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 bmr18547_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 5.27 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 PHE -0.70 -2.70 0 140 GLU 5.60 6.30 0 106 GLU -5.60 0.60 0 68 LEU 3.50 -0.60 0 11 MET -0.40 0.00 1 12 ALA 0.00 0.10 1 13 SER 0.20 0.20 1 15 GLN -0.40 -0.10 1 16 ALA -0.30 -0.20 1 17 THR 0.60 1.40 1 18 GLU -3.50 -1.50 1 19 ARG -1.90 -1.20 1 20 ALA -5.10 -1.40 1 21 LEU -5.00 -2.00 1 23 ARG -2.90 -0.20 1 24 ARG -4.60 -0.80 1 25 THR 3.00 1.80 1 26 ILE 1.10 0.60 1 28 ALA 0.20 0.60 1 30 GLU 1.50 0.70 1 31 ALA -4.70 -1.30 1 32 ARG -2.10 -0.50 1 33 SER -6.20 -2.70 1 34 ILE -3.90 -2.80 1 35 ILE -2.90 -0.40 1 36 ILE -4.50 -1.20 1 37 ARG -3.90 -1.90 1 38 GLN -7.10 -1.30 1 39 ARG -2.50 -0.90 1 40 TYR -4.90 -1.00 1 41 ASP 0.90 -1.00 1 42 ALA -2.50 -0.40 1 44 VAL 4.70 3.80 1 45 ASP 4.00 3.30 1 46 GLU 2.00 1.80 1 47 VAL 6.60 4.70 1 48 TRP 3.70 3.40 1 49 SER 5.50 4.40 1 50 ALA 3.00 2.70 1 52 THR -1.60 0.40 1 53 ASP -2.70 -1.60 1 55 ASN 2.00 2.00 1 56 ARG 1.50 2.40 1 57 ILE 2.60 3.30 1 58 ASN 2.00 1.30 1 59 ARG 0.90 -0.10 1 60 TRP -3.60 -1.70 1 62 ILE -4.00 -1.20 1 63 GLU -1.90 0.60 1 65 LYS -4.20 -2.00 1 67 ASP -1.40 -1.80 1 69 ARG -2.80 -1.90 1 70 GLU 3.10 3.40 1 73 ASN -2.80 -0.20 1 74 PHE -6.80 -1.80 1 75 ALA -2.70 0.00 1 76 LEU -2.60 -2.60 1 77 GLN 3.50 2.10 1 79 ASN -2.90 -0.20 1 80 ALA 0.50 0.00 1 81 SER -4.80 -2.00 1 83 ASP -4.00 -1.50 1 84 ILE 2.70 0.60 1 85 LEU 2.30 1.90 1 86 ARG -4.30 -1.30 1 88 GLU -3.40 -2.10 1 91 ARG -1.90 1.40 1 92 ARG -3.30 -0.10 1 93 LEU -6.10 -1.40 1 94 THR 1.10 0.90 1 95 ILE -3.90 -1.80 1 96 SER -2.60 -0.70 1 97 TRP -1.50 0.40 1 98 VAL 0.20 -0.20 1 99 TYR -4.40 -1.10 1 100 GLU 2.40 1.70 1 102 LYS -2.30 -1.70 1 104 ASP 2.30 1.70 1 105 SER -2.20 -0.40 1 107 VAL -3.40 -2.10 1 108 GLU -7.70 -2.40 1 109 LEU -6.40 -2.40 1 110 ARG -4.60 -1.40 1 111 LEU -4.60 -2.10 1 112 SER -3.20 -1.30 1 113 GLU 0.60 0.90 1 114 GLU -2.30 -0.90 1 116 ASP 0.40 0.10 1 118 THR -1.50 1.70 1 119 LEU -1.30 -0.80 1 120 LEU -3.10 -0.20 1 121 GLU -5.30 -2.10 1 122 LEU -4.90 -1.90 1 123 GLU -7.10 -3.70 1 124 HIS -6.30 -0.70 1 125 ALA -5.80 -2.40 1 126 THR -2.40 -3.00 1 127 THR 2.10 1.10 1 128 SER -2.10 -2.90 1 129 GLU 3.50 3.30 1 130 GLN 4.10 2.70 1 131 MET 2.40 1.90 1 132 LEU 3.70 3.20 1 133 VAL 5.50 4.40 1 134 GLU 2.70 2.70 1 135 VAL 4.10 1.60 1 137 VAL 5.60 5.20 1 139 TRP 1.80 2.30 1 141 MET 4.60 2.30 1 142 ALA 4.10 3.20 1 143 LEU 4.00 2.20 1 144 ASP 4.90 3.60 1 145 PHE 4.20 4.00 1 146 LEU 6.90 3.30 1 148 MET 2.40 4.00 1 149 PHE 3.50 3.10 1 150 ILE 3.70 2.00 1 151 ARG 0.90 1.50 1 153 ASP -1.00 0.00 1 154 LEU -1.10 -0.30 1 159 VAL -0.00 -0.00 1 161 GLU 0.80 0.80 1 162 ASP 0.10 0.00 1 163 ALA 0.10 0.20 1 164 ALA -0.10 0.10 1 165 GLU -0.50 -0.10 1 166 GLU -0.70 -0.30 1 167 PHE -0.30 0.00 1 168 GLU -1.70 -0.50 1 170 SER -0.10 -0.20 1 172 GLU 3.20 2.70 1 173 MET 3.20 2.80 1 174 MET 3.80 2.80 1 175 ARG 4.40 3.40 1 176 ILE 4.30 3.40 1 177 SER 5.20 4.20 1 178 GLN 4.90 3.50 1 179 GLU 3.10 2.90 1 180 ARG 4.20 3.90 1 182 GLU 3.30 2.70 1 183 ALA 4.50 2.50 1 184 TRP 1.90 3.10 1 185 ALA 4.30 3.10 1 186 ALA 3.50 2.30 1 187 LEU 2.20 2.50 1 188 VAL 4.30 3.80 1 189 HIS 1.70 1.20 1 190 SER 1.00 1.20 1 192 SER 0.60 1.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18547_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 5.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.75 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -1.63 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 PHE -0.70 -2.00 0 140 GLU 5.60 0.70 0 106 GLU -5.60 6.20 0 68 LEU 3.50 -4.10 0 11 MET -0.40 0.40 1 12 ALA 0.00 0.10 1 13 SER 0.20 0.00 1 15 GLN -0.40 0.30 1 16 ALA -0.30 0.10 1 17 THR 0.60 0.80 1 18 GLU -3.50 2.00 1 19 ARG -1.90 0.70 1 20 ALA -5.10 3.70 1 21 LEU -5.00 3.00 1 23 ARG -2.90 2.70 1 24 ARG -4.60 3.80 1 25 THR 3.00 -1.20 1 26 ILE 1.10 -0.50 1 28 ALA 0.20 0.40 1 30 GLU 1.50 -0.80 1 31 ALA -4.70 3.40 1 32 ARG -2.10 1.60 1 33 SER -6.20 3.50 1 34 ILE -3.90 1.10 1 35 ILE -2.90 2.50 1 36 ILE -4.50 3.30 1 37 ARG -3.90 2.00 1 38 GLN -7.10 5.80 1 39 ARG -2.50 1.60 1 40 TYR -4.90 3.90 1 41 ASP 0.90 -1.90 1 42 ALA -2.50 2.10 1 44 VAL 4.70 -0.90 1 45 ASP 4.00 -0.70 1 46 GLU 2.00 -0.20 1 47 VAL 6.60 -1.90 1 48 TRP 3.70 -0.30 1 49 SER 5.50 -1.10 1 50 ALA 3.00 -0.30 1 52 THR -1.60 2.00 1 53 ASP -2.70 1.10 1 55 ASN 2.00 0.00 1 56 ARG 1.50 0.90 1 57 ILE 2.60 0.70 1 58 ASN 2.00 -0.70 1 59 ARG 0.90 -1.00 1 60 TRP -3.60 1.90 1 62 ILE -4.00 2.80 1 63 GLU -1.90 2.50 1 65 LYS -4.20 2.20 1 67 ASP -1.40 -0.40 1 69 ARG -2.80 0.90 1 70 GLU 3.10 0.30 1 73 ASN -2.80 2.60 1 74 PHE -6.80 5.00 1 75 ALA -2.70 2.70 1 76 LEU -2.60 0.00 1 77 GLN 3.50 -1.40 1 79 ASN -2.90 2.70 1 80 ALA 0.50 -0.50 1 81 SER -4.80 2.80 1 83 ASP -4.00 2.50 1 84 ILE 2.70 -2.10 1 85 LEU 2.30 -0.40 1 86 ARG -4.30 3.00 1 88 GLU -3.40 1.30 1 91 ARG -1.90 3.30 1 92 ARG -3.30 3.20 1 93 LEU -6.10 4.70 1 94 THR 1.10 -0.20 1 95 ILE -3.90 2.10 1 96 SER -2.60 1.90 1 97 TRP -1.50 1.90 1 98 VAL 0.20 -0.40 1 99 TYR -4.40 3.30 1 100 GLU 2.40 -0.70 1 102 LYS -2.30 0.60 1 104 ASP 2.30 -0.60 1 105 SER -2.20 1.80 1 107 VAL -3.40 1.30 1 108 GLU -7.70 5.30 1 109 LEU -6.40 4.00 1 110 ARG -4.60 3.20 1 111 LEU -4.60 2.50 1 112 SER -3.20 1.90 1 113 GLU 0.60 0.30 1 114 GLU -2.30 1.40 1 116 ASP 0.40 -0.30 1 118 THR -1.50 3.20 1 119 LEU -1.30 0.50 1 120 LEU -3.10 2.90 1 121 GLU -5.30 3.20 1 122 LEU -4.90 3.00 1 123 GLU -7.10 3.40 1 124 HIS -6.30 5.60 1 125 ALA -5.80 3.40 1 126 THR -2.40 -0.60 1 127 THR 2.10 -1.00 1 128 SER -2.10 -0.80 1 129 GLU 3.50 -0.20 1 130 GLN 4.10 -1.40 1 131 MET 2.40 -0.50 1 132 LEU 3.70 -0.50 1 133 VAL 5.50 -1.10 1 134 GLU 2.70 0.00 1 135 VAL 4.10 -2.50 1 137 VAL 5.60 -0.40 1 139 TRP 1.80 0.50 1 141 MET 4.60 -2.30 1 142 ALA 4.10 -0.90 1 143 LEU 4.00 -1.80 1 144 ASP 4.90 -1.30 1 145 PHE 4.20 -0.20 1 146 LEU 6.90 -3.60 1 148 MET 2.40 1.60 1 149 PHE 3.50 -0.40 1 150 ILE 3.70 -1.70 1 151 ARG 0.90 0.60 1 153 ASP -1.00 1.00 1 154 LEU -1.10 0.80 1 159 VAL -0.00 0.00 1 161 GLU 0.80 0.00 1 162 ASP 0.10 -0.10 1 163 ALA 0.10 0.10 1 164 ALA -0.10 0.20 1 165 GLU -0.50 0.40 1 166 GLU -0.70 0.40 1 167 PHE -0.30 0.30 1 168 GLU -1.70 1.20 1 170 SER -0.10 -0.10 1 172 GLU 3.20 -0.50 1 173 MET 3.20 -0.40 1 174 MET 3.80 -1.00 1 175 ARG 4.40 -1.00 1 176 ILE 4.30 -0.90 1 177 SER 5.20 -1.00 1 178 GLN 4.90 -1.40 1 179 GLU 3.10 -0.20 1 180 ARG 4.20 -0.30 1 182 GLU 3.30 -0.60 1 183 ALA 4.50 -2.00 1 184 TRP 1.90 1.20 1 185 ALA 4.30 -1.20 1 186 ALA 3.50 -1.20 1 187 LEU 2.20 0.30 1 188 VAL 4.30 -0.50 1 189 HIS 1.70 -0.50 1 190 SER 1.00 0.20 1 192 SER 0.60 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18547_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 0.93 _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 0.31 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 THR 1.10 0.99 0 62 ILE -4.00 -0.41 0 37 ARG -3.90 1.51 0 81 SER -4.80 -0.30 0 63 GLU -1.90 -0.78 0 11 MET -0.40 -0.10 1 12 ALA 0.00 -0.02 1 13 SER 0.20 -0.08 1 15 GLN -0.40 -0.03 1 16 ALA -0.30 0.04 1 17 THR 0.60 0.02 1 18 GLU -3.50 0.19 1 19 ARG -1.90 0.72 1 20 ALA -5.10 0.32 1 21 LEU -5.00 1.45 1 23 ARG -2.90 0.70 1 24 ARG -4.60 0.19 1 25 THR 3.00 0.07 1 26 ILE 1.10 0.49 1 28 ALA 0.20 -0.05 1 30 GLU 1.50 -0.03 1 31 ALA -4.70 0.29 1 32 ARG -2.10 0.61 1 33 SER -6.20 1.09 1 34 ILE -3.90 0.78 1 35 ILE -2.90 0.79 1 36 ILE -4.50 0.60 1 38 GLN -7.10 0.37 1 39 ARG -2.50 0.92 1 40 TYR -4.90 0.05 1 41 ASP 0.90 0.24 1 42 ALA -2.50 0.07 1 44 VAL 4.70 -0.16 1 45 ASP 4.00 -0.35 1 46 GLU 2.00 -0.09 1 47 VAL 6.60 -0.75 1 48 TRP 3.70 -0.67 1 49 SER 5.50 -0.46 1 50 ALA 3.00 -0.30 1 52 THR -1.60 -0.11 1 53 ASP -2.70 0.15 1 55 ASN 2.00 -0.22 1 56 ARG 1.50 -0.09 1 57 ILE 2.60 -0.75 1 58 ASN 2.00 -0.96 1 59 ARG 0.90 -0.22 1 60 TRP -3.60 0.20 1 61 PHE -0.70 0.07 1 65 LYS -4.20 0.46 1 67 ASP -1.40 0.26 1 68 LEU 3.50 -0.07 1 69 ARG -2.80 0.37 1 70 GLU 3.10 -0.48 1 73 ASN -2.80 0.75 1 74 PHE -6.80 0.88 1 75 ALA -2.70 0.03 1 76 LEU -2.60 0.18 1 77 GLN 3.50 -0.44 1 79 ASN -2.90 -0.14 1 80 ALA 0.50 -0.15 1 83 ASP -4.00 0.79 1 84 ILE 2.70 0.36 1 85 LEU 2.30 -0.01 1 86 ARG -4.30 0.50 1 88 GLU -3.40 0.32 1 91 ARG -1.90 0.36 1 92 ARG -3.30 1.36 1 93 LEU -6.10 0.91 1 95 ILE -3.90 1.46 1 96 SER -2.60 0.80 1 97 TRP -1.50 0.47 1 98 VAL 0.20 0.34 1 99 TYR -4.40 -0.11 1 100 GLU 2.40 -0.41 1 102 LYS -2.30 0.38 1 104 ASP 2.30 0.22 1 105 SER -2.20 0.81 1 106 GLU -5.60 0.83 1 107 VAL -3.40 0.65 1 108 GLU -7.70 1.23 1 109 LEU -6.40 0.74 1 110 ARG -4.60 1.05 1 111 LEU -4.60 1.28 1 112 SER -3.20 0.22 1 113 GLU 0.60 0.09 1 114 GLU -2.30 0.10 1 116 ASP 0.40 0.11 1 118 THR -1.50 0.62 1 119 LEU -1.30 0.45 1 120 LEU -3.10 0.48 1 121 GLU -5.30 1.18 1 122 LEU -4.90 0.69 1 123 GLU -7.10 1.40 1 124 HIS -6.30 0.51 1 125 ALA -5.80 0.83 1 126 THR -2.40 0.61 1 127 THR 2.10 0.04 1 128 SER -2.10 0.42 1 129 GLU 3.50 -0.41 1 130 GLN 4.10 -0.22 1 131 MET 2.40 -0.24 1 132 LEU 3.70 -0.71 1 133 VAL 5.50 -0.76 1 134 GLU 2.70 -0.45 1 135 VAL 4.10 -0.19 1 137 VAL 5.60 -0.61 1 139 TRP 1.80 0.23 1 140 GLU 5.60 -0.33 1 141 MET 4.60 -0.15 1 142 ALA 4.10 0.40 1 143 LEU 4.00 -0.19 1 144 ASP 4.90 -0.06 1 145 PHE 4.20 -0.04 1 146 LEU 6.90 -1.14 1 148 MET 2.40 -0.39 1 149 PHE 3.50 -0.24 1 150 ILE 3.70 -0.75 1 151 ARG 0.90 -0.12 1 153 ASP -1.00 0.14 1 154 LEU -1.10 0.13 1 159 VAL -0.00 -0.05 1 161 GLU 0.80 -0.18 1 162 ASP 0.10 -0.07 1 163 ALA 0.10 -0.05 1 164 ALA -0.10 -0.06 1 165 GLU -0.50 -0.13 1 166 GLU -0.70 -0.11 1 167 PHE -0.30 -0.03 1 168 GLU -1.70 -0.03 1 170 SER -0.10 0.00 1 172 GLU 3.20 -0.19 1 173 MET 3.20 -0.22 1 174 MET 3.80 -0.22 1 175 ARG 4.40 -0.18 1 176 ILE 4.30 -0.25 1 177 SER 5.20 -0.23 1 178 GLN 4.90 -0.23 1 179 GLU 3.10 -0.26 1 180 ARG 4.20 -0.33 1 182 GLU 3.30 -0.24 1 183 ALA 4.50 -0.17 1 184 TRP 1.90 -0.12 1 185 ALA 4.30 -0.40 1 186 ALA 3.50 -0.13 1 187 LEU 2.20 -0.13 1 188 VAL 4.30 -0.46 1 189 HIS 1.70 0.05 1 190 SER 1.00 0.01 1 192 SER 0.60 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18547_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 -3.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 3.01 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 LEU 3.50 -3.90 0 11 MET -0.40 -0.70 1 12 ALA 0.00 -0.20 1 13 SER 0.20 0.50 1 15 GLN -0.40 -0.50 1 16 ALA -0.30 -0.50 1 17 THR 0.60 -1.10 1 18 GLU -3.50 -2.40 1 19 ARG -1.90 -1.30 1 20 ALA -5.10 -4.00 1 21 LEU -5.00 0.50 1 23 ARG -2.90 -1.40 1 24 ARG -4.60 -2.30 1 25 THR 3.00 -1.00 1 28 ALA 0.20 -0.80 1 30 GLU 1.50 -1.00 1 31 ALA -4.70 -0.60 1 32 ARG -2.10 -2.90 1 33 SER -6.20 -0.10 1 34 ILE -3.90 -1.00 1 35 ILE -2.90 -1.60 1 36 ILE -4.50 -1.40 1 37 ARG -3.90 -0.10 1 38 GLN -7.10 -2.80 1 39 ARG -2.50 -0.90 1 40 TYR -4.90 -0.30 1 41 ASP 0.90 -1.80 1 44 VAL 4.70 1.20 1 45 ASP 4.00 2.50 1 46 GLU 2.00 2.40 1 47 VAL 6.60 0.80 1 48 TRP 3.70 4.60 1 49 SER 5.50 1.10 1 50 ALA 3.00 -1.10 1 52 THR -1.60 -1.20 1 55 ASN 2.00 0.70 1 56 ARG 1.50 0.80 1 57 ILE 2.60 1.00 1 58 ASN 2.00 0.10 1 59 ARG 0.90 -1.60 1 60 TRP -3.60 -2.70 1 61 PHE -0.70 -2.80 1 62 ILE -4.00 -3.80 1 65 LYS -4.20 -0.60 1 67 ASP -1.40 -0.70 1 70 GLU 3.10 0.60 1 73 ASN -2.80 -3.80 1 74 PHE -6.80 -2.60 1 75 ALA -2.70 -1.80 1 76 LEU -2.60 -1.80 1 77 GLN 3.50 0.60 1 79 ASN -2.90 -1.90 1 80 ALA 0.50 -3.30 1 81 SER -4.80 -3.70 1 83 ASP -4.00 -0.20 1 84 ILE 2.70 -0.80 1 85 LEU 2.30 0.50 1 86 ARG -4.30 -1.40 1 91 ARG -1.90 0.20 1 92 ARG -3.30 -3.60 1 93 LEU -6.10 -3.60 1 94 THR 1.10 -0.60 1 95 ILE -3.90 -1.40 1 96 SER -2.60 -2.40 1 97 TRP -1.50 -0.60 1 98 VAL 0.20 -1.20 1 99 TYR -4.40 -2.00 1 100 GLU 2.40 0.10 1 104 ASP 2.30 0.80 1 105 SER -2.20 -0.90 1 106 GLU -5.60 -4.20 1 107 VAL -3.40 -3.20 1 108 GLU -7.70 -4.50 1 109 LEU -6.40 -2.50 1 110 ARG -4.60 -0.90 1 111 LEU -4.60 -0.50 1 112 SER -3.20 -1.90 1 113 GLU 0.60 0.00 1 114 GLU -2.30 -1.00 1 116 ASP 0.40 -0.70 1 118 THR -1.50 -1.70 1 119 LEU -1.30 -4.10 1 120 LEU -3.10 -3.50 1 121 GLU -5.30 -3.10 1 122 LEU -4.90 -3.90 1 123 GLU -7.10 -2.40 1 124 HIS -6.30 -0.20 1 125 ALA -5.80 -2.40 1 126 THR -2.40 -2.50 1 127 THR 2.10 -0.30 1 128 SER -2.10 0.10 1 129 GLU 3.50 1.80 1 130 GLN 4.10 1.90 1 131 MET 2.40 0.10 1 132 LEU 3.70 -0.50 1 133 VAL 5.50 0.40 1 134 GLU 2.70 4.10 1 135 VAL 4.10 1.60 1 137 VAL 5.60 2.80 1 139 TRP 1.80 3.00 1 140 GLU 5.60 2.70 1 141 MET 4.60 2.20 1 142 ALA 4.10 3.10 1 143 LEU 4.00 2.70 1 144 ASP 4.90 3.60 1 145 PHE 4.20 2.20 1 146 LEU 6.90 1.20 1 148 MET 2.40 1.40 1 149 PHE 3.50 3.30 1 150 ILE 3.70 1.10 1 151 ARG 0.90 0.40 1 153 ASP -1.00 -0.90 1 162 ASP 0.10 -0.30 1 163 ALA 0.10 -0.40 1 164 ALA -0.10 0.10 1 165 GLU -0.50 -0.40 1 166 GLU -0.70 -0.80 1 167 PHE -0.30 -0.70 1 172 GLU 3.20 1.70 1 173 MET 3.20 2.90 1 174 MET 3.80 2.30 1 175 ARG 4.40 2.50 1 176 ILE 4.30 2.10 1 177 SER 5.20 2.70 1 178 GLN 4.90 2.60 1 179 GLU 3.10 3.90 1 180 ARG 4.20 1.80 1 182 GLU 3.30 2.70 1 183 ALA 4.50 3.70 1 184 TRP 1.90 2.40 1 185 ALA 4.30 1.80 1 186 ALA 3.50 2.50 1 187 LEU 2.20 1.80 1 188 VAL 4.30 1.30 1 189 HIS 1.70 1.20 1 190 SER 1.00 0.50 1 stop_ save_