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 bmr15611_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 -2.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.14 _LACS_plot.Line_2_terminator_val_x_2 6.71 _LACS_plot.Line_2_terminator_val_y_2 3.49 _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 86 GLU 6.39 4.66 0 54 LEU 6.71 4.99 0 10 LEU 4.43 3.47 1 11 ASP 2.13 1.29 1 12 ASP 1.67 1.47 1 13 ILE 0.13 -0.78 1 14 LEU 1.56 0.52 1 17 THR -4.02 -1.08 1 19 VAL -6.07 -3.18 1 21 ALA -4.95 -2.25 1 22 LEU -1.90 -1.48 1 23 VAL -1.87 -1.04 1 24 GLU 4.22 1.07 1 25 GLN 3.33 1.41 1 26 GLN -1.71 -1.27 1 27 GLN 0.22 -0.25 1 28 ILE -3.26 -0.75 1 29 ALA -2.69 -1.61 1 30 VAL -1.24 -1.65 1 31 PHE -4.79 -0.52 1 32 ARG -5.05 -1.76 1 34 ARG -4.31 -2.06 1 35 ASN 1.19 -1.36 1 36 ASP -0.36 -1.08 1 37 GLU 0.05 -0.91 1 38 GLN 1.04 0.25 1 39 VAL -6.43 -3.85 1 40 TYR -5.99 -0.89 1 41 ALA -5.80 -1.99 1 42 ILE -7.17 -1.84 1 43 SER -0.11 0.74 1 44 ASN -1.37 0.30 1 45 ILE 0.67 -1.22 1 46 ASP -3.32 -1.66 1 48 PHE 5.28 3.36 1 49 ALA -4.12 -1.03 1 50 GLN 4.43 0.52 1 51 ALA -6.94 -2.15 1 52 SER 0.05 -1.91 1 53 VAL -4.35 -1.22 1 55 SER 5.20 3.35 1 56 ARG -0.07 -0.52 1 58 ILE -1.24 -0.84 1 59 VAL -0.27 -1.02 1 60 ALA -4.96 -1.25 1 61 GLU -2.05 -1.05 1 62 HIS -0.17 2.15 1 63 GLN 4.45 1.45 1 64 ASP 3.47 2.30 1 65 ASP -6.21 -1.08 1 66 LEU -2.68 -0.92 1 67 TRP -4.60 -2.59 1 68 VAL -4.87 -3.73 1 69 ALA -4.03 -3.93 1 70 SER -1.74 -1.00 1 72 LEU 4.16 0.42 1 73 LYS 1.47 -1.01 1 74 LYS 6.23 1.41 1 75 GLN 5.97 2.78 1 76 HIS -0.69 1.32 1 77 PHE -2.50 -1.54 1 78 ARG 1.85 1.72 1 79 LEU 5.73 2.78 1 80 TYR 2.51 1.20 1 81 ASP -1.96 -1.33 1 83 PHE -0.56 0.60 1 85 LEU 2.16 2.45 1 87 ASP 0.44 0.95 1 89 ALA 2.73 1.50 1 90 TYR 0.48 -0.06 1 91 SER 3.02 2.58 1 92 VAL -5.94 -3.04 1 93 ALA -0.02 0.18 1 94 ALA -5.22 -2.48 1 95 TYR -4.19 -1.57 1 96 ASP 0.19 0.62 1 97 THR -6.08 -2.58 1 98 GLN -1.81 -0.91 1 99 VAL -1.56 -1.55 1 100 THR -2.92 -2.51 1 101 ASN 2.42 1.00 1 103 ASN -1.83 -0.59 1 104 VAL 2.44 0.94 1 105 GLN -6.53 -2.25 1 106 ILE -6.05 -2.76 1 107 SER -1.28 -2.33 1 108 ILE -1.56 -1.36 1 109 ALA -0.57 -0.25 1 110 ASP 0.26 0.19 1 111 SER 0.10 0.17 1 112 ASP 0.16 0.09 1 113 VAL 0.05 -0.19 1 114 ALA -0.35 -0.25 1 115 VAL -0.00 -0.12 1 116 ASP -0.23 -0.24 1 117 ASN 0.72 0.44 1 118 SER 0.60 0.56 1 119 GLN -0.33 -0.29 1 121 LEU -0.20 -0.18 1 123 LEU 0.46 0.21 1 124 GLU -0.58 -0.33 1 125 HIS -0.28 0.41 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15611_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 4.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.86 _LACS_plot.Line_2_terminator_val_x_2 6.71 _LACS_plot.Line_2_terminator_val_y_2 -3.22 _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 86 GLU 6.39 -1.73 0 54 LEU 6.71 -1.72 0 10 LEU 4.43 -0.96 1 11 ASP 2.13 -0.84 1 12 ASP 1.67 -0.20 1 13 ILE 0.13 -0.91 1 14 LEU 1.56 -1.04 1 17 THR -4.02 2.94 1 19 VAL -6.07 2.89 1 21 ALA -4.95 2.70 1 22 LEU -1.90 0.42 1 23 VAL -1.87 0.83 1 24 GLU 4.22 -3.15 1 25 GLN 3.33 -1.92 1 26 GLN -1.71 0.44 1 27 GLN 0.22 -0.47 1 28 ILE -3.26 2.51 1 29 ALA -2.69 1.08 1 30 VAL -1.24 -0.41 1 31 PHE -4.79 4.27 1 32 ARG -5.05 3.29 1 34 ARG -4.31 2.25 1 35 ASN 1.19 -2.55 1 36 ASP -0.36 -0.72 1 37 GLU 0.05 -0.96 1 38 GLN 1.04 -0.79 1 39 VAL -6.43 2.58 1 40 TYR -5.99 5.10 1 41 ALA -5.80 3.81 1 42 ILE -7.17 5.33 1 43 SER -0.11 0.85 1 44 ASN -1.37 1.67 1 45 ILE 0.67 -1.89 1 46 ASP -3.32 1.66 1 48 PHE 5.28 -1.92 1 49 ALA -4.12 3.09 1 50 GLN 4.43 -3.91 1 51 ALA -6.94 4.79 1 52 SER 0.05 -1.96 1 53 VAL -4.35 3.13 1 55 SER 5.20 -1.85 1 56 ARG -0.07 -0.45 1 58 ILE -1.24 0.40 1 59 VAL -0.27 -0.75 1 60 ALA -4.96 3.71 1 61 GLU -2.05 1.00 1 62 HIS -0.17 2.32 1 63 GLN 4.45 -3.00 1 64 ASP 3.47 -1.17 1 65 ASP -6.21 5.13 1 66 LEU -2.68 1.76 1 67 TRP -4.60 2.01 1 68 VAL -4.87 1.14 1 69 ALA -4.03 0.10 1 70 SER -1.74 0.74 1 72 LEU 4.16 -3.74 1 73 LYS 1.47 -2.48 1 74 LYS 6.23 -4.82 1 75 GLN 5.97 -3.19 1 76 HIS -0.69 2.01 1 77 PHE -2.50 0.96 1 78 ARG 1.85 -0.13 1 79 LEU 5.73 -2.95 1 80 TYR 2.51 -1.31 1 81 ASP -1.96 0.63 1 83 PHE -0.56 1.16 1 85 LEU 2.16 0.29 1 87 ASP 0.44 0.51 1 89 ALA 2.73 -1.23 1 90 TYR 0.48 -0.54 1 91 SER 3.02 -0.44 1 92 VAL -5.94 2.90 1 93 ALA -0.02 0.20 1 94 ALA -5.22 2.74 1 95 TYR -4.19 2.62 1 96 ASP 0.19 0.43 1 97 THR -6.08 3.50 1 98 GLN -1.81 0.90 1 99 VAL -1.56 0.01 1 100 THR -2.92 0.41 1 101 ASN 2.42 -1.42 1 103 ASN -1.83 1.24 1 104 VAL 2.44 -1.50 1 105 GLN -6.53 4.28 1 106 ILE -6.05 3.29 1 107 SER -1.28 -1.05 1 108 ILE -1.56 0.20 1 109 ALA -0.57 0.32 1 110 ASP 0.26 -0.07 1 111 SER 0.10 0.07 1 112 ASP 0.16 -0.07 1 113 VAL 0.05 -0.24 1 114 ALA -0.35 0.10 1 115 VAL -0.00 -0.12 1 116 ASP -0.23 -0.01 1 117 ASN 0.72 -0.28 1 118 SER 0.60 -0.04 1 119 GLN -0.33 0.04 1 121 LEU -0.20 0.02 1 123 LEU 0.46 -0.25 1 124 GLU -0.58 0.25 1 125 HIS -0.28 0.69 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15611_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 0.89 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.71 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 ALA -5.80 1.97 0 10 LEU 4.43 -0.60 1 11 ASP 2.13 -0.36 1 12 ASP 1.67 -0.12 1 13 ILE 0.13 -0.14 1 14 LEU 1.56 -0.26 1 17 THR -4.02 0.80 1 19 VAL -6.07 0.44 1 21 ALA -4.95 0.28 1 22 LEU -1.90 0.63 1 23 VAL -1.87 -0.01 1 24 GLU 4.22 -0.60 1 25 GLN 3.33 -0.46 1 26 GLN -1.71 0.18 1 27 GLN 0.22 0.28 1 28 ILE -3.26 0.19 1 29 ALA -2.69 0.39 1 30 VAL -1.24 0.74 1 31 PHE -4.79 0.54 1 32 ARG -5.05 0.75 1 34 ARG -4.31 0.44 1 35 ASN 1.19 0.00 1 36 ASP -0.36 -0.02 1 37 GLU 0.05 0.11 1 38 GLN 1.04 -0.16 1 39 VAL -6.43 1.32 1 40 TYR -5.99 0.45 1 42 ILE -7.17 1.37 1 43 SER -0.11 -0.10 1 44 ASN -1.37 0.19 1 45 ILE 0.67 -0.06 1 46 ASP -3.32 -0.51 1 48 PHE 5.28 -0.41 1 49 ALA -4.12 0.04 1 50 GLN 4.43 -0.74 1 51 ALA -6.94 0.49 1 52 SER 0.05 0.06 1 53 VAL -4.35 0.80 1 54 LEU 6.71 -0.43 1 55 SER 5.20 -0.68 1 56 ARG -0.07 0.23 1 58 ILE -1.24 0.16 1 59 VAL -0.27 0.83 1 60 ALA -4.96 0.37 1 61 GLU -2.05 0.80 1 62 HIS -0.17 -0.06 1 63 GLN 4.45 -0.62 1 64 ASP 3.47 -0.42 1 65 ASP -6.21 0.63 1 66 LEU -2.68 0.49 1 67 TRP -4.60 0.51 1 68 VAL -4.87 0.89 1 69 ALA -4.03 0.65 1 70 SER -1.74 -0.33 1 72 LEU 4.16 0.21 1 73 LYS 1.47 0.12 1 74 LYS 6.23 -0.17 1 75 GLN 5.97 -0.68 1 76 HIS -0.69 0.57 1 77 PHE -2.50 0.78 1 78 ARG 1.85 -0.75 1 79 LEU 5.73 -0.59 1 80 TYR 2.51 0.03 1 81 ASP -1.96 -0.15 1 83 PHE -0.56 -0.08 1 85 LEU 2.16 -0.68 1 86 GLU 6.39 -0.64 1 87 ASP 0.44 -0.17 1 89 ALA 2.73 -0.03 1 90 TYR 0.48 -0.31 1 91 SER 3.02 0.24 1 92 VAL -5.94 0.62 1 93 ALA -0.02 -0.33 1 94 ALA -5.22 0.70 1 95 TYR -4.19 0.35 1 96 ASP 0.19 0.36 1 97 THR -6.08 1.49 1 98 GLN -1.81 0.14 1 99 VAL -1.56 0.91 1 100 THR -2.92 0.13 1 101 ASN 2.42 -0.43 1 103 ASN -1.83 0.39 1 104 VAL 2.44 -0.07 1 105 GLN -6.53 1.29 1 106 ILE -6.05 1.28 1 107 SER -1.28 0.03 1 108 ILE -1.56 0.24 1 109 ALA -0.57 -0.09 1 110 ASP 0.26 -0.12 1 111 SER 0.10 -0.09 1 112 ASP 0.16 -0.02 1 113 VAL 0.05 -0.05 1 114 ALA -0.35 0.02 1 115 VAL -0.00 -0.06 1 116 ASP -0.23 -0.03 1 117 ASN 0.72 -0.01 1 118 SER 0.60 -0.11 1 119 GLN -0.33 -0.02 1 121 LEU -0.20 -0.11 1 123 LEU 0.46 -0.12 1 124 GLU -0.58 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15611_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.17 _LACS_plot.Line_1_terminator_val_y_1 -1.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 6.71 _LACS_plot.Line_2_terminator_val_y_2 0.14 _LACS_plot.Y_axis_chem_shift_offset 0.68 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 GLN 5.97 -1.80 0 74 LYS 6.23 -1.73 0 54 LEU 6.71 1.98 0 10 LEU 4.43 -0.13 1 11 ASP 2.13 0.39 1 12 ASP 1.67 -0.59 1 13 ILE 0.13 -2.04 1 17 THR -4.02 -2.23 1 19 VAL -6.07 -3.18 1 21 ALA -4.95 -3.39 1 22 LEU -1.90 -1.16 1 23 VAL -1.87 -1.37 1 25 GLN 3.33 -0.85 1 26 GLN -1.71 -1.21 1 27 GLN 0.22 -0.53 1 28 ILE -3.26 -3.15 1 29 ALA -2.69 -2.55 1 30 VAL -1.24 -1.37 1 31 PHE -4.79 -0.49 1 34 ARG -4.31 -2.05 1 35 ASN 1.19 -0.54 1 36 ASP -0.36 -0.37 1 37 GLU 0.05 -1.45 1 38 GLN 1.04 -1.18 1 39 VAL -6.43 -1.61 1 40 TYR -5.99 -1.92 1 41 ALA -5.80 -1.19 1 42 ILE -7.17 -1.34 1 43 SER -0.11 -2.05 1 44 ASN -1.37 0.70 1 45 ILE 0.67 -1.31 1 48 PHE 5.28 1.57 1 49 ALA -4.12 -0.68 1 50 GLN 4.43 -1.97 1 52 SER 0.05 -0.84 1 53 VAL -4.35 0.52 1 55 SER 5.20 -0.29 1 56 ARG -0.07 1.33 1 58 ILE -1.24 0.04 1 59 VAL -0.27 -0.91 1 60 ALA -4.96 -1.55 1 61 GLU -2.05 -0.16 1 62 HIS -0.17 0.80 1 63 GLN 4.45 -1.21 1 64 ASP 3.47 -2.10 1 65 ASP -6.21 -1.61 1 66 LEU -2.68 -0.72 1 67 TRP -4.60 -1.33 1 68 VAL -4.87 -3.40 1 69 ALA -4.03 0.24 1 72 LEU 4.16 -1.24 1 73 LYS 1.47 -0.29 1 76 HIS -0.69 0.04 1 77 PHE -2.50 -0.90 1 78 ARG 1.85 1.04 1 79 LEU 5.73 0.44 1 80 TYR 2.51 0.25 1 81 ASP -1.96 -0.02 1 83 PHE -0.56 -0.76 1 85 LEU 2.16 0.82 1 86 GLU 6.39 0.85 1 87 ASP 0.44 0.23 1 89 ALA 2.73 0.73 1 90 TYR 0.48 -3.19 1 91 SER 3.02 -0.43 1 92 VAL -5.94 -0.97 1 93 ALA -0.02 -2.65 1 94 ALA -5.22 -1.63 1 95 TYR -4.19 -0.97 1 96 ASP 0.19 -0.59 1 97 THR -6.08 -0.18 1 98 GLN -1.81 -3.24 1 99 VAL -1.56 -0.18 1 100 THR -2.92 -0.39 1 101 ASN 2.42 -0.46 1 103 ASN -1.83 -1.41 1 104 VAL 2.44 -1.48 1 105 GLN -6.53 -1.67 1 106 ILE -6.05 -1.69 1 107 SER -1.28 -0.43 1 108 ILE -1.56 -1.04 1 109 ALA -0.57 -0.46 1 110 ASP 0.26 0.06 1 111 SER 0.10 -0.32 1 112 ASP 0.16 -0.29 1 113 VAL 0.05 -0.59 1 114 ALA -0.35 -0.19 1 115 VAL -0.00 -0.59 1 116 ASP -0.23 -0.26 1 117 ASN 0.72 0.16 1 118 SER 0.60 -0.43 1 123 LEU 0.46 -0.18 1 124 GLU -0.58 -0.48 1 stop_ save_