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 bmr36078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.44 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.69 _LACS_plot.Line_2_terminator_val_x_2 8.49 _LACS_plot.Line_2_terminator_val_y_2 7.11 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ILE 2.20 -2.98 0 10 GLN 0.27 0.58 1 11 ASP 0.39 0.50 1 12 LEU 0.40 0.36 1 13 LEU 0.15 -0.05 1 14 LEU 0.14 -0.03 1 15 LEU -1.10 -0.31 1 16 ASP -0.21 0.10 1 17 VAL -7.60 -4.00 1 18 ALA -0.45 -1.34 1 20 LEU -8.44 -2.50 1 21 SER 2.20 1.19 1 22 LEU -7.06 -2.41 1 24 LEU -5.70 -2.41 1 25 GLU -3.62 -1.06 1 26 THR -1.14 -0.96 1 27 ALA 0.89 1.21 1 30 VAL -1.19 -0.03 1 31 MET -1.17 -0.47 1 32 THR 0.87 0.51 1 33 ALA 0.50 0.24 1 34 LEU 0.16 1.62 1 35 ILE -3.55 -1.82 1 36 LYS -0.41 -0.15 1 37 ARG 2.72 1.86 1 38 ASN 4.82 2.22 1 39 SER 1.38 1.59 1 40 THR 1.79 1.72 1 41 ILE -1.10 -0.70 1 43 THR 1.49 -0.01 1 44 LYS -3.56 -1.04 1 45 GLN -5.33 -1.17 1 46 THR -2.53 -0.34 1 47 GLN -5.06 -0.66 1 48 ILE 0.23 -0.80 1 49 PHE -3.95 -0.73 1 50 THR -3.22 -2.83 1 51 THR -0.71 -1.64 1 52 TYR -2.19 0.59 1 53 SER -3.94 -1.84 1 54 ASP 1.68 1.43 1 55 ASN 4.44 2.02 1 56 GLN -0.39 1.32 1 59 VAL -5.01 -2.45 1 60 LEU -1.29 -1.45 1 62 GLN -3.51 -0.91 1 63 VAL 0.60 -0.08 1 64 TYR -8.19 -0.51 1 65 GLU -7.77 -3.53 1 67 GLU -3.92 -2.27 1 68 ARG 0.88 -2.38 1 69 ALA 0.20 2.19 1 70 MET -1.26 -3.63 1 71 THR 4.56 4.40 1 72 LYS 3.99 1.87 1 73 ASP -0.96 0.43 1 74 ASN -3.11 -1.27 1 75 ASN -1.99 -0.29 1 76 LEU 1.58 0.62 1 77 LEU -1.77 -0.33 1 79 ARG -5.72 -1.70 1 80 PHE -1.63 -0.82 1 81 GLU -5.11 -2.35 1 82 LEU -2.39 -0.78 1 83 SER -2.95 -1.47 1 85 ILE 1.58 0.84 1 88 ALA -1.47 0.17 1 90 ARG 1.19 -0.33 1 92 VAL 8.49 5.90 1 94 GLN -2.52 -0.84 1 95 ILE -1.96 -2.71 1 96 GLU -2.75 -0.07 1 97 VAL -1.62 -0.80 1 98 THR -2.23 -0.44 1 99 PHE -2.76 -1.72 1 100 ASP -5.04 -1.06 1 101 ILE -4.38 -1.80 1 102 ASP -2.26 -1.53 1 103 ALA 1.91 1.71 1 104 ASN -1.13 -0.36 1 106 ILE 3.81 1.04 1 107 LEU -3.51 -1.82 1 108 ASN -4.20 -0.57 1 109 VAL -1.98 -1.39 1 110 THR -2.31 -0.72 1 111 ALA -5.76 -2.17 1 112 THR -2.85 -0.79 1 113 ASP -1.07 -0.25 1 114 LYS 4.13 2.18 1 115 SER 3.58 2.91 1 116 THR -1.21 0.36 1 118 LYS 1.81 1.62 1 119 ALA -7.30 -1.71 1 120 ASN -4.30 -1.68 1 121 LYS -5.39 -1.76 1 122 ILE -4.54 -0.89 1 123 THR -0.80 0.03 1 124 ILE -2.05 -1.24 1 125 THR 0.42 -0.10 1 126 ASN -0.30 -0.29 1 127 ASP 0.12 0.36 1 128 LYS 1.48 1.04 1 130 ARG 0.78 0.37 1 131 LEU -1.52 -0.37 1 132 SER -3.22 -1.35 1 133 LYS 4.64 3.96 1 134 GLU 3.99 3.26 1 135 GLU 2.05 2.47 1 136 ILE 5.48 4.91 1 137 GLU 3.52 3.00 1 138 ARG 4.76 3.77 1 139 MET 4.22 4.18 1 140 VAL 6.01 5.08 1 141 GLN 4.35 3.30 1 142 GLU 2.90 3.08 1 143 ALA 3.18 2.75 1 144 GLU 2.77 2.35 1 145 LYS 3.61 3.03 1 146 TYR 0.57 -0.32 1 147 LYS 4.43 4.24 1 148 ALA 3.77 2.83 1 149 GLU 3.58 3.10 1 150 ASP 3.78 3.03 1 151 GLU 3.27 2.87 1 152 VAL 5.04 3.99 1 153 GLN 4.33 3.42 1 154 ARG 4.44 3.82 1 155 GLU 2.83 2.45 1 156 ARG 3.73 3.10 1 157 VAL 4.10 3.13 1 158 SER 2.81 2.29 1 159 ALA 1.62 1.54 1 160 LYS 2.00 1.73 1 161 ASN 0.75 0.76 1 162 ALA 1.25 1.17 1 163 TYR 0.99 0.70 1 164 GLU 0.65 0.70 1 165 SER 0.94 0.63 1 166 TYR 0.72 0.47 1 167 ALA 0.42 0.29 1 168 PHE -0.26 -0.37 1 172 SER 0.00 0.10 1 173 ALA 0.01 0.26 1 174 VAL 0.71 0.45 1 175 GLU -0.10 0.10 1 176 ASP 0.15 0.33 1 177 GLU 0.56 1.01 1 179 LEU 0.49 0.39 1 180 LYS 0.94 0.63 1 182 LYS 0.33 0.01 1 183 ILE -0.07 -0.02 1 184 SER -0.51 -0.22 1 185 GLU 0.16 1.61 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.44 _LACS_plot.Line_1_terminator_val_y_1 5.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 8.49 _LACS_plot.Line_2_terminator_val_y_2 -1.38 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ILE 2.20 -5.18 0 10 GLN 0.27 0.31 1 11 ASP 0.39 0.11 1 12 LEU 0.40 -0.04 1 13 LEU 0.15 -0.20 1 14 LEU 0.14 -0.17 1 15 LEU -1.10 0.79 1 16 ASP -0.21 0.31 1 17 VAL -7.60 3.60 1 18 ALA -0.45 -0.89 1 20 LEU -8.44 5.94 1 21 SER 2.20 -1.01 1 22 LEU -7.06 4.65 1 24 LEU -5.70 3.29 1 25 GLU -3.62 2.56 1 26 THR -1.14 0.18 1 27 ALA 0.89 0.32 1 30 VAL -1.19 1.16 1 31 MET -1.17 0.70 1 32 THR 0.87 -0.36 1 33 ALA 0.50 -0.26 1 34 LEU 0.16 1.46 1 35 ILE -3.55 1.73 1 36 LYS -0.41 0.26 1 37 ARG 2.72 -0.86 1 38 ASN 4.82 -2.60 1 39 SER 1.38 0.21 1 40 THR 1.79 -0.07 1 41 ILE -1.10 0.40 1 43 THR 1.49 -1.50 1 44 LYS -3.56 2.52 1 45 GLN -5.33 4.16 1 46 THR -2.53 2.19 1 47 GLN -5.06 4.40 1 48 ILE 0.23 -1.03 1 49 PHE -3.95 3.22 1 50 THR -3.22 0.39 1 51 THR -0.71 -0.93 1 52 TYR -2.19 2.78 1 53 SER -3.94 2.10 1 54 ASP 1.68 -0.25 1 55 ASN 4.44 -2.42 1 56 GLN -0.39 1.71 1 59 VAL -5.01 2.56 1 60 LEU -1.29 -0.16 1 62 GLN -3.51 2.60 1 63 VAL 0.60 -0.68 1 64 TYR -8.19 7.68 1 65 GLU -7.77 4.24 1 67 GLU -3.92 1.65 1 68 ARG 0.88 -3.26 1 69 ALA 0.20 1.99 1 70 MET -1.26 -2.37 1 71 THR 4.56 -0.16 1 72 LYS 3.99 -2.12 1 73 ASP -0.96 1.39 1 74 ASN -3.11 1.84 1 75 ASN -1.99 1.70 1 76 LEU 1.58 -0.96 1 77 LEU -1.77 1.44 1 79 ARG -5.72 4.02 1 80 PHE -1.63 0.81 1 81 GLU -5.11 2.76 1 82 LEU -2.39 1.61 1 83 SER -2.95 1.48 1 85 ILE 1.58 -0.74 1 88 ALA -1.47 1.64 1 90 ARG 1.19 -1.52 1 92 VAL 8.49 -2.59 1 94 GLN -2.52 1.68 1 95 ILE -1.96 -0.75 1 96 GLU -2.75 2.68 1 97 VAL -1.62 0.82 1 98 THR -2.23 1.79 1 99 PHE -2.76 1.04 1 100 ASP -5.04 3.98 1 101 ILE -4.38 2.58 1 102 ASP -2.26 0.73 1 103 ALA 1.91 -0.20 1 104 ASN -1.13 0.77 1 106 ILE 3.81 -2.77 1 107 LEU -3.51 1.69 1 108 ASN -4.20 3.63 1 109 VAL -1.98 0.59 1 110 THR -2.31 1.59 1 111 ALA -5.76 3.59 1 112 THR -2.85 2.06 1 113 ASP -1.07 0.82 1 114 LYS 4.13 -1.95 1 115 SER 3.58 -0.67 1 116 THR -1.21 1.57 1 118 LYS 1.81 -0.19 1 119 ALA -7.30 5.59 1 120 ASN -4.30 2.62 1 121 LYS -5.39 3.63 1 122 ILE -4.54 3.65 1 123 THR -0.80 0.83 1 124 ILE -2.05 0.81 1 125 THR 0.42 -0.52 1 126 ASN -0.30 0.01 1 127 ASP 0.12 0.24 1 128 LYS 1.48 -0.44 1 130 ARG 0.78 -0.41 1 131 LEU -1.52 1.15 1 132 SER -3.22 1.87 1 133 LYS 4.64 -0.68 1 134 GLU 3.99 -0.73 1 135 GLU 2.05 0.42 1 136 ILE 5.48 -0.57 1 137 GLU 3.52 -0.52 1 138 ARG 4.76 -0.99 1 139 MET 4.22 -0.04 1 140 VAL 6.01 -0.93 1 141 GLN 4.35 -1.05 1 142 GLU 2.90 0.18 1 143 ALA 3.18 -0.43 1 144 GLU 2.77 -0.42 1 145 LYS 3.61 -0.58 1 146 TYR 0.57 -0.89 1 147 LYS 4.43 -0.19 1 148 ALA 3.77 -0.94 1 149 GLU 3.58 -0.48 1 150 ASP 3.78 -0.75 1 151 GLU 3.27 -0.40 1 152 VAL 5.04 -1.05 1 153 GLN 4.33 -0.91 1 154 ARG 4.44 -0.62 1 155 GLU 2.83 -0.38 1 156 ARG 3.73 -0.63 1 157 VAL 4.10 -0.97 1 158 SER 2.81 -0.52 1 159 ALA 1.62 -0.08 1 160 LYS 2.00 -0.27 1 161 ASN 0.75 0.01 1 162 ALA 1.25 -0.08 1 163 TYR 0.99 -0.29 1 164 GLU 0.65 0.05 1 165 SER 0.94 -0.31 1 166 TYR 0.72 -0.25 1 167 ALA 0.42 -0.13 1 168 PHE -0.26 -0.11 1 172 SER 0.00 0.10 1 173 ALA 0.01 0.25 1 174 VAL 0.71 -0.26 1 175 GLU -0.10 0.20 1 176 ASP 0.15 0.18 1 177 GLU 0.56 0.45 1 179 LEU 0.49 -0.10 1 180 LYS 0.94 -0.31 1 182 LYS 0.33 -0.32 1 183 ILE -0.07 0.05 1 184 SER -0.51 0.29 1 185 GLU 0.16 1.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.44 _LACS_plot.Line_1_terminator_val_y_1 0.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 8.49 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 LEU -8.44 0.19 0 24 LEU -5.70 1.92 0 10 GLN 0.27 -0.05 1 11 ASP 0.39 -0.08 1 12 LEU 0.40 -0.06 1 13 LEU 0.15 0.03 1 14 LEU 0.14 0.00 1 15 LEU -1.10 0.12 1 16 ASP -0.21 0.06 1 17 VAL -7.60 0.97 1 18 ALA -0.45 0.00 1 21 SER 2.20 0.17 1 22 LEU -7.06 1.10 1 25 GLU -3.62 0.45 1 26 THR -1.14 0.45 1 27 ALA 0.89 -0.34 1 30 VAL -1.19 -0.03 1 31 MET -1.17 -0.56 1 32 THR 0.87 0.12 1 33 ALA 0.50 -0.21 1 34 LEU 0.16 0.08 1 35 ILE -3.55 0.20 1 36 LYS -0.41 -0.16 1 37 ARG 2.72 -0.90 1 38 ASN 4.82 -0.58 1 39 SER 1.38 0.04 1 40 THR 1.79 0.12 1 41 ILE -1.10 -0.22 1 43 THR 1.49 0.25 1 44 LYS -3.56 1.24 1 45 GLN -5.33 0.48 1 46 THR -2.53 1.34 1 47 GLN -5.06 0.21 1 48 ILE 0.23 0.53 1 49 PHE -3.95 0.34 1 50 THR -3.22 0.55 1 52 TYR -2.19 0.03 1 53 SER -3.94 0.17 1 54 ASP 1.68 -0.23 1 55 ASN 4.44 -0.48 1 56 GLN -0.39 -0.21 1 59 VAL -5.01 0.07 1 60 LEU -1.29 0.20 1 61 ILE 2.20 -0.36 1 62 GLN -3.51 0.39 1 63 VAL 0.60 0.50 1 64 TYR -8.19 0.69 1 65 GLU -7.77 1.40 1 67 GLU -3.92 0.19 1 68 ARG 0.88 0.03 1 69 ALA 0.20 -0.25 1 70 MET -1.26 0.66 1 71 THR 4.56 -1.50 1 72 LYS 3.99 -0.19 1 73 ASP -0.96 0.21 1 74 ASN -3.11 0.51 1 75 ASN -1.99 0.46 1 76 LEU 1.58 -0.95 1 77 LEU -1.77 0.12 1 79 ARG -5.72 1.38 1 80 PHE -1.63 0.12 1 81 GLU -5.11 0.65 1 82 LEU -2.39 0.53 1 83 SER -2.95 0.65 1 85 ILE 1.58 -0.29 1 88 ALA -1.47 0.09 1 90 ARG 1.19 -0.50 1 92 VAL 8.49 -0.33 1 94 GLN -2.52 0.41 1 95 ILE -1.96 0.69 1 96 GLU -2.75 0.30 1 97 VAL -1.62 1.33 1 98 THR -2.23 1.11 1 99 PHE -2.76 0.46 1 100 ASP -5.04 0.65 1 101 ILE -4.38 1.21 1 102 ASP -2.26 0.10 1 103 ALA 1.91 -0.47 1 104 ASN -1.13 0.06 1 106 ILE 3.81 -0.37 1 107 LEU -3.51 0.75 1 108 ASN -4.20 0.67 1 109 VAL -1.98 0.94 1 110 THR -2.31 0.65 1 111 ALA -5.76 1.38 1 112 THR -2.85 0.78 1 113 ASP -1.07 0.19 1 114 LYS 4.13 -0.26 1 115 SER 3.58 -0.02 1 116 THR -1.21 0.13 1 118 LYS 1.81 -0.19 1 119 ALA -7.30 1.51 1 120 ASN -4.30 0.26 1 121 LYS -5.39 0.64 1 122 ILE -4.54 0.16 1 123 THR -0.80 0.52 1 124 ILE -2.05 0.13 1 125 THR 0.42 -0.04 1 126 ASN -0.30 0.08 1 127 ASP 0.12 -0.36 1 128 LYS 1.48 -0.06 1 130 ARG 0.78 -0.07 1 131 LEU -1.52 0.14 1 132 SER -3.22 0.03 1 133 LYS 4.64 -0.37 1 134 GLU 3.99 -0.40 1 135 GLU 2.05 -0.26 1 136 ILE 5.48 -0.55 1 137 GLU 3.52 -0.41 1 138 ARG 4.76 -0.17 1 139 MET 4.22 -0.34 1 140 VAL 6.01 -0.65 1 141 GLN 4.35 -0.22 1 142 GLU 2.90 -0.34 1 143 ALA 3.18 -0.33 1 144 GLU 2.77 -0.41 1 145 LYS 3.61 -0.39 1 146 TYR 0.57 0.38 1 147 LYS 4.43 -0.13 1 148 ALA 3.77 -0.10 1 149 GLU 3.58 -0.29 1 150 ASP 3.78 -0.23 1 151 GLU 3.27 -0.27 1 152 VAL 5.04 -0.33 1 153 GLN 4.33 -0.26 1 154 ARG 4.44 -0.38 1 155 GLU 2.83 -0.23 1 156 ARG 3.73 -0.21 1 157 VAL 4.10 -0.27 1 159 ALA 1.62 -0.08 1 161 ASN 0.75 -0.02 1 162 ALA 1.25 -0.10 1 163 TYR 0.99 -0.08 1 164 GLU 0.65 -0.13 1 166 TYR 0.72 -0.10 1 167 ALA 0.42 -0.18 1 168 PHE -0.26 -0.45 1 172 SER 0.00 -0.08 1 173 ALA 0.01 0.02 1 174 VAL 0.71 -0.03 1 175 GLU -0.10 -0.06 1 176 ASP 0.15 -0.06 1 177 GLU 0.56 -0.17 1 179 LEU 0.49 -0.04 1 180 LYS 0.94 -0.06 1 182 LYS 0.33 0.02 1 183 ILE -0.07 0.06 1 184 SER -0.51 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.44 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.15 _LACS_plot.Line_2_terminator_val_x_2 8.49 _LACS_plot.Line_2_terminator_val_y_2 3.45 _LACS_plot.Y_axis_chem_shift_offset 0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 92 VAL 8.49 -0.46 0 43 THR 1.49 -4.88 0 10 GLN 0.27 -0.25 1 11 ASP 0.39 -0.18 1 12 LEU 0.40 -0.58 1 13 LEU 0.15 -0.94 1 14 LEU 0.14 -1.00 1 15 LEU -1.10 -1.09 1 16 ASP -0.21 -0.82 1 17 VAL -7.60 -0.71 1 18 ALA -0.45 0.41 1 20 LEU -8.44 -1.70 1 21 SER 2.20 -1.82 1 22 LEU -7.06 -0.06 1 24 LEU -5.70 -2.83 1 25 GLU -3.62 1.17 1 26 THR -1.14 -0.69 1 27 ALA 0.89 -0.28 1 30 VAL -1.19 -1.70 1 31 MET -1.17 -1.80 1 32 THR 0.87 -1.23 1 33 ALA 0.50 -0.99 1 34 LEU 0.16 -1.29 1 35 ILE -3.55 -1.40 1 36 LYS -0.41 0.35 1 37 ARG 2.72 -0.73 1 38 ASN 4.82 -0.55 1 39 SER 1.38 -0.88 1 40 THR 1.79 -1.15 1 41 ILE -1.10 -1.32 1 44 LYS -3.56 -1.21 1 45 GLN -5.33 -1.92 1 46 THR -2.53 -0.70 1 47 GLN -5.06 -3.28 1 48 ILE 0.23 -1.54 1 49 PHE -3.95 -2.62 1 50 THR -3.22 -1.16 1 51 THR -0.71 -1.16 1 52 TYR -2.19 -1.35 1 53 SER -3.94 -1.05 1 54 ASP 1.68 0.49 1 55 ASN 4.44 -1.17 1 56 GLN -0.39 2.17 1 59 VAL -5.01 -3.71 1 60 LEU -1.29 -2.97 1 61 ILE 2.20 -2.68 1 62 GLN -3.51 -2.30 1 63 VAL 0.60 -1.97 1 64 TYR -8.19 -1.74 1 65 GLU -7.77 -1.01 1 67 GLU -3.92 1.18 1 68 ARG 0.88 1.43 1 69 ALA 0.20 -1.18 1 70 MET -1.26 1.67 1 71 THR 4.56 1.95 1 72 LYS 3.99 -0.32 1 73 ASP -0.96 -1.47 1 74 ASN -3.11 -2.33 1 75 ASN -1.99 -1.19 1 76 LEU 1.58 -1.18 1 77 LEU -1.77 -0.01 1 79 ARG -5.72 -2.02 1 80 PHE -1.63 -4.84 1 81 GLU -5.11 -0.74 1 82 LEU -2.39 -3.20 1 83 SER -2.95 -0.72 1 85 ILE 1.58 -0.56 1 88 ALA -1.47 -1.89 1 90 ARG 1.19 -0.27 1 94 GLN -2.52 -3.09 1 95 ILE -1.96 -1.02 1 96 GLU -2.75 -0.67 1 97 VAL -1.62 -2.26 1 98 THR -2.23 -0.70 1 99 PHE -2.76 -2.94 1 100 ASP -5.04 -1.85 1 101 ILE -4.38 -1.12 1 102 ASP -2.26 0.73 1 103 ALA 1.91 -0.10 1 104 ASN -1.13 0.31 1 106 ILE 3.81 -1.56 1 107 LEU -3.51 -3.85 1 108 ASN -4.20 -0.44 1 109 VAL -1.98 -2.11 1 110 THR -2.31 -1.33 1 111 ALA -5.76 -2.92 1 112 THR -2.85 -0.84 1 113 ASP -1.07 0.83 1 114 LYS 4.13 1.79 1 115 SER 3.58 1.33 1 116 THR -1.21 1.99 1 118 LYS 1.81 -1.92 1 119 ALA -7.30 -0.27 1 120 ASN -4.30 -3.57 1 121 LYS -5.39 -2.53 1 122 ILE -4.54 -4.17 1 123 THR -0.80 -1.00 1 124 ILE -2.05 -1.26 1 125 THR 0.42 -0.92 1 126 ASN -0.30 -0.44 1 127 ASP 0.12 0.05 1 128 LYS 1.48 0.24 1 130 ARG 0.78 0.27 1 131 LEU -1.52 -0.99 1 132 SER -3.22 0.23 1 133 LYS 4.64 2.16 1 134 GLU 3.99 2.76 1 135 GLU 2.05 2.42 1 136 ILE 5.48 1.19 1 137 GLU 3.52 2.62 1 138 ARG 4.76 2.49 1 139 MET 4.22 3.20 1 140 VAL 6.01 2.40 1 141 GLN 4.35 3.79 1 142 GLU 2.90 1.41 1 143 ALA 3.18 2.16 1 144 GLU 2.77 2.52 1 145 LYS 3.61 1.94 1 146 TYR 0.57 -0.73 1 147 LYS 4.43 1.72 1 148 ALA 3.77 2.86 1 149 GLU 3.58 3.02 1 150 ASP 3.78 1.89 1 151 GLU 3.27 2.72 1 152 VAL 5.04 2.55 1 153 GLN 4.33 2.34 1 154 ARG 4.44 2.86 1 155 GLU 2.83 2.28 1 156 ARG 3.73 2.77 1 157 VAL 4.10 1.34 1 158 SER 2.81 1.29 1 159 ALA 1.62 1.31 1 161 ASN 0.75 0.45 1 162 ALA 1.25 0.20 1 163 TYR 0.99 0.59 1 164 GLU 0.65 0.22 1 165 SER 0.94 0.03 1 166 TYR 0.72 0.10 1 167 ALA 0.42 -0.39 1 168 PHE -0.26 -0.55 1 172 SER 0.00 -0.36 1 173 ALA 0.01 -0.09 1 174 VAL 0.71 0.04 1 175 GLU -0.10 -0.41 1 176 ASP 0.15 0.41 1 177 GLU 0.56 0.94 1 179 LEU 0.49 0.14 1 180 LYS 0.94 0.59 1 182 LYS 0.33 -0.07 1 183 ILE -0.07 -0.27 1 184 SER -0.51 -1.22 1 185 GLU 0.16 4.40 1 stop_ save_