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 bmr5876_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -2.39 _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 -0.94 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 5.57 _LACS_plot.Y_axis_chem_shift_offset -0.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 SER -2.85 3.51 0 146 HIS 4.73 8.21 0 10 VAL -2.69 -0.22 1 11 HIS -2.27 -0.48 1 12 VAL -4.89 -1.30 1 13 VAL -1.34 -0.85 1 14 LEU -3.34 -1.10 1 15 LYS -1.08 -0.09 1 16 LEU -1.50 -1.00 1 17 TRP -3.54 -1.49 1 18 LYS 4.90 5.79 1 19 THR -0.44 -0.54 1 21 PHE -7.36 -3.24 1 22 SER -4.62 -0.56 1 23 LEU -3.61 -2.29 1 24 ASP 4.41 3.52 1 25 ASN 1.04 0.54 1 27 ASP -1.68 0.14 1 28 LEU 1.53 1.11 1 29 ARG -0.32 -1.54 1 31 TYR 3.48 2.71 1 32 GLN 0.64 0.84 1 33 ASP -2.30 -0.40 1 35 SER 3.88 3.26 1 36 ASN 2.98 3.66 1 37 ALA 1.99 1.78 1 38 GLN 5.00 4.36 1 39 PHE 4.71 4.29 1 40 LEU 3.18 2.85 1 41 GLU 3.41 2.82 1 42 SER 3.30 4.24 1 43 ILE 4.64 2.36 1 44 ARG 4.76 4.39 1 45 ARG -0.08 0.67 1 47 GLU -5.36 -2.67 1 50 ALA 4.25 3.76 1 51 GLU 1.88 3.29 1 52 LEU 1.72 1.16 1 53 ARG 4.92 4.14 1 55 LEU 1.64 1.77 1 56 ALA -1.43 -0.28 1 57 HIS 2.32 1.35 1 60 GLN -1.41 0.04 1 62 ASN -1.59 -0.46 1 63 LEU -3.46 -0.82 1 64 ASP -3.86 -0.87 1 65 MET -3.59 -0.52 1 66 GLU -5.66 -1.63 1 67 ASP 0.35 0.60 1 68 HIS -1.12 -0.64 1 69 ARG 5.64 5.01 1 70 ASP 0.02 -0.27 1 71 GLU -4.86 -0.66 1 72 ASP -1.21 0.34 1 73 PHE 0.60 1.84 1 74 VAL -2.45 -1.37 1 75 LYS -1.53 0.42 1 77 LYS -0.04 0.60 1 79 ALA -0.90 0.14 1 80 PHE -0.03 0.65 1 81 LYS -0.87 0.08 1 82 ALA -0.89 0.25 1 83 PHE -0.03 0.55 1 84 THR -0.21 0.29 1 86 GLU -0.43 0.61 1 88 GLN -0.23 0.58 1 89 LYS -0.25 0.18 1 90 LEU 0.39 0.97 1 92 SER -0.22 0.36 1 93 THR -0.10 0.40 1 94 ALA 0.42 0.90 1 96 GLN -0.34 0.58 1 97 VAL 0.23 0.62 1 98 LEU -0.51 0.34 1 99 ASN 0.10 0.58 1 100 THR 0.14 0.43 1 101 SER -0.36 0.42 1 102 SER -0.14 0.44 1 104 ALA 1.52 1.88 1 105 GLN 2.07 2.32 1 106 GLN -0.03 1.51 1 107 ALA 1.76 2.00 1 110 GLU -0.80 -0.46 1 111 ALA -0.35 -0.34 1 112 LYS 2.38 2.29 1 113 ALA 1.08 1.98 1 114 SER 1.76 2.15 1 115 SER 2.30 2.78 1 116 SER 1.31 1.97 1 117 ILE 0.60 -0.47 1 118 LEU -0.31 -0.08 1 119 ILE -1.90 -1.72 1 120 ASN -0.39 -0.67 1 121 GLU 2.70 2.34 1 122 ALA -0.44 0.29 1 123 GLU -3.44 -0.52 1 125 THR -5.28 -1.62 1 126 THR -2.15 -1.17 1 127 ASN -1.82 0.31 1 128 ILE -4.22 -2.79 1 129 GLN -3.49 -0.95 1 130 ILE -3.50 -0.47 1 131 ARG -0.34 -0.72 1 132 LEU -1.83 -0.17 1 133 ALA 2.33 2.43 1 137 ARG -3.72 -0.63 1 138 LEU -5.57 -0.88 1 139 VAL -1.86 -0.41 1 140 GLN -4.65 -1.31 1 141 LYS -0.92 0.42 1 142 PHE -6.79 -0.46 1 143 ASN 2.37 5.57 1 144 HIS 0.81 4.47 1 145 SER 0.61 0.73 1 147 ARG -3.98 -1.07 1 148 ILE 6.74 5.23 1 149 SER 3.63 2.60 1 150 ASP 4.62 5.00 1 151 ILE 6.66 4.70 1 152 ARG 6.26 5.79 1 153 LEU 4.14 3.66 1 154 PHE 3.73 4.00 1 155 ILE 5.85 5.85 1 156 VAL 4.82 3.86 1 157 ASP 2.94 2.78 1 158 ALA 1.61 1.98 1 159 ARG 3.91 3.51 1 161 ALA 2.42 2.43 1 162 MET 1.47 1.40 1 163 ALA 2.95 3.32 1 164 ALA -1.06 -0.33 1 165 THR -1.00 0.25 1 166 SER 0.42 0.64 1 167 PHE -3.05 -0.46 1 168 VAL -5.25 -2.02 1 169 LEU -2.99 -1.24 1 170 MET -5.31 -0.83 1 171 THR -1.26 -0.19 1 172 THR -0.20 0.43 1 173 PHE 1.05 2.00 1 175 ASN 1.57 1.29 1 176 LYS -2.43 0.33 1 177 GLU -0.24 0.82 1 178 LEU 2.18 -0.88 1 179 ALA 0.37 1.72 1 180 ASP -0.89 -1.41 1 181 GLU 3.59 1.98 1 182 ASN 0.33 1.12 1 183 GLN -0.74 1.54 1 184 THR -1.98 -0.37 1 185 LEU 5.65 4.10 1 186 LYS 3.01 3.72 1 187 GLU 2.61 2.96 1 188 ALA -0.97 -0.07 1 189 ASN 3.35 1.74 1 190 LEU -1.20 -1.06 1 191 LEU 4.23 1.52 1 192 ASN 2.02 1.65 1 193 ALA -3.11 0.38 1 194 VAL 0.01 -0.15 1 195 ILE -3.67 -1.98 1 196 VAL -3.38 -0.86 1 197 GLN -1.89 -0.42 1 198 ARG -3.71 -0.89 1 199 LEU 2.80 1.52 1 200 THR -0.02 0.88 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5876_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 4.97 _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 1.06 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -1.16 _LACS_plot.Y_axis_chem_shift_offset -0.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 SER -2.85 6.36 0 146 HIS 4.73 3.48 0 10 VAL -2.69 2.47 1 11 HIS -2.27 1.79 1 12 VAL -4.89 3.59 1 13 VAL -1.34 0.49 1 14 LEU -3.34 2.24 1 15 LYS -1.08 0.99 1 16 LEU -1.50 0.50 1 17 TRP -3.54 2.05 1 18 LYS 4.90 0.89 1 19 THR -0.44 -0.10 1 21 PHE -7.36 4.12 1 22 SER -4.62 4.06 1 23 LEU -3.61 1.32 1 24 ASP 4.41 -0.89 1 25 ASN 1.04 -0.50 1 27 ASP -1.68 1.82 1 28 LEU 1.53 -0.42 1 29 ARG -0.32 -1.22 1 31 TYR 3.48 -0.77 1 32 GLN 0.64 0.20 1 33 ASP -2.30 1.90 1 35 SER 3.88 -0.62 1 36 ASN 2.98 0.68 1 37 ALA 1.99 -0.21 1 38 GLN 5.00 -0.64 1 39 PHE 4.71 -0.42 1 40 LEU 3.18 -0.33 1 41 GLU 3.41 -0.59 1 42 SER 3.30 0.94 1 43 ILE 4.64 -2.28 1 44 ARG 4.76 -0.37 1 45 ARG -0.08 0.75 1 47 GLU -5.36 2.69 1 50 ALA 4.25 -0.49 1 51 GLU 1.88 1.41 1 52 LEU 1.72 -0.56 1 53 ARG 4.92 -0.78 1 55 LEU 1.64 0.13 1 56 ALA -1.43 1.15 1 57 HIS 2.32 -0.97 1 60 GLN -1.41 1.45 1 62 ASN -1.59 1.13 1 63 LEU -3.46 2.64 1 64 ASP -3.86 2.99 1 65 MET -3.59 3.07 1 66 GLU -5.66 4.03 1 67 ASP 0.35 0.25 1 68 HIS -1.12 0.48 1 69 ARG 5.64 -0.63 1 70 ASP 0.02 -0.29 1 71 GLU -4.86 4.20 1 72 ASP -1.21 1.55 1 73 PHE 0.60 1.24 1 74 VAL -2.45 1.08 1 75 LYS -1.53 1.95 1 77 LYS -0.04 0.64 1 79 ALA -0.90 1.04 1 80 PHE -0.03 0.68 1 81 LYS -0.87 0.95 1 82 ALA -0.89 1.14 1 83 PHE -0.03 0.58 1 84 THR -0.21 0.50 1 86 GLU -0.43 1.04 1 88 GLN -0.23 0.81 1 89 LYS -0.25 0.43 1 90 LEU 0.39 0.58 1 92 SER -0.22 0.58 1 93 THR -0.10 0.50 1 94 ALA 0.42 0.48 1 96 GLN -0.34 0.92 1 97 VAL 0.23 0.39 1 98 LEU -0.51 0.85 1 99 ASN 0.10 0.48 1 100 THR 0.14 0.29 1 101 SER -0.36 0.78 1 102 SER -0.14 0.58 1 104 ALA 1.52 0.36 1 105 GLN 2.07 0.25 1 106 GLN -0.03 1.54 1 107 ALA 1.76 0.24 1 110 GLU -0.80 0.34 1 111 ALA -0.35 0.01 1 112 LYS 2.38 -0.09 1 113 ALA 1.08 0.90 1 114 SER 1.76 0.39 1 115 SER 2.30 0.48 1 116 SER 1.31 0.66 1 117 ILE 0.60 -1.07 1 118 LEU -0.31 0.23 1 119 ILE -1.90 0.18 1 120 ASN -0.39 -0.28 1 121 GLU 2.70 -0.36 1 122 ALA -0.44 0.73 1 123 GLU -3.44 2.92 1 125 THR -5.28 3.66 1 126 THR -2.15 0.98 1 127 ASN -1.82 2.13 1 128 ILE -4.22 1.43 1 129 GLN -3.49 2.54 1 130 ILE -3.50 3.03 1 131 ARG -0.34 -0.38 1 132 LEU -1.83 1.66 1 133 ALA 2.33 0.10 1 137 ARG -3.72 3.09 1 138 LEU -5.57 4.69 1 139 VAL -1.86 1.45 1 140 GLN -4.65 3.34 1 141 LYS -0.92 1.34 1 142 PHE -6.79 6.33 1 143 ASN 2.37 3.20 1 144 HIS 0.81 3.66 1 145 SER 0.61 0.12 1 147 ARG -3.98 2.91 1 148 ILE 6.74 -1.51 1 149 SER 3.63 -1.03 1 150 ASP 4.62 0.38 1 151 ILE 6.66 -1.96 1 152 ARG 6.26 -0.47 1 153 LEU 4.14 -0.48 1 154 PHE 3.73 0.27 1 155 ILE 5.85 0.00 1 156 VAL 4.82 -0.96 1 157 ASP 2.94 -0.16 1 158 ALA 1.61 0.37 1 159 ARG 3.91 -0.40 1 161 ALA 2.42 0.01 1 162 MET 1.47 -0.07 1 163 ALA 2.95 0.37 1 164 ALA -1.06 0.73 1 165 THR -1.00 1.25 1 166 SER 0.42 0.22 1 167 PHE -3.05 2.59 1 168 VAL -5.25 3.23 1 169 LEU -2.99 1.75 1 170 MET -5.31 4.48 1 171 THR -1.26 1.07 1 172 THR -0.20 0.63 1 173 PHE 1.05 0.95 1 175 ASN 1.57 -0.28 1 176 LYS -2.43 2.76 1 177 GLU -0.24 1.06 1 178 LEU 2.18 -3.06 1 179 ALA 0.37 1.35 1 180 ASP -0.89 -0.52 1 181 GLU 3.59 -1.61 1 182 ASN 0.33 0.79 1 183 GLN -0.74 2.28 1 184 THR -1.98 1.61 1 185 LEU 5.65 -1.55 1 186 LYS 3.01 0.71 1 187 GLU 2.61 0.35 1 188 ALA -0.97 0.90 1 189 ASN 3.35 -1.61 1 190 LEU -1.20 0.14 1 191 LEU 4.23 -2.71 1 192 ASN 2.02 -0.37 1 193 ALA -3.11 3.49 1 194 VAL 0.01 -0.16 1 195 ILE -3.67 1.69 1 196 VAL -3.38 2.52 1 197 GLN -1.89 1.47 1 198 ARG -3.71 2.82 1 199 LEU 2.80 -1.28 1 200 THR -0.02 0.90 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5876_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.17 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _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 73 PHE 0.60 -2.26 0 10 VAL -2.69 0.08 1 11 HIS -2.27 0.71 1 12 VAL -4.89 0.39 1 13 VAL -1.34 0.40 1 14 LEU -3.34 0.61 1 15 LYS -1.08 0.53 1 16 LEU -1.50 0.23 1 17 TRP -3.54 0.53 1 18 LYS 4.90 0.13 1 19 THR -0.44 0.35 1 21 PHE -7.36 1.54 1 22 SER -4.62 0.16 1 23 LEU -3.61 1.03 1 24 ASP 4.41 -0.52 1 25 ASN 1.04 0.26 1 27 ASP -1.68 -0.25 1 28 LEU 1.53 -1.38 1 29 ARG -0.32 -0.46 1 30 SER -2.85 -0.37 1 31 TYR 3.48 -0.05 1 32 GLN 0.64 -0.14 1 33 ASP -2.30 -0.12 1 35 SER 3.88 -0.18 1 36 ASN 2.98 0.30 1 37 ALA 1.99 -0.18 1 38 GLN 5.00 -0.33 1 39 PHE 4.71 -0.80 1 40 LEU 3.18 -0.55 1 41 GLU 3.41 -0.35 1 42 SER 3.30 -0.64 1 43 ILE 4.64 -0.40 1 44 ARG 4.76 -0.45 1 45 ARG -0.08 -0.13 1 47 GLU -5.36 0.00 1 50 ALA 4.25 -0.55 1 51 GLU 1.88 -0.36 1 52 LEU 1.72 -0.08 1 53 ARG 4.92 -0.61 1 55 LEU 1.64 -0.33 1 56 ALA -1.43 -0.18 1 57 HIS 2.32 -0.41 1 60 GLN -1.41 -0.09 1 62 ASN -1.59 0.02 1 63 LEU -3.46 0.60 1 64 ASP -3.86 0.36 1 65 MET -3.59 0.90 1 66 GLU -5.66 0.04 1 67 ASP 0.35 -0.25 1 68 HIS -1.12 0.02 1 69 ARG 5.64 -0.89 1 70 ASP 0.02 0.06 1 71 GLU -4.86 0.35 1 72 ASP -1.21 0.14 1 74 VAL -2.45 -0.65 1 75 LYS -1.53 -0.72 1 77 LYS -0.04 -0.18 1 79 ALA -0.90 -0.23 1 80 PHE -0.03 -0.17 1 81 LYS -0.87 -0.23 1 82 ALA -0.89 -0.22 1 83 PHE -0.03 -0.04 1 84 THR -0.21 -0.18 1 86 GLU -0.43 -0.18 1 88 GLN -0.23 -0.14 1 89 LYS -0.25 -0.12 1 90 LEU 0.39 -0.18 1 92 SER -0.22 -0.07 1 93 THR -0.10 -0.09 1 94 ALA 0.42 -0.14 1 96 GLN -0.34 -0.13 1 97 VAL 0.23 -0.14 1 98 LEU -0.51 -0.08 1 99 ASN 0.10 -0.05 1 100 THR 0.14 -0.09 1 101 SER -0.36 -0.02 1 102 SER -0.14 -0.17 1 104 ALA 1.52 -0.18 1 105 GLN 2.07 -0.06 1 106 GLN -0.03 -0.11 1 110 GLU -0.80 -0.14 1 111 ALA -0.35 -0.10 1 112 LYS 2.38 -0.22 1 113 ALA 1.08 -0.15 1 114 SER 1.76 -0.07 1 115 SER 2.30 -0.21 1 116 SER 1.31 -0.14 1 117 ILE 0.60 -0.19 1 118 LEU -0.31 0.06 1 119 ILE -1.90 0.01 1 120 ASN -0.39 -0.02 1 121 GLU 2.70 -0.38 1 122 ALA -0.44 -0.05 1 123 GLU -3.44 0.03 1 125 THR -5.28 1.01 1 126 THR -2.15 0.37 1 127 ASN -1.82 0.40 1 128 ILE -4.22 0.36 1 129 GLN -3.49 0.70 1 130 ILE -3.50 0.69 1 131 ARG -0.34 0.38 1 132 LEU -1.83 -0.13 1 133 ALA 2.33 -0.16 1 137 ARG -3.72 1.04 1 138 LEU -5.57 0.54 1 139 VAL -1.86 0.83 1 140 GLN -4.65 -0.12 1 141 LYS -0.92 0.69 1 142 PHE -6.79 -0.12 1 143 ASN 2.37 0.71 1 144 HIS 0.81 -0.64 1 145 SER 0.61 -0.19 1 146 HIS 4.73 -0.29 1 147 ARG -3.98 0.72 1 148 ILE 6.74 -0.89 1 149 SER 3.63 -0.02 1 150 ASP 4.62 0.04 1 151 ILE 6.66 -0.53 1 152 ARG 6.26 -0.52 1 153 LEU 4.14 -0.39 1 154 PHE 3.73 -0.20 1 155 ILE 5.85 0.03 1 156 VAL 4.82 0.00 1 157 ASP 2.94 -0.34 1 158 ALA 1.61 -0.62 1 159 ARG 3.91 -0.01 1 161 ALA 2.42 -0.13 1 162 MET 1.47 0.03 1 163 ALA 2.95 -0.29 1 164 ALA -1.06 0.19 1 165 THR -1.00 0.03 1 166 SER 0.42 0.10 1 167 PHE -3.05 0.86 1 168 VAL -5.25 0.20 1 169 LEU -2.99 0.86 1 170 MET -5.31 0.83 1 171 THR -1.26 0.50 1 172 THR -0.20 -0.03 1 173 PHE 1.05 -0.53 1 175 ASN 1.57 0.01 1 176 LYS -2.43 0.04 1 177 GLU -0.24 -0.01 1 178 LEU 2.18 0.08 1 179 ALA 0.37 -0.04 1 180 ASP -0.89 0.13 1 181 GLU 3.59 0.28 1 182 ASN 0.33 -0.01 1 183 GLN -0.74 -0.11 1 184 THR -1.98 0.57 1 185 LEU 5.65 -0.69 1 186 LYS 3.01 -0.58 1 187 GLU 2.61 -0.51 1 188 ALA -0.97 -0.12 1 189 ASN 3.35 -0.48 1 190 LEU -1.20 0.02 1 191 LEU 4.23 -0.42 1 192 ASN 2.02 0.13 1 193 ALA -3.11 0.06 1 194 VAL 0.01 0.57 1 195 ILE -3.67 0.51 1 196 VAL -3.38 0.41 1 197 GLN -1.89 0.28 1 198 ARG -3.71 0.29 1 199 LEU 2.80 0.21 1 200 THR -0.02 0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5876_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -4.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.09 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 1.32 _LACS_plot.Y_axis_chem_shift_offset 1.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ARG 5.64 4.63 0 200 THR -0.02 3.56 0 142 PHE -6.79 0.32 0 10 VAL -2.69 -3.10 1 11 HIS -2.27 -1.32 1 12 VAL -4.89 -4.14 1 13 VAL -1.34 -2.93 1 14 LEU -3.34 -4.85 1 15 LYS -1.08 -3.17 1 16 LEU -1.50 -3.86 1 17 TRP -3.54 0.84 1 18 LYS 4.90 1.74 1 19 THR -0.44 -0.87 1 21 PHE -7.36 -4.54 1 22 SER -4.62 -3.71 1 23 LEU -3.61 -1.14 1 24 ASP 4.41 0.48 1 25 ASN 1.04 -1.09 1 27 ASP -1.68 -2.47 1 28 LEU 1.53 -2.44 1 29 ARG -0.32 -0.86 1 30 SER -2.85 -2.39 1 31 TYR 3.48 -1.50 1 32 GLN 0.64 -1.20 1 33 ASP -2.30 0.11 1 35 SER 3.88 1.56 1 36 ASN 2.98 -0.58 1 37 ALA 1.99 1.62 1 38 GLN 5.00 1.41 1 39 PHE 4.71 0.70 1 40 LEU 3.18 0.41 1 41 GLU 3.41 1.07 1 42 SER 3.30 0.24 1 43 ILE 4.64 2.92 1 44 ARG 4.76 0.57 1 45 ARG -0.08 -1.05 1 47 GLU -5.36 -2.34 1 50 ALA 4.25 0.95 1 51 GLU 1.88 0.34 1 52 LEU 1.72 -0.71 1 53 ARG 4.92 -0.62 1 55 LEU 1.64 -1.42 1 56 ALA -1.43 -1.12 1 57 HIS 2.32 -0.29 1 60 GLN -1.41 -1.62 1 62 ASN -1.59 -3.90 1 63 LEU -3.46 -3.47 1 64 ASP -3.86 -3.17 1 65 MET -3.59 -1.55 1 66 GLU -5.66 -3.38 1 67 ASP 0.35 -2.19 1 68 HIS -1.12 1.39 1 70 ASP 0.02 -1.39 1 71 GLU -4.86 -2.36 1 72 ASP -1.21 -2.08 1 73 PHE 0.60 -2.62 1 74 VAL -2.45 -4.01 1 75 LYS -1.53 -1.50 1 77 LYS -0.04 -0.53 1 79 ALA -0.90 -1.75 1 80 PHE -0.03 -1.56 1 81 LYS -0.87 -2.47 1 82 ALA -0.89 -1.73 1 83 PHE -0.03 -0.96 1 84 THR -0.21 -1.05 1 86 GLU -0.43 -0.53 1 88 GLN -0.23 -1.12 1 89 LYS -0.25 -1.18 1 90 LEU 0.39 -0.88 1 92 SER -0.22 -0.90 1 93 THR -0.10 -1.87 1 94 ALA 0.42 2.14 1 96 GLN -0.34 -1.20 1 97 VAL 0.23 -1.65 1 98 LEU -0.51 -1.92 1 99 ASN 0.10 -0.88 1 100 THR 0.14 -1.23 1 101 SER -0.36 -1.64 1 104 ALA 1.52 0.37 1 105 GLN 2.07 0.03 1 106 GLN -0.03 3.33 1 111 ALA -0.35 1.17 1 112 LYS 2.38 0.99 1 113 ALA 1.08 0.80 1 114 SER 1.76 -0.75 1 115 SER 2.30 0.87 1 116 SER 1.31 1.02 1 117 ILE 0.60 -2.81 1 118 LEU -0.31 -2.80 1 119 ILE -1.90 -1.67 1 120 ASN -0.39 0.83 1 121 GLU 2.70 2.37 1 122 ALA -0.44 -2.09 1 123 GLU -3.44 -2.63 1 125 THR -5.28 -2.08 1 127 ASN -1.82 -2.41 1 128 ILE -4.22 -2.14 1 129 GLN -3.49 -3.21 1 130 ILE -3.50 -2.03 1 131 ARG -0.34 -2.20 1 132 LEU -1.83 0.52 1 133 ALA 2.33 -1.34 1 137 ARG -3.72 -2.28 1 138 LEU -5.57 -3.34 1 139 VAL -1.86 -2.97 1 140 GLN -4.65 -4.85 1 141 LYS -0.92 -3.32 1 143 ASN 2.37 -1.92 1 144 HIS 0.81 -0.45 1 145 SER 0.61 1.02 1 146 HIS 4.73 -1.29 1 147 ARG -3.98 1.40 1 148 ILE 6.74 1.51 1 149 SER 3.63 1.19 1 150 ASP 4.62 1.11 1 151 ILE 6.66 0.35 1 152 ARG 6.26 2.05 1 153 LEU 4.14 -0.24 1 154 PHE 3.73 -0.46 1 155 ILE 5.85 -0.97 1 156 VAL 4.82 0.20 1 158 ALA 1.61 -0.17 1 159 ARG 3.91 -2.96 1 161 ALA 2.42 1.05 1 162 MET 1.47 -0.41 1 163 ALA 2.95 -1.04 1 164 ALA -1.06 -2.10 1 165 THR -1.00 -2.15 1 166 SER 0.42 -1.01 1 167 PHE -3.05 -3.48 1 168 VAL -5.25 -4.14 1 169 LEU -2.99 -3.44 1 170 MET -5.31 -1.52 1 171 THR -1.26 -1.07 1 172 THR -0.20 -1.53 1 173 PHE 1.05 -1.98 1 175 ASN 1.57 -1.22 1 176 LYS -2.43 -3.43 1 177 GLU -0.24 -1.13 1 178 LEU 2.18 -3.44 1 179 ALA 0.37 -1.15 1 180 ASP -0.89 -0.23 1 181 GLU 3.59 -2.69 1 182 ASN 0.33 -0.81 1 183 GLN -0.74 -0.94 1 184 THR -1.98 -0.29 1 185 LEU 5.65 0.40 1 186 LYS 3.01 2.00 1 187 GLU 2.61 0.12 1 188 ALA -0.97 -3.20 1 189 ASN 3.35 -0.65 1 190 LEU -1.20 -4.04 1 191 LEU 4.23 -0.13 1 192 ASN 2.02 -1.82 1 193 ALA -3.11 -2.83 1 194 VAL 0.01 -1.93 1 195 ILE -3.67 -3.64 1 196 VAL -3.38 -2.60 1 197 GLN -1.89 -3.84 1 198 ARG -3.71 -2.83 1 199 LEU 2.80 -1.74 1 stop_ save_