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 bmr6241_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -2.07 _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 -1.31 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 4.45 _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 26 GLU 0.08 -1.70 0 133 LEU -1.67 -2.59 0 119 HIS -2.46 1.65 0 115 ASN -6.54 -1.38 0 179 GLN -3.78 0.90 0 10 GLU -1.55 -0.59 1 12 SER 0.88 1.16 1 13 LEU 1.94 0.70 1 15 ALA 3.89 3.90 1 16 GLN 6.03 2.98 1 17 HIS 3.61 2.41 1 19 LEU 3.16 2.73 1 20 ASN 4.70 2.78 1 21 ASN 4.83 2.91 1 22 LEU 5.62 4.22 1 23 LEU 1.03 0.60 1 24 GLN 3.20 0.31 1 27 TYR -0.85 1.67 1 28 PHE -2.18 0.99 1 29 SER -2.94 -0.70 1 31 VAL 4.46 3.55 1 32 GLU 3.45 3.76 1 33 LEU 4.41 2.53 1 34 SER 4.52 3.59 1 35 SER 4.81 3.66 1 36 ILE 4.75 4.21 1 37 ALA 3.89 3.42 1 38 HIS 4.22 3.83 1 39 GLN 3.52 2.24 1 40 LEU 3.07 2.80 1 41 ASP 4.21 3.30 1 42 GLU 2.83 2.50 1 43 GLU 3.44 2.95 1 44 GLU 3.31 2.66 1 45 ARG 5.07 3.90 1 46 MET 3.33 2.74 1 47 ARG 3.52 3.00 1 48 MET 4.28 1.59 1 49 ALA 1.51 1.04 1 50 GLU 1.06 1.05 1 53 VAL 0.53 0.10 1 54 THR -0.56 -0.50 1 55 SER 0.39 0.42 1 56 GLU 1.97 1.80 1 57 ASP 1.83 1.41 1 58 TYR 2.46 2.08 1 59 ARG 2.89 2.37 1 60 THR 3.15 2.43 1 61 PHE 2.36 1.83 1 62 LEU 0.94 0.83 1 63 GLN 0.33 0.02 1 64 GLN 0.10 -0.09 1 66 SER 0.26 0.32 1 68 ASN -0.39 1.55 1 69 MET -1.87 0.11 1 70 ASP -2.03 -0.52 1 71 ASP 1.51 1.09 1 72 SER 0.21 0.80 1 74 PHE 0.85 0.96 1 75 PHE -3.42 -0.25 1 76 SER -3.30 -1.12 1 77 ILE 2.57 1.71 1 78 GLN 5.00 3.88 1 79 VAL 5.73 4.01 1 80 ILE 5.12 2.17 1 81 SER 4.60 3.60 1 82 ASN 4.24 3.60 1 83 ALA 3.85 2.57 1 84 LEU 2.51 1.27 1 85 LYS 4.43 3.48 1 86 VAL 3.76 2.68 1 87 TRP 0.08 0.05 1 89 LEU -3.55 -2.22 1 90 GLU -6.42 -2.24 1 91 LEU -2.60 -1.43 1 92 ILE -4.30 -1.78 1 93 LEU 2.06 1.63 1 94 PHE 0.30 1.70 1 95 ASN 0.67 -0.93 1 96 SER -0.31 0.25 1 98 GLU 4.13 3.16 1 99 TYR 2.55 3.14 1 100 GLN 4.08 3.13 1 101 ARG 3.13 2.12 1 102 LEU 1.61 0.69 1 103 ARG 4.18 0.60 1 104 ILE -0.67 -0.40 1 105 ASP -1.35 -0.28 1 107 ILE 2.63 2.42 1 108 ASN 0.53 0.70 1 109 GLU 0.35 -0.14 1 110 ARG -1.15 1.22 1 111 SER -1.22 0.77 1 112 PHE -5.02 -1.69 1 113 ILE -4.27 -0.94 1 116 TYR 0.04 -0.34 1 117 LYS 6.07 2.38 1 118 GLU 2.36 1.23 1 120 TRP -4.34 -1.63 1 121 PHE -4.10 -0.44 1 122 THR -1.33 0.21 1 123 VAL -2.74 -0.92 1 124 ARG -4.07 -0.89 1 125 LYS 0.12 -0.99 1 126 LEU -2.17 -1.16 1 128 LYS -0.26 -0.25 1 129 GLN -4.89 -0.86 1 130 TRP -0.14 0.80 1 131 PHE -4.04 -0.55 1 132 ASN 0.25 -0.06 1 134 ASN 4.24 2.48 1 135 SER 2.65 1.95 1 136 LEU 0.11 0.16 1 137 LEU -2.85 -1.52 1 138 THR 2.71 1.91 1 141 GLU -5.36 -1.99 1 142 LEU 0.47 0.84 1 143 ILE -2.76 -1.69 1 144 SER 0.63 0.35 1 145 ASP 4.99 4.08 1 146 THR 2.19 1.36 1 147 TYR -3.27 -1.07 1 148 LEU 5.41 4.17 1 149 ALA 4.75 3.15 1 150 LEU 3.36 2.28 1 151 PHE 3.65 2.47 1 152 LEU 3.91 2.35 1 153 ALA 3.56 2.60 1 154 GLN 4.87 3.11 1 155 LEU 3.68 2.28 1 156 GLN 3.65 3.66 1 157 GLN 4.19 2.91 1 158 GLU 0.29 0.28 1 160 TYR 2.05 1.67 1 161 SER -0.68 -0.13 1 162 ILE -1.07 -1.28 1 163 PHE -3.97 -1.93 1 164 VAL -0.40 -0.03 1 165 VAL 1.64 -0.24 1 166 LYS -3.49 -2.19 1 168 ASP 0.77 0.19 1 169 LEU 0.57 -0.13 1 171 ASP 0.89 0.95 1 173 GLU 2.91 3.06 1 174 ALA 1.69 2.18 1 175 ASP 1.75 2.45 1 176 GLN 1.97 1.50 1 177 LEU 1.97 1.86 1 178 LEU 2.02 1.10 1 180 MET 0.04 0.25 1 181 ILE 0.53 0.32 1 182 ARG 0.66 1.58 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6241_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 4.47 _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 0.69 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 -1.61 _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 26 GLU 0.08 -1.78 0 133 LEU -1.67 -0.92 0 119 HIS -2.46 4.11 0 115 ASN -6.54 5.16 0 179 GLN -3.78 4.68 0 10 GLU -1.55 0.96 1 12 SER 0.88 0.28 1 13 LEU 1.94 -1.24 1 15 ALA 3.89 0.01 1 16 GLN 6.03 -3.05 1 17 HIS 3.61 -1.20 1 19 LEU 3.16 -0.43 1 20 ASN 4.70 -1.92 1 21 ASN 4.83 -1.92 1 22 LEU 5.62 -1.40 1 23 LEU 1.03 -0.43 1 24 GLN 3.20 -2.89 1 27 TYR -0.85 2.52 1 28 PHE -2.18 3.17 1 29 SER -2.94 2.24 1 31 VAL 4.46 -0.91 1 32 GLU 3.45 0.31 1 33 LEU 4.41 -1.88 1 34 SER 4.52 -0.93 1 35 SER 4.81 -1.15 1 36 ILE 4.75 -0.54 1 37 ALA 3.89 -0.47 1 38 HIS 4.22 -0.39 1 39 GLN 3.52 -1.28 1 40 LEU 3.07 -0.27 1 41 ASP 4.21 -0.91 1 42 GLU 2.83 -0.33 1 43 GLU 3.44 -0.49 1 44 GLU 3.31 -0.65 1 45 ARG 5.07 -1.17 1 46 MET 3.33 -0.59 1 47 ARG 3.52 -0.52 1 48 MET 4.28 -2.69 1 49 ALA 1.51 -0.47 1 50 GLU 1.06 -0.01 1 53 VAL 0.53 -0.43 1 54 THR -0.56 0.06 1 55 SER 0.39 0.03 1 56 GLU 1.97 -0.17 1 57 ASP 1.83 -0.42 1 58 TYR 2.46 -0.38 1 59 ARG 2.89 -0.52 1 60 THR 3.15 -0.72 1 61 PHE 2.36 -0.53 1 62 LEU 0.94 -0.11 1 63 GLN 0.33 -0.31 1 64 GLN 0.10 -0.19 1 66 SER 0.26 0.06 1 68 ASN -0.39 1.94 1 69 MET -1.87 1.98 1 70 ASP -2.03 1.51 1 71 ASP 1.51 -0.42 1 72 SER 0.21 0.59 1 74 PHE 0.85 0.11 1 75 PHE -3.42 3.17 1 76 SER -3.30 2.18 1 77 ILE 2.57 -0.86 1 78 GLN 5.00 -1.12 1 79 VAL 5.73 -1.72 1 80 ILE 5.12 -2.95 1 81 SER 4.60 -1.00 1 82 ASN 4.24 -0.64 1 83 ALA 3.85 -1.28 1 84 LEU 2.51 -1.24 1 85 LYS 4.43 -0.95 1 86 VAL 3.76 -1.08 1 87 TRP 0.08 -0.03 1 89 LEU -3.55 1.33 1 90 GLU -6.42 4.18 1 91 LEU -2.60 1.17 1 92 ILE -4.30 2.52 1 93 LEU 2.06 -0.43 1 94 PHE 0.30 1.40 1 95 ASN 0.67 -1.60 1 96 SER -0.31 0.56 1 98 GLU 4.13 -0.97 1 99 TYR 2.55 0.59 1 100 GLN 4.08 -0.95 1 101 ARG 3.13 -1.01 1 102 LEU 1.61 -0.92 1 103 ARG 4.18 -3.58 1 104 ILE -0.67 0.27 1 105 ASP -1.35 1.07 1 107 ILE 2.63 -0.21 1 108 ASN 0.53 0.17 1 109 GLU 0.35 -0.49 1 110 ARG -1.15 2.37 1 111 SER -1.22 1.99 1 112 PHE -5.02 3.33 1 113 ILE -4.27 3.33 1 116 TYR 0.04 -0.38 1 117 LYS 6.07 -3.69 1 118 GLU 2.36 -1.13 1 120 TRP -4.34 2.71 1 121 PHE -4.10 3.66 1 122 THR -1.33 1.54 1 123 VAL -2.74 1.82 1 124 ARG -4.07 3.18 1 125 LYS 0.12 -1.11 1 126 LEU -2.17 1.01 1 128 LYS -0.26 0.01 1 129 GLN -4.89 4.03 1 130 TRP -0.14 0.94 1 131 PHE -4.04 3.49 1 132 ASN 0.25 -0.31 1 134 ASN 4.24 -1.76 1 135 SER 2.65 -0.70 1 136 LEU 0.11 0.05 1 137 LEU -2.85 1.33 1 138 THR 2.71 -0.80 1 141 GLU -5.36 3.37 1 142 LEU 0.47 0.37 1 143 ILE -2.76 1.07 1 144 SER 0.63 -0.28 1 145 ASP 4.99 -0.91 1 146 THR 2.19 -0.83 1 147 TYR -3.27 2.20 1 148 LEU 5.41 -1.24 1 149 ALA 4.75 -1.60 1 150 LEU 3.36 -1.08 1 151 PHE 3.65 -1.18 1 152 LEU 3.91 -1.56 1 153 ALA 3.56 -0.96 1 154 GLN 4.87 -1.76 1 155 LEU 3.68 -1.40 1 156 GLN 3.65 0.01 1 157 GLN 4.19 -1.28 1 158 GLU 0.29 -0.01 1 160 TYR 2.05 -0.38 1 161 SER -0.68 0.55 1 162 ILE -1.07 -0.21 1 163 PHE -3.97 2.04 1 164 VAL -0.40 0.37 1 165 VAL 1.64 -1.88 1 166 LYS -3.49 1.30 1 168 ASP 0.77 -0.58 1 169 LEU 0.57 -0.70 1 171 ASP 0.89 0.06 1 173 GLU 2.91 0.15 1 174 ALA 1.69 0.49 1 175 ASP 1.75 0.70 1 176 GLN 1.97 -0.47 1 177 LEU 1.97 -0.11 1 178 LEU 2.02 -0.92 1 180 MET 0.04 0.21 1 181 ILE 0.53 -0.21 1 182 ARG 0.66 0.92 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6241_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 0.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _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 123 VAL -2.74 1.02 0 80 ILE 5.12 -1.17 0 124 ARG -4.07 1.08 0 90 GLU -6.42 0.17 0 10 GLU -1.55 0.15 1 12 SER 0.88 0.02 1 13 LEU 1.94 0.36 1 15 ALA 3.89 -0.64 1 16 GLN 6.03 -0.77 1 17 HIS 3.61 0.12 1 19 LEU 3.16 -0.53 1 20 ASN 4.70 0.27 1 21 ASN 4.83 0.18 1 22 LEU 5.62 -0.30 1 23 LEU 1.03 -0.50 1 24 GLN 3.20 -0.84 1 26 GLU 0.08 -0.26 1 27 TYR -0.85 -0.14 1 28 PHE -2.18 0.13 1 29 SER -2.94 0.24 1 31 VAL 4.46 -0.32 1 32 GLU 3.45 -0.14 1 33 LEU 4.41 -0.51 1 34 SER 4.52 0.02 1 35 SER 4.81 -0.12 1 36 ILE 4.75 -0.38 1 37 ALA 3.89 -0.47 1 38 HIS 4.22 -0.21 1 39 GLN 3.52 -0.25 1 40 LEU 3.07 -0.25 1 41 ASP 4.21 -0.17 1 42 GLU 2.83 -0.25 1 43 GLU 3.44 -0.31 1 44 GLU 3.31 -0.22 1 45 ARG 5.07 -0.40 1 46 MET 3.33 -0.28 1 47 ARG 3.52 -0.20 1 48 MET 4.28 -0.20 1 49 ALA 1.51 -0.29 1 50 GLU 1.06 -0.17 1 53 VAL 0.53 0.01 1 54 THR -0.56 0.12 1 55 SER 0.39 -0.05 1 56 GLU 1.97 -0.17 1 57 ASP 1.83 -0.15 1 58 TYR 2.46 -0.22 1 59 ARG 2.89 -0.33 1 60 THR 3.15 -0.28 1 61 PHE 2.36 -0.18 1 62 LEU 0.94 -0.31 1 63 GLN 0.33 -0.10 1 64 GLN 0.10 -0.10 1 66 SER 0.26 -0.13 1 68 ASN -0.39 0.05 1 69 MET -1.87 0.37 1 70 ASP -2.03 0.13 1 71 ASP 1.51 -0.03 1 72 SER 0.21 0.02 1 74 PHE 0.85 -0.12 1 75 PHE -3.42 0.15 1 76 SER -3.30 0.02 1 77 ILE 2.57 -0.28 1 78 GLN 5.00 -0.35 1 79 VAL 5.73 -0.75 1 81 SER 4.60 -0.64 1 82 ASN 4.24 -0.41 1 83 ALA 3.85 -0.23 1 84 LEU 2.51 -0.05 1 85 LYS 4.43 -0.09 1 86 VAL 3.76 -0.37 1 87 TRP 0.08 -0.39 1 89 LEU -3.55 0.82 1 91 LEU -2.60 0.91 1 92 ILE -4.30 0.37 1 93 LEU 2.06 -0.09 1 94 PHE 0.30 -0.65 1 95 ASN 0.67 -0.16 1 96 SER -0.31 -0.07 1 98 GLU 4.13 -0.40 1 99 TYR 2.55 -0.24 1 100 GLN 4.08 -0.60 1 101 ARG 3.13 -0.27 1 102 LEU 1.61 -0.35 1 103 ARG 4.18 -0.61 1 104 ILE -0.67 -0.27 1 105 ASP -1.35 -0.13 1 107 ILE 2.63 -0.10 1 108 ASN 0.53 0.24 1 109 GLU 0.35 0.49 1 110 ARG -1.15 0.12 1 111 SER -1.22 0.76 1 112 PHE -5.02 1.01 1 113 ILE -4.27 0.96 1 115 ASN -6.54 0.76 1 116 TYR 0.04 -0.33 1 117 LYS 6.07 -0.88 1 118 GLU 2.36 0.06 1 119 HIS -2.46 0.46 1 120 TRP -4.34 1.05 1 121 PHE -4.10 0.35 1 122 THR -1.33 0.13 1 125 LYS 0.12 0.01 1 126 LEU -2.17 0.31 1 128 LYS -0.26 0.01 1 129 GLN -4.89 0.34 1 130 TRP -0.14 -0.22 1 131 PHE -4.04 0.59 1 132 ASN 0.25 0.16 1 133 LEU -1.67 0.42 1 134 ASN 4.24 0.02 1 135 SER 2.65 0.30 1 136 LEU 0.11 0.11 1 137 LEU -2.85 0.21 1 138 THR 2.71 -0.30 1 141 GLU -5.36 0.50 1 142 LEU 0.47 -0.36 1 143 ILE -2.76 -0.03 1 144 SER 0.63 -0.11 1 145 ASP 4.99 -0.28 1 146 THR 2.19 -0.20 1 147 TYR -3.27 0.27 1 148 LEU 5.41 -0.83 1 149 ALA 4.75 -0.65 1 150 LEU 3.36 -0.33 1 151 PHE 3.65 -0.66 1 152 LEU 3.91 -0.95 1 153 ALA 3.56 -0.23 1 154 GLN 4.87 -0.43 1 155 LEU 3.68 -0.57 1 156 GLN 3.65 0.08 1 157 GLN 4.19 -0.29 1 158 GLU 0.29 -0.15 1 160 TYR 2.05 -0.11 1 161 SER -0.68 0.13 1 162 ILE -1.07 0.32 1 163 PHE -3.97 0.65 1 164 VAL -0.40 0.01 1 165 VAL 1.64 0.43 1 166 LYS -3.49 0.45 1 168 ASP 0.77 -0.02 1 169 LEU 0.57 -0.32 1 171 ASP 0.89 0.01 1 173 GLU 2.91 -0.27 1 174 ALA 1.69 -0.21 1 175 ASP 1.75 -0.20 1 176 GLN 1.97 -0.11 1 177 LEU 1.97 -0.11 1 178 LEU 2.02 -0.05 1 179 GLN -3.78 -0.05 1 180 MET 0.04 -0.02 1 181 ILE 0.53 0.01 1 182 ARG 0.66 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6241_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -2.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.74 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 2.13 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 GLU -6.42 -2.80 0 148 LEU 5.41 -0.98 0 115 ASN -6.54 -2.56 0 121 PHE -4.10 -4.04 0 24 GLN 3.20 -2.34 0 22 LEU 5.62 -1.00 0 177 LEU 1.97 -3.02 0 117 LYS 6.07 -0.90 0 10 GLU -1.55 -0.30 1 12 SER 0.88 0.12 1 13 LEU 1.94 -1.16 1 15 ALA 3.89 -0.07 1 16 GLN 6.03 -0.24 1 17 HIS 3.61 2.20 1 19 LEU 3.16 0.23 1 20 ASN 4.70 3.00 1 23 LEU 1.03 -1.08 1 26 GLU 0.08 -1.15 1 27 TYR -0.85 0.23 1 28 PHE -2.18 -1.30 1 32 GLU 3.45 2.90 1 33 LEU 4.41 0.55 1 34 SER 4.52 2.17 1 35 SER 4.81 2.82 1 36 ILE 4.75 1.67 1 37 ALA 3.89 1.00 1 38 HIS 4.22 3.34 1 39 GLN 3.52 2.65 1 40 LEU 3.07 2.53 1 41 ASP 4.21 2.64 1 42 GLU 2.83 2.10 1 43 GLU 3.44 2.91 1 45 ARG 5.07 2.89 1 46 MET 3.33 2.26 1 47 ARG 3.52 2.96 1 48 MET 4.28 -0.41 1 49 ALA 1.51 1.29 1 50 GLU 1.06 1.03 1 53 VAL 0.53 0.10 1 54 THR -0.56 0.15 1 55 SER 0.39 0.73 1 56 GLU 1.97 0.86 1 57 ASP 1.83 1.17 1 59 ARG 2.89 1.82 1 60 THR 3.15 0.92 1 61 PHE 2.36 0.91 1 62 LEU 0.94 -0.18 1 63 GLN 0.33 -0.19 1 66 SER 0.26 1.24 1 68 ASN -0.39 -1.37 1 69 MET -1.87 -1.60 1 70 ASP -2.03 0.08 1 71 ASP 1.51 0.75 1 72 SER 0.21 -0.04 1 74 PHE 0.85 -1.15 1 75 PHE -3.42 -1.32 1 76 SER -3.30 0.78 1 77 ILE 2.57 0.65 1 78 GLN 5.00 2.66 1 79 VAL 5.73 0.32 1 80 ILE 5.12 1.18 1 81 SER 4.60 3.16 1 82 ASN 4.24 2.53 1 83 ALA 3.85 1.44 1 84 LEU 2.51 1.93 1 85 LYS 4.43 3.92 1 86 VAL 3.76 0.29 1 87 TRP 0.08 -0.48 1 89 LEU -3.55 -1.73 1 91 LEU -2.60 -0.70 1 92 ILE -4.30 -0.73 1 93 LEU 2.06 0.13 1 95 ASN 0.67 -0.09 1 98 GLU 4.13 1.23 1 99 TYR 2.55 3.34 1 102 LEU 1.61 -0.70 1 103 ARG 4.18 -0.97 1 104 ILE -0.67 0.89 1 108 ASN 0.53 2.12 1 109 GLU 0.35 -3.02 1 110 ARG -1.15 0.71 1 111 SER -1.22 -3.44 1 112 PHE -5.02 -0.27 1 113 ILE -4.27 -1.73 1 116 TYR 0.04 0.91 1 118 GLU 2.36 -1.30 1 119 HIS -2.46 0.74 1 120 TRP -4.34 0.03 1 122 THR -1.33 -2.23 1 124 ARG -4.07 -3.79 1 125 LYS 0.12 0.31 1 126 LEU -2.17 -1.59 1 128 LYS -0.26 -0.69 1 129 GLN -4.89 -2.97 1 130 TRP -0.14 -0.80 1 131 PHE -4.04 -0.93 1 132 ASN 0.25 0.35 1 133 LEU -1.67 1.28 1 134 ASN 4.24 3.09 1 135 SER 2.65 0.15 1 136 LEU 0.11 -0.09 1 137 LEU -2.85 0.08 1 138 THR 2.71 0.12 1 141 GLU -5.36 -1.60 1 142 LEU 0.47 -1.04 1 143 ILE -2.76 -1.72 1 144 SER 0.63 1.26 1 145 ASP 4.99 2.14 1 146 THR 2.19 0.10 1 147 TYR -3.27 -0.59 1 149 ALA 4.75 2.53 1 150 LEU 3.36 0.89 1 151 PHE 3.65 1.66 1 152 LEU 3.91 1.27 1 153 ALA 3.56 3.11 1 154 GLN 4.87 2.77 1 155 LEU 3.68 2.71 1 157 GLN 4.19 1.73 1 158 GLU 0.29 -0.74 1 160 TYR 2.05 1.49 1 161 SER -0.68 -2.13 1 162 ILE -1.07 -2.99 1 163 PHE -3.97 -0.25 1 164 VAL -0.40 -0.90 1 165 VAL 1.64 -0.44 1 166 LYS -3.49 -1.35 1 168 ASP 0.77 -1.10 1 171 ASP 0.89 -0.56 1 173 GLU 2.91 1.98 1 174 ALA 1.69 0.37 1 175 ASP 1.75 1.00 1 179 GLN -3.78 -0.07 1 180 MET 0.04 1.43 1 181 ILE 0.53 -1.24 1 stop_ save_