47 ASP 1.49 0.83 1 49 HIS -2.24 2.49 1 50 SER 1.26 -0.52 1 52 THR 4.28 -1.17 1 53 ASN 3.15 -1.76 1 54 GLN -2.66 1.48 1 55 GLN -0.89 -0.32 1 56 TRP -4.30 1.63 1 57 ALA -3.91 1.88 1 58 ALA -1.80 0.02 1 59 THR -5.16 2.48 1 60 ASP 3.40 -1.08 1 61 ALA -0.28 -0.35 1 63 GLU -4.69 2.36 1 64 LEU -1.92 2.11 1 65 ARG -4.38 3.85 1 66 VAL -3.72 0.49 1 67 TYR 1.07 -1.63 1 69 ASP -1.02 0.58 1 70 LYS -2.78 0.18 1 72 LEU 1.89 -0.17 1 73 ASP -5.66 6.33 1 74 ALA -3.99 2.39 1 75 ALA -0.43 0.16 1 77 THR -0.93 -0.68 1 78 SER -3.90 1.97 1 79 ASN 2.26 -1.11 1 81 SER 2.09 0.55 1 82 LYS 0.65 1.03 1 83 VAL 0.38 -0.67 1 84 GLN -5.89 3.68 1 85 ILE -5.26 3.82 1 86 TYR -6.07 6.58 1 87 SER 3.20 -0.26 1 89 TRP -2.40 0.91 1 92 ASP 4.41 -1.49 1 93 ASN 4.68 -2.78 1 94 GLN -1.55 -0.57 1 95 LYS -3.11 1.57 1 96 TRP -4.87 3.26 1 97 ARG -2.25 0.92 1 98 LEU 2.26 -2.92 1 99 ASN -1.44 1.52 1 100 SER 3.96 -1.06 1 101 ASP 0.59 -1.17 1 103 SER -1.14 1.61 1 104 VAL -0.04 -0.15 1 105 VAL -4.75 2.59 1 107 VAL 5.62 -1.54 1 108 GLN 2.14 0.21 1 109 SER 0.52 0.53 1 111 LEU -2.58 1.10 1 113 LEU 0.58 0.85 1 114 ASP -6.21 6.57 1 115 ALA 0.12 -0.85 1 116 VAL 3.09 -0.79 1 118 ASN 2.29 -1.14 1 120 THR -2.60 0.57 1 121 ALA -2.62 1.65 1 122 ASN 3.66 -2.78 1 124 THR 2.87 0.49 1 125 LEU -0.96 0.97 1 126 ILE -1.26 -2.29 1 127 GLN -5.62 2.82 1 128 LEU -4.35 2.43 1 130 THR 2.27 0.68 1 132 SER -2.74 1.93 1 133 ASN 2.34 -0.89 1 135 SER 4.13 -1.31 1 136 ASN 2.32 -1.15 1 137 GLN -3.09 1.13 1 138 ARG -3.25 1.80 1 139 TRP -4.04 2.26 1 140 THR -2.89 1.12 1 141 ARG -1.56 0.17 1 142 THR -0.08 0.82 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5772_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 0.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 8.11 _LACS_plot.Line_2_terminator_val_y_2 -1.03 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 ILE 8.12 0.15 0 12 SER -0.21 -0.08 1 13 GLU -0.59 -0.03 1 17 ASP -0.77 -0.05 1 20 GLN -0.39 0.61 1 22 LYS -4.07 0.68 1 24 VAL 4.65 -0.65 1 26 SER -1.10 -0.35 1 28 ARG -2.61 0.30 1 30 LEU 0.99 -0.07 1 31 ASP -7.25 0.53 1 34 ASP 2.58 -0.60 1 35 ALA 3.29 -0.50 1 36 SER -0.63 -0.37 1 37 THR -0.54 -0.09 1 38 SER 0.88 -0.24 1 39 ASP 3.28 -0.46 1 41 THR 3.10 -0.26 1 42 GLN 1.98 0.25 1 43 LEU -1.81 0.09 1 44 GLN -7.06 1.46 1 45 LEU -4.48 0.80 1 47 ASP 1.49 -0.16 1 49 HIS -2.24 0.21 1 50 SER 1.26 -0.07 1 52 THR 4.28 -0.07 1 53 ASN 3.15 -0.75 1 54 GLN -2.66 0.50 1 55 GLN -0.89 -0.16 1 56 TRP -4.30 0.28 1 57 ALA -3.91 0.43 1 58 ALA -1.80 1.12 1 59 THR -5.16 0.57 1 60 ASP 3.40 -0.19 1 61 ALA -0.28 0.09 1 63 GLU -4.69 0.68 1 64 LEU -1.92 0.69 1 65 ARG -4.38 1.29 1 66 VAL -3.72 -0.05 1 67 TYR 1.07 -0.42 1 69 ASP -1.02 0.01 1 70 LYS -2.78 0.63 1 72 LEU 1.89 0.00 1 73 ASP -5.66 0.66 1 74 ALA -3.99 0.68 1 75 ALA -0.43 0.16 1 77 THR -0.93 -0.09 1 78 SER -3.90 0.17 1 79 ASN 2.26 -0.48 1 81 SER 2.09 -0.15 1 82 LYS 0.65 -0.23 1 83 VAL 0.38 0.63 1 84 GLN -5.89 1.34 1 85 ILE -5.26 1.35 1 86 TYR -6.07 -0.09 1 87 SER 3.20 0.01 1 89 TRP -2.40 0.42 1 92 ASP 4.41 -0.59 1 93 ASN 4.68 -0.51 1 94 GLN -1.55 0.77 1 95 LYS -3.11 0.49 1 96 TRP -4.87 0.47 1 97 ARG -2.25 0.20 1 98 LEU 2.26 0.39 1 100 SER 3.96 -0.21 1 101 ASP 0.59 -0.13 1 103 SER -1.14 0.54 1 104 VAL -0.04 0.80 1 105 VAL -4.75 0.74 1 107 VAL 5.62 -0.84 1 108 GLN 2.14 -0.43 1 109 SER 0.52 -0.42 1 111 LEU -2.58 0.28 1 113 LEU 0.58 -0.08 1 114 ASP -6.21 0.61 1 115 ALA 0.12 0.54 1 116 VAL 3.09 0.83 1 118 ASN 2.29 -0.79 1 120 THR -2.60 -0.17 1 121 ALA -2.62 -0.31 1 122 ASN 3.66 -0.70 1 124 THR 2.87 -0.42 1 125 LEU -0.96 0.50 1 126 ILE -1.26 0.75 1 127 GLN -5.62 1.07 1 128 LEU -4.35 0.91 1 130 THR 2.27 -0.47 1 132 SER -2.74 0.18 1 133 ASN 2.34 -0.26 1 135 SER 4.13 -0.26 1 136 ASN 2.32 -0.32 1 137 GLN -3.09 0.69 1 138 ARG -3.25 0.28 1 139 TRP -4.04 0.73 1 140 THR -2.89 0.36 1 141 ARG -1.56 0.86 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5772_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 -1.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.75 _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 8.11 _LACS_plot.Line_2_terminator_val_y_2 -0.07 _LACS_plot.Y_axis_chem_shift_offset 0.96 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 ILE 8.12 -2.29 0 59 THR -5.16 3.90 0 10 ARG -0.39 -2.35 1 11 ALA -0.26 -1.81 1 12 SER -0.21 3.01 1 13 GLU -0.59 -0.91 1 16 ALA -0.61 -1.18 1 22 LYS -4.07 -3.24 1 24 VAL 4.65 -1.19 1 26 SER -1.10 -0.43 1 28 ARG -2.61 -3.09 1 30 LEU 0.99 -3.57 1 31 ASP -7.25 0.33 1 32 VAL 0.57 -1.01 1 34 ASP 2.58 1.53 1 35 ALA 3.29 -2.58 1 36 SER -0.63 1.65 1 37 THR -0.54 1.02 1 38 SER 0.88 -0.33 1 39 ASP 3.28 -1.58 1 41 THR 3.10 -0.48 1 42 GLN 1.98 -2.62 1 43 LEU -1.81 -2.83 1 44 GLN -7.06 -0.50 1 45 LEU -4.48 -2.85 1 46 TRP -5.58 2.11 1 47 ASP 1.49 -2.80 1 49 HIS -2.24 1.85 1 50 SER 1.26 0.21 1 52 THR 4.28 1.67 1 53 ASN 3.15 0.07 1 54 GLN -2.66 -3.70 1 55 GLN -0.89 -0.56 1 56 TRP -4.30 -2.68 1 57 ALA -3.91 -1.80 1 58 ALA -1.80 -1.80 1 60 ASP 3.40 0.80 1 61 ALA -0.28 -1.15 1 63 GLU -4.69 -2.45 1 64 LEU -1.92 -0.06 1 65 ARG -4.38 -1.28 1 66 VAL -3.72 -0.83 1 67 TYR 1.07 -2.96 1 69 ASP -1.02 -0.71 1 70 LYS -2.78 -0.77 1 72 LEU 1.89 -3.25 1 73 ASP -5.66 1.91 1 74 ALA -3.99 -4.61 1 75 ALA -0.43 -0.98 1 77 THR -0.93 -1.31 1 78 SER -3.90 -1.62 1 79 ASN 2.26 -0.09 1 81 SER 2.09 0.62 1 82 LYS 0.65 -3.88 1 83 VAL 0.38 -1.75 1 84 GLN -5.89 -2.03 1 85 ILE -5.26 -1.16 1 86 TYR -6.07 0.29 1 87 SER 3.20 1.07 1 89 TRP -2.40 0.18 1 92 ASP 4.41 -0.25 1 93 ASN 4.68 1.72 1 94 GLN -1.55 -1.90 1 95 LYS -3.11 -2.64 1 96 TRP -4.87 -0.31 1 97 ARG -2.25 -1.32 1 98 LEU 2.26 -3.21 1 99 ASN -1.44 1.23 1 101 ASP 0.59 -1.52 1 103 SER -1.14 -0.21 1 104 VAL -0.04 -1.20 1 105 VAL -4.75 -2.01 1 107 VAL 5.62 -1.45 1 108 GLN 2.14 1.29 1 109 SER 0.52 1.92 1 113 LEU 0.58 -2.60 1 114 ASP -6.21 1.89 1 115 ALA 0.12 -4.34 1 116 VAL 3.09 -0.11 1 118 ASN 2.29 0.40 1 120 THR -2.60 -1.77 1 121 ALA -2.62 -3.60 1 122 ASN 3.66 3.30 1 124 THR 2.87 0.18 1 125 LEU -0.96 -4.22 1 126 ILE -1.26 -1.15 1 127 GLN -5.62 -1.24 1 128 LEU -4.35 -3.44 1 130 THR 2.27 -1.17 1 132 SER -2.74 1.22 1 133 ASN 2.34 -0.05 1 137 GLN -3.09 -2.02 1 138 ARG -3.25 -0.89 1 139 TRP -4.04 -0.95 1 140 THR -2.89 1.03 1 141 ARG -1.56 -3.06 1 stop_ save_