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 bmr25358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 7.28 _LACS_plot.Line_2_terminator_val_y_2 5.40 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 ILE -5.83 -0.43 0 10 ASN 2.13 2.62 1 12 SER -1.80 -0.53 1 15 LEU -4.03 -1.41 1 16 VAL -2.25 -0.84 1 17 ILE -6.14 -2.87 1 18 ASP -3.01 -1.95 1 19 LYS 2.33 1.61 1 20 LYS 0.80 -1.19 1 21 GLU 3.69 1.36 1 22 LYS 0.03 -0.20 1 23 VAL 3.32 1.25 1 24 ILE -0.22 -0.21 1 25 ASP -3.39 -0.52 1 26 ALA -5.09 -1.46 1 27 LYS -4.32 -1.67 1 29 LEU 2.35 0.05 1 30 ASN -3.27 -2.27 1 31 ASN 4.11 3.29 1 32 ASP 2.97 1.79 1 33 ALA -1.03 0.99 1 34 LYS 3.60 2.16 1 36 ILE 3.89 2.68 1 37 LEU 3.98 3.08 1 38 ASP 1.42 1.76 1 39 GLU 1.34 2.04 1 40 ALA 1.69 1.71 1 41 ALA 4.49 3.42 1 43 LYS 4.71 2.88 1 44 ASP -0.03 1.21 1 45 MET 4.15 3.94 1 47 LEU 4.35 4.11 1 48 TYR 2.99 2.80 1 49 ASP 1.66 2.47 1 50 ALA 1.72 2.09 1 51 LEU 5.72 4.36 1 52 SER 3.68 2.98 1 53 LYS 5.81 5.14 1 54 ILE 5.67 3.60 1 55 LEU 3.66 4.32 1 56 ASP 4.12 2.88 1 57 ILE 7.29 6.05 1 58 SER 3.75 3.56 1 59 LYS 4.41 3.37 1 60 LYS 0.15 0.23 1 61 ASN 1.47 2.18 1 63 TYR -1.62 -0.84 1 64 ILE -1.34 -0.43 1 65 ASN 2.28 1.92 1 66 SER 0.55 0.66 1 67 ALA -0.36 -0.52 1 68 ASP -0.16 0.00 1 69 ASN -2.72 -1.04 1 70 ILE -2.12 -1.49 1 71 VAL -5.45 -2.14 1 72 LEU -6.49 -2.39 1 73 PHE -3.15 -1.57 1 74 SER -6.42 -2.23 1 75 ALA -3.90 -1.07 1 76 SER -2.35 -1.49 1 77 ILE 0.22 -0.23 1 78 ASN 0.26 0.51 1 79 SER 0.67 0.30 1 81 ARG 0.54 0.42 1 82 ASN 0.41 0.16 1 83 ASN 1.55 1.11 1 84 VAL 0.61 0.66 1 85 SER 1.12 1.05 1 86 GLU 1.35 1.02 1 87 SER 1.21 1.14 1 88 ASP 2.28 1.72 1 89 LYS 2.18 1.39 1 91 ILE 4.99 3.25 1 92 GLN 3.85 3.03 1 93 GLU 4.37 3.46 1 94 ILE 6.56 5.05 1 95 ILE 6.82 5.01 1 97 THR 5.23 2.64 1 98 LEU 4.59 3.72 1 99 LYS 4.47 3.42 1 100 ASP 5.25 3.55 1 101 VAL 3.18 2.72 1 102 ALA 4.30 3.12 1 103 LYS 4.29 2.84 1 104 ASP -1.50 -0.28 1 105 ALA -3.86 -3.25 1 107 VAL -0.31 -0.07 1 108 LYS -4.81 -2.07 1 109 PHE -4.66 -1.58 1 110 GLU -2.55 -1.24 1 111 ILE -2.58 -0.58 1 112 ILE -4.19 -2.45 1 114 SER -4.48 -1.34 1 115 THR 2.47 2.07 1 116 GLU 3.97 3.30 1 117 GLU 4.01 3.08 1 118 ASP 5.23 4.28 1 119 ARG 4.30 2.77 1 120 GLN 3.94 3.25 1 121 LYS 5.14 3.05 1 122 ALA 3.58 3.00 1 123 LEU 3.29 2.65 1 124 ASP -0.92 -1.68 1 125 GLN 2.79 1.01 1 126 ASN -7.05 -1.92 1 127 LEU -2.49 -1.68 1 128 SER 4.74 5.09 1 129 MET 5.46 4.34 1 131 ARG 3.89 4.15 1 132 TYR 2.56 2.44 1 133 ALA 5.20 3.31 1 134 ILE 4.70 3.59 1 135 TYR 5.63 4.13 1 136 VAL 3.42 2.44 1 137 LYS 4.01 2.93 1 138 ALA 5.49 3.97 1 139 VAL 3.19 2.65 1 140 GLU -0.42 -0.13 1 141 GLU -0.05 -0.57 1 143 VAL 1.96 0.01 1 144 ASN -2.66 -0.88 1 145 LEU -1.89 -1.57 1 146 ASN 3.42 3.16 1 147 LEU 4.18 3.02 1 148 GLU 3.52 2.74 1 149 ASP 3.69 2.09 1 150 ALA 2.60 3.12 1 151 ARG -0.42 1.76 1 152 ASN 0.24 -0.07 1 153 LEU -0.47 -0.30 1 154 SER 5.75 4.81 1 155 VAL 5.28 4.02 1 156 SER 2.34 2.57 1 157 GLU 6.66 5.04 1 158 ILE 4.44 2.74 1 159 LEU 2.45 1.74 1 161 LYS 1.20 0.65 1 162 LEU 1.26 1.13 1 163 GLU 1.21 1.66 1 164 HIS 0.55 1.66 1 165 HIS 0.15 0.94 1 166 HIS -0.21 0.85 1 167 HIS 0.04 0.85 1 168 HIS 1.26 2.28 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 4.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.84 _LACS_plot.Line_2_terminator_val_x_2 7.28 _LACS_plot.Line_2_terminator_val_y_2 -1.88 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 ILE -5.83 5.40 0 10 ASN 2.13 0.49 1 12 SER -1.80 1.27 1 15 LEU -4.03 2.62 1 16 VAL -2.25 1.41 1 17 ILE -6.14 3.27 1 18 ASP -3.01 1.06 1 19 LYS 2.33 -0.72 1 20 LYS 0.80 -1.99 1 21 GLU 3.69 -2.33 1 22 LYS 0.03 -0.23 1 23 VAL 3.32 -2.07 1 24 ILE -0.22 0.01 1 25 ASP -3.39 2.87 1 26 ALA -5.09 3.63 1 27 LYS -4.32 2.65 1 29 LEU 2.35 -2.30 1 30 ASN -3.27 1.00 1 31 ASN 4.11 -0.82 1 32 ASP 2.97 -1.18 1 33 ALA -1.03 2.02 1 34 LYS 3.60 -1.44 1 36 ILE 3.89 -1.21 1 37 LEU 3.98 -0.90 1 38 ASP 1.42 0.34 1 39 GLU 1.34 0.70 1 40 ALA 1.69 0.02 1 41 ALA 4.49 -1.07 1 43 LYS 4.71 -1.83 1 44 ASP -0.03 1.24 1 45 MET 4.15 -0.21 1 47 LEU 4.35 -0.24 1 48 TYR 2.99 -0.19 1 49 ASP 1.66 0.81 1 50 ALA 1.72 0.37 1 51 LEU 5.72 -1.36 1 52 SER 3.68 -0.70 1 53 LYS 5.81 -0.67 1 54 ILE 5.67 -2.07 1 55 LEU 3.66 0.66 1 56 ASP 4.12 -1.24 1 57 ILE 7.29 -1.24 1 58 SER 3.75 -0.19 1 59 LYS 4.41 -1.04 1 60 LYS 0.15 0.08 1 61 ASN 1.47 0.71 1 63 TYR -1.62 0.78 1 64 ILE -1.34 0.91 1 65 ASN 2.28 -0.36 1 66 SER 0.55 0.11 1 67 ALA -0.36 -0.16 1 68 ASP -0.16 0.16 1 69 ASN -2.72 1.68 1 70 ILE -2.12 0.63 1 71 VAL -5.45 3.31 1 72 LEU -6.49 4.10 1 73 PHE -3.15 1.58 1 74 SER -6.42 4.19 1 75 ALA -3.90 2.83 1 76 SER -2.35 0.86 1 77 ILE 0.22 -0.45 1 78 ASN 0.26 0.25 1 79 SER 0.67 -0.37 1 81 ARG 0.54 -0.12 1 82 ASN 0.41 -0.25 1 83 ASN 1.55 -0.44 1 84 VAL 0.61 0.05 1 85 SER 1.12 -0.07 1 86 GLU 1.35 -0.33 1 87 SER 1.21 -0.07 1 88 ASP 2.28 -0.56 1 89 LYS 2.18 -0.79 1 91 ILE 4.99 -1.74 1 92 GLN 3.85 -0.82 1 93 GLU 4.37 -0.91 1 94 ILE 6.56 -1.51 1 95 ILE 6.82 -1.81 1 97 THR 5.23 -2.59 1 98 LEU 4.59 -0.87 1 99 LYS 4.47 -1.05 1 100 ASP 5.25 -1.70 1 101 VAL 3.18 -0.46 1 102 ALA 4.30 -1.18 1 103 LYS 4.29 -1.45 1 104 ASP -1.50 1.22 1 105 ALA -3.86 0.61 1 107 VAL -0.31 0.24 1 108 LYS -4.81 2.74 1 109 PHE -4.66 3.08 1 110 GLU -2.55 1.31 1 111 ILE -2.58 2.00 1 112 ILE -4.19 1.74 1 114 SER -4.48 3.14 1 115 THR 2.47 -0.40 1 116 GLU 3.97 -0.67 1 117 GLU 4.01 -0.93 1 118 ASP 5.23 -0.95 1 119 ARG 4.30 -1.53 1 120 GLN 3.94 -0.69 1 121 LYS 5.14 -2.09 1 122 ALA 3.58 -0.58 1 123 LEU 3.29 -0.64 1 124 ASP -0.92 -0.76 1 125 GLN 2.79 -1.78 1 126 ASN -7.05 5.13 1 127 LEU -2.49 0.81 1 128 SER 4.74 0.35 1 129 MET 5.46 -1.12 1 131 ARG 3.89 0.26 1 132 TYR 2.56 -0.12 1 133 ALA 5.20 -1.89 1 134 ILE 4.70 -1.11 1 135 TYR 5.63 -1.50 1 136 VAL 3.42 -0.98 1 137 LYS 4.01 -1.08 1 138 ALA 5.49 -1.52 1 139 VAL 3.19 -0.54 1 140 GLU -0.42 0.29 1 141 GLU -0.05 -0.52 1 143 VAL 1.96 -1.95 1 144 ASN -2.66 1.78 1 145 LEU -1.89 0.32 1 146 ASN 3.42 -0.26 1 147 LEU 4.18 -1.16 1 148 GLU 3.52 -0.78 1 149 ASP 3.69 -1.60 1 150 ALA 2.60 0.52 1 151 ARG -0.42 2.18 1 152 ASN 0.24 -0.31 1 153 LEU -0.47 0.17 1 154 SER 5.75 -0.94 1 155 VAL 5.28 -1.26 1 156 SER 2.34 0.23 1 157 GLU 6.66 -1.62 1 158 ILE 4.44 -1.70 1 159 LEU 2.45 -0.71 1 161 LYS 1.20 -0.55 1 162 LEU 1.26 -0.13 1 163 GLU 1.21 0.45 1 164 HIS 0.55 1.11 1 165 HIS 0.15 0.79 1 166 HIS -0.21 1.06 1 167 HIS 0.04 0.81 1 168 HIS 1.26 1.02 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _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 7.28 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 74 SER -6.42 1.54 0 17 ILE -6.14 1.65 0 10 ASN 2.13 -0.20 1 12 SER -1.80 1.09 1 13 ILE -5.83 0.31 1 15 LEU -4.03 0.92 1 16 VAL -2.25 0.61 1 18 ASP -3.01 0.27 1 19 LYS 2.33 -0.81 1 20 LYS 0.80 0.03 1 21 GLU 3.69 -0.73 1 22 LYS 0.03 0.02 1 23 VAL 3.32 0.06 1 24 ILE -0.22 0.32 1 25 ASP -3.39 0.09 1 26 ALA -5.09 0.97 1 27 LYS -4.32 0.33 1 29 LEU 2.35 -0.04 1 30 ASN -3.27 -0.03 1 31 ASN 4.11 -0.26 1 32 ASP 2.97 -0.17 1 33 ALA -1.03 -0.31 1 34 LYS 3.60 -0.40 1 36 ILE 3.89 -0.46 1 37 LEU 3.98 -0.27 1 38 ASP 1.42 -0.21 1 39 GLU 1.34 -0.55 1 40 ALA 1.69 -0.38 1 41 ALA 4.49 -0.78 1 43 LYS 4.71 -0.46 1 44 ASP -0.03 0.12 1 45 MET 4.15 -0.47 1 47 LEU 4.35 -0.98 1 48 TYR 2.99 -0.37 1 49 ASP 1.66 -0.17 1 50 ALA 1.72 -0.39 1 51 LEU 5.72 -0.66 1 52 SER 3.68 -0.09 1 53 LYS 5.81 -0.84 1 54 ILE 5.67 -0.40 1 55 LEU 3.66 -0.19 1 56 ASP 4.12 -0.44 1 57 ILE 7.29 -0.18 1 58 SER 3.75 0.10 1 59 LYS 4.41 -0.26 1 60 LYS 0.15 -0.04 1 61 ASN 1.47 -0.04 1 63 TYR -1.62 0.24 1 64 ILE -1.34 0.04 1 65 ASN 2.28 -0.19 1 66 SER 0.55 0.11 1 67 ALA -0.36 0.10 1 68 ASP -0.16 0.09 1 69 ASN -2.72 0.25 1 70 ILE -2.12 0.23 1 71 VAL -5.45 0.71 1 72 LEU -6.49 1.11 1 73 PHE -3.15 0.81 1 75 ALA -3.90 0.29 1 76 SER -2.35 0.24 1 77 ILE 0.22 0.18 1 78 ASN 0.26 0.03 1 79 SER 0.67 0.03 1 81 ARG 0.54 -0.02 1 82 ASN 0.41 0.03 1 83 ASN 1.55 0.03 1 84 VAL 0.61 0.03 1 85 SER 1.12 -0.05 1 86 GLU 1.35 -0.06 1 87 SER 1.21 -0.06 1 88 ASP 2.28 -0.13 1 89 LYS 2.18 -0.11 1 91 ILE 4.99 -0.36 1 92 GLN 3.85 -0.24 1 93 GLU 4.37 -0.54 1 94 ILE 6.56 -0.82 1 95 ILE 6.82 -0.32 1 97 THR 5.23 -1.10 1 98 LEU 4.59 -1.15 1 99 LYS 4.47 -0.22 1 100 ASP 5.25 -0.72 1 101 VAL 3.18 -0.53 1 102 ALA 4.30 -0.12 1 103 LYS 4.29 -0.20 1 104 ASP -1.50 0.06 1 105 ALA -3.86 0.71 1 107 VAL -0.31 0.16 1 108 LYS -4.81 1.39 1 109 PHE -4.66 0.30 1 110 GLU -2.55 1.07 1 111 ILE -2.58 0.32 1 112 ILE -4.19 0.56 1 114 SER -4.48 0.54 1 115 THR 2.47 -0.15 1 116 GLU 3.97 -0.37 1 117 GLU 4.01 -0.22 1 118 ASP 5.23 -0.74 1 119 ARG 4.30 -0.60 1 120 GLN 3.94 -0.46 1 121 LYS 5.14 -1.10 1 122 ALA 3.58 -0.37 1 123 LEU 3.29 -0.28 1 124 ASP -0.92 0.12 1 125 GLN 2.79 -0.45 1 126 ASN -7.05 0.36 1 127 LEU -2.49 -0.18 1 128 SER 4.74 -0.77 1 129 MET 5.46 -0.61 1 131 ARG 3.89 -0.51 1 132 TYR 2.56 -0.39 1 133 ALA 5.20 -0.58 1 134 ILE 4.70 -0.55 1 135 TYR 5.63 -1.05 1 136 VAL 3.42 -0.31 1 137 LYS 4.01 -0.61 1 138 ALA 5.49 -0.49 1 139 VAL 3.19 -0.40 1 140 GLU -0.42 -0.06 1 141 GLU -0.05 -0.39 1 143 VAL 1.96 -0.18 1 144 ASN -2.66 0.34 1 145 LEU -1.89 0.31 1 146 ASN 3.42 -0.86 1 147 LEU 4.18 -0.47 1 148 GLU 3.52 -0.21 1 149 ASP 3.69 -0.45 1 150 ALA 2.60 -0.46 1 151 ARG -0.42 0.00 1 152 ASN 0.24 0.09 1 153 LEU -0.47 -0.07 1 154 SER 5.75 -0.72 1 155 VAL 5.28 -0.55 1 156 SER 2.34 -0.30 1 157 GLU 6.66 -0.39 1 158 ILE 4.44 -0.35 1 159 LEU 2.45 -0.19 1 161 LYS 1.20 -0.16 1 162 LEU 1.26 -0.30 1 163 GLU 1.21 -0.25 1 164 HIS 0.55 -0.22 1 165 HIS 0.15 -0.18 1 166 HIS -0.21 -0.15 1 167 HIS 0.04 -0.15 1 168 HIS 1.26 -0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 -3.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 7.28 _LACS_plot.Line_2_terminator_val_y_2 2.20 _LACS_plot.Y_axis_chem_shift_offset 0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 GLU 3.69 -3.49 0 168 HIS 1.26 4.50 0 10 ASN 2.13 -3.10 1 12 SER -1.80 -2.32 1 13 ILE -5.83 -4.22 1 15 LEU -4.03 -1.57 1 16 VAL -2.25 -0.76 1 17 ILE -6.14 -1.09 1 18 ASP -3.01 1.26 1 19 LYS 2.33 0.08 1 20 LYS 0.80 -1.27 1 22 LYS 0.03 -0.24 1 23 VAL 3.32 -0.31 1 24 ILE -0.22 -0.90 1 25 ASP -3.39 -3.63 1 26 ALA -5.09 -3.23 1 27 LYS -4.32 -1.81 1 29 LEU 2.35 -1.50 1 30 ASN -3.27 -0.05 1 31 ASN 4.11 3.11 1 32 ASP 2.97 0.40 1 33 ALA -1.03 0.12 1 34 LYS 3.60 0.37 1 36 ILE 3.89 1.73 1 37 LEU 3.98 1.09 1 38 ASP 1.42 0.56 1 39 GLU 1.34 -2.21 1 40 ALA 1.69 -1.74 1 41 ALA 4.49 -0.35 1 43 LYS 4.71 -1.65 1 44 ASP -0.03 -1.41 1 45 MET 4.15 -0.80 1 47 LEU 4.35 1.18 1 48 TYR 2.99 1.74 1 49 ASP 1.66 1.71 1 50 ALA 1.72 0.49 1 51 LEU 5.72 1.45 1 52 SER 3.68 1.47 1 53 LYS 5.81 2.29 1 54 ILE 5.67 -0.06 1 55 LEU 3.66 2.54 1 56 ASP 4.12 2.07 1 57 ILE 7.29 1.01 1 58 SER 3.75 2.94 1 59 LYS 4.41 1.15 1 60 LYS 0.15 -0.74 1 61 ASN 1.47 -1.25 1 63 TYR -1.62 -2.18 1 64 ILE -1.34 -0.97 1 65 ASN 2.28 -0.36 1 66 SER 0.55 -0.87 1 67 ALA -0.36 -0.89 1 68 ASP -0.16 -2.23 1 69 ASN -2.72 -1.82 1 70 ILE -2.12 -3.72 1 71 VAL -5.45 -3.36 1 72 LEU -6.49 -1.48 1 73 PHE -3.15 -2.07 1 74 SER -6.42 -3.74 1 75 ALA -3.90 -1.62 1 76 SER -2.35 -1.24 1 77 ILE 0.22 -0.70 1 78 ASN 0.26 0.21 1 79 SER 0.67 -0.51 1 81 ARG 0.54 -0.88 1 82 ASN 0.41 -0.36 1 83 ASN 1.55 -0.27 1 84 VAL 0.61 0.37 1 85 SER 1.12 0.18 1 86 GLU 1.35 -0.25 1 87 SER 1.21 0.24 1 88 ASP 2.28 0.98 1 89 LYS 2.18 0.02 1 91 ILE 4.99 2.38 1 92 GLN 3.85 1.91 1 93 GLU 4.37 0.79 1 94 ILE 6.56 0.34 1 95 ILE 6.82 0.90 1 97 THR 5.23 -0.47 1 98 LEU 4.59 1.88 1 99 LYS 4.47 1.63 1 100 ASP 5.25 1.37 1 101 VAL 3.18 0.94 1 102 ALA 4.30 3.84 1 103 LYS 4.29 0.93 1 104 ASP -1.50 -0.29 1 105 ALA -3.86 -0.91 1 107 VAL -0.31 -1.23 1 108 LYS -4.81 -2.44 1 109 PHE -4.66 -2.36 1 110 GLU -2.55 -1.71 1 111 ILE -2.58 -1.50 1 112 ILE -4.19 -0.20 1 114 SER -4.48 0.13 1 115 THR 2.47 1.63 1 116 GLU 3.97 2.22 1 117 GLU 4.01 0.54 1 118 ASP 5.23 1.12 1 119 ARG 4.30 1.84 1 120 GLN 3.94 1.67 1 121 LYS 5.14 2.16 1 122 ALA 3.58 4.04 1 123 LEU 3.29 0.71 1 124 ASP -0.92 -1.80 1 125 GLN 2.79 -1.94 1 126 ASN -7.05 -2.28 1 127 LEU -2.49 0.40 1 128 SER 4.74 3.32 1 129 MET 5.46 1.70 1 131 ARG 3.89 -0.27 1 132 TYR 2.56 3.04 1 133 ALA 5.20 -0.55 1 134 ILE 4.70 -0.31 1 135 TYR 5.63 2.26 1 136 VAL 3.42 0.84 1 137 LYS 4.01 1.39 1 138 ALA 5.49 4.06 1 139 VAL 3.19 1.62 1 140 GLU -0.42 -0.44 1 141 GLU -0.05 -0.94 1 143 VAL 1.96 -2.31 1 144 ASN -2.66 -3.51 1 145 LEU -1.89 -0.36 1 146 ASN 3.42 0.05 1 147 LEU 4.18 1.92 1 148 GLU 3.52 1.36 1 149 ASP 3.69 -0.26 1 150 ALA 2.60 1.04 1 151 ARG -0.42 1.71 1 152 ASN 0.24 -0.75 1 153 LEU -0.47 -0.20 1 154 SER 5.75 0.71 1 155 VAL 5.28 2.62 1 156 SER 2.34 2.65 1 157 GLU 6.66 0.51 1 158 ILE 4.44 2.69 1 159 LEU 2.45 0.94 1 161 LYS 1.20 -0.38 1 162 LEU 1.26 0.35 1 163 GLU 1.21 0.63 1 164 HIS 0.55 0.43 1 165 HIS 0.15 0.15 1 166 HIS -0.21 -0.04 1 167 HIS 0.04 -0.72 1 stop_ save_