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 bmr25439_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.58 _LACS_plot.Line_1_terminator_val_y_1 -3.67 _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 -1.53 _LACS_plot.Line_2_terminator_val_x_2 9.11 _LACS_plot.Line_2_terminator_val_y_2 7.39 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 125 ARG 0.12 -2.82 0 89 ALA -7.58 -3.38 0 87 LYS 6.79 1.69 0 10 ARG -0.15 0.01 1 11 SER 0.08 0.27 1 12 LYS 0.12 0.21 1 14 ALA -0.74 -0.77 1 16 ASP 2.15 2.23 1 18 PHE 2.98 3.02 1 19 GLU 4.03 2.63 1 20 LYS 2.42 2.05 1 21 ILE -0.35 -0.01 1 22 LYS 9.11 6.72 1 24 THR 5.85 4.78 1 25 LEU 5.55 3.64 1 26 THR 6.22 5.03 1 27 ASP 4.73 3.96 1 28 PHE 4.96 4.83 1 29 GLU 3.46 3.25 1 30 ILE 4.68 3.90 1 31 GLN 3.43 3.81 1 32 LEU 3.29 3.23 1 33 ARG 4.20 3.34 1 34 ASP 3.90 3.00 1 35 ALA 2.07 1.71 1 36 GLN 0.53 0.87 1 37 LYS 1.44 1.23 1 38 ASP 0.75 0.78 1 39 LYS 0.81 0.53 1 40 SER 0.95 0.89 1 41 SER 0.72 0.63 1 42 LYS 0.99 0.65 1 43 LEU 0.43 0.24 1 44 ALA 0.31 0.35 1 45 ALA 0.01 0.23 1 46 LYS 0.34 0.07 1 47 SER -0.08 0.18 1 48 ASN 2.81 1.56 1 49 GLU 3.51 2.61 1 50 GLN 3.33 2.83 1 51 LEU 3.39 2.38 1 52 TRP 1.57 0.85 1 53 GLU 3.65 3.43 1 54 ILE 4.68 4.41 1 55 MET 3.88 2.82 1 56 GLN 4.88 3.30 1 57 LEU 3.29 3.59 1 58 HIS 4.20 5.73 1 59 HIS 6.01 5.74 1 60 GLN 4.10 3.81 1 62 SER 6.75 6.53 1 63 ARG 4.67 2.85 1 64 TYR 3.52 3.11 1 65 ILE 5.37 4.59 1 66 TYR 2.89 3.86 1 67 THR 6.31 5.22 1 68 LEU 2.60 3.38 1 69 TYR 1.35 2.93 1 70 TYR 4.88 4.13 1 71 LYS 1.74 0.62 1 72 ARG 0.08 0.31 1 73 LYS 5.12 0.92 1 74 ALA -2.36 0.10 1 76 SER -2.82 -1.22 1 77 LYS 4.15 3.42 1 78 ASP 3.87 3.16 1 80 TYR 5.39 4.96 1 81 ASP 4.12 3.02 1 82 TRP 4.50 4.87 1 83 LEU 3.77 3.19 1 84 ILE 4.19 1.63 1 85 LYS 4.51 3.44 1 86 GLU -0.58 -1.02 1 88 TYR 2.60 3.33 1 90 ASP -2.23 -1.49 1 91 LYS 3.46 3.21 1 92 LEU 3.25 1.95 1 93 LEU 2.45 1.87 1 94 ILE 4.67 4.08 1 95 ALA 3.32 2.34 1 96 LYS 2.80 0.75 1 97 TRP 1.07 -0.36 1 98 ARG 0.88 0.23 1 99 LYS -2.33 -1.26 1 100 THR 3.47 2.87 1 102 TYR -0.81 -0.20 1 103 GLU 4.86 4.61 1 104 LYS -1.38 -1.99 1 105 LEU -0.01 1.45 1 108 LEU 2.18 1.01 1 109 ARG 4.25 2.31 1 111 ILE -0.14 -0.62 1 112 GLN 0.02 0.28 1 113 LYS 0.60 0.35 1 114 ASN -0.63 -0.20 1 115 GLU 2.32 2.01 1 116 THR 1.68 1.36 1 117 ASN 0.25 0.01 1 118 ASN 1.60 0.87 1 120 SER -1.01 -0.33 1 121 THR -1.35 -0.58 1 123 ILE 2.83 2.25 1 126 VAL 0.59 0.85 1 128 ARG 5.21 3.65 1 129 ALA 3.47 2.73 1 130 GLN 3.99 2.81 1 131 LEU 3.43 2.85 1 132 GLU 3.31 2.75 1 133 GLU 3.17 2.69 1 134 GLU 3.21 2.73 1 135 ALA 3.42 2.47 1 136 ARG 4.19 3.44 1 137 LYS 3.69 3.13 1 138 LYS -0.15 0.38 1 140 THR -3.44 -2.49 1 141 GLN -2.64 -1.26 1 142 VAL 2.48 1.73 1 143 SER -0.83 -0.46 1 144 PHE 0.52 0.97 1 145 HIS -1.11 1.84 1 146 GLN -5.01 -1.49 1 148 VAL 2.54 1.80 1 149 HIS 0.51 3.71 1 153 ARG 0.71 0.16 1 156 ALA 0.85 0.69 1 157 SER 2.06 1.84 1 158 THR -0.74 -0.54 1 159 ASP 0.74 1.93 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25439_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.58 _LACS_plot.Line_1_terminator_val_y_1 3.91 _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 0.47 _LACS_plot.Line_2_terminator_val_x_2 9.11 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 125 ARG 0.12 -2.94 0 89 ALA -7.58 4.20 0 87 LYS 6.79 -5.10 0 10 ARG -0.15 0.16 1 11 SER 0.08 0.19 1 12 LYS 0.12 0.09 1 14 ALA -0.74 -0.03 1 16 ASP 2.15 0.08 1 18 PHE 2.98 0.04 1 19 GLU 4.03 -1.40 1 20 LYS 2.42 -0.37 1 21 ILE -0.35 0.34 1 22 LYS 9.11 -2.39 1 24 THR 5.85 -1.07 1 25 LEU 5.55 -1.91 1 26 THR 6.22 -1.19 1 27 ASP 4.73 -0.77 1 28 PHE 4.96 -0.13 1 29 GLU 3.46 -0.21 1 30 ILE 4.68 -0.78 1 31 GLN 3.43 0.38 1 32 LEU 3.29 -0.06 1 33 ARG 4.20 -0.86 1 34 ASP 3.90 -0.90 1 35 ALA 2.07 -0.36 1 36 GLN 0.53 0.34 1 37 LYS 1.44 -0.21 1 38 ASP 0.75 0.03 1 39 LYS 0.81 -0.28 1 40 SER 0.95 -0.06 1 41 SER 0.72 -0.09 1 42 LYS 0.99 -0.34 1 43 LEU 0.43 -0.19 1 44 ALA 0.31 0.04 1 45 ALA 0.01 0.22 1 46 LYS 0.34 -0.27 1 47 SER -0.08 0.26 1 48 ASN 2.81 -1.25 1 49 GLU 3.51 -0.90 1 50 GLN 3.33 -0.50 1 51 LEU 3.39 -1.01 1 52 TRP 1.57 -0.72 1 53 GLU 3.65 -0.22 1 54 ILE 4.68 -0.27 1 55 MET 3.88 -1.06 1 56 GLN 4.88 -1.58 1 57 LEU 3.29 0.30 1 58 HIS 4.20 1.53 1 59 HIS 6.01 -0.27 1 60 GLN 4.10 -0.29 1 62 SER 6.75 -0.22 1 63 ARG 4.67 -1.82 1 64 TYR 3.52 -0.41 1 65 ILE 5.37 -0.78 1 66 TYR 2.89 0.97 1 67 THR 6.31 -1.09 1 68 LEU 2.60 0.78 1 69 TYR 1.35 1.58 1 70 TYR 4.88 -0.75 1 71 LYS 1.74 -1.12 1 72 ARG 0.08 0.23 1 73 LYS 5.12 -4.20 1 74 ALA -2.36 2.46 1 76 SER -2.82 1.60 1 77 LYS 4.15 -0.73 1 78 ASP 3.87 -0.71 1 80 TYR 5.39 -0.43 1 81 ASP 4.12 -1.10 1 82 TRP 4.50 0.37 1 83 LEU 3.77 -0.58 1 84 ILE 4.19 -2.56 1 85 LYS 4.51 -1.07 1 86 GLU -0.58 -0.44 1 88 TYR 2.60 0.73 1 90 ASP -2.23 0.74 1 91 LYS 3.46 -0.25 1 92 LEU 3.25 -1.30 1 93 LEU 2.45 -0.58 1 94 ILE 4.67 -0.59 1 95 ALA 3.32 -0.98 1 96 LYS 2.80 -2.05 1 97 TRP 1.07 -1.43 1 98 ARG 0.88 -0.65 1 99 LYS -2.33 1.07 1 100 THR 3.47 -0.60 1 102 TYR -0.81 0.61 1 103 GLU 4.86 -0.25 1 104 LYS -1.38 -0.61 1 105 LEU -0.01 1.46 1 108 LEU 2.18 -1.17 1 109 ARG 4.25 -1.94 1 111 ILE -0.14 -0.48 1 112 GLN 0.02 0.26 1 113 LYS 0.60 -0.25 1 114 ASN -0.63 0.43 1 115 GLU 2.32 -0.31 1 116 THR 1.68 -0.32 1 117 ASN 0.25 -0.24 1 118 ASN 1.60 -0.73 1 120 SER -1.01 0.68 1 121 THR -1.35 0.77 1 123 ILE 2.83 -0.58 1 126 VAL 0.59 0.26 1 128 ARG 5.21 -1.56 1 129 ALA 3.47 -0.74 1 130 GLN 3.99 -1.18 1 131 LEU 3.43 -0.58 1 132 GLU 3.31 -0.56 1 133 GLU 3.17 -0.48 1 134 GLU 3.21 -0.48 1 135 ALA 3.42 -0.95 1 136 ARG 4.19 -0.75 1 137 LYS 3.69 -0.56 1 138 LYS -0.15 0.53 1 140 THR -3.44 0.95 1 141 GLN -2.64 1.38 1 142 VAL 2.48 -0.75 1 143 SER -0.83 0.37 1 144 PHE 0.52 0.45 1 145 HIS -1.11 2.95 1 146 GLN -5.01 3.52 1 148 VAL 2.54 -0.74 1 149 HIS 0.51 3.20 1 153 ARG 0.71 -0.55 1 156 ALA 0.85 -0.16 1 157 SER 2.06 -0.22 1 158 THR -0.74 0.20 1 159 ASP 0.74 1.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25439_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.58 _LACS_plot.Line_1_terminator_val_y_1 0.47 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 9.11 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _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 14 ALA -0.74 -1.73 0 10 ARG -0.15 0.08 1 11 SER 0.08 0.00 1 12 LYS 0.12 0.06 1 16 ASP 2.15 -0.26 1 18 PHE 2.98 -0.50 1 19 GLU 4.03 -0.58 1 20 LYS 2.42 -0.15 1 21 ILE -0.35 0.55 1 22 LYS 9.11 -1.01 1 24 THR 5.85 -0.48 1 25 LEU 5.55 0.06 1 26 THR 6.22 -0.26 1 27 ASP 4.73 -0.16 1 28 PHE 4.96 -0.16 1 29 GLU 3.46 -0.24 1 30 ILE 4.68 -0.45 1 31 GLN 3.43 -0.16 1 32 LEU 3.29 -0.31 1 33 ARG 4.20 -0.23 1 34 ASP 3.90 -0.16 1 35 ALA 2.07 0.00 1 36 GLN 0.53 -0.09 1 37 LYS 1.44 -0.09 1 38 ASP 0.75 -0.05 1 39 LYS 0.81 0.05 1 40 SER 0.95 -0.05 1 41 SER 0.72 -0.02 1 42 LYS 0.99 0.00 1 43 LEU 0.43 -0.03 1 44 ALA 0.31 -0.05 1 45 ALA 0.01 -0.02 1 46 LYS 0.34 0.03 1 47 SER -0.08 -0.10 1 48 ASN 2.81 -0.38 1 49 GLU 3.51 -1.00 1 50 GLN 3.33 -0.09 1 51 LEU 3.39 -0.11 1 52 TRP 1.57 -0.14 1 53 GLU 3.65 -0.21 1 54 ILE 4.68 -0.50 1 55 MET 3.88 -0.03 1 56 GLN 4.88 -0.01 1 57 LEU 3.29 -0.04 1 58 HIS 4.20 -0.41 1 59 HIS 6.01 -0.41 1 60 GLN 4.10 -0.14 1 62 SER 6.75 0.04 1 63 ARG 4.67 -0.14 1 64 TYR 3.52 0.13 1 65 ILE 5.37 -0.68 1 66 TYR 2.89 0.03 1 67 THR 6.31 -0.79 1 68 LEU 2.60 -0.56 1 69 TYR 1.35 -0.21 1 70 TYR 4.88 -0.85 1 71 LYS 1.74 0.24 1 72 ARG 0.08 -0.09 1 73 LYS 5.12 -0.28 1 74 ALA -2.36 0.07 1 76 SER -2.82 0.01 1 77 LYS 4.15 -0.47 1 78 ASP 3.87 -0.22 1 80 TYR 5.39 -0.76 1 81 ASP 4.12 -0.57 1 82 TRP 4.50 -0.50 1 83 LEU 3.77 -0.37 1 84 ILE 4.19 -0.31 1 85 LYS 4.51 -0.41 1 86 GLU -0.58 -0.51 1 87 LYS 6.79 -0.50 1 88 TYR 2.60 -0.41 1 89 ALA -7.58 0.42 1 90 ASP -2.23 -0.10 1 91 LYS 3.46 -0.49 1 92 LEU 3.25 -0.32 1 93 LEU 2.45 -0.84 1 94 ILE 4.67 -0.90 1 95 ALA 3.32 -0.39 1 96 LYS 2.80 -0.52 1 97 TRP 1.07 0.15 1 98 ARG 0.88 -0.11 1 99 LYS -2.33 0.31 1 100 THR 3.47 -0.13 1 102 TYR -0.81 0.15 1 103 GLU 4.86 0.25 1 104 LYS -1.38 -0.03 1 105 LEU -0.01 0.04 1 108 LEU 2.18 -0.29 1 109 ARG 4.25 -0.35 1 111 ILE -0.14 0.51 1 112 GLN 0.02 -0.07 1 113 LYS 0.60 -0.07 1 114 ASN -0.63 0.04 1 115 GLU 2.32 -0.10 1 116 THR 1.68 -0.03 1 117 ASN 0.25 0.09 1 118 ASN 1.60 -0.12 1 120 SER -1.01 0.12 1 121 THR -1.35 0.10 1 123 ILE 2.83 -0.14 1 125 ARG 0.12 -0.19 1 126 VAL 0.59 -0.36 1 128 ARG 5.21 -0.43 1 129 ALA 3.47 -0.13 1 130 GLN 3.99 -0.13 1 131 LEU 3.43 -0.25 1 132 GLU 3.31 -0.39 1 133 GLU 3.17 -0.19 1 134 GLU 3.21 -0.35 1 135 ALA 3.42 -0.27 1 136 ARG 4.19 -0.20 1 137 LYS 3.69 -0.25 1 138 LYS -0.15 0.04 1 140 THR -3.44 0.39 1 141 GLN -2.64 0.27 1 142 VAL 2.48 -0.33 1 143 SER -0.83 0.05 1 144 PHE 0.52 -0.16 1 145 HIS -1.11 -0.39 1 146 GLN -5.01 0.09 1 148 VAL 2.54 0.12 1 149 HIS 0.51 -0.13 1 153 ARG 0.71 0.44 1 156 ALA 0.85 -0.16 1 157 SER 2.06 -0.19 1 158 THR -0.74 0.01 1 159 ASP 0.74 -0.15 1 stop_ save_