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 bmr16052_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 -2.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 7.74 _LACS_plot.Line_2_terminator_val_y_2 6.15 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 ARG 6.82 1.92 0 85 MET -7.49 -0.87 0 10 ALA 0.33 0.67 1 11 LYS -0.23 0.01 1 12 ARG 0.43 0.44 1 13 VAL -0.75 -0.13 1 16 LEU -1.63 -1.25 1 17 VAL -2.64 -0.76 1 18 VAL -1.16 -1.07 1 19 TYR -6.54 -0.77 1 20 ARG -4.53 -1.31 1 21 TYR -1.26 0.13 1 22 ASP 1.49 1.37 1 23 ALA -2.13 -0.06 1 25 LEU -0.10 0.24 1 27 PHE 4.51 3.50 1 28 ALA 1.82 1.74 1 29 ASN -1.64 -0.71 1 30 ALA 4.34 4.21 1 31 GLU 3.63 2.93 1 32 ASP 2.76 4.12 1 33 PHE 4.41 3.05 1 34 ARG 4.46 4.32 1 35 ARG 4.18 3.82 1 36 ARG 4.87 4.38 1 37 ALA 2.84 2.85 1 38 LEU 3.72 2.26 1 39 THR 6.59 5.71 1 40 VAL 6.09 4.70 1 41 VAL 5.82 4.57 1 42 ASP 3.39 2.95 1 43 GLN 1.30 0.80 1 44 ASP -0.83 1.31 1 47 GLN -0.46 -0.35 1 48 VAL 2.75 2.51 1 49 GLU -1.51 1.63 1 50 TRP -6.68 -1.10 1 51 PHE -5.64 -1.37 1 52 VAL -2.81 -2.22 1 53 LEU -4.31 -1.35 1 54 ASN 0.90 -0.43 1 55 ALA -0.63 -0.58 1 56 GLU 2.69 2.88 1 57 SER 0.47 0.79 1 58 ASN 0.04 1.32 1 59 VAL 0.43 0.64 1 60 GLU -1.32 -0.19 1 61 VAL -1.96 -0.90 1 62 ASP -2.45 -1.01 1 63 LEU -1.94 -1.99 1 64 THR 5.86 4.72 1 65 ALA 2.85 2.58 1 66 LEU 4.54 3.35 1 67 ASP 3.40 3.67 1 68 ALA 3.36 3.19 1 69 LEU 3.47 3.50 1 70 ASP 2.36 3.75 1 71 GLN 4.57 3.86 1 72 LEU 3.85 3.13 1 73 ARG 6.18 4.58 1 74 THR 6.44 5.49 1 75 GLU 3.66 2.85 1 76 LEU 5.65 3.31 1 77 LEU 4.03 3.65 1 78 ARG 4.39 3.68 1 79 ARG -0.78 0.21 1 81 ILE -1.51 0.10 1 82 VAL 1.02 1.42 1 83 PHE -3.17 -0.94 1 84 ALA -7.01 -2.69 1 86 ALA -7.69 -2.86 1 88 VAL 0.99 0.07 1 89 LYS -0.09 0.24 1 90 GLN 5.37 4.34 1 91 ASP 4.14 3.44 1 92 LEU 4.55 2.58 1 93 ARG 5.98 5.29 1 94 GLU 3.49 2.47 1 95 SER 2.48 0.47 1 96 LEU 3.41 3.21 1 97 ARG 4.42 3.72 1 98 ALA 3.46 2.65 1 99 ALA -1.25 -0.25 1 100 SER 4.34 2.28 1 101 LEU 3.29 0.37 1 102 LEU 4.62 4.09 1 103 ASP 2.74 2.34 1 104 LYS 2.54 2.81 1 105 ILE 2.48 3.87 1 107 GLU 4.09 3.73 1 108 ASP 2.47 0.31 1 109 HIS 0.08 0.06 1 110 ILE -0.77 -1.20 1 111 PHE -4.20 -0.85 1 112 MET 2.30 3.15 1 113 THR -6.41 -3.19 1 114 LEU 7.75 5.50 1 116 THR 5.27 4.51 1 117 ALA 2.38 2.21 1 118 VAL 6.10 4.84 1 119 GLN 4.27 3.53 1 120 ALA 2.66 2.98 1 121 PHE 4.36 3.42 1 122 ARG 4.51 3.72 1 123 ARG 0.72 0.19 1 124 ARG 4.35 2.29 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16052_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 5.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.83 _LACS_plot.Line_2_terminator_val_x_2 7.74 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 ARG 6.82 -4.90 0 85 MET -7.49 6.62 0 10 ALA 0.33 0.34 1 11 LYS -0.23 0.24 1 12 ARG 0.43 0.01 1 13 VAL -0.75 0.62 1 16 LEU -1.63 0.38 1 17 VAL -2.64 1.88 1 18 VAL -1.16 0.09 1 19 TYR -6.54 5.77 1 20 ARG -4.53 3.22 1 21 TYR -1.26 1.39 1 22 ASP 1.49 -0.12 1 23 ALA -2.13 2.07 1 25 LEU -0.10 0.34 1 27 PHE 4.51 -1.01 1 28 ALA 1.82 -0.08 1 29 ASN -1.64 0.93 1 30 ALA 4.34 -0.13 1 31 GLU 3.63 -0.70 1 32 ASP 2.76 1.36 1 33 PHE 4.41 -1.36 1 34 ARG 4.46 -0.14 1 35 ARG 4.18 -0.36 1 36 ARG 4.87 -0.49 1 37 ALA 2.84 0.01 1 38 LEU 3.72 -1.46 1 39 THR 6.59 -0.88 1 40 VAL 6.09 -1.39 1 41 VAL 5.82 -1.25 1 42 ASP 3.39 -0.44 1 43 GLN 1.30 -0.50 1 44 ASP -0.83 2.14 1 47 GLN -0.46 0.11 1 48 VAL 2.75 -0.24 1 49 GLU -1.51 3.14 1 50 TRP -6.68 5.58 1 51 PHE -5.64 4.27 1 52 VAL -2.81 0.59 1 53 LEU -4.31 2.96 1 54 ASN 0.90 -1.33 1 55 ALA -0.63 0.05 1 56 GLU 2.69 0.19 1 57 SER 0.47 0.32 1 58 ASN 0.04 1.28 1 59 VAL 0.43 0.21 1 60 GLU -1.32 1.13 1 61 VAL -1.96 1.06 1 62 ASP -2.45 1.44 1 63 LEU -1.94 -0.05 1 64 THR 5.86 -1.14 1 65 ALA 2.85 -0.27 1 66 LEU 4.54 -1.19 1 67 ASP 3.40 0.27 1 68 ALA 3.36 -0.17 1 69 LEU 3.47 0.03 1 70 ASP 2.36 1.39 1 71 GLN 4.57 -0.71 1 72 LEU 3.85 -0.72 1 73 ARG 6.18 -1.60 1 74 THR 6.44 -0.95 1 75 GLU 3.66 -0.81 1 76 LEU 5.65 -2.34 1 77 LEU 4.03 -0.38 1 78 ARG 4.39 -0.71 1 79 ARG -0.78 0.99 1 81 ILE -1.51 1.61 1 82 VAL 1.02 0.40 1 83 PHE -3.17 2.23 1 84 ALA -7.01 4.32 1 86 ALA -7.69 4.83 1 88 VAL 0.99 -0.92 1 89 LYS -0.09 0.33 1 90 GLN 5.37 -1.03 1 91 ASP 4.14 -0.70 1 92 LEU 4.55 -1.97 1 93 ARG 5.98 -0.69 1 94 GLU 3.49 -1.02 1 95 SER 2.48 -2.01 1 96 LEU 3.41 -0.20 1 97 ARG 4.42 -0.70 1 98 ALA 3.46 -0.81 1 99 ALA -1.25 1.00 1 100 SER 4.34 -2.06 1 101 LEU 3.29 -2.92 1 102 LEU 4.62 -0.53 1 103 ASP 2.74 -0.40 1 104 LYS 2.54 0.27 1 105 ILE 2.48 1.39 1 107 GLU 4.09 -0.36 1 108 ASP 2.47 -2.16 1 109 HIS 0.08 -0.02 1 110 ILE -0.77 -0.43 1 111 PHE -4.20 3.35 1 112 MET 2.30 0.85 1 113 THR -6.41 3.22 1 114 LEU 7.75 -2.25 1 116 THR 5.27 -0.76 1 117 ALA 2.38 -0.17 1 118 VAL 6.10 -1.26 1 119 GLN 4.27 -0.74 1 120 ALA 2.66 0.32 1 121 PHE 4.36 -0.94 1 122 ARG 4.51 -0.79 1 123 ARG 0.72 -0.53 1 124 ARG 4.35 -2.06 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16052_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 0.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.12 _LACS_plot.Line_2_terminator_val_x_2 7.74 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 117 ALA 2.38 -1.93 0 10 ALA 0.33 -0.13 1 11 LYS -0.23 -0.07 1 12 ARG 0.43 -0.16 1 13 VAL -0.75 -0.04 1 16 LEU -1.63 0.38 1 17 VAL -2.64 0.20 1 18 VAL -1.16 0.55 1 19 TYR -6.54 0.27 1 20 ARG -4.53 0.13 1 21 TYR -1.26 -0.07 1 22 ASP 1.49 -0.37 1 23 ALA -2.13 -0.01 1 25 LEU -0.10 0.14 1 27 PHE 4.51 -0.50 1 28 ALA 1.82 -0.35 1 29 ASN -1.64 0.34 1 30 ALA 4.34 -0.48 1 31 GLU 3.63 -0.27 1 32 ASP 2.76 -0.33 1 33 PHE 4.41 -0.77 1 34 ARG 4.46 -1.19 1 35 ARG 4.18 -0.52 1 36 ARG 4.87 -0.47 1 37 ALA 2.84 -1.31 1 38 LEU 3.72 -0.61 1 39 THR 6.59 -0.44 1 40 VAL 6.09 -0.41 1 41 VAL 5.82 -0.41 1 42 ASP 3.39 -0.23 1 43 GLN 1.30 -0.13 1 44 ASP -0.83 -0.51 1 47 GLN -0.46 0.14 1 48 VAL 2.75 -0.45 1 49 GLU -1.51 0.53 1 50 TRP -6.68 0.93 1 51 PHE -5.64 0.38 1 52 VAL -2.81 0.23 1 53 LEU -4.31 0.54 1 54 ASN 0.90 -0.18 1 55 ALA -0.63 0.25 1 56 GLU 2.69 -0.05 1 57 SER 0.47 -0.04 1 58 ASN 0.04 0.07 1 59 VAL 0.43 0.01 1 60 GLU -1.32 0.03 1 61 VAL -1.96 0.38 1 62 ASP -2.45 0.03 1 63 LEU -1.94 -0.26 1 64 THR 5.86 -0.24 1 65 ALA 2.85 -0.44 1 66 LEU 4.54 -0.51 1 67 ASP 3.40 -0.22 1 68 ALA 3.36 -0.25 1 69 LEU 3.47 -0.43 1 70 ASP 2.36 -0.43 1 71 GLN 4.57 -0.42 1 72 LEU 3.85 -0.54 1 73 ARG 6.18 -0.12 1 74 THR 6.44 -0.66 1 75 GLU 3.66 -0.27 1 76 LEU 5.65 -0.54 1 77 LEU 4.03 -0.21 1 78 ARG 4.39 -0.28 1 79 ARG -0.78 -0.04 1 81 ILE -1.51 -0.04 1 82 VAL 1.02 -0.56 1 83 PHE -3.17 0.62 1 84 ALA -7.01 0.50 1 85 MET -7.49 0.79 1 86 ALA -7.69 1.32 1 87 ARG 6.82 -0.58 1 88 VAL 0.99 -0.35 1 89 LYS -0.09 -0.50 1 90 GLN 5.37 -0.41 1 91 ASP 4.14 -0.29 1 92 LEU 4.55 -0.11 1 93 ARG 5.98 -0.78 1 94 GLU 3.49 -0.14 1 95 SER 2.48 -0.51 1 96 LEU 3.41 -0.46 1 97 ARG 4.42 -0.33 1 98 ALA 3.46 -0.20 1 99 ALA -1.25 0.14 1 100 SER 4.34 -0.15 1 101 LEU 3.29 0.00 1 102 LEU 4.62 -0.63 1 103 ASP 2.74 -0.28 1 104 LYS 2.54 -0.30 1 105 ILE 2.48 -0.42 1 107 GLU 4.09 -0.65 1 108 ASP 2.47 -0.43 1 109 HIS 0.08 -0.32 1 110 ILE -0.77 0.25 1 111 PHE -4.20 0.36 1 112 MET 2.30 -0.11 1 113 THR -6.41 0.47 1 114 LEU 7.75 -0.11 1 116 THR 5.27 -0.37 1 118 VAL 6.10 -0.96 1 119 GLN 4.27 -0.45 1 120 ALA 2.66 -0.36 1 121 PHE 4.36 -0.50 1 122 ARG 4.51 -0.88 1 123 ARG 0.72 -0.14 1 124 ARG 4.35 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16052_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 -3.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 6.82 _LACS_plot.Line_2_terminator_val_y_2 2.56 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 ARG 6.82 -2.39 0 10 ALA 0.33 -0.27 1 11 LYS -0.23 -0.63 1 12 ARG 0.43 -0.59 1 13 VAL -0.75 -1.69 1 16 LEU -1.63 -2.05 1 17 VAL -2.64 -2.92 1 18 VAL -1.16 -1.47 1 19 TYR -6.54 -3.98 1 20 ARG -4.53 -2.94 1 21 TYR -1.26 -0.42 1 22 ASP 1.49 -2.09 1 23 ALA -2.13 -2.22 1 25 LEU -0.10 -1.75 1 27 PHE 4.51 0.77 1 28 ALA 1.82 0.38 1 29 ASN -1.64 0.76 1 30 ALA 4.34 1.10 1 31 GLU 3.63 1.59 1 32 ASP 2.76 0.77 1 33 PHE 4.41 0.01 1 34 ARG 4.46 0.85 1 35 ARG 4.18 4.14 1 36 ARG 4.87 2.67 1 37 ALA 2.84 0.91 1 38 LEU 3.72 1.45 1 39 THR 6.59 1.25 1 40 VAL 6.09 2.57 1 41 VAL 5.82 1.59 1 42 ASP 3.39 1.46 1 43 GLN 1.30 -0.04 1 44 ASP -0.83 -0.10 1 47 GLN -0.46 -0.19 1 48 VAL 2.75 -1.34 1 49 GLU -1.51 0.12 1 50 TRP -6.68 -3.40 1 51 PHE -5.64 -2.84 1 52 VAL -2.81 -2.65 1 53 LEU -4.31 -2.03 1 54 ASN 0.90 -0.34 1 55 ALA -0.63 -0.46 1 56 GLU 2.69 -0.28 1 58 ASN 0.04 -1.43 1 59 VAL 0.43 0.83 1 60 GLU -1.32 -1.21 1 61 VAL -1.96 0.06 1 62 ASP -2.45 -0.27 1 63 LEU -1.94 2.13 1 64 THR 5.86 2.27 1 65 ALA 2.85 0.97 1 66 LEU 4.54 1.24 1 67 ASP 3.40 1.96 1 68 ALA 3.36 2.26 1 69 LEU 3.47 0.65 1 70 ASP 2.36 2.35 1 71 GLN 4.57 3.48 1 72 LEU 3.85 -0.62 1 73 ARG 6.18 2.00 1 74 THR 6.44 0.05 1 75 GLU 3.66 2.36 1 76 LEU 5.65 1.69 1 77 LEU 4.03 4.34 1 78 ARG 4.39 1.59 1 79 ARG -0.78 -0.29 1 81 ILE -1.51 -1.59 1 82 VAL 1.02 -2.70 1 83 PHE -3.17 -3.72 1 84 ALA -7.01 -3.02 1 85 MET -7.49 -2.75 1 86 ALA -7.69 -2.02 1 88 VAL 0.99 -0.15 1 90 GLN 5.37 1.60 1 91 ASP 4.14 2.51 1 92 LEU 4.55 0.59 1 93 ARG 5.98 1.88 1 94 GLU 3.49 1.53 1 95 SER 2.48 2.55 1 96 LEU 3.41 1.87 1 97 ARG 4.42 3.93 1 98 ALA 3.46 0.73 1 99 ALA -1.25 -1.21 1 100 SER 4.34 3.54 1 101 LEU 3.29 0.78 1 102 LEU 4.62 0.19 1 103 ASP 2.74 1.09 1 104 LYS 2.54 1.28 1 105 ILE 2.48 0.88 1 107 GLU 4.09 0.73 1 108 ASP 2.47 -0.70 1 109 HIS 0.08 -2.90 1 110 ILE -0.77 -1.81 1 112 MET 2.30 0.21 1 113 THR -6.41 -1.29 1 116 THR 5.27 1.83 1 117 ALA 2.38 0.33 1 118 VAL 6.10 1.69 1 119 GLN 4.27 2.11 1 120 ALA 2.66 2.42 1 121 PHE 4.36 3.16 1 122 ARG 4.51 1.44 1 123 ARG 0.72 0.87 1 124 ARG 4.35 -0.16 1 stop_ save_