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 bmr18934_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.67 _LACS_plot.Line_1_terminator_val_y_1 -5.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.13 _LACS_plot.Line_2_terminator_val_x_2 9.67 _LACS_plot.Line_2_terminator_val_y_2 4.12 _LACS_plot.Y_axis_chem_shift_offset 2.76 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 ILE 0.30 -5.64 0 114 PHE 1.41 2.42 0 10 ILE 6.08 1.61 1 11 VAL 7.77 3.23 1 12 ASN 3.89 0.66 1 13 HIS 1.49 1.82 1 14 LEU 2.26 -0.67 1 15 ARG 5.07 1.49 1 16 SER -1.26 -3.52 1 17 ARG -1.16 -1.91 1 18 LEU -2.09 -2.71 1 19 ALA -6.06 -3.95 1 20 PHE -4.45 -4.28 1 21 GLU -3.04 -3.98 1 22 TYR -4.15 -4.60 1 23 ASN 2.31 -2.41 1 25 GLN -4.27 -4.78 1 26 LEU -0.23 -3.38 1 27 ILE 0.79 -4.06 1 28 LYS 1.45 -1.65 1 29 ILE 0.43 -3.15 1 30 LEU 0.26 -2.82 1 31 SER 4.35 0.67 1 32 LYS 3.39 -1.20 1 33 ASN -0.64 -3.42 1 34 ILE -1.44 -2.93 1 35 VAL -4.56 -4.47 1 36 ALA 0.71 -2.15 1 37 VAL -2.45 -5.05 1 39 SER 3.74 -0.01 1 40 LEU 4.01 1.60 1 41 ARG 4.50 0.25 1 42 ARG 2.14 -1.22 1 43 GLU 4.25 -2.28 1 44 GLU 1.99 -1.71 1 45 LYS 3.60 0.95 1 46 MET -4.40 -5.73 1 47 LEU -4.54 -5.60 1 48 ASN 3.14 -0.02 1 49 ASP -3.01 -5.31 1 50 VAL 0.24 -2.21 1 51 ASP -3.25 -3.61 1 52 LEU -5.57 -4.40 1 53 LEU -5.01 -4.51 1 54 ILE -2.83 -4.62 1 56 VAL -1.30 -3.22 1 58 GLU -4.50 -4.61 1 59 LYS 4.76 1.22 1 60 LYS 3.85 -0.36 1 61 LEU 0.33 -2.67 1 62 LEU 4.94 1.62 1 63 LYS 3.17 -1.04 1 64 HIS -2.89 -1.43 1 65 VAL 6.26 1.56 1 66 LEU 9.68 2.75 1 68 ASN -3.95 -4.50 1 69 ILE -1.68 -3.90 1 70 ARG -4.92 -5.14 1 71 ILE -1.23 -3.68 1 72 LYS 2.05 -1.27 1 74 LEU -3.84 -3.79 1 75 SER 0.07 -2.68 1 76 PHE -5.20 -4.58 1 77 SER -4.24 -4.73 1 78 VAL 0.62 -2.28 1 79 LYS 0.92 -2.17 1 80 VAL -2.80 -3.64 1 83 GLU 1.85 0.15 1 84 ARG -3.12 -4.69 1 85 LYS -2.93 -3.30 1 87 VAL -1.42 -3.18 1 88 LEU -5.23 -4.93 1 89 PHE -2.01 -4.58 1 90 ILE -4.62 -4.80 1 91 GLU -2.46 -4.38 1 92 TRP -2.75 -3.69 1 93 GLU 3.66 -2.12 1 94 LYS 5.22 -1.04 1 95 LYS -3.85 -4.22 1 96 THR -0.61 -3.02 1 97 TYR -5.51 -4.55 1 98 GLN -1.38 -2.81 1 99 LEU -5.67 -4.92 1 100 ASP -3.59 -4.70 1 101 LEU -5.21 -5.60 1 102 PHE -5.41 -5.48 1 103 THR -5.61 -6.19 1 104 ALA -6.67 -4.82 1 105 LEU -2.04 -4.24 1 106 ALA 5.12 1.53 1 107 GLU 3.43 -0.31 1 108 GLU -1.78 -3.93 1 109 LYS 4.00 -1.16 1 111 TYR 2.85 0.17 1 112 ALA 6.26 3.12 1 113 ILE 3.63 1.75 1 115 HIS 4.10 -0.50 1 116 PHE 6.88 2.42 1 117 THR 7.18 2.70 1 120 VAL 5.74 0.49 1 121 SER 0.61 -1.38 1 122 TYR 4.05 -0.40 1 123 LEU 5.34 1.77 1 124 ILE 4.58 0.97 1 125 ARG 3.99 -1.18 1 126 ILE 5.04 1.66 1 127 ARG 3.98 -0.06 1 128 ALA 3.32 -0.27 1 129 ALA 3.39 -0.39 1 130 LEU 4.09 0.55 1 131 LYS 3.40 -0.14 1 132 LYS -1.12 -3.76 1 133 LYS 3.70 -1.11 1 134 ASN -5.51 -4.55 1 135 TYR -3.83 -3.75 1 136 LYS -6.14 -4.47 1 137 LEU 0.08 -3.37 1 138 ASN 4.51 -1.22 1 139 GLN -0.07 -3.42 1 140 TYR -5.22 -4.92 1 142 LEU -4.96 -4.13 1 143 PHE -2.03 -3.53 1 144 LYS 4.44 0.12 1 145 ASN 3.00 -1.38 1 146 GLN -0.85 -2.57 1 147 THR 0.44 -1.98 1 148 LEU -0.01 -2.83 1 149 VAL -3.63 -3.55 1 151 LEU 1.65 -3.86 1 152 LYS -5.98 -4.80 1 153 ILE -0.83 -2.10 1 154 THR -6.15 -5.28 1 155 THR 3.19 0.16 1 156 GLU 5.01 1.68 1 157 LYS 2.08 -0.30 1 158 GLU 4.76 0.74 1 159 LEU 4.68 1.77 1 160 ILE 4.09 0.32 1 161 LYS 2.97 -0.77 1 162 GLU 0.44 -2.43 1 163 LEU -3.36 -4.34 1 165 PHE 1.00 -1.65 1 166 THR 3.70 0.21 1 167 TYR -5.39 -6.05 1 168 ARG 5.37 -0.37 1 169 ILE 2.06 -1.03 1 171 LYS -1.35 -4.44 1 172 LYS 2.77 -1.29 1 173 ARG -0.92 -0.62 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18934_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.67 _LACS_plot.Line_1_terminator_val_y_1 1.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -4.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.13 _LACS_plot.Line_2_terminator_val_x_2 9.67 _LACS_plot.Line_2_terminator_val_y_2 -5.55 _LACS_plot.Y_axis_chem_shift_offset 2.76 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 ILE 0.30 -5.94 0 114 PHE 1.41 1.01 0 10 ILE 6.08 -4.47 1 11 VAL 7.77 -4.54 1 12 ASN 3.89 -3.23 1 13 HIS 1.49 0.33 1 14 LEU 2.26 -2.93 1 15 ARG 5.07 -3.58 1 16 SER -1.26 -2.26 1 17 ARG -1.16 -0.75 1 18 LEU -2.09 -0.62 1 19 ALA -6.06 2.11 1 20 PHE -4.45 0.17 1 21 GLU -3.04 -0.94 1 22 TYR -4.15 -0.45 1 23 ASN 2.31 -4.72 1 25 GLN -4.27 -0.51 1 26 LEU -0.23 -3.15 1 27 ILE 0.79 -4.85 1 28 LYS 1.45 -3.10 1 29 ILE 0.43 -3.58 1 30 LEU 0.26 -3.08 1 31 SER 4.35 -3.68 1 32 LYS 3.39 -4.59 1 33 ASN -0.64 -2.78 1 34 ILE -1.44 -1.49 1 35 VAL -4.56 0.09 1 36 ALA 0.71 -2.86 1 37 VAL -2.45 -2.60 1 39 SER 3.74 -3.75 1 40 LEU 4.01 -2.41 1 41 ARG 4.50 -4.25 1 42 ARG 2.14 -3.36 1 43 GLU 4.25 -6.53 1 44 GLU 1.99 -3.70 1 45 LYS 3.60 -2.65 1 46 MET -4.40 -1.33 1 47 LEU -4.54 -1.06 1 48 ASN 3.14 -3.16 1 49 ASP -3.01 -2.30 1 50 VAL 0.24 -2.45 1 51 ASP -3.25 -0.36 1 52 LEU -5.57 1.17 1 53 LEU -5.01 0.50 1 54 ILE -2.83 -1.79 1 56 VAL -1.30 -1.92 1 58 GLU -4.50 -0.11 1 59 LYS 4.76 -3.54 1 60 LYS 3.85 -4.21 1 61 LEU 0.33 -3.00 1 62 LEU 4.94 -3.32 1 63 LYS 3.17 -4.21 1 64 HIS -2.89 1.46 1 65 VAL 6.26 -4.70 1 66 LEU 9.68 -6.93 1 68 ASN -3.95 -0.55 1 69 ILE -1.68 -2.22 1 70 ARG -4.92 -0.22 1 71 ILE -1.23 -2.45 1 72 LYS 2.05 -3.32 1 74 LEU -3.84 0.05 1 75 SER 0.07 -2.75 1 76 PHE -5.20 0.62 1 77 SER -4.24 -0.49 1 78 VAL 0.62 -2.90 1 79 LYS 0.92 -3.09 1 80 VAL -2.80 -0.84 1 83 GLU 1.85 -1.70 1 84 ARG -3.12 -1.57 1 85 LYS -2.93 -0.37 1 87 VAL -1.42 -1.76 1 88 LEU -5.23 0.30 1 89 PHE -2.01 -2.57 1 90 ILE -4.62 -0.18 1 91 GLU -2.46 -1.92 1 92 TRP -2.75 -0.94 1 93 GLU 3.66 -5.78 1 94 LYS 5.22 -6.26 1 95 LYS -3.85 -0.37 1 96 THR -0.61 -2.41 1 97 TYR -5.51 0.96 1 98 GLN -1.38 -1.43 1 99 LEU -5.67 0.75 1 100 ASP -3.59 -1.11 1 101 LEU -5.21 -0.39 1 102 PHE -5.41 -0.07 1 103 THR -5.61 -0.58 1 104 ALA -6.67 1.85 1 105 LEU -2.04 -2.20 1 106 ALA 5.12 -3.59 1 107 GLU 3.43 -3.74 1 108 GLU -1.78 -2.15 1 109 LYS 4.00 -5.16 1 111 TYR 2.85 -2.68 1 112 ALA 6.26 -3.14 1 113 ILE 3.63 -1.88 1 115 HIS 4.10 -4.60 1 116 PHE 6.88 -4.46 1 117 THR 7.18 -4.48 1 120 VAL 5.74 -5.25 1 121 SER 0.61 -1.99 1 122 TYR 4.05 -4.45 1 123 LEU 5.34 -3.57 1 124 ILE 4.58 -3.61 1 125 ARG 3.99 -5.17 1 126 ILE 5.04 -3.38 1 127 ARG 3.98 -4.04 1 128 ALA 3.32 -3.59 1 129 ALA 3.39 -3.78 1 130 LEU 4.09 -3.54 1 131 LYS 3.40 -3.54 1 132 LYS -1.12 -2.64 1 133 LYS 3.70 -4.81 1 134 ASN -5.51 0.96 1 135 TYR -3.83 0.08 1 136 LYS -6.14 1.67 1 137 LEU 0.08 -3.45 1 138 ASN 4.51 -5.73 1 139 GLN -0.07 -3.35 1 140 TYR -5.22 0.30 1 142 LEU -4.96 0.83 1 143 PHE -2.03 -1.50 1 144 LYS 4.44 -4.32 1 145 ASN 3.00 -4.38 1 146 GLN -0.85 -1.72 1 147 THR 0.44 -2.42 1 148 LEU -0.01 -2.82 1 149 VAL -3.63 0.08 1 151 LEU 1.65 -5.51 1 152 LYS -5.98 1.18 1 153 ILE -0.83 -1.27 1 154 THR -6.15 0.87 1 155 THR 3.19 -3.03 1 156 GLU 5.01 -3.33 1 157 LYS 2.08 -2.38 1 158 GLU 4.76 -4.02 1 159 LEU 4.68 -2.91 1 160 ILE 4.09 -3.77 1 161 LYS 2.97 -3.74 1 162 GLU 0.44 -2.87 1 163 LEU -3.36 -0.98 1 165 PHE 1.00 -2.65 1 166 THR 3.70 -3.49 1 167 TYR -5.39 -0.66 1 168 ARG 5.37 -5.74 1 169 ILE 2.06 -3.09 1 171 LYS -1.35 -3.09 1 172 LYS 2.77 -4.06 1 173 ARG -0.92 0.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18934_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.67 _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 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 9.67 _LACS_plot.Line_2_terminator_val_y_2 -1.11 _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 10 ILE 6.08 -1.41 0 116 PHE 6.88 -0.04 0 66 LEU 9.68 -0.54 0 11 VAL 7.77 -0.95 1 12 ASN 3.89 -0.45 1 13 HIS 1.49 -0.50 1 14 LEU 2.26 -0.55 1 15 ARG 5.07 -0.50 1 16 SER -1.26 0.34 1 17 ARG -1.16 0.15 1 18 LEU -2.09 0.61 1 19 ALA -6.06 0.72 1 20 PHE -4.45 0.86 1 21 GLU -3.04 0.56 1 22 TYR -4.15 0.19 1 23 ASN 2.31 -0.70 1 25 GLN -4.27 0.16 1 26 LEU -0.23 0.05 1 27 ILE 0.79 -0.24 1 28 LYS 1.45 -0.26 1 29 ILE 0.43 0.01 1 30 LEU 0.26 -0.08 1 31 SER 4.35 -0.33 1 32 LYS 3.39 -0.10 1 33 ASN -0.64 0.17 1 34 ILE -1.44 0.62 1 35 VAL -4.56 0.23 1 36 ALA 0.71 0.25 1 37 VAL -2.45 0.44 1 39 SER 3.74 -0.20 1 40 LEU 4.01 -0.27 1 41 ARG 4.50 -0.39 1 42 ARG 2.14 -0.71 1 43 GLU 4.25 -0.71 1 44 GLU 1.99 -0.23 1 45 LYS 3.60 -0.48 1 46 MET -4.40 0.63 1 47 LEU -4.54 0.42 1 48 ASN 3.14 -0.21 1 49 ASP -3.01 -0.39 1 50 VAL 0.24 -0.05 1 51 ASP -3.25 0.81 1 52 LEU -5.57 0.45 1 53 LEU -5.01 0.46 1 54 ILE -2.83 0.64 1 55 ILE 0.30 0.51 1 56 VAL -1.30 -0.15 1 58 GLU -4.50 0.38 1 59 LYS 4.76 -0.48 1 60 LYS 3.85 -0.14 1 61 LEU 0.33 -0.16 1 62 LEU 4.94 -0.58 1 63 LYS 3.17 -0.40 1 64 HIS -2.89 -0.26 1 65 VAL 6.26 -1.22 1 68 ASN -3.95 0.51 1 69 ILE -1.68 0.37 1 70 ARG -4.92 0.41 1 71 ILE -1.23 0.46 1 72 LYS 2.05 -0.11 1 74 LEU -3.84 0.59 1 75 SER 0.07 0.21 1 76 PHE -5.20 1.09 1 77 SER -4.24 0.27 1 78 VAL 0.62 0.12 1 79 LYS 0.92 0.08 1 80 VAL -2.80 0.14 1 83 GLU 1.85 -0.38 1 84 ARG -3.12 0.51 1 85 LYS -2.93 0.88 1 87 VAL -1.42 0.59 1 88 LEU -5.23 0.98 1 89 PHE -2.01 0.99 1 90 ILE -4.62 0.96 1 91 GLU -2.46 0.81 1 92 TRP -2.75 0.19 1 93 GLU 3.66 -0.88 1 94 LYS 5.22 -0.62 1 95 LYS -3.85 0.24 1 96 THR -0.61 0.90 1 97 TYR -5.51 0.21 1 98 GLN -1.38 0.32 1 99 LEU -5.67 0.62 1 100 ASP -3.59 0.47 1 101 LEU -5.21 0.85 1 102 PHE -5.41 0.70 1 103 THR -5.61 1.30 1 104 ALA -6.67 0.25 1 105 LEU -2.04 0.59 1 106 ALA 5.12 -0.49 1 107 GLU 3.43 -0.09 1 108 GLU -1.78 0.16 1 109 LYS 4.00 -0.72 1 111 TYR 2.85 -0.42 1 112 ALA 6.26 -0.84 1 113 ILE 3.63 -0.07 1 114 PHE 1.41 -0.81 1 115 HIS 4.10 -0.18 1 117 THR 7.18 -1.10 1 120 VAL 5.74 -0.66 1 121 SER 0.61 -0.37 1 122 TYR 4.05 -0.83 1 123 LEU 5.34 -0.67 1 124 ILE 4.58 -0.24 1 125 ARG 3.99 -0.76 1 126 ILE 5.04 -0.43 1 127 ARG 3.98 -0.14 1 128 ALA 3.32 -0.06 1 129 ALA 3.39 -0.13 1 130 LEU 4.09 -0.05 1 131 LYS 3.40 -0.16 1 132 LYS -1.12 0.10 1 133 LYS 3.70 -0.40 1 134 ASN -5.51 1.16 1 135 TYR -3.83 0.32 1 136 LYS -6.14 1.03 1 137 LEU 0.08 0.01 1 138 ASN 4.51 -0.80 1 139 GLN -0.07 -0.04 1 140 TYR -5.22 0.61 1 142 LEU -4.96 0.48 1 143 PHE -2.03 0.36 1 144 LYS 4.44 -0.49 1 145 ASN 3.00 -0.35 1 146 GLN -0.85 0.21 1 147 THR 0.44 -0.69 1 148 LEU -0.01 -0.22 1 149 VAL -3.63 0.05 1 151 LEU 1.65 0.18 1 152 LYS -5.98 0.41 1 153 ILE -0.83 0.19 1 154 THR -6.15 0.55 1 155 THR 3.19 -0.59 1 156 GLU 5.01 -0.53 1 157 LYS 2.08 -0.50 1 158 GLU 4.76 -0.70 1 159 LEU 4.68 -0.99 1 160 ILE 4.09 -0.11 1 161 LYS 2.97 -0.39 1 162 GLU 0.44 -0.39 1 163 LEU -3.36 0.24 1 165 PHE 1.00 -0.21 1 166 THR 3.70 -0.51 1 167 TYR -5.39 0.13 1 168 ARG 5.37 -0.32 1 169 ILE 2.06 -0.03 1 171 LYS -1.35 0.00 1 172 LYS 2.77 -0.94 1 173 ARG -0.92 -0.35 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18934_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.67 _LACS_plot.Line_1_terminator_val_y_1 -5.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.75 _LACS_plot.Line_2_terminator_val_x_2 9.67 _LACS_plot.Line_2_terminator_val_y_2 -0.09 _LACS_plot.Y_axis_chem_shift_offset 3.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 HIS -2.89 -0.48 0 99 LEU -5.67 -7.70 0 160 ILE 4.09 1.61 0 139 GLN -5.22 -7.74 0 42 ARG 2.14 -6.29 0 173 ARG -0.92 0.63 0 66 LEU 9.68 -0.60 0 172 LYS 2.77 -6.21 0 10 ILE 6.08 -1.32 1 11 VAL 7.77 -1.89 1 13 HIS 1.49 0.98 1 14 LEU 2.26 -1.20 1 15 ARG 5.07 -2.81 1 16 SER -1.26 -1.17 1 17 ARG -1.16 -0.68 1 18 LEU -2.09 -4.02 1 19 ALA -6.06 -6.71 1 20 PHE -4.45 -6.00 1 21 GLU -3.04 -4.55 1 22 TYR -4.15 -3.83 1 23 ASN 2.31 -2.52 1 25 GLN -4.27 -5.06 1 26 LEU -0.23 -4.44 1 27 ILE 0.79 -3.99 1 28 LYS 1.45 -2.65 1 29 ILE 0.43 -3.33 1 32 LYS 3.39 -3.21 1 33 ASN -0.64 -1.88 1 34 ILE -1.44 -3.53 1 35 VAL -4.56 -3.91 1 36 ALA 0.71 -3.76 1 37 VAL -2.45 -4.06 1 40 LEU 4.01 0.61 1 41 ARG 4.50 -2.05 1 43 GLU 4.25 -3.44 1 44 GLU 1.99 -4.48 1 45 LYS 3.60 -1.73 1 46 MET -4.40 -4.94 1 47 LEU -4.54 -6.24 1 48 ASN 3.14 -4.09 1 50 VAL 0.24 -6.21 1 52 LEU -5.57 -7.30 1 54 ILE -2.83 -4.14 1 55 ILE 0.30 -3.53 1 58 GLU -4.50 -3.42 1 59 LYS 4.76 -0.30 1 60 LYS 3.85 -2.38 1 61 LEU 0.33 -1.91 1 63 LYS 3.17 -3.92 1 65 VAL 6.26 -2.70 1 69 ILE -1.68 -4.89 1 70 ARG -4.92 -4.50 1 71 ILE -1.23 -3.60 1 72 LYS 2.05 -1.73 1 74 LEU -3.84 -4.57 1 75 SER 0.07 -4.24 1 76 PHE -5.20 -5.08 1 78 VAL 0.62 -2.97 1 79 LYS 0.92 -2.90 1 83 GLU 1.85 -0.66 1 84 ARG -3.12 -2.87 1 85 LYS -2.93 -4.57 1 87 VAL -1.42 -4.44 1 88 LEU -5.23 -4.61 1 89 PHE -2.01 -1.58 1 90 ILE -4.62 -5.50 1 91 GLU -2.46 -3.73 1 92 TRP -2.75 -3.86 1 93 GLU 3.66 -3.69 1 94 LYS 5.22 -3.96 1 95 LYS -3.85 -5.03 1 96 THR -0.61 -3.18 1 97 TYR -5.51 -5.46 1 98 GLN -1.38 -6.10 1 101 LEU -5.21 -5.88 1 103 THR -5.61 -2.65 1 104 ALA -6.67 -4.81 1 105 LEU -2.04 -5.57 1 106 ALA 5.12 0.54 1 107 GLU 3.43 -1.71 1 109 LYS 4.00 0.68 1 111 TYR 2.85 -1.59 1 112 ALA 6.26 -0.92 1 113 ILE 3.63 -0.43 1 114 PHE 1.41 0.23 1 115 HIS 4.10 -0.95 1 116 PHE 7.18 -1.63 1 120 VAL 0.61 -2.64 1 122 TYR 4.05 -0.83 1 123 LEU 5.34 -0.44 1 124 ILE 4.58 0.51 1 125 ARG 3.99 -4.68 1 126 ILE 5.04 0.70 1 127 ARG 3.98 -0.30 1 128 ALA 3.32 0.94 1 129 ALA 3.39 -0.49 1 130 LEU 4.09 0.84 1 131 LYS 3.40 -1.96 1 132 LYS -1.12 -4.82 1 133 LYS 3.70 -4.07 1 134 ASN -5.51 -2.34 1 135 TYR -3.83 -5.97 1 136 LYS -6.14 -4.92 1 137 LEU 0.08 -3.00 1 138 ASN 4.51 -4.64 1 142 LEU -4.96 -3.33 1 143 PHE -2.03 -2.38 1 144 LYS -0.85 -4.26 1 147 THR 0.44 -3.65 1 148 LEU -0.01 -2.81 1 149 VAL -3.63 -2.71 1 151 LEU 1.65 -4.34 1 152 LYS -5.98 -3.33 1 153 ILE -6.15 -2.62 1 155 THR 5.01 -0.64 1 157 LYS 2.08 -0.47 1 158 GLU 4.76 -3.92 1 159 LEU 4.68 -2.07 1 161 LYS 2.97 -0.62 1 162 GLU -3.36 -3.96 1 165 PHE 1.00 -2.96 1 166 THR -5.39 -3.33 1 168 ARG 5.37 -2.97 1 169 ILE 2.06 -3.25 1 171 LYS -1.35 -3.73 1 stop_ save_