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 bmr5194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 -2.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 5.97 _LACS_plot.Line_2_terminator_val_y_2 4.24 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 ILE 1.61 -2.64 0 10 SER -5.84 -3.36 1 11 LEU -6.55 -2.15 1 12 ARG -4.90 -1.21 1 13 TYR -2.57 -1.57 1 14 VAL -1.16 -1.28 1 16 THR 4.29 2.65 1 17 ALA -2.45 -1.30 1 19 LYS -3.62 -1.19 1 20 LEU -5.17 -1.55 1 21 THR -0.59 0.31 1 22 VAL -4.31 -2.35 1 23 VAL -1.26 -1.86 1 25 LEU 3.94 3.04 1 26 GLU -4.81 -1.66 1 27 ALA -5.28 -1.77 1 28 LYS -5.89 -1.21 1 29 ASN 2.52 0.61 1 30 LEU -0.53 -0.18 1 31 LYS -1.63 0.35 1 32 LYS 0.91 0.73 1 33 MET -1.35 -1.67 1 34 ASP -2.38 -1.55 1 35 VAL 4.09 2.37 1 38 LEU -1.38 -1.65 1 39 SER -5.80 -1.04 1 40 ASP -1.93 -0.34 1 42 TYR -5.53 -2.35 1 43 VAL -2.77 -2.12 1 44 LYS -4.45 -1.55 1 45 ILE -3.51 -1.02 1 46 HIS -6.27 -0.94 1 47 LEU -3.33 -1.71 1 48 MET -4.81 -1.80 1 49 GLN -2.56 0.20 1 50 ASN 2.16 0.95 1 52 LYS -2.85 -1.86 1 53 ARG 1.64 0.39 1 54 LEU 0.42 1.11 1 55 LYS -5.80 -1.74 1 56 LYS -3.49 -1.20 1 57 LYS -7.43 -2.69 1 58 LYS -4.59 -1.18 1 59 THR -4.20 -0.86 1 60 THR -0.10 0.97 1 61 ILE -1.35 -0.03 1 62 LYS -2.70 -4.10 1 63 LYS -1.42 -0.89 1 64 ASN 1.42 0.70 1 65 THR -0.06 -1.23 1 66 LEU -0.54 -2.41 1 67 ASN -2.58 -0.32 1 69 TYR -1.97 -0.23 1 70 TYR -0.43 1.16 1 71 ASN 2.27 0.81 1 72 GLU -4.54 -1.16 1 73 SER -2.46 -1.60 1 74 PHE -3.96 -0.66 1 75 SER -3.21 -1.09 1 76 PHE -5.57 -1.68 1 77 GLU -0.08 -0.66 1 78 VAL -3.88 -0.78 1 80 PHE 3.84 3.13 1 81 GLU 3.44 2.19 1 82 GLN -1.48 -0.66 1 83 ILE 0.28 -0.01 1 84 GLN 2.75 1.29 1 85 LYS -1.62 -1.18 1 86 VAL -2.89 -1.70 1 87 GLN -2.91 -1.34 1 88 VAL 0.08 -0.65 1 89 VAL -1.27 -1.05 1 90 VAL -1.64 -1.01 1 91 THR -1.22 -0.45 1 92 VAL -0.25 -1.14 1 93 LEU -2.35 0.05 1 94 ASP -5.22 -2.30 1 95 TYR 1.68 2.12 1 96 ASP -2.25 -1.03 1 97 LYS 1.02 1.37 1 98 ILE 0.03 -0.16 1 100 LYS -0.40 -0.08 1 101 ASN -2.08 -1.01 1 102 ASP -2.17 -0.27 1 103 ALA 1.29 0.05 1 104 ILE 3.40 3.39 1 106 LYS -7.12 -1.19 1 107 VAL -4.03 -1.48 1 108 PHE -7.15 -2.35 1 109 VAL -6.30 -4.10 1 111 TYR 2.50 1.70 1 112 ASN 2.70 0.70 1 113 SER -0.76 0.30 1 114 THR -4.66 -1.77 1 116 ALA 2.68 1.74 1 117 GLU 5.97 5.85 1 118 LEU 3.86 1.71 1 119 ARG 4.09 3.19 1 120 HIS -1.53 2.35 1 121 TRP 1.48 2.66 1 122 SER 4.70 3.60 1 123 ASP 4.43 3.38 1 124 MET 4.49 3.80 1 125 LEU 2.53 1.70 1 126 ALA -0.09 0.22 1 127 ASN -2.34 -0.34 1 129 ARG 4.70 2.72 1 130 ARG -2.58 -1.08 1 132 ILE -3.15 -2.82 1 133 ALA -2.79 -1.60 1 134 GLN -3.95 -0.75 1 135 TRP -0.15 0.43 1 136 HIS -4.38 0.00 1 137 THR 0.20 0.70 1 138 LEU 0.02 0.56 1 139 GLN -4.44 -1.96 1 140 VAL 1.32 0.81 1 141 GLU 3.91 4.00 1 142 GLU 4.15 3.29 1 143 GLU 2.32 1.85 1 144 VAL 5.07 3.78 1 145 ASP 5.39 3.24 1 146 ALA 3.19 2.09 1 147 MET 1.91 1.99 1 148 LEU 0.24 0.44 1 149 ALA 0.10 -0.27 1 150 VAL 0.98 0.47 1 151 LYS -0.22 -0.32 1 152 LYS 0.85 1.29 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 4.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 5.97 _LACS_plot.Line_2_terminator_val_y_2 -1.73 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 ILE 1.61 -4.25 0 10 SER -5.84 2.48 1 11 LEU -6.55 4.40 1 12 ARG -4.90 3.69 1 13 TYR -2.57 1.00 1 14 VAL -1.16 -0.12 1 16 THR 4.29 -1.64 1 17 ALA -2.45 1.15 1 19 LYS -3.62 2.43 1 20 LEU -5.17 3.62 1 21 THR -0.59 0.90 1 22 VAL -4.31 1.96 1 23 VAL -1.26 -0.60 1 25 LEU 3.94 -0.90 1 26 GLU -4.81 3.15 1 27 ALA -5.28 3.51 1 28 LYS -5.89 4.68 1 29 ASN 2.52 -1.91 1 30 LEU -0.53 0.35 1 31 LYS -1.63 1.98 1 32 LYS 0.91 -0.18 1 33 MET -1.35 -0.32 1 34 ASP -2.38 0.83 1 35 VAL 4.09 -1.72 1 38 LEU -1.38 -0.27 1 39 SER -5.80 4.76 1 40 ASP -1.93 1.59 1 42 TYR -5.53 3.18 1 43 VAL -2.77 0.65 1 44 LYS -4.45 2.90 1 45 ILE -3.51 2.49 1 46 HIS -6.27 5.33 1 47 LEU -3.33 1.62 1 48 MET -4.81 3.01 1 49 GLN -2.56 2.76 1 50 ASN 2.16 -1.21 1 52 LYS -2.85 0.99 1 53 ARG 1.64 -1.25 1 54 LEU 0.42 0.69 1 55 LYS -5.80 4.06 1 56 LYS -3.49 2.29 1 57 LYS -7.43 4.74 1 58 LYS -4.59 3.41 1 59 THR -4.20 3.34 1 60 THR -0.10 1.07 1 61 ILE -1.35 1.32 1 62 LYS -2.70 -1.40 1 63 LYS -1.42 0.53 1 64 ASN 1.42 -0.72 1 65 THR -0.06 -1.17 1 66 LEU -0.54 -1.87 1 67 ASN -2.58 2.26 1 69 TYR -1.97 1.74 1 70 TYR -0.43 1.59 1 71 ASN 2.27 -1.46 1 72 GLU -4.54 3.38 1 73 SER -2.46 0.86 1 74 PHE -3.96 3.30 1 75 SER -3.21 2.12 1 76 PHE -5.57 3.89 1 77 GLU -0.08 -0.58 1 78 VAL -3.88 3.10 1 80 PHE 3.84 -0.71 1 81 GLU 3.44 -1.25 1 82 GLN -1.48 0.82 1 83 ILE 0.28 -0.29 1 84 GLN 2.75 -1.46 1 85 LYS -1.62 0.44 1 86 VAL -2.89 1.19 1 87 GLN -2.91 1.57 1 88 VAL 0.08 -0.73 1 89 VAL -1.27 0.22 1 90 VAL -1.64 0.63 1 91 THR -1.22 0.77 1 92 VAL -0.25 -0.89 1 93 LEU -2.35 2.40 1 94 ASP -5.22 2.92 1 95 TYR 1.68 0.44 1 96 ASP -2.25 1.22 1 97 LYS 1.02 0.35 1 98 ILE 0.03 -0.19 1 100 LYS -0.40 0.32 1 101 ASN -2.08 1.07 1 102 ASP -2.17 1.90 1 103 ALA 1.29 -1.24 1 104 ILE 3.40 -0.01 1 106 LYS -7.12 5.93 1 107 VAL -4.03 2.55 1 108 PHE -7.15 4.80 1 109 VAL -6.30 2.20 1 111 TYR 2.50 -0.80 1 112 ASN 2.70 -2.00 1 113 SER -0.76 1.06 1 114 THR -4.66 2.89 1 116 ALA 2.68 -0.94 1 117 GLU 5.97 -0.12 1 118 LEU 3.86 -2.15 1 119 ARG 4.09 -0.90 1 120 HIS -1.53 3.88 1 121 TRP 1.48 1.18 1 122 SER 4.70 -1.10 1 123 ASP 4.43 -1.05 1 124 MET 4.49 -0.69 1 125 LEU 2.53 -0.83 1 126 ALA -0.09 0.31 1 127 ASN -2.34 2.00 1 129 ARG 4.70 -1.98 1 130 ARG -2.58 1.50 1 132 ILE -3.15 0.33 1 133 ALA -2.79 1.19 1 134 GLN -3.95 3.20 1 135 TRP -0.15 0.58 1 136 HIS -4.38 4.38 1 137 THR 0.20 0.50 1 138 LEU 0.02 0.54 1 139 GLN -4.44 2.48 1 140 VAL 1.32 -0.51 1 141 GLU 3.91 0.09 1 142 GLU 4.15 -0.86 1 143 GLU 2.32 -0.47 1 144 VAL 5.07 -1.29 1 145 ASP 5.39 -2.15 1 146 ALA 3.19 -1.10 1 147 MET 1.91 0.08 1 148 LEU 0.24 0.20 1 149 ALA 0.10 -0.37 1 150 VAL 0.98 -0.51 1 151 LYS -0.22 -0.10 1 152 LYS 0.85 0.44 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 0.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 5.97 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _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 117 GLU 5.97 -0.17 0 39 SER -5.80 0.02 0 21 THR -0.59 1.03 0 109 VAL -6.30 0.04 0 10 SER -5.84 1.50 0 11 LEU -6.55 0.88 1 12 ARG -4.90 0.48 1 13 TYR -2.57 1.04 1 14 VAL -1.16 -0.09 1 16 THR 4.29 -0.40 1 17 ALA -2.45 0.16 1 19 LYS -3.62 0.70 1 20 LEU -5.17 1.24 1 22 VAL -4.31 1.04 1 23 VAL -1.26 0.81 1 24 ILE 1.61 -0.06 1 25 LEU 3.94 -0.14 1 26 GLU -4.81 0.80 1 27 ALA -5.28 1.33 1 28 LYS -5.89 1.15 1 29 ASN 2.52 -0.49 1 30 LEU -0.53 0.24 1 31 LYS -1.63 -0.31 1 32 LYS 0.91 -0.48 1 33 MET -1.35 0.38 1 34 ASP -2.38 0.54 1 35 VAL 4.09 -0.36 1 38 LEU -1.38 0.38 1 40 ASP -1.93 1.09 1 42 TYR -5.53 0.30 1 43 VAL -2.77 0.81 1 44 LYS -4.45 0.56 1 45 ILE -3.51 0.63 1 46 HIS -6.27 0.73 1 47 LEU -3.33 0.51 1 48 MET -4.81 0.95 1 49 GLN -2.56 0.13 1 50 ASN 2.16 -0.40 1 52 LYS -2.85 0.18 1 53 ARG 1.64 0.06 1 54 LEU 0.42 0.07 1 55 LYS -5.80 0.44 1 56 LYS -3.49 1.04 1 57 LYS -7.43 0.45 1 58 LYS -4.59 1.07 1 59 THR -4.20 0.62 1 60 THR -0.10 -0.06 1 61 ILE -1.35 0.16 1 62 LYS -2.70 0.39 1 63 LYS -1.42 0.44 1 64 ASN 1.42 -0.44 1 65 THR -0.06 0.33 1 66 LEU -0.54 0.23 1 67 ASN -2.58 0.57 1 69 TYR -1.97 0.02 1 70 TYR -0.43 -0.01 1 71 ASN 2.27 -0.57 1 72 GLU -4.54 0.08 1 73 SER -2.46 0.37 1 74 PHE -3.96 -0.04 1 75 SER -3.21 1.11 1 76 PHE -5.57 0.26 1 77 GLU -0.08 0.61 1 78 VAL -3.88 0.05 1 80 PHE 3.84 0.14 1 81 GLU 3.44 -0.38 1 82 GLN -1.48 0.02 1 83 ILE 0.28 -0.18 1 84 GLN 2.75 0.20 1 85 LYS -1.62 -0.23 1 86 VAL -2.89 0.75 1 87 GLN -2.91 0.28 1 88 VAL 0.08 0.25 1 89 VAL -1.27 0.24 1 90 VAL -1.64 0.47 1 91 THR -1.22 0.47 1 92 VAL -0.25 0.53 1 93 LEU -2.35 0.55 1 94 ASP -5.22 0.14 1 95 TYR 1.68 -0.08 1 96 ASP -2.25 0.09 1 97 LYS 1.02 -0.39 1 98 ILE 0.03 -0.01 1 100 LYS -0.40 0.00 1 101 ASN -2.08 0.33 1 102 ASP -2.17 0.06 1 103 ALA 1.29 -0.01 1 104 ILE 3.40 -0.24 1 106 LYS -7.12 1.28 1 107 VAL -4.03 0.59 1 108 PHE -7.15 1.13 1 111 TYR 2.50 -0.43 1 112 ASN 2.70 -0.51 1 113 SER -0.76 -0.34 1 114 THR -4.66 0.46 1 116 ALA 2.68 -0.14 1 118 LEU 3.86 -0.09 1 119 ARG 4.09 -0.30 1 120 HIS -1.53 -0.09 1 121 TRP 1.48 -0.54 1 122 SER 4.70 -0.36 1 123 ASP 4.43 -0.18 1 124 MET 4.49 -0.48 1 125 LEU 2.53 -0.37 1 126 ALA -0.09 0.00 1 127 ASN -2.34 0.17 1 129 ARG 4.70 -0.77 1 130 ARG -2.58 0.27 1 132 ILE -3.15 0.39 1 133 ALA -2.79 0.73 1 134 GLN -3.95 -0.22 1 135 TRP -0.15 -0.01 1 136 HIS -4.38 0.15 1 137 THR 0.20 0.64 1 138 LEU 0.02 -0.33 1 139 GLN -4.44 0.40 1 140 VAL 1.32 -0.18 1 141 GLU 3.91 -0.75 1 142 GLU 4.15 -0.29 1 143 GLU 2.32 -0.21 1 144 VAL 5.07 -0.36 1 145 ASP 5.39 -0.46 1 146 ALA 3.19 -0.19 1 147 MET 1.91 -0.22 1 148 LEU 0.24 -0.68 1 149 ALA 0.10 -0.19 1 150 VAL 0.98 -0.22 1 151 LYS -0.22 0.03 1 152 LYS 0.85 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.43 _LACS_plot.Line_1_terminator_val_y_1 -3.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.36 _LACS_plot.Line_2_terminator_val_x_2 5.97 _LACS_plot.Line_2_terminator_val_y_2 1.60 _LACS_plot.Y_axis_chem_shift_offset 0.61 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 152 LYS 0.85 4.99 0 10 SER -5.84 -1.66 1 11 LEU -6.55 -2.63 1 12 ARG -4.90 -2.82 1 13 TYR -2.57 -1.57 1 14 VAL -1.16 -0.38 1 16 THR 4.29 0.24 1 17 ALA -2.45 -0.69 1 19 LYS -3.62 -2.65 1 20 LEU -5.17 -2.78 1 21 THR -0.59 -1.02 1 22 VAL -4.31 -1.71 1 23 VAL -1.26 1.36 1 24 ILE 1.61 -1.20 1 25 LEU 3.94 -2.25 1 26 GLU -4.81 -4.26 1 27 ALA -5.28 -3.24 1 28 LYS -5.89 -2.32 1 29 ASN 2.52 -1.32 1 30 LEU -0.53 -0.87 1 31 LYS -1.63 -1.14 1 32 LYS 0.91 0.24 1 33 MET -1.35 -0.04 1 34 ASP -2.38 -1.15 1 35 VAL 4.09 1.54 1 38 LEU -1.38 -5.04 1 39 SER -5.80 -4.48 1 40 ASP -1.93 -1.41 1 42 TYR -5.53 -4.89 1 43 VAL -2.77 -1.46 1 44 LYS -4.45 -1.80 1 45 ILE -3.51 -1.83 1 46 HIS -6.27 -0.56 1 47 LEU -3.33 -2.19 1 48 MET -4.81 -1.64 1 49 GLN -2.56 -0.18 1 50 ASN 2.16 -0.48 1 52 LYS -2.85 -1.06 1 53 ARG 1.64 -0.72 1 54 LEU 0.42 -0.29 1 55 LYS -5.80 -2.23 1 56 LYS -3.49 -1.85 1 57 LYS -7.43 -1.82 1 58 LYS -4.59 -1.76 1 59 THR -4.20 1.00 1 60 THR -0.10 -0.95 1 61 ILE -1.35 0.45 1 62 LYS -2.70 -2.50 1 63 LYS -1.42 0.87 1 64 ASN 1.42 -1.83 1 65 THR -0.06 -4.68 1 66 LEU -0.54 -1.92 1 67 ASN -2.58 -1.78 1 69 TYR -1.97 -1.47 1 70 TYR -0.43 -0.62 1 71 ASN 2.27 -1.61 1 72 GLU -4.54 -3.46 1 73 SER -2.46 -1.65 1 74 PHE -3.96 -2.24 1 75 SER -3.21 -2.35 1 76 PHE -5.57 -1.30 1 77 GLU -0.08 -1.01 1 78 VAL -3.88 -3.00 1 80 PHE 3.84 1.85 1 81 GLU 3.44 0.41 1 82 GLN -1.48 1.71 1 83 ILE 0.28 -1.52 1 84 GLN 2.75 0.51 1 85 LYS -1.62 -0.66 1 86 VAL -2.89 -1.40 1 87 GLN -2.91 -1.50 1 88 VAL 0.08 -2.30 1 89 VAL -1.27 -1.37 1 90 VAL -1.64 -2.63 1 91 THR -1.22 -1.68 1 92 VAL -0.25 -1.90 1 93 LEU -2.35 -4.16 1 94 ASP -5.22 -1.29 1 95 TYR 1.68 -0.53 1 96 ASP -2.25 -2.99 1 97 LYS 1.02 -0.87 1 98 ILE 0.03 -0.21 1 100 LYS -0.40 -1.25 1 101 ASN -2.08 -1.60 1 102 ASP -2.17 -1.10 1 103 ALA 1.29 -0.69 1 104 ILE 3.40 -0.24 1 106 LYS -7.12 -3.00 1 107 VAL -4.03 -4.16 1 108 PHE -7.15 -4.19 1 109 VAL -6.30 -3.00 1 111 TYR 2.50 -0.55 1 113 SER -0.76 -1.97 1 114 THR -4.66 1.32 1 116 ALA 2.68 1.93 1 117 GLU 5.97 -0.55 1 118 LEU 3.86 2.04 1 119 ARG 4.09 0.99 1 120 HIS -1.53 3.15 1 121 TRP 1.48 0.84 1 122 SER 4.70 2.90 1 123 ASP 4.43 2.60 1 124 MET 4.49 2.63 1 125 LEU 2.53 0.65 1 126 ALA -0.09 -0.98 1 127 ASN -2.34 -2.90 1 129 ARG 4.70 -1.39 1 130 ARG -2.58 -1.40 1 132 ILE -3.15 0.11 1 133 ALA -2.79 -2.52 1 134 GLN -3.95 -2.25 1 135 TRP -0.15 0.20 1 136 HIS -4.38 -0.50 1 137 THR 0.20 -0.30 1 138 LEU 0.02 -2.12 1 139 GLN -4.44 -0.79 1 140 VAL 1.32 1.80 1 141 GLU 3.91 0.28 1 142 GLU 4.15 2.51 1 143 GLU 2.32 2.26 1 144 VAL 5.07 1.68 1 145 ASP 5.39 2.65 1 146 ALA 3.19 2.10 1 147 MET 1.91 1.69 1 148 LEU 0.24 -0.68 1 149 ALA 0.10 -0.72 1 150 VAL 0.98 -0.51 1 151 LYS -0.22 -1.35 1 stop_ save_