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 bmr34376_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.20 _LACS_plot.Line_1_terminator_val_y_1 -3.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.28 _LACS_plot.Line_2_terminator_val_x_2 9.64 _LACS_plot.Line_2_terminator_val_y_2 7.45 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 LEU -9.20 -2.16 0 80 MET -5.87 0.83 0 10 LYS 4.29 2.28 1 11 ILE 4.52 0.61 1 12 ALA 5.17 3.51 1 13 ALA 3.31 3.02 1 14 HIS 3.14 4.72 1 15 LEU 5.81 2.91 1 16 VAL 5.78 4.43 1 17 ASN 2.89 2.56 1 18 SER 0.50 0.15 1 20 TYR 1.08 0.58 1 22 VAL 2.78 2.00 1 23 ILE 0.64 1.08 1 24 GLN -1.85 0.75 1 25 ALA -2.46 -0.17 1 27 GLU -0.46 0.02 1 28 SER 0.94 1.04 1 29 ASP 0.86 0.81 1 30 GLU -5.96 -2.20 1 31 ILE -4.86 -0.43 1 32 TRP -3.19 -0.90 1 33 LEU -5.43 -1.27 1 34 GLU -3.51 -1.38 1 35 ALA -1.23 0.12 1 37 ASP 1.11 1.47 1 38 LYS 4.21 1.09 1 39 SER -3.43 -1.23 1 40 SER 2.20 1.77 1 41 HIS -2.32 0.48 1 42 ASP -1.26 2.75 1 44 VAL -4.98 -1.45 1 45 ARG -4.48 -2.85 1 46 LEU -1.69 -2.40 1 47 TYR -4.98 -3.93 1 48 LYS 1.53 -1.13 1 49 HIS -0.32 0.80 1 50 ASP 1.66 0.37 1 51 LEU -3.88 -1.33 1 52 ASP -0.09 1.71 1 53 PHE -4.85 -1.01 1 54 ARG 5.37 3.95 1 55 GLN 4.39 2.92 1 56 GLU 1.56 2.46 1 57 MET 2.68 3.78 1 58 VAL 5.65 4.93 1 59 ARG 4.08 3.23 1 60 ASP 2.26 4.75 1 61 ILE 6.21 5.78 1 62 GLU 3.92 3.45 1 63 GLU 3.65 2.96 1 64 GLN 4.24 1.17 1 65 ALA 4.35 3.27 1 66 GLU 3.16 2.66 1 67 ARG 3.63 3.93 1 68 VAL 5.91 4.29 1 69 GLU 3.78 2.10 1 70 ARG 4.76 3.84 1 71 VAL 5.03 3.94 1 72 ARG 6.33 4.54 1 73 HIS 3.24 4.62 1 74 GLN 3.76 3.09 1 75 LEU -0.72 0.27 1 77 ARG -2.91 -1.72 1 78 ARG 2.71 2.56 1 79 ARG -4.27 -1.40 1 81 LYS -3.59 -0.85 1 82 LEU -6.53 -1.97 1 83 LEU -0.56 -0.61 1 84 ASN -4.28 -0.88 1 85 VAL -0.27 -0.47 1 86 PHE -0.99 0.04 1 87 PHE -0.62 -0.97 1 88 SER -4.16 -2.23 1 89 THR 9.64 8.17 1 90 GLU -6.64 -2.98 1 91 ALA 0.16 -0.33 1 93 VAL 1.19 0.74 1 94 ASP -0.84 -2.07 1 95 ASP 2.85 0.90 1 96 TRP -0.63 -0.21 1 97 GLU 5.51 4.38 1 98 GLU 2.31 2.22 1 99 ILE 1.76 0.24 1 100 ALA 1.37 1.37 1 101 LYS -0.07 -0.04 1 102 LYS -2.44 -0.73 1 103 THR 1.91 1.77 1 104 PHE -1.55 0.11 1 105 GLU -4.06 -1.48 1 106 LYS -2.19 -0.73 1 108 THR 1.52 0.07 1 109 VAL -3.30 -1.52 1 110 SER -4.11 -1.85 1 111 VAL -2.64 -0.78 1 112 GLU -5.12 -2.11 1 114 ALA -5.22 -0.84 1 115 ILE -5.54 -1.72 1 116 VAL -0.39 -0.69 1 117 ARG -4.12 -2.72 1 119 THR 1.20 0.90 1 120 MET -1.03 -1.34 1 121 LEU 3.80 5.16 1 122 ARG 5.91 4.83 1 123 ASP 3.47 3.25 1 124 ASP 3.67 3.42 1 125 LEU 3.45 3.45 1 126 GLN 3.63 2.96 1 127 ALA 1.61 1.69 1 128 VAL 1.01 1.89 1 129 PHE -2.25 -0.92 1 131 SER 1.06 0.94 1 132 PHE -0.45 -0.21 1 133 ARG 0.97 -0.37 1 134 THR 2.06 1.59 1 135 GLU 3.15 2.52 1 136 ASP 1.01 0.69 1 138 SER -2.49 -0.99 1 139 GLU 3.23 2.90 1 140 GLU 2.49 1.89 1 141 HIS -0.32 0.83 1 142 ALA -0.74 -0.66 1 143 SER 0.67 0.98 1 144 PHE 4.44 3.75 1 145 GLU 4.45 3.61 1 146 ASN 3.60 2.77 1 147 ALA 5.72 4.27 1 148 GLN 4.21 2.96 1 149 MET 3.46 3.19 1 150 ALA 3.57 3.12 1 151 ARG 6.27 4.10 1 152 GLU 4.02 3.26 1 153 ARG 4.22 3.21 1 154 PHE 4.96 4.28 1 155 LEU 4.81 3.06 1 156 SER 4.45 3.66 1 157 LEU 3.09 2.64 1 158 VAL 5.40 4.23 1 159 LEU 3.26 2.64 1 160 LYS 3.16 2.36 1 161 GLN 3.15 2.96 1 162 GLU 2.45 2.35 1 163 GLU 2.25 2.22 1 164 GLN 2.66 2.10 1 165 ARG 2.33 1.95 1 166 LYS 2.09 1.82 1 167 THR 1.72 1.65 1 168 GLU 0.60 0.85 1 169 ALA 0.65 0.72 1 170 ALA 0.55 0.68 1 171 VAL 1.09 0.92 1 172 PHE 0.38 0.37 1 173 GLN 0.57 0.60 1 174 ASN 0.68 0.71 1 176 LYS 0.16 0.34 1 177 LEU 0.42 0.49 1 178 GLU -0.13 0.33 1 179 ARG 0.69 0.72 1 180 GLU 0.32 0.66 1 181 ASN 0.22 0.46 1 182 LEU 0.10 0.30 1 183 TYR -0.19 0.06 1 184 PHE 0.08 0.03 1 185 GLN 0.61 1.89 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34376_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.20 _LACS_plot.Line_1_terminator_val_y_1 5.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.72 _LACS_plot.Line_2_terminator_val_x_2 9.64 _LACS_plot.Line_2_terminator_val_y_2 -2.19 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 LEU -9.20 7.04 0 80 MET -5.87 6.70 0 10 LYS 4.29 -2.01 1 11 ILE 4.52 -3.91 1 12 ALA 5.17 -1.66 1 13 ALA 3.31 -0.29 1 14 HIS 3.14 1.58 1 15 LEU 5.81 -2.90 1 16 VAL 5.78 -1.35 1 17 ASN 2.89 -0.33 1 18 SER 0.50 -0.35 1 20 TYR 1.08 -0.50 1 22 VAL 2.78 -0.78 1 23 ILE 0.64 0.44 1 24 GLN -1.85 2.60 1 25 ALA -2.46 2.29 1 27 GLU -0.46 0.48 1 28 SER 0.94 0.10 1 29 ASP 0.86 -0.05 1 30 GLU -5.96 3.76 1 31 ILE -4.86 4.43 1 32 TRP -3.19 2.29 1 33 LEU -5.43 4.16 1 34 GLU -3.51 2.13 1 35 ALA -1.23 1.35 1 37 ASP 1.11 0.36 1 38 LYS 4.21 -3.12 1 39 SER -3.43 2.20 1 40 SER 2.20 -0.43 1 41 HIS -2.32 2.80 1 42 ASP -1.26 4.01 1 44 VAL -4.98 3.53 1 45 ARG -4.48 1.63 1 46 LEU -1.69 -0.71 1 47 TYR -4.98 1.05 1 48 LYS 1.53 -2.66 1 49 HIS -0.32 1.12 1 50 ASP 1.66 -1.29 1 51 LEU -3.88 2.55 1 52 ASP -0.09 1.80 1 53 PHE -4.85 3.84 1 54 ARG 5.37 -1.42 1 55 GLN 4.39 -1.47 1 56 GLU 1.56 0.90 1 57 MET 2.68 1.10 1 58 VAL 5.65 -0.72 1 59 ARG 4.08 -0.85 1 60 ASP 2.26 2.49 1 61 ILE 6.21 -0.43 1 62 GLU 3.92 -0.47 1 63 GLU 3.65 -0.69 1 64 GLN 4.24 -3.07 1 65 ALA 4.35 -1.08 1 66 GLU 3.16 -0.50 1 67 ARG 3.63 0.30 1 68 VAL 5.91 -1.62 1 69 GLU 3.78 -1.68 1 70 ARG 4.76 -0.92 1 71 VAL 5.03 -1.09 1 72 ARG 6.33 -1.79 1 73 HIS 3.24 1.38 1 74 GLN 3.76 -0.67 1 75 LEU -0.72 0.99 1 77 ARG -2.91 1.19 1 78 ARG 2.71 -0.15 1 79 ARG -4.27 2.87 1 81 LYS -3.59 2.74 1 82 LEU -6.53 4.56 1 83 LEU -0.56 -0.05 1 84 ASN -4.28 3.40 1 85 VAL -0.27 -0.20 1 86 PHE -0.99 1.03 1 87 PHE -0.62 -0.35 1 88 SER -4.16 1.93 1 89 THR 9.64 -1.47 1 90 GLU -6.64 3.66 1 91 ALA 0.16 -0.49 1 93 VAL 1.19 -0.45 1 94 ASP -0.84 -1.23 1 95 ASP 2.85 -1.95 1 96 TRP -0.63 0.42 1 97 GLU 5.51 -1.13 1 98 GLU 2.31 -0.09 1 99 ILE 1.76 -1.52 1 100 ALA 1.37 0.00 1 101 LYS -0.07 0.03 1 102 LYS -2.44 1.71 1 103 THR 1.91 -0.14 1 104 PHE -1.55 1.66 1 105 GLU -4.06 2.58 1 106 LYS -2.19 1.46 1 108 THR 1.52 -1.45 1 109 VAL -3.30 1.78 1 110 SER -4.11 2.26 1 111 VAL -2.64 1.86 1 112 GLU -5.12 3.01 1 114 ALA -5.22 4.38 1 115 ILE -5.54 3.82 1 116 VAL -0.39 -0.30 1 117 ARG -4.12 1.40 1 119 THR 1.20 -0.30 1 120 MET -1.03 -0.31 1 121 LEU 3.80 1.36 1 122 ARG 5.91 -1.08 1 123 ASP 3.47 -0.22 1 124 ASP 3.67 -0.25 1 125 LEU 3.45 0.00 1 126 GLN 3.63 -0.67 1 127 ALA 1.61 0.08 1 128 VAL 1.01 0.88 1 129 PHE -2.25 1.33 1 131 SER 1.06 -0.12 1 132 PHE -0.45 0.24 1 133 ARG 0.97 -1.34 1 134 THR 2.06 -0.47 1 135 GLU 3.15 -0.63 1 136 ASP 1.01 -0.32 1 138 SER -2.49 1.50 1 139 GLU 3.23 -0.33 1 140 GLU 2.49 -0.60 1 141 HIS -0.32 1.15 1 142 ALA -0.74 0.08 1 143 SER 0.67 0.31 1 144 PHE 4.44 -0.69 1 145 GLU 4.45 -0.84 1 146 ASN 3.60 -0.83 1 147 ALA 5.72 -1.45 1 148 GLN 4.21 -1.25 1 149 MET 3.46 -0.27 1 150 ALA 3.57 -0.45 1 151 ARG 6.27 -2.17 1 152 GLU 4.02 -0.76 1 153 ARG 4.22 -1.01 1 154 PHE 4.96 -0.68 1 155 LEU 4.81 -1.75 1 156 SER 4.45 -0.79 1 157 LEU 3.09 -0.45 1 158 VAL 5.40 -1.17 1 159 LEU 3.26 -0.62 1 160 LYS 3.16 -0.80 1 161 GLN 3.15 -0.19 1 162 GLU 2.45 -0.10 1 163 GLU 2.25 -0.03 1 164 GLN 2.66 -0.56 1 165 ARG 2.33 -0.38 1 166 LYS 2.09 -0.27 1 167 THR 1.72 -0.07 1 168 GLU 0.60 0.25 1 169 ALA 0.65 0.07 1 170 ALA 0.55 0.13 1 171 VAL 1.09 -0.17 1 172 PHE 0.38 -0.01 1 173 GLN 0.57 0.03 1 174 ASN 0.68 0.03 1 176 LYS 0.16 0.18 1 177 LEU 0.42 0.07 1 178 GLU -0.13 0.46 1 179 ARG 0.69 0.03 1 180 GLU 0.32 0.34 1 181 ASN 0.22 0.24 1 182 LEU 0.10 0.20 1 183 TYR -0.19 0.25 1 184 PHE 0.08 -0.05 1 185 GLN 0.61 1.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34376_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.20 _LACS_plot.Line_1_terminator_val_y_1 1.15 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.38 _LACS_plot.Line_2_terminator_val_x_2 9.64 _LACS_plot.Line_2_terminator_val_y_2 -0.91 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 GLU 5.51 -1.31 0 43 LEU -9.20 1.36 0 35 ALA -1.23 -0.67 0 16 VAL 5.78 0.41 0 132 PHE -0.45 -0.83 0 10 LYS 4.29 -0.21 1 11 ILE 4.52 -0.84 1 12 ALA 5.17 -0.99 1 13 ALA 3.31 -0.13 1 14 HIS 3.14 -0.22 1 15 LEU 5.81 -0.70 1 17 ASN 2.89 0.00 1 18 SER 0.50 0.28 1 20 TYR 1.08 0.21 1 22 VAL 2.78 0.23 1 23 ILE 0.64 0.18 1 24 GLN -1.85 0.41 1 25 ALA -2.46 0.64 1 27 GLU -0.46 0.35 1 28 SER 0.94 0.22 1 29 ASP 0.86 0.12 1 30 GLU -5.96 1.41 1 31 ILE -4.86 0.63 1 32 TRP -3.19 0.78 1 33 LEU -5.43 1.42 1 34 GLU -3.51 0.60 1 37 ASP 1.11 -0.11 1 38 LYS 4.21 -0.11 1 39 SER -3.43 -0.12 1 40 SER 2.20 -0.18 1 41 HIS -2.32 -0.13 1 42 ASP -1.26 0.33 1 44 VAL -4.98 0.88 1 45 ARG -4.48 0.58 1 46 LEU -1.69 0.70 1 47 TYR -4.98 1.25 1 48 LYS 1.53 0.30 1 49 HIS -0.32 -0.52 1 50 ASP 1.66 0.22 1 51 LEU -3.88 -0.02 1 52 ASP -0.09 -0.04 1 53 PHE -4.85 0.70 1 54 ARG 5.37 -0.33 1 55 GLN 4.39 -0.14 1 56 GLU 1.56 -0.12 1 57 MET 2.68 -0.46 1 58 VAL 5.65 -0.61 1 59 ARG 4.08 -0.16 1 60 ASP 2.26 -0.19 1 61 ILE 6.21 -0.82 1 62 GLU 3.92 -0.66 1 63 GLU 3.65 -0.17 1 64 GLN 4.24 0.13 1 65 ALA 4.35 -0.38 1 66 GLU 3.16 -0.16 1 67 ARG 3.63 -0.27 1 68 VAL 5.91 -0.46 1 69 GLU 3.78 0.10 1 70 ARG 4.76 -0.13 1 71 VAL 5.03 -0.38 1 72 ARG 6.33 -0.58 1 73 HIS 3.24 -0.41 1 74 GLN 3.76 -0.25 1 75 LEU -0.72 0.04 1 77 ARG -2.91 0.26 1 78 ARG 2.71 -0.15 1 79 ARG -4.27 0.69 1 80 MET -5.87 0.50 1 81 LYS -3.59 1.19 1 82 LEU -6.53 0.94 1 83 LEU -0.56 0.72 1 84 ASN -4.28 0.19 1 85 VAL -0.27 0.35 1 86 PHE -0.99 0.51 1 87 PHE -0.62 0.68 1 88 SER -4.16 0.33 1 89 THR 9.64 -0.77 1 90 GLU -6.64 0.32 1 91 ALA 0.16 -0.75 1 93 VAL 1.19 0.09 1 94 ASP -0.84 0.36 1 95 ASP 2.85 0.18 1 96 TRP -0.63 -0.22 1 98 GLU 2.31 -0.36 1 99 ILE 1.76 -0.04 1 100 ALA 1.37 -0.09 1 101 LYS -0.07 0.20 1 102 LYS -2.44 0.37 1 103 THR 1.91 0.41 1 104 PHE -1.55 0.16 1 105 GLU -4.06 0.66 1 106 LYS -2.19 0.13 1 108 THR 1.52 0.16 1 109 VAL -3.30 1.22 1 110 SER -4.11 1.20 1 111 VAL -2.64 0.94 1 112 GLU -5.12 0.63 1 114 ALA -5.22 0.42 1 115 ILE -5.54 1.04 1 116 VAL -0.39 -0.13 1 117 ARG -4.12 0.67 1 119 THR 1.20 -0.08 1 120 MET -1.03 0.56 1 121 LEU 3.80 -0.31 1 122 ARG 5.91 -0.33 1 123 ASP 3.47 -0.17 1 124 ASP 3.67 0.03 1 125 LEU 3.45 -0.26 1 126 GLN 3.63 -0.23 1 127 ALA 1.61 -0.03 1 128 VAL 1.01 -0.31 1 129 PHE -2.25 0.52 1 131 SER 1.06 0.07 1 133 ARG 0.97 0.00 1 134 THR 2.06 -0.27 1 135 GLU 3.15 -0.22 1 136 ASP 1.01 0.02 1 138 SER -2.49 0.24 1 139 GLU 3.23 -0.22 1 140 GLU 2.49 -0.20 1 141 HIS -0.32 -0.11 1 142 ALA -0.74 -0.19 1 143 SER 0.67 0.11 1 144 PHE 4.44 -0.99 1 145 GLU 4.45 0.01 1 146 ASN 3.60 0.01 1 147 ALA 5.72 0.11 1 148 GLN 4.21 -0.48 1 149 MET 3.46 -0.20 1 150 ALA 3.57 -0.13 1 151 ARG 6.27 -1.14 1 152 GLU 4.02 -0.47 1 153 ARG 4.22 -0.17 1 154 PHE 4.96 -0.25 1 155 LEU 4.81 -0.56 1 156 SER 4.45 -0.17 1 157 LEU 3.09 -0.14 1 158 VAL 5.40 -0.62 1 159 LEU 3.26 -0.11 1 160 LYS 3.16 -0.08 1 161 GLN 3.15 -0.09 1 162 GLU 2.45 -0.11 1 163 GLU 2.25 -0.15 1 164 GLN 2.66 -0.05 1 165 ARG 2.33 -0.03 1 166 LYS 2.09 0.04 1 167 THR 1.72 0.00 1 168 GLU 0.60 -0.02 1 169 ALA 0.65 0.04 1 170 ALA 0.55 0.05 1 171 VAL 1.09 -0.04 1 172 PHE 0.38 0.09 1 173 GLN 0.57 0.04 1 174 ASN 0.68 -0.01 1 176 LYS 0.16 0.08 1 177 LEU 0.42 0.04 1 178 GLU -0.13 0.02 1 179 ARG 0.69 -0.01 1 180 GLU 0.32 -0.06 1 181 ASN 0.22 -0.02 1 182 LEU 0.10 -0.07 1 183 TYR -0.19 -0.03 1 184 PHE 0.08 -0.04 1 185 GLN 0.61 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34376_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.20 _LACS_plot.Line_1_terminator_val_y_1 -4.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.97 _LACS_plot.Line_2_terminator_val_x_2 9.64 _LACS_plot.Line_2_terminator_val_y_2 4.11 _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 89 THR 9.64 -1.32 0 10 LYS 4.29 3.56 1 11 ILE 4.52 0.50 1 12 ALA 5.17 0.87 1 13 ALA 3.31 0.54 1 14 HIS 3.14 4.60 1 15 LEU 5.81 2.69 1 16 VAL 5.78 3.86 1 17 ASN 2.89 1.36 1 18 SER 0.50 -0.78 1 20 TYR 1.08 0.00 1 22 VAL 2.78 -0.02 1 23 ILE 0.64 -0.46 1 24 GLN -1.85 -1.97 1 25 ALA -2.46 -1.42 1 27 GLU -0.46 0.43 1 28 SER 0.94 0.03 1 29 ASP 0.86 -2.24 1 30 GLU -5.96 -1.63 1 31 ILE -4.86 -1.22 1 32 TRP -3.19 -0.04 1 33 LEU -5.43 -2.41 1 34 GLU -3.51 -1.16 1 37 ASP 1.11 0.02 1 38 LYS 4.21 0.11 1 39 SER -3.43 0.10 1 40 SER 2.20 -1.50 1 41 HIS -2.32 -1.04 1 42 ASP -1.26 0.61 1 43 LEU -9.20 -2.69 1 44 VAL -4.98 -3.55 1 45 ARG -4.48 -2.56 1 46 LEU -1.69 -1.45 1 47 TYR -4.98 -2.67 1 48 LYS 1.53 -3.47 1 49 HIS -0.32 -2.15 1 50 ASP 1.66 -1.11 1 51 LEU -3.88 -2.35 1 52 ASP -0.09 -0.96 1 53 PHE -4.85 1.65 1 54 ARG 5.37 2.24 1 55 GLN 4.39 1.77 1 56 GLU 1.56 3.45 1 57 MET 2.68 0.86 1 58 VAL 5.65 1.28 1 59 ARG 4.08 2.46 1 60 ASP 2.26 2.17 1 61 ILE 6.21 0.82 1 62 GLU 3.92 3.47 1 63 GLU 3.65 3.50 1 64 GLN 4.24 3.13 1 65 ALA 4.35 1.85 1 66 GLU 3.16 2.72 1 67 ARG 3.63 3.09 1 68 VAL 5.91 0.67 1 69 GLU 3.78 1.26 1 70 ARG 4.76 3.40 1 71 VAL 5.03 0.83 1 72 ARG 6.33 2.48 1 73 HIS 3.24 4.35 1 74 GLN 3.76 2.10 1 75 LEU -0.72 0.41 1 77 ARG -2.91 0.09 1 78 ARG 2.71 0.29 1 79 ARG -4.27 -1.26 1 80 MET -5.87 -2.51 1 81 LYS -3.59 -1.19 1 82 LEU -6.53 -3.23 1 83 LEU -0.56 -4.36 1 84 ASN -4.28 -3.58 1 85 VAL -0.27 -1.69 1 86 PHE -0.99 -0.76 1 87 PHE -0.62 -1.46 1 88 SER -4.16 -0.84 1 90 GLU -6.64 -0.73 1 91 ALA 0.16 -1.10 1 93 VAL 1.19 0.01 1 94 ASP -0.84 -0.23 1 95 ASP 2.85 0.14 1 96 TRP -0.63 1.09 1 97 GLU 5.51 1.60 1 98 GLU 2.31 1.82 1 99 ILE 1.76 0.84 1 100 ALA 1.37 -0.75 1 101 LYS -0.07 -0.63 1 102 LYS -2.44 -1.18 1 103 THR 1.91 -0.57 1 104 PHE -1.55 -1.73 1 105 GLU -4.06 -1.49 1 106 LYS -2.19 -0.18 1 108 THR 1.52 -0.68 1 109 VAL -3.30 -1.57 1 110 SER -4.11 -1.07 1 111 VAL -2.64 -2.57 1 112 GLU -5.12 -1.41 1 114 ALA -5.22 -2.94 1 115 ILE -5.54 -4.50 1 116 VAL -0.39 -2.40 1 117 ARG -4.12 2.74 1 119 THR 1.20 0.90 1 120 MET -1.03 -0.37 1 121 LEU 3.80 0.81 1 122 ARG 5.91 2.63 1 123 ASP 3.47 2.94 1 124 ASP 3.67 3.17 1 125 LEU 3.45 1.64 1 126 GLN 3.63 0.82 1 127 ALA 1.61 1.05 1 128 VAL 1.01 -1.59 1 129 PHE -2.25 -0.59 1 131 SER 1.06 -0.14 1 132 PHE -0.45 -1.16 1 133 ARG 0.97 -0.41 1 134 THR 2.06 1.83 1 135 GLU 3.15 0.36 1 136 ASP 1.01 0.30 1 138 SER -2.49 0.43 1 139 GLU 3.23 1.29 1 140 GLU 2.49 0.60 1 141 HIS -0.32 0.12 1 142 ALA -0.74 -1.76 1 143 SER 0.67 -0.25 1 144 PHE 4.44 1.46 1 145 GLU 4.45 2.49 1 146 ASN 3.60 3.31 1 147 ALA 5.72 1.05 1 148 GLN 4.21 2.90 1 149 MET 3.46 2.28 1 150 ALA 3.57 3.04 1 151 ARG 6.27 0.99 1 152 GLU 4.02 3.30 1 153 ARG 4.22 3.37 1 154 PHE 4.96 0.55 1 155 LEU 4.81 2.55 1 156 SER 4.45 2.14 1 157 LEU 3.09 2.00 1 158 VAL 5.40 1.92 1 159 LEU 3.26 1.80 1 160 LYS 3.16 2.17 1 161 GLN 3.15 2.24 1 162 GLU 2.45 2.12 1 163 GLU 2.25 2.07 1 164 GLN 2.66 1.55 1 165 ARG 2.33 1.46 1 166 LYS 2.09 1.30 1 167 THR 1.72 0.64 1 168 GLU 0.60 0.19 1 169 ALA 0.65 0.17 1 170 ALA 0.55 0.35 1 171 VAL 1.09 0.03 1 172 PHE 0.38 0.27 1 173 GLN 0.57 -0.15 1 174 ASN 0.68 0.65 1 176 LYS 0.16 -0.10 1 177 LEU 0.42 -0.20 1 178 GLU -0.13 0.09 1 179 ARG 0.69 0.24 1 180 GLU 0.32 -0.21 1 181 ASN 0.22 -0.34 1 182 LEU 0.10 -1.15 1 183 TYR -0.19 -0.75 1 184 PHE 0.08 -1.22 1 185 GLN 0.61 4.31 1 stop_ save_