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 bmr11427_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.38 _LACS_plot.Line_1_terminator_val_y_1 -3.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 3.92 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 28 ILE 1.23 -2.09 0 98 ILE -0.49 -3.29 0 10 LEU -1.59 -0.82 1 11 LEU -4.06 -1.49 1 12 LEU -5.52 -2.59 1 13 GLU -3.77 -2.24 1 14 VAL -3.68 -2.86 1 15 ASN 1.42 -0.04 1 16 THR 2.65 2.51 1 17 LYS 1.01 0.61 1 18 THR -0.23 -0.43 1 19 THR 2.12 1.61 1 20 LYS -1.28 -0.76 1 21 LEU 6.01 3.33 1 22 ARG 4.66 3.55 1 23 GLU 2.52 2.26 1 24 VAL 4.97 3.70 1 25 ILE 5.77 2.97 1 26 GLU 3.10 2.88 1 27 LYS 3.08 2.68 1 29 ILE 6.07 4.26 1 30 LYS 3.82 2.54 1 31 SER 4.24 3.16 1 32 LYS 2.81 1.78 1 33 LEU 2.08 -0.09 1 35 MET 1.03 0.18 1 36 ASN 0.51 1.56 1 37 LEU -2.15 -1.25 1 39 LEU -1.74 -0.48 1 40 VAL -1.33 -1.00 1 41 MET -5.21 -1.38 1 42 ILE -0.42 -0.85 1 44 SER -0.05 -0.38 1 45 THR 1.19 0.73 1 46 LEU 0.80 0.73 1 47 VAL -1.69 -1.33 1 48 PHE 0.36 3.02 1 49 GLU -4.38 -1.75 1 50 ASP -3.87 -1.76 1 52 GLU -0.35 -0.14 1 54 LEU -0.93 -0.81 1 55 GLU -0.36 -0.52 1 56 GLU 3.52 3.19 1 57 ASP 4.00 2.35 1 58 GLU 2.32 1.63 1 59 ALA 3.59 2.34 1 60 ALA 3.43 2.03 1 61 ASN 3.70 2.71 1 62 TYR 3.61 1.08 1 63 ALA 4.12 2.50 1 64 LEU 3.28 2.19 1 65 ASN 4.24 2.07 1 66 LEU 2.41 2.57 1 67 GLU -2.20 -2.19 1 68 LYS -0.96 -0.72 1 69 VAL -0.91 -1.66 1 70 LEU 5.33 2.72 1 71 ALA 1.33 1.25 1 72 GLU -1.90 -2.17 1 73 LEU 1.00 1.23 1 75 ALA -3.12 -2.00 1 77 VAL 2.12 -0.32 1 78 VAL -6.38 -4.35 1 79 ASN 3.06 3.42 1 80 ASP 4.64 2.21 1 81 THR 3.06 2.76 1 82 LYS -2.14 -1.47 1 83 LEU -3.66 -1.78 1 84 THR 0.26 0.41 1 85 VAL -3.62 -2.75 1 86 GLU -6.21 -2.51 1 87 ASP -3.95 -1.36 1 88 PHE 2.69 2.00 1 89 GLN 3.13 2.23 1 90 GLN -1.11 -0.24 1 91 GLU 3.06 0.14 1 92 LEU -5.84 -1.86 1 93 SER -2.73 -1.63 1 95 SER -2.52 -1.55 1 96 ILE -3.91 -1.24 1 97 ASN -1.18 -0.59 1 99 LYS -4.93 -2.98 1 100 HIS -0.61 2.19 1 101 ARG -4.06 -1.57 1 102 ASP 0.00 1.33 1 103 GLU -3.63 -1.31 1 104 PHE -3.28 -1.12 1 105 ASP -2.58 -0.70 1 106 GLU 2.75 2.43 1 107 GLU 0.72 1.08 1 108 LYS -0.16 0.71 1 109 GLU -0.83 -1.02 1 111 ASP 0.81 0.59 1 113 MET -4.74 -1.42 1 114 VAL -3.44 -0.31 1 115 LEU -4.09 -2.18 1 116 SER -1.62 -0.56 1 118 TRP -2.72 -1.41 1 119 SER -0.85 -0.86 1 120 ALA 0.38 1.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11427_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.38 _LACS_plot.Line_1_terminator_val_y_1 3.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.84 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 -2.14 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 28 ILE 1.23 -3.32 0 98 ILE -0.49 -2.80 0 10 LEU -1.59 0.77 1 11 LEU -4.06 2.57 1 12 LEU -5.52 2.93 1 13 GLU -3.77 1.53 1 14 VAL -3.68 0.82 1 15 ASN 1.42 -1.46 1 16 THR 2.65 -0.14 1 17 LYS 1.01 -0.40 1 18 THR -0.23 -0.20 1 19 THR 2.12 -0.51 1 20 LYS -1.28 0.52 1 21 LEU 6.01 -2.68 1 22 ARG 4.66 -1.11 1 23 GLU 2.52 -0.26 1 24 VAL 4.97 -1.27 1 25 ILE 5.77 -2.80 1 26 GLU 3.10 -0.22 1 27 LYS 3.08 -0.40 1 29 ILE 6.07 -1.81 1 30 LYS 3.82 -1.28 1 31 SER 4.24 -1.08 1 32 LYS 2.81 -1.03 1 33 LEU 2.08 -2.17 1 35 MET 1.03 -0.85 1 36 ASN 0.51 1.05 1 37 LEU -2.15 0.90 1 39 LEU -1.74 1.26 1 40 VAL -1.33 0.33 1 41 MET -5.21 3.83 1 42 ILE -0.42 -0.43 1 44 SER -0.05 -0.33 1 45 THR 1.19 -0.46 1 46 LEU 0.80 -0.07 1 47 VAL -1.69 0.36 1 48 PHE 0.36 2.66 1 49 GLU -4.38 2.63 1 50 ASP -3.87 2.11 1 52 GLU -0.35 0.21 1 54 LEU -0.93 0.12 1 55 GLU -0.36 -0.16 1 56 GLU 3.52 -0.33 1 57 ASP 4.00 -1.65 1 58 GLU 2.32 -0.69 1 59 ALA 3.59 -1.25 1 60 ALA 3.43 -1.40 1 61 ASN 3.70 -0.99 1 62 TYR 3.61 -2.53 1 63 ALA 4.12 -1.62 1 64 LEU 3.28 -1.09 1 65 ASN 4.24 -2.17 1 66 LEU 2.41 0.16 1 67 GLU -2.20 0.01 1 68 LYS -0.96 0.24 1 69 VAL -0.91 -0.75 1 70 LEU 5.33 -2.61 1 71 ALA 1.33 -0.08 1 72 GLU -1.90 -0.27 1 73 LEU 1.00 0.23 1 75 ALA -3.12 1.12 1 77 VAL 2.12 -2.44 1 78 VAL -6.38 2.03 1 79 ASN 3.06 0.36 1 80 ASP 4.64 -2.43 1 81 THR 3.06 -0.30 1 82 LYS -2.14 0.67 1 83 LEU -3.66 1.88 1 84 THR 0.26 0.15 1 85 VAL -3.62 0.87 1 86 GLU -6.21 3.70 1 87 ASP -3.95 2.59 1 88 PHE 2.69 -0.69 1 89 GLN 3.13 -0.90 1 90 GLN -1.11 0.87 1 91 GLU 3.06 -2.92 1 92 LEU -5.84 3.98 1 93 SER -2.73 1.10 1 95 SER -2.52 0.97 1 96 ILE -3.91 2.67 1 97 ASN -1.18 0.59 1 99 LYS -4.93 1.95 1 100 HIS -0.61 2.80 1 101 ARG -4.06 2.49 1 102 ASP 0.00 1.33 1 103 GLU -3.63 2.32 1 104 PHE -3.28 2.16 1 105 ASP -2.58 1.88 1 106 GLU 2.75 -0.32 1 107 GLU 0.72 0.36 1 108 LYS -0.16 0.87 1 109 GLU -0.83 -0.19 1 111 ASP 0.81 -0.22 1 113 MET -4.74 3.32 1 114 VAL -3.44 3.13 1 115 LEU -4.09 1.91 1 116 SER -1.62 1.06 1 118 TRP -2.72 1.31 1 119 SER -0.85 -0.01 1 120 ALA 0.38 0.62 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11427_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.38 _LACS_plot.Line_1_terminator_val_y_1 0.71 _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 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _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 48 PHE 0.36 -0.86 0 13 GLU -3.77 1.35 0 10 LEU -1.59 0.37 1 11 LEU -4.06 0.82 1 12 LEU -5.52 0.95 1 14 VAL -3.68 0.46 1 15 ASN 1.42 0.19 1 16 THR 2.65 -0.26 1 17 LYS 1.01 0.01 1 18 THR -0.23 0.26 1 19 THR 2.12 -0.02 1 20 LYS -1.28 0.34 1 21 LEU 6.01 -0.45 1 22 ARG 4.66 -0.77 1 23 GLU 2.52 -0.25 1 24 VAL 4.97 -0.71 1 25 ILE 5.77 -0.77 1 26 GLU 3.10 -0.47 1 27 LYS 3.08 -0.20 1 28 ILE 1.23 0.02 1 29 ILE 6.07 -0.82 1 30 LYS 3.82 0.00 1 31 SER 4.24 -0.28 1 32 LYS 2.81 0.06 1 33 LEU 2.08 -0.34 1 35 MET 1.03 -0.30 1 36 ASN 0.51 -0.16 1 37 LEU -2.15 0.08 1 39 LEU -1.74 0.57 1 40 VAL -1.33 0.66 1 41 MET -5.21 0.81 1 42 ILE -0.42 0.32 1 44 SER -0.05 0.15 1 45 THR 1.19 -0.05 1 46 LEU 0.80 0.12 1 47 VAL -1.69 0.46 1 49 GLU -4.38 -0.14 1 50 ASP -3.87 -0.18 1 52 GLU -0.35 -0.06 1 54 LEU -0.93 -0.01 1 55 GLU -0.36 -0.09 1 56 GLU 3.52 -0.41 1 57 ASP 4.00 -0.28 1 58 GLU 2.32 -0.48 1 59 ALA 3.59 -0.28 1 60 ALA 3.43 -0.14 1 61 ASN 3.70 -0.28 1 62 TYR 3.61 0.20 1 63 ALA 4.12 -0.03 1 64 LEU 3.28 -0.15 1 65 ASN 4.24 -0.38 1 66 LEU 2.41 -0.57 1 67 GLU -2.20 0.07 1 68 LYS -0.96 0.12 1 69 VAL -0.91 0.45 1 70 LEU 5.33 -0.49 1 71 ALA 1.33 -0.24 1 72 GLU -1.90 0.15 1 73 LEU 1.00 -0.51 1 75 ALA -3.12 0.25 1 77 VAL 2.12 0.00 1 78 VAL -6.38 0.55 1 79 ASN 3.06 -0.50 1 80 ASP 4.64 -0.12 1 81 THR 3.06 -0.17 1 82 LYS -2.14 0.83 1 83 LEU -3.66 0.60 1 84 THR 0.26 0.47 1 85 VAL -3.62 1.20 1 86 GLU -6.21 0.65 1 87 ASP -3.95 0.35 1 88 PHE 2.69 -0.17 1 89 GLN 3.13 -0.19 1 90 GLN -1.11 -0.06 1 91 GLU 3.06 -0.41 1 92 LEU -5.84 0.53 1 93 SER -2.73 0.72 1 95 SER -2.52 0.93 1 96 ILE -3.91 0.15 1 97 ASN -1.18 0.39 1 98 ILE -0.49 0.53 1 99 LYS -4.93 0.64 1 100 HIS -0.61 0.58 1 101 ARG -4.06 -0.27 1 102 ASP 0.00 0.04 1 103 GLU -3.63 0.30 1 104 PHE -3.28 -0.32 1 105 ASP -2.58 -0.05 1 106 GLU 2.75 -0.38 1 107 GLU 0.72 -0.13 1 108 LYS -0.16 -0.06 1 109 GLU -0.83 0.23 1 111 ASP 0.81 -0.07 1 113 MET -4.74 -0.04 1 114 VAL -3.44 0.27 1 115 LEU -4.09 1.09 1 116 SER -1.62 0.45 1 118 TRP -2.72 0.12 1 119 SER -0.85 -0.27 1 120 ALA 0.38 -0.39 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11427_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.38 _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 0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 1.75 _LACS_plot.Y_axis_chem_shift_offset 0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 PHE 0.36 -5.05 0 120 ALA 0.38 4.32 0 10 LEU -1.59 -2.65 1 11 LEU -4.06 -3.69 1 12 LEU -5.52 -3.61 1 13 GLU -3.77 -1.05 1 14 VAL -3.68 -4.84 1 15 ASN 1.42 2.34 1 16 THR 2.65 -1.73 1 17 LYS 1.01 1.00 1 18 THR -0.23 0.00 1 19 THR 2.12 -1.76 1 20 LYS -1.28 1.94 1 21 LEU 6.01 0.72 1 22 ARG 4.66 0.08 1 23 GLU 2.52 1.95 1 24 VAL 4.97 2.07 1 25 ILE 5.77 -0.43 1 26 GLU 3.10 2.05 1 27 LYS 3.08 0.38 1 28 ILE 1.23 -0.40 1 29 ILE 6.07 -1.26 1 30 LYS 3.82 2.43 1 31 SER 4.24 0.57 1 32 LYS 2.81 0.75 1 33 LEU 2.08 -0.38 1 35 MET 1.03 -2.61 1 36 ASN 0.51 -0.58 1 39 LEU -1.74 -1.53 1 40 VAL -1.33 -2.37 1 41 MET -5.21 -2.51 1 42 ILE -0.42 0.47 1 44 SER -0.05 -0.75 1 45 THR 1.19 -1.69 1 46 LEU 0.80 -1.03 1 47 VAL -1.69 -2.00 1 49 GLU -4.38 -4.90 1 50 ASP -3.87 -1.11 1 52 GLU -0.35 0.51 1 54 LEU -0.93 0.14 1 55 GLU -0.36 0.74 1 56 GLU 3.52 1.87 1 57 ASP 4.00 1.80 1 58 GLU 2.32 0.70 1 59 ALA 3.59 2.44 1 60 ALA 3.43 2.12 1 61 ASN 3.70 2.41 1 62 TYR 3.61 1.72 1 63 ALA 4.12 3.31 1 64 LEU 3.28 2.82 1 65 ASN 4.24 1.98 1 66 LEU 2.41 -0.42 1 67 GLU -2.20 -0.87 1 68 LYS -0.96 0.00 1 69 VAL -0.91 1.77 1 70 LEU 5.33 1.19 1 71 ALA 1.33 -0.98 1 72 GLU -1.90 -1.13 1 73 LEU 1.00 -1.41 1 75 ALA -3.12 -3.52 1 77 VAL 2.12 -3.23 1 78 VAL -6.38 -0.92 1 79 ASN 3.06 0.05 1 80 ASP 4.64 -0.59 1 81 THR 3.06 -2.92 1 82 LYS -2.14 -0.86 1 83 LEU -3.66 -1.44 1 84 THR 0.26 -2.01 1 85 VAL -3.62 -2.39 1 86 GLU -6.21 -2.71 1 87 ASP -3.95 0.62 1 88 PHE 2.69 1.72 1 89 GLN 3.13 1.25 1 90 GLN -1.11 -1.26 1 91 GLU 3.06 -1.93 1 92 LEU -5.84 -2.39 1 93 SER -2.73 -1.52 1 95 SER -2.52 -1.61 1 96 ILE -3.91 -2.07 1 97 ASN -1.18 -1.70 1 98 ILE -0.49 -0.71 1 99 LYS -4.93 -1.78 1 100 HIS -0.61 0.94 1 101 ARG -4.06 -3.55 1 102 ASP 0.00 -0.13 1 103 GLU -3.63 -3.03 1 104 PHE -3.28 -1.68 1 105 ASP -2.58 -0.09 1 106 GLU 2.75 -0.13 1 107 GLU 0.72 1.24 1 108 LYS -0.16 0.19 1 109 GLU -0.83 -0.39 1 111 ASP 0.81 0.56 1 113 MET -4.74 -1.58 1 114 VAL -3.44 -2.54 1 115 LEU -4.09 -2.21 1 116 SER -1.62 -1.37 1 118 TRP -2.72 -1.14 1 119 SER -0.85 -2.62 1 stop_ save_