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 bmr6275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 -2.91 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 4.35 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 PHE -6.10 -0.70 0 15 TYR -5.30 0.10 0 13 ARG 1.80 1.40 1 14 THR -4.00 -1.90 1 16 SER 0.60 1.00 1 17 THR -5.50 -2.90 1 18 ALA 2.90 1.70 1 20 ASN 3.40 1.90 1 21 LEU 5.10 3.00 1 22 ARG 4.70 3.70 1 23 THR 6.00 4.60 1 24 HIS 5.00 4.00 1 25 GLN 5.30 4.30 1 26 LYS 3.10 2.50 1 27 THR 2.30 1.80 1 28 HIS 1.00 0.70 1 29 ARG 0.70 0.50 1 31 GLU -0.90 -0.30 1 32 TYR 0.60 -0.60 1 33 THR 0.30 0.20 1 34 PHE 0.40 -0.10 1 35 VAL -2.50 -0.90 1 37 ASN 0.10 0.00 1 38 GLN 2.40 0.90 1 39 GLU 2.60 1.80 1 43 LYS 1.10 1.60 1 44 ALA -6.00 -2.20 1 45 PHE -3.90 0.00 1 46 LEU 0.00 1.40 1 47 THR -6.80 -3.40 1 48 SER 3.60 1.80 1 49 TYR 4.30 3.20 1 50 SER 5.20 3.40 1 51 LEU 4.40 2.80 1 52 ARG 4.70 3.40 1 53 ILE 3.70 2.10 1 54 HIS 4.80 4.30 1 55 VAL 5.00 3.70 1 56 ARG 3.10 2.30 1 57 VAL 3.60 1.80 1 58 HIS 0.80 0.30 1 59 THR 0.90 0.60 1 60 LYS 0.70 0.40 1 61 GLU -0.30 0.30 1 62 LYS 1.50 -0.60 1 64 PHE 0.40 -0.40 1 65 GLU -3.10 -1.20 1 67 ASP 0.00 -0.50 1 68 VAL 3.30 1.90 1 69 GLN 3.50 2.20 1 72 GLU 0.80 -0.30 1 73 LYS 0.20 0.50 1 74 ALA -6.00 -2.00 1 76 ASN 1.00 1.20 1 77 THR -6.10 -2.90 1 78 LEU 2.90 1.70 1 79 TYR 4.10 3.00 1 80 ARG 3.80 2.70 1 81 LEU 5.30 3.10 1 82 LYS 4.40 2.80 1 83 ALA 3.50 2.30 1 84 HIS 4.00 3.80 1 85 GLN 4.80 3.80 1 86 ARG 4.40 3.50 1 87 LEU 2.40 1.10 1 88 HIS 1.30 1.20 1 89 THR 1.10 0.90 1 91 LYS -0.40 -0.30 1 92 THR -2.50 -1.30 1 93 PHE -1.50 -0.70 1 94 ASN -0.80 0.00 1 96 GLU -1.10 -0.50 1 97 SER 2.70 1.80 1 98 GLN 3.60 2.40 1 101 SER -0.10 -0.40 1 102 LYS 0.20 0.40 1 103 TYR -4.80 -2.40 1 104 PHE -5.00 -0.40 1 105 THR 1.10 1.00 1 106 THR -5.30 -2.40 1 107 LEU 3.10 1.90 1 108 SER 5.50 3.70 1 109 ASP 3.80 2.80 1 110 LEU 5.10 3.10 1 111 ARG 5.20 3.90 1 112 LYS 3.80 3.30 1 113 HIS 4.20 4.10 1 114 ILE 5.40 4.80 1 115 ARG 3.20 2.30 1 116 THR 2.70 2.10 1 117 HIS 1.60 1.30 1 118 THR 1.10 0.90 1 120 GLU -1.10 -0.30 1 121 LYS 0.00 -0.20 1 123 PHE 0.60 -0.40 1 124 ARG -2.70 -0.90 1 126 ASP -0.40 -0.40 1 127 HIS 2.00 3.40 1 128 ASP 2.50 2.10 1 132 LYS 1.00 1.40 1 133 ALA -5.60 -2.10 1 134 PHE -5.10 -0.50 1 135 ALA -0.30 0.80 1 136 ALA -4.80 -2.10 1 137 SER 0.10 0.00 1 138 HIS 3.50 4.00 1 139 HIS -0.40 2.10 1 140 LEU 4.50 2.70 1 141 LYS 4.50 3.60 1 142 THR 5.40 4.20 1 143 HIS 4.50 4.40 1 144 VAL 5.70 4.40 1 145 ARG 3.10 2.20 1 146 THR 2.70 2.10 1 147 HIS 1.40 0.80 1 148 THR 0.70 0.50 1 150 GLU -0.20 0.40 1 151 ARG -0.40 -0.50 1 153 PHE -3.10 -1.90 1 154 PHE 2.20 1.70 1 157 SER 2.70 2.40 1 158 ASN 0.20 -0.50 1 161 GLU 0.60 1.10 1 162 LYS -4.30 -2.60 1 163 THR -4.90 -0.10 1 164 PHE 1.30 1.70 1 165 SER -6.30 -2.90 1 166 THR 3.90 2.50 1 167 GLN 4.00 3.10 1 168 TYR 4.20 3.00 1 169 SER 4.60 2.80 1 170 LEU 4.80 3.60 1 171 LYS 4.30 3.00 1 172 SER 4.30 3.80 1 173 HIS 4.00 3.10 1 174 MET 3.00 1.90 1 175 LYS 1.50 2.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 3.89 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -1.65 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 PHE -6.10 5.40 0 15 TYR -5.30 5.40 0 13 ARG 1.80 -0.40 1 14 THR -4.00 2.10 1 16 SER 0.60 0.40 1 17 THR -5.50 2.60 1 18 ALA 2.90 -1.20 1 20 ASN 3.40 -1.50 1 21 LEU 5.10 -2.10 1 22 ARG 4.70 -1.00 1 23 THR 6.00 -1.40 1 24 HIS 5.00 -1.00 1 25 GLN 5.30 -1.00 1 26 LYS 3.10 -0.60 1 27 THR 2.30 -0.50 1 28 HIS 1.00 -0.30 1 29 ARG 0.70 -0.20 1 31 GLU -0.90 0.60 1 32 TYR 0.60 -1.20 1 33 THR 0.30 -0.10 1 34 PHE 0.40 -0.50 1 35 VAL -2.50 1.60 1 37 ASN 0.10 -0.10 1 38 GLN 2.40 -1.50 1 39 GLU 2.60 -0.80 1 43 LYS 1.10 0.50 1 44 ALA -6.00 3.80 1 45 PHE -3.90 3.90 1 46 LEU 0.00 1.40 1 47 THR -6.80 3.40 1 48 SER 3.60 -1.80 1 49 TYR 4.30 -1.10 1 50 SER 5.20 -1.80 1 51 LEU 4.40 -1.60 1 52 ARG 4.70 -1.30 1 53 ILE 3.70 -1.60 1 54 HIS 4.80 -0.50 1 55 VAL 5.00 -1.30 1 56 ARG 3.10 -0.80 1 57 VAL 3.60 -1.80 1 58 HIS 0.80 -0.50 1 59 THR 0.90 -0.30 1 60 LYS 0.70 -0.30 1 61 GLU -0.30 0.60 1 62 LYS 1.50 -2.10 1 64 PHE 0.40 -0.80 1 65 GLU -3.10 1.90 1 67 ASP 0.00 -0.50 1 68 VAL 3.30 -1.40 1 69 GLN 3.50 -1.30 1 72 GLU 0.80 -1.10 1 73 LYS 0.20 0.30 1 74 ALA -6.00 4.00 1 76 ASN 1.00 0.20 1 77 THR -6.10 3.20 1 78 LEU 2.90 -1.20 1 79 TYR 4.10 -1.10 1 80 ARG 3.80 -1.10 1 81 LEU 5.30 -2.20 1 82 LYS 4.40 -1.60 1 83 ALA 3.50 -1.20 1 84 HIS 4.00 -0.20 1 85 GLN 4.80 -1.00 1 86 ARG 4.40 -0.90 1 87 LEU 2.40 -1.30 1 88 HIS 1.30 -0.10 1 89 THR 1.10 -0.20 1 91 LYS -0.40 0.10 1 92 THR -2.50 1.20 1 93 PHE -1.50 0.80 1 94 ASN -0.80 0.80 1 96 GLU -1.10 0.60 1 97 SER 2.70 -0.90 1 98 GLN 3.60 -1.20 1 101 SER -0.10 -0.30 1 102 LYS 0.20 0.20 1 103 TYR -4.80 2.40 1 104 PHE -5.00 4.60 1 105 THR 1.10 -0.10 1 106 THR -5.30 2.90 1 107 LEU 3.10 -1.20 1 108 SER 5.50 -1.80 1 109 ASP 3.80 -1.00 1 110 LEU 5.10 -2.00 1 111 ARG 5.20 -1.30 1 112 LYS 3.80 -0.50 1 113 HIS 4.20 -0.10 1 114 ILE 5.40 -0.60 1 115 ARG 3.20 -0.90 1 116 THR 2.70 -0.60 1 117 HIS 1.60 -0.30 1 118 THR 1.10 -0.20 1 120 GLU -1.10 0.80 1 121 LYS 0.00 -0.20 1 123 PHE 0.60 -1.00 1 124 ARG -2.70 1.80 1 126 ASP -0.40 0.00 1 127 HIS 2.00 1.40 1 128 ASP 2.50 -0.40 1 132 LYS 1.00 0.40 1 133 ALA -5.60 3.50 1 134 PHE -5.10 4.60 1 135 ALA -0.30 1.10 1 136 ALA -4.80 2.70 1 137 SER 0.10 -0.10 1 138 HIS 3.50 0.50 1 139 HIS -0.40 2.50 1 140 LEU 4.50 -1.80 1 141 LYS 4.50 -0.90 1 142 THR 5.40 -1.20 1 143 HIS 4.50 -0.10 1 144 VAL 5.70 -1.30 1 145 ARG 3.10 -0.90 1 146 THR 2.70 -0.60 1 147 HIS 1.40 -0.60 1 148 THR 0.70 -0.20 1 150 GLU -0.20 0.60 1 151 ARG -0.40 -0.10 1 153 PHE -3.10 1.20 1 154 PHE 2.20 -0.50 1 157 SER 2.70 -0.30 1 158 ASN 0.20 -0.70 1 161 GLU 0.60 0.50 1 162 LYS -4.30 1.70 1 163 THR -4.90 4.80 1 164 PHE 1.30 0.40 1 165 SER -6.30 3.40 1 166 THR 3.90 -1.40 1 167 GLN 4.00 -0.90 1 168 TYR 4.20 -1.20 1 169 SER 4.60 -1.80 1 170 LEU 4.80 -1.20 1 171 LYS 4.30 -1.30 1 172 SER 4.30 -0.50 1 173 HIS 4.00 -0.90 1 174 MET 3.00 -1.10 1 175 LYS 1.50 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 0.52 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.11 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 168 TYR 4.60 -1.37 0 13 ARG 1.80 -0.38 1 14 THR -4.00 0.64 1 15 TYR -5.30 0.19 1 17 THR -5.50 0.23 1 18 ALA 2.90 -1.09 1 20 ASN 3.40 -0.37 1 21 LEU 5.10 -0.67 1 22 ARG 4.70 -0.28 1 23 THR 6.00 -0.63 1 24 HIS 5.00 -0.46 1 25 GLN 5.30 -0.85 1 26 LYS 3.10 -0.31 1 27 THR 2.30 -0.32 1 28 HIS 1.00 -0.33 1 29 ARG 0.70 -0.07 1 31 GLU -0.90 -0.08 1 32 TYR 0.60 -0.10 1 33 THR 0.30 -0.19 1 34 PHE 0.40 -0.03 1 35 VAL -2.50 0.48 1 37 ASN 0.10 0.05 1 38 GLN 2.40 -0.38 1 39 GLU 2.60 -0.39 1 43 LYS 1.10 -0.41 1 44 ALA -6.00 0.73 1 45 PHE -3.90 0.17 1 46 LEU 0.00 0.11 1 47 THR -6.80 0.14 1 48 SER 3.60 0.22 1 49 TYR 4.30 -0.54 1 50 SER 5.20 -0.51 1 51 LEU 4.40 -1.14 1 52 ARG 4.70 -0.53 1 53 ILE 3.70 -0.63 1 54 HIS 4.80 -0.59 1 55 VAL 5.00 -0.69 1 56 ARG 3.10 -0.32 1 57 VAL 3.60 -0.29 1 58 HIS 0.80 -0.01 1 59 THR 0.90 -0.07 1 60 LYS 0.70 -0.10 1 61 GLU -0.30 -0.13 1 62 LYS 1.50 -0.09 1 64 PHE 0.40 -0.04 1 65 GLU -3.10 0.23 1 67 ASP 0.00 -0.01 1 68 VAL 3.30 -0.49 1 69 GLN 3.50 -0.39 1 73 LYS 0.20 -0.31 1 74 ALA -6.00 0.57 1 75 PHE -6.10 0.17 1 77 THR -6.10 0.18 1 78 LEU 2.90 -1.06 1 79 TYR 4.10 -0.59 1 80 ARG 3.80 -0.33 1 81 LEU 5.30 -0.86 1 82 LYS 4.40 -0.35 1 83 ALA 3.50 -0.44 1 84 HIS 4.00 -0.62 1 85 GLN 4.80 -0.68 1 86 ARG 4.40 -0.28 1 87 LEU 2.40 -0.30 1 88 HIS 1.30 -0.10 1 89 THR 1.10 -0.08 1 91 LYS -0.40 -0.07 1 92 THR -2.50 0.14 1 93 PHE -1.50 0.04 1 94 ASN -0.80 0.26 1 96 GLU -1.10 0.15 1 97 SER 2.70 -0.39 1 98 GLN 3.60 -0.39 1 101 SER -0.10 0.29 1 102 LYS 0.20 -0.30 1 103 TYR -4.80 0.14 1 104 PHE -5.00 0.27 1 105 THR 1.10 0.43 1 106 THR -5.30 0.23 1 107 LEU 3.10 -0.95 1 108 SER 5.50 -0.66 1 109 ASP 3.80 -0.37 1 110 LEU 5.10 -1.01 1 111 ARG 5.20 -0.59 1 112 LYS 3.80 -0.47 1 113 HIS 4.20 -0.51 1 114 ILE 5.40 -0.63 1 115 ARG 3.20 -0.23 1 116 THR 2.70 -0.26 1 117 HIS 1.60 -0.02 1 118 THR 1.10 -0.08 1 120 GLU -1.10 -0.13 1 121 LYS 0.00 -0.08 1 123 PHE 0.60 -0.01 1 124 ARG -2.70 0.50 1 126 ASP -0.40 0.13 1 127 HIS 2.00 -0.67 1 128 ASP 2.50 -0.44 1 132 LYS 1.00 -0.41 1 133 ALA -5.60 0.68 1 134 PHE -5.10 0.10 1 136 ALA -4.80 0.26 1 138 HIS 3.50 -0.30 1 139 HIS -0.40 -0.41 1 140 LEU 4.50 -0.94 1 141 LYS 4.50 -0.47 1 142 THR 5.40 -0.57 1 143 HIS 4.50 -0.54 1 144 VAL 5.70 -0.66 1 145 ARG 3.10 -0.23 1 146 THR 2.70 -0.29 1 147 HIS 1.40 -0.15 1 148 THR 0.70 -0.03 1 150 GLU -0.20 -0.18 1 151 ARG -0.40 0.06 1 153 PHE -3.10 0.31 1 154 PHE 2.20 -0.41 1 157 SER 2.70 -0.37 1 158 ASN 0.60 -0.25 1 162 LYS -4.30 0.56 1 163 THR -4.90 0.10 1 164 PHE -6.30 0.39 1 166 THR 4.00 -0.54 1 170 LEU 4.80 -0.57 1 171 LYS 4.30 -0.51 1 172 SER 4.30 -0.57 1 173 HIS 4.00 -0.66 1 174 MET 3.00 -0.21 1 175 LYS 1.50 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.80 _LACS_plot.Line_1_terminator_val_y_1 -2.33 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.74 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 2.40 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 175 LYS 1.50 5.60 0 13 ARG 1.80 -1.20 1 14 THR -4.00 -2.30 1 15 TYR -5.30 -0.50 1 16 SER 0.60 -0.20 1 17 THR -5.50 -1.30 1 18 ALA 2.90 3.00 1 20 ASN 3.40 2.60 1 21 LEU 5.10 0.00 1 22 ARG 4.70 3.10 1 23 THR 6.00 1.80 1 24 HIS 5.00 4.10 1 25 GLN 5.30 1.80 1 26 LYS 3.10 1.50 1 27 THR 2.30 0.80 1 28 HIS 1.00 0.80 1 29 ARG 0.70 0.20 1 31 GLU -0.90 -0.70 1 32 TYR 0.60 -0.30 1 33 THR 0.30 -0.70 1 34 PHE 0.40 -1.40 1 35 VAL -2.50 -1.40 1 37 ASN 0.10 0.20 1 38 GLN 2.40 0.70 1 39 GLU 2.60 0.90 1 43 LYS 1.10 -3.30 1 44 ALA -6.00 -1.70 1 45 PHE -3.90 -0.40 1 46 LEU 0.00 0.40 1 47 THR -6.80 -1.30 1 48 SER 3.60 2.60 1 49 TYR 4.30 2.20 1 50 SER 5.20 2.20 1 51 LEU 4.40 -1.00 1 52 ARG 4.70 2.60 1 53 ILE 3.70 2.00 1 54 HIS 4.80 2.70 1 55 VAL 5.00 1.10 1 56 ARG 3.10 2.20 1 57 VAL 3.60 1.00 1 58 HIS 0.80 1.50 1 59 THR 0.90 -0.30 1 60 LYS 0.70 -0.20 1 61 GLU -0.30 -0.20 1 62 LYS 1.50 1.40 1 64 PHE 0.40 -1.00 1 65 GLU -3.10 -1.40 1 67 ASP 0.00 0.10 1 68 VAL 3.30 0.40 1 69 GLN 3.50 0.90 1 72 GLU 0.80 -0.60 1 73 LYS 0.20 -2.50 1 74 ALA -6.00 -2.30 1 75 PHE -6.10 -0.60 1 76 ASN 1.00 0.00 1 77 THR -6.10 -1.30 1 78 LEU 2.90 0.90 1 79 TYR 4.10 2.50 1 80 ARG 3.80 2.30 1 81 LEU 5.30 0.40 1 82 LYS 4.40 2.90 1 83 ALA 3.50 2.30 1 84 HIS 4.00 2.60 1 85 GLN 4.80 2.30 1 86 ARG 4.40 2.00 1 87 LEU 2.40 1.10 1 88 HIS 1.30 1.40 1 89 THR 1.10 0.50 1 91 LYS -0.40 -0.70 1 92 THR -2.50 -1.70 1 93 PHE -1.50 -0.70 1 94 ASN -0.80 -1.30 1 96 GLU -1.10 0.10 1 97 SER 2.70 0.90 1 98 GLN 3.60 1.50 1 101 SER -0.10 0.10 1 102 LYS 0.20 -1.80 1 103 TYR -4.80 -2.50 1 104 PHE -5.00 0.00 1 105 THR 1.10 0.20 1 106 THR -5.30 -1.10 1 107 LEU 3.10 1.30 1 108 SER 5.50 2.70 1 109 ASP 3.80 2.30 1 110 LEU 5.10 0.20 1 111 ARG 5.20 2.70 1 112 LYS 3.80 2.00 1 113 HIS 4.20 4.50 1 114 ILE 5.40 1.40 1 115 ARG 3.20 1.70 1 116 THR 2.70 1.00 1 117 HIS 1.60 1.80 1 118 THR 1.10 0.50 1 120 GLU -1.10 -0.40 1 121 LYS 0.00 -0.70 1 123 PHE 0.60 -1.30 1 124 ARG -2.70 -1.60 1 126 ASP -0.40 -0.10 1 127 HIS 2.00 2.20 1 128 ASP 2.50 0.70 1 132 LYS 1.00 -2.60 1 133 ALA -5.60 -2.20 1 134 PHE -5.10 -1.00 1 135 ALA -0.30 -1.30 1 136 ALA -4.80 -0.50 1 137 SER 0.10 -1.40 1 138 HIS 3.50 3.40 1 139 HIS -0.40 4.10 1 140 LEU 4.50 -0.50 1 141 LYS 4.50 2.40 1 142 THR 5.40 1.40 1 143 HIS 4.50 4.20 1 144 VAL 5.70 1.40 1 145 ARG 3.10 1.80 1 146 THR 2.70 1.00 1 147 HIS 1.40 1.50 1 148 THR 0.70 0.50 1 150 GLU -0.20 -0.20 1 151 ARG -0.40 -1.10 1 153 PHE -3.10 -1.80 1 154 PHE 2.20 1.00 1 157 SER 2.70 1.70 1 158 ASN 0.20 -0.50 1 161 GLU 0.60 -1.40 1 162 LYS -4.30 -1.40 1 163 THR -4.90 -0.30 1 164 PHE 1.30 -0.20 1 165 SER -6.30 -1.20 1 166 THR 3.90 1.90 1 167 GLN 4.00 2.20 1 168 TYR 4.20 2.20 1 169 SER 4.60 0.00 1 170 LEU 4.80 2.90 1 171 LYS 4.30 2.20 1 172 SER 4.30 3.60 1 173 HIS 4.00 1.40 1 174 MET 3.00 0.40 1 stop_ save_