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 bmr4307_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 -1.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.20 _LACS_plot.Line_2_terminator_val_x_2 8.25 _LACS_plot.Line_2_terminator_val_y_2 6.88 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 98 HIS 1.83 4.59 0 71 GLN -5.62 -1.10 0 68 TYR 0.61 -1.62 0 10 TRP -0.24 -0.08 1 11 ASN -0.20 0.09 1 12 LYS 0.04 0.33 1 14 SER -0.53 0.05 1 15 LYS -0.03 0.35 1 17 LYS 0.37 0.52 1 18 THR -0.36 0.15 1 19 ASN 0.16 0.41 1 20 MET 0.12 0.48 1 21 LYS 0.36 0.56 1 22 HIS 0.09 0.71 1 23 MET -0.24 0.22 1 24 ALA -0.08 0.48 1 26 ALA -0.29 0.33 1 27 ALA -0.12 0.31 1 28 ALA -0.19 0.32 1 29 ALA -0.04 0.41 1 31 ALA -0.61 0.13 1 32 VAL 0.29 0.37 1 33 VAL 0.41 0.55 1 36 LEU -0.21 0.21 1 39 TYR -0.92 0.60 1 40 MET -3.02 -1.24 1 41 LEU -3.00 -1.37 1 43 SER -0.20 0.46 1 44 ALA 1.22 0.86 1 45 MET -4.96 -1.05 1 46 SER 0.94 0.69 1 47 ARG 2.29 1.47 1 49 MET 1.09 -0.42 1 50 MET -3.42 -1.42 1 51 HIS -1.58 -0.45 1 52 PHE 0.59 1.79 1 54 ASN -2.95 -0.21 1 55 ASP 3.53 3.87 1 56 TRP 5.17 4.29 1 57 GLU 3.32 3.44 1 58 ASP 4.84 4.64 1 59 ARG 4.54 3.84 1 60 TYR 4.53 4.51 1 61 TYR 4.12 4.38 1 62 ARG 5.12 4.22 1 63 GLU 1.23 1.66 1 64 ASN -0.85 1.68 1 65 MET 5.00 4.73 1 66 ASN 3.13 1.93 1 67 ARG 0.99 1.16 1 70 ASN -0.62 -0.87 1 72 VAL -4.41 -3.19 1 73 TYR -4.40 -0.68 1 74 TYR -2.95 -1.55 1 75 ARG 0.67 0.09 1 77 VAL 4.00 3.77 1 78 ASP 1.90 0.54 1 79 GLN 2.06 0.48 1 80 TYR -4.01 -0.40 1 81 ASN 0.35 0.66 1 82 ASN -1.80 -0.13 1 83 GLN 3.35 3.40 1 84 ASN 4.39 3.69 1 85 ASN 3.56 3.33 1 86 PHE 4.22 3.60 1 87 VAL 6.61 6.07 1 88 HIS 5.05 4.77 1 89 ASP 3.18 3.45 1 91 VAL 5.12 4.42 1 92 ASN 3.58 3.88 1 93 ILE 3.67 1.85 1 94 THR 8.25 7.26 1 95 ILE 7.12 5.46 1 96 LYS 4.82 4.28 1 97 GLN 3.50 2.53 1 99 THR 4.23 3.97 1 100 VAL 4.11 3.50 1 101 THR 3.16 3.00 1 102 THR 3.25 2.91 1 103 THR 3.23 3.02 1 104 THR 2.86 2.63 1 105 LYS 0.83 0.56 1 107 GLU -1.92 -0.59 1 108 ASN -1.96 0.08 1 109 PHE -1.51 -0.52 1 110 THR -3.69 -1.01 1 111 GLU 4.25 3.75 1 112 THR 6.17 5.47 1 113 ASP 3.26 4.47 1 114 ILE 5.51 3.86 1 115 LYS 4.07 3.49 1 116 ILE 5.10 4.17 1 117 MET 4.10 5.33 1 118 GLU 5.27 4.43 1 119 ARG 2.87 2.86 1 120 VAL 4.03 4.20 1 121 VAL 5.75 4.36 1 122 GLU 5.44 4.78 1 123 GLN 5.21 3.99 1 124 MET 3.11 5.04 1 126 THR 7.90 6.62 1 127 THR 6.58 5.53 1 128 GLN 4.55 3.37 1 129 TYR 5.92 4.59 1 130 GLN 5.12 3.69 1 131 LYS 3.72 3.45 1 132 GLU 1.45 1.63 1 133 SER 3.74 2.98 1 134 GLN 3.04 2.45 1 135 ALA 1.81 1.66 1 136 TYR 1.63 1.92 1 137 TYR 1.75 1.67 1 138 ASP 0.97 0.99 1 140 ARG 0.45 0.57 1 141 ARG -0.10 0.30 1 142 SER 0.56 1.95 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4307_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 4.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.80 _LACS_plot.Line_2_terminator_val_x_2 8.25 _LACS_plot.Line_2_terminator_val_y_2 -1.37 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 98 HIS 1.83 2.76 0 71 GLN -5.62 4.52 0 68 TYR 0.61 -2.23 0 10 TRP -0.24 0.16 1 11 ASN -0.20 0.29 1 12 LYS 0.04 0.29 1 14 SER -0.53 0.58 1 15 LYS -0.03 0.38 1 17 LYS 0.37 0.15 1 18 THR -0.36 0.51 1 19 ASN 0.16 0.25 1 20 MET 0.12 0.36 1 21 LYS 0.36 0.20 1 22 HIS 0.09 0.62 1 23 MET -0.24 0.46 1 24 ALA -0.08 0.56 1 26 ALA -0.29 0.62 1 27 ALA -0.12 0.43 1 28 ALA -0.19 0.51 1 29 ALA -0.04 0.45 1 31 ALA -0.61 0.74 1 32 VAL 0.29 0.08 1 33 VAL 0.41 0.14 1 36 LEU -0.21 0.42 1 39 TYR -0.92 1.52 1 40 MET -3.02 1.78 1 41 LEU -3.00 1.63 1 43 SER -0.20 0.66 1 44 ALA 1.22 -0.36 1 45 MET -4.96 3.91 1 46 SER 0.94 -0.25 1 47 ARG 2.29 -0.82 1 49 MET 1.09 -1.51 1 50 MET -3.42 2.00 1 51 HIS -1.58 1.13 1 52 PHE 0.59 1.20 1 54 ASN -2.95 2.74 1 55 ASP 3.53 0.34 1 56 TRP 5.17 -0.88 1 57 GLU 3.32 0.12 1 58 ASP 4.84 -0.20 1 59 ARG 4.54 -0.70 1 60 TYR 4.53 -0.02 1 61 TYR 4.12 0.26 1 62 ARG 5.12 -0.90 1 63 GLU 1.23 0.43 1 64 ASN -0.85 2.53 1 65 MET 5.00 -0.27 1 66 ASN 3.13 -1.20 1 67 ARG 0.99 0.17 1 70 ASN -0.62 -0.25 1 72 VAL -4.41 1.22 1 73 TYR -4.40 3.72 1 74 TYR -2.95 1.40 1 75 ARG 0.67 -0.58 1 77 VAL 4.00 -0.23 1 78 ASP 1.90 -1.36 1 79 GLN 2.06 -1.58 1 80 TYR -4.01 3.61 1 81 ASN 0.35 0.31 1 82 ASN -1.80 1.67 1 83 GLN 3.35 0.05 1 84 ASN 4.39 -0.70 1 85 ASN 3.56 -0.23 1 86 PHE 4.22 -0.62 1 87 VAL 6.61 -0.54 1 88 HIS 5.05 -0.28 1 89 ASP 3.18 0.27 1 91 VAL 5.12 -0.70 1 92 ASN 3.58 0.30 1 93 ILE 3.67 -1.82 1 94 THR 8.25 -0.99 1 95 ILE 7.12 -1.66 1 96 LYS 4.82 -0.54 1 97 GLN 3.50 -0.97 1 99 THR 4.23 -0.26 1 100 VAL 4.11 -0.61 1 101 THR 3.16 -0.16 1 102 THR 3.25 -0.34 1 103 THR 3.23 -0.21 1 104 THR 2.86 -0.23 1 105 LYS 0.83 -0.27 1 107 GLU -1.92 1.33 1 108 ASN -1.96 2.04 1 109 PHE -1.51 0.99 1 110 THR -3.69 2.68 1 111 GLU 4.25 -0.50 1 112 THR 6.17 -0.70 1 113 ASP 3.26 1.21 1 114 ILE 5.51 -1.65 1 115 LYS 4.07 -0.58 1 116 ILE 5.10 -0.93 1 117 MET 4.10 1.23 1 118 GLU 5.27 -0.84 1 119 ARG 2.87 -0.01 1 120 VAL 4.03 0.17 1 121 VAL 5.75 -1.39 1 122 GLU 5.44 -0.66 1 123 GLN 5.21 -1.22 1 124 MET 3.11 1.93 1 126 THR 7.90 -1.28 1 127 THR 6.58 -1.05 1 128 GLN 4.55 -1.18 1 129 TYR 5.92 -1.33 1 130 GLN 5.12 -1.43 1 131 LYS 3.72 -0.27 1 132 GLU 1.45 0.18 1 133 SER 3.74 -0.76 1 134 GLN 3.04 -0.59 1 135 ALA 1.81 -0.15 1 136 TYR 1.63 0.29 1 137 TYR 1.75 -0.08 1 138 ASP 0.97 0.02 1 140 ARG 0.45 0.12 1 141 ARG -0.10 0.40 1 142 SER 0.56 1.39 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4307_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 0.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 8.25 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 PHE 4.22 -1.82 0 10 TRP -0.24 0.07 1 11 ASN -0.20 -0.08 1 12 LYS 0.04 -0.11 1 14 SER -0.53 0.01 1 15 LYS -0.03 0.05 1 17 LYS 0.37 0.07 1 18 THR -0.36 0.01 1 19 ASN 0.16 0.02 1 20 MET 0.12 0.00 1 21 LYS 0.36 -0.04 1 22 HIS 0.09 0.01 1 23 MET -0.24 0.02 1 24 ALA -0.08 0.04 1 26 ALA -0.29 0.01 1 27 ALA -0.12 0.00 1 28 ALA -0.19 0.00 1 29 ALA -0.04 0.01 1 31 ALA -0.61 0.08 1 32 VAL 0.29 0.05 1 33 VAL 0.41 0.02 1 36 LEU -0.21 0.06 1 39 TYR -0.92 -0.08 1 40 MET -3.02 0.05 1 41 LEU -3.00 0.18 1 43 SER -0.20 -0.03 1 44 ALA 1.22 0.08 1 45 MET -4.96 0.28 1 46 SER 0.94 -0.08 1 47 ARG 2.29 -0.20 1 49 MET 1.09 0.28 1 50 MET -3.42 -0.07 1 51 HIS -1.58 0.23 1 52 PHE 0.59 -0.24 1 54 ASN -2.95 0.17 1 55 ASP 3.53 -0.15 1 56 TRP 5.17 -0.34 1 57 GLU 3.32 -0.86 1 58 ASP 4.84 -0.01 1 59 ARG 4.54 -0.33 1 60 TYR 4.53 -0.72 1 61 TYR 4.12 -0.32 1 62 ARG 5.12 -0.59 1 63 GLU 1.23 -0.29 1 64 ASN -0.85 -0.14 1 65 MET 5.00 -0.79 1 66 ASN 3.13 -0.26 1 67 ARG 0.99 -0.07 1 68 TYR 0.61 0.19 1 70 ASN -0.62 0.02 1 71 GLN -5.62 0.27 1 72 VAL -4.41 0.83 1 73 TYR -4.40 1.03 1 74 TYR -2.95 0.32 1 75 ARG 0.67 0.04 1 77 VAL 4.00 0.15 1 78 ASP 1.90 -0.16 1 79 GLN 2.06 -0.21 1 80 TYR -4.01 0.34 1 81 ASN 0.35 0.10 1 82 ASN -1.80 0.05 1 83 GLN 3.35 -1.36 1 84 ASN 4.39 -0.45 1 85 ASN 3.56 -0.11 1 87 VAL 6.61 -0.69 1 88 HIS 5.05 -0.39 1 89 ASP 3.18 -0.02 1 91 VAL 5.12 -0.44 1 92 ASN 3.58 -0.37 1 93 ILE 3.67 -0.41 1 94 THR 8.25 -0.24 1 95 ILE 7.12 -0.44 1 96 LYS 4.82 -0.23 1 97 GLN 3.50 -0.26 1 98 HIS 1.83 -0.07 1 99 THR 4.23 -0.13 1 100 VAL 4.11 -0.09 1 101 THR 3.16 -0.11 1 102 THR 3.25 -0.15 1 103 THR 3.23 0.07 1 104 THR 2.86 -0.09 1 105 LYS 0.83 0.09 1 107 GLU -1.92 -0.05 1 108 ASN -1.96 -0.02 1 109 PHE -1.51 0.68 1 110 THR -3.69 0.33 1 111 GLU 4.25 -0.24 1 112 THR 6.17 -0.50 1 113 ASP 3.26 -0.02 1 114 ILE 5.51 -0.64 1 115 LYS 4.07 -0.23 1 116 ILE 5.10 -0.54 1 117 MET 4.10 -0.90 1 118 GLU 5.27 -0.62 1 119 ARG 2.87 -0.11 1 120 VAL 4.03 -0.34 1 121 VAL 5.75 -0.38 1 122 GLU 5.44 -0.72 1 123 GLN 5.21 -0.22 1 124 MET 3.11 -0.32 1 126 THR 7.90 -0.53 1 127 THR 6.58 -0.39 1 128 GLN 4.55 -0.64 1 129 TYR 5.92 -1.59 1 130 GLN 5.12 -0.60 1 131 LYS 3.72 -0.31 1 132 GLU 1.45 -0.25 1 133 SER 3.74 -0.48 1 134 GLN 3.04 -0.18 1 135 ALA 1.81 -0.09 1 136 TYR 1.63 -0.22 1 137 TYR 1.75 -0.16 1 138 ASP 0.97 -0.08 1 140 ARG 0.45 0.02 1 141 ARG -0.10 0.11 1 142 SER 0.56 -0.16 1 stop_ save_