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 bmr6075_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.38 _LACS_plot.Line_1_terminator_val_y_1 -2.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.94 _LACS_plot.Line_2_terminator_val_x_2 6.89 _LACS_plot.Line_2_terminator_val_y_2 5.20 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 TYR -7.38 -1.99 0 52 MET 3.94 -0.05 0 101 TRP -6.55 -5.43 0 65 ASP -5.39 0.23 0 11 THR 6.90 4.47 1 13 ASN -4.26 -2.38 1 14 SER -0.13 3.14 1 16 ARG 4.02 4.33 1 17 SER 4.75 2.64 1 18 GLN 4.27 1.99 1 19 MET 4.53 4.66 1 20 ALA 5.23 2.94 1 21 GLU 2.77 2.36 1 23 TRP 0.01 2.28 1 24 ALA 2.53 3.42 1 25 LYS 4.34 3.45 1 26 GLN 2.64 1.94 1 27 TYR 0.02 1.47 1 28 LEU 2.44 0.82 1 30 ASP 1.11 1.69 1 31 GLU 1.28 1.17 1 32 TRP -2.51 -1.29 1 33 LYS -1.70 -1.45 1 34 VAL -1.67 -1.51 1 36 SER -5.64 -0.76 1 37 ALA -5.51 -0.91 1 39 ILE 4.34 3.05 1 40 GLU -6.32 -2.64 1 41 ALA -1.77 -1.35 1 42 HIS -1.31 0.24 1 44 LEU 0.88 1.04 1 45 ASN -2.38 0.29 1 47 ASN 4.50 2.52 1 48 ALA 3.41 2.82 1 49 VAL 5.19 3.86 1 50 LYS 3.62 3.87 1 51 ALA 4.90 3.12 1 53 LYS 4.21 3.27 1 54 GLU 2.10 2.58 1 55 VAL 0.10 -2.12 1 57 ILE -1.93 -0.55 1 58 ASP -1.52 -1.85 1 59 ILE 1.04 0.19 1 60 SER 4.10 3.82 1 61 ASN -0.50 -0.47 1 62 GLN 2.35 1.07 1 63 THR -1.12 -1.45 1 64 SER -2.69 -1.95 1 66 ILE -2.37 -1.59 1 67 ILE 3.02 2.86 1 68 ASP -4.20 -1.85 1 69 SER 4.70 3.74 1 70 ASP 3.91 3.28 1 71 ILE 5.37 3.49 1 72 LEU 2.74 3.79 1 73 ASN 1.84 1.93 1 74 ASN -2.00 -0.18 1 75 ALA 0.67 0.44 1 76 ASP 1.46 2.89 1 77 LEU -3.80 -0.37 1 78 VAL -2.91 -1.87 1 79 VAL -3.48 -2.71 1 80 THR -1.82 -1.75 1 81 LEU -2.50 -0.01 1 85 ALA 2.70 2.28 1 86 ALA 2.82 1.93 1 87 ASP 1.80 2.01 1 88 LYS -1.42 -0.58 1 91 MET 0.95 0.21 1 92 THR -0.92 -1.74 1 95 HIS 1.32 2.11 1 96 VAL 0.43 0.24 1 97 LYS 1.54 0.90 1 98 ARG -4.31 -2.16 1 99 GLU -6.22 -2.18 1 100 HIS -2.73 0.14 1 103 PHE -4.44 -0.29 1 104 ASP -1.59 0.59 1 105 ASP -2.13 -1.07 1 107 ALA 1.62 1.33 1 108 ARG -0.92 -1.21 1 109 ALA 0.94 0.46 1 110 GLN -3.72 -1.57 1 112 THR -1.79 -0.54 1 113 GLU 4.82 3.77 1 114 GLU 4.75 4.04 1 115 GLU 3.02 2.88 1 116 LYS 5.17 4.43 1 117 TRP 1.20 1.68 1 118 ALA 3.46 1.98 1 119 PHE 2.76 2.69 1 120 PHE 5.95 6.53 1 121 GLN 3.48 4.16 1 122 ARG 4.96 3.78 1 123 VAL 5.73 4.99 1 124 ARG 4.90 4.08 1 125 ASP 4.80 3.22 1 126 GLU 2.68 3.16 1 127 ILE 5.63 4.68 1 129 ASN 3.54 2.77 1 130 ARG 2.21 0.48 1 131 LEU 2.39 1.66 1 132 LYS 4.80 3.57 1 133 GLU 2.40 2.29 1 134 PHE 3.10 3.33 1 135 ALA 2.65 2.26 1 136 GLU 1.26 1.99 1 137 THR -1.49 0.69 1 139 LYS -0.51 1.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6075_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.38 _LACS_plot.Line_1_terminator_val_y_1 4.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.06 _LACS_plot.Line_2_terminator_val_x_2 6.89 _LACS_plot.Line_2_terminator_val_y_2 -1.69 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 TYR -7.38 5.39 0 52 MET 3.94 -3.99 0 101 TRP -6.55 1.12 0 65 ASP -5.39 5.62 0 11 THR 6.90 -2.43 1 13 ASN -4.26 1.88 1 14 SER -0.13 3.27 1 16 ARG 4.02 0.31 1 17 SER 4.75 -2.11 1 18 GLN 4.27 -2.28 1 19 MET 4.53 0.13 1 20 ALA 5.23 -2.29 1 21 GLU 2.77 -0.41 1 23 TRP 0.01 2.27 1 24 ALA 2.53 0.89 1 25 LYS 4.34 -0.89 1 26 GLN 2.64 -0.70 1 27 TYR 0.02 1.45 1 28 LEU 2.44 -1.62 1 30 ASP 1.11 0.58 1 31 GLU 1.28 -0.11 1 32 TRP -2.51 1.22 1 33 LYS -1.70 0.25 1 34 VAL -1.67 0.16 1 36 SER -5.64 4.88 1 37 ALA -5.51 4.60 1 39 ILE 4.34 -1.29 1 40 GLU -6.32 3.68 1 41 ALA -1.77 0.42 1 42 HIS -1.31 1.55 1 44 LEU 0.88 0.16 1 45 ASN -2.38 2.67 1 47 ASN 4.50 -1.98 1 48 ALA 3.41 -0.59 1 49 VAL 5.19 -1.33 1 50 LYS 3.62 0.25 1 51 ALA 4.90 -1.78 1 53 LYS 4.21 -0.94 1 54 GLU 2.10 0.48 1 55 VAL 0.10 -2.22 1 57 ILE -1.93 1.38 1 58 ASP -1.52 -0.33 1 59 ILE 1.04 -0.85 1 60 SER 4.10 -0.28 1 61 ASN -0.50 0.03 1 62 GLN 2.35 -1.28 1 63 THR -1.12 -0.33 1 64 SER -2.69 0.74 1 66 ILE -2.37 0.78 1 67 ILE 3.02 -0.16 1 68 ASP -4.20 2.35 1 69 SER 4.70 -0.96 1 70 ASP 3.91 -0.63 1 71 ILE 5.37 -1.88 1 72 LEU 2.74 1.05 1 73 ASN 1.84 0.09 1 74 ASN -2.00 1.82 1 75 ALA 0.67 -0.23 1 76 ASP 1.46 1.43 1 77 LEU -3.80 3.43 1 78 VAL -2.91 1.04 1 79 VAL -3.48 0.77 1 80 THR -1.82 0.07 1 81 LEU -2.50 2.49 1 85 ALA 2.70 -0.42 1 86 ALA 2.82 -0.89 1 87 ASP 1.80 0.21 1 88 LYS -1.42 0.84 1 91 MET 0.95 -0.74 1 92 THR -0.92 -0.82 1 95 HIS 1.32 0.79 1 96 VAL 0.43 -0.19 1 97 LYS 1.54 -0.64 1 98 ARG -4.31 2.15 1 99 GLU -6.22 4.04 1 100 HIS -2.73 2.87 1 103 PHE -4.44 4.15 1 104 ASP -1.59 2.18 1 105 ASP -2.13 1.06 1 107 ALA 1.62 -0.29 1 108 ARG -0.92 -0.29 1 109 ALA 0.94 -0.48 1 110 GLN -3.72 2.15 1 112 THR -1.79 1.25 1 113 GLU 4.82 -1.05 1 114 GLU 4.75 -0.71 1 115 GLU 3.02 -0.14 1 116 LYS 5.17 -0.74 1 117 TRP 1.20 0.48 1 118 ALA 3.46 -1.48 1 119 PHE 2.76 -0.07 1 120 PHE 5.95 0.58 1 121 GLN 3.48 0.68 1 122 ARG 4.96 -1.18 1 123 VAL 5.73 -0.74 1 124 ARG 4.90 -0.82 1 125 ASP 4.80 -1.58 1 126 GLU 2.68 0.48 1 127 ILE 5.63 -0.95 1 129 ASN 3.54 -0.77 1 130 ARG 2.21 -1.73 1 131 LEU 2.39 -0.73 1 132 LYS 4.80 -1.23 1 133 GLU 2.40 -0.11 1 134 PHE 3.10 0.23 1 135 ALA 2.65 -0.39 1 136 GLU 1.26 0.73 1 137 THR -1.49 2.18 1 139 LYS -0.51 1.73 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6075_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.38 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 6.89 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 GLU -6.32 0.00 0 36 SER -5.64 1.58 0 11 THR 6.90 -0.35 1 13 ASN -4.26 0.77 1 14 SER -0.13 0.82 1 16 ARG 4.02 -0.66 1 17 SER 4.75 -0.67 1 18 GLN 4.27 -0.12 1 19 MET 4.53 -0.57 1 20 ALA 5.23 -0.66 1 21 GLU 2.77 -0.54 1 23 TRP 0.01 -0.09 1 24 ALA 2.53 -0.17 1 25 LYS 4.34 -0.11 1 26 GLN 2.64 -0.05 1 27 TYR 0.02 0.30 1 28 LEU 2.44 0.29 1 30 ASP 1.11 -0.04 1 31 GLU 1.28 0.00 1 32 TRP -2.51 0.48 1 33 LYS -1.70 0.35 1 34 VAL -1.67 0.62 1 35 TYR -7.38 0.65 1 37 ALA -5.51 0.38 1 39 ILE 4.34 -0.33 1 41 ALA -1.77 0.27 1 42 HIS -1.31 0.11 1 44 LEU 0.88 -0.18 1 45 ASN -2.38 0.12 1 47 ASN 4.50 -0.17 1 48 ALA 3.41 -0.01 1 49 VAL 5.19 -0.70 1 50 LYS 3.62 -0.23 1 51 ALA 4.90 -0.01 1 52 MET 3.94 0.09 1 53 LYS 4.21 -0.40 1 54 GLU 2.10 -0.10 1 55 VAL 0.10 0.65 1 57 ILE -1.93 -0.10 1 58 ASP -1.52 0.03 1 59 ILE 1.04 0.40 1 60 SER 4.10 -0.58 1 61 ASN -0.50 0.23 1 62 GLN 2.35 0.00 1 63 THR -1.12 0.04 1 64 SER -2.69 0.44 1 65 ASP -5.39 0.51 1 66 ILE -2.37 0.97 1 67 ILE 3.02 -0.75 1 68 ASP -4.20 0.29 1 69 SER 4.70 -0.43 1 70 ASP 3.91 -0.13 1 71 ILE 5.37 -0.72 1 72 LEU 2.74 -0.55 1 73 ASN 1.84 -0.29 1 74 ASN -2.00 0.22 1 75 ALA 0.67 -0.25 1 76 ASP 1.46 0.23 1 77 LEU -3.80 0.65 1 78 VAL -2.91 0.74 1 79 VAL -3.48 0.59 1 80 THR -1.82 0.99 1 81 LEU -2.50 1.23 1 85 ALA 2.70 -0.18 1 86 ALA 2.82 -0.17 1 87 ASP 1.80 -0.15 1 88 LYS -1.42 0.09 1 91 MET 0.95 -0.08 1 92 THR -0.92 0.12 1 95 HIS 1.32 -0.09 1 96 VAL 0.43 -0.21 1 97 LYS 1.54 -0.04 1 98 ARG -4.31 1.09 1 99 GLU -6.22 0.24 1 100 HIS -2.73 0.48 1 101 TRP -6.55 0.36 1 103 PHE -4.44 0.36 1 104 ASP -1.59 -0.09 1 105 ASP -2.13 -0.32 1 107 ALA 1.62 0.00 1 108 ARG -0.92 0.07 1 109 ALA 0.94 -0.56 1 110 GLN -3.72 0.28 1 112 THR -1.79 0.14 1 113 GLU 4.82 -0.30 1 114 GLU 4.75 -0.05 1 115 GLU 3.02 -0.16 1 116 LYS 5.17 -0.33 1 117 TRP 1.20 0.38 1 118 ALA 3.46 0.09 1 119 PHE 2.76 -0.29 1 120 PHE 5.95 -0.96 1 121 GLN 3.48 -1.03 1 122 ARG 4.96 -0.31 1 123 VAL 5.73 -0.36 1 124 ARG 4.90 -0.24 1 125 ASP 4.80 -0.05 1 126 GLU 2.68 -0.29 1 127 ILE 5.63 -1.07 1 129 ASN 3.54 -0.56 1 130 ARG 2.21 -0.17 1 131 LEU 2.39 -0.13 1 132 LYS 4.80 -1.27 1 133 GLU 2.40 -0.25 1 134 PHE 3.10 0.01 1 135 ALA 2.65 -0.50 1 136 GLU 1.26 -0.13 1 137 THR -1.49 0.24 1 139 LYS -0.51 0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6075_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.38 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.40 _LACS_plot.Line_2_terminator_val_x_2 6.89 _LACS_plot.Line_2_terminator_val_y_2 2.63 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 TYR -7.38 -0.68 0 13 ASN -4.26 2.18 0 11 THR 6.90 0.45 1 14 SER -0.13 -0.23 1 16 ARG 4.02 1.78 1 17 SER 4.75 0.77 1 18 GLN 4.27 3.33 1 19 MET 4.53 0.69 1 20 ALA 5.23 -0.53 1 21 GLU 2.77 0.87 1 23 TRP 0.01 -2.04 1 24 ALA 2.53 1.05 1 25 LYS 4.34 1.80 1 26 GLN 2.64 1.79 1 27 TYR 0.02 1.59 1 28 LEU 2.44 0.71 1 30 ASP 1.11 0.80 1 31 GLU 1.28 -0.73 1 32 TRP -2.51 -0.03 1 33 LYS -1.70 -1.84 1 34 VAL -1.67 -1.49 1 36 SER -5.64 -1.44 1 37 ALA -5.51 -3.57 1 39 ILE 4.34 1.00 1 40 GLU -6.32 -3.38 1 41 ALA -1.77 -0.35 1 42 HIS -1.31 1.48 1 44 LEU 0.88 -0.84 1 47 ASN 4.50 2.50 1 48 ALA 3.41 1.17 1 49 VAL 5.19 3.45 1 50 LYS 3.62 2.31 1 51 ALA 4.90 2.95 1 52 MET 3.94 2.23 1 53 LYS 4.21 3.85 1 54 GLU 2.10 1.41 1 55 VAL 0.10 -0.78 1 57 ILE -1.93 -2.66 1 58 ASP -1.52 0.77 1 59 ILE 1.04 0.15 1 60 SER 4.10 -0.39 1 61 ASN -0.50 0.78 1 62 GLN 2.35 -1.01 1 63 THR -1.12 0.28 1 64 SER -2.69 -1.18 1 65 ASP -5.39 -1.19 1 66 ILE -2.37 0.95 1 67 ILE 3.02 -2.10 1 68 ASP -4.20 0.73 1 69 SER 4.70 0.75 1 70 ASP 3.91 2.26 1 71 ILE 5.37 1.43 1 72 LEU 2.74 -0.89 1 73 ASN 1.84 0.86 1 74 ASN -2.00 -1.62 1 75 ALA 0.67 -2.07 1 76 ASP 1.46 0.84 1 77 LEU -3.80 -3.94 1 78 VAL -2.91 -2.40 1 79 VAL -3.48 0.30 1 80 THR -1.82 2.08 1 81 LEU -2.50 -0.95 1 85 ALA 2.70 0.46 1 86 ALA 2.82 1.49 1 87 ASP 1.80 1.03 1 88 LYS -1.42 -1.10 1 91 MET 0.95 -0.47 1 95 HIS 1.32 0.93 1 96 VAL 0.43 -0.38 1 97 LYS 1.54 -2.13 1 98 ARG -4.31 -0.34 1 99 GLU -6.22 -2.63 1 100 HIS -2.73 -0.10 1 101 TRP -6.55 -3.07 1 103 PHE -4.44 -0.06 1 104 ASP -1.59 -1.83 1 107 ALA 1.62 0.74 1 108 ARG -0.92 -0.47 1 109 ALA 0.94 -1.04 1 110 GLN -3.72 -1.22 1 112 THR -1.79 0.87 1 113 GLU 4.82 3.17 1 114 GLU 4.75 3.36 1 115 GLU 3.02 4.06 1 116 LYS 5.17 2.50 1 117 TRP 1.20 1.50 1 118 ALA 3.46 2.69 1 119 PHE 2.76 3.08 1 120 PHE 5.95 2.77 1 121 GLN 3.48 0.66 1 122 ARG 4.96 2.79 1 123 VAL 5.73 1.29 1 124 ARG 4.90 3.46 1 125 ASP 4.80 2.30 1 126 GLU 2.68 4.01 1 127 ILE 5.63 1.13 1 129 ASN 3.54 2.71 1 130 ARG 2.21 2.62 1 131 LEU 2.39 0.48 1 132 LYS 4.80 1.83 1 133 GLU 2.40 3.56 1 134 PHE 3.10 2.67 1 135 ALA 2.65 1.57 1 136 GLU 1.26 1.92 1 137 THR -1.49 1.36 1 stop_ save_