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 bmr26937_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.32 _LACS_plot.Line_1_terminator_val_y_1 -2.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.70 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 4.96 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 MET -6.32 2.15 0 12 LEU -2.16 -0.75 1 13 VAL -5.43 -2.71 1 18 SER -5.93 -2.46 1 19 LEU -6.07 -0.61 1 20 ARG -3.40 -1.40 1 21 LEU -3.55 -2.02 1 22 SER -5.69 -1.73 1 24 VAL -6.12 -2.50 1 25 ASP -1.69 -1.24 1 26 SER 3.62 2.98 1 27 GLU -0.36 -0.21 1 28 ARG 5.89 1.98 1 29 THR 1.61 0.53 1 30 SER -1.01 -0.67 1 35 TRP -6.26 -1.91 1 36 PHE -6.43 -1.45 1 37 ARG -3.11 -1.53 1 38 ARG -4.78 -0.21 1 42 LYS -3.96 -1.60 1 43 GLU -2.24 -1.20 1 44 ARG 1.38 1.48 1 45 GLU -6.56 -2.46 1 46 PHE 1.66 1.92 1 47 VAL 1.15 1.94 1 48 ALA -4.66 -0.61 1 49 SER -4.41 -0.70 1 50 ILE -3.90 -0.18 1 51 THR -1.41 0.38 1 52 TRP 4.77 3.92 1 53 SER 1.06 0.39 1 55 ILE -3.97 -1.54 1 58 THR -1.78 -0.09 1 59 TYR -4.99 -0.73 1 60 ALA -0.51 0.03 1 61 ASP 4.22 3.56 1 62 SER 2.65 1.77 1 63 VAL -0.79 -1.73 1 64 ALA 2.42 2.13 1 65 ASP 2.54 1.62 1 66 ARG 0.60 1.58 1 67 PHE -4.41 -4.86 1 68 THR -3.49 -0.95 1 69 THR -4.70 -2.77 1 70 SER -2.71 -0.86 1 71 ARG -5.93 -1.30 1 72 ASP -2.71 -2.04 1 73 VAL 5.07 4.13 1 74 ALA 3.57 2.78 1 75 ASN -0.42 -0.55 1 76 ASN 1.52 0.99 1 77 THR -2.09 -0.29 1 78 LEU -7.00 -2.02 1 79 TYR -4.34 -0.67 1 80 LEU -0.89 -0.71 1 81 GLN -0.35 -0.90 1 82 MET -2.81 -0.79 1 83 ASN -4.17 -1.73 1 84 SER 1.10 -0.68 1 85 LEU 1.47 1.89 1 86 LYS -5.45 -2.05 1 87 HIS 5.12 6.26 1 88 GLU 3.52 2.35 1 89 ASP -0.34 0.93 1 90 THR 3.09 3.13 1 91 ALA -1.89 0.24 1 92 VAL 1.12 0.53 1 93 TYR -2.04 -0.05 1 94 TYR -4.76 -1.31 1 96 ALA -4.56 -2.54 1 97 ALA -9.32 -2.35 1 98 ARG -2.18 0.89 1 101 VAL -0.60 -0.52 1 105 SER 0.04 0.14 1 108 TYR -0.39 -0.64 1 109 ASP -1.03 -0.18 1 110 TYR -1.24 0.47 1 111 ASP -1.20 2.17 1 112 TYR -5.60 -1.74 1 113 TRP -4.84 -1.35 1 115 GLN 1.30 1.92 1 117 THR -2.95 -1.74 1 118 GLN 1.09 1.15 1 119 VAL 3.58 0.14 1 120 THR -0.71 0.09 1 121 VAL -0.43 -2.09 1 123 SER 0.49 0.52 1 124 LEU 0.87 0.48 1 125 GLU 1.21 1.31 1 126 VAL -5.01 -5.44 1 127 LEU 0.58 0.31 1 128 PHE 0.07 0.12 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26937_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.32 _LACS_plot.Line_1_terminator_val_y_1 6.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.30 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 -0.92 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 MET -6.32 8.47 0 12 LEU -2.16 1.41 1 13 VAL -5.43 2.72 1 18 SER -5.93 3.47 1 19 LEU -6.07 5.46 1 20 ARG -3.40 2.00 1 21 LEU -3.55 1.53 1 22 SER -5.69 3.96 1 24 VAL -6.12 3.62 1 25 ASP -1.69 0.45 1 26 SER 3.62 -0.64 1 27 GLU -0.36 0.15 1 28 ARG 5.89 -3.91 1 29 THR 1.61 -1.08 1 30 SER -1.01 0.34 1 35 TRP -6.26 4.35 1 36 PHE -6.43 4.98 1 37 ARG -3.11 1.58 1 38 ARG -4.78 4.57 1 42 LYS -3.96 2.36 1 43 GLU -2.24 1.04 1 44 ARG 1.38 0.10 1 45 GLU -6.56 4.10 1 46 PHE 1.66 0.26 1 47 VAL 1.15 0.79 1 48 ALA -4.66 4.05 1 49 SER -4.41 3.71 1 50 ILE -3.90 3.72 1 51 THR -1.41 1.79 1 52 TRP 4.77 -0.85 1 53 SER 1.06 -0.67 1 55 ILE -3.97 2.43 1 58 THR -1.78 1.69 1 59 TYR -4.99 4.26 1 60 ALA -0.51 0.54 1 61 ASP 4.22 -0.66 1 62 SER 2.65 -0.88 1 63 VAL -0.79 -0.94 1 64 ALA 2.42 -0.29 1 65 ASP 2.54 -0.92 1 66 ARG 0.60 0.98 1 67 PHE -4.41 -0.45 1 68 THR -3.49 2.54 1 69 THR -4.70 1.93 1 70 SER -2.71 1.85 1 71 ARG -5.93 4.63 1 72 ASP -2.71 0.67 1 73 VAL 5.07 -0.94 1 74 ALA 3.57 -0.79 1 75 ASN -0.42 -0.13 1 76 ASN 1.52 -0.53 1 77 THR -2.09 1.80 1 78 LEU -7.00 4.98 1 79 TYR -4.34 3.67 1 80 LEU -0.89 0.18 1 81 GLN -0.35 -0.55 1 82 MET -2.81 2.02 1 83 ASN -4.17 2.44 1 84 SER 1.10 -1.78 1 85 LEU 1.47 0.42 1 86 LYS -5.45 3.40 1 87 HIS 5.12 1.14 1 88 GLU 3.52 -1.17 1 89 ASP -0.34 1.27 1 90 THR 3.09 0.04 1 91 ALA -1.89 2.13 1 92 VAL 1.12 -0.59 1 93 TYR -2.04 1.99 1 94 TYR -4.76 3.45 1 96 ALA -4.56 2.02 1 97 ALA -9.32 6.97 1 98 ARG -2.18 3.07 1 101 VAL -0.60 0.08 1 105 SER 0.04 0.10 1 108 TYR -0.39 -0.25 1 109 ASP -1.03 0.85 1 110 TYR -1.24 1.71 1 111 ASP -1.20 3.37 1 112 TYR -5.60 3.86 1 113 TRP -4.84 3.49 1 115 GLN 1.30 0.62 1 117 THR -2.95 1.21 1 118 GLN 1.09 0.06 1 119 VAL 3.58 -3.44 1 120 THR -0.71 0.80 1 121 VAL -0.43 -1.66 1 123 SER 0.49 0.03 1 124 LEU 0.87 -0.39 1 125 GLU 1.21 0.10 1 126 VAL -5.01 -0.43 1 127 LEU 0.58 -0.27 1 128 PHE 0.07 0.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26937_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.32 _LACS_plot.Line_1_terminator_val_y_1 1.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 82 MET -2.81 -0.65 0 37 ARG -3.11 1.54 0 12 LEU -2.16 0.93 1 13 VAL -5.43 0.41 1 18 SER -5.93 1.08 1 19 LEU -6.07 0.05 1 20 ARG -3.40 0.76 1 21 LEU -3.55 0.81 1 22 SER -5.69 1.28 1 24 VAL -6.12 0.80 1 25 ASP -1.69 0.55 1 26 SER 3.62 -0.21 1 27 GLU -0.36 0.03 1 28 ARG 5.89 -0.74 1 29 THR 1.61 -0.32 1 30 SER -1.01 -0.17 1 33 MET -6.32 0.00 1 35 TRP -6.26 1.14 1 36 PHE -6.43 0.67 1 38 ARG -4.78 0.55 1 42 LYS -3.96 0.47 1 43 GLU -2.24 0.05 1 44 ARG 1.38 0.18 1 45 GLU -6.56 0.78 1 46 PHE 1.66 -1.04 1 47 VAL 1.15 -0.28 1 48 ALA -4.66 0.63 1 49 SER -4.41 0.89 1 50 ILE -3.90 0.30 1 51 THR -1.41 0.22 1 52 TRP 4.77 -0.70 1 53 SER 1.06 -0.58 1 55 ILE -3.97 0.57 1 58 THR -1.78 0.17 1 59 TYR -4.99 0.63 1 60 ALA -0.51 0.25 1 61 ASP 4.22 -0.28 1 62 SER 2.65 -0.27 1 63 VAL -0.79 0.02 1 64 ALA 2.42 -0.71 1 65 ASP 2.54 -0.34 1 66 ARG 0.60 0.24 1 67 PHE -4.41 1.28 1 68 THR -3.49 0.72 1 69 THR -4.70 1.20 1 70 SER -2.71 0.22 1 71 ARG -5.93 0.96 1 72 ASP -2.71 0.24 1 73 VAL 5.07 -0.76 1 74 ALA 3.57 -0.14 1 75 ASN -0.42 0.17 1 76 ASN 1.52 -0.36 1 77 THR -2.09 0.60 1 78 LEU -7.00 0.52 1 79 TYR -4.34 1.34 1 80 LEU -0.89 0.27 1 81 GLN -0.35 -0.06 1 83 ASN -4.17 0.39 1 84 SER 1.10 -0.45 1 85 LEU 1.47 -0.40 1 86 LYS -5.45 0.41 1 87 HIS 5.12 -0.51 1 88 GLU 3.52 -0.08 1 89 ASP -0.34 0.14 1 90 THR 3.09 0.05 1 91 ALA -1.89 0.17 1 92 VAL 1.12 0.13 1 93 TYR -2.04 0.37 1 94 TYR -4.76 0.60 1 96 ALA -4.56 0.19 1 97 ALA -9.32 0.91 1 98 ARG -2.18 0.34 1 101 VAL -0.60 0.00 1 105 SER 0.04 -0.04 1 108 TYR -0.39 0.17 1 109 ASP -1.03 0.21 1 110 TYR -1.24 -0.42 1 111 ASP -1.20 -0.18 1 112 TYR -5.60 0.50 1 113 TRP -4.84 0.38 1 115 GLN 1.30 0.04 1 117 THR -2.95 0.37 1 118 GLN 1.09 0.05 1 119 VAL 3.58 0.38 1 120 THR -0.71 0.24 1 121 VAL -0.43 0.69 1 123 SER 0.49 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26937_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.32 _LACS_plot.Line_1_terminator_val_y_1 -2.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.98 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 0.78 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 HIS 5.12 4.52 0 12 LEU -2.16 -0.85 1 13 VAL -5.43 -3.53 1 18 SER -5.93 -1.53 1 19 LEU -6.07 -3.93 1 20 ARG -3.40 -0.70 1 21 LEU -3.55 -0.43 1 22 SER -5.69 -0.90 1 24 VAL -6.12 -3.01 1 25 ASP -1.69 3.03 1 26 SER 3.62 1.13 1 27 GLU -0.36 -0.16 1 28 ARG 5.89 -1.66 1 29 THR 1.61 -1.99 1 30 SER -1.01 -2.10 1 33 MET -6.32 -3.97 1 35 TRP -6.26 -1.11 1 36 PHE -6.43 -1.23 1 37 ARG -3.11 -2.74 1 38 ARG -4.78 -1.18 1 42 LYS -3.96 -0.52 1 43 GLU -2.24 0.14 1 44 ARG 1.38 -0.65 1 45 GLU -6.56 -1.39 1 46 PHE 1.66 -1.80 1 47 VAL 1.15 -3.75 1 48 ALA -4.66 -2.78 1 49 SER -4.41 -2.97 1 50 ILE -3.90 -3.00 1 51 THR -1.41 2.30 1 52 TRP 4.77 1.90 1 53 SER 1.06 0.30 1 55 ILE -3.97 -1.85 1 58 THR -1.78 -2.49 1 59 TYR -4.99 0.88 1 60 ALA -0.51 1.31 1 61 ASP 4.22 2.16 1 62 SER 2.65 1.28 1 63 VAL -0.79 -0.64 1 64 ALA 2.42 -0.23 1 65 ASP 2.54 -0.05 1 66 ARG 0.60 -0.94 1 67 PHE -4.41 -1.01 1 68 THR -3.49 -0.30 1 69 THR -4.70 -3.97 1 70 SER -2.71 -2.74 1 71 ARG -5.93 -2.32 1 72 ASP -2.71 0.66 1 73 VAL 5.07 3.04 1 74 ALA 3.57 1.65 1 75 ASN -0.42 0.28 1 76 ASN 1.52 -2.45 1 77 THR -2.09 -3.83 1 78 LEU -7.00 -3.17 1 79 TYR -4.34 1.48 1 80 LEU -0.89 -3.98 1 81 GLN -0.35 -2.14 1 82 MET -2.81 -2.96 1 83 ASN -4.17 -1.88 1 84 SER 1.10 1.47 1 85 LEU 1.47 -0.47 1 86 LYS -5.45 0.92 1 88 GLU 3.52 -0.70 1 89 ASP -0.34 0.74 1 90 THR 3.09 -0.43 1 91 ALA -1.89 -2.38 1 92 VAL 1.12 -0.80 1 93 TYR -2.04 -1.14 1 94 TYR -4.76 -0.98 1 96 ALA -4.56 -2.09 1 97 ALA -9.32 -1.57 1 98 ARG -2.18 0.87 1 101 VAL -0.60 -0.22 1 105 SER 0.04 -0.43 1 108 TYR -0.39 -0.75 1 109 ASP -1.03 -1.75 1 110 TYR -1.24 -2.00 1 111 ASP -1.20 -1.20 1 112 TYR -5.60 -2.80 1 113 TRP -4.84 1.68 1 115 GLN 1.30 1.60 1 117 THR -2.95 -1.84 1 118 GLN 1.09 -0.63 1 119 VAL 3.58 -1.63 1 120 THR -0.71 -3.04 1 121 VAL -0.43 -0.41 1 123 SER 0.49 -0.40 1 124 LEU 0.87 -2.55 1 125 GLU 1.21 0.71 1 126 VAL -5.01 -0.29 1 128 PHE 0.07 1.11 1 stop_ save_