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 bmr4492_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.45 _LACS_plot.Line_1_terminator_val_y_1 -4.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.19 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 5.83 _LACS_plot.Y_axis_chem_shift_offset -0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 177 ASP -3.74 0.10 0 92 THR -8.45 -6.07 0 10 ALA 0.11 0.51 1 11 GLU -1.08 -0.11 1 12 GLU -0.63 0.10 1 13 ASN 0.29 0.61 1 15 ALA -0.28 0.15 1 16 VAL 0.48 0.42 1 18 ALA 0.56 0.87 1 19 ALA 0.88 0.85 1 20 ASP 0.37 0.80 1 21 ALA 2.90 2.54 1 22 ALA 3.09 2.48 1 23 GLN 3.02 2.61 1 24 LEU 3.59 3.12 1 25 GLN 5.13 4.21 1 26 GLU 3.61 2.85 1 28 TYR 3.46 2.63 1 29 LYS 4.33 3.94 1 31 PHE 3.78 4.14 1 32 LEU 2.13 1.53 1 33 GLU 1.89 2.25 1 34 GLU -0.56 0.40 1 37 SER 1.02 1.16 1 39 THR -3.42 -1.69 1 40 LEU 1.35 1.90 1 42 MET 4.98 4.72 1 43 HIS 3.86 4.49 1 44 GLU 0.61 1.68 1 45 PHE 2.90 3.82 1 46 LYS 4.44 3.96 1 47 ARG 3.54 2.86 1 48 PHE -3.64 -3.36 1 49 PHE 1.92 1.99 1 53 ASP 0.72 0.11 1 54 ASN -0.86 0.07 1 55 GLU 2.14 2.41 1 56 GLU 3.09 2.58 1 57 ALA 1.05 1.39 1 58 THR 5.84 5.02 1 59 GLN 4.73 3.79 1 60 TYR 3.26 3.56 1 61 VAL 6.80 4.93 1 62 GLU 1.85 3.53 1 63 ALA 3.27 2.54 1 64 MET 3.47 3.42 1 65 PHE 4.74 4.34 1 66 ARG 3.95 3.41 1 67 ALA 2.81 1.89 1 68 PHE 0.17 0.59 1 69 ASP 4.73 2.19 1 70 THR 4.23 3.41 1 71 ASN 0.59 -0.92 1 73 ASP -0.35 -1.02 1 74 ASN 3.12 2.01 1 75 THR -3.70 -1.05 1 76 ILE -1.31 -1.05 1 77 ASP -2.94 -1.67 1 78 PHE 2.93 3.71 1 79 LEU 4.31 2.61 1 80 GLU 2.39 2.26 1 81 TYR 4.01 3.78 1 82 VAL 5.64 4.22 1 83 ALA 3.39 2.73 1 84 ALA 3.39 2.51 1 85 LEU 3.70 2.58 1 86 ASN 3.49 3.97 1 87 LEU 3.75 3.12 1 88 VAL 4.15 3.45 1 89 LEU 1.39 1.80 1 90 ARG -0.50 0.12 1 93 LEU 4.50 3.77 1 94 GLU 5.20 4.47 1 95 HIS 2.94 5.07 1 96 LYS 4.86 4.51 1 97 LEU 2.50 3.09 1 98 LYS 5.57 4.49 1 99 TRP 4.05 3.96 1 100 THR 6.14 5.32 1 101 PHE 4.14 4.29 1 102 LYS 2.99 2.67 1 103 ILE 4.37 2.73 1 104 TYR 0.67 0.93 1 105 ASP 1.29 -1.20 1 106 LYS 3.51 3.85 1 107 ASP 0.33 -1.08 1 108 ARG 5.01 1.55 1 109 ASN -0.05 -0.52 1 112 ILE -1.43 -1.02 1 113 ASP -2.82 -1.46 1 114 ARG 5.38 4.77 1 115 GLN 4.08 3.11 1 116 GLU 2.44 2.72 1 117 LEU 3.20 2.54 1 118 LEU 4.09 3.60 1 119 ASP 3.46 3.41 1 120 ILE 3.17 1.63 1 121 VAL 6.86 5.60 1 122 GLU 4.39 4.10 1 123 SER 2.93 2.40 1 124 ILE 5.36 4.05 1 125 TYR 4.96 4.15 1 126 LYS 4.09 3.84 1 127 LEU 2.78 2.63 1 128 LYS 3.82 3.34 1 129 LYS 3.17 2.33 1 130 ALA 1.46 1.46 1 132 SER 1.09 0.55 1 133 VAL 0.26 0.09 1 134 GLU -0.19 0.29 1 135 VAL 0.41 0.37 1 136 GLU 0.29 0.59 1 137 ALA 0.31 0.70 1 138 GLU 0.13 0.46 1 139 GLN 0.55 0.64 1 140 GLN 1.19 0.87 1 142 LYS -0.62 -0.24 1 143 LEU -0.24 -0.14 1 144 LEU -1.34 -0.14 1 145 THR 1.74 0.40 1 147 GLU 4.92 4.21 1 148 GLU 1.70 2.81 1 149 VAL 6.38 5.54 1 150 VAL 6.70 5.35 1 151 ASP 4.56 4.01 1 152 ARG 4.66 3.54 1 153 ILE 6.96 5.33 1 154 PHE 7.11 6.75 1 155 LEU 3.38 3.39 1 156 LEU 0.34 1.77 1 157 VAL 0.44 0.53 1 158 ASP 0.98 -0.85 1 159 GLU 1.82 2.87 1 160 ASN 0.31 -1.25 1 162 ASP -0.11 -0.63 1 164 GLN -4.88 -2.02 1 165 LEU -1.41 -2.06 1 166 SER -3.37 -1.43 1 167 LEU 5.16 3.83 1 168 ASN 4.35 3.80 1 169 GLU 2.91 2.59 1 170 PHE 2.48 4.40 1 171 VAL 5.28 4.56 1 172 GLU 3.07 2.29 1 174 ALA 2.29 2.01 1 175 ARG 3.00 2.79 1 176 ARG 0.61 1.41 1 178 LYS 3.48 3.19 1 179 TRP 6.31 5.03 1 180 VAL 6.18 4.96 1 181 MET 4.36 3.67 1 182 LYS 4.15 3.31 1 183 MET 3.56 1.53 1 184 LEU 1.30 0.54 1 185 GLN 0.07 0.47 1 186 MET 3.47 0.78 1 187 ASP 2.75 1.52 1 191 SER 3.08 2.56 1 192 SER 0.99 1.60 1 193 TRP -0.45 -0.44 1 194 ILE 0.92 0.90 1 195 SER 0.52 0.66 1 197 GLN 0.29 0.53 1 198 ARG 0.63 1.50 1 199 ARG 0.30 0.40 1 200 LYS 0.60 0.66 1 201 SER -0.19 0.09 1 202 ALA -0.51 0.02 1 203 MET -0.07 0.46 1 204 PHE 0.25 1.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4492_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.45 _LACS_plot.Line_1_terminator_val_y_1 3.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.81 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 -1.28 _LACS_plot.Y_axis_chem_shift_offset -0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 177 ASP -3.74 3.84 0 92 THR -8.45 2.38 0 10 ALA 0.11 0.40 1 11 GLU -1.08 0.97 1 12 GLU -0.63 0.73 1 13 ASN 0.29 0.32 1 15 ALA -0.28 0.43 1 16 VAL 0.48 -0.06 1 18 ALA 0.56 0.31 1 19 ALA 0.88 -0.03 1 20 ASP 0.37 0.43 1 21 ALA 2.90 -0.36 1 22 ALA 3.09 -0.61 1 23 GLN 3.02 -0.41 1 24 LEU 3.59 -0.47 1 25 GLN 5.13 -0.92 1 26 GLU 3.61 -0.76 1 28 TYR 3.46 -0.83 1 29 LYS 4.33 -0.39 1 31 PHE 3.78 0.36 1 32 LEU 2.13 -0.60 1 33 GLU 1.89 0.36 1 34 GLU -0.56 0.96 1 37 SER 1.02 0.14 1 39 THR -3.42 1.73 1 40 LEU 1.35 0.55 1 42 MET 4.98 -0.26 1 43 HIS 3.86 0.63 1 44 GLU 0.61 1.07 1 45 PHE 2.90 0.92 1 46 LYS 4.44 -0.48 1 47 ARG 3.54 -0.68 1 48 PHE -3.64 0.28 1 49 PHE 1.92 0.07 1 53 ASP 0.72 -0.61 1 54 ASN -0.86 0.93 1 55 GLU 2.14 0.27 1 56 GLU 3.09 -0.51 1 57 ALA 1.05 0.34 1 58 THR 5.84 -0.82 1 59 GLN 4.73 -0.94 1 60 TYR 3.26 0.30 1 61 VAL 6.80 -1.87 1 62 GLU 1.85 1.68 1 63 ALA 3.27 -0.73 1 64 MET 3.47 -0.05 1 65 PHE 4.74 -0.40 1 66 ARG 3.95 -0.54 1 67 ALA 2.81 -0.92 1 68 PHE 0.17 0.42 1 69 ASP 4.73 -2.54 1 70 THR 4.23 -0.82 1 71 ASN 0.59 -1.51 1 73 ASP -0.35 -0.67 1 74 ASN 3.12 -1.11 1 75 THR -3.70 2.65 1 76 ILE -1.31 0.26 1 77 ASP -2.94 1.27 1 78 PHE 2.93 0.78 1 79 LEU 4.31 -1.70 1 80 GLU 2.39 -0.13 1 81 TYR 4.01 -0.23 1 82 VAL 5.64 -1.42 1 83 ALA 3.39 -0.66 1 84 ALA 3.39 -0.88 1 85 LEU 3.70 -1.12 1 86 ASN 3.49 0.48 1 87 LEU 3.75 -0.63 1 88 VAL 4.15 -0.70 1 89 LEU 1.39 0.41 1 90 ARG -0.50 0.62 1 93 LEU 4.50 -0.73 1 94 GLU 5.20 -0.73 1 95 HIS 2.94 2.13 1 96 LYS 4.86 -0.35 1 97 LEU 2.50 0.59 1 98 LYS 5.57 -1.08 1 99 TRP 4.05 -0.09 1 100 THR 6.14 -0.82 1 101 PHE 4.14 0.15 1 102 LYS 2.99 -0.32 1 103 ILE 4.37 -1.64 1 104 TYR 0.67 0.26 1 105 ASP 1.29 -2.49 1 106 LYS 3.51 0.34 1 107 ASP 0.33 -1.41 1 108 ARG 5.01 -3.46 1 109 ASN -0.05 -0.47 1 112 ILE -1.43 0.41 1 113 ASP -2.82 1.36 1 114 ARG 5.38 -0.61 1 115 GLN 4.08 -0.97 1 116 GLU 2.44 0.28 1 117 LEU 3.20 -0.66 1 118 LEU 4.09 -0.49 1 119 ASP 3.46 -0.05 1 120 ILE 3.17 -1.54 1 121 VAL 6.86 -1.26 1 122 GLU 4.39 -0.29 1 123 SER 2.93 -0.53 1 124 ILE 5.36 -1.31 1 125 TYR 4.96 -0.81 1 126 LYS 4.09 -0.25 1 127 LEU 2.78 -0.15 1 128 LYS 3.82 -0.48 1 129 LYS 3.17 -0.84 1 130 ALA 1.46 0.00 1 132 SER 1.09 -0.54 1 133 VAL 0.26 -0.17 1 134 GLU -0.19 0.48 1 135 VAL 0.41 -0.04 1 136 GLU 0.29 0.30 1 137 ALA 0.31 0.39 1 138 GLU 0.13 0.33 1 139 GLN 0.55 0.09 1 140 GLN 1.19 -0.32 1 142 LYS -0.62 0.38 1 143 LEU -0.24 0.10 1 144 LEU -1.34 1.20 1 145 THR 1.74 -1.34 1 147 GLU 4.92 -0.71 1 148 GLU 1.70 1.11 1 149 VAL 6.38 -0.84 1 150 VAL 6.70 -1.35 1 151 ASP 4.56 -0.55 1 152 ARG 4.66 -1.12 1 153 ILE 6.96 -1.63 1 154 PHE 7.11 -0.36 1 155 LEU 3.38 0.01 1 156 LEU 0.34 1.43 1 157 VAL 0.44 0.09 1 158 ASP 0.98 -1.83 1 159 GLU 1.82 1.05 1 160 ASN 0.31 -1.56 1 162 ASP -0.11 -0.52 1 164 GLN -4.88 2.86 1 165 LEU -1.41 -0.65 1 166 SER -3.37 1.94 1 167 LEU 5.16 -1.33 1 168 ASN 4.35 -0.55 1 169 GLU 2.91 -0.32 1 170 PHE 2.48 1.92 1 171 VAL 5.28 -0.72 1 172 GLU 3.07 -0.78 1 174 ALA 2.29 -0.28 1 175 ARG 3.00 -0.21 1 176 ARG 0.61 0.80 1 178 LYS 3.48 -0.29 1 179 TRP 6.31 -1.28 1 180 VAL 6.18 -1.22 1 181 MET 4.36 -0.69 1 182 LYS 4.15 -0.84 1 183 MET 3.56 -2.03 1 184 LEU 1.30 -0.76 1 185 GLN 0.07 0.40 1 186 MET 3.47 -2.69 1 187 ASP 2.75 -1.23 1 191 SER 3.08 -0.52 1 192 SER 0.99 0.61 1 193 TRP -0.45 0.01 1 194 ILE 0.92 -0.02 1 195 SER 0.52 0.14 1 197 GLN 0.29 0.24 1 198 ARG 0.63 0.87 1 199 ARG 0.30 0.10 1 200 LYS 0.60 0.06 1 201 SER -0.19 0.28 1 202 ALA -0.51 0.53 1 203 MET -0.07 0.53 1 204 PHE 0.25 0.93 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4492_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.88 _LACS_plot.Line_1_terminator_val_y_1 0.54 _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 0.22 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 165 LEU -1.41 1.13 0 101 PHE 4.14 -1.53 0 10 ALA 0.11 -0.03 1 11 GLU -1.08 -0.45 1 12 GLU -0.63 -0.02 1 13 ASN 0.29 -0.02 1 15 ALA -0.28 0.04 1 16 VAL 0.48 -0.01 1 18 ALA 0.56 -0.02 1 19 ALA 0.88 -0.05 1 20 ASP 0.37 -0.12 1 21 ALA 2.90 -0.32 1 22 ALA 3.09 -0.18 1 23 GLN 3.02 -0.29 1 24 LEU 3.59 -0.34 1 25 GLN 5.13 -0.39 1 26 GLU 3.61 -0.21 1 28 TYR 3.46 -0.46 1 29 LYS 4.33 -0.49 1 31 PHE 3.78 -0.60 1 32 LEU 2.13 -0.40 1 33 GLU 1.89 -0.36 1 34 GLU -0.56 -0.20 1 37 SER 1.02 -0.03 1 39 THR -3.42 0.45 1 40 LEU 1.35 0.36 1 42 MET 4.98 -0.64 1 43 HIS 3.86 -0.38 1 44 GLU 0.61 -0.19 1 45 PHE 2.90 -0.47 1 46 LYS 4.44 -0.36 1 47 ARG 3.54 -0.12 1 48 PHE -3.64 0.04 1 49 PHE 1.92 -0.68 1 53 ASP 0.72 -0.03 1 54 ASN -0.86 0.01 1 55 GLU 2.14 -0.15 1 56 GLU 3.09 -0.13 1 57 ALA 1.05 0.02 1 58 THR 5.84 -0.47 1 59 GLN 4.73 -0.25 1 60 TYR 3.26 -0.40 1 61 VAL 6.80 -0.68 1 62 GLU 1.85 -0.45 1 63 ALA 3.27 -0.30 1 64 MET 3.47 -0.61 1 65 PHE 4.74 -0.46 1 66 ARG 3.95 -0.32 1 67 ALA 2.81 -0.56 1 68 PHE 0.17 -0.39 1 69 ASP 4.73 -0.13 1 70 THR 4.23 -0.37 1 71 ASN 0.59 0.07 1 73 ASP -0.35 -0.02 1 74 ASN 3.12 -0.34 1 75 THR -3.70 0.56 1 76 ILE -1.31 0.83 1 77 ASP -2.94 0.71 1 78 PHE 2.93 -1.05 1 79 LEU 4.31 -0.55 1 80 GLU 2.39 -0.33 1 81 TYR 4.01 -0.50 1 82 VAL 5.64 -0.93 1 83 ALA 3.39 -0.41 1 84 ALA 3.39 -0.72 1 85 LEU 3.70 -0.75 1 86 ASN 3.49 -0.59 1 87 LEU 3.75 -0.46 1 88 VAL 4.15 0.04 1 89 LEU 1.39 -0.05 1 90 ARG -0.50 0.19 1 93 LEU 4.50 -0.32 1 94 GLU 5.20 -0.59 1 95 HIS 2.94 -0.43 1 96 LYS 4.86 -0.23 1 97 LEU 2.50 -0.08 1 98 LYS 5.57 -0.42 1 99 TRP 4.05 -0.46 1 100 THR 6.14 -0.75 1 102 LYS 2.99 -0.46 1 103 ILE 4.37 -0.81 1 104 TYR 0.67 -0.36 1 105 ASP 1.29 -0.16 1 106 LYS 3.51 -0.45 1 107 ASP 0.33 -0.12 1 108 ARG 5.01 -0.48 1 109 ASN -0.05 0.01 1 112 ILE -1.43 0.67 1 113 ASP -2.82 0.68 1 114 ARG 5.38 -0.65 1 115 GLN 4.08 -0.42 1 116 GLU 2.44 -0.25 1 117 LEU 3.20 -0.14 1 118 LEU 4.09 -0.43 1 119 ASP 3.46 -0.21 1 120 ILE 3.17 -0.21 1 121 VAL 6.86 -0.50 1 122 GLU 4.39 -0.42 1 123 SER 2.93 -0.54 1 124 ILE 5.36 -0.41 1 125 TYR 4.96 -0.44 1 126 LYS 4.09 -0.27 1 127 LEU 2.78 -0.19 1 128 LYS 3.82 -0.65 1 129 LYS 3.17 -0.26 1 130 ALA 1.46 -0.02 1 132 SER 1.09 -0.09 1 133 VAL 0.26 0.03 1 134 GLU -0.19 -0.05 1 135 VAL 0.41 -0.04 1 136 GLU 0.29 -0.11 1 137 ALA 0.31 -0.04 1 138 GLU 0.13 -0.04 1 139 GLN 0.55 -0.03 1 140 GLN 1.19 -0.09 1 142 LYS -0.62 0.05 1 143 LEU -0.24 0.12 1 144 LEU -1.34 0.29 1 145 THR 1.74 -0.45 1 147 GLU 4.92 -0.58 1 148 GLU 1.70 -0.25 1 149 VAL 6.38 -0.41 1 150 VAL 6.70 -0.54 1 151 ASP 4.56 -0.11 1 152 ARG 4.66 -0.24 1 153 ILE 6.96 -0.43 1 154 PHE 7.11 -0.85 1 155 LEU 3.38 -0.19 1 156 LEU 0.34 -0.05 1 157 VAL 0.44 0.12 1 158 ASP 0.98 0.03 1 159 GLU 1.82 -0.34 1 160 ASN 0.31 0.10 1 162 ASP -0.11 -0.03 1 164 GLN -4.88 0.80 1 166 SER -3.37 0.52 1 167 LEU 5.16 -1.03 1 168 ASN 4.35 -0.37 1 169 GLU 2.91 -0.13 1 170 PHE 2.48 -0.64 1 171 VAL 5.28 -0.55 1 172 GLU 3.07 -0.27 1 174 ALA 2.29 -0.37 1 175 ARG 3.00 -0.42 1 176 ARG 0.61 -0.02 1 177 ASP -3.74 0.37 1 178 LYS 3.48 -0.26 1 179 TRP 6.31 -0.45 1 180 VAL 6.18 -1.19 1 181 MET 4.36 -0.55 1 182 LYS 4.15 -0.39 1 183 MET 3.56 -0.23 1 184 LEU 1.30 0.28 1 185 GLN 0.07 0.01 1 186 MET 3.47 -0.20 1 192 SER 0.99 -0.07 1 193 TRP -0.45 0.08 1 194 ILE 0.92 -0.01 1 195 SER 0.52 -0.05 1 197 GLN 0.29 0.01 1 198 ARG 0.63 -0.13 1 200 LYS 0.60 0.01 1 201 SER -0.19 -0.04 1 202 ALA -0.51 0.04 1 203 MET -0.07 -0.12 1 204 PHE 0.25 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4492_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.88 _LACS_plot.Line_1_terminator_val_y_1 -1.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.32 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 2.41 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 183 MET 3.56 -2.48 0 69 ASP 4.73 -2.27 0 10 ALA 0.11 0.13 1 11 GLU -1.08 -0.93 1 12 GLU -0.63 -1.36 1 13 ASN 0.29 0.61 1 15 ALA -0.28 -0.11 1 16 VAL 0.48 0.23 1 18 ALA 0.56 0.53 1 19 ALA 0.88 0.33 1 20 ASP 0.37 0.69 1 21 ALA 2.90 1.38 1 22 ALA 3.09 2.44 1 23 GLN 3.02 1.68 1 24 LEU 3.59 0.69 1 25 GLN 5.13 2.31 1 26 GLU 3.61 2.85 1 28 TYR 3.46 1.01 1 31 PHE 3.78 0.94 1 32 LEU 2.13 1.45 1 33 GLU 1.89 1.82 1 34 GLU -0.56 0.13 1 37 SER 1.02 1.50 1 39 THR -3.42 -2.92 1 40 LEU 1.35 1.16 1 43 HIS 3.86 3.02 1 44 GLU 0.61 1.41 1 45 PHE 2.90 0.92 1 46 LYS 4.44 1.44 1 47 ARG 3.54 -0.91 1 48 PHE -3.64 0.70 1 49 PHE 1.92 2.32 1 53 ASP 0.72 -0.57 1 54 ASN -0.86 0.59 1 55 GLU 2.14 1.48 1 56 GLU 3.09 -0.88 1 57 ALA 1.05 0.69 1 58 THR 5.84 1.25 1 59 GLN 4.73 2.78 1 61 VAL 6.80 1.62 1 62 GLU 1.85 -0.51 1 63 ALA 3.27 2.08 1 64 MET 3.47 0.96 1 65 PHE 4.74 1.42 1 66 ARG 3.95 1.63 1 67 ALA 2.81 1.05 1 68 PHE 0.17 1.86 1 70 THR 4.23 1.63 1 71 ASN 0.59 1.54 1 73 ASP -0.35 0.74 1 74 ASN 3.12 -1.50 1 75 THR -3.70 -1.68 1 76 ILE -1.31 -1.23 1 77 ASP -2.94 0.03 1 78 PHE 2.93 0.73 1 79 LEU 4.31 2.62 1 80 GLU 2.39 3.61 1 81 TYR 4.01 0.34 1 82 VAL 5.64 2.05 1 83 ALA 3.39 2.26 1 84 ALA 3.39 1.10 1 85 LEU 3.70 1.28 1 86 ASN 3.49 1.70 1 87 LEU 3.75 1.04 1 88 VAL 4.15 1.26 1 89 LEU 1.39 1.10 1 90 ARG -0.50 0.51 1 93 LEU 4.50 0.93 1 94 GLU 5.20 1.71 1 96 LYS 4.86 3.66 1 98 LYS 5.57 1.84 1 99 TRP 4.05 1.35 1 101 PHE 4.14 0.36 1 102 LYS 2.99 2.14 1 104 TYR 0.67 0.65 1 105 ASP 1.29 0.90 1 106 LYS 3.51 0.79 1 107 ASP 0.33 -0.05 1 108 ARG 5.01 -0.28 1 109 ASN -0.05 1.96 1 112 ILE -1.43 -0.39 1 114 ARG 5.38 1.80 1 115 GLN 4.08 2.33 1 116 GLU 2.44 1.39 1 117 LEU 3.20 0.66 1 118 LEU 4.09 0.26 1 119 ASP 3.46 3.40 1 120 ILE 3.17 1.67 1 121 VAL 6.86 2.22 1 122 GLU 4.39 2.64 1 123 SER 2.93 1.92 1 124 ILE 5.36 1.62 1 125 TYR 4.96 3.03 1 126 LYS 4.09 2.78 1 127 LEU 2.78 0.90 1 128 LYS 3.82 2.14 1 129 LYS 3.17 1.99 1 130 ALA 1.46 0.98 1 132 SER 1.09 -0.43 1 133 VAL 0.26 -0.41 1 134 GLU -0.19 -0.18 1 135 VAL 0.41 -0.14 1 136 GLU 0.29 0.01 1 137 ALA 0.31 0.24 1 138 GLU 0.13 0.34 1 139 GLN 0.55 0.16 1 140 GLN 1.19 0.44 1 142 LYS -0.62 -0.73 1 143 LEU -0.24 -0.58 1 144 LEU -1.34 0.33 1 147 GLU 4.92 1.73 1 148 GLU 1.70 3.58 1 149 VAL 6.38 1.43 1 150 VAL 6.70 1.44 1 151 ASP 4.56 2.94 1 153 ILE 6.96 1.71 1 154 PHE 7.11 2.78 1 155 LEU 3.38 1.52 1 156 LEU 0.34 1.48 1 157 VAL 0.44 1.37 1 158 ASP 0.98 0.88 1 159 GLU 1.82 0.66 1 160 ASN 0.31 1.52 1 162 ASP -0.11 1.53 1 164 GLN -4.88 -1.00 1 165 LEU -1.41 -0.80 1 166 SER -3.37 -0.03 1 167 LEU 5.16 0.63 1 168 ASN 4.35 1.25 1 169 GLU 2.91 2.80 1 170 PHE 2.48 0.02 1 171 VAL 5.28 1.51 1 172 GLU 3.07 3.15 1 174 ALA 2.29 -0.04 1 175 ARG 3.00 1.73 1 176 ARG 0.61 -0.34 1 177 ASP -3.74 -1.39 1 178 LYS 3.48 2.02 1 179 TRP 6.31 1.59 1 180 VAL 6.18 1.45 1 181 MET 4.36 1.44 1 182 LYS 4.15 2.25 1 185 GLN 0.07 -0.48 1 186 MET 3.47 -0.96 1 191 SER 3.08 0.88 1 192 SER 0.99 0.76 1 193 TRP -0.45 0.76 1 195 SER 0.52 0.53 1 197 GLN 0.29 -1.13 1 199 ARG 0.30 -2.77 1 200 LYS 0.60 -0.03 1 201 SER -0.19 -0.61 1 202 ALA -0.51 -0.69 1 203 MET -0.07 -1.62 1 stop_ save_