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 bmr6936_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 -2.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _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 7.71 _LACS_plot.Line_2_terminator_val_y_2 4.57 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 MET -0.83 -2.55 0 25 ARG 4.34 3.84 0 36 TYR 7.71 3.88 0 11 ALA -0.01 0.16 1 12 LYS -4.95 -1.65 1 13 ASN -1.91 -0.88 1 14 TYR -2.25 -1.46 1 15 GLN 2.81 0.20 1 16 TYR -5.64 -1.08 1 17 VAL -5.59 -2.90 1 18 MET -5.88 -2.06 1 19 SER -0.37 -0.52 1 20 GLU -2.53 -0.82 1 21 GLN -6.39 -1.14 1 23 GLU 3.61 2.05 1 26 SER 4.26 2.93 1 27 ILE 0.22 -0.37 1 28 GLN 1.60 0.36 1 30 VAL 0.94 1.04 1 31 HIS -5.54 -0.02 1 32 VAL -3.69 -0.76 1 33 TRP -4.55 -1.21 1 34 ASP -7.43 -1.20 1 35 ASN -1.28 -1.62 1 37 ARG 0.71 2.37 1 38 PHE -6.29 -3.94 1 39 THR -0.76 0.32 1 40 ARG -2.80 -1.18 1 41 PHE -4.96 -2.05 1 42 GLU -4.77 -1.79 1 43 PHE 2.03 1.93 1 45 ALA 1.76 1.04 1 46 ASN 2.51 1.19 1 47 ALA -2.09 -0.89 1 48 GLU 0.05 -0.15 1 49 LEU -1.03 -0.90 1 51 GLN -3.47 -0.36 1 52 VAL 0.75 0.11 1 53 TYR -3.39 -0.96 1 54 MET -4.33 -1.40 1 55 ILE 0.34 -1.96 1 56 SER -2.43 -0.78 1 57 ALA 3.17 2.34 1 58 SER -0.11 -0.31 1 60 LYS -1.42 -1.12 1 61 GLU -0.56 -0.21 1 62 THR -3.35 -1.48 1 63 LEU -2.47 -1.25 1 65 ASN 1.86 1.17 1 66 SER -4.96 -1.38 1 67 HIS -3.76 -0.57 1 68 VAL 0.80 0.14 1 69 VAL -5.22 -2.68 1 71 GLU 3.13 2.79 1 72 ASN 0.09 -0.41 1 73 ARG 4.53 1.01 1 74 ASN 0.44 -0.21 1 75 ILE -2.86 -1.78 1 76 ILE -2.16 -0.52 1 77 GLU -5.64 -2.10 1 78 VAL -2.78 -1.48 1 79 GLU 2.13 0.02 1 80 THR 0.29 0.05 1 81 VAL -3.33 -1.12 1 82 ALA -4.77 -1.60 1 83 LYS 2.27 2.11 1 84 GLU -4.27 -0.74 1 85 TRP -6.70 -2.03 1 86 ARG -3.99 -1.50 1 87 ILE -0.75 -0.82 1 88 ARG -5.26 -0.07 1 89 LEU -2.25 1.01 1 92 LYS -2.01 -0.60 1 93 VAL -5.34 -3.54 1 94 VAL -4.32 -0.41 1 96 VAL -4.73 -1.12 1 97 ARG -4.46 -1.09 1 98 ASN -3.31 -1.97 1 99 ASN 0.20 -0.21 1 100 ASN -0.90 -0.78 1 101 PHE -0.43 -0.06 1 102 ALA -0.93 -0.33 1 105 ALA 0.17 0.24 1 107 ALA -0.61 -0.09 1 108 VAL -0.12 -0.19 1 109 ALA -0.51 -0.08 1 110 THR 0.01 0.00 1 112 THR -0.18 -0.19 1 113 ALA -0.78 -0.19 1 114 SER -0.22 -0.16 1 116 ASP -0.01 0.06 1 117 VAL 0.42 0.05 1 118 ARG 0.36 0.21 1 119 ARG 0.13 -0.01 1 120 VAL 0.05 -0.03 1 121 GLN -0.34 -0.28 1 122 ILE 0.27 0.22 1 124 GLU -1.18 -0.44 1 125 ASP -0.02 0.06 1 126 ASN -0.08 1.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6936_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 5.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.59 _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 7.71 _LACS_plot.Line_2_terminator_val_y_2 -3.14 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 MET -0.83 -1.72 0 25 ARG 4.34 -0.50 0 36 TYR 7.71 -3.83 0 11 ALA -0.01 0.17 1 12 LYS -4.95 3.30 1 13 ASN -1.91 1.03 1 14 TYR -2.25 0.79 1 15 GLN 2.81 -2.61 1 16 TYR -5.64 4.56 1 17 VAL -5.59 2.69 1 18 MET -5.88 3.82 1 19 SER -0.37 -0.15 1 20 GLU -2.53 1.71 1 21 GLN -6.39 5.25 1 23 GLU 3.61 -1.56 1 26 SER 4.26 -1.33 1 27 ILE 0.22 -0.59 1 28 GLN 1.60 -1.24 1 30 VAL 0.94 0.10 1 31 HIS -5.54 5.52 1 32 VAL -3.69 2.93 1 33 TRP -4.55 3.34 1 34 ASP -7.43 6.23 1 35 ASN -1.28 -0.34 1 37 ARG 0.71 1.66 1 38 PHE -6.29 2.35 1 39 THR -0.76 1.08 1 40 ARG -2.80 1.62 1 41 PHE -4.96 2.91 1 42 GLU -4.77 2.98 1 43 PHE 2.03 -0.10 1 45 ALA 1.76 -0.72 1 46 ASN 2.51 -1.32 1 47 ALA -2.09 1.20 1 48 GLU 0.05 -0.20 1 49 LEU -1.03 0.13 1 51 GLN -3.47 3.11 1 52 VAL 0.75 -0.64 1 53 TYR -3.39 2.43 1 54 MET -4.33 2.93 1 55 ILE 0.34 -2.30 1 56 SER -2.43 1.65 1 57 ALA 3.17 -0.83 1 58 SER -0.11 -0.20 1 60 LYS -1.42 0.30 1 61 GLU -0.56 0.35 1 62 THR -3.35 1.87 1 63 LEU -2.47 1.22 1 65 ASN 1.86 -0.69 1 66 SER -4.96 3.58 1 67 HIS -3.76 3.19 1 68 VAL 0.80 -0.66 1 69 VAL -5.22 2.54 1 71 GLU 3.13 -0.34 1 72 ASN 0.09 -0.50 1 73 ARG 4.53 -3.52 1 74 ASN 0.44 -0.65 1 75 ILE -2.86 1.08 1 76 ILE -2.16 1.64 1 77 GLU -5.64 3.54 1 78 VAL -2.78 1.30 1 79 GLU 2.13 -2.11 1 80 THR 0.29 -0.24 1 81 VAL -3.33 2.21 1 82 ALA -4.77 3.17 1 83 LYS 2.27 -0.16 1 84 GLU -4.27 3.53 1 85 TRP -6.70 4.67 1 86 ARG -3.99 2.49 1 87 ILE -0.75 -0.07 1 88 ARG -5.26 5.19 1 89 LEU -2.25 3.26 1 92 LYS -2.01 1.41 1 93 VAL -5.34 1.80 1 94 VAL -4.32 3.91 1 96 VAL -4.73 3.61 1 97 ARG -4.46 3.37 1 98 ASN -3.31 1.34 1 99 ASN 0.20 -0.41 1 100 ASN -0.90 0.12 1 101 PHE -0.43 0.37 1 102 ALA -0.93 0.60 1 105 ALA 0.17 0.07 1 107 ALA -0.61 0.52 1 108 VAL -0.12 -0.07 1 109 ALA -0.51 0.43 1 110 THR 0.01 -0.01 1 112 THR -0.18 -0.01 1 113 ALA -0.78 0.59 1 114 SER -0.22 0.06 1 116 ASP -0.01 0.07 1 117 VAL 0.42 -0.37 1 118 ARG 0.36 -0.15 1 119 ARG 0.13 -0.14 1 120 VAL 0.05 -0.08 1 121 GLN -0.34 0.06 1 122 ILE 0.27 -0.05 1 124 GLU -1.18 0.74 1 125 ASP -0.02 0.08 1 126 ASN -0.08 1.74 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6936_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 0.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _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 7.71 _LACS_plot.Line_2_terminator_val_y_2 -0.96 _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 36 TYR 7.71 -0.85 0 98 ASN -3.31 -0.76 0 11 ALA -0.01 -0.02 1 12 LYS -4.95 0.63 1 13 ASN -1.91 0.22 1 14 TYR -2.25 0.64 1 15 GLN 2.81 0.21 1 16 TYR -5.64 1.06 1 17 VAL -5.59 1.25 1 18 MET -5.88 1.61 1 19 SER -0.37 -0.31 1 20 GLU -2.53 0.31 1 21 GLN -6.39 0.31 1 23 GLU 3.61 -0.09 1 24 MET -0.83 -0.08 1 25 ARG 4.34 -0.67 1 26 SER 4.26 -0.30 1 27 ILE 0.22 0.45 1 28 GLN 1.60 -0.33 1 30 VAL 0.94 -0.42 1 31 HIS -5.54 0.63 1 32 VAL -3.69 0.57 1 33 TRP -4.55 0.56 1 34 ASP -7.43 0.86 1 35 ASN -1.28 0.64 1 37 ARG 0.71 0.04 1 38 PHE -6.29 0.72 1 39 THR -0.76 0.20 1 40 ARG -2.80 0.57 1 41 PHE -4.96 -0.20 1 42 GLU -4.77 0.53 1 43 PHE 2.03 -0.16 1 45 ALA 1.76 -0.29 1 46 ASN 2.51 -0.36 1 47 ALA -2.09 0.07 1 48 GLU 0.05 -0.36 1 49 LEU -1.03 -0.64 1 51 GLN -3.47 -0.05 1 52 VAL 0.75 0.19 1 53 TYR -3.39 0.45 1 54 MET -4.33 -0.07 1 55 ILE 0.34 0.31 1 56 SER -2.43 -0.02 1 57 ALA 3.17 -0.20 1 58 SER -0.11 -0.08 1 60 LYS -1.42 0.01 1 61 GLU -0.56 0.67 1 62 THR -3.35 0.41 1 63 LEU -2.47 0.21 1 65 ASN 1.86 -0.20 1 66 SER -4.96 0.75 1 67 HIS -3.76 0.20 1 68 VAL 0.80 0.71 1 69 VAL -5.22 0.55 1 71 GLU 3.13 -0.29 1 72 ASN 0.09 0.19 1 73 ARG 4.53 -0.77 1 74 ASN 0.44 0.26 1 75 ILE -2.86 1.04 1 76 ILE -2.16 0.39 1 77 GLU -5.64 0.73 1 78 VAL -2.78 0.32 1 79 GLU 2.13 -0.38 1 80 THR 0.29 0.51 1 81 VAL -3.33 0.33 1 82 ALA -4.77 0.04 1 83 LYS 2.27 -0.56 1 84 GLU -4.27 0.92 1 85 TRP -6.70 0.83 1 86 ARG -3.99 0.73 1 87 ILE -0.75 0.64 1 88 ARG -5.26 0.88 1 89 LEU -2.25 0.06 1 92 LYS -2.01 0.28 1 93 VAL -5.34 1.47 1 94 VAL -4.32 -0.39 1 96 VAL -4.73 1.37 1 97 ARG -4.46 1.06 1 99 ASN 0.20 0.11 1 100 ASN -0.90 0.13 1 101 PHE -0.43 -0.29 1 102 ALA -0.93 -0.29 1 105 ALA 0.17 -0.10 1 107 ALA -0.61 -0.02 1 108 VAL -0.12 -0.05 1 109 ALA -0.51 0.05 1 110 THR 0.01 -0.05 1 112 THR -0.18 -0.05 1 113 ALA -0.78 0.02 1 114 SER -0.22 -0.08 1 116 ASP -0.01 -0.06 1 117 VAL 0.42 -0.06 1 118 ARG 0.36 -0.07 1 119 ARG 0.13 -0.01 1 120 VAL 0.05 -0.06 1 121 GLN -0.34 0.01 1 122 ILE 0.27 -0.04 1 124 GLU -1.18 -0.04 1 125 ASP -0.02 -0.02 1 126 ASN -0.08 -0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6936_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 -1.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 7.71 _LACS_plot.Line_2_terminator_val_y_2 0.81 _LACS_plot.Y_axis_chem_shift_offset 0.62 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 TYR 7.71 -1.72 0 126 ASN -0.08 4.38 0 11 ALA -0.01 -0.73 1 12 LYS -4.95 -1.17 1 13 ASN -1.91 -1.04 1 14 TYR -2.25 1.98 1 15 GLN 2.81 -3.29 1 16 TYR -5.64 1.39 1 17 VAL -5.59 -2.03 1 18 MET -5.88 -1.75 1 19 SER -0.37 -0.03 1 20 GLU -2.53 -1.28 1 21 GLN -6.39 0.26 1 23 GLU 3.61 1.09 1 24 MET -0.83 -0.05 1 25 ARG 4.34 1.78 1 26 SER 4.26 1.43 1 27 ILE 0.22 -2.43 1 28 GLN 1.60 0.52 1 30 VAL 0.94 -1.49 1 31 HIS -5.54 0.15 1 32 VAL -3.69 -3.54 1 33 TRP -4.55 -4.22 1 34 ASP -7.43 -2.16 1 35 ASN -1.28 2.03 1 37 ARG 0.71 -2.24 1 38 PHE -6.29 -0.48 1 39 THR -0.76 -1.84 1 40 ARG -2.80 -3.46 1 41 PHE -4.96 -2.67 1 42 GLU -4.77 -2.38 1 43 PHE 2.03 -2.03 1 45 ALA 1.76 0.00 1 46 ASN 2.51 -1.14 1 47 ALA -2.09 -0.33 1 48 GLU 0.05 -0.66 1 49 LEU -1.03 -0.62 1 51 GLN -3.47 -0.74 1 52 VAL 0.75 -2.76 1 53 TYR -3.39 0.66 1 54 MET -4.33 -1.35 1 55 ILE 0.34 -0.68 1 56 SER -2.43 1.28 1 58 SER -0.11 0.65 1 60 LYS -1.42 -0.17 1 61 GLU -0.56 0.39 1 62 THR -3.35 -2.42 1 63 LEU -2.47 -1.36 1 65 ASN 1.86 -0.89 1 66 SER -4.96 -1.90 1 67 HIS -3.76 -1.33 1 68 VAL 0.80 0.29 1 69 VAL -5.22 -1.78 1 71 GLU 3.13 1.16 1 72 ASN 0.09 -0.85 1 73 ARG 4.53 -1.64 1 74 ASN 0.44 -2.19 1 75 ILE -2.86 -1.56 1 76 ILE -2.16 -1.51 1 77 GLU -5.64 -2.18 1 78 VAL -2.78 0.95 1 79 GLU 2.13 -0.98 1 80 THR 0.29 -2.38 1 81 VAL -3.33 -2.67 1 82 ALA -4.77 -2.69 1 83 LYS 2.27 -0.56 1 84 GLU -4.27 -3.66 1 85 TRP -6.70 1.92 1 86 ARG -3.99 -3.03 1 87 ILE -0.75 -0.54 1 88 ARG -5.26 -0.97 1 89 LEU -2.25 -0.75 1 92 LYS -2.01 0.45 1 93 VAL -5.34 -4.33 1 94 VAL -4.32 -0.45 1 96 VAL -4.73 -1.77 1 97 ARG -4.46 -2.57 1 98 ASN -3.31 0.56 1 99 ASN 0.20 0.01 1 100 ASN -0.90 -2.16 1 101 PHE -0.43 -1.34 1 102 ALA -0.93 -2.02 1 105 ALA 0.17 0.52 1 107 ALA -0.61 0.02 1 108 VAL -0.12 -0.18 1 109 ALA -0.51 0.15 1 110 THR 0.01 0.61 1 112 THR -0.18 -0.41 1 113 ALA -0.78 -0.37 1 114 SER -0.22 0.07 1 116 ASP -0.01 0.18 1 117 VAL 0.42 -0.11 1 118 ARG 0.36 -0.02 1 119 ARG 0.13 -0.09 1 120 VAL 0.05 -0.32 1 121 GLN -0.34 -0.28 1 122 ILE 0.27 0.32 1 124 GLU -1.18 -0.44 1 125 ASP -0.02 -1.19 1 stop_ save_