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 bmr6225_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 -2.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.38 _LACS_plot.Line_2_terminator_val_x_2 6.12 _LACS_plot.Line_2_terminator_val_y_2 4.88 _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 38 HIS -4.21 1.31 0 45 ILE -0.58 -2.98 0 10 GLU 3.41 0.26 1 11 LYS 5.37 2.48 1 12 VAL -1.65 -0.24 1 13 SER 1.61 1.68 1 15 ILE -4.50 -1.62 1 16 ILE -3.79 -1.02 1 17 ALA -4.03 -0.99 1 18 ILE -0.46 -0.16 1 19 ASN -2.19 -1.33 1 20 GLU -1.56 -0.52 1 21 ASP 2.02 1.50 1 22 VAL -4.10 -2.97 1 23 SER -4.12 -2.52 1 25 ALA -1.27 0.24 1 26 GLU -7.12 -2.42 1 27 LEU -4.56 -1.24 1 28 THR -2.38 -0.49 1 29 TRP -4.13 -1.62 1 30 ARG -5.41 -2.49 1 31 SER -0.84 -0.32 1 32 THR 5.61 4.52 1 33 ASP 0.27 0.28 1 35 ASP 0.66 0.72 1 36 LYS -3.23 -0.44 1 37 VAL -4.87 -1.83 1 39 THR -1.39 -0.15 1 40 VAL -3.16 -1.68 1 41 VAL 3.63 1.69 1 42 LEU 5.29 3.67 1 43 SER 3.73 1.44 1 44 THR 0.16 0.52 1 46 ASP -2.95 0.76 1 47 LYS -4.83 -1.42 1 48 LEU -4.57 -1.81 1 49 GLN -3.70 -1.16 1 50 ALA -6.04 -2.34 1 51 THR 1.41 -0.13 1 53 ALA 3.40 2.40 1 54 SER 0.64 -0.04 1 55 SER -1.09 -0.64 1 56 GLU 1.88 1.56 1 57 LYS -0.68 -0.36 1 58 MET -2.13 -0.01 1 59 MET -4.99 -0.35 1 60 LEU -6.23 -1.65 1 61 ARG -4.20 -1.54 1 62 LEU -0.57 -0.24 1 63 ILE -0.60 -0.84 1 65 LYS -0.80 0.57 1 66 VAL -0.51 -0.13 1 67 ASP -0.89 -1.06 1 68 GLU 1.17 1.01 1 69 SER 2.40 2.07 1 70 LYS -0.20 -0.71 1 71 LYS 0.47 0.42 1 72 ARG -2.75 -1.15 1 73 LYS -2.28 -0.75 1 74 ASP -1.18 -1.19 1 75 ASN 2.51 1.86 1 76 GLU -0.58 -0.18 1 78 ASN -0.34 -0.10 1 79 GLU 1.14 2.61 1 85 GLN 0.03 0.53 1 86 ARG -3.62 -1.11 1 87 HIS -4.90 -0.53 1 88 MET -2.43 -0.34 1 89 PHE -5.42 -1.15 1 90 SER -2.30 -1.09 1 91 PHE -4.41 -0.29 1 92 ASN -1.76 -0.64 1 93 ASN -2.90 0.05 1 94 ARG 4.14 3.38 1 95 THR 6.04 4.78 1 96 VAL 4.48 3.87 1 97 MET 4.79 4.37 1 98 ASP 4.69 3.45 1 99 ASN 3.54 3.07 1 100 ILE 4.71 1.73 1 101 LYS 4.72 4.33 1 102 MET 4.11 3.39 1 103 THR 6.12 4.54 1 104 LEU 2.49 3.02 1 105 GLN 4.38 3.55 1 106 GLN 4.02 3.13 1 107 ILE 4.24 4.57 1 108 ILE 5.08 4.60 1 109 SER 4.30 3.44 1 110 ARG 3.60 2.59 1 111 TYR 1.00 -0.19 1 112 LYS 1.39 1.25 1 113 ASP 0.79 0.79 1 114 ALA 0.48 0.60 1 115 ASP 0.25 0.52 1 117 ASN 0.08 0.49 1 118 SER -0.06 0.20 1 119 SER 0.76 1.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6225_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 4.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.62 _LACS_plot.Line_2_terminator_val_x_2 6.12 _LACS_plot.Line_2_terminator_val_y_2 -1.24 _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 38 HIS -4.21 5.52 0 45 ILE -0.58 -2.40 0 10 GLU 3.41 -3.15 1 11 LYS 5.37 -2.89 1 12 VAL -1.65 1.41 1 13 SER 1.61 0.07 1 15 ILE -4.50 2.88 1 16 ILE -3.79 2.77 1 17 ALA -4.03 3.04 1 18 ILE -0.46 0.30 1 19 ASN -2.19 0.86 1 20 GLU -1.56 1.04 1 21 ASP 2.02 -0.52 1 22 VAL -4.10 1.13 1 23 SER -4.12 1.60 1 25 ALA -1.27 1.51 1 26 GLU -7.12 4.70 1 27 LEU -4.56 3.32 1 28 THR -2.38 1.89 1 29 TRP -4.13 2.51 1 30 ARG -5.41 2.92 1 31 SER -0.84 0.52 1 32 THR 5.61 -1.09 1 33 ASP 0.27 0.01 1 35 ASP 0.66 0.06 1 36 LYS -3.23 2.79 1 37 VAL -4.87 3.04 1 39 THR -1.39 1.24 1 40 VAL -3.16 1.48 1 41 VAL 3.63 -1.94 1 42 LEU 5.29 -1.62 1 43 SER 3.73 -2.29 1 44 THR 0.16 0.36 1 46 ASP -2.95 3.71 1 47 LYS -4.83 3.41 1 48 LEU -4.57 2.76 1 49 GLN -3.70 2.54 1 50 ALA -6.04 3.70 1 51 THR 1.41 -1.54 1 53 ALA 3.40 -1.00 1 54 SER 0.64 -0.68 1 55 SER -1.09 0.45 1 56 GLU 1.88 -0.32 1 57 LYS -0.68 0.32 1 58 MET -2.13 2.12 1 59 MET -4.99 4.64 1 60 LEU -6.23 4.58 1 61 ARG -4.20 2.66 1 62 LEU -0.57 0.33 1 63 ILE -0.60 -0.24 1 65 LYS -0.80 1.37 1 66 VAL -0.51 0.38 1 67 ASP -0.89 -0.17 1 68 GLU 1.17 -0.16 1 69 SER 2.40 -0.33 1 70 LYS -0.20 -0.51 1 71 LYS 0.47 -0.05 1 72 ARG -2.75 1.60 1 73 LYS -2.28 1.53 1 74 ASP -1.18 -0.01 1 75 ASN 2.51 -0.65 1 76 GLU -0.58 0.40 1 78 ASN -0.34 0.24 1 79 GLU 1.14 1.47 1 85 GLN 0.03 0.50 1 86 ARG -3.62 2.51 1 87 HIS -4.90 4.37 1 88 MET -2.43 2.09 1 89 PHE -5.42 4.27 1 90 SER -2.30 1.21 1 91 PHE -4.41 4.12 1 92 ASN -1.76 1.12 1 93 ASN -2.90 2.95 1 94 ARG 4.14 -0.76 1 95 THR 6.04 -1.26 1 96 VAL 4.48 -0.61 1 97 MET 4.79 -0.42 1 98 ASP 4.69 -1.24 1 99 ASN 3.54 -0.47 1 100 ILE 4.71 -2.98 1 101 LYS 4.72 -0.39 1 102 MET 4.11 -0.72 1 103 THR 6.12 -1.58 1 104 LEU 2.49 0.53 1 105 GLN 4.38 -0.83 1 106 GLN 4.02 -0.89 1 107 ILE 4.24 0.33 1 108 ILE 5.08 -0.48 1 109 SER 4.30 -0.86 1 110 ARG 3.60 -1.01 1 111 TYR 1.00 -1.19 1 112 LYS 1.39 -0.14 1 113 ASP 0.79 0.00 1 114 ALA 0.48 0.12 1 115 ASP 0.25 0.27 1 117 ASN 0.08 0.41 1 118 SER -0.06 0.26 1 119 SER 0.76 1.04 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6225_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 6.12 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 MET 4.79 -2.16 0 10 GLU 3.41 -1.21 1 11 LYS 5.37 -0.96 1 12 VAL -1.65 0.25 1 13 SER 1.61 0.11 1 15 ILE -4.50 0.59 1 16 ILE -3.79 0.71 1 17 ALA -4.03 0.74 1 18 ILE -0.46 0.35 1 19 ASN -2.19 0.31 1 20 GLU -1.56 0.31 1 21 ASP 2.02 -0.07 1 22 VAL -4.10 0.16 1 23 SER -4.12 -0.08 1 25 ALA -1.27 0.16 1 26 GLU -7.12 0.64 1 27 LEU -4.56 0.66 1 28 THR -2.38 0.84 1 29 TRP -4.13 0.72 1 30 ARG -5.41 0.43 1 31 SER -0.84 -0.43 1 32 THR 5.61 -0.53 1 33 ASP 0.27 -0.05 1 35 ASP 0.66 -0.19 1 36 LYS -3.23 0.46 1 37 VAL -4.87 1.13 1 38 HIS -4.21 0.27 1 39 THR -1.39 0.76 1 40 VAL -3.16 -0.27 1 41 VAL 3.63 -0.21 1 42 LEU 5.29 -0.45 1 43 SER 3.73 -0.58 1 44 THR 0.16 0.13 1 45 ILE -0.58 0.11 1 46 ASP -2.95 -0.02 1 47 LYS -4.83 0.38 1 48 LEU -4.57 0.91 1 49 GLN -3.70 0.41 1 50 ALA -6.04 1.14 1 51 THR 1.41 -0.11 1 53 ALA 3.40 -0.29 1 54 SER 0.64 -0.24 1 55 SER -1.09 0.05 1 56 GLU 1.88 -0.22 1 57 LYS -0.68 -0.03 1 58 MET -2.13 -0.17 1 59 MET -4.99 1.11 1 60 LEU -6.23 0.93 1 61 ARG -4.20 1.05 1 62 LEU -0.57 0.63 1 63 ILE -0.60 0.37 1 65 LYS -0.80 -0.07 1 66 VAL -0.51 -0.02 1 67 ASP -0.89 0.03 1 68 GLU 1.17 -0.24 1 69 SER 2.40 -0.19 1 70 LYS -0.20 0.06 1 71 LYS 0.47 0.04 1 72 ARG -2.75 0.21 1 73 LYS -2.28 0.48 1 74 ASP -1.18 -0.03 1 75 ASN 2.51 -0.24 1 76 GLU -0.58 -0.02 1 78 ASN -0.34 -0.04 1 85 GLN 0.03 -0.20 1 86 ARG -3.62 0.76 1 87 HIS -4.90 -0.02 1 88 MET -2.43 0.77 1 89 PHE -5.42 0.49 1 90 SER -2.30 1.17 1 91 PHE -4.41 0.26 1 92 ASN -1.76 0.33 1 93 ASN -2.90 0.13 1 94 ARG 4.14 -0.50 1 95 THR 6.04 -0.39 1 96 VAL 4.48 -0.36 1 98 ASP 4.69 -0.42 1 99 ASN 3.54 -0.33 1 100 ILE 4.71 -0.55 1 101 LYS 4.72 -0.73 1 102 MET 4.11 -0.35 1 103 THR 6.12 -0.54 1 104 LEU 2.49 -0.51 1 105 GLN 4.38 -0.45 1 106 GLN 4.02 -0.30 1 107 ILE 4.24 -0.73 1 108 ILE 5.08 -0.36 1 109 SER 4.30 -0.28 1 110 ARG 3.60 -0.26 1 111 TYR 1.00 0.20 1 112 LYS 1.39 0.02 1 113 ASP 0.79 -0.05 1 114 ALA 0.48 -0.02 1 115 ASP 0.25 -0.04 1 117 ASN 0.08 0.06 1 118 SER -0.06 0.05 1 119 SER 0.76 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6225_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.97 _LACS_plot.Line_2_terminator_val_x_2 6.12 _LACS_plot.Line_2_terminator_val_y_2 1.92 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 LYS 5.37 -1.12 0 42 LEU 5.29 -1.46 0 10 GLU 3.41 -1.46 1 12 VAL -1.65 -1.23 1 13 SER 1.61 0.66 1 15 ILE -4.50 -0.96 1 16 ILE -3.79 -3.03 1 17 ALA -4.03 -1.63 1 18 ILE -0.46 -2.21 1 19 ASN -2.19 -0.49 1 20 GLU -1.56 -0.49 1 21 ASP 2.02 -0.67 1 22 VAL -4.10 -2.94 1 25 ALA -1.27 -2.14 1 26 GLU -7.12 -2.07 1 27 LEU -4.56 -2.96 1 28 THR -2.38 -2.03 1 29 TRP -4.13 -2.27 1 30 ARG -5.41 -1.51 1 31 SER -0.84 1.75 1 32 THR 5.61 0.86 1 33 ASP 0.27 0.71 1 35 ASP 0.66 -0.99 1 36 LYS -3.23 -2.10 1 37 VAL -4.87 -1.22 1 38 HIS -4.21 -0.73 1 39 THR -1.39 -1.64 1 40 VAL -3.16 -1.61 1 41 VAL 3.63 2.99 1 43 SER 3.73 0.79 1 44 THR 0.16 -1.11 1 45 ILE -0.58 -2.73 1 46 ASP -2.95 -0.82 1 47 LYS -4.83 -3.83 1 48 LEU -4.57 -1.72 1 49 GLN -3.70 -2.05 1 50 ALA -6.04 -0.41 1 53 ALA 3.40 -0.32 1 54 SER 0.64 0.16 1 55 SER -1.09 0.15 1 56 GLU 1.88 0.70 1 57 LYS -0.68 -0.74 1 58 MET -2.13 -2.27 1 59 MET -4.99 -2.16 1 60 LEU -6.23 -2.68 1 61 ARG -4.20 -1.80 1 62 LEU -0.57 -2.33 1 63 ILE -0.60 -0.17 1 65 LYS -0.80 0.71 1 67 ASP -0.89 0.23 1 68 GLU 1.17 0.75 1 69 SER 2.40 0.56 1 70 LYS -0.20 -0.56 1 71 LYS 0.47 -0.55 1 72 ARG -2.75 -1.13 1 73 LYS -2.28 0.40 1 74 ASP -1.18 1.08 1 75 ASN 2.51 0.70 1 76 GLU -0.58 -0.15 1 78 ASN -0.34 -0.15 1 85 GLN 0.03 -1.03 1 86 ARG -3.62 -1.41 1 87 HIS -4.90 -0.05 1 88 MET -2.43 -2.75 1 89 PHE -5.42 -1.41 1 90 SER -2.30 -1.62 1 91 PHE -4.41 -1.41 1 92 ASN -1.76 -0.48 1 93 ASN -2.90 -0.76 1 94 ARG 4.14 0.40 1 95 THR 6.04 1.83 1 96 VAL 4.48 1.17 1 97 MET 4.79 0.79 1 98 ASP 4.69 2.61 1 99 ASN 3.54 2.77 1 100 ILE 4.71 1.08 1 101 LYS 4.72 0.88 1 102 MET 4.11 2.63 1 103 THR 6.12 1.78 1 104 LEU 2.49 0.71 1 105 GLN 4.38 2.65 1 106 GLN 4.02 2.56 1 107 ILE 4.24 1.19 1 108 ILE 5.08 2.82 1 109 SER 4.30 1.27 1 110 ARG 3.60 2.05 1 111 TYR 1.00 0.91 1 112 LYS 1.39 0.60 1 113 ASP 0.79 0.34 1 114 ALA 0.48 0.14 1 115 ASP 0.25 0.70 1 117 ASN 0.08 0.09 1 118 SER -0.06 -0.87 1 stop_ save_