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 bmr17109_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.46 _LACS_plot.Line_1_terminator_val_y_1 -3.06 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.73 _LACS_plot.Line_2_terminator_val_x_2 6.46 _LACS_plot.Line_2_terminator_val_y_2 3.83 _LACS_plot.Y_axis_chem_shift_offset 0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ILE 4.73 -0.14 0 10 HIS -0.99 -1.07 1 11 LYS -2.41 -1.96 1 12 GLU 2.40 1.75 1 14 GLU -2.05 -0.96 1 15 LYS 2.32 0.90 1 16 VAL -4.04 -2.06 1 17 ALA -5.15 -1.40 1 18 MET -3.93 -1.79 1 19 LEU -4.55 -2.25 1 20 ASN -3.83 -1.76 1 21 ILE 0.76 -0.46 1 23 LYS 2.37 2.44 1 24 LEU -2.20 -2.13 1 25 LYS 4.58 0.40 1 26 LYS -6.79 -2.41 1 27 LYS -5.07 -2.32 1 28 PHE -4.73 -1.60 1 29 SER 1.03 1.66 1 30 ILE -2.53 -3.33 1 31 TYR -4.12 -1.78 1 32 TRP -0.17 -0.10 1 34 ALA -2.44 -2.59 1 35 ASP -1.58 -1.17 1 36 ASP 2.24 0.98 1 37 ALA 2.56 1.47 1 43 VAL -1.13 -1.12 1 45 MET -2.97 -1.32 1 46 PHE 0.55 1.59 1 47 VAL 0.15 -0.75 1 48 SER -2.84 -0.92 1 49 ASP 1.91 1.02 1 50 VAL -0.53 -1.36 1 51 THR -5.18 -3.31 1 52 THR -5.13 -2.02 1 53 THR 3.73 1.12 1 55 SER 0.64 -0.21 1 59 HIS -3.43 -2.18 1 60 THR -0.46 -0.44 1 61 VAL -2.82 -2.39 1 62 LEU -4.90 -3.96 1 63 SER -4.51 -3.41 1 75 GLN 0.41 0.32 1 76 LEU 0.16 -0.52 1 77 LYS -6.14 -2.86 1 78 GLU 4.22 2.60 1 79 LYS 6.47 3.03 1 80 ASP 0.78 1.46 1 81 THR -2.16 -0.70 1 82 LEU -4.64 -1.38 1 83 VAL -3.06 -1.04 1 84 LEU -6.35 -1.94 1 85 GLU -2.88 -1.88 1 86 TYR -3.30 -0.38 1 87 ASP 1.85 0.41 1 88 ASN 2.95 1.43 1 89 LYS -4.43 -1.07 1 90 THR 0.03 -0.06 1 91 TYR -3.39 -1.14 1 92 THR -0.23 -0.48 1 93 TYR -5.93 -2.10 1 94 GLU -6.42 -2.53 1 95 ILE 4.89 3.56 1 96 GLN -2.83 -1.07 1 97 LYS -3.03 0.33 1 98 ILE -4.30 -1.02 1 99 TRP -2.67 -1.11 1 100 ILE -4.06 -2.13 1 101 THR -5.10 -4.24 1 102 HIS -2.65 -0.41 1 103 ALA 3.56 2.44 1 104 ASP -0.06 -1.13 1 105 ASP 1.32 0.07 1 106 ARG 1.53 -0.11 1 107 THR 1.41 0.55 1 108 VAL 2.11 1.68 1 110 ILE -6.52 -3.17 1 111 LYS 0.51 0.50 1 112 LYS -5.92 -2.93 1 113 GLU -0.63 -1.43 1 114 GLU -2.86 -1.57 1 116 ILE -6.74 -4.12 1 117 LEU -6.09 -3.04 1 118 THR 0.04 -1.20 1 119 LEU -4.63 -2.66 1 120 THR -4.78 -4.44 1 121 THR -4.15 -2.25 1 125 PHE 2.20 1.22 1 126 ASP -0.58 -2.23 1 127 TYR 0.30 0.83 1 128 ILE 0.74 -0.94 1 130 ASP 0.26 -0.86 1 131 ALA -0.90 -2.31 1 133 ASP -5.13 -1.13 1 134 ARG -4.93 -2.04 1 135 TYR -2.20 -0.48 1 136 ILE -4.33 -2.13 1 137 ILE -3.20 -1.23 1 138 GLU -5.70 -1.70 1 139 ALA -7.46 -2.30 1 140 LYS -3.79 -1.95 1 141 LEU 1.06 1.07 1 142 THR -0.58 -0.89 1 144 SER -3.70 -1.91 1 145 TYR -2.79 -1.49 1 146 SER -0.41 -0.30 1 147 LYS 1.68 1.49 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17109_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.46 _LACS_plot.Line_1_terminator_val_y_1 4.40 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.46 _LACS_plot.Line_2_terminator_val_y_2 -2.63 _LACS_plot.Y_axis_chem_shift_offset 0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ILE 4.73 -4.87 0 10 HIS -0.99 -0.08 1 11 LYS -2.41 0.45 1 12 GLU 2.40 -0.65 1 14 GLU -2.05 1.09 1 15 LYS 2.32 -1.42 1 16 VAL -4.04 1.98 1 17 ALA -5.15 3.75 1 18 MET -3.93 2.14 1 19 LEU -4.55 2.30 1 20 ASN -3.83 2.07 1 21 ILE 0.76 -1.22 1 23 LYS 2.37 0.07 1 24 LEU -2.20 0.07 1 25 LYS 4.58 -4.18 1 26 LYS -6.79 4.38 1 27 LYS -5.07 2.75 1 28 PHE -4.73 3.13 1 29 SER 1.03 0.63 1 30 ILE -2.53 -0.80 1 31 TYR -4.12 2.34 1 32 TRP -0.17 0.07 1 34 ALA -2.44 -0.15 1 35 ASP -1.58 0.41 1 36 ASP 2.24 -1.26 1 37 ALA 2.56 -1.09 1 43 VAL -1.13 0.01 1 45 MET -2.97 1.65 1 46 PHE 0.55 1.04 1 47 VAL 0.15 -0.90 1 48 SER -2.84 1.92 1 49 ASP 1.91 -0.89 1 50 VAL -0.53 -0.83 1 51 THR -5.18 1.87 1 52 THR -5.13 3.11 1 53 THR 3.73 -2.61 1 55 SER 0.64 -0.85 1 59 HIS -3.43 1.25 1 60 THR -0.46 0.02 1 61 VAL -2.82 0.43 1 62 LEU -4.90 0.94 1 63 SER -4.51 1.10 1 75 GLN 0.41 -0.09 1 76 LEU 0.16 -0.68 1 77 LYS -6.14 3.28 1 78 GLU 4.22 -1.62 1 79 LYS 6.47 -3.44 1 80 ASP 0.78 0.68 1 81 THR -2.16 1.46 1 82 LEU -4.64 3.26 1 83 VAL -3.06 2.02 1 84 LEU -6.35 4.41 1 85 GLU -2.88 1.00 1 86 TYR -3.30 2.92 1 87 ASP 1.85 -1.44 1 88 ASN 2.95 -1.52 1 89 LYS -4.43 3.36 1 90 THR 0.03 -0.09 1 91 TYR -3.39 2.25 1 92 THR -0.23 -0.25 1 93 TYR -5.93 3.83 1 94 GLU -6.42 3.89 1 95 ILE 4.89 -1.33 1 96 GLN -2.83 1.76 1 97 LYS -3.03 3.36 1 98 ILE -4.30 3.28 1 99 TRP -2.67 1.56 1 100 ILE -4.06 1.93 1 101 THR -5.10 0.86 1 102 HIS -2.65 2.24 1 103 ALA 3.56 -1.12 1 104 ASP -0.06 -1.07 1 105 ASP 1.32 -1.25 1 106 ARG 1.53 -1.64 1 107 THR 1.41 -0.86 1 108 VAL 2.11 -0.43 1 110 ILE -6.52 3.35 1 111 LYS 0.51 -0.01 1 112 LYS -5.92 2.99 1 113 GLU -0.63 -0.80 1 114 GLU -2.86 1.29 1 116 ILE -6.74 2.62 1 117 LEU -6.09 3.05 1 118 THR 0.04 -1.24 1 119 LEU -4.63 1.97 1 120 THR -4.78 0.34 1 121 THR -4.15 1.90 1 125 PHE 2.20 -0.98 1 126 ASP -0.58 -1.65 1 127 TYR 0.30 0.53 1 128 ILE 0.74 -1.68 1 130 ASP 0.26 -1.12 1 131 ALA -0.90 -1.41 1 133 ASP -5.13 4.00 1 134 ARG -4.93 2.89 1 135 TYR -2.20 1.72 1 136 ILE -4.33 2.20 1 137 ILE -3.20 1.97 1 138 GLU -5.70 4.00 1 139 ALA -7.46 5.16 1 140 LYS -3.79 1.84 1 141 LEU 1.06 0.01 1 142 THR -0.58 -0.31 1 144 SER -3.70 1.79 1 145 TYR -2.79 1.30 1 146 SER -0.41 0.11 1 147 LYS 1.68 -0.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17109_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.46 _LACS_plot.Line_1_terminator_val_y_1 0.94 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _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 6.46 _LACS_plot.Line_2_terminator_val_y_2 -0.80 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 118 THR 0.04 1.10 0 10 HIS -0.99 -0.32 1 11 LYS -2.41 0.15 1 12 GLU 2.40 -0.11 1 14 GLU -2.05 0.15 1 15 LYS 2.32 -0.22 1 16 VAL -4.04 0.45 1 17 ALA -5.15 0.87 1 18 MET -3.93 0.82 1 19 LEU -4.55 0.93 1 20 ASN -3.83 0.60 1 21 ILE 0.76 0.38 1 23 LYS 2.37 -0.34 1 24 LEU -2.20 -0.02 1 25 LYS 4.58 -0.47 1 26 LYS -6.79 0.24 1 27 LYS -5.07 1.13 1 28 PHE -4.73 0.25 1 29 SER 1.03 0.38 1 30 ILE -2.53 0.77 1 31 TYR -4.12 0.75 1 32 TRP -0.17 -0.08 1 34 ALA -2.44 0.13 1 35 ASP -1.58 -0.19 1 36 ASP 2.24 -0.30 1 37 ALA 2.56 -0.26 1 43 VAL -1.13 0.36 1 45 MET -2.97 0.26 1 46 PHE 0.55 -0.97 1 47 VAL 0.15 -0.46 1 48 SER -2.84 0.16 1 49 ASP 1.91 -0.04 1 50 VAL -0.53 0.36 1 51 THR -5.18 0.94 1 52 THR -5.13 0.64 1 53 THR 3.73 -0.01 1 55 SER 0.64 0.01 1 59 HIS -3.43 0.43 1 60 THR -0.46 0.52 1 61 VAL -2.82 0.52 1 62 LEU -4.90 1.00 1 63 SER -4.51 0.86 1 75 GLN 0.41 -0.11 1 76 LEU 0.16 0.03 1 77 LYS -6.14 0.22 1 78 GLU 4.22 -0.83 1 79 LYS 6.47 -0.57 1 80 ASP 0.78 0.31 1 81 THR -2.16 0.97 1 82 LEU -4.64 0.50 1 83 VAL -3.06 1.15 1 84 LEU -6.35 1.31 1 85 GLU -2.88 0.94 1 86 TYR -3.30 0.28 1 87 ASP 1.85 -0.72 1 88 ASN 2.95 -0.55 1 89 LYS -4.43 0.42 1 90 THR 0.03 0.47 1 91 TYR -3.39 0.07 1 92 THR -0.23 0.59 1 93 TYR -5.93 0.88 1 94 GLU -6.42 0.55 1 95 ILE 4.89 -0.43 1 96 GLN -2.83 0.49 1 97 LYS -3.03 0.34 1 98 ILE -4.30 1.05 1 99 TRP -2.67 0.00 1 100 ILE -4.06 0.45 1 101 THR -5.10 0.40 1 102 HIS -2.65 0.67 1 103 ALA 3.56 -0.61 1 104 ASP -0.06 -0.04 1 105 ASP 1.32 -0.47 1 106 ARG 1.53 0.03 1 107 THR 1.41 -0.19 1 108 VAL 2.11 -0.18 1 109 ILE 4.73 -0.71 1 110 ILE -6.52 0.37 1 111 LYS 0.51 0.29 1 112 LYS -5.92 0.41 1 113 GLU -0.63 0.02 1 114 GLU -2.86 0.07 1 116 ILE -6.74 0.62 1 117 LEU -6.09 0.97 1 119 LEU -4.63 0.76 1 120 THR -4.78 1.24 1 121 THR -4.15 0.42 1 125 PHE 2.20 -0.20 1 126 ASP -0.58 -0.09 1 127 TYR 0.30 -0.58 1 128 ILE 0.74 -0.09 1 130 ASP 0.26 0.00 1 131 ALA -0.90 -0.65 1 133 ASP -5.13 0.87 1 134 ARG -4.93 0.56 1 135 TYR -2.20 -0.49 1 136 ILE -4.33 -0.04 1 137 ILE -3.20 0.16 1 138 GLU -5.70 0.87 1 139 ALA -7.46 0.91 1 140 LYS -3.79 0.74 1 141 LEU 1.06 -0.23 1 142 THR -0.58 0.20 1 144 SER -3.70 0.59 1 145 TYR -2.79 0.20 1 146 SER -0.41 0.09 1 147 LYS 1.68 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17109_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.46 _LACS_plot.Line_1_terminator_val_y_1 -162.29 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -160.38 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -161.17 _LACS_plot.Line_2_terminator_val_x_2 6.46 _LACS_plot.Line_2_terminator_val_y_2 -159.64 _LACS_plot.Y_axis_chem_shift_offset 160.80 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 HIS -2.65 -157.32 0 87 ASP 1.85 -164.53 0 52 THR -5.13 -157.64 0 109 ILE 4.73 -163.21 0 99 TRP -2.67 -165.75 0 10 HIS -0.99 -160.36 1 11 LYS -2.41 -160.39 1 12 GLU 2.40 -158.58 1 14 GLU -2.05 -160.16 1 15 LYS 2.32 -159.63 1 16 VAL -4.04 -162.15 1 17 ALA -5.15 -163.14 1 18 MET -3.93 -161.89 1 19 LEU -4.55 -163.98 1 20 ASN -3.83 -160.88 1 21 ILE 0.76 -160.59 1 23 LYS 2.37 -159.37 1 24 LEU -2.20 -162.04 1 25 LYS 4.58 -161.30 1 26 LYS -6.79 -162.64 1 27 LYS -5.07 -161.12 1 28 PHE -4.73 -160.32 1 29 SER 1.03 -162.59 1 30 ILE -2.53 -161.53 1 31 TYR -4.12 -161.09 1 32 TRP -0.17 -160.91 1 34 ALA -2.44 -161.63 1 35 ASP -1.58 -160.31 1 36 ASP 2.24 -159.00 1 37 ALA 2.56 -158.20 1 43 VAL -1.13 -161.99 1 45 MET -2.97 -162.43 1 46 PHE 0.55 -160.78 1 47 VAL 0.15 -162.07 1 48 SER -2.84 -161.43 1 49 ASP 1.91 -161.76 1 50 VAL -0.53 -161.81 1 51 THR -5.18 -160.11 1 53 THR 3.73 -157.11 1 55 SER 0.64 -158.35 1 59 HIS -3.43 -159.17 1 60 THR -0.46 -162.85 1 61 VAL -2.82 -162.51 1 62 LEU -4.90 -162.05 1 63 SER -4.51 -160.02 1 75 GLN 0.41 -158.68 1 76 LEU 0.16 -161.96 1 77 LYS -6.14 -161.05 1 78 GLU 4.22 -159.55 1 79 LYS 6.47 -160.17 1 80 ASP 0.78 -160.41 1 81 THR -2.16 -160.48 1 82 LEU -4.64 -162.75 1 83 VAL -3.06 -161.53 1 84 LEU -6.35 -161.96 1 85 GLU -2.88 -160.69 1 86 TYR -3.30 -161.82 1 88 ASN 2.95 -161.21 1 89 LYS -4.43 -161.96 1 90 THR 0.03 -161.88 1 91 TYR -3.39 -161.59 1 92 THR -0.23 -162.24 1 93 TYR -5.93 -161.05 1 94 GLU -6.42 -159.54 1 95 ILE 4.89 -160.14 1 96 GLN -2.83 -161.33 1 97 LYS -3.03 -163.40 1 98 ILE -4.30 -160.58 1 100 ILE -4.06 -160.14 1 101 THR -5.10 -162.63 1 103 ALA 3.56 -160.21 1 104 ASP -0.06 -161.02 1 105 ASP 1.32 -158.63 1 106 ARG 1.53 -158.59 1 107 THR 1.41 -161.15 1 108 VAL 2.11 -159.45 1 110 ILE -6.52 -162.00 1 111 LYS 0.51 -160.07 1 112 LYS -5.92 -160.60 1 113 GLU -0.63 -162.12 1 114 GLU -2.86 -162.52 1 116 ILE -6.74 -163.41 1 117 LEU -6.09 -163.11 1 118 THR 0.04 -161.53 1 119 LEU -4.63 -163.20 1 120 THR -4.78 -161.97 1 121 THR -4.15 -160.56 1 125 PHE 2.20 -159.72 1 126 ASP -0.58 -161.01 1 127 TYR 0.30 -160.88 1 128 ILE 0.74 -161.82 1 130 ASP 0.26 -161.72 1 131 ALA -0.90 -161.01 1 133 ASP -5.13 -160.31 1 134 ARG -4.93 -164.01 1 135 TYR -2.20 -162.09 1 136 ILE -4.33 -162.79 1 137 ILE -3.20 -162.88 1 138 GLU -5.70 -161.22 1 139 ALA -7.46 -164.01 1 140 LYS -3.79 -160.79 1 141 LEU 1.06 -160.36 1 142 THR -0.58 -159.51 1 144 SER -3.70 -161.42 1 145 TYR -2.79 -161.32 1 147 LYS 1.68 -158.10 1 stop_ save_