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 bmr25895_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.86 _LACS_plot.Line_1_terminator_val_y_1 -2.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 4.67 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 MET 5.72 5.80 0 91 HIS 2.29 4.70 0 62 TRP -7.07 -0.43 0 10 ALA -1.52 -1.20 1 11 VAL 1.16 1.06 1 12 ASP -1.72 0.43 1 14 ASP 3.44 2.01 1 15 SER 1.58 2.15 1 17 LEU -0.86 -1.11 1 18 GLU 3.86 2.95 1 19 HIS 0.11 1.30 1 20 SER -1.64 0.13 1 21 ALA -6.30 -1.76 1 22 HIS -3.69 -1.18 1 23 VAL 2.21 1.18 1 24 LEU 0.18 1.59 1 25 GLU -4.38 -1.88 1 26 LYS -2.54 0.59 1 29 LYS -3.35 -1.69 1 30 VAL -0.58 -0.47 1 31 PHE 2.89 0.32 1 32 SER -1.97 -1.06 1 33 ALA -3.56 -0.56 1 34 THR 0.62 1.08 1 35 LEU -5.71 -2.50 1 37 LEU -1.28 0.73 1 38 VAL -1.11 -0.55 1 39 ASP -2.29 -1.30 1 40 ILE 2.68 2.14 1 41 VAL 4.42 3.31 1 42 LYS -0.01 0.24 1 45 ASN -1.21 -0.35 1 46 SER -2.00 0.10 1 47 TYR -5.84 -2.16 1 48 TYR -3.15 0.57 1 50 LEU -6.48 -1.52 1 51 GLN -6.13 -0.19 1 52 LEU -2.12 0.25 1 53 LEU -3.82 -2.03 1 54 GLU -7.86 -3.27 1 55 ASP -1.50 1.06 1 56 ASP 3.83 3.12 1 57 LYS -0.14 0.99 1 59 ASN 0.81 -0.20 1 60 ARG -4.42 -1.09 1 61 TYR -5.21 -0.56 1 63 ILE -2.15 -1.87 1 64 PHE -4.62 -1.52 1 65 ARG -7.02 -3.10 1 66 SER -4.44 -2.31 1 67 TRP -3.02 -0.71 1 69 ARG -1.70 -0.87 1 70 VAL 3.52 2.89 1 72 THR -2.71 -0.95 1 73 VAL 1.88 0.47 1 74 ILE 0.79 0.08 1 76 SER -2.08 -1.26 1 77 ASN -3.25 -0.25 1 78 LYS -3.45 0.43 1 79 LEU -3.87 -1.16 1 80 GLU -5.57 -1.59 1 81 GLN 1.50 0.96 1 82 MET -4.15 -2.48 1 84 SER -4.05 -1.42 1 85 LYS 4.65 3.62 1 86 GLU 5.77 4.31 1 87 ASP 2.90 3.45 1 88 ALA 4.31 3.15 1 89 ILE 5.66 5.33 1 90 GLU 3.64 3.33 1 92 PHE 4.35 4.81 1 94 LYS 4.20 3.50 1 95 LEU 2.81 2.61 1 96 TYR 5.18 5.25 1 97 GLU 2.72 2.39 1 98 GLU 3.41 2.95 1 99 LYS 1.92 0.28 1 100 THR -2.33 0.85 1 102 ASN -6.31 -1.16 1 103 ALA -0.56 -0.86 1 104 TRP 0.93 1.96 1 105 HIS 0.26 0.94 1 106 SER 0.58 0.79 1 107 LYS 1.81 1.45 1 108 ASN -2.75 -0.96 1 109 PHE -0.84 0.66 1 110 THR -1.27 -0.32 1 111 LYS 0.93 0.53 1 112 TYR -0.68 0.44 1 114 LYS 4.49 1.59 1 115 LYS -3.37 -2.37 1 116 PHE -1.59 0.32 1 117 TYR -2.74 -1.89 1 119 LEU 0.11 0.58 1 120 GLU -0.02 0.06 1 121 ILE -0.12 0.19 1 122 ASP -0.63 -0.37 1 123 TYR 0.60 0.48 1 125 GLN -0.35 0.02 1 126 ASP 0.21 0.45 1 127 GLU 0.10 1.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25895_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.86 _LACS_plot.Line_1_terminator_val_y_1 5.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.79 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -1.09 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 MET 5.72 0.08 0 91 HIS 2.29 2.41 0 62 TRP -7.07 6.64 0 10 ALA -1.52 0.32 1 11 VAL 1.16 -0.10 1 12 ASP -1.72 2.15 1 14 ASP 3.44 -1.43 1 15 SER 1.58 0.57 1 17 LEU -0.86 -0.25 1 18 GLU 3.86 -0.91 1 19 HIS 0.11 1.19 1 20 SER -1.64 1.77 1 21 ALA -6.30 4.54 1 22 HIS -3.69 2.51 1 23 VAL 2.21 -1.03 1 24 LEU 0.18 1.41 1 25 GLU -4.38 2.50 1 26 LYS -2.54 3.13 1 29 LYS -3.35 1.66 1 30 VAL -0.58 0.11 1 31 PHE 2.89 -2.57 1 32 SER -1.97 0.91 1 33 ALA -3.56 3.00 1 34 THR 0.62 0.46 1 35 LEU -5.71 3.21 1 37 LEU -1.28 2.01 1 38 VAL -1.11 0.56 1 39 ASP -2.29 0.99 1 40 ILE 2.68 -0.54 1 41 VAL 4.42 -1.11 1 42 LYS -0.01 0.25 1 45 ASN -1.21 0.86 1 46 SER -2.00 2.10 1 47 TYR -5.84 3.68 1 48 TYR -3.15 3.72 1 50 LEU -6.48 4.96 1 51 GLN -6.13 5.94 1 52 LEU -2.12 2.37 1 53 LEU -3.82 1.79 1 54 GLU -7.86 4.59 1 55 ASP -1.50 2.56 1 56 ASP 3.83 -0.71 1 57 LYS -0.14 1.13 1 59 ASN 0.81 -1.01 1 60 ARG -4.42 3.33 1 61 TYR -5.21 4.65 1 63 ILE -2.15 0.28 1 64 PHE -4.62 3.10 1 65 ARG -7.02 3.92 1 66 SER -4.44 2.13 1 67 TRP -3.02 2.31 1 69 ARG -1.70 0.83 1 70 VAL 3.52 -0.63 1 72 THR -2.71 1.76 1 73 VAL 1.88 -1.41 1 74 ILE 0.79 -0.71 1 76 SER -2.08 0.82 1 77 ASN -3.25 3.00 1 78 LYS -3.45 3.88 1 79 LEU -3.87 2.71 1 80 GLU -5.57 3.98 1 81 GLN 1.50 -0.54 1 82 MET -4.15 1.67 1 84 SER -4.05 2.63 1 85 LYS 4.65 -1.03 1 86 GLU 5.77 -1.46 1 87 ASP 2.90 0.55 1 88 ALA 4.31 -1.16 1 89 ILE 5.66 -0.33 1 90 GLU 3.64 -0.31 1 92 PHE 4.35 0.46 1 94 LYS 4.20 -0.70 1 95 LEU 2.81 -0.20 1 96 TYR 5.18 0.07 1 97 GLU 2.72 -0.33 1 98 GLU 3.41 -0.46 1 99 LYS 1.92 -1.64 1 100 THR -2.33 3.18 1 102 ASN -6.31 5.15 1 103 ALA -0.56 -0.30 1 104 TRP 0.93 1.03 1 105 HIS 0.26 0.68 1 106 SER 0.58 0.21 1 107 LYS 1.81 -0.36 1 108 ASN -2.75 1.79 1 109 PHE -0.84 1.50 1 110 THR -1.27 0.95 1 111 LYS 0.93 -0.40 1 112 TYR -0.68 1.12 1 114 LYS 4.49 -2.90 1 115 LYS -3.37 1.00 1 116 PHE -1.59 1.91 1 117 TYR -2.74 0.85 1 119 LEU 0.11 0.47 1 120 GLU -0.02 0.08 1 121 ILE -0.12 0.31 1 122 ASP -0.63 0.26 1 123 TYR 0.60 -0.12 1 125 GLN -0.35 0.37 1 126 ASP 0.21 0.24 1 127 GLU 0.10 1.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25895_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.86 _LACS_plot.Line_1_terminator_val_y_1 1.08 _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 0.37 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 85 LYS 4.65 -1.75 0 10 ALA -1.52 0.16 1 11 VAL 1.16 -0.72 1 12 ASP -1.72 -0.45 1 15 SER 1.58 -0.96 1 19 HIS 0.11 0.19 1 20 SER -1.64 0.29 1 21 ALA -6.30 0.66 1 22 HIS -3.69 0.23 1 23 VAL 2.21 0.13 1 24 LEU 0.18 0.11 1 25 GLU -4.38 1.15 1 26 LYS -2.54 0.35 1 29 LYS -3.35 0.42 1 30 VAL -0.58 0.57 1 31 PHE 2.89 -0.40 1 32 SER -1.97 1.26 1 33 ALA -3.56 1.00 1 34 THR 0.62 0.48 1 35 LEU -5.71 0.97 1 37 LEU -1.28 -0.14 1 38 VAL -1.11 0.51 1 39 ASP -2.29 0.27 1 40 ILE 2.68 -0.07 1 41 VAL 4.42 -0.24 1 42 LYS -0.01 -0.02 1 45 ASN -1.21 0.63 1 46 SER -2.00 1.09 1 47 TYR -5.84 1.59 1 48 TYR -3.15 0.49 1 50 LEU -6.48 1.26 1 51 GLN -6.13 1.54 1 52 LEU -2.12 1.17 1 53 LEU -3.82 0.75 1 54 GLU -7.86 0.38 1 55 ASP -1.50 0.03 1 56 ASP 3.83 -0.03 1 57 LYS -0.14 0.25 1 59 ASN 0.81 0.08 1 60 ARG -4.42 -0.01 1 61 TYR -5.21 0.66 1 62 TRP -7.07 1.03 1 63 ILE -2.15 1.26 1 64 PHE -4.62 1.01 1 65 ARG -7.02 1.09 1 66 SER -4.44 0.33 1 67 TRP -3.02 0.30 1 69 ARG -1.70 0.75 1 70 VAL 3.52 -0.15 1 72 THR -2.71 0.51 1 73 VAL 1.88 0.23 1 74 ILE 0.79 0.05 1 76 SER -2.08 -0.04 1 77 ASN -3.25 -0.03 1 78 LYS -3.45 0.28 1 79 LEU -3.87 1.14 1 80 GLU -5.57 0.65 1 81 GLN 1.50 0.17 1 82 MET -4.15 0.62 1 84 SER -4.05 0.20 1 86 GLU 5.77 -0.56 1 87 ASP 2.90 -0.18 1 88 ALA 4.31 -0.16 1 89 ILE 5.66 -0.90 1 90 GLU 3.64 -0.24 1 91 HIS 2.29 -0.23 1 92 PHE 4.35 -0.82 1 93 MET 5.72 -0.65 1 94 LYS 4.20 -0.07 1 95 LEU 2.81 -0.35 1 96 TYR 5.18 -1.02 1 97 GLU 2.72 0.11 1 99 LYS 1.92 -0.17 1 100 THR -2.33 1.08 1 102 ASN -6.31 0.27 1 103 ALA -0.56 0.38 1 104 TRP 0.93 -0.40 1 105 HIS 0.26 -0.39 1 106 SER 0.58 -0.10 1 107 LYS 1.81 -0.04 1 108 ASN -2.75 0.23 1 109 PHE -0.84 -0.18 1 110 THR -1.27 -0.11 1 111 LYS 0.93 0.19 1 112 TYR -0.68 0.15 1 114 LYS 4.49 -0.42 1 115 LYS -3.37 0.57 1 116 PHE -1.59 0.05 1 117 TYR -2.74 0.57 1 119 LEU 0.11 0.10 1 120 GLU -0.02 0.04 1 121 ILE -0.12 -0.03 1 122 ASP -0.63 0.09 1 123 TYR 0.60 0.06 1 125 GLN -0.35 0.11 1 126 ASP 0.21 0.06 1 127 GLU 0.10 -0.18 1 stop_ save_