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 bmr25379_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 -7.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -4.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -6.83 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset 5.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 ALA -8.71 -6.84 0 88 VAL 0.51 -7.69 0 10 ALA 0.13 -4.99 1 11 ASN 0.35 -5.09 1 12 VAL 0.68 -4.88 1 13 PHE 0.55 -5.05 1 15 LYS -0.35 -5.53 1 17 LYS 0.24 -4.97 1 18 LYS -0.10 -5.15 1 19 ASN 0.34 -4.97 1 20 THR 0.29 -5.21 1 21 GLU 0.26 -3.99 1 22 PHE -5.56 -6.40 1 23 MET -3.98 -6.77 1 25 TYR -2.03 -4.78 1 26 ASN -1.57 -5.87 1 28 ASP 1.21 -5.91 1 30 PHE -4.52 -7.38 1 31 LYS -4.47 -6.38 1 32 LEU 0.77 -3.85 1 33 LEU -2.06 -6.56 1 34 VAL -3.90 -7.67 1 36 SER 3.33 -2.27 1 37 LYS 0.99 -5.51 1 38 TRP -1.15 -6.24 1 39 ASN -2.77 -5.97 1 41 SER -2.96 -7.55 1 42 LYS 0.61 -5.15 1 43 GLU -0.08 -5.33 1 44 LYS -0.64 -5.96 1 45 GLU -0.98 -4.24 1 46 PHE -4.77 -6.75 1 49 GLN 0.91 -2.98 1 50 VAL -1.63 -6.04 1 51 LEU -4.43 -5.02 1 52 ARG -1.73 -4.63 1 53 TYR -7.06 -6.30 1 54 GLU -7.32 -8.32 1 55 ASP -1.39 -5.45 1 56 ASN 3.23 -2.48 1 57 PHE 0.38 -4.79 1 58 ASP -0.85 -5.97 1 59 ALA 2.77 -3.36 1 60 THR 2.80 -3.02 1 61 SER -0.87 -6.38 1 62 ASN -1.85 -4.94 1 63 LEU -5.42 -5.93 1 64 SER -4.13 -5.86 1 65 VAL -2.47 -6.32 1 66 LEU -3.35 -6.46 1 67 VAL -2.29 -6.01 1 68 GLN -4.99 -7.14 1 70 THR -0.90 -6.33 1 71 ASP 0.04 -6.04 1 72 LYS 1.11 -5.40 1 73 LYS 0.27 -4.74 1 74 SER -3.07 -7.74 1 75 ILE 0.20 -5.11 1 76 THR 2.79 -4.15 1 77 ASP 2.38 -3.10 1 78 PHE 2.94 -2.25 1 80 SER 1.96 -3.71 1 82 GLU 5.77 -0.74 1 83 ASP 4.67 -1.15 1 84 PHE 4.70 -1.93 1 85 LEU 2.80 -3.35 1 86 SER 3.63 -2.19 1 87 GLN 1.61 -3.64 1 89 ASP 4.85 -2.08 1 90 TYR 2.44 -4.98 1 91 LEU 0.77 -4.26 1 92 LEU 0.54 -5.49 1 94 LYS 0.72 -4.64 1 95 GLN 0.28 -4.98 1 96 ALA -1.06 -5.61 1 97 TYR -0.53 -5.30 1 98 PHE 0.07 -5.18 1 100 LYS 0.00 -5.11 1 101 THR -0.14 -5.31 1 102 ASP 0.03 -5.33 1 103 SER 0.51 -4.68 1 104 GLU 0.22 -5.08 1 107 PHE 0.25 -4.99 1 108 ASP -0.16 -5.30 1 109 SER 0.75 -4.46 1 111 VAL 0.60 -4.88 1 112 VAL 0.61 -4.85 1 113 ALA -0.84 -5.37 1 114 SER -0.46 -5.39 1 115 ALA -2.81 -6.22 1 116 ASN -2.86 -5.98 1 119 GLU -6.86 -6.60 1 120 SER -3.25 -5.96 1 121 SER -2.27 -5.85 1 122 THR -2.63 -8.18 1 124 VAL -0.66 -6.20 1 125 VAL -2.29 -5.87 1 126 ASP 2.45 -4.05 1 128 LYS -2.40 -6.65 1 129 GLN -0.80 -5.14 1 130 TYR -3.60 -6.47 1 131 TYR -5.92 -9.51 1 132 SER -1.78 -6.94 1 133 ILE -4.37 -5.26 1 134 THR 0.08 -5.10 1 135 VAL -5.25 -7.71 1 136 LEU -3.73 -7.07 1 137 THR -2.53 -6.97 1 138 ARG -2.41 -5.76 1 139 THR -1.45 -6.15 1 140 ALA -0.21 -5.16 1 141 ASP 0.09 -5.13 1 143 ASP 0.79 -4.37 1 144 GLU 0.95 -4.39 1 147 LYS -3.02 -5.71 1 148 HIS -0.94 -5.58 1 149 GLN -2.97 -6.19 1 150 VAL -2.25 -6.05 1 151 ILE -4.41 -6.33 1 152 ALA -5.37 -7.24 1 154 THR 1.34 -5.27 1 155 VAL -4.36 -6.87 1 156 LYS -2.83 -4.91 1 157 ASP 2.35 -3.91 1 159 LYS -4.06 -6.47 1 160 LEU -3.52 -6.85 1 161 TYR -3.13 -5.95 1 162 ILE -5.38 -6.69 1 164 LYS -4.84 -7.58 1 165 ALA -7.39 -6.93 1 166 GLN -6.75 -6.89 1 167 ALA -5.22 -5.30 1 169 ASP 4.17 -0.85 1 170 LYS 4.56 -1.83 1 171 ARG 1.75 -4.56 1 172 TRP 3.76 -1.28 1 173 PHE 3.75 -2.63 1 174 LYS -0.63 -6.05 1 176 ALA 3.01 -2.78 1 177 LYS 3.58 -2.38 1 178 LYS 3.46 -2.95 1 179 PHE 3.78 -2.73 1 180 VAL 5.37 -0.76 1 181 GLU 4.17 -2.11 1 182 SER 4.69 -1.13 1 183 ALA 2.81 -2.35 1 184 THR 4.78 -1.43 1 185 SER 3.30 -2.20 1 186 SER 0.99 -4.50 1 187 PHE 1.37 -4.60 1 188 SER -3.59 -7.27 1 189 VAL -0.90 -6.48 1 190 ALA 0.82 -3.62 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25379_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 0.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -6.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.83 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -6.47 _LACS_plot.Y_axis_chem_shift_offset 5.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 ALA -8.71 1.87 0 88 VAL 0.51 -8.20 0 10 ALA 0.13 -5.12 1 11 ASN 0.35 -5.44 1 12 VAL 0.68 -5.56 1 13 PHE 0.55 -5.60 1 15 LYS -0.35 -5.18 1 17 LYS 0.24 -5.21 1 18 LYS -0.10 -5.05 1 19 ASN 0.34 -5.31 1 20 THR 0.29 -5.50 1 21 GLU 0.26 -4.25 1 22 PHE -5.56 -0.84 1 23 MET -3.98 -2.79 1 25 TYR -2.03 -2.75 1 26 ASN -1.57 -4.30 1 28 ASP 1.21 -7.12 1 30 PHE -4.52 -2.86 1 31 LYS -4.47 -1.91 1 32 LEU 0.77 -4.62 1 33 LEU -2.06 -4.50 1 34 VAL -3.90 -3.77 1 36 SER 3.33 -5.60 1 37 LYS 0.99 -6.50 1 38 TRP -1.15 -5.09 1 39 ASN -2.77 -3.20 1 41 SER -2.96 -4.59 1 42 LYS 0.61 -5.76 1 43 GLU -0.08 -5.25 1 44 LYS -0.64 -5.32 1 45 GLU -0.98 -3.26 1 46 PHE -4.77 -1.98 1 49 GLN 0.91 -3.89 1 50 VAL -1.63 -4.41 1 51 LEU -4.43 -0.59 1 52 ARG -1.73 -2.90 1 53 TYR -7.06 0.76 1 54 GLU -7.32 -1.00 1 55 ASP -1.39 -4.06 1 56 ASN 3.23 -5.71 1 57 PHE 0.38 -5.17 1 58 ASP -0.85 -5.12 1 59 ALA 2.77 -6.13 1 60 THR 2.80 -5.82 1 61 SER -0.87 -5.51 1 62 ASN -1.85 -3.09 1 63 LEU -5.42 -0.51 1 64 SER -4.13 -1.73 1 65 VAL -2.47 -3.85 1 66 LEU -3.35 -3.11 1 67 VAL -2.29 -3.72 1 68 GLN -4.99 -2.15 1 70 THR -0.90 -5.43 1 71 ASP 0.04 -6.08 1 72 LYS 1.11 -6.51 1 73 LYS 0.27 -5.01 1 74 SER -3.07 -4.67 1 75 ILE 0.20 -5.31 1 76 THR 2.79 -6.94 1 77 ASP 2.38 -5.48 1 78 PHE 2.94 -5.19 1 80 SER 1.96 -5.67 1 82 GLU 5.77 -6.51 1 83 ASP 4.67 -5.82 1 84 PHE 4.70 -6.63 1 85 LEU 2.80 -6.15 1 86 SER 3.63 -5.82 1 87 GLN 1.61 -5.25 1 89 ASP 4.85 -6.93 1 90 TYR 2.44 -7.42 1 91 LEU 0.77 -5.03 1 92 LEU 0.54 -6.03 1 94 LYS 0.72 -5.36 1 95 GLN 0.28 -5.26 1 96 ALA -1.06 -4.55 1 97 TYR -0.53 -4.77 1 98 PHE 0.07 -5.25 1 100 LYS 0.00 -5.11 1 101 THR -0.14 -5.17 1 102 ASP 0.03 -5.36 1 103 SER 0.51 -5.19 1 104 GLU 0.22 -5.30 1 107 PHE 0.25 -5.24 1 108 ASP -0.16 -5.14 1 109 SER 0.75 -5.21 1 111 VAL 0.60 -5.48 1 112 VAL 0.61 -5.46 1 113 ALA -0.84 -4.53 1 114 SER -0.46 -4.93 1 115 ALA -2.81 -3.41 1 116 ASN -2.86 -3.12 1 119 GLU -6.86 0.26 1 120 SER -3.25 -2.71 1 121 SER -2.27 -3.58 1 122 THR -2.63 -5.55 1 124 VAL -0.66 -5.54 1 125 VAL -2.29 -3.58 1 126 ASP 2.45 -6.50 1 128 LYS -2.40 -4.25 1 129 GLN -0.80 -4.34 1 130 TYR -3.60 -2.87 1 131 TYR -5.92 -3.59 1 132 SER -1.78 -5.16 1 133 ILE -4.37 -0.89 1 134 THR 0.08 -5.18 1 135 VAL -5.25 -2.46 1 136 LEU -3.73 -3.34 1 137 THR -2.53 -4.44 1 138 ARG -2.41 -3.35 1 139 THR -1.45 -4.70 1 140 ALA -0.21 -4.95 1 141 ASP 0.09 -5.22 1 143 ASP 0.79 -5.16 1 144 GLU 0.95 -5.34 1 147 LYS -3.02 -2.69 1 148 HIS -0.94 -4.64 1 149 GLN -2.97 -3.22 1 150 VAL -2.25 -3.80 1 151 ILE -4.41 -1.92 1 152 ALA -5.37 -1.87 1 154 THR 1.34 -6.61 1 155 VAL -4.36 -2.51 1 156 LYS -2.83 -2.08 1 157 ASP 2.35 -6.26 1 159 LYS -4.06 -2.41 1 160 LEU -3.52 -3.33 1 161 TYR -3.13 -2.82 1 162 ILE -5.38 -1.31 1 164 LYS -4.84 -2.74 1 165 ALA -7.39 0.46 1 166 GLN -6.75 -0.14 1 167 ALA -5.22 -0.08 1 169 ASP 4.17 -5.02 1 170 LYS 4.56 -6.39 1 171 ARG 1.75 -6.31 1 172 TRP 3.76 -5.04 1 173 PHE 3.75 -6.38 1 174 LYS -0.63 -5.42 1 176 ALA 3.01 -5.79 1 177 LYS 3.58 -5.96 1 178 LYS 3.46 -6.41 1 179 PHE 3.78 -6.51 1 180 VAL 5.37 -6.13 1 181 GLU 4.17 -6.28 1 182 SER 4.69 -5.82 1 183 ALA 2.81 -5.16 1 184 THR 4.78 -6.21 1 185 SER 3.30 -5.50 1 186 SER 0.99 -5.49 1 187 PHE 1.37 -5.97 1 188 SER -3.59 -3.68 1 189 VAL -0.90 -5.58 1 190 ALA 0.82 -4.44 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25379_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 0.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.13 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -1.09 _LACS_plot.Y_axis_chem_shift_offset 0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 177 LYS 3.58 -2.74 0 10 ALA 0.13 -0.50 1 11 ASN 0.35 -0.53 1 12 VAL 0.68 -0.55 1 13 PHE 0.55 -0.49 1 15 LYS -0.35 -0.63 1 17 LYS 0.24 -0.46 1 18 LYS -0.10 -0.35 1 19 ASN 0.34 -0.37 1 20 THR 0.29 -0.36 1 21 GLU 0.26 -0.66 1 22 PHE -5.56 -0.08 1 23 MET -3.98 -0.11 1 25 TYR -2.03 -0.55 1 26 ASN -1.57 -0.35 1 28 ASP 1.21 -0.43 1 30 PHE -4.52 0.30 1 31 LYS -4.47 0.52 1 32 LEU 0.77 -0.12 1 33 LEU -2.06 -0.09 1 34 VAL -3.90 -0.53 1 36 SER 3.33 -0.91 1 37 LYS 0.99 -0.34 1 38 TRP -1.15 -0.10 1 39 ASN -2.77 -0.05 1 41 SER -2.96 -0.33 1 42 LYS 0.61 -0.45 1 43 GLU -0.08 -0.74 1 44 LYS -0.64 -0.50 1 45 GLU -0.98 -0.86 1 46 PHE -4.77 -0.10 1 49 GLN 0.91 -0.24 1 50 VAL -1.63 0.21 1 51 LEU -4.43 -0.05 1 52 ARG -1.73 0.79 1 53 TYR -7.06 0.36 1 54 GLU -7.32 -0.18 1 55 ASP -1.39 -1.72 1 56 ASN 3.23 -0.93 1 57 PHE 0.38 -0.54 1 58 ASP -0.85 -0.54 1 59 ALA 2.77 -0.66 1 60 THR 2.80 -0.80 1 61 SER -0.87 0.75 1 62 ASN -1.85 -0.25 1 63 LEU -5.42 0.87 1 64 SER -4.13 0.64 1 65 VAL -2.47 0.56 1 66 LEU -3.35 0.35 1 67 VAL -2.29 0.23 1 68 GLN -4.99 0.01 1 70 THR -0.90 -0.03 1 71 ASP 0.04 -0.38 1 72 LYS 1.11 -0.66 1 73 LYS 0.27 -0.52 1 74 SER -3.07 -0.37 1 75 ILE 0.20 -0.52 1 76 THR 2.79 -0.36 1 77 ASP 2.38 -0.64 1 78 PHE 2.94 -0.72 1 80 SER 1.96 -0.56 1 82 GLU 5.77 -1.04 1 83 ASP 4.67 -0.62 1 84 PHE 4.70 -1.07 1 85 LEU 2.80 -1.44 1 86 SER 3.63 -0.85 1 87 GLN 1.61 -0.54 1 88 VAL 0.51 -0.29 1 89 ASP 4.85 -1.33 1 90 TYR 2.44 -0.57 1 91 LEU 0.77 -1.09 1 92 LEU 0.54 -0.42 1 94 LYS 0.72 -0.53 1 95 GLN 0.28 -0.55 1 96 ALA -1.06 -0.49 1 97 TYR -0.53 -0.51 1 98 PHE 0.07 -0.49 1 100 LYS 0.00 -0.13 1 101 THR -0.14 -0.41 1 102 ASP 0.03 -0.50 1 103 SER 0.51 -0.51 1 104 GLU 0.22 -0.48 1 107 PHE 0.25 -0.48 1 108 ASP -0.16 -0.48 1 109 SER 0.75 -0.57 1 111 VAL 0.60 -0.47 1 112 VAL 0.61 -0.55 1 113 ALA -0.84 -0.36 1 114 SER -0.46 -0.46 1 115 ALA -2.81 0.01 1 116 ASN -2.86 -0.22 1 119 GLU -6.86 -0.19 1 120 SER -3.25 0.49 1 121 SER -2.27 -0.10 1 122 THR -2.63 0.56 1 124 VAL -0.66 0.37 1 125 VAL -2.29 -0.28 1 126 ASP 2.45 -0.76 1 128 LYS -2.40 -0.11 1 129 GLN -0.80 -0.12 1 130 TYR -3.60 0.32 1 131 TYR -5.92 0.56 1 132 SER -1.78 0.84 1 133 ILE -4.37 0.23 1 134 THR 0.08 0.54 1 135 VAL -5.25 0.29 1 136 LEU -3.73 0.21 1 137 THR -2.53 0.23 1 138 ARG -2.41 0.00 1 139 THR -1.45 -0.22 1 140 ALA -0.21 -0.47 1 141 ASP 0.09 -0.50 1 143 ASP 0.79 -0.48 1 144 GLU 0.95 -0.48 1 147 LYS -3.02 0.07 1 148 HIS -0.94 -0.58 1 149 GLN -2.97 0.59 1 150 VAL -2.25 0.62 1 151 ILE -4.41 0.36 1 152 ALA -5.37 1.08 1 153 ALA -8.71 1.14 1 154 THR 1.34 -0.68 1 155 VAL -4.36 0.75 1 156 LYS -2.83 -0.21 1 157 ASP 2.35 -0.73 1 159 LYS -4.06 0.15 1 160 LEU -3.52 0.02 1 161 TYR -3.13 0.09 1 162 ILE -5.38 0.25 1 164 LYS -4.84 0.89 1 165 ALA -7.39 0.99 1 166 GLN -6.75 1.10 1 167 ALA -5.22 0.19 1 169 ASP 4.17 -0.80 1 170 LYS 4.56 -0.50 1 171 ARG 1.75 -0.47 1 172 TRP 3.76 -1.22 1 173 PHE 3.75 -0.63 1 174 LYS -0.63 -0.17 1 176 ALA 3.01 -0.36 1 178 LYS 3.46 -0.79 1 179 PHE 3.78 -0.65 1 180 VAL 5.37 -1.00 1 181 GLU 4.17 -0.87 1 182 SER 4.69 -0.91 1 183 ALA 2.81 -0.40 1 184 THR 4.78 -0.78 1 185 SER 3.30 -0.63 1 186 SER 0.99 -0.69 1 187 PHE 1.37 0.03 1 188 SER -3.59 -0.17 1 189 VAL -0.90 -0.29 1 190 ALA 0.82 -0.86 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25379_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 -8.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -4.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -6.47 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -3.29 _LACS_plot.Y_axis_chem_shift_offset 5.64 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 154 THR 1.34 -9.34 0 10 ALA 0.13 -5.52 1 11 ASN 0.35 -6.00 1 12 VAL 0.68 -5.62 1 13 PHE 0.55 -4.77 1 17 LYS 0.24 -5.29 1 18 LYS -0.10 -5.75 1 19 ASN 0.34 -4.97 1 20 THR 0.29 -4.71 1 21 GLU 0.26 -6.18 1 22 PHE -5.56 -6.80 1 25 TYR -2.03 -7.38 1 26 ASN -1.57 -7.04 1 28 ASP 1.21 -6.01 1 30 PHE -4.52 -9.22 1 31 LYS -4.47 -8.46 1 32 LEU 0.77 -8.81 1 33 LEU -2.06 -8.12 1 36 SER 3.33 -4.41 1 37 LYS 0.99 -4.88 1 38 TRP -1.15 -6.80 1 41 SER -2.96 -5.00 1 42 LYS 0.61 -5.44 1 43 GLU -0.08 -6.82 1 44 LYS -0.64 -6.60 1 45 GLU -0.98 -6.41 1 49 GLN 0.91 -4.32 1 50 VAL -1.63 -5.92 1 51 LEU -4.43 -7.13 1 52 ARG -1.73 -7.56 1 53 TYR -7.06 -6.55 1 54 GLU -7.32 -8.59 1 55 ASP -1.39 -6.44 1 56 ASN 3.23 -4.91 1 57 PHE 0.38 -5.15 1 58 ASP -0.85 -6.82 1 59 ALA 2.77 -5.00 1 60 THR 2.80 -4.85 1 61 SER -0.87 -7.69 1 62 ASN -1.85 -7.71 1 63 LEU -5.42 -8.43 1 64 SER -4.13 -7.22 1 65 VAL -2.47 -6.97 1 66 LEU -3.35 -8.43 1 67 VAL -2.29 -5.91 1 70 THR -0.90 -8.93 1 71 ASP 0.04 -4.80 1 72 LYS 1.11 -6.09 1 73 LYS 0.27 -4.89 1 74 SER -3.07 -4.86 1 75 ILE 0.20 -6.84 1 76 THR 2.79 -2.53 1 77 ASP 2.38 -3.75 1 78 PHE 2.94 -5.85 1 82 GLU 5.77 -3.09 1 83 ASP 4.67 -1.60 1 84 PHE 4.70 -5.29 1 85 LEU 2.80 -4.84 1 86 SER 3.63 -3.74 1 87 GLN 1.61 -3.89 1 88 VAL 0.51 -6.21 1 89 ASP 4.85 -3.80 1 90 TYR 2.44 -3.71 1 91 LEU 0.77 -5.41 1 92 LEU 0.54 -5.14 1 94 LYS 0.72 -5.25 1 95 GLN 0.28 -6.22 1 96 ALA -1.06 -6.52 1 97 TYR -0.53 -5.68 1 98 PHE 0.07 -5.34 1 100 LYS 0.00 -5.05 1 101 THR -0.14 -5.58 1 102 ASP 0.03 -5.15 1 103 SER 0.51 -5.04 1 104 GLU 0.22 -4.92 1 107 PHE 0.25 -6.60 1 108 ASP -0.16 -5.49 1 109 SER 0.75 -4.74 1 111 VAL 0.60 -5.53 1 112 VAL 0.61 -6.18 1 113 ALA -0.84 -5.87 1 114 SER -0.46 -6.65 1 115 ALA -2.81 -7.22 1 119 GLU -6.86 -8.27 1 120 SER -3.25 -6.85 1 121 SER -2.27 -6.68 1 124 VAL -0.66 -4.88 1 125 VAL -2.29 -4.73 1 126 ASP 2.45 -5.53 1 128 LYS -2.40 -7.63 1 129 GLN -0.80 -5.88 1 130 TYR -3.60 -5.19 1 131 TYR -5.92 -5.82 1 132 SER -1.78 -5.94 1 133 ILE -4.37 -7.96 1 134 THR 0.08 -6.18 1 135 VAL -5.25 -8.37 1 136 LEU -3.73 -5.97 1 137 THR -2.53 -6.34 1 138 ARG -2.41 -5.60 1 139 THR -1.45 -5.66 1 140 ALA -0.21 -5.99 1 141 ASP 0.09 -4.97 1 143 ASP 0.79 -4.28 1 144 GLU 0.95 -4.64 1 147 LYS -3.02 -6.73 1 148 HIS -0.94 -5.74 1 149 GLN -2.97 -7.47 1 150 VAL -2.25 -7.22 1 151 ILE -4.41 -7.96 1 152 ALA -5.37 -6.42 1 153 ALA -8.71 -7.38 1 155 VAL -4.36 -6.35 1 156 LYS -2.83 -6.48 1 157 ASP 2.35 -5.96 1 159 LYS -4.06 -8.85 1 160 LEU -3.52 -8.87 1 161 TYR -3.13 -5.98 1 162 ILE -5.38 -8.13 1 164 LYS -4.84 -7.11 1 165 ALA -7.39 -8.50 1 166 GLN -6.75 -7.82 1 167 ALA -5.22 -6.12 1 169 ASP 4.17 -3.85 1 170 LYS 4.56 -2.73 1 171 ARG 1.75 -2.30 1 172 TRP 3.76 -3.81 1 173 PHE 3.75 -5.71 1 174 LYS -0.63 -5.58 1 176 ALA 3.01 -5.22 1 177 LYS 3.58 -5.53 1 178 LYS 3.46 -2.47 1 179 PHE 3.78 -4.12 1 180 VAL 5.37 -2.92 1 181 GLU 4.17 -2.64 1 182 SER 4.69 -3.70 1 183 ALA 2.81 -3.40 1 184 THR 4.78 -2.21 1 185 SER 3.30 -4.74 1 186 SER 0.99 -6.16 1 187 PHE 1.37 -6.50 1 188 SER -3.59 -6.42 1 189 VAL -0.90 -6.81 1 stop_ save_