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 bmr19404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.79 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 9.13 _LACS_plot.Line_2_terminator_val_y_2 6.42 _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 102 VAL -3.66 -4.31 0 10 VAL -1.82 -0.95 1 11 LYS -3.28 -1.11 1 12 ILE -3.70 -1.37 1 13 THR -1.11 -0.65 1 15 ASN 2.87 0.61 1 17 LYS -3.26 -1.46 1 18 THR -0.71 -0.16 1 19 TYR -2.52 -1.42 1 20 GLU -5.79 -1.93 1 21 ARG -3.28 0.16 1 22 THR -0.31 -0.15 1 23 TYR -3.93 -1.19 1 24 GLN -0.20 -0.90 1 25 LEU -3.89 -1.82 1 26 TYR -2.65 -1.13 1 27 ALA -3.58 -1.12 1 28 VAL 0.82 0.47 1 29 ARG -2.73 -1.28 1 30 ASP 4.98 3.63 1 31 GLU 4.16 2.87 1 32 GLU 1.33 1.31 1 33 LEU 4.35 2.78 1 34 LYS 5.89 3.78 1 35 GLU 3.36 2.49 1 36 LYS 3.88 3.47 1 37 LEU 2.48 2.31 1 38 LYS 5.52 4.24 1 39 LYS 4.47 3.41 1 40 VAL 5.30 3.18 1 41 LEU 4.18 2.68 1 42 ASN 3.78 3.20 1 43 GLU 2.96 2.24 1 44 ARG 0.77 -0.01 1 45 MET 1.27 0.36 1 46 ASP 9.14 7.06 1 48 ILE 3.31 0.78 1 49 LYS 3.88 3.03 1 50 LYS 2.30 1.46 1 51 LEU 0.38 0.39 1 54 LYS 0.92 0.99 1 55 ARG -1.79 -0.79 1 56 VAL -5.40 -2.74 1 57 ARG -3.33 -1.07 1 58 ILE -3.12 -1.08 1 59 SER -3.65 -2.03 1 60 ILE -3.64 -1.60 1 61 ARG -3.66 -1.37 1 62 VAL -1.63 -1.17 1 63 LYS -2.55 -1.17 1 66 ASP -1.34 -0.96 1 67 ALA 1.13 0.91 1 68 ALA 2.05 1.40 1 69 GLU 1.16 0.60 1 70 GLU 2.28 1.99 1 71 LYS 3.64 2.46 1 72 LYS 2.97 2.24 1 73 GLU 0.80 0.52 1 74 ALA 3.52 2.80 1 75 LYS 3.80 2.36 1 76 LYS 4.15 2.59 1 77 PHE 4.62 3.39 1 78 ALA 4.57 2.85 1 79 ALA 3.92 2.59 1 80 ILE 4.61 3.56 1 81 LEU 4.42 2.73 1 82 ASN 4.44 3.35 1 83 LYS 3.91 2.83 1 84 VAL 7.30 4.90 1 85 PHE 5.22 2.51 1 86 ALA 3.75 2.53 1 87 GLU 3.40 2.41 1 88 LEU 0.34 0.11 1 90 TYR 0.56 -0.62 1 91 ASN -0.94 -0.18 1 92 ASP 3.19 2.38 1 93 SER 2.05 1.63 1 94 ASN -0.89 0.46 1 95 VAL -0.56 -0.19 1 96 THR -2.60 -1.08 1 97 TRP -1.37 -0.11 1 98 ASP -1.60 -1.07 1 100 ASP 0.14 0.00 1 101 THR -1.59 -0.06 1 103 THR -2.44 -1.19 1 104 VAL -4.01 -2.64 1 105 GLU -4.40 -2.08 1 107 GLN -1.58 -0.75 1 108 LEU -0.56 -0.35 1 109 GLU -0.73 -0.28 1 111 VAL -0.06 -0.26 1 112 ASP -0.23 -0.52 1 113 LEU 0.47 0.12 1 114 GLU 0.16 0.13 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.79 _LACS_plot.Line_1_terminator_val_y_1 3.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.61 _LACS_plot.Line_2_terminator_val_x_2 9.13 _LACS_plot.Line_2_terminator_val_y_2 -2.71 _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 102 VAL -3.66 -0.65 0 10 VAL -1.82 0.87 1 11 LYS -3.28 2.17 1 12 ILE -3.70 2.33 1 13 THR -1.11 0.46 1 15 ASN 2.87 -2.26 1 17 LYS -3.26 1.80 1 18 THR -0.71 0.55 1 19 TYR -2.52 1.10 1 20 GLU -5.79 3.86 1 21 ARG -3.28 3.44 1 22 THR -0.31 0.16 1 23 TYR -3.93 2.74 1 24 GLN -0.20 -0.70 1 25 LEU -3.89 2.07 1 26 TYR -2.65 1.52 1 27 ALA -3.58 2.46 1 28 VAL 0.82 -0.35 1 29 ARG -2.73 1.45 1 30 ASP 4.98 -1.35 1 31 GLU 4.16 -1.29 1 32 GLU 1.33 -0.02 1 33 LEU 4.35 -1.57 1 34 LYS 5.89 -2.11 1 35 GLU 3.36 -0.87 1 36 LYS 3.88 -0.41 1 37 LEU 2.48 -0.17 1 38 LYS 5.52 -1.28 1 39 LYS 4.47 -1.06 1 40 VAL 5.30 -2.12 1 41 LEU 4.18 -1.50 1 42 ASN 3.78 -0.58 1 43 GLU 2.96 -0.72 1 44 ARG 0.77 -0.78 1 45 MET 1.27 -0.91 1 46 ASP 9.14 -2.08 1 48 ILE 3.31 -2.53 1 49 LYS 3.88 -0.85 1 50 LYS 2.30 -0.84 1 51 LEU 0.38 0.01 1 54 LYS 0.92 0.07 1 55 ARG -1.79 1.00 1 56 VAL -5.40 2.66 1 57 ARG -3.33 2.26 1 58 ILE -3.12 2.04 1 59 SER -3.65 1.62 1 60 ILE -3.64 2.04 1 61 ARG -3.66 2.29 1 62 VAL -1.63 0.46 1 63 LYS -2.55 1.38 1 66 ASP -1.34 0.38 1 67 ALA 1.13 -0.22 1 68 ALA 2.05 -0.65 1 69 GLU 1.16 -0.56 1 70 GLU 2.28 -0.29 1 71 LYS 3.64 -1.18 1 72 LYS 2.97 -0.73 1 73 GLU 0.80 -0.28 1 74 ALA 3.52 -0.72 1 75 LYS 3.80 -1.44 1 76 LYS 4.15 -1.56 1 77 PHE 4.62 -1.23 1 78 ALA 4.57 -1.72 1 79 ALA 3.92 -1.33 1 80 ILE 4.61 -1.05 1 81 LEU 4.42 -1.69 1 82 ASN 4.44 -1.09 1 83 LYS 3.91 -1.08 1 84 VAL 7.30 -2.40 1 85 PHE 5.22 -2.71 1 86 ALA 3.75 -1.22 1 87 GLU 3.40 -0.99 1 88 LEU 0.34 -0.23 1 90 TYR 0.56 -1.18 1 91 ASN -0.94 0.76 1 92 ASP 3.19 -0.81 1 93 SER 2.05 -0.42 1 94 ASN -0.89 1.35 1 95 VAL -0.56 0.37 1 96 THR -2.60 1.52 1 97 TRP -1.37 1.26 1 98 ASP -1.60 0.53 1 100 ASP 0.14 -0.14 1 101 THR -1.59 1.53 1 103 THR -2.44 1.25 1 104 VAL -4.01 1.37 1 105 GLU -4.40 2.32 1 107 GLN -1.58 0.83 1 108 LEU -0.56 0.21 1 109 GLU -0.73 0.45 1 111 VAL -0.06 -0.20 1 112 ASP -0.23 -0.29 1 113 LEU 0.47 -0.35 1 114 GLU 0.16 -0.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.79 _LACS_plot.Line_1_terminator_val_y_1 0.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.33 _LACS_plot.Line_2_terminator_val_x_2 9.13 _LACS_plot.Line_2_terminator_val_y_2 -1.01 _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 13 THR -1.11 1.19 0 46 ASP 9.14 -0.41 0 10 VAL -1.82 0.58 1 11 LYS -3.28 0.86 1 12 ILE -3.70 0.93 1 15 ASN 2.87 -0.24 1 17 LYS -3.26 0.21 1 18 THR -0.71 0.69 1 19 TYR -2.52 0.10 1 20 GLU -5.79 1.25 1 21 ARG -3.28 -0.02 1 22 THR -0.31 0.91 1 23 TYR -3.93 0.11 1 24 GLN -0.20 0.59 1 25 LEU -3.89 0.46 1 26 TYR -2.65 0.49 1 27 ALA -3.58 0.18 1 28 VAL 0.82 0.03 1 29 ARG -2.73 0.30 1 30 ASP 4.98 -0.48 1 31 GLU 4.16 -0.39 1 32 GLU 1.33 -0.16 1 33 LEU 4.35 -0.51 1 34 LYS 5.89 -0.90 1 35 GLU 3.36 -0.37 1 36 LYS 3.88 -0.32 1 37 LEU 2.48 -0.54 1 38 LYS 5.52 -0.68 1 39 LYS 4.47 -0.31 1 40 VAL 5.30 -0.57 1 41 LEU 4.18 -0.50 1 42 ASN 3.78 -0.30 1 43 GLU 2.96 -0.23 1 44 ARG 0.77 -0.14 1 45 MET 1.27 -0.10 1 48 ILE 3.31 -0.46 1 49 LYS 3.88 -0.36 1 50 LYS 2.30 -0.15 1 51 LEU 0.38 -0.09 1 54 LYS 0.92 0.02 1 55 ARG -1.79 0.43 1 56 VAL -5.40 0.75 1 57 ARG -3.33 0.76 1 58 ILE -3.12 0.59 1 59 SER -3.65 1.26 1 60 ILE -3.64 1.04 1 61 ARG -3.66 0.79 1 62 VAL -1.63 0.51 1 63 LYS -2.55 0.31 1 66 ASP -1.34 0.02 1 67 ALA 1.13 -0.09 1 68 ALA 2.05 -0.15 1 69 GLU 1.16 -0.16 1 70 GLU 2.28 -0.60 1 71 LYS 3.64 -0.28 1 72 LYS 2.97 -0.23 1 73 GLU 0.80 -0.09 1 74 ALA 3.52 -0.23 1 75 LYS 3.80 -0.40 1 76 LYS 4.15 -0.30 1 77 PHE 4.62 -0.52 1 78 ALA 4.57 -0.19 1 79 ALA 3.92 -0.20 1 80 ILE 4.61 -0.55 1 81 LEU 4.42 -0.78 1 82 ASN 4.44 -0.13 1 83 LYS 3.91 -0.15 1 84 VAL 7.30 -0.88 1 85 PHE 5.22 -0.23 1 86 ALA 3.75 0.07 1 87 GLU 3.40 -0.32 1 88 LEU 0.34 -0.03 1 90 TYR 0.56 -0.01 1 91 ASN -0.94 0.03 1 92 ASP 3.19 -0.26 1 93 SER 2.05 -0.09 1 94 ASN -0.89 0.16 1 95 VAL -0.56 0.19 1 96 THR -2.60 0.32 1 97 TRP -1.37 0.11 1 98 ASP -1.60 0.16 1 100 ASP 0.14 0.15 1 101 THR -1.59 0.86 1 102 VAL -3.66 0.34 1 103 THR -2.44 0.95 1 104 VAL -4.01 0.57 1 105 GLU -4.40 0.81 1 107 GLN -1.58 0.44 1 108 LEU -0.56 0.04 1 109 GLU -0.73 -0.04 1 111 VAL -0.06 -0.03 1 112 ASP -0.23 -0.04 1 113 LEU 0.47 -0.13 1 114 GLU 0.16 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.79 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.54 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 7.29 _LACS_plot.Line_2_terminator_val_y_2 2.97 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 ALA 3.75 4.45 0 10 VAL -1.82 -1.95 1 11 LYS -3.28 -1.87 1 12 ILE -3.70 -1.58 1 13 THR -1.11 -0.85 1 17 LYS -3.26 -2.49 1 18 THR -0.71 -1.82 1 20 GLU -5.79 -1.97 1 21 ARG -3.28 -2.97 1 22 THR -0.31 -1.56 1 23 TYR -3.93 -1.60 1 24 GLN -0.20 -1.39 1 26 TYR -2.65 -1.53 1 27 ALA -3.58 -1.99 1 28 VAL 0.82 -0.61 1 30 ASP 4.98 1.83 1 31 GLU 4.16 1.39 1 32 GLU 1.33 1.25 1 33 LEU 4.35 -0.23 1 34 LYS 5.89 0.82 1 35 GLU 3.36 2.90 1 36 LYS 3.88 2.26 1 37 LEU 2.48 0.20 1 38 LYS 5.52 0.80 1 39 LYS 4.47 2.62 1 40 VAL 5.30 1.19 1 41 LEU 4.18 0.96 1 42 ASN 3.78 2.62 1 43 GLU 2.96 2.22 1 44 ARG 0.77 1.24 1 45 MET 1.27 1.19 1 48 ILE 3.31 1.76 1 49 LYS 3.88 2.36 1 50 LYS 2.30 0.84 1 51 LEU 0.38 0.27 1 54 LYS 0.92 0.84 1 55 ARG -1.79 -1.79 1 56 VAL -5.40 -3.33 1 57 ARG -3.33 -1.81 1 58 ILE -3.12 -2.39 1 59 SER -3.65 -1.18 1 60 ILE -3.64 -3.38 1 61 ARG -3.66 -1.27 1 62 VAL -1.63 -2.19 1 63 LYS -2.55 -1.47 1 66 ASP -1.34 -0.87 1 67 ALA 1.13 0.64 1 68 ALA 2.05 1.35 1 69 GLU 1.16 0.33 1 70 GLU 2.28 0.89 1 71 LYS 3.64 1.51 1 72 LYS 2.97 1.77 1 73 GLU 0.80 0.89 1 74 ALA 3.52 0.00 1 75 LYS 3.80 2.00 1 76 LYS 4.15 1.67 1 77 PHE 4.62 1.15 1 78 ALA 4.57 0.59 1 79 ALA 3.92 3.29 1 80 ILE 4.61 1.14 1 81 LEU 4.42 -0.30 1 82 ASN 4.44 3.29 1 83 LYS 3.91 1.44 1 84 VAL 7.30 1.12 1 85 PHE 5.22 2.24 1 87 GLU 3.40 1.96 1 88 LEU 0.34 -1.20 1 90 TYR 0.56 -0.84 1 91 ASN -0.94 0.40 1 92 ASP 3.19 1.07 1 93 SER 2.05 -0.11 1 94 ASN -0.89 -1.94 1 95 VAL -0.56 -0.89 1 96 THR -2.60 -1.89 1 97 TRP -1.37 -0.50 1 100 ASP 0.14 -1.53 1 101 THR -1.59 -2.58 1 102 VAL -3.66 -4.18 1 103 THR -2.44 -1.99 1 104 VAL -4.01 -2.59 1 105 GLU -4.40 -1.26 1 107 GLN -1.58 -0.83 1 108 LEU -0.56 -1.38 1 109 GLU -0.73 -0.17 1 111 VAL -0.06 -1.08 1 112 ASP -0.23 -0.44 1 113 LEU 0.47 -0.34 1 stop_ save_