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 bmr25135_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -3.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 9.70 _LACS_plot.Line_2_terminator_val_y_2 7.42 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 TYR -6.00 -2.90 0 13 LEU 4.40 2.80 1 14 GLU 3.50 2.80 1 15 ASN 2.60 2.70 1 16 LEU 3.70 3.30 1 17 LYS 5.00 3.80 1 18 HIS 2.20 4.10 1 19 ILE 5.00 4.90 1 20 ILE 4.90 4.70 1 21 THR 6.10 5.10 1 22 LEU 2.90 2.80 1 24 GLN 5.10 3.60 1 25 VAL 5.50 4.50 1 26 ILE 5.10 4.70 1 27 HIS 5.30 6.30 1 28 LYS 3.90 3.30 1 29 ARG 3.60 3.20 1 31 GLU 1.60 1.70 1 32 GLU -1.40 -0.70 1 33 MET 0.60 1.00 1 34 LYS 0.30 0.80 1 37 LYS 4.30 4.50 1 38 LYS 5.50 2.80 1 39 GLN 0.90 3.60 1 41 ARG 5.00 3.30 1 42 ARG 4.00 2.20 1 43 LEU 5.40 3.20 1 45 HIS 3.00 4.60 1 46 ARG 4.30 3.50 1 47 VAL 7.20 5.60 1 48 LEU 3.90 2.90 1 50 LEU 2.20 1.40 1 51 ILE 1.90 1.60 1 52 LYS 9.70 6.50 1 54 LEU 4.10 2.00 1 55 GLU 2.70 2.90 1 56 MET 2.60 2.20 1 57 LEU 1.90 1.50 1 58 GLN 1.90 2.00 1 59 ASP 0.90 1.10 1 60 GLN 1.10 1.00 1 62 LYS 0.50 0.30 1 63 ARG -0.30 0.00 1 64 SER -1.00 -0.50 1 65 VAL 0.70 0.60 1 67 SER -0.50 -0.10 1 68 GLU 3.80 3.10 1 69 LYS 3.80 3.40 1 70 LEU 5.10 3.20 1 71 THR 7.10 5.70 1 72 THR 6.50 5.10 1 73 ALA 3.60 3.30 1 74 MET 4.60 4.20 1 75 ASN 4.40 3.20 1 76 ARG 3.90 3.70 1 77 PHE 3.10 2.90 1 78 LYS 5.10 4.50 1 79 ALA 3.60 2.50 1 80 ALA 4.00 2.70 1 81 LEU 3.40 2.40 1 82 GLU 4.00 3.30 1 83 GLU 3.30 2.80 1 84 ALA 5.10 3.20 1 85 ASN 3.20 3.20 1 87 GLU 2.10 2.10 1 88 ILE 5.30 4.40 1 89 GLU 3.70 3.10 1 90 LYS 4.50 3.70 1 91 PHE 3.20 0.50 1 92 SER 2.60 2.20 1 93 ASN -2.40 -1.00 1 94 ARG 4.60 3.80 1 95 SER 5.70 3.90 1 96 ASN 3.60 2.30 1 97 ILE 5.00 3.60 1 99 ARG 4.10 3.50 1 100 PHE 3.60 3.80 1 101 LEU 3.10 2.30 1 102 THR 3.90 3.40 1 103 ALA -0.40 0.50 1 104 SER -0.90 -0.70 1 105 GLN 2.40 2.00 1 106 ASP -0.80 -0.20 1 108 ILE 0.40 -0.30 1 109 LEU 2.40 2.90 1 110 PHE 0.00 -2.00 1 111 LYS 4.50 4.90 1 112 ASP 4.30 3.60 1 113 VAL 4.10 3.50 1 114 ASN 4.10 3.10 1 115 ARG 4.10 3.10 1 116 LYS 4.50 3.90 1 117 LEU 3.30 3.40 1 118 SER 4.30 3.10 1 119 ASP 4.20 3.70 1 120 VAL 4.80 3.40 1 121 TRP 2.50 2.60 1 122 LYS 5.20 4.30 1 123 GLU 1.70 2.20 1 124 LEU 2.90 2.70 1 125 SER 5.30 3.30 1 126 LEU 3.50 2.90 1 127 LEU 1.90 2.60 1 128 LEU 3.50 2.50 1 129 GLN 3.70 3.10 1 130 VAL 3.20 3.20 1 131 GLU 1.00 1.80 1 132 GLN -0.40 -1.20 1 133 ARG 3.80 0.60 1 134 MET -1.90 0.40 1 136 VAL -0.70 -0.50 1 137 SER -0.60 -0.20 1 139 ILE 0.20 0.20 1 140 SER 0.20 0.00 1 141 GLN 0.90 0.60 1 143 ALA 1.50 1.30 1 144 SER 0.20 0.20 1 145 TRP 1.80 1.40 1 146 ALA 4.30 3.20 1 147 GLN 4.20 3.30 1 148 GLU 2.30 2.40 1 149 ASP 4.00 3.00 1 150 GLN 3.90 3.20 1 151 GLN 4.00 3.20 1 152 ASP 3.50 3.10 1 153 ALA 2.50 2.90 1 154 ASP 3.20 3.40 1 155 GLU 3.40 3.10 1 156 ASP 3.30 3.30 1 157 ARG 4.80 3.50 1 158 ARG 4.10 3.40 1 159 ALA 1.60 1.60 1 160 PHE 2.70 2.80 1 161 GLN 1.70 1.20 1 162 MET 0.70 0.60 1 163 LEU 0.40 0.30 1 164 ARG 0.20 0.20 1 165 ARG -0.10 0.00 1 166 ASP 0.40 1.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25135_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 2.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 9.70 _LACS_plot.Line_2_terminator_val_y_2 -2.28 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 TYR -6.00 3.10 0 13 LEU 4.40 -1.60 1 14 GLU 3.50 -0.70 1 15 ASN 2.60 0.10 1 16 LEU 3.70 -0.40 1 17 LYS 5.00 -1.20 1 18 HIS 2.20 1.90 1 19 ILE 5.00 -0.10 1 20 ILE 4.90 -0.20 1 21 THR 6.10 -1.00 1 22 LEU 2.90 -0.10 1 24 GLN 5.10 -1.50 1 25 VAL 5.50 -1.00 1 26 ILE 5.10 -0.40 1 27 HIS 5.30 1.00 1 28 LYS 3.90 -0.60 1 29 ARG 3.60 -0.40 1 31 GLU 1.60 0.10 1 32 GLU -1.40 0.70 1 33 MET 0.60 0.40 1 34 LYS 0.30 0.50 1 37 LYS 4.30 0.20 1 38 LYS 5.50 -2.70 1 39 GLN 0.90 2.70 1 41 ARG 5.00 -1.70 1 42 ARG 4.00 -1.80 1 43 LEU 5.40 -2.20 1 45 HIS 3.00 1.60 1 46 ARG 4.30 -0.80 1 47 VAL 7.20 -1.60 1 48 LEU 3.90 -1.00 1 50 LEU 2.20 -0.80 1 51 ILE 1.90 -0.30 1 52 LYS 9.70 -3.20 1 54 LEU 4.10 -2.10 1 55 GLU 2.70 0.20 1 56 MET 2.60 -0.40 1 57 LEU 1.90 -0.40 1 58 GLN 1.90 0.10 1 59 ASP 0.90 0.20 1 60 GLN 1.10 -0.10 1 62 LYS 0.50 -0.20 1 63 ARG -0.30 0.30 1 64 SER -1.00 0.50 1 65 VAL 0.70 -0.10 1 67 SER -0.50 0.40 1 68 GLU 3.80 -0.70 1 69 LYS 3.80 -0.40 1 70 LEU 5.10 -1.90 1 71 THR 7.10 -1.40 1 72 THR 6.50 -1.40 1 73 ALA 3.60 -0.30 1 74 MET 4.60 -0.40 1 75 ASN 4.40 -1.20 1 76 ARG 3.90 -0.20 1 77 PHE 3.10 -0.20 1 78 LYS 5.10 -0.60 1 79 ALA 3.60 -1.10 1 80 ALA 4.00 -1.30 1 81 LEU 3.40 -1.00 1 82 GLU 4.00 -0.70 1 83 GLU 3.30 -0.50 1 84 ALA 5.10 -1.90 1 85 ASN 3.20 0.00 1 87 GLU 2.10 0.00 1 88 ILE 5.30 -0.90 1 89 GLU 3.70 -0.60 1 90 LYS 4.50 -0.80 1 91 PHE 3.20 -2.70 1 92 SER 2.60 -0.40 1 93 ASN -2.40 1.40 1 94 ARG 4.60 -0.80 1 95 SER 5.70 -1.80 1 96 ASN 3.60 -1.30 1 97 ILE 5.00 -1.40 1 99 ARG 4.10 -0.60 1 100 PHE 3.60 0.20 1 101 LEU 3.10 -0.80 1 102 THR 3.90 -0.50 1 103 ALA -0.40 0.90 1 104 SER -0.90 0.20 1 105 GLN 2.40 -0.40 1 106 ASP -0.80 0.60 1 108 ILE 0.40 -0.70 1 109 LEU 2.40 0.50 1 110 PHE 0.00 -2.00 1 111 LYS 4.50 0.40 1 112 ASP 4.30 -0.70 1 113 VAL 4.10 -0.60 1 114 ASN 4.10 -1.00 1 115 ARG 4.10 -1.00 1 116 LYS 4.50 -0.60 1 117 LEU 3.30 0.10 1 118 SER 4.30 -1.20 1 119 ASP 4.20 -0.50 1 120 VAL 4.80 -1.40 1 121 TRP 2.50 0.10 1 122 LYS 5.20 -0.90 1 123 GLU 1.70 0.50 1 124 LEU 2.90 -0.20 1 125 SER 5.30 -2.00 1 126 LEU 3.50 -0.60 1 127 LEU 1.90 0.70 1 128 LEU 3.50 -1.00 1 129 GLN 3.70 -0.60 1 130 VAL 3.20 0.00 1 131 GLU 1.00 0.80 1 132 GLN -0.40 -0.80 1 133 ARG 3.80 -3.20 1 134 MET -1.90 2.30 1 136 VAL -0.70 0.20 1 137 SER -0.60 0.40 1 139 ILE 0.20 0.00 1 140 SER 0.20 -0.20 1 141 GLN 0.90 -0.30 1 143 ALA 1.50 -0.20 1 144 SER 0.20 0.00 1 145 TRP 1.80 -0.40 1 146 ALA 4.30 -1.10 1 147 GLN 4.20 -0.90 1 148 GLU 2.30 0.10 1 149 ASP 4.00 -1.00 1 150 GLN 3.90 -0.70 1 151 GLN 4.00 -0.80 1 152 ASP 3.50 -0.40 1 153 ALA 2.50 0.40 1 154 ASP 3.20 0.20 1 155 GLU 3.40 -0.30 1 156 ASP 3.30 0.00 1 157 ARG 4.80 -1.30 1 158 ARG 4.10 -0.70 1 159 ALA 1.60 0.00 1 160 PHE 2.70 0.10 1 161 GLN 1.70 -0.50 1 162 MET 0.70 -0.10 1 163 LEU 0.40 -0.10 1 164 ARG 0.20 0.00 1 165 ARG -0.10 0.10 1 166 ASP 0.40 1.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25135_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 0.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 9.70 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 125 SER 5.30 -1.28 0 35 TYR -6.00 0.36 0 109 LEU 2.40 -1.22 0 13 LEU 4.40 -0.28 1 14 GLU 3.50 -0.37 1 15 ASN 2.60 -0.10 1 16 LEU 3.70 -0.31 1 17 LYS 5.00 -0.38 1 18 HIS 2.20 -0.31 1 19 ILE 5.00 -0.73 1 20 ILE 4.90 -0.59 1 21 THR 6.10 -0.47 1 22 LEU 2.90 -0.29 1 24 GLN 5.10 -0.35 1 25 VAL 5.50 -0.45 1 26 ILE 5.10 -0.70 1 27 HIS 5.30 -0.83 1 28 LYS 3.90 -0.65 1 29 ARG 3.60 -0.38 1 31 GLU 1.60 -0.54 1 32 GLU -1.40 -0.13 1 33 MET 0.60 -0.22 1 34 LYS 0.30 -0.37 1 37 LYS 4.30 -0.74 1 38 LYS 5.50 -0.33 1 39 GLN 0.90 -0.37 1 41 ARG 5.00 -0.47 1 42 ARG 4.00 -0.45 1 43 LEU 5.40 -0.30 1 45 HIS 3.00 -0.50 1 46 ARG 4.30 -0.47 1 47 VAL 7.20 -0.71 1 48 LEU 3.90 -0.44 1 50 LEU 2.20 -0.75 1 51 ILE 1.90 0.02 1 52 LYS 9.70 -0.18 1 54 LEU 4.10 -0.28 1 55 GLU 2.70 -0.43 1 56 MET 2.60 -0.17 1 57 LEU 1.90 -0.19 1 58 GLN 1.90 -0.32 1 59 ASP 0.90 -0.07 1 60 GLN 1.10 -0.11 1 62 LYS 0.50 0.00 1 63 ARG -0.30 0.12 1 64 SER -1.00 0.08 1 65 VAL 0.70 -0.15 1 67 SER -0.50 -0.10 1 68 GLU 3.80 -0.21 1 69 LYS 3.80 -0.32 1 70 LEU 5.10 -0.24 1 71 THR 7.10 -0.62 1 72 THR 6.50 -0.37 1 73 ALA 3.60 -0.20 1 74 MET 4.60 -0.37 1 75 ASN 4.40 -0.16 1 76 ARG 3.90 -0.15 1 77 PHE 3.10 -0.15 1 78 LYS 5.10 -0.70 1 79 ALA 3.60 -0.09 1 80 ALA 4.00 -0.13 1 81 LEU 3.40 -0.49 1 82 GLU 4.00 -0.41 1 83 GLU 3.30 -0.28 1 84 ALA 5.10 -0.43 1 85 ASN 3.20 -0.29 1 87 GLU 2.10 -0.24 1 88 ILE 5.30 -0.35 1 89 GLU 3.70 -0.43 1 90 LYS 4.50 -0.42 1 91 PHE 3.20 0.06 1 92 SER 2.60 0.03 1 93 ASN -2.40 0.23 1 94 ARG 4.60 -0.75 1 95 SER 5.70 -0.54 1 96 ASN 3.60 -0.14 1 97 ILE 5.00 -0.35 1 99 ARG 4.10 -0.32 1 100 PHE 3.60 -0.40 1 101 LEU 3.10 -0.70 1 102 THR 3.90 -0.37 1 103 ALA -0.40 -0.05 1 104 SER -0.90 -0.34 1 105 GLN 2.40 -0.14 1 106 ASP -0.80 -0.08 1 108 ILE 0.40 0.15 1 110 PHE 0.00 0.48 1 111 LYS 4.50 -0.44 1 112 ASP 4.30 -0.03 1 113 VAL 4.10 -0.26 1 114 ASN 4.10 -0.18 1 115 ARG 4.10 -0.18 1 116 LYS 4.50 -0.13 1 117 LEU 3.30 -0.30 1 118 SER 4.30 -0.60 1 119 ASP 4.20 -0.20 1 120 VAL 4.80 -0.11 1 121 TRP 2.50 -0.39 1 122 LYS 5.20 -0.69 1 123 GLU 1.70 -0.34 1 124 LEU 2.90 -0.60 1 126 LEU 3.50 -0.32 1 127 LEU 1.90 -0.28 1 128 LEU 3.50 -0.49 1 129 GLN 3.70 0.00 1 130 VAL 3.20 -0.28 1 131 GLU 1.00 -0.04 1 132 GLN -0.40 0.11 1 133 ARG 3.80 -0.22 1 134 MET -1.90 -0.14 1 136 VAL -0.70 -0.04 1 137 SER -0.60 0.02 1 139 ILE 0.20 -0.03 1 140 SER 0.20 -0.07 1 141 GLN 0.90 -0.11 1 143 ALA 1.50 -0.09 1 144 SER 0.20 0.11 1 145 TRP 1.80 -0.13 1 146 ALA 4.30 -0.07 1 147 GLN 4.20 -0.24 1 148 GLU 2.30 -0.53 1 149 ASP 4.00 -0.18 1 150 GLN 3.90 -0.46 1 151 GLN 4.00 -0.23 1 152 ASP 3.50 -0.62 1 153 ALA 2.50 -0.07 1 154 ASP 3.20 -0.21 1 155 GLU 3.40 -0.32 1 156 ASP 3.30 0.01 1 157 ARG 4.80 -0.21 1 158 ARG 4.10 -0.23 1 159 ALA 1.60 -0.01 1 160 PHE 2.70 -0.23 1 161 GLN 1.70 -0.21 1 162 MET 0.70 -0.12 1 163 LEU 0.40 -0.07 1 164 ARG 0.20 -0.10 1 165 ARG -0.10 0.02 1 166 ASP 0.40 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25135_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -2.37 _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 -0.45 _LACS_plot.Line_2_terminator_val_x_2 7.19 _LACS_plot.Line_2_terminator_val_y_2 3.14 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 TYR -6.00 -2.20 0 13 LEU 4.40 1.70 1 14 GLU 3.50 1.80 1 15 ASN 2.60 2.70 1 16 LEU 3.70 0.30 1 17 LYS 5.00 2.60 1 18 HIS 2.20 4.10 1 19 ILE 5.00 0.10 1 20 ILE 4.90 1.60 1 21 THR 6.10 1.60 1 22 LEU 2.90 1.20 1 24 GLN 5.10 3.60 1 25 VAL 5.50 2.20 1 26 ILE 5.10 1.30 1 27 HIS 5.30 2.10 1 28 LYS 3.90 2.60 1 29 ARG 3.60 4.30 1 31 GLU 1.60 0.50 1 32 GLU -1.40 0.50 1 33 MET 0.60 1.50 1 34 LYS 0.30 -1.20 1 37 LYS 4.30 3.20 1 38 LYS 5.50 4.70 1 39 GLN 0.90 4.20 1 41 ARG 5.00 2.60 1 42 ARG 4.00 1.70 1 43 LEU 5.40 0.80 1 45 HIS 3.00 5.30 1 46 ARG 4.30 3.30 1 47 VAL 7.20 1.30 1 48 LEU 3.90 2.00 1 50 LEU 2.20 -0.70 1 51 ILE 1.90 1.70 1 54 LEU 4.10 1.20 1 55 GLU 2.70 2.50 1 56 MET 2.60 1.60 1 57 LEU 1.90 0.40 1 58 GLN 1.90 0.50 1 59 ASP 0.90 0.60 1 60 GLN 1.10 1.20 1 62 LYS 0.50 -0.20 1 63 ARG -0.30 -0.20 1 64 SER -1.00 -0.70 1 67 SER -0.50 0.90 1 68 GLU 3.80 2.70 1 69 LYS 3.80 2.80 1 70 LEU 5.10 0.60 1 71 THR 7.10 2.10 1 72 THR 6.50 1.70 1 73 ALA 3.60 2.20 1 74 MET 4.60 2.00 1 75 ASN 4.40 3.80 1 76 ARG 3.90 3.00 1 77 PHE 3.10 0.60 1 78 LYS 5.10 1.00 1 79 ALA 3.60 2.60 1 80 ALA 4.00 2.00 1 81 LEU 3.40 1.60 1 82 GLU 4.00 3.90 1 83 GLU 3.30 3.00 1 84 ALA 5.10 0.70 1 85 ASN 3.20 2.40 1 87 GLU 2.10 1.90 1 88 ILE 5.30 1.90 1 89 GLU 3.70 3.60 1 90 LYS 4.50 2.60 1 91 PHE 3.20 -1.70 1 92 SER 2.60 -0.90 1 94 ARG 4.60 1.40 1 95 SER 5.70 2.50 1 96 ASN 3.60 3.90 1 97 ILE 5.00 0.50 1 99 ARG 4.10 2.20 1 100 PHE 3.60 1.40 1 101 LEU 3.10 1.10 1 102 THR 3.90 0.20 1 103 ALA -0.40 -0.30 1 105 GLN 2.40 0.70 1 108 ILE 0.40 0.60 1 109 LEU 2.40 -0.40 1 110 PHE 0.00 -0.40 1 111 LYS 4.50 2.30 1 112 ASP 4.30 2.70 1 113 VAL 4.10 0.80 1 114 ASN 4.10 3.30 1 115 ARG 4.10 1.60 1 116 LYS 4.50 2.70 1 117 LEU 3.30 0.80 1 118 SER 4.30 2.90 1 119 ASP 4.20 3.40 1 120 VAL 4.80 2.10 1 121 TRP 2.50 1.90 1 122 LYS 5.20 1.40 1 123 GLU 1.70 1.80 1 124 LEU 2.90 0.00 1 125 SER 5.30 1.70 1 126 LEU 3.50 1.50 1 127 LEU 1.90 2.00 1 128 LEU 3.50 1.70 1 129 GLN 3.70 2.20 1 130 VAL 3.20 1.60 1 131 GLU 1.00 1.10 1 132 GLN -0.40 -1.30 1 133 ARG 3.80 -0.70 1 136 VAL -0.70 -0.50 1 139 ILE 0.20 -0.10 1 140 SER 0.20 0.00 1 141 GLN 0.90 0.20 1 143 ALA 1.50 0.90 1 144 SER 0.20 1.10 1 145 TRP 1.80 2.10 1 146 ALA 4.30 2.90 1 147 GLN 4.20 3.20 1 148 GLU 2.30 1.20 1 149 ASP 4.00 1.80 1 150 GLN 3.90 2.40 1 151 GLN 4.00 2.90 1 152 ASP 3.50 1.40 1 153 ALA 2.50 3.00 1 154 ASP 3.20 2.30 1 155 GLU 3.40 3.50 1 156 ASP 3.30 3.20 1 157 ARG 4.80 2.40 1 158 ARG 4.10 2.10 1 159 ALA 1.60 1.70 1 160 PHE 2.70 1.10 1 161 GLN 1.70 0.40 1 162 MET 0.70 0.00 1 163 LEU 0.40 -0.50 1 164 ARG 0.20 -0.30 1 165 ARG -0.10 -1.40 1 stop_ save_