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 bmr26730_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 5.65 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ARG 5.58 1.20 0 124 ARG 6.23 1.47 0 11 THR 0.08 0.12 1 13 ARG 0.58 0.39 1 14 THR -0.27 -0.10 1 15 SER -0.09 0.07 1 16 ARG 0.59 0.38 1 17 THR -0.03 0.13 1 19 HIS 0.08 0.55 1 22 VAL 0.54 0.31 1 23 ASN 0.45 0.33 1 24 GLN 0.41 0.32 1 25 LEU 0.46 0.33 1 28 VAL -0.11 -0.11 1 29 PHE -1.14 -0.40 1 30 VAL -0.73 -0.16 1 31 ASN 1.31 0.78 1 33 ARG -1.01 -0.51 1 35 LEU -1.18 -0.14 1 37 ASP 4.17 3.74 1 38 VAL 4.32 2.90 1 39 VAL 5.04 3.77 1 40 ARG 5.73 4.60 1 41 GLN 4.23 2.95 1 42 ARG 3.16 2.29 1 43 ILE 6.04 5.28 1 44 VAL 5.71 4.50 1 45 GLU 2.96 2.93 1 46 LEU 3.32 2.69 1 47 ALA 3.17 2.70 1 48 HIS 3.89 3.30 1 49 GLN 1.03 0.41 1 51 VAL 2.55 0.80 1 52 ARG 1.56 1.36 1 55 ASP 2.91 2.81 1 56 ILE 6.34 5.57 1 57 SER 3.84 3.18 1 58 ARG 3.34 3.06 1 59 GLN 3.62 3.30 1 60 LEU -0.44 -0.75 1 62 VAL -5.13 -2.81 1 63 SER -1.54 -0.53 1 64 HIS 3.19 4.58 1 67 VAL 6.63 5.34 1 68 SER 5.50 4.54 1 69 LYS 3.60 2.96 1 70 ILE 3.68 2.09 1 71 LEU 3.00 1.68 1 73 ARG 1.88 1.13 1 74 TYR 1.65 1.73 1 75 TYR 1.09 0.97 1 76 GLU 0.27 0.65 1 77 THR 0.15 0.66 1 79 SER -0.37 -0.05 1 80 ILE 0.04 -0.04 1 81 LYS -0.07 -0.13 1 84 VAL 0.27 0.16 1 85 ILE 0.53 0.20 1 88 SER -0.31 -0.05 1 89 LYS 0.29 0.18 1 91 LYS 0.26 0.05 1 92 VAL -0.70 -0.41 1 93 ALA -0.65 -0.74 1 94 THR 1.86 0.57 1 96 LYS 3.48 2.41 1 97 VAL 5.83 4.56 1 98 VAL 6.83 5.41 1 99 GLU 2.89 2.36 1 100 LYS 3.63 1.06 1 101 ILE 6.74 5.56 1 102 ALA 3.78 2.53 1 103 GLU 3.08 2.81 1 104 TYR 2.17 -0.17 1 105 LYS 1.10 0.27 1 106 ARG 3.63 3.02 1 107 GLN 2.22 1.91 1 108 ASN -1.39 -0.85 1 110 THR 0.31 -0.84 1 111 MET 0.76 2.05 1 112 PHE -1.64 -0.52 1 113 ALA 3.96 3.80 1 114 TRP 4.77 2.15 1 115 GLU 1.86 2.09 1 116 ILE 5.88 4.66 1 117 ARG 6.20 4.75 1 118 ASP 4.34 3.29 1 119 ARG 5.11 3.73 1 120 LEU 2.41 2.95 1 121 LEU 1.96 1.92 1 122 ALA 3.47 2.95 1 123 GLU 0.36 -0.04 1 125 VAL 3.04 2.77 1 127 ASP -3.23 -1.82 1 128 ASN 4.08 3.75 1 129 ASP 1.37 1.77 1 130 THR -1.79 -0.55 1 131 VAL -1.20 -1.05 1 133 SER -2.78 -1.32 1 134 VAL 7.02 5.69 1 135 SER 4.58 3.22 1 136 SER 4.63 3.51 1 137 ILE 6.09 5.28 1 138 ASN 3.88 3.24 1 139 ARG 4.79 3.73 1 140 ILE 4.55 4.07 1 141 ILE 4.45 3.66 1 142 ARG 2.43 1.98 1 143 THR 0.64 1.32 1 144 LYS -0.21 -0.05 1 145 VAL 0.90 0.51 1 146 GLN 0.15 0.08 1 147 GLN -0.28 -0.07 1 150 ASN 0.50 0.40 1 151 GLN 0.50 1.65 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26730_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 2.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 -1.36 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ARG 5.58 -4.38 0 124 ARG 6.23 -4.76 0 11 THR 0.08 0.04 1 13 ARG 0.58 -0.19 1 14 THR -0.27 0.17 1 15 SER -0.09 0.16 1 16 ARG 0.59 -0.21 1 17 THR -0.03 0.16 1 19 HIS 0.08 0.47 1 22 VAL 0.54 -0.23 1 23 ASN 0.45 -0.12 1 24 GLN 0.41 -0.09 1 25 LEU 0.46 -0.13 1 28 VAL -0.11 0.00 1 29 PHE -1.14 0.74 1 30 VAL -0.73 0.57 1 31 ASN 1.31 -0.53 1 33 ARG -1.01 0.50 1 35 LEU -1.18 1.04 1 37 ASP 4.17 -0.43 1 38 VAL 4.32 -1.42 1 39 VAL 5.04 -1.27 1 40 ARG 5.73 -1.13 1 41 GLN 4.23 -1.28 1 42 ARG 3.16 -0.87 1 43 ILE 6.04 -0.76 1 44 VAL 5.71 -1.21 1 45 GLU 2.96 -0.03 1 46 LEU 3.32 -0.63 1 47 ALA 3.17 -0.47 1 48 HIS 3.89 -0.59 1 49 GLN 1.03 -0.62 1 51 VAL 2.55 -1.75 1 52 ARG 1.56 -0.20 1 55 ASP 2.91 -0.10 1 56 ILE 6.34 -0.77 1 57 SER 3.84 -0.66 1 58 ARG 3.34 -0.28 1 59 GLN 3.62 -0.32 1 60 LEU -0.44 -0.31 1 62 VAL -5.13 2.32 1 63 SER -1.54 1.01 1 64 HIS 3.19 1.39 1 67 VAL 6.63 -1.29 1 68 SER 5.50 -0.96 1 69 LYS 3.60 -0.64 1 70 ILE 3.68 -1.59 1 71 LEU 3.00 -1.32 1 73 ARG 1.88 -0.75 1 74 TYR 1.65 0.08 1 75 TYR 1.09 -0.12 1 76 GLU 0.27 0.38 1 77 THR 0.15 0.51 1 79 SER -0.37 0.32 1 80 ILE 0.04 -0.08 1 81 LYS -0.07 -0.06 1 84 VAL 0.27 -0.11 1 85 ILE 0.53 -0.33 1 88 SER -0.31 0.26 1 89 LYS 0.29 -0.11 1 91 LYS 0.26 -0.21 1 92 VAL -0.70 0.29 1 93 ALA -0.65 -0.09 1 94 THR 1.86 -1.29 1 96 LYS 3.48 -1.07 1 97 VAL 5.83 -1.27 1 98 VAL 6.83 -1.42 1 99 GLU 2.89 -0.53 1 100 LYS 3.63 -2.57 1 101 ILE 6.74 -1.18 1 102 ALA 3.78 -1.25 1 103 GLU 3.08 -0.27 1 104 TYR 2.17 -2.34 1 105 LYS 1.10 -0.83 1 106 ARG 3.63 -0.61 1 107 GLN 2.22 -0.31 1 108 ASN -1.39 0.54 1 110 THR 0.31 -1.15 1 111 MET 0.76 1.29 1 112 PHE -1.64 1.12 1 113 ALA 3.96 -0.16 1 114 TRP 4.77 -2.62 1 115 GLU 1.86 0.23 1 116 ILE 5.88 -1.22 1 117 ARG 6.20 -1.45 1 118 ASP 4.34 -1.05 1 119 ARG 5.11 -1.38 1 120 LEU 2.41 0.54 1 121 LEU 1.96 -0.04 1 122 ALA 3.47 -0.52 1 123 GLU 0.36 -0.40 1 125 VAL 3.04 -0.27 1 127 ASP -3.23 1.41 1 128 ASN 4.08 -0.33 1 129 ASP 1.37 0.40 1 130 THR -1.79 1.24 1 131 VAL -1.20 0.15 1 133 SER -2.78 1.46 1 134 VAL 7.02 -1.33 1 135 SER 4.58 -1.36 1 136 SER 4.63 -1.12 1 137 ILE 6.09 -0.81 1 138 ASN 3.88 -0.64 1 139 ARG 4.79 -1.06 1 140 ILE 4.55 -0.48 1 141 ILE 4.45 -0.79 1 142 ARG 2.43 -0.45 1 143 THR 0.64 0.68 1 144 LYS -0.21 0.16 1 145 VAL 0.90 -0.39 1 146 GLN 0.15 -0.07 1 147 GLN -0.28 0.21 1 150 ASN 0.50 -0.10 1 151 GLN 0.50 1.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26730_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 -1.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.31 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 2.17 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 ALA 3.17 4.70 0 151 GLN 0.50 4.30 0 11 THR 0.08 -0.20 1 13 ARG 0.58 0.40 1 14 THR -0.27 -0.20 1 15 SER -0.09 0.00 1 16 ARG 0.59 0.20 1 17 THR -0.03 0.40 1 19 HIS 0.08 1.10 1 22 VAL 0.54 -0.20 1 23 ASN 0.45 -0.10 1 24 GLN 0.41 -0.10 1 25 LEU 0.46 0.20 1 28 VAL -0.11 -0.90 1 29 PHE -1.14 -0.10 1 30 VAL -0.73 -0.50 1 31 ASN 1.31 0.40 1 33 ARG -1.01 -1.00 1 35 LEU -1.18 -0.60 1 37 ASP 4.17 1.90 1 38 VAL 4.32 1.30 1 39 VAL 5.04 0.90 1 40 ARG 5.73 1.30 1 41 GLN 4.23 2.30 1 42 ARG 3.16 1.60 1 43 ILE 6.04 0.30 1 44 VAL 5.71 1.80 1 45 GLU 2.96 3.10 1 46 LEU 3.32 2.10 1 48 HIS 3.89 2.30 1 49 GLN 1.03 0.10 1 51 VAL 2.55 -0.20 1 52 ARG 1.56 2.30 1 55 ASP 2.91 1.70 1 56 ILE 6.34 1.00 1 57 SER 3.84 2.10 1 58 ARG 3.34 2.50 1 59 GLN 3.62 1.90 1 60 LEU -0.44 -2.00 1 61 ARG 5.58 -0.90 1 62 VAL -5.13 -0.80 1 63 SER -1.54 0.60 1 64 HIS 3.19 4.20 1 67 VAL 6.63 1.10 1 68 SER 5.50 2.60 1 69 LYS 3.60 2.50 1 70 ILE 3.68 1.90 1 71 LEU 3.00 1.10 1 73 ARG 1.88 0.90 1 74 TYR 1.65 0.50 1 75 TYR 1.09 0.40 1 76 GLU 0.27 0.40 1 77 THR 0.15 0.80 1 79 SER -0.37 -0.30 1 80 ILE 0.04 -0.60 1 81 LYS -0.07 -0.50 1 84 VAL 0.27 0.10 1 85 ILE 0.53 0.40 1 88 SER -0.31 -0.40 1 89 LYS 0.29 -0.40 1 91 LYS 0.26 0.00 1 92 VAL -0.70 -0.60 1 93 ALA -0.65 -1.00 1 94 THR 1.86 0.20 1 96 LYS 3.48 1.80 1 97 VAL 5.83 1.00 1 98 VAL 6.83 1.30 1 99 GLU 2.89 2.80 1 100 LYS 3.63 0.20 1 101 ILE 6.74 0.60 1 102 ALA 3.78 2.20 1 103 GLU 3.08 2.70 1 104 TYR 2.17 3.30 1 105 LYS 1.10 1.40 1 106 ARG 3.63 2.30 1 107 GLN 2.22 0.60 1 108 ASN -1.39 -1.40 1 110 THR 0.31 0.30 1 111 MET 0.76 -0.40 1 112 PHE -1.64 2.30 1 113 ALA 3.96 2.00 1 114 TRP 4.77 1.10 1 115 GLU 1.86 3.30 1 116 ILE 5.88 0.00 1 117 ARG 6.20 0.90 1 118 ASP 4.34 2.80 1 119 ARG 5.11 1.10 1 120 LEU 2.41 2.80 1 121 LEU 1.96 3.50 1 122 ALA 3.47 2.60 1 123 GLU 0.36 -1.00 1 124 ARG 6.23 -0.30 1 125 VAL 3.04 0.40 1 127 ASP -3.23 0.00 1 128 ASN 4.08 1.10 1 129 ASP 1.37 1.30 1 130 THR -1.79 0.40 1 131 VAL -1.20 -2.40 1 133 SER -2.78 0.80 1 134 VAL 7.02 1.60 1 135 SER 4.58 3.20 1 136 SER 4.63 2.00 1 137 ILE 6.09 1.10 1 138 ASN 3.88 2.20 1 139 ARG 4.79 2.80 1 140 ILE 4.55 2.10 1 141 ILE 4.45 0.80 1 142 ARG 2.43 0.90 1 143 THR 0.64 0.50 1 144 LYS -0.21 -0.10 1 145 VAL 0.90 -0.50 1 146 GLN 0.15 -0.60 1 147 GLN -0.28 -0.90 1 150 ASN 0.50 -1.00 1 stop_ save_