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 bmr6475_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 -2.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.38 _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 4.61 _LACS_plot.Line_2_terminator_val_y_2 2.88 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 HIS 2.63 4.22 0 10 THR -0.16 -0.06 1 11 TYR -4.49 -1.85 1 12 THR -1.42 -0.81 1 13 ALA 4.03 2.73 1 14 ALA 2.70 1.75 1 15 SER -0.46 -0.31 1 16 ALA -0.32 -1.02 1 17 SER 1.24 -0.15 1 18 ILE -0.73 -2.23 1 19 THR 0.11 -0.30 1 20 ALA 1.93 0.93 1 22 ALA -1.40 0.48 1 23 GLN -5.01 -2.30 1 24 LEU -0.86 -1.04 1 25 VAL -0.10 -0.62 1 27 ASN -0.03 -0.62 1 28 VAL -1.78 -0.23 1 30 GLU -1.09 -1.19 1 31 LEU 1.82 0.37 1 32 GLN 0.74 -1.46 1 34 ALA 2.43 1.73 1 36 SER 0.72 1.40 1 37 ALA -2.61 0.56 1 38 VAL -1.02 -0.23 1 39 ILE -5.19 -3.58 1 40 TRP 0.30 1.77 1 41 ASN -0.61 -0.44 1 42 VAL -4.91 -3.10 1 43 ASP -1.46 -1.08 1 44 VAL 0.22 -1.81 1 46 VAL -6.88 -3.28 1 47 THR 1.25 0.07 1 49 GLU -1.30 -0.69 1 50 TYR -5.04 -2.17 1 51 ARG -1.70 -0.24 1 52 ILE -0.77 0.05 1 53 ASN -4.81 -2.02 1 54 LEU -3.37 -0.57 1 55 THR 2.73 1.29 1 56 TRP -6.53 -2.85 1 57 SER 2.06 2.09 1 58 SER -0.51 -1.11 1 60 TYR 1.77 1.55 1 61 SER -0.30 -0.14 1 62 SER 1.21 0.33 1 63 LYS -7.05 -2.07 1 64 VAL 0.36 -0.93 1 65 ASN -5.54 0.08 1 66 THR 3.12 1.93 1 67 LEU -2.66 -0.51 1 68 VAL 0.31 -0.70 1 69 MET -4.39 -3.39 1 70 ASP 2.29 0.33 1 72 THR 0.94 0.52 1 73 ALA -2.88 -1.77 1 74 LEU -3.67 -1.27 1 75 SER 2.26 0.86 1 76 TYR -3.98 -0.03 1 77 ALA -0.70 -2.42 1 78 PHE 2.35 0.05 1 79 ALA -0.94 -0.61 1 80 GLU 0.66 0.80 1 81 ALA -1.86 0.27 1 82 THR 3.07 1.35 1 83 VAL -0.53 -0.76 1 85 VAL -3.74 -1.93 1 86 THR 0.08 -0.06 1 87 TYR 0.13 0.44 1 88 VAL -3.78 -2.22 1 89 GLN -5.40 -0.88 1 90 THR -0.73 -0.88 1 91 LYS -4.22 -0.56 1 92 THR 2.68 1.23 1 93 LEU -3.99 -2.62 1 94 SER -1.49 -1.84 1 95 ALA 2.31 1.09 1 97 ASN -1.23 0.80 1 98 HIS -5.28 -0.59 1 99 SER -3.29 -1.83 1 100 PHE -8.37 -2.12 1 102 VAL -4.97 -1.87 1 103 ARG -6.34 -2.40 1 104 VAL -1.00 -2.05 1 106 SER 4.62 3.50 1 107 SER -0.43 -0.78 1 108 ASP -0.45 0.15 1 109 TRP -1.92 -0.45 1 111 TYR 3.03 2.55 1 112 MET 0.12 0.13 1 113 ASN -3.52 -0.74 1 114 VAL -0.23 0.13 1 116 SER -1.60 -0.32 1 117 LEU -4.23 -2.85 1 118 LYS -4.82 -2.16 1 119 LEU -4.61 -1.44 1 120 GLU -5.58 -2.36 1 121 LEU -0.15 -0.32 1 122 LEU 0.63 -0.57 1 126 THR 0.18 0.92 1 127 ILE 1.55 0.95 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6475_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 5.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.62 _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 4.61 _LACS_plot.Line_2_terminator_val_y_2 -1.73 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 HIS 2.63 1.59 0 10 THR -0.16 0.10 1 11 TYR -4.49 2.64 1 12 THR -1.42 0.61 1 13 ALA 4.03 -1.30 1 14 ALA 2.70 -0.95 1 15 SER -0.46 0.15 1 16 ALA -0.32 -0.70 1 17 SER 1.24 -1.39 1 18 ILE -0.73 -1.50 1 19 THR 0.11 -0.41 1 20 ALA 1.93 -1.00 1 22 ALA -1.40 1.88 1 23 GLN -5.01 2.71 1 24 LEU -0.86 -0.18 1 25 VAL -0.10 -0.52 1 27 ASN -0.03 -0.59 1 28 VAL -1.78 1.55 1 30 GLU -1.09 -0.10 1 31 LEU 1.82 -1.45 1 32 GLN 0.74 -2.20 1 34 ALA 2.43 -0.70 1 36 SER 0.72 0.68 1 37 ALA -2.61 3.17 1 38 VAL -1.02 0.79 1 39 ILE -5.19 1.61 1 40 TRP 0.30 1.47 1 41 ASN -0.61 0.17 1 42 VAL -4.91 1.81 1 43 ASP -1.46 0.38 1 44 VAL 0.22 -2.03 1 46 VAL -6.88 3.60 1 47 THR 1.25 -1.18 1 49 GLU -1.30 0.61 1 50 TYR -5.04 2.87 1 51 ARG -1.70 1.46 1 52 ILE -0.77 0.82 1 53 ASN -4.81 2.79 1 54 LEU -3.37 2.80 1 55 THR 2.73 -1.44 1 56 TRP -6.53 3.68 1 57 SER 2.06 0.03 1 58 SER -0.51 -0.60 1 60 TYR 1.77 -0.22 1 61 SER -0.30 0.16 1 62 SER 1.21 -0.88 1 63 LYS -7.05 4.98 1 64 VAL 0.36 -1.29 1 65 ASN -5.54 5.62 1 66 THR 3.12 -1.19 1 67 LEU -2.66 2.15 1 68 VAL 0.31 -1.01 1 69 MET -4.39 1.00 1 70 ASP 2.29 -1.96 1 72 THR 0.94 -0.42 1 73 ALA -2.88 1.11 1 74 LEU -3.67 2.40 1 75 SER 2.26 -1.40 1 76 TYR -3.98 3.95 1 77 ALA -0.70 -1.72 1 78 PHE 2.35 -2.30 1 79 ALA -0.94 0.33 1 80 GLU 0.66 0.14 1 81 ALA -1.86 2.13 1 82 THR 3.07 -1.72 1 83 VAL -0.53 -0.23 1 85 VAL -3.74 1.81 1 86 THR 0.08 -0.14 1 87 TYR 0.13 0.31 1 88 VAL -3.78 1.56 1 89 GLN -5.40 4.52 1 90 THR -0.73 -0.15 1 91 LYS -4.22 3.66 1 92 THR 2.68 -1.45 1 93 LEU -3.99 1.37 1 94 SER -1.49 -0.35 1 95 ALA 2.31 -1.22 1 97 ASN -1.23 2.03 1 98 HIS -5.28 4.69 1 99 SER -3.29 1.46 1 100 PHE -8.37 6.25 1 102 VAL -4.97 3.10 1 103 ARG -6.34 3.94 1 104 VAL -1.00 -1.05 1 106 SER 4.62 -1.12 1 107 SER -0.43 -0.35 1 108 ASP -0.45 0.60 1 109 TRP -1.92 1.47 1 111 TYR 3.03 -0.48 1 112 MET 0.12 0.01 1 113 ASN -3.52 2.78 1 114 VAL -0.23 0.36 1 116 SER -1.60 1.28 1 117 LEU -4.23 1.38 1 118 LYS -4.82 2.66 1 119 LEU -4.61 3.17 1 120 GLU -5.58 3.22 1 121 LEU -0.15 -0.17 1 122 LEU 0.63 -1.20 1 126 THR 0.18 0.74 1 127 ILE 1.55 -0.60 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6475_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 0.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _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 4.61 _LACS_plot.Line_2_terminator_val_y_2 -0.43 _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 63 LYS -7.05 -0.66 0 10 THR -0.16 0.52 1 11 TYR -4.49 0.28 1 12 THR -1.42 0.75 1 13 ALA 4.03 -0.46 1 14 ALA 2.70 -0.21 1 15 SER -0.46 0.28 1 16 ALA -0.32 -0.50 1 17 SER 1.24 -0.08 1 18 ILE -0.73 0.37 1 19 THR 0.11 0.02 1 20 ALA 1.93 0.00 1 22 ALA -1.40 0.41 1 23 GLN -5.01 0.13 1 24 LEU -0.86 0.25 1 25 VAL -0.10 -0.05 1 27 ASN -0.03 -0.03 1 28 VAL -1.78 -0.04 1 30 GLU -1.09 0.39 1 31 LEU 1.82 -0.47 1 32 GLN 0.74 -0.99 1 34 ALA 2.43 -0.70 1 36 SER 0.72 -0.33 1 37 ALA -2.61 0.37 1 38 VAL -1.02 -0.12 1 39 ILE -5.19 0.51 1 40 TRP 0.30 -0.04 1 41 ASN -0.61 0.38 1 42 VAL -4.91 0.20 1 43 ASP -1.46 0.20 1 44 VAL 0.22 -0.40 1 46 VAL -6.88 0.48 1 47 THR 1.25 0.82 1 49 GLU -1.30 0.16 1 50 TYR -5.04 0.93 1 51 ARG -1.70 0.39 1 52 ILE -0.77 -0.02 1 53 ASN -4.81 0.88 1 54 LEU -3.37 0.90 1 55 THR 2.73 1.01 1 56 TRP -6.53 0.86 1 57 SER 2.06 -0.25 1 58 SER -0.51 0.33 1 60 TYR 1.77 -0.01 1 61 SER -0.30 0.14 1 62 SER 1.21 0.49 1 64 VAL 0.36 0.50 1 65 ASN -5.54 0.35 1 66 THR 3.12 0.21 1 67 LEU -2.66 0.10 1 68 VAL 0.31 0.32 1 69 MET -4.39 0.77 1 70 ASP 2.29 -0.77 1 72 THR 0.94 -0.15 1 73 ALA -2.88 0.55 1 74 LEU -3.67 0.24 1 75 SER 2.26 -0.11 1 76 TYR -3.98 -0.31 1 77 ALA -0.70 -0.21 1 78 PHE 2.35 -0.91 1 79 ALA -0.94 -0.22 1 80 GLU 0.66 -0.19 1 81 ALA -1.86 0.17 1 82 THR 3.07 -0.31 1 83 VAL -0.53 -0.19 1 85 VAL -3.74 -0.35 1 86 THR 0.08 0.52 1 87 TYR 0.13 0.11 1 88 VAL -3.78 1.09 1 89 GLN -5.40 0.12 1 90 THR -0.73 1.18 1 91 LYS -4.22 0.31 1 92 THR 2.68 0.53 1 93 LEU -3.99 0.32 1 94 SER -1.49 0.17 1 95 ALA 2.31 -0.56 1 97 ASN -1.23 0.43 1 98 HIS -5.28 -0.06 1 99 SER -3.29 1.28 1 100 PHE -8.37 0.76 1 102 VAL -4.97 0.93 1 103 ARG -6.34 0.61 1 104 VAL -1.00 0.59 1 106 SER 4.62 -0.49 1 107 SER -0.43 0.21 1 108 ASP -0.45 0.07 1 109 TRP -1.92 0.11 1 111 TYR 3.03 -0.38 1 112 MET 0.12 0.16 1 113 ASN -3.52 1.03 1 114 VAL -0.23 0.38 1 115 HIS 2.63 -0.03 1 116 SER -1.60 0.69 1 117 LEU -4.23 0.47 1 118 LYS -4.82 1.31 1 119 LEU -4.61 1.04 1 120 GLU -5.58 0.61 1 121 LEU -0.15 -0.53 1 122 LEU 0.63 -0.01 1 126 THR 0.18 -0.28 1 127 ILE 1.55 -0.60 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6475_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.62 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 4.61 _LACS_plot.Line_2_terminator_val_y_2 -0.07 _LACS_plot.Y_axis_chem_shift_offset 1.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 TRP -1.92 2.33 0 100 PHE -8.37 -0.99 0 12 THR -1.42 2.87 0 10 THR -0.16 -1.95 1 11 TYR -4.49 0.25 1 13 ALA 4.03 -1.00 1 14 ALA 2.70 0.67 1 15 SER -0.46 -0.44 1 16 ALA -0.32 -1.12 1 17 SER 1.24 -0.25 1 18 ILE -0.73 -0.29 1 19 THR 0.11 -0.99 1 20 ALA 1.93 -0.35 1 22 ALA -1.40 -2.07 1 23 GLN -5.01 -2.33 1 24 LEU -0.86 -1.72 1 25 VAL -0.10 0.50 1 27 ASN -0.03 -2.17 1 28 VAL -1.78 -2.29 1 30 GLU -1.09 0.01 1 31 LEU 1.82 -1.02 1 32 GLN 0.74 -1.90 1 34 ALA 2.43 -0.61 1 36 SER 0.72 -2.09 1 37 ALA -2.61 -2.95 1 38 VAL -1.02 -3.23 1 39 ILE -5.19 -1.27 1 40 TRP 0.30 -1.62 1 41 ASN -0.61 -0.44 1 42 VAL -4.91 -2.38 1 43 ASP -1.46 -0.40 1 44 VAL 0.22 1.94 1 46 VAL -6.88 -1.58 1 47 THR 1.25 -0.12 1 49 GLU -1.30 -2.18 1 50 TYR -5.04 -0.97 1 51 ARG -1.70 -1.54 1 52 ILE -0.77 -2.68 1 53 ASN -4.81 -0.95 1 54 LEU -3.37 -2.64 1 55 THR 2.73 -1.95 1 56 TRP -6.53 -3.63 1 57 SER 2.06 -1.02 1 60 TYR 1.77 0.54 1 61 SER -0.30 -1.28 1 62 SER 1.21 0.51 1 63 LYS -7.05 -1.73 1 64 VAL 0.36 -0.40 1 65 ASN -5.54 -3.33 1 66 THR 3.12 -1.55 1 67 LEU -2.66 -2.82 1 68 VAL 0.31 -0.79 1 69 MET -4.39 -0.72 1 70 ASP 2.29 0.33 1 72 THR 0.94 -2.43 1 73 ALA -2.88 -1.45 1 74 LEU -3.67 -2.37 1 75 SER 2.26 -0.88 1 76 TYR -3.98 -4.81 1 77 ALA -0.70 -3.32 1 78 PHE 2.35 -1.38 1 79 ALA -0.94 -2.97 1 80 GLU 0.66 0.61 1 81 ALA -1.86 -1.15 1 82 THR 3.07 0.09 1 83 VAL -0.53 -1.58 1 85 VAL -3.74 -2.82 1 86 THR 0.08 -0.30 1 87 TYR 0.13 -1.90 1 88 VAL -3.78 -1.07 1 89 GLN -5.40 -2.31 1 90 THR -0.73 -0.26 1 91 LYS -4.22 -1.90 1 92 THR 2.68 -0.39 1 93 LEU -3.99 -2.41 1 94 SER -1.49 0.80 1 95 ALA 2.31 -0.31 1 97 ASN -1.23 0.42 1 98 HIS -5.28 -1.72 1 99 SER -3.29 -0.50 1 102 VAL -4.97 -3.36 1 103 ARG -6.34 -3.81 1 104 VAL -1.00 1.40 1 106 SER 4.62 1.17 1 107 SER -0.43 -0.50 1 108 ASP -0.45 0.24 1 111 TYR 3.03 -2.33 1 112 MET 0.12 -4.01 1 113 ASN -3.52 -0.44 1 114 VAL -0.23 -1.70 1 115 HIS 2.63 1.46 1 116 SER -1.60 -4.62 1 117 LEU -4.23 -3.94 1 118 LYS -4.82 -0.87 1 119 LEU -4.61 -1.85 1 120 GLU -5.58 -1.80 1 121 LEU -0.15 -1.57 1 122 LEU 0.63 0.02 1 stop_ save_