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 bmr6315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 -2.93 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.89 _LACS_plot.Line_2_terminator_val_x_2 5.74 _LACS_plot.Line_2_terminator_val_y_2 3.90 _LACS_plot.Y_axis_chem_shift_offset 0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 TYR 4.64 -0.57 0 10 TYR -0.27 -0.77 1 11 ASP -1.65 -1.27 1 13 TYR 0.65 -0.69 1 15 GLN 0.86 0.19 1 16 THR 1.32 0.51 1 17 ALA 1.18 0.38 1 18 GLN 1.62 0.56 1 19 LEU 1.35 0.49 1 20 GLN 0.70 -0.04 1 21 GLN 1.40 0.48 1 22 LEU 1.35 0.49 1 23 GLN 1.46 0.63 1 24 GLN 1.46 0.63 1 25 GLN 1.46 0.63 1 26 GLN 1.46 0.63 1 27 GLN 1.46 0.63 1 28 GLN 1.47 0.50 1 29 HIS 0.08 0.18 1 30 ILE -2.27 -1.09 1 33 THR 0.24 -0.45 1 34 GLN -0.09 -0.47 1 35 MET 0.09 -0.42 1 36 ASN -0.77 -0.69 1 38 GLU -1.26 -0.36 1 40 ASP 3.62 2.63 1 41 VAL 2.86 1.17 1 42 LEU 0.46 -0.51 1 43 ARG -1.16 -1.41 1 44 ASN -2.05 -1.12 1 45 LEU -2.20 -1.80 1 46 MET -2.68 -1.23 1 47 VAL -2.52 -2.43 1 48 ASN -5.68 -2.81 1 50 ILE -3.24 -2.41 1 52 THR 4.35 2.73 1 53 THR 1.12 -0.62 1 54 VAL 2.39 0.16 1 55 ASP -3.89 -3.03 1 56 GLU 4.39 3.23 1 57 VAL 5.75 3.86 1 58 GLN 2.90 2.53 1 59 LEU 3.08 2.68 1 60 ARG 5.12 3.91 1 61 GLN 4.35 2.65 1 62 LEU 2.20 1.94 1 63 PHE 3.00 3.06 1 64 GLU 2.97 1.33 1 65 ARG 3.35 1.28 1 66 TYR 2.37 1.23 1 69 ILE -2.41 -0.70 1 70 GLU 0.14 0.91 1 71 SER -2.28 -1.27 1 72 VAL -3.49 -1.97 1 73 LYS -5.00 -2.01 1 74 ILE -0.69 -1.02 1 75 VAL 5.31 1.26 1 77 ASP -1.81 -0.20 1 78 ARG 3.55 2.39 1 79 GLU 1.45 1.42 1 80 THR -0.75 -0.31 1 81 ARG 5.43 1.02 1 82 GLN -1.17 -0.96 1 83 SER -0.26 -0.26 1 84 ARG 0.22 -0.82 1 86 TYR -4.86 -3.56 1 88 PHE -5.56 -2.09 1 89 VAL -3.06 -1.29 1 90 LYS -2.50 -2.28 1 91 PHE -0.46 1.53 1 92 GLN 3.94 2.87 1 93 SER -4.71 -2.88 1 96 SER 4.06 2.96 1 97 ALA 4.01 2.17 1 98 GLN 4.39 2.49 1 99 GLN 3.95 2.26 1 100 ALA 1.57 1.21 1 101 ILE 5.45 4.73 1 102 ALA 3.24 1.53 1 104 LEU -1.50 -0.90 1 105 ASN 3.87 3.00 1 107 PHE -0.40 1.05 1 108 ASN -0.62 -0.70 1 109 ILE -3.67 -2.56 1 110 LEU 4.11 0.42 1 111 ASN 2.31 0.31 1 112 LYS -4.22 -2.49 1 113 ARG -1.84 -2.05 1 114 LEU -0.49 0.15 1 115 LYS -3.90 -1.84 1 116 VAL -2.96 -1.37 1 117 ALA -5.80 -2.26 1 118 LEU 2.19 0.81 1 119 ALA 1.88 0.91 1 120 ALA -0.30 -0.67 1 121 SER 0.04 -0.22 1 129 ALA 0.23 -0.38 1 131 ALA -0.52 -0.76 1 132 VAL 0.34 -0.36 1 134 ASP -0.27 -0.55 1 136 ASN -0.08 -0.42 1 138 TYR -0.43 -0.98 1 139 LEU 0.43 1.25 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 2.87 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.11 _LACS_plot.Line_2_terminator_val_x_2 5.74 _LACS_plot.Line_2_terminator_val_y_2 -1.84 _LACS_plot.Y_axis_chem_shift_offset 0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 TYR 4.64 -5.21 0 10 TYR -0.27 -0.50 1 11 ASP -1.65 0.38 1 13 TYR 0.65 -1.34 1 15 GLN 0.86 -0.67 1 16 THR 1.32 -0.81 1 17 ALA 1.18 -0.80 1 18 GLN 1.62 -1.06 1 19 LEU 1.35 -0.86 1 20 GLN 0.70 -0.74 1 21 GLN 1.40 -0.92 1 22 LEU 1.35 -0.86 1 23 GLN 1.46 -0.83 1 24 GLN 1.46 -0.83 1 25 GLN 1.46 -0.83 1 26 GLN 1.46 -0.83 1 27 GLN 1.46 -0.83 1 28 GLN 1.47 -0.97 1 29 HIS 0.08 0.10 1 30 ILE -2.27 1.18 1 33 THR 0.24 -0.69 1 34 GLN -0.09 -0.38 1 35 MET 0.09 -0.51 1 36 ASN -0.77 0.08 1 38 GLU -1.26 0.90 1 40 ASP 3.62 -0.99 1 41 VAL 2.86 -1.69 1 42 LEU 0.46 -0.97 1 43 ARG -1.16 -0.25 1 44 ASN -2.05 0.93 1 45 LEU -2.20 0.40 1 46 MET -2.68 1.45 1 47 VAL -2.52 0.09 1 48 ASN -5.68 2.87 1 50 ILE -3.24 0.83 1 52 THR 4.35 -1.62 1 53 THR 1.12 -1.74 1 54 VAL 2.39 -2.23 1 55 ASP -3.89 0.86 1 56 GLU 4.39 -1.16 1 57 VAL 5.75 -1.89 1 58 GLN 2.90 -0.37 1 59 LEU 3.08 -0.40 1 60 ARG 5.12 -1.21 1 61 GLN 4.35 -1.70 1 62 LEU 2.20 -0.26 1 63 PHE 3.00 0.06 1 64 GLU 2.97 -1.64 1 65 ARG 3.35 -2.07 1 66 TYR 2.37 -1.14 1 69 ILE -2.41 1.71 1 70 GLU 0.14 0.77 1 71 SER -2.28 1.01 1 72 VAL -3.49 1.52 1 73 LYS -5.00 2.99 1 74 ILE -0.69 -0.33 1 75 VAL 5.31 -4.05 1 77 ASP -1.81 1.61 1 78 ARG 3.55 -1.16 1 79 GLU 1.45 -0.03 1 80 THR -0.75 0.44 1 81 ARG 5.43 -4.41 1 82 GLN -1.17 0.21 1 83 SER -0.26 0.00 1 84 ARG 0.22 -1.04 1 86 TYR -4.86 1.30 1 88 PHE -5.56 3.47 1 89 VAL -3.06 1.77 1 90 LYS -2.50 0.22 1 91 PHE -0.46 1.99 1 92 GLN 3.94 -1.07 1 93 SER -4.71 1.83 1 96 SER 4.06 -1.10 1 97 ALA 4.01 -1.84 1 98 GLN 4.39 -1.90 1 99 GLN 3.95 -1.69 1 100 ALA 1.57 -0.36 1 101 ILE 5.45 -0.72 1 102 ALA 3.24 -1.71 1 104 LEU -1.50 0.60 1 105 ASN 3.87 -0.87 1 107 PHE -0.40 1.45 1 108 ASN -0.62 -0.08 1 109 ILE -3.67 1.11 1 110 LEU 4.11 -3.69 1 111 ASN 2.31 -2.00 1 112 LYS -4.22 1.73 1 113 ARG -1.84 -0.21 1 114 LEU -0.49 0.64 1 115 LYS -3.90 2.06 1 116 VAL -2.96 1.59 1 117 ALA -5.80 3.54 1 118 LEU 2.19 -1.38 1 119 ALA 1.88 -0.97 1 120 ALA -0.30 -0.37 1 121 SER 0.04 -0.26 1 129 ALA 0.23 -0.61 1 131 ALA -0.52 -0.24 1 132 VAL 0.34 -0.70 1 134 ASP -0.27 -0.28 1 136 ASN -0.08 -0.34 1 138 TYR -0.43 -0.55 1 139 LEU 0.43 0.82 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 0.41 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 5.74 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 ALA 1.57 -1.77 0 10 TYR -0.27 -0.04 1 11 ASP -1.65 -0.55 1 13 TYR 0.65 -0.04 1 15 GLN 0.86 0.30 1 16 THR 1.32 -0.18 1 17 ALA 1.18 -0.14 1 18 GLN 1.62 -0.18 1 19 LEU 1.35 -0.16 1 20 GLN 0.70 -0.13 1 21 GLN 1.40 -0.16 1 22 LEU 1.35 -0.16 1 23 GLN 1.46 -0.17 1 24 GLN 1.46 -0.17 1 25 GLN 1.46 -0.17 1 26 GLN 1.46 -0.17 1 27 GLN 1.46 -0.17 1 28 GLN 1.47 -0.13 1 29 HIS 0.08 -0.45 1 30 ILE -2.27 -0.36 1 33 THR 0.24 -0.16 1 34 GLN -0.09 -0.04 1 35 MET 0.09 -0.14 1 36 ASN -0.77 -0.18 1 38 GLU -1.26 -0.09 1 40 ASP 3.62 -0.94 1 41 VAL 2.86 -0.09 1 42 LEU 0.46 0.07 1 43 ARG -1.16 0.19 1 44 ASN -2.05 0.50 1 45 LEU -2.20 0.53 1 46 MET -2.68 0.20 1 47 VAL -2.52 0.82 1 48 ASN -5.68 0.40 1 49 TYR 4.64 -0.33 1 50 ILE -3.24 -0.39 1 52 THR 4.35 0.02 1 53 THR 1.12 -0.15 1 54 VAL 2.39 -0.19 1 55 ASP -3.89 0.09 1 56 GLU 4.39 -0.82 1 57 VAL 5.75 -0.58 1 59 LEU 3.08 -0.38 1 60 ARG 5.12 -0.77 1 61 GLN 4.35 -0.37 1 62 LEU 2.20 -0.33 1 63 PHE 3.00 -0.38 1 64 GLU 2.97 0.14 1 65 ARG 3.35 -0.39 1 66 TYR 2.37 -0.32 1 69 ILE -2.41 -0.29 1 70 GLU 0.14 -0.10 1 71 SER -2.28 0.02 1 72 VAL -3.49 0.51 1 73 LYS -5.00 0.33 1 74 ILE -0.69 -0.11 1 75 VAL 5.31 -0.52 1 77 ASP -1.81 -0.20 1 78 ARG 3.55 -0.43 1 79 GLU 1.45 -0.14 1 80 THR -0.75 -0.10 1 81 ARG 5.43 -0.44 1 82 GLN -1.17 -0.07 1 83 SER -0.26 -0.03 1 84 ARG 0.22 0.06 1 86 TYR -4.86 0.69 1 88 PHE -5.56 1.08 1 89 VAL -3.06 -0.03 1 90 LYS -2.50 1.05 1 91 PHE -0.46 -0.09 1 92 GLN 3.94 -0.24 1 93 SER -4.71 0.45 1 96 SER 4.06 -0.52 1 97 ALA 4.01 -0.81 1 98 GLN 4.39 -0.54 1 99 GLN 3.95 -0.45 1 101 ILE 5.45 -0.98 1 102 ALA 3.24 -0.32 1 104 LEU -1.50 0.23 1 105 ASN 3.87 -0.26 1 107 PHE -0.40 -0.44 1 108 ASN -0.62 0.29 1 109 ILE -3.67 -0.03 1 110 LEU 4.11 -0.67 1 111 ASN 2.31 -0.28 1 112 LYS -4.22 0.24 1 113 ARG -1.84 0.51 1 114 LEU -0.49 0.18 1 115 LYS -3.90 0.84 1 116 VAL -2.96 0.65 1 117 ALA -5.80 0.15 1 118 LEU 2.19 0.01 1 119 ALA 1.88 -0.22 1 120 ALA -0.30 0.00 1 121 SER 0.04 -0.12 1 129 ALA 0.23 -0.09 1 131 ALA -0.52 -0.02 1 132 VAL 0.34 -0.08 1 134 ASP -0.27 -0.12 1 136 ASN -0.08 -0.12 1 138 TYR -0.43 -0.03 1 139 LEU 0.43 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.80 _LACS_plot.Line_1_terminator_val_y_1 -1.23 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.66 _LACS_plot.Line_2_terminator_val_x_2 5.44 _LACS_plot.Line_2_terminator_val_y_2 0.47 _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 75 VAL 5.31 -1.16 0 110 LEU 4.11 -1.80 0 10 TYR -0.27 -0.71 1 13 TYR 0.65 0.37 1 15 GLN 0.86 0.29 1 16 THR 1.32 0.66 1 17 ALA 1.18 -0.73 1 18 GLN 1.62 0.26 1 19 LEU 1.35 -0.73 1 20 GLN 0.70 -0.03 1 21 GLN 1.40 0.25 1 22 LEU 1.35 -1.40 1 23 GLN 1.46 0.90 1 24 GLN 1.46 0.90 1 25 GLN 1.46 0.90 1 26 GLN 1.46 0.90 1 27 GLN 1.46 0.90 1 28 GLN 1.47 -0.03 1 29 HIS 0.08 0.87 1 33 THR 0.24 0.45 1 34 GLN -0.09 -0.37 1 35 MET 0.09 -0.68 1 40 ASP 3.62 0.76 1 41 VAL 2.86 0.26 1 42 LEU 0.46 -1.49 1 43 ARG -1.16 -1.93 1 44 ASN -2.05 -0.27 1 45 LEU -2.20 -1.68 1 46 MET -2.68 -1.35 1 47 VAL -2.52 -0.09 1 48 ASN -5.68 -0.74 1 49 TYR 4.64 -1.26 1 52 THR 4.35 0.42 1 53 THR 1.12 0.59 1 54 VAL 2.39 -1.28 1 55 ASP -3.89 -0.34 1 56 GLU 4.39 0.62 1 59 LEU 3.08 -0.48 1 60 ARG 5.12 0.23 1 61 GLN 4.35 1.12 1 62 LEU 2.20 -0.87 1 63 PHE 3.00 1.05 1 64 GLU 2.97 0.04 1 65 ARG 3.35 0.11 1 66 TYR 2.37 -0.60 1 69 ILE -2.41 -0.65 1 70 GLU 0.14 -0.67 1 71 SER -2.28 -0.84 1 72 VAL -3.49 -1.64 1 73 LYS -5.00 -1.27 1 74 ILE -0.69 -0.53 1 77 ASP -1.81 0.43 1 78 ARG 3.55 0.13 1 79 GLU 1.45 0.47 1 80 THR -0.75 1.21 1 81 ARG 5.43 -0.87 1 82 GLN -1.17 0.03 1 83 SER -0.26 0.01 1 84 ARG 0.22 0.39 1 86 TYR -4.86 -1.74 1 88 PHE -5.56 -0.13 1 89 VAL -3.06 -2.07 1 90 LYS -2.50 -0.35 1 91 PHE -0.46 -0.16 1 92 GLN 3.94 -0.30 1 96 SER 4.06 0.49 1 97 ALA 4.01 -0.62 1 98 GLN 4.39 1.69 1 99 GLN 3.95 0.92 1 100 ALA 1.57 -0.30 1 101 ILE 5.45 0.34 1 102 ALA 3.24 0.29 1 104 LEU -1.50 -0.88 1 105 ASN 3.87 1.10 1 107 PHE -0.40 -0.60 1 108 ASN -0.62 -0.57 1 109 ILE -3.67 -1.82 1 111 ASN 2.31 -0.05 1 112 LYS -4.22 -1.07 1 113 ARG -1.84 -0.39 1 114 LEU -0.49 -0.77 1 115 LYS -3.90 -1.16 1 116 VAL -2.96 -1.81 1 117 ALA -5.80 -1.99 1 118 LEU 2.19 -0.61 1 119 ALA 1.88 -1.07 1 120 ALA -0.30 -1.32 1 121 SER 0.04 0.78 1 129 ALA 0.23 -0.91 1 131 ALA -0.52 -1.04 1 132 VAL 0.34 -0.03 1 134 ASP -0.27 0.05 1 136 ASN -0.08 0.47 1 138 TYR -0.43 -0.64 1 stop_ save_