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 bmr25381_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.09 _LACS_plot.Line_1_terminator_val_y_1 -3.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 8.90 _LACS_plot.Line_2_terminator_val_y_2 6.53 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 ILE 4.16 -1.29 0 10 ALA 4.17 2.93 1 11 ALA 3.57 2.15 1 12 ALA 2.99 2.25 1 13 ILE 5.32 4.23 1 14 ASP 5.08 3.68 1 15 VAL 6.07 4.30 1 16 LEU 3.76 2.35 1 17 ASN 2.68 1.82 1 18 GLU -0.21 -0.55 1 19 GLU 4.49 0.99 1 20 ARG -3.96 -1.55 1 21 VAL -1.86 -1.06 1 22 ILE -6.15 -2.33 1 23 ALA -5.94 -2.60 1 24 TYR 1.01 -1.15 1 26 THR -1.55 -1.80 1 28 ALA -3.03 0.09 1 29 VAL -6.64 -3.61 1 30 PHE 2.41 2.01 1 32 VAL -4.97 -3.31 1 35 ASP -2.20 -0.49 1 37 ASP -0.10 0.60 1 38 SER -1.49 -3.17 1 39 GLU 4.02 2.71 1 40 THR 5.42 4.31 1 41 ALA 3.14 3.08 1 42 VAL 6.52 4.55 1 43 MET 5.43 2.13 1 44 ARG 5.45 3.98 1 45 LEU 5.19 4.31 1 46 LEU 6.03 3.32 1 47 GLU 2.95 2.49 1 48 LEU 2.59 2.83 1 49 LYS 1.25 -0.24 1 50 GLN 4.09 1.13 1 51 ARG -5.89 -1.64 1 53 VAL 1.70 1.05 1 54 ASP 1.20 1.28 1 55 LYS 3.63 3.29 1 57 LEU -6.85 -1.51 1 59 LEU -3.64 -2.03 1 60 ILE -6.73 -2.48 1 61 ALA -7.21 -1.70 1 62 ALA -2.21 0.14 1 63 ASN -2.05 -1.07 1 64 TYR 2.54 2.76 1 65 GLU 5.39 3.67 1 66 GLN 2.22 2.53 1 67 LEU -0.55 0.27 1 68 LYS 8.90 6.66 1 70 TYR -0.33 0.86 1 71 ILE -5.06 -1.66 1 72 ASP -2.26 -2.06 1 73 ASP -2.48 -1.83 1 74 THR 3.47 3.42 1 75 MET 4.62 0.75 1 76 LEU -0.22 -0.08 1 77 THR -3.40 -1.80 1 78 ASP 5.44 3.84 1 79 VAL 4.39 3.33 1 80 GLN 3.49 3.00 1 81 ARG 5.34 4.34 1 82 GLU 3.68 2.82 1 83 THR 5.72 4.43 1 84 ILE 3.30 2.52 1 85 PHE 4.34 1.61 1 86 SER 2.93 2.37 1 87 ARG -0.46 -0.92 1 88 TRP -9.09 -4.64 1 92 VAL -1.36 -0.03 1 93 THR -0.90 -0.92 1 94 PHE -5.95 -1.14 1 95 VAL 0.70 -0.07 1 96 PHE -3.12 -0.10 1 98 ALA -4.04 -2.02 1 100 ALA 2.68 1.83 1 101 THR 1.18 0.11 1 102 THR 3.78 2.26 1 104 ARG 0.46 -0.19 1 105 TRP 5.90 1.42 1 106 LEU -5.62 -2.08 1 107 THR 2.18 1.53 1 109 ARG 2.01 0.24 1 110 PHE -1.66 -0.32 1 111 ASP -0.03 -1.23 1 112 SER -4.39 -1.64 1 113 LEU -6.21 -0.71 1 114 ALA -3.07 -1.73 1 115 VAL -6.75 -3.73 1 117 VAL 0.92 -1.35 1 118 THR -1.25 -1.50 1 119 ASP -2.47 -2.35 1 120 HIS 0.83 3.40 1 122 LEU 2.07 1.91 1 123 VAL 6.20 4.52 1 124 VAL 6.55 5.45 1 125 ALA 3.89 2.80 1 126 LEU 3.48 3.44 1 128 GLN 4.97 3.68 1 129 ALA 2.36 2.03 1 130 TYR -0.90 -0.17 1 132 LYS -0.58 0.27 1 134 LEU -5.66 -2.37 1 135 VAL 1.56 1.42 1 136 SER -2.14 0.28 1 137 THR -2.00 -2.23 1 138 SER 2.23 2.01 1 139 ALA 0.74 -1.33 1 140 ASN -0.98 0.68 1 141 LEU -0.92 -1.67 1 142 SER 2.97 1.85 1 144 LEU 0.84 -0.54 1 148 ARG -0.30 1.22 1 149 THR -7.02 -3.38 1 150 VAL 5.27 4.05 1 151 ASP 4.41 3.41 1 152 GLU 3.62 3.01 1 153 VAL 6.23 4.21 1 154 ARG 3.98 2.90 1 155 ALA 3.26 2.28 1 156 GLN 2.68 3.54 1 157 PHE 2.02 1.14 1 159 ALA 3.14 2.62 1 160 ALA -1.00 -1.37 1 161 PHE 1.21 2.34 1 163 VAL -5.69 -3.53 1 164 VAL -0.14 -0.17 1 167 GLU -4.57 -1.93 1 168 THR -0.67 -0.32 1 171 ARG 0.49 0.19 1 172 LEU 0.59 1.03 1 173 ASN -1.26 -0.24 1 175 SER 1.18 1.46 1 176 GLU -1.82 -0.47 1 177 ILE -1.24 -0.84 1 178 ARG -6.28 -2.14 1 179 ASP -2.06 0.30 1 180 ALA 3.53 2.70 1 181 LEU 2.80 1.49 1 182 THR -1.75 -0.51 1 184 GLU -2.31 -1.11 1 185 LEU 1.55 0.98 1 186 PHE -1.19 0.05 1 187 ARG -0.84 -0.66 1 188 GLN -0.33 0.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25381_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.09 _LACS_plot.Line_1_terminator_val_y_1 5.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 8.90 _LACS_plot.Line_2_terminator_val_y_2 -2.37 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 ILE 4.16 -5.45 0 10 ALA 4.17 -1.24 1 11 ALA 3.57 -1.42 1 12 ALA 2.99 -0.74 1 13 ILE 5.32 -1.09 1 14 ASP 5.08 -1.40 1 15 VAL 6.07 -1.77 1 16 LEU 3.76 -1.41 1 17 ASN 2.68 -0.86 1 18 GLU -0.21 -0.34 1 19 GLU 4.49 -3.50 1 20 ARG -3.96 2.41 1 21 VAL -1.86 0.80 1 22 ILE -6.15 3.82 1 23 ALA -5.94 3.34 1 24 TYR 1.01 -2.16 1 26 THR -1.55 -0.25 1 28 ALA -3.03 3.12 1 29 VAL -6.64 3.03 1 30 PHE 2.41 -0.40 1 32 VAL -4.97 1.66 1 35 ASP -2.20 1.71 1 37 ASP -0.10 0.70 1 38 SER -1.49 -1.68 1 39 GLU 4.02 -1.31 1 40 THR 5.42 -1.11 1 41 ALA 3.14 -0.06 1 42 VAL 6.52 -1.97 1 43 MET 5.43 -3.30 1 44 ARG 5.45 -1.47 1 45 LEU 5.19 -0.88 1 46 LEU 6.03 -2.71 1 47 GLU 2.95 -0.46 1 48 LEU 2.59 0.24 1 49 LYS 1.25 -1.49 1 50 GLN 4.09 -2.96 1 51 ARG -5.89 4.25 1 53 VAL 1.70 -0.65 1 54 ASP 1.20 0.08 1 55 LYS 3.63 -0.34 1 57 LEU -6.85 5.34 1 59 LEU -3.64 1.61 1 60 ILE -6.73 4.25 1 61 ALA -7.21 5.51 1 62 ALA -2.21 2.35 1 63 ASN -2.05 0.98 1 64 TYR 2.54 0.22 1 65 GLU 5.39 -1.72 1 66 GLN 2.22 0.31 1 67 LEU -0.55 0.82 1 68 LYS 8.90 -2.24 1 70 TYR -0.33 1.19 1 71 ILE -5.06 3.40 1 72 ASP -2.26 0.20 1 73 ASP -2.48 0.65 1 74 THR 3.47 -0.05 1 75 MET 4.62 -3.87 1 76 LEU -0.22 0.14 1 77 THR -3.40 1.60 1 78 ASP 5.44 -1.60 1 79 VAL 4.39 -1.06 1 80 GLN 3.49 -0.49 1 81 ARG 5.34 -1.00 1 82 GLU 3.68 -0.86 1 83 THR 5.72 -1.29 1 84 ILE 3.30 -0.78 1 85 PHE 4.34 -2.73 1 86 SER 2.93 -0.56 1 87 ARG -0.46 -0.46 1 88 TRP -9.09 4.45 1 92 VAL -1.36 1.33 1 93 THR -0.90 -0.02 1 94 PHE -5.95 4.81 1 95 VAL 0.70 -0.77 1 96 PHE -3.12 3.02 1 98 ALA -4.04 2.02 1 100 ALA 2.68 -0.85 1 101 THR 1.18 -1.07 1 102 THR 3.78 -1.52 1 104 ARG 0.46 -0.65 1 105 TRP 5.90 -4.48 1 106 LEU -5.62 3.54 1 107 THR 2.18 -0.65 1 109 ARG 2.01 -1.77 1 110 PHE -1.66 1.34 1 111 ASP -0.03 -1.20 1 112 SER -4.39 2.75 1 113 LEU -6.21 5.50 1 114 ALA -3.07 1.34 1 115 VAL -6.75 3.02 1 117 VAL 0.92 -2.27 1 118 THR -1.25 -0.25 1 119 ASP -2.47 0.12 1 120 HIS 0.83 2.57 1 122 LEU 2.07 -0.16 1 123 VAL 6.20 -1.68 1 124 VAL 6.55 -1.10 1 125 ALA 3.89 -1.09 1 126 LEU 3.48 -0.04 1 128 GLN 4.97 -1.29 1 129 ALA 2.36 -0.33 1 130 TYR -0.90 0.73 1 132 LYS -0.58 0.85 1 134 LEU -5.66 3.29 1 135 VAL 1.56 -0.14 1 136 SER -2.14 2.42 1 137 THR -2.00 -0.23 1 138 SER 2.23 -0.22 1 139 ALA 0.74 -2.07 1 140 ASN -0.98 1.66 1 141 LEU -0.92 -0.75 1 142 SER 2.97 -1.12 1 144 LEU 0.84 -1.38 1 148 ARG -0.30 1.52 1 149 THR -7.02 3.64 1 150 VAL 5.27 -1.22 1 151 ASP 4.41 -1.00 1 152 GLU 3.62 -0.61 1 153 VAL 6.23 -2.02 1 154 ARG 3.98 -1.08 1 155 ALA 3.26 -0.98 1 156 GLN 2.68 0.86 1 157 PHE 2.02 -0.88 1 159 ALA 3.14 -0.52 1 160 ALA -1.00 -0.37 1 161 PHE 1.21 1.13 1 163 VAL -5.69 2.16 1 164 VAL -0.14 -0.03 1 167 GLU -4.57 2.64 1 168 THR -0.67 0.35 1 171 ARG 0.49 -0.30 1 172 LEU 0.59 0.44 1 173 ASN -1.26 1.02 1 175 SER 1.18 0.28 1 176 GLU -1.82 1.35 1 177 ILE -1.24 0.40 1 178 ARG -6.28 4.14 1 179 ASP -2.06 2.36 1 180 ALA 3.53 -0.83 1 181 LEU 2.80 -1.31 1 182 THR -1.75 1.24 1 184 GLU -2.31 1.20 1 185 LEU 1.55 -0.57 1 186 PHE -1.19 1.24 1 187 ARG -0.84 0.18 1 188 GLN -0.33 0.41 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25381_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.09 _LACS_plot.Line_1_terminator_val_y_1 0.87 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 6.55 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _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 58 ILE 4.16 0.58 0 23 ALA -5.94 1.53 0 84 ILE 3.30 -1.43 0 115 VAL -6.75 1.68 0 10 ALA 4.17 -0.37 1 11 ALA 3.57 -0.24 1 12 ALA 2.99 -0.54 1 13 ILE 5.32 -1.08 1 14 ASP 5.08 -0.26 1 15 VAL 6.07 -0.67 1 16 LEU 3.76 0.17 1 17 ASN 2.68 -0.02 1 18 GLU -0.21 0.06 1 19 GLU 4.49 -0.43 1 20 ARG -3.96 0.26 1 21 VAL -1.86 0.24 1 22 ILE -6.15 0.61 1 24 TYR 1.01 0.20 1 26 THR -1.55 -0.46 1 28 ALA -3.03 0.50 1 29 VAL -6.64 0.67 1 30 PHE 2.41 -0.37 1 32 VAL -4.97 1.25 1 37 ASP -0.10 0.24 1 38 SER -1.49 0.17 1 40 THR 5.42 -0.87 1 41 ALA 3.14 -0.51 1 42 VAL 6.52 -0.17 1 43 MET 5.43 -0.14 1 44 ARG 5.45 -0.26 1 45 LEU 5.19 -0.46 1 46 LEU 6.03 -0.47 1 47 GLU 2.95 -0.28 1 48 LEU 2.59 -0.22 1 49 LYS 1.25 -0.27 1 50 GLN 4.09 0.24 1 51 ARG -5.89 0.30 1 53 VAL 1.70 0.61 1 54 ASP 1.20 -0.38 1 55 LYS 3.63 -0.06 1 57 LEU -6.85 0.46 1 59 LEU -3.64 0.81 1 60 ILE -6.73 1.16 1 61 ALA -7.21 0.85 1 62 ALA -2.21 -0.19 1 63 ASN -2.05 -0.33 1 64 TYR 2.54 -0.75 1 65 GLU 5.39 -0.80 1 66 GLN 2.22 -0.37 1 67 LEU -0.55 -0.30 1 70 TYR -0.33 -0.57 1 71 ILE -5.06 0.67 1 72 ASP -2.26 0.30 1 73 ASP -2.48 0.24 1 74 THR 3.47 -0.44 1 75 MET 4.62 0.08 1 76 LEU -0.22 0.19 1 77 THR -3.40 0.10 1 78 ASP 5.44 -0.44 1 79 VAL 4.39 -0.39 1 80 GLN 3.49 -0.46 1 81 ARG 5.34 -0.95 1 82 GLU 3.68 -0.25 1 83 THR 5.72 -0.63 1 85 PHE 4.34 -0.42 1 86 SER 2.93 -0.08 1 87 ARG -0.46 0.12 1 88 TRP -9.09 0.44 1 92 VAL -1.36 0.14 1 93 THR -0.90 0.63 1 94 PHE -5.95 0.95 1 95 VAL 0.70 0.41 1 96 PHE -3.12 -0.03 1 98 ALA -4.04 0.56 1 100 ALA 2.68 -0.31 1 101 THR 1.18 -0.47 1 102 THR 3.78 -0.33 1 104 ARG 0.46 0.36 1 105 TRP 5.90 -0.19 1 106 LEU -5.62 0.32 1 107 THR 2.18 -0.11 1 109 ARG 2.01 -0.08 1 110 PHE -1.66 -0.05 1 111 ASP -0.03 0.49 1 112 SER -4.39 0.73 1 113 LEU -6.21 0.27 1 114 ALA -3.07 0.72 1 117 VAL 0.92 -0.35 1 118 THR -1.25 0.10 1 119 ASP -2.47 -0.21 1 122 LEU 2.07 -0.06 1 123 VAL 6.20 -0.93 1 124 VAL 6.55 -0.99 1 125 ALA 3.89 -0.33 1 126 LEU 3.48 -0.38 1 128 GLN 4.97 -0.54 1 129 ALA 2.36 -0.26 1 130 TYR -0.90 -0.10 1 132 LYS -0.58 -0.02 1 134 LEU -5.66 0.46 1 135 VAL 1.56 0.25 1 136 SER -2.14 0.41 1 137 THR -2.00 0.38 1 138 SER 2.23 -0.37 1 139 ALA 0.74 -0.03 1 140 ASN -0.98 0.24 1 141 LEU -0.92 -0.06 1 142 SER 2.97 -0.48 1 144 LEU 0.84 0.10 1 148 ARG -0.30 0.13 1 149 THR -7.02 0.56 1 151 ASP 4.41 -0.43 1 152 GLU 3.62 -0.38 1 153 VAL 6.23 -0.20 1 154 ARG 3.98 -0.53 1 155 ALA 3.26 -0.32 1 156 GLN 2.68 -0.44 1 157 PHE 2.02 -0.61 1 159 ALA 3.14 -0.52 1 160 ALA -1.00 0.07 1 161 PHE 1.21 -0.53 1 163 VAL -5.69 0.83 1 164 VAL -0.14 -0.06 1 167 GLU -4.57 0.59 1 168 THR -0.67 0.09 1 171 ARG 0.49 -0.06 1 172 LEU 0.59 -0.14 1 173 ASN -1.26 0.03 1 175 SER 1.18 -0.36 1 176 GLU -1.82 0.18 1 177 ILE -1.24 0.60 1 178 ARG -6.28 0.55 1 179 ASP -2.06 -0.19 1 180 ALA 3.53 -0.80 1 181 LEU 2.80 -0.32 1 182 THR -1.75 0.05 1 184 GLU -2.31 -0.17 1 185 LEU 1.55 -0.07 1 186 PHE -1.19 -0.23 1 187 ARG -0.84 -0.17 1 188 GLN -0.33 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25381_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.09 _LACS_plot.Line_1_terminator_val_y_1 -4.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.12 _LACS_plot.Line_2_terminator_val_x_2 8.90 _LACS_plot.Line_2_terminator_val_y_2 1.32 _LACS_plot.Y_axis_chem_shift_offset 1.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 THR 2.18 3.65 0 16 LEU 3.76 3.98 0 68 LYS 8.90 -1.88 0 73 ASP -2.48 2.41 0 139 ALA 0.74 -5.93 0 88 TRP -9.09 -1.20 0 10 ALA 4.17 1.17 1 11 ALA 3.57 1.19 1 12 ALA 2.99 -0.06 1 13 ILE 5.32 -0.36 1 14 ASP 5.08 1.11 1 15 VAL 6.07 1.79 1 17 ASN 2.68 -0.51 1 18 GLU -0.21 -3.09 1 19 GLU 4.49 -2.93 1 20 ARG -3.96 -3.34 1 21 VAL -1.86 -3.00 1 22 ILE -6.15 -3.64 1 23 ALA -5.94 -2.60 1 26 THR -1.55 -2.68 1 28 ALA -3.03 -2.33 1 29 VAL -6.64 -0.54 1 30 PHE 2.41 -2.53 1 32 VAL -4.97 -2.32 1 35 ASP -2.20 -1.09 1 37 ASP -0.10 -1.79 1 38 SER -1.49 -2.96 1 39 GLU 4.02 -0.14 1 40 THR 5.42 0.13 1 41 ALA 3.14 -0.56 1 42 VAL 6.52 0.81 1 43 MET 5.43 3.02 1 44 ARG 5.45 1.78 1 45 LEU 5.19 -0.76 1 46 LEU 6.03 1.10 1 47 GLU 2.95 1.77 1 48 LEU 2.59 -0.13 1 49 LYS 1.25 -2.63 1 50 GLN 4.09 -2.73 1 51 ARG -5.89 -2.39 1 53 VAL 1.70 -1.67 1 54 ASP 1.20 -0.05 1 55 LYS 3.63 -0.45 1 57 LEU -6.85 -4.15 1 58 ILE 4.16 -1.27 1 59 LEU -3.64 -4.32 1 60 ILE -6.73 -5.14 1 61 ALA -7.21 -3.56 1 62 ALA -2.21 -1.83 1 63 ASN -2.05 -2.73 1 64 TYR 2.54 -0.37 1 65 GLU 5.39 1.27 1 66 GLN 2.22 -0.21 1 67 LEU -0.55 -1.74 1 70 TYR -0.33 -2.09 1 71 ILE -5.06 -4.76 1 72 ASP -2.26 -3.28 1 74 THR 3.47 -0.19 1 75 MET 4.62 -1.55 1 76 LEU -0.22 -0.94 1 77 THR -3.40 -0.54 1 78 ASP 5.44 1.16 1 79 VAL 4.39 1.19 1 80 GLN 3.49 2.09 1 81 ARG 5.34 -0.75 1 82 GLU 3.68 1.41 1 83 THR 5.72 -0.21 1 84 ILE 3.30 -0.79 1 85 PHE 4.34 1.26 1 86 SER 2.93 -0.55 1 87 ARG -0.46 -3.06 1 92 VAL -1.36 -4.41 1 93 THR -0.90 -2.73 1 94 PHE -5.95 -1.68 1 95 VAL 0.70 -1.51 1 96 PHE -3.12 -2.94 1 98 ALA -4.04 -2.05 1 100 ALA 2.68 -1.30 1 101 THR 1.18 0.13 1 102 THR 3.78 -2.83 1 104 ARG 0.46 0.88 1 105 TRP 5.90 -2.23 1 106 LEU -5.62 -2.39 1 109 ARG 2.01 -3.11 1 110 PHE -1.66 -2.51 1 111 ASP -0.03 -2.30 1 112 SER -4.39 -4.12 1 113 LEU -6.21 -5.59 1 114 ALA -3.07 -3.56 1 115 VAL -6.75 -2.92 1 117 VAL 0.92 -3.85 1 118 THR -1.25 -5.01 1 119 ASP -2.47 -0.08 1 120 HIS 0.83 1.06 1 122 LEU 2.07 -0.68 1 123 VAL 6.20 0.39 1 124 VAL 6.55 -0.43 1 125 ALA 3.89 1.68 1 126 LEU 3.48 -1.06 1 128 GLN 4.97 0.68 1 129 ALA 2.36 0.18 1 130 TYR -0.90 -0.46 1 134 LEU -5.66 -0.14 1 135 VAL 1.56 -1.76 1 136 SER -2.14 -2.52 1 137 THR -2.00 -3.46 1 138 SER 2.23 -0.45 1 140 ASN -0.98 -1.98 1 141 LEU -0.92 -1.12 1 142 SER 2.97 0.59 1 144 LEU 0.84 -2.78 1 148 ARG -0.30 -2.91 1 149 THR -7.02 -1.80 1 150 VAL 5.27 -0.69 1 151 ASP 4.41 1.76 1 152 GLU 3.62 0.90 1 153 VAL 6.23 0.69 1 154 ARG 3.98 1.35 1 155 ALA 3.26 0.07 1 156 GLN 2.68 -0.32 1 157 PHE 2.02 -0.81 1 159 ALA 3.14 -0.73 1 160 ALA -1.00 -1.73 1 161 PHE 1.21 -1.70 1 163 VAL -5.69 -3.07 1 164 VAL -0.14 -3.23 1 167 GLU -4.57 -0.11 1 168 THR -0.67 -1.20 1 171 ARG 0.49 -1.29 1 172 LEU 0.59 -2.00 1 173 ASN -1.26 -2.67 1 175 SER 1.18 -1.33 1 176 GLU -1.82 -3.85 1 177 ILE -1.24 -2.30 1 178 ARG -6.28 -3.23 1 179 ASP -2.06 -0.13 1 180 ALA 3.53 -2.43 1 181 LEU 2.80 0.52 1 182 THR -1.75 0.40 1 184 GLU -2.31 -2.10 1 185 LEU 1.55 -1.85 1 186 PHE -1.19 -2.43 1 187 ARG -0.84 -3.01 1 188 GLN -0.33 -2.18 1 stop_ save_