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 bmr19921_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -2.86 _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 -1.72 _LACS_plot.Line_2_terminator_val_x_2 5.05 _LACS_plot.Line_2_terminator_val_y_2 3.46 _LACS_plot.Y_axis_chem_shift_offset 0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 ASP -4.42 0.91 0 29 MET 3.00 4.62 0 10 THR 0.58 -0.11 1 11 GLN 1.02 -0.09 1 12 ALA 1.22 1.09 1 13 PHE 1.97 1.35 1 14 ASP 2.16 0.15 1 15 SER -0.35 0.75 1 16 THR 2.18 1.23 1 17 TRP -4.97 -2.67 1 18 LYS -4.53 -2.04 1 19 VAL 3.53 1.90 1 21 ARG -1.32 -1.31 1 22 SER -3.39 -1.32 1 23 GLU -4.32 -1.56 1 24 ASN 0.18 0.73 1 25 TYR 0.46 1.00 1 26 ASP 4.35 3.98 1 27 LYS 3.53 1.73 1 28 PHE 3.02 3.79 1 30 GLU 3.32 2.74 1 31 LYS 2.31 0.72 1 32 MET 0.50 0.20 1 34 VAL 1.00 -0.02 1 35 ASN 0.13 0.77 1 36 ILE 3.79 3.47 1 37 VAL 5.06 3.65 1 38 LYS 2.73 1.98 1 39 ARG 3.87 3.51 1 40 LYS 4.20 2.97 1 41 LEU 2.03 1.55 1 42 ALA 1.38 1.86 1 43 ALA 1.26 0.56 1 44 HIS -0.77 -1.77 1 45 ASP 0.61 0.07 1 46 ASN 1.83 0.12 1 47 LEU 1.84 1.66 1 48 LYS -4.37 -1.69 1 49 LEU -6.80 -3.02 1 50 THR 0.57 0.51 1 51 ILE -0.96 -0.23 1 52 THR -2.68 -1.34 1 53 GLN -2.22 -1.70 1 54 GLU -3.23 -2.28 1 56 ASN -0.12 -0.43 1 57 LYS -2.22 -1.24 1 58 PHE -4.71 -1.77 1 59 THR 0.01 -0.10 1 60 VAL -2.68 -1.27 1 61 LYS -0.37 -1.06 1 62 GLU -3.25 -1.47 1 63 SER -3.31 -2.26 1 64 SER -5.96 -1.73 1 65 ALA 1.33 0.90 1 66 PHE 0.54 1.58 1 67 ARG 0.08 -0.71 1 68 ASN -2.28 -0.59 1 69 ILE -6.20 -1.68 1 70 GLU -4.45 -1.86 1 71 VAL -3.36 -1.29 1 72 VAL -3.80 -2.57 1 73 PHE -4.14 -2.71 1 74 GLU -5.94 -3.63 1 75 LEU 2.30 0.91 1 77 VAL 0.09 -0.32 1 78 THR 3.26 2.00 1 79 PHE -4.30 -2.20 1 80 ASN -3.30 -1.89 1 81 TYR -4.97 -0.85 1 82 ASN -3.22 -2.41 1 83 LEU -1.26 -1.23 1 84 ALA 3.30 1.38 1 85 ASP -0.50 -1.82 1 87 THR 4.94 2.75 1 88 GLU -1.28 -0.03 1 89 LEU -6.28 -2.61 1 90 ARG -4.50 -1.88 1 92 THR -5.87 -3.11 1 93 TRP -6.29 -2.01 1 94 SER -2.70 -1.08 1 95 LEU -3.30 -1.01 1 96 GLU -2.86 -1.83 1 98 ASN -0.31 -0.68 1 99 LYS -3.50 -1.02 1 100 LEU -3.46 -2.17 1 101 ILE -1.00 -1.69 1 103 LYS -1.39 -1.14 1 104 PHE -6.30 -2.25 1 105 LYS -4.47 -1.54 1 106 ARG -0.49 -0.13 1 107 THR 3.79 1.76 1 108 ASP 4.06 1.32 1 109 ASN -1.96 -1.88 1 111 ASN -0.70 -0.65 1 112 GLU -1.75 -0.18 1 113 LEU -3.13 -0.12 1 114 ASN -4.24 -1.42 1 115 THR -4.11 -3.94 1 116 VAL -5.28 -1.85 1 117 ARG -4.57 -1.45 1 118 GLU -6.62 -2.53 1 119 ILE 0.17 -2.55 1 120 ILE -0.69 -0.71 1 122 ASP -0.47 -0.37 1 123 GLU -4.49 -1.64 1 124 LEU -0.51 -1.36 1 125 VAL -0.55 -0.57 1 126 GLN -2.77 -2.82 1 127 THR -1.26 -1.16 1 128 TYR -7.24 -3.62 1 129 VAL -2.22 -0.60 1 130 TYR -4.75 -0.26 1 131 GLU 0.46 -1.01 1 133 VAL 0.41 0.00 1 134 GLU -5.73 -3.03 1 135 ALA -6.82 -2.35 1 136 LYS -6.39 -1.85 1 137 ARG -1.90 0.60 1 138 ILE -1.14 -0.14 1 139 PHE -5.17 -2.09 1 140 LYS -5.33 -2.03 1 141 LYS 1.11 0.67 1 142 ASP -2.30 0.86 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19921_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 4.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 5.05 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _LACS_plot.Y_axis_chem_shift_offset 0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 ASP -4.42 5.33 0 29 MET 3.00 1.62 0 10 THR 0.58 -0.69 1 11 GLN 1.02 -1.11 1 12 ALA 1.22 -0.13 1 13 PHE 1.97 -0.62 1 14 ASP 2.16 -2.01 1 15 SER -0.35 1.10 1 16 THR 2.18 -0.95 1 17 TRP -4.97 2.30 1 18 LYS -4.53 2.49 1 19 VAL 3.53 -1.63 1 21 ARG -1.32 0.01 1 22 SER -3.39 2.07 1 23 GLU -4.32 2.76 1 24 ASN 0.18 0.55 1 25 TYR 0.46 0.54 1 26 ASP 4.35 -0.37 1 27 LYS 3.53 -1.80 1 28 PHE 3.02 0.77 1 30 GLU 3.32 -0.58 1 31 LYS 2.31 -1.59 1 32 MET 0.50 -0.30 1 34 VAL 1.00 -1.02 1 35 ASN 0.13 0.64 1 36 ILE 3.79 -0.32 1 37 VAL 5.06 -1.41 1 38 LYS 2.73 -0.75 1 39 ARG 3.87 -0.36 1 40 LYS 4.20 -1.23 1 41 LEU 2.03 -0.48 1 42 ALA 1.38 0.48 1 43 ALA 1.26 -0.70 1 44 HIS -0.77 -1.00 1 45 ASP 0.61 -0.54 1 46 ASN 1.83 -1.71 1 47 LEU 1.84 -0.18 1 48 LYS -4.37 2.68 1 49 LEU -6.80 3.78 1 50 THR 0.57 -0.06 1 51 ILE -0.96 0.73 1 52 THR -2.68 1.34 1 53 GLN -2.22 0.52 1 54 GLU -3.23 0.95 1 56 ASN -0.12 -0.31 1 57 LYS -2.22 0.98 1 58 PHE -4.71 2.94 1 59 THR 0.01 -0.11 1 60 VAL -2.68 1.41 1 61 LYS -0.37 -0.69 1 62 GLU -3.25 1.78 1 63 SER -3.31 1.05 1 64 SER -5.96 4.23 1 65 ALA 1.33 -0.43 1 66 PHE 0.54 1.04 1 67 ARG 0.08 -0.79 1 68 ASN -2.28 1.69 1 69 ILE -6.20 4.52 1 70 GLU -4.45 2.59 1 71 VAL -3.36 2.07 1 72 VAL -3.80 1.23 1 73 PHE -4.14 1.43 1 74 GLU -5.94 2.31 1 75 LEU 2.30 -1.39 1 77 VAL 0.09 -0.41 1 78 THR 3.26 -1.26 1 79 PHE -4.30 2.10 1 80 ASN -3.30 1.41 1 81 TYR -4.97 4.12 1 82 ASN -3.22 0.81 1 83 LEU -1.26 0.03 1 84 ALA 3.30 -1.92 1 85 ASP -0.50 -1.32 1 87 THR 4.94 -2.19 1 88 GLU -1.28 1.25 1 89 LEU -6.28 3.67 1 90 ARG -4.50 2.62 1 92 THR -5.87 2.76 1 93 TRP -6.29 4.28 1 94 SER -2.70 1.62 1 95 LEU -3.30 2.29 1 96 GLU -2.86 1.03 1 98 ASN -0.31 -0.37 1 99 LYS -3.50 2.48 1 100 LEU -3.46 1.29 1 101 ILE -1.00 -0.69 1 103 LYS -1.39 0.25 1 104 PHE -6.30 4.05 1 105 LYS -4.47 2.93 1 106 ARG -0.49 0.36 1 107 THR 3.79 -2.03 1 108 ASP 4.06 -2.74 1 109 ASN -1.96 0.08 1 111 ASN -0.70 0.05 1 112 GLU -1.75 1.57 1 113 LEU -3.13 3.01 1 114 ASN -4.24 2.82 1 115 THR -4.11 0.17 1 116 VAL -5.28 3.43 1 117 ARG -4.57 3.12 1 118 GLU -6.62 4.09 1 119 ILE 0.17 -2.72 1 120 ILE -0.69 -0.02 1 122 ASP -0.47 0.10 1 123 GLU -4.49 2.85 1 124 LEU -0.51 -0.85 1 125 VAL -0.55 -0.02 1 126 GLN -2.77 -0.05 1 127 THR -1.26 0.10 1 128 TYR -7.24 3.62 1 129 VAL -2.22 1.62 1 130 TYR -4.75 4.49 1 131 GLU 0.46 -1.47 1 133 VAL 0.41 -0.41 1 134 GLU -5.73 2.70 1 135 ALA -6.82 4.47 1 136 LYS -6.39 4.54 1 137 ARG -1.90 2.50 1 138 ILE -1.14 1.00 1 139 PHE -5.17 3.08 1 140 LYS -5.33 3.30 1 141 LYS 1.11 -0.44 1 142 ASP -2.30 3.16 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19921_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _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 -0.24 _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 5.05 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 GLN -2.77 1.37 0 131 GLU 0.46 -1.02 0 16 THR 2.18 0.68 0 29 MET 3.00 -1.30 0 10 THR 0.58 -0.09 1 11 GLN 1.02 -0.10 1 12 ALA 1.22 -0.36 1 13 PHE 1.97 -0.25 1 14 ASP 2.16 0.17 1 15 SER -0.35 -0.34 1 17 TRP -4.97 0.52 1 18 LYS -4.53 1.06 1 19 VAL 3.53 -0.87 1 20 ASP -4.42 0.22 1 21 ARG -1.32 0.33 1 22 SER -3.39 0.76 1 23 GLU -4.32 0.31 1 24 ASN 0.18 -0.09 1 25 TYR 0.46 -0.15 1 26 ASP 4.35 -0.58 1 27 LYS 3.53 -0.35 1 28 PHE 3.02 -0.71 1 30 GLU 3.32 -0.62 1 31 LYS 2.31 -0.30 1 32 MET 0.50 -0.89 1 34 VAL 1.00 -0.52 1 35 ASN 0.13 -0.42 1 36 ILE 3.79 -0.53 1 37 VAL 5.06 -0.50 1 38 LYS 2.73 -0.25 1 39 ARG 3.87 -0.54 1 40 LYS 4.20 -0.33 1 41 LEU 2.03 -0.32 1 42 ALA 1.38 -0.21 1 43 ALA 1.26 -0.22 1 44 HIS -0.77 0.21 1 45 ASP 0.61 -0.71 1 46 ASN 1.83 -0.56 1 47 LEU 1.84 -0.06 1 48 LYS -4.37 1.25 1 49 LEU -6.80 1.19 1 50 THR 0.57 0.86 1 51 ILE -0.96 0.68 1 52 THR -2.68 0.07 1 53 GLN -2.22 -0.19 1 54 GLU -3.23 -0.04 1 56 ASN -0.12 0.01 1 57 LYS -2.22 0.53 1 58 PHE -4.71 0.04 1 59 THR 0.01 0.38 1 60 VAL -2.68 0.56 1 61 LYS -0.37 0.54 1 62 GLU -3.25 0.54 1 63 SER -3.31 1.01 1 64 SER -5.96 0.46 1 65 ALA 1.33 -0.31 1 66 PHE 0.54 -0.22 1 67 ARG 0.08 0.28 1 68 ASN -2.28 1.14 1 69 ILE -6.20 0.67 1 70 GLU -4.45 0.92 1 71 VAL -3.36 0.26 1 72 VAL -3.80 0.96 1 73 PHE -4.14 0.19 1 74 GLU -5.94 0.93 1 75 LEU 2.30 0.10 1 77 VAL 0.09 0.19 1 78 THR 3.26 -0.09 1 79 PHE -4.30 0.44 1 80 ASN -3.30 0.85 1 81 TYR -4.97 0.03 1 82 ASN -3.22 0.56 1 83 LEU -1.26 -0.42 1 84 ALA 3.30 -0.67 1 85 ASP -0.50 -0.38 1 87 THR 4.94 -0.70 1 88 GLU -1.28 0.21 1 89 LEU -6.28 0.91 1 90 ARG -4.50 0.98 1 92 THR -5.87 0.16 1 93 TRP -6.29 0.61 1 94 SER -2.70 0.23 1 95 LEU -3.30 0.78 1 96 GLU -2.86 0.19 1 98 ASN -0.31 0.02 1 99 LYS -3.50 0.60 1 100 LEU -3.46 0.58 1 101 ILE -1.00 0.42 1 103 LYS -1.39 0.36 1 104 PHE -6.30 0.37 1 105 LYS -4.47 0.66 1 106 ARG -0.49 0.37 1 107 THR 3.79 -0.35 1 108 ASP 4.06 -0.41 1 109 ASN -1.96 -0.06 1 111 ASN -0.70 -0.11 1 112 GLU -1.75 0.34 1 113 LEU -3.13 0.74 1 114 ASN -4.24 0.84 1 115 THR -4.11 1.21 1 116 VAL -5.28 1.22 1 117 ARG -4.57 0.67 1 118 GLU -6.62 0.50 1 119 ILE 0.17 0.57 1 120 ILE -0.69 0.00 1 122 ASP -0.47 0.05 1 123 GLU -4.49 0.71 1 124 LEU -0.51 -0.04 1 125 VAL -0.55 0.32 1 127 THR -1.26 0.51 1 128 TYR -7.24 0.58 1 129 VAL -2.22 1.15 1 130 TYR -4.75 0.27 1 133 VAL 0.41 0.01 1 134 GLU -5.73 1.32 1 135 ALA -6.82 0.71 1 136 LYS -6.39 1.08 1 137 ARG -1.90 0.34 1 138 ILE -1.14 0.75 1 139 PHE -5.17 0.55 1 140 LYS -5.33 0.93 1 141 LYS 1.11 -0.21 1 142 ASP -2.30 -0.21 1 stop_ save_