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 bmr11329_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 -3.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.43 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 5.60 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 ILE 0.94 -3.75 0 10 ASN 0.78 0.52 1 13 LYS 4.11 3.36 1 14 LEU 2.94 2.30 1 15 THR 7.01 6.37 1 16 LYS 4.23 3.68 1 17 GLN 4.12 3.48 1 18 MET 4.69 5.66 1 19 ASN 3.38 3.29 1 20 ALA 3.98 2.90 1 21 ILE 4.55 4.32 1 22 ILE 2.28 -0.33 1 23 ASP 5.43 3.61 1 24 THR 6.73 5.29 1 25 VAL 5.01 4.00 1 26 ILE 4.86 4.05 1 27 ASN 0.86 0.70 1 28 TYR 4.17 3.37 1 29 LYS -6.40 -2.92 1 30 ASP -2.41 -2.21 1 31 SER 3.99 2.98 1 32 SER -0.20 0.50 1 34 ARG -0.47 0.58 1 35 GLN 0.09 -0.56 1 36 LEU 3.72 3.98 1 37 SER 2.93 2.25 1 38 GLU 4.17 4.74 1 39 VAL 2.91 1.34 1 40 PHE -2.56 -0.90 1 41 ILE 6.21 4.05 1 42 GLN -5.07 -2.27 1 43 LEU 0.55 0.75 1 45 SER -1.44 -0.58 1 46 ARG 4.28 3.12 1 47 LYS 2.04 1.68 1 48 GLU 0.05 1.06 1 49 LEU -3.32 -1.14 1 51 GLU 3.89 2.83 1 52 TYR 4.00 3.98 1 53 TYR 2.53 2.01 1 54 GLU 1.06 1.06 1 55 LEU -0.79 1.15 1 57 ARG 1.88 1.45 1 58 LYS -1.74 -1.08 1 60 VAL -1.44 0.48 1 61 ASP -3.44 -1.86 1 62 PHE 6.38 5.87 1 63 LYS 5.78 4.73 1 64 LYS 3.37 2.09 1 65 ILE 4.36 4.03 1 66 LYS 6.24 4.30 1 67 GLU 3.14 2.95 1 68 ARG 5.04 4.04 1 69 ILE 4.71 5.19 1 70 ARG 3.84 3.09 1 71 ASN -0.03 -0.80 1 72 HIS 2.95 1.84 1 73 LYS 2.03 0.64 1 74 TYR -3.50 -2.98 1 75 ARG -0.80 -2.26 1 76 SER -4.36 -1.93 1 77 LEU 4.20 2.61 1 79 ASP 3.12 3.11 1 80 LEU 2.89 2.21 1 81 GLU 3.03 2.93 1 82 LYS 4.83 4.00 1 83 ASP 2.97 2.13 1 84 VAL 6.42 4.54 1 85 MET 3.95 1.75 1 86 LEU 3.24 3.03 1 87 LEU 5.69 5.32 1 89 HIS 3.75 4.51 1 90 ASN 3.87 2.36 1 91 ALA 3.09 2.94 1 92 GLN 3.00 1.23 1 93 THR 3.75 3.01 1 94 PHE 1.56 3.07 1 95 ASN -3.04 -0.78 1 96 LEU -0.88 -0.38 1 97 GLU 2.15 1.11 1 99 SER -1.25 0.10 1 100 GLN 3.25 3.79 1 101 ILE 4.76 4.65 1 102 TYR 2.57 4.15 1 103 GLU 3.94 3.00 1 104 ASP 4.24 3.40 1 105 SER 4.96 4.17 1 106 ILE 4.19 2.68 1 107 VAL 5.83 4.40 1 108 LEU 4.44 3.21 1 109 GLN 4.92 4.61 1 110 SER 4.17 3.32 1 111 VAL 5.42 3.97 1 112 PHE 5.97 4.90 1 113 LYS 4.83 3.88 1 114 SER 3.93 2.97 1 115 ALA 2.30 1.66 1 116 ARG 3.51 1.98 1 117 GLN 1.33 0.93 1 118 SER 0.43 0.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11329_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 3.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.65 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.57 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 -1.41 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 ILE 0.94 -4.69 0 10 ASN 0.78 -0.26 1 13 LYS 4.11 -0.75 1 14 LEU 2.94 -0.64 1 15 THR 7.01 -0.64 1 16 LYS 4.23 -0.55 1 17 GLN 4.12 -0.64 1 18 MET 4.69 0.97 1 19 ASN 3.38 -0.09 1 20 ALA 3.98 -1.08 1 21 ILE 4.55 -0.23 1 22 ILE 2.28 -2.61 1 23 ASP 5.43 -1.82 1 24 THR 6.73 -1.44 1 25 VAL 5.01 -1.01 1 26 ILE 4.86 -0.81 1 27 ASN 0.86 -0.16 1 28 TYR 4.17 -0.80 1 29 LYS -6.40 3.48 1 30 ASP -2.41 0.20 1 31 SER 3.99 -1.01 1 32 SER -0.20 0.70 1 34 ARG -0.47 1.05 1 35 GLN 0.09 -0.65 1 36 LEU 3.72 0.26 1 37 SER 2.93 -0.68 1 38 GLU 4.17 0.57 1 39 VAL 2.91 -1.57 1 40 PHE -2.56 1.66 1 41 ILE 6.21 -2.16 1 42 GLN -5.07 2.80 1 43 LEU 0.55 0.20 1 45 SER -1.44 0.86 1 46 ARG 4.28 -1.16 1 47 LYS 2.04 -0.36 1 48 GLU 0.05 1.01 1 49 LEU -3.32 2.18 1 51 GLU 3.89 -1.06 1 52 TYR 4.00 -0.02 1 53 TYR 2.53 -0.52 1 54 GLU 1.06 0.00 1 55 LEU -0.79 1.94 1 57 ARG 1.88 -0.43 1 58 LYS -1.74 0.66 1 60 VAL -1.44 1.92 1 61 ASP -3.44 1.58 1 62 PHE 6.38 -0.51 1 63 LYS 5.78 -1.05 1 64 LYS 3.37 -1.28 1 65 ILE 4.36 -0.33 1 66 LYS 6.24 -1.94 1 67 GLU 3.14 -0.19 1 68 ARG 5.04 -1.00 1 69 ILE 4.71 0.48 1 70 ARG 3.84 -0.75 1 71 ASN -0.03 -0.77 1 72 HIS 2.95 -1.11 1 73 LYS 2.03 -1.39 1 74 TYR -3.50 0.52 1 75 ARG -0.80 -1.46 1 76 SER -4.36 2.43 1 77 LEU 4.20 -1.59 1 79 ASP 3.12 -0.01 1 80 LEU 2.89 -0.68 1 81 GLU 3.03 -0.10 1 82 LYS 4.83 -0.83 1 83 ASP 2.97 -0.84 1 84 VAL 6.42 -1.88 1 85 MET 3.95 -2.20 1 86 LEU 3.24 -0.21 1 87 LEU 5.69 -0.37 1 89 HIS 3.75 0.76 1 90 ASN 3.87 -1.51 1 91 ALA 3.09 -0.15 1 92 GLN 3.00 -1.77 1 93 THR 3.75 -0.74 1 94 PHE 1.56 1.51 1 95 ASN -3.04 2.26 1 96 LEU -0.88 0.50 1 97 GLU 2.15 -1.04 1 99 SER -1.25 1.35 1 100 GLN 3.25 0.54 1 101 ILE 4.76 -0.11 1 102 TYR 2.57 1.58 1 103 GLU 3.94 -0.94 1 104 ASP 4.24 -0.84 1 105 SER 4.96 -0.79 1 106 ILE 4.19 -1.51 1 107 VAL 5.83 -1.43 1 108 LEU 4.44 -1.23 1 109 GLN 4.92 -0.31 1 110 SER 4.17 -0.85 1 111 VAL 5.42 -1.45 1 112 PHE 5.97 -1.07 1 113 LYS 4.83 -0.95 1 114 SER 3.93 -0.96 1 115 ALA 2.30 -0.64 1 116 ARG 3.51 -1.53 1 117 GLN 1.33 -0.40 1 118 SER 0.43 0.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11329_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 0.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 GLU 2.15 -2.44 0 10 ASN 0.78 -0.08 1 13 LYS 4.11 -0.26 1 14 LEU 2.94 0.15 1 15 THR 7.01 -0.64 1 16 LYS 4.23 -0.16 1 17 GLN 4.12 -0.16 1 18 MET 4.69 -0.74 1 19 ASN 3.38 -0.27 1 20 ALA 3.98 -0.14 1 21 ILE 4.55 -0.61 1 22 ILE 2.28 -0.12 1 23 ASP 5.43 -0.31 1 24 THR 6.73 -0.47 1 25 VAL 5.01 -0.64 1 26 ILE 4.86 -1.10 1 27 ASN 0.86 -0.24 1 28 TYR 4.17 -0.45 1 29 LYS -6.40 0.78 1 30 ASP -2.41 -0.17 1 31 SER 3.99 -0.30 1 32 SER -0.20 0.14 1 34 ARG -0.47 -0.14 1 35 GLN 0.09 0.54 1 36 LEU 3.72 -0.31 1 37 SER 2.93 -0.20 1 38 GLU 4.17 -0.35 1 39 VAL 2.91 0.05 1 40 PHE -2.56 0.14 1 41 ILE 6.21 -0.15 1 42 GLN -5.07 0.65 1 43 LEU 0.55 -0.41 1 45 SER -1.44 -0.10 1 46 ARG 4.28 -0.65 1 47 LYS 2.04 -0.27 1 48 GLU 0.05 -0.14 1 49 LEU -3.32 0.29 1 51 GLU 3.89 -0.18 1 52 TYR 4.00 -1.01 1 53 TYR 2.53 -0.48 1 54 GLU 1.06 -0.14 1 55 LEU -0.79 -0.05 1 56 ILE 0.94 -0.25 1 57 ARG 1.88 -0.19 1 58 LYS -1.74 0.15 1 60 VAL -1.44 0.08 1 61 ASP -3.44 0.03 1 62 PHE 6.38 -0.19 1 63 LYS 5.78 -0.26 1 64 LYS 3.37 -0.13 1 65 ILE 4.36 0.23 1 66 LYS 6.24 -0.26 1 67 GLU 3.14 -0.39 1 68 ARG 5.04 -0.60 1 69 ILE 4.71 -0.34 1 70 ARG 3.84 -0.48 1 71 ASN -0.03 -0.13 1 72 HIS 2.95 -0.53 1 73 LYS 2.03 -0.22 1 74 TYR -3.50 0.36 1 75 ARG -0.80 0.46 1 76 SER -4.36 0.16 1 77 LEU 4.20 -0.26 1 79 ASP 3.12 -0.29 1 80 LEU 2.89 -1.46 1 81 GLU 3.03 -1.18 1 82 LYS 4.83 -0.48 1 83 ASP 2.97 0.29 1 84 VAL 6.42 -0.92 1 85 MET 3.95 -0.42 1 86 LEU 3.24 -0.19 1 87 LEU 5.69 -0.74 1 89 HIS 3.75 -0.68 1 90 ASN 3.87 -0.46 1 91 ALA 3.09 0.14 1 92 GLN 3.00 -0.20 1 93 THR 3.75 -0.15 1 94 PHE 1.56 -0.43 1 95 ASN -3.04 -0.02 1 96 LEU -0.88 -0.18 1 99 SER -1.25 0.02 1 100 GLN 3.25 -0.27 1 101 ILE 4.76 -0.19 1 102 TYR 2.57 -0.81 1 103 GLU 3.94 -0.19 1 104 ASP 4.24 -0.08 1 105 SER 4.96 -0.68 1 106 ILE 4.19 -0.38 1 107 VAL 5.83 -0.42 1 108 LEU 4.44 -0.55 1 109 GLN 4.92 -0.59 1 110 SER 4.17 -0.20 1 111 VAL 5.42 -0.62 1 112 PHE 5.97 -1.00 1 113 LYS 4.83 -0.59 1 114 SER 3.93 -0.27 1 115 ALA 2.30 -0.17 1 116 ARG 3.51 -0.54 1 117 GLN 1.33 -0.09 1 118 SER 0.43 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11329_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 -2.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.45 _LACS_plot.Line_2_terminator_val_x_2 7.01 _LACS_plot.Line_2_terminator_val_y_2 2.57 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 VAL -1.44 -5.45 0 10 ASN 0.78 -0.16 1 13 LYS 4.11 2.23 1 14 LEU 2.94 0.89 1 15 THR 7.01 1.17 1 16 LYS 4.23 2.71 1 17 GLN 4.12 2.56 1 18 MET 4.69 1.24 1 19 ASN 3.38 1.27 1 20 ALA 3.98 3.41 1 21 ILE 4.55 1.30 1 22 ILE 2.28 1.07 1 23 ASP 5.43 2.21 1 24 THR 6.73 1.51 1 25 VAL 5.01 0.92 1 26 ILE 4.86 1.35 1 27 ASN 0.86 -0.23 1 28 TYR 4.17 -1.02 1 29 LYS -6.40 -1.23 1 30 ASP -2.41 2.16 1 31 SER 3.99 0.87 1 32 SER -0.20 0.09 1 34 ARG -0.47 -1.16 1 35 GLN 0.09 0.13 1 36 LEU 3.72 0.93 1 37 SER 2.93 1.99 1 38 GLU 4.17 2.37 1 39 VAL 2.91 -0.52 1 40 PHE -2.56 0.34 1 41 ILE 6.21 -1.88 1 42 GLN -5.07 -0.28 1 43 LEU 0.55 3.53 1 45 SER -1.44 0.43 1 46 ARG 4.28 1.21 1 47 LYS 2.04 1.48 1 48 GLU 0.05 0.07 1 49 LEU -3.32 -2.73 1 51 GLU 3.89 2.63 1 52 TYR 4.00 -0.14 1 53 TYR 2.53 0.78 1 54 GLU 1.06 0.56 1 55 LEU -0.79 -1.21 1 56 ILE 0.94 -1.83 1 57 ARG 1.88 0.87 1 58 LYS -1.74 -3.13 1 61 ASP -3.44 -0.53 1 62 PHE 6.38 1.95 1 63 LYS 5.78 3.12 1 64 LYS 3.37 2.19 1 65 ILE 4.36 2.30 1 66 LYS 6.24 3.43 1 67 GLU 3.14 1.36 1 68 ARG 5.04 2.79 1 69 ILE 4.71 2.71 1 70 ARG 3.84 0.56 1 71 ASN -0.03 -0.76 1 72 HIS 2.95 0.87 1 73 LYS 2.03 1.62 1 74 TYR -3.50 -0.10 1 75 ARG -0.80 -0.99 1 76 SER -4.36 -0.03 1 79 ASP 3.12 1.59 1 80 LEU 2.89 -0.16 1 81 GLU 3.03 0.78 1 82 LYS 4.83 3.08 1 83 ASP 2.97 2.02 1 84 VAL 6.42 1.43 1 85 MET 3.95 2.49 1 86 LEU 3.24 -0.54 1 87 LEU 5.69 3.34 1 89 HIS 3.75 5.15 1 90 ASN 3.87 2.81 1 91 ALA 3.09 3.03 1 92 GLN 3.00 -0.76 1 93 THR 3.75 0.46 1 94 PHE 1.56 -1.37 1 95 ASN -3.04 -1.94 1 96 LEU -0.88 0.54 1 97 GLU 2.15 0.30 1 100 GLN 3.25 1.81 1 101 ILE 4.76 1.56 1 102 TYR 2.57 3.47 1 103 GLU 3.94 3.34 1 104 ASP 4.24 2.54 1 105 SER 4.96 0.51 1 106 ILE 4.19 3.27 1 107 VAL 5.83 3.16 1 108 LEU 4.44 0.94 1 109 GLN 4.92 2.18 1 110 SER 4.17 2.57 1 111 VAL 5.42 2.26 1 112 PHE 5.97 0.08 1 113 LYS 4.83 2.63 1 114 SER 3.93 1.98 1 115 ALA 2.30 1.60 1 116 ARG 3.51 0.78 1 117 GLN 1.33 0.25 1 118 SER 0.43 0.04 1 stop_ save_