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 bmr18096_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -0.89 _LACS_plot.Line_1_terminator_val_y_1 -0.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.48 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 7.06 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 GLU 0.08 1.13 0 58 LYS 0.95 -0.09 0 10 TYR 3.39 3.31 1 11 THR 6.61 5.39 1 12 ILE 4.56 3.72 1 13 ASN 1.51 2.16 1 14 LEU 1.90 1.27 1 15 ILE 7.77 6.75 1 19 VAL 6.01 4.86 1 20 LEU 4.02 3.55 1 21 ILE 5.14 4.26 1 22 THR 7.72 6.35 1 23 SER 6.41 5.58 1 24 LEU 3.40 2.94 1 25 ALA 3.96 3.11 1 26 ILE 5.21 4.24 1 27 LEU 4.20 3.64 1 28 VAL 4.66 3.81 1 29 PHE 3.16 3.16 1 30 TYR 0.65 1.49 1 31 LEU -0.89 -0.95 1 34 ASP 0.10 0.24 1 37 GLU 2.10 1.93 1 38 LYS 3.79 2.37 1 39 MET 4.13 3.45 1 43 ILE 4.84 3.98 1 44 SER 5.90 5.05 1 45 VAL 5.88 4.74 1 46 LEU 3.85 3.43 1 47 LEU 3.69 3.34 1 48 ALA 4.18 3.21 1 49 LEU 3.66 3.21 1 51 VAL 6.44 5.16 1 52 PHE 4.21 3.94 1 53 LEU 3.17 2.76 1 54 LEU 3.36 2.99 1 55 LEU 3.19 2.76 1 56 ILE 3.52 2.41 1 57 SER 2.89 2.65 1 59 ILE 2.01 1.28 1 60 VAL 0.28 -0.05 1 63 THR -0.57 -0.56 1 64 SER 0.37 0.31 1 65 SER 0.41 0.28 1 66 ASP -0.06 0.04 1 67 SER -0.21 0.09 1 69 SER -0.16 -0.04 1 70 VAL 5.44 4.44 1 72 GLU 3.83 3.52 1 73 TYR 4.11 4.23 1 74 LEU 3.83 3.37 1 75 MET 4.58 3.77 1 76 PHE 4.32 3.68 1 77 THR 8.22 6.62 1 78 MET 4.13 3.41 1 79 VAL 6.46 5.17 1 80 LEU 3.96 3.50 1 81 VAL 6.43 5.14 1 82 THR 8.12 6.79 1 83 PHE 4.82 3.91 1 84 SER 5.81 4.97 1 85 ILE 5.08 4.40 1 86 VAL 6.15 4.85 1 88 SER 5.27 4.42 1 91 VAL 2.39 1.41 1 92 LEU 0.96 0.49 1 93 ASN -0.45 0.16 1 94 VAL 0.60 0.33 1 95 HIS -0.17 0.58 1 96 HIS -0.19 0.58 1 97 ARG 0.10 0.23 1 98 SER -0.11 0.21 1 100 GLU -0.17 -0.13 1 101 THR 0.16 0.18 1 102 HIS 0.44 0.69 1 103 THR 0.15 0.18 1 109 ILE 2.56 1.83 1 110 ASP 3.52 2.60 1 111 ARG 3.52 2.72 1 112 LEU 3.79 3.13 1 113 PHE 5.40 4.69 1 114 LEU 4.03 3.41 1 115 TRP 3.72 3.24 1 116 ILE 5.54 4.89 1 117 PHE 4.91 4.25 1 118 VAL 6.68 5.24 1 119 PHE 5.35 4.90 1 120 VAL 6.48 5.24 1 122 VAL 5.83 5.06 1 123 PHE 5.35 4.39 1 126 ILE 5.59 4.62 1 128 MET 3.59 2.80 1 129 PHE 2.62 2.11 1 130 LEU 0.35 0.37 1 131 GLN 8.60 6.62 1 133 LEU 1.71 1.30 1 134 PHE 0.03 0.04 1 135 GLN -0.06 0.41 1 136 GLU -0.45 -0.12 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18096_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -0.89 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.52 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -1.53 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 GLU 0.08 1.05 0 58 LYS 0.95 -1.04 0 10 TYR 3.39 -0.08 1 11 THR 6.61 -1.22 1 12 ILE 4.56 -0.84 1 13 ASN 1.51 0.65 1 14 LEU 1.90 -0.63 1 15 ILE 7.77 -1.02 1 19 VAL 6.01 -1.15 1 20 LEU 4.02 -0.47 1 21 ILE 5.14 -0.88 1 22 THR 7.72 -1.37 1 23 SER 6.41 -0.83 1 24 LEU 3.40 -0.46 1 25 ALA 3.96 -0.85 1 26 ILE 5.21 -0.97 1 27 LEU 4.20 -0.56 1 28 VAL 4.66 -0.85 1 29 PHE 3.16 0.00 1 30 TYR 0.65 0.84 1 31 LEU -0.89 -0.06 1 34 ASP 0.10 0.14 1 37 GLU 2.10 -0.17 1 38 LYS 3.79 -1.42 1 39 MET 4.13 -0.68 1 43 ILE 4.84 -0.86 1 44 SER 5.90 -0.85 1 45 VAL 5.88 -1.14 1 46 LEU 3.85 -0.42 1 47 LEU 3.69 -0.35 1 48 ALA 4.18 -0.97 1 49 LEU 3.66 -0.45 1 51 VAL 6.44 -1.28 1 52 PHE 4.21 -0.27 1 53 LEU 3.17 -0.41 1 54 LEU 3.36 -0.37 1 55 LEU 3.19 -0.43 1 56 ILE 3.52 -1.11 1 57 SER 2.89 -0.24 1 59 ILE 2.01 -0.73 1 60 VAL 0.28 -0.33 1 63 THR -0.57 0.01 1 64 SER 0.37 -0.06 1 65 SER 0.41 -0.13 1 66 ASP -0.06 0.10 1 67 SER -0.21 0.30 1 69 SER -0.16 0.12 1 70 VAL 5.44 -1.00 1 72 GLU 3.83 -0.31 1 73 TYR 4.11 0.12 1 74 LEU 3.83 -0.46 1 75 MET 4.58 -0.81 1 76 PHE 4.32 -0.64 1 77 THR 8.22 -1.60 1 78 MET 4.13 -0.72 1 79 VAL 6.46 -1.29 1 80 LEU 3.96 -0.46 1 81 VAL 6.43 -1.29 1 82 THR 8.12 -1.33 1 83 PHE 4.82 -0.91 1 84 SER 5.81 -0.84 1 85 ILE 5.08 -0.68 1 86 VAL 6.15 -1.30 1 88 SER 5.27 -0.85 1 91 VAL 2.39 -0.98 1 92 LEU 0.96 -0.47 1 93 ASN -0.45 0.61 1 94 VAL 0.60 -0.27 1 95 HIS -0.17 0.75 1 96 HIS -0.19 0.77 1 97 ARG 0.10 0.13 1 98 SER -0.11 0.32 1 100 GLU -0.17 0.04 1 101 THR 0.16 0.02 1 102 HIS 0.44 0.25 1 103 THR 0.15 0.03 1 109 ILE 2.56 -0.73 1 110 ASP 3.52 -0.92 1 111 ARG 3.52 -0.80 1 112 LEU 3.79 -0.66 1 113 PHE 5.40 -0.71 1 114 LEU 4.03 -0.62 1 115 TRP 3.72 -0.48 1 116 ILE 5.54 -0.65 1 117 PHE 4.91 -0.66 1 118 VAL 6.68 -1.44 1 119 PHE 5.35 -0.45 1 120 VAL 6.48 -1.24 1 122 VAL 5.83 -0.77 1 123 PHE 5.35 -0.96 1 126 ILE 5.59 -0.97 1 128 MET 3.59 -0.79 1 129 PHE 2.62 -0.51 1 130 LEU 0.35 0.02 1 131 GLN 8.60 -1.98 1 133 LEU 1.71 -0.41 1 134 PHE 0.03 0.01 1 135 GLN -0.06 0.47 1 136 GLU -0.45 0.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18096_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -0.89 _LACS_plot.Line_1_terminator_val_y_1 0.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _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 131 GLN 8.60 -0.55 0 10 TYR 3.39 -0.36 1 11 THR 6.61 -0.47 1 12 ILE 4.56 -0.49 1 13 ASN 1.51 -0.35 1 14 LEU 1.90 0.01 1 15 ILE 7.77 -0.85 1 19 VAL 6.01 -0.60 1 20 LEU 4.02 -0.32 1 21 ILE 5.14 -0.50 1 22 THR 7.72 -0.67 1 23 SER 6.41 -0.45 1 24 LEU 3.40 -0.36 1 25 ALA 3.96 -0.38 1 26 ILE 5.21 -0.37 1 27 LEU 4.20 -0.33 1 28 VAL 4.66 -0.54 1 29 PHE 3.16 -0.41 1 30 TYR 0.65 -0.31 1 31 LEU -0.89 0.11 1 34 ASP 0.10 -0.06 1 37 GLU 2.10 -0.28 1 38 LYS 3.79 -0.20 1 39 MET 4.13 -0.35 1 43 ILE 4.84 -0.54 1 44 SER 5.90 -0.39 1 45 VAL 5.88 -0.60 1 46 LEU 3.85 -0.39 1 47 LEU 3.69 -0.34 1 48 ALA 4.18 -0.47 1 49 LEU 3.66 -0.34 1 51 VAL 6.44 -0.62 1 52 PHE 4.21 -0.52 1 53 LEU 3.17 -0.47 1 54 LEU 3.36 -0.33 1 55 LEU 3.19 -0.24 1 56 ILE 3.52 -0.31 1 57 SER 2.89 -0.29 1 58 LYS 0.95 -0.03 1 59 ILE 2.01 -0.14 1 60 VAL 0.28 -0.11 1 63 THR -0.57 0.10 1 64 SER 0.37 -0.06 1 65 SER 0.41 -0.02 1 66 ASP -0.06 -0.02 1 67 SER -0.21 -0.25 1 69 SER -0.16 -0.03 1 70 VAL 5.44 -0.32 1 72 GLU 3.83 -0.46 1 73 TYR 4.11 -0.49 1 74 LEU 3.83 -0.28 1 75 MET 4.58 -0.42 1 76 PHE 4.32 -0.51 1 77 THR 8.22 -0.68 1 78 MET 4.13 -0.39 1 79 VAL 6.46 -0.63 1 80 LEU 3.96 -0.40 1 81 VAL 6.43 -0.66 1 82 THR 8.12 -0.67 1 83 PHE 4.82 -0.54 1 84 SER 5.81 -0.38 1 85 ILE 5.08 -0.52 1 86 VAL 6.15 -0.61 1 88 SER 5.27 -0.45 1 91 VAL 2.39 -0.49 1 92 LEU 0.96 -0.10 1 93 ASN -0.45 -0.06 1 94 VAL 0.60 -0.10 1 95 HIS -0.17 -0.11 1 96 HIS -0.19 -0.10 1 97 ARG 0.10 -0.05 1 98 SER -0.11 -0.04 1 100 GLU -0.17 -0.05 1 101 THR 0.16 -0.07 1 102 HIS 0.44 0.02 1 103 THR 0.15 -0.01 1 109 ILE 2.56 -0.19 1 110 ASP 3.52 -0.39 1 111 ARG 3.52 -0.35 1 112 LEU 3.79 -0.34 1 113 PHE 5.40 -0.54 1 114 LEU 4.03 -0.34 1 115 TRP 3.72 -0.38 1 116 ILE 5.54 -0.48 1 117 PHE 4.91 -0.53 1 118 VAL 6.68 -0.61 1 119 PHE 5.35 -0.58 1 120 VAL 6.48 -0.65 1 122 VAL 5.83 -0.64 1 123 PHE 5.35 -0.59 1 126 ILE 5.59 -0.52 1 128 MET 3.59 -0.33 1 129 PHE 2.62 -0.49 1 130 LEU 0.35 0.00 1 133 LEU 1.71 -0.28 1 134 PHE 0.03 -0.09 1 135 GLN -0.06 -0.02 1 136 GLU -0.45 -0.04 1 137 GLU 0.08 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18096_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -0.57 _LACS_plot.Line_1_terminator_val_y_1 -0.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.80 _LACS_plot.Line_2_terminator_val_x_2 8.22 _LACS_plot.Line_2_terminator_val_y_2 1.95 _LACS_plot.Y_axis_chem_shift_offset 0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 TYR 4.11 4.02 0 10 TYR 3.39 1.84 1 11 THR 6.61 1.24 1 12 ILE 4.56 -0.54 1 13 ASN 1.51 -0.32 1 14 LEU 1.90 -0.17 1 19 VAL 6.01 1.77 1 20 LEU 4.02 0.39 1 21 ILE 5.14 0.55 1 22 THR 7.72 1.37 1 23 SER 6.41 0.68 1 24 LEU 3.40 -0.06 1 25 ALA 3.96 0.11 1 26 ILE 5.21 1.33 1 27 LEU 4.20 0.76 1 28 VAL 4.66 1.51 1 29 PHE 3.16 0.57 1 30 TYR 0.65 -0.51 1 34 ASP 0.10 -0.33 1 37 GLU 2.10 -0.06 1 38 LYS 3.79 0.94 1 39 MET 4.13 2.30 1 43 ILE 4.84 0.86 1 44 SER 5.90 1.71 1 45 VAL 5.88 0.95 1 46 LEU 3.85 2.43 1 47 LEU 3.69 0.39 1 48 ALA 4.18 1.03 1 49 LEU 3.66 0.47 1 51 VAL 6.44 0.76 1 52 PHE 4.21 0.92 1 53 LEU 3.17 1.58 1 54 LEU 3.36 1.62 1 55 LEU 3.19 1.37 1 56 ILE 3.52 0.36 1 57 SER 2.89 0.66 1 58 LYS 0.95 0.07 1 59 ILE 2.01 -1.17 1 63 THR -0.57 0.02 1 64 SER 0.37 -0.02 1 65 SER 0.41 -0.50 1 66 ASP -0.06 -0.57 1 69 SER -0.16 0.01 1 70 VAL 5.44 1.47 1 72 GLU 3.83 1.90 1 74 LEU 3.83 0.78 1 75 MET 4.58 1.55 1 76 PHE 4.32 1.51 1 77 THR 8.22 1.36 1 78 MET 4.13 3.12 1 79 VAL 6.46 0.57 1 80 LEU 3.96 2.48 1 81 VAL 6.43 1.37 1 82 THR 8.12 1.57 1 83 PHE 4.82 2.21 1 84 SER 5.81 1.30 1 85 ILE 5.08 1.38 1 86 VAL 6.15 1.52 1 88 SER 5.27 0.33 1 91 VAL 2.39 -0.26 1 92 LEU 0.96 -0.83 1 93 ASN -0.45 -0.24 1 94 VAL 0.60 -0.56 1 95 HIS -0.17 0.05 1 97 ARG 0.10 -0.52 1 100 GLU -0.17 -0.02 1 101 THR 0.16 -0.19 1 102 HIS 0.44 0.66 1 103 THR 0.15 0.39 1 109 ILE 2.56 -0.38 1 110 ASP 3.52 1.35 1 111 ARG 3.52 1.20 1 112 LEU 3.79 0.76 1 113 PHE 5.40 1.29 1 114 LEU 4.03 0.61 1 115 TRP 3.72 2.44 1 116 ILE 5.54 1.02 1 117 PHE 4.91 1.59 1 118 VAL 6.68 1.15 1 119 PHE 5.35 1.60 1 120 VAL 6.48 1.55 1 122 VAL 5.83 0.62 1 123 PHE 5.35 2.35 1 126 ILE 5.59 1.58 1 128 MET 3.59 1.51 1 129 PHE 2.62 0.06 1 130 LEU 0.35 -0.38 1 133 LEU 1.71 -0.68 1 134 PHE 0.03 -0.55 1 135 GLN -0.06 -0.64 1 136 GLU -0.45 -1.45 1 stop_ save_