#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkb n HIS 135 N 0.00 0.00 0.00 0.66 -0.00 -1.26 -0.60 115.22 114.01 2qkb n HIS 135 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2qkb n HIS 135 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2qkb n HIS 135 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2qkb n GLY 137 N 0.00 0.00 0.10 -1.41 0.00 -1.26 -4.88 105.19 97.74 2qkb n GLY 137 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2qkb n GLY 137 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2qkb h ASP 138 N 0.00 0.00 -2.87 1.61 -0.00 -2.03 -3.45 116.42 109.67 2qkb h ASP 138 Ca 0.00 -0.07 -0.54 0.00 -0.00 0.00 0.00 57.03 56.42 2qkb h ASP 138 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 39.34 2qkb h ASP 138 CO 0.00 0.04 0.85 -0.36 -0.00 0.00 0.00 179.24 179.77 2qkb s PHE 139 N -3.30 2.85 0.01 4.15 0.40 -1.26 -4.77 117.98 116.06 2qkb s PHE 139 Ca 0.02 0.72 -0.06 0.00 -0.60 0.00 0.00 56.93 57.02 2qkb s PHE 139 Cb 0.11 -3.75 -0.05 0.00 0.51 0.00 0.00 43.02 39.84 2qkb s PHE 139 CO 0.77 -2.80 0.26 0.54 0.70 0.00 0.00 175.22 174.68 2qkb s VAL 140 N 2.11 5.32 -0.03 -0.44 0.11 -0.05 -4.53 120.40 122.89 2qkb s VAL 140 Ca 0.67 0.08 -0.18 0.00 -2.93 0.00 0.00 61.98 59.62 2qkb s VAL 140 Cb -0.35 -3.57 -0.05 0.00 -1.53 0.00 0.00 36.38 30.88 2qkb s VAL 140 CO 0.29 0.33 0.49 -0.69 -3.33 0.00 0.00 175.10 172.19 2qkb s VAL 141 N -1.33 5.01 0.01 2.04 1.01 0.23 -1.30 120.40 126.06 2qkb s VAL 141 Ca 0.28 1.01 -0.02 0.00 0.00 0.00 0.00 61.98 63.26 2qkb s VAL 141 Cb -0.13 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 2qkb s VAL 141 CO 0.17 0.46 0.02 0.54 0.00 0.00 0.00 175.10 176.29 2qkb s VAL 142 N -0.35 0.07 -0.10 2.92 0.11 -0.42 -4.79 120.40 117.85 2qkb s VAL 142 Ca 0.27 -0.57 0.01 0.00 -2.93 0.00 0.00 61.98 58.75 2qkb s VAL 142 Cb -0.17 -0.22 -0.02 0.00 -1.53 0.00 0.00 36.38 34.44 2qkb s VAL 142 CO 0.14 -0.31 -0.11 -0.31 -3.33 0.00 0.00 175.10 171.17 2qkb s TYR 143 N -0.95 2.83 0.12 1.54 2.02 -0.38 -0.63 117.35 121.90 2qkb s TYR 143 Ca -0.10 -0.37 0.05 0.00 -0.37 0.00 0.00 57.07 56.27 2qkb s TYR 143 Cb -0.06 -1.78 -0.04 0.00 -0.40 0.00 0.00 41.96 39.68 2qkb s TYR 143 CO -0.00 -0.01 -0.11 0.95 -1.57 0.00 0.00 175.55 174.81 2qkb s THR 144 N -0.10 1.12 -0.12 -0.71 -4.23 -0.34 -1.02 115.64 110.24 2qkb s THR 144 Ca -0.01 -1.81 -0.30 0.00 -1.18 0.00 0.00 61.69 58.39 2qkb s THR 144 Cb -0.14 -1.58 0.11 0.00 1.34 0.00 0.00 72.50 72.24 2qkb s THR 144 CO 0.03 -0.59 0.93 -0.62 -0.54 0.00 0.00 174.62 173.83 2qkb s ASP 145 N -2.71 -0.42 0.42 3.99 2.15 -0.72 -4.43 116.67 114.95 2qkb s ASP 145 Ca 0.10 0.41 0.04 0.00 0.43 0.00 0.00 52.55 53.53 2qkb s ASP 145 Cb -0.01 0.35 -0.04 0.00 -0.30 0.00 0.00 42.92 42.92 2qkb s ASP 145 CO 0.01 -0.42 0.05 -0.83 -0.17 0.00 0.00 175.17 173.80 2qkb s GLY 146 N -1.29 2.58 0.08 2.66 0.00 -1.26 -1.62 107.32 108.47 2qkb s GLY 146 Ca -0.03 -1.44 -0.26 0.00 0.00 0.00 0.00 44.72 43.00 2qkb s GLY 146 CO 0.02 -2.00 0.72 0.00 0.00 0.00 0.00 173.10 171.83 2qkb s SER 149 N 2.92 6.42 0.00 0.00 1.04 -1.10 -3.82 113.70 119.15 2qkb s SER 149 Ca 0.07 0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.91 2qkb s SER 149 Cb -0.12 -2.02 0.00 0.00 0.10 0.00 0.00 66.02 63.98 2qkb s SER 149 CO -0.15 0.19 0.00 -1.20 0.98 0.00 0.00 173.24 173.06 2qkb n SER 150 N 0.61 0.00 0.00 7.02 7.64 -1.26 -2.95 113.62 124.68 2qkb n SER 150 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 2qkb n SER 150 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 2qkb n SER 150 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2qkb n ASN 151 N 0.00 0.00 0.00 6.43 5.15 -1.25 -4.54 115.26 121.05 2qkb n ASN 151 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2qkb n ASN 151 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2qkb n ASN 151 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 2qkb n ARG 153 N 0.00 0.00 0.00 1.20 1.85 -1.26 -5.01 116.66 113.44 2qkb n ARG 153 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2qkb n ARG 153 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 2qkb n ARG 153 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2qkb n ARG 154 N 0.00 0.00 -2.21 2.89 1.85 -1.26 -4.84 116.66 113.08 2qkb n ARG 154 Ca 0.00 0.04 -0.20 0.00 -1.00 0.00 0.00 57.85 56.70 2qkb n ARG 154 Cb 0.00 -0.43 0.02 0.00 -1.05 0.00 0.00 32.46 31.00 2qkb n ARG 154 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2qkb n ARG 155 N -2.17 3.23 -0.19 2.89 1.85 -1.26 -5.06 116.66 115.96 2qkb n ARG 155 Ca 0.00 -4.07 -0.07 0.00 -1.00 0.00 0.00 57.85 52.71 2qkb n ARG 155 Cb 0.00 -2.14 -0.02 0.00 -1.05 0.00 0.00 32.46 29.25 2qkb n ARG 155 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2qkb n PRO 156 N -0.66 0.00 -3.95 2.89 -0.04 -1.26 -4.82 135.00 127.16 2qkb n PRO 156 Ca 0.37 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.47 2qkb n PRO 156 Cb 0.91 -0.20 -0.11 0.00 -0.04 0.00 0.00 33.50 34.05 2qkb n PRO 156 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qkb s ARG 157 N 0.99 3.83 -0.09 0.54 0.52 -1.15 -4.68 118.95 118.90 2qkb s ARG 157 Ca 0.17 -0.41 0.02 0.00 -0.52 0.00 0.00 55.73 54.99 2qkb s ARG 157 Cb -0.19 -3.24 -0.02 0.00 0.52 0.00 0.00 34.95 32.02 2qkb s ARG 157 CO 0.08 0.09 -0.15 0.00 0.02 0.00 0.00 175.30 175.34 2qkb s ALA 158 N 0.87 2.59 0.13 2.13 0.00 -1.26 -2.72 121.76 123.51 2qkb s ALA 158 Ca 0.03 -0.93 0.10 0.00 0.00 0.00 0.00 51.96 51.16 2qkb s ALA 158 Cb -0.14 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 2qkb s ALA 158 CO 0.02 0.38 -0.21 0.20 0.00 0.00 0.00 175.76 176.15 2qkb s GLY 159 N -0.09 1.65 -0.05 0.00 0.00 -0.06 -1.36 107.32 107.41 2qkb s GLY 159 Ca -0.02 -1.43 0.02 0.00 0.00 0.00 0.00 44.72 43.28 2qkb s GLY 159 CO 0.04 -1.42 -0.08 -0.42 0.00 0.00 0.00 173.10 171.22 2qkb s ILE 160 N -1.19 0.79 -0.01 0.90 1.01 -0.40 -1.82 121.20 120.47 2qkb s ILE 160 Ca 0.17 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.55 2qkb s ILE 160 Cb -0.10 -0.76 0.00 0.00 0.01 0.00 0.00 42.46 41.61 2qkb s ILE 160 CO 0.09 0.28 -0.01 -0.83 0.00 0.00 0.00 174.94 174.46 2qkb s GLY 161 N 0.79 0.12 -0.04 6.18 0.00 -0.64 0.44 107.32 114.17 2qkb s GLY 161 Ca -0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 44.72 44.56 2qkb s GLY 161 CO 0.02 0.07 0.01 -1.34 0.00 0.00 0.00 173.10 171.85 2qkb s VAL 162 N 0.17 0.22 -0.12 1.40 -7.23 -0.12 -1.75 120.40 112.98 2qkb s VAL 162 Ca -0.01 0.13 0.03 0.00 -1.81 0.00 0.00 61.98 60.31 2qkb s VAL 162 Cb -0.03 -0.35 -0.00 0.00 0.56 0.00 0.00 36.38 36.56 2qkb s VAL 162 CO -0.00 0.19 -0.21 -0.47 -0.31 0.00 0.00 175.10 174.29 2qkb s TYR 163 N 1.42 2.64 -0.30 2.82 6.14 -0.19 -1.56 117.35 128.32 2qkb s TYR 163 Ca -0.04 -1.02 0.13 0.00 0.64 0.00 0.00 57.07 56.78 2qkb s TYR 163 Cb -0.13 -1.77 -0.17 0.00 0.42 0.00 0.00 41.96 40.31 2qkb s TYR 163 CO -0.03 -0.42 0.41 0.91 0.64 0.00 0.00 175.55 177.07 2qkb n TRP 164 N 3.66 0.00 0.00 4.97 7.02 -1.26 -1.25 117.44 130.58 2qkb n TRP 164 Ca -0.19 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.29 2qkb n TRP 164 Cb 0.53 -0.16 0.00 0.00 -2.42 0.00 0.00 31.31 29.26 2qkb n TRP 164 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2qkb n GLY 165 N 1.54 3.10 3.57 6.99 0.00 -1.26 -4.43 105.19 114.70 2qkb n GLY 165 Ca -0.00 -1.77 -0.61 0.00 0.00 0.00 0.00 46.02 43.64 2qkb n GLY 165 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qkb n PRO 166 N -1.93 0.45 -3.73 1.61 -0.02 -1.26 -2.48 135.00 127.64 2qkb n PRO 166 Ca 0.00 0.15 -0.28 0.00 -2.02 0.00 0.00 63.50 61.35 2qkb n PRO 166 Cb 0.00 -1.78 0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2qkb n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qkb n GLY 167 N 5.27 -0.74 3.69 -1.23 0.00 -1.26 -4.98 105.19 105.94 2qkb n GLY 167 Ca 0.37 0.35 -0.35 0.00 0.00 0.00 0.00 46.02 46.39 2qkb n GLY 167 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qkb s HIS 168 N -3.60 3.27 0.14 1.61 5.04 -1.04 -4.99 115.29 115.73 2qkb s HIS 168 Ca 0.31 0.18 0.31 0.00 -1.54 0.00 0.00 55.06 54.32 2qkb s HIS 168 Cb -0.11 -1.95 1.68 0.00 0.04 0.00 0.00 32.58 32.25 2qkb s HIS 168 CO 0.86 0.36 1.95 -1.00 -2.34 0.00 0.00 174.74 174.57 2qkb h PRO 169 N 5.84 0.00 -0.02 2.88 0.13 -1.94 -2.07 132.00 136.83 2qkb h PRO 169 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2qkb h PRO 169 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2qkb h PRO 169 CO 0.62 0.00 -0.28 1.28 -0.23 0.00 0.00 178.00 179.39 2qkb n LEU 170 N -2.59 2.32 -4.67 1.56 4.32 -1.26 -4.92 117.00 111.76 2qkb n LEU 170 Ca -0.02 -0.85 -0.42 0.00 -0.02 0.00 0.00 56.01 54.70 2qkb n LEU 170 Cb 0.05 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.82 2qkb n LEU 170 CO 0.14 0.41 1.51 0.20 -1.22 0.00 0.00 177.39 178.43 2qkb s ASN 171 N -2.19 6.50 0.02 -1.43 0.01 -0.78 -4.89 114.94 112.18 2qkb s ASN 171 Ca 0.21 2.59 0.00 0.00 -0.71 0.00 0.00 52.86 54.95 2qkb s ASN 171 Cb 0.18 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 39.28 2qkb s ASN 171 CO 0.44 -1.01 -0.03 0.68 -1.51 0.00 0.00 177.10 175.68 2qkb s VAL 172 N 3.90 0.11 -0.12 1.60 -7.23 -0.60 -5.00 120.40 113.06 2qkb s VAL 172 Ca 0.83 -0.80 0.01 0.00 -1.81 0.00 0.00 61.98 60.20 2qkb s VAL 172 Cb -0.41 -0.24 0.02 0.00 0.56 0.00 0.00 36.38 36.31 2qkb s VAL 172 CO 0.38 -0.44 -0.12 -0.83 -0.31 0.00 0.00 175.10 173.78 2qkb s GLY 173 N -1.28 0.98 0.20 2.32 0.00 -1.26 -0.94 107.32 107.34 2qkb s GLY 173 Ca -0.14 -0.70 -0.05 0.00 0.00 0.00 0.00 44.72 43.83 2qkb s GLY 173 CO -0.01 0.48 0.21 -0.26 0.00 0.00 0.00 173.10 173.53 2qkb s ILE 174 N 1.33 0.02 0.05 0.90 -4.36 0.17 -4.35 121.20 114.96 2qkb s ILE 174 Ca -0.00 -1.79 -0.30 0.00 -0.26 0.00 0.00 60.65 58.30 2qkb s ILE 174 Cb -0.14 -2.30 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 2qkb s ILE 174 CO -0.06 -0.10 0.96 -0.60 0.24 0.00 0.00 174.94 175.38 2qkb s ARG 175 N -4.09 4.62 -0.16 0.37 6.06 -1.17 -1.28 118.95 123.30 2qkb s ARG 175 Ca 0.31 1.41 -0.29 0.00 -2.50 0.00 0.00 55.73 54.66 2qkb s ARG 175 Cb 0.05 -3.42 -0.02 0.00 0.06 0.00 0.00 34.95 31.62 2qkb s ARG 175 CO 0.09 0.09 1.38 -1.17 -2.50 0.00 0.00 175.30 173.19 2qkb s LEU 176 N 0.47 4.16 0.39 -0.88 2.96 -0.46 -4.89 118.68 120.42 2qkb s LEU 176 Ca 0.49 1.75 -0.24 0.00 -0.22 0.00 0.00 54.13 55.91 2qkb s LEU 176 Cb -0.22 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.84 2qkb s LEU 176 CO 0.28 -0.87 1.02 -2.84 -1.32 0.00 0.00 176.35 172.63 2qkb s PRO 177 N 3.77 4.24 1.20 0.98 0.02 -1.26 -4.79 135.00 139.16 2qkb s PRO 177 Ca 0.60 1.44 0.00 0.00 0.02 0.00 0.00 61.00 63.06 2qkb s PRO 177 Cb -0.24 -2.55 0.00 0.00 0.02 0.00 0.00 34.50 31.73 2qkb s PRO 177 CO 0.20 -0.06 0.00 0.41 -0.33 0.00 0.00 177.00 177.22 2qkb n GLY 178 N 0.28 -1.81 3.68 0.52 0.00 -1.26 -4.88 105.19 101.71 2qkb n GLY 178 Ca 0.05 -1.50 -0.53 0.00 0.00 0.00 0.00 46.02 44.04 2qkb n GLY 178 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2qkb n ARG 179 N 0.00 1.56 -2.94 1.61 0.63 -1.26 -4.91 116.66 111.35 2qkb n ARG 179 Ca 0.00 0.57 -0.42 0.00 -0.92 0.00 0.00 57.85 57.08 2qkb n ARG 179 Cb 0.00 -2.30 -0.05 0.00 0.45 0.00 0.00 32.46 30.56 2qkb n ARG 179 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2qkb s GLN 180 N 2.98 3.69 0.22 -0.14 -1.52 -1.26 -4.91 119.66 118.71 2qkb s GLN 180 Ca 0.93 0.25 -0.05 0.00 -1.95 0.00 0.00 55.36 54.54 2qkb s GLN 180 Cb -0.90 -3.84 -0.03 0.00 -0.22 0.00 0.00 33.01 28.02 2qkb s GLN 180 CO 0.56 -0.93 0.26 0.95 -0.25 0.00 0.00 175.29 175.88 2qkb s THR 181 N 3.20 0.00 0.05 -0.19 -4.23 -1.26 -4.90 115.64 108.32 2qkb s THR 181 Ca 0.32 -1.78 -0.16 0.00 -1.18 0.00 0.00 61.69 58.88 2qkb s THR 181 Cb -0.13 -2.38 -0.22 0.00 1.34 0.00 0.00 72.50 71.11 2qkb s THR 181 CO 0.19 -0.01 1.17 -0.55 -0.54 0.00 0.00 174.62 174.88 2qkb h ASN 182 N 2.49 0.75 -0.73 3.99 -1.07 -1.88 -2.90 115.58 116.22 2qkb h ASN 182 Ca -0.32 -0.72 -0.03 0.00 0.07 0.00 0.00 56.30 55.29 2qkb h ASN 182 Cb 1.25 -0.23 -0.03 0.00 -2.07 0.00 0.00 38.32 37.24 2qkb h ASN 182 CO 0.47 1.36 0.33 1.56 0.07 0.00 0.00 177.43 181.22 2qkb h GLN 183 N 0.20 1.07 -0.42 4.14 1.08 -1.98 -1.02 115.11 118.18 2qkb h GLN 183 Ca -0.09 -0.17 -0.10 0.00 -1.45 0.00 0.00 58.65 56.84 2qkb h GLN 183 Cb 1.46 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 28.69 2qkb h GLN 183 CO 0.16 0.85 -0.14 0.00 -0.95 0.00 0.00 178.83 178.75 2qkb h ARG 184 N 1.03 0.78 -0.28 1.46 3.08 -1.91 -1.46 114.38 117.08 2qkb h ARG 184 Ca 0.25 -0.27 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 2qkb h ARG 184 Cb 0.15 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 2qkb h ARG 184 CO -0.03 0.88 -0.30 0.00 -1.07 0.00 0.00 179.97 179.46 2qkb h ALA 185 N 1.14 0.41 -0.73 0.04 0.00 -1.24 -0.44 119.26 118.44 2qkb h ALA 185 Ca 0.11 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.65 2qkb h ALA 185 Cb 0.63 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 2qkb h ALA 185 CO 0.04 0.43 0.46 0.93 0.00 0.00 0.00 179.25 181.11 2qkb h GLU 186 N 0.43 0.86 -0.18 0.00 4.39 -1.07 0.94 114.58 119.94 2qkb h GLU 186 Ca 0.04 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 2qkb h GLU 186 Cb 0.87 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.32 2qkb h GLU 186 CO 0.07 0.57 -0.08 0.82 -1.16 0.00 0.00 179.01 179.23 2qkb h ILE 187 N 0.88 1.31 0.00 3.13 2.04 -1.13 -2.83 117.51 120.91 2qkb h ILE 187 Ca 0.30 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 65.03 2qkb h ILE 187 Cb 0.04 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 2qkb h ILE 187 CO -0.12 0.34 0.00 0.45 0.00 0.00 0.00 178.15 178.82 2qkb h HIS 188 N 0.06 0.00 -0.28 1.37 3.86 -0.93 -0.53 115.15 118.69 2qkb h HIS 188 Ca 0.04 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.15 2qkb h HIS 188 Cb 0.56 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 2qkb h HIS 188 CO 0.06 0.00 -0.22 0.00 0.86 0.00 0.00 177.93 178.63 2qkb h ALA 189 N 2.28 0.40 -0.49 2.45 0.00 -0.68 0.78 119.26 124.00 2qkb h ALA 189 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 2qkb h ALA 189 Cb 0.60 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2qkb h ALA 189 CO 0.00 0.36 0.22 0.00 0.00 0.00 0.00 179.25 179.84 2qkb h ALA 190 N 0.71 0.64 -0.19 0.00 0.00 -1.12 -1.62 119.26 117.68 2qkb h ALA 190 Ca 0.05 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2qkb h ALA 190 Cb 0.77 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2qkb h ALA 190 CO 0.06 0.21 -0.07 0.00 0.00 0.00 0.00 179.25 179.45 2qkb h LYS 192 N -0.04 0.23 -0.93 0.00 1.63 -0.50 -1.60 116.57 115.36 2qkb h LYS 192 Ca 0.10 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.89 2qkb h LYS 192 Cb 0.19 -0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.72 2qkb h LYS 192 CO -0.22 0.15 0.61 0.00 -3.45 0.00 0.00 179.45 176.55 2qkb h ALA 193 N 1.34 1.33 -0.09 5.00 0.00 -0.79 -2.00 119.26 124.05 2qkb h ALA 193 Ca 0.22 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2qkb h ALA 193 Cb 0.27 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2qkb h ALA 193 CO -0.28 0.62 -0.43 0.82 0.00 0.00 0.00 179.25 179.97 2qkb h ILE 194 N 1.26 1.32 -0.32 0.00 2.04 -0.39 -0.30 117.51 121.12 2qkb h ILE 194 Ca 0.34 -1.57 -0.02 0.00 1.00 0.00 0.00 64.86 64.61 2qkb h ILE 194 Cb -0.14 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 2qkb h ILE 194 CO -0.07 0.46 0.11 -0.33 0.00 0.00 0.00 178.15 178.32 2qkb h GLU 195 N 0.17 0.48 -0.83 2.37 5.08 -0.95 -2.49 114.58 118.41 2qkb h GLU 195 Ca 0.01 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2qkb h GLU 195 Cb 0.84 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.97 2qkb h GLU 195 CO 0.07 0.51 0.49 1.96 -1.00 0.00 0.00 179.01 181.03 2qkb h GLN 196 N 0.36 1.13 -0.90 2.33 4.20 -0.84 -1.61 115.11 119.77 2qkb h GLN 196 Ca 0.10 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2qkb h GLN 196 Cb 0.22 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 2qkb h GLN 196 CO -0.01 0.80 0.58 0.00 -0.67 0.00 0.00 178.83 179.53 2qkb h ALA 197 N 1.39 1.32 0.00 3.87 0.00 -0.77 -1.14 119.26 123.94 2qkb h ALA 197 Ca 0.30 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2qkb h ALA 197 Cb -0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2qkb h ALA 197 CO -0.05 0.61 -0.45 0.87 0.00 0.00 0.00 179.25 180.23 2qkb h LYS 198 N 1.23 0.00 0.00 0.00 1.57 -0.93 -0.58 116.57 117.86 2qkb h LYS 198 Ca 0.33 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.06 2qkb h LYS 198 Cb -0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2qkb h LYS 198 CO -0.07 0.45 -0.22 0.00 -0.57 0.00 0.00 179.45 179.04 2qkb h THR 199 N 0.00 0.98 -0.63 -0.16 1.03 -0.30 -1.95 112.91 111.88 2qkb h THR 199 Ca -0.00 -0.80 0.00 0.00 -0.01 0.00 0.00 66.41 65.59 2qkb h THR 199 Cb 0.82 1.45 0.00 0.00 -1.07 0.00 0.00 68.15 69.35 2qkb h THR 199 CO 0.06 0.22 0.00 0.00 -0.01 0.00 0.00 175.52 175.78 2qkb n GLN 200 N -4.02 3.17 -3.80 0.00 6.02 -0.44 -4.95 117.38 113.36 2qkb n GLN 200 Ca -0.02 -2.55 -0.27 0.00 -0.01 0.00 0.00 57.00 54.15 2qkb n GLN 200 Cb 0.30 -1.73 0.04 0.00 1.02 0.00 0.00 30.24 29.86 2qkb n GLN 200 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2qkb n ASN 201 N 1.19 -3.89 -4.73 1.08 5.15 -0.73 -4.98 115.26 108.35 2qkb n ASN 201 Ca 0.23 -0.76 -0.35 0.00 -0.60 0.00 0.00 54.58 53.10 2qkb n ASN 201 Cb 0.74 -4.10 -0.08 0.00 -0.53 0.00 0.00 39.78 35.80 2qkb n ASN 201 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2qkb s ILE 202 N -3.41 5.08 0.00 -1.44 1.01 -0.36 -4.97 121.20 117.12 2qkb s ILE 202 Ca 0.45 0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.16 2qkb s ILE 202 Cb -0.22 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2qkb s ILE 202 CO 0.81 0.51 0.06 -0.46 0.00 0.00 0.00 174.94 175.86 2qkb n ASN 203 N 3.00 0.13 -4.13 3.58 6.94 -1.26 -4.35 115.26 119.16 2qkb n ASN 203 Ca -0.17 -0.47 -0.35 0.00 -0.02 0.00 0.00 54.58 53.57 2qkb n ASN 203 Cb 0.53 0.57 -0.13 0.00 -2.36 0.00 0.00 39.78 38.39 2qkb n ASN 203 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2qkb s LYS 204 N -0.57 2.10 -0.03 -3.83 1.02 -1.26 0.17 119.74 117.35 2qkb s LYS 204 Ca 0.00 -1.63 0.07 0.00 0.02 0.00 0.00 55.97 54.43 2qkb s LYS 204 Cb 0.00 -3.41 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 2qkb s LYS 204 CO 0.00 -0.90 -0.24 -1.17 -0.92 0.00 0.00 175.35 172.12 2qkb s LEU 205 N 1.16 2.04 -0.21 3.17 2.96 0.04 -0.87 118.68 126.96 2qkb s LEU 205 Ca 0.04 -0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 53.46 2qkb s LEU 205 Cb -0.21 -1.25 -0.01 0.00 0.50 0.00 0.00 46.19 45.22 2qkb s LEU 205 CO -0.03 0.27 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.54 2qkb s VAL 206 N -0.42 3.47 -0.19 1.68 1.01 -0.42 -0.76 120.40 124.76 2qkb s VAL 206 Ca 0.05 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 2qkb s VAL 206 Cb -0.10 -2.57 -0.00 0.00 0.00 0.00 0.00 36.38 33.70 2qkb s VAL 206 CO 0.00 0.43 -0.10 -0.22 0.00 0.00 0.00 175.10 175.21 2qkb s LEU 207 N 1.36 2.64 -0.20 3.92 0.20 0.15 -1.30 118.68 125.44 2qkb s LEU 207 Ca 0.04 -0.46 -0.08 0.00 0.69 0.00 0.00 54.13 54.33 2qkb s LEU 207 Cb -0.14 -1.64 -0.04 0.00 -0.43 0.00 0.00 46.19 43.94 2qkb s LEU 207 CO -0.02 0.02 0.08 -0.31 -0.29 0.00 0.00 176.35 175.83 2qkb s TYR 208 N 1.23 3.24 0.06 5.38 1.51 0.20 -4.36 117.35 124.60 2qkb s TYR 208 Ca 0.03 0.03 -0.20 0.00 -1.01 0.00 0.00 57.07 55.92 2qkb s TYR 208 Cb -0.14 -2.13 0.04 0.00 -0.11 0.00 0.00 41.96 39.62 2qkb s TYR 208 CO -0.04 0.07 0.46 -0.08 -1.11 0.00 0.00 175.55 174.84 2qkb s THR 209 N 0.65 0.05 -2.45 -0.71 -1.32 -1.26 -1.19 115.64 109.40 2qkb s THR 209 Ca 0.04 -0.38 0.22 0.00 -1.21 0.00 0.00 61.69 60.37 2qkb s THR 209 Cb -0.13 -0.98 0.42 0.00 -1.51 0.00 0.00 72.50 70.30 2qkb s THR 209 CO 0.01 -0.21 1.47 -0.46 -2.21 0.00 0.00 174.62 173.22 2qkb n ASN 210 N 0.37 2.55 -4.90 8.08 0.23 -1.26 -1.09 115.26 119.23 2qkb n ASN 210 Ca -0.18 -1.85 -0.28 0.00 -0.53 0.00 0.00 54.58 51.74 2qkb n ASN 210 Cb 0.60 -0.15 0.01 0.00 -2.08 0.00 0.00 39.78 38.17 2qkb n ASN 210 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2qkb s SER 211 N -1.60 6.04 0.00 0.53 0.15 -1.26 -4.85 113.70 112.70 2qkb s SER 211 Ca 0.35 0.93 0.00 0.00 0.70 0.00 0.00 55.95 57.93 2qkb s SER 211 Cb 0.20 -2.10 0.00 0.00 -1.71 0.00 0.00 66.02 62.41 2qkb s SER 211 CO 0.29 -0.78 0.00 0.33 1.20 0.00 0.00 173.24 174.28 2qkb n PHE 213 N -2.44 0.00 -0.06 3.44 7.35 -1.26 -1.76 117.46 122.73 2qkb n PHE 213 Ca 0.03 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.60 2qkb n PHE 213 Cb 0.56 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.33 2qkb n PHE 213 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2qkb h THR 214 N 0.00 1.27 -0.57 -2.13 2.02 -1.95 -1.10 112.91 110.45 2qkb h THR 214 Ca 0.00 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.28 2qkb h THR 214 Cb 0.00 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 2qkb h THR 214 CO 0.00 0.28 0.37 0.40 0.37 0.00 0.00 175.52 176.94 2qkb h ILE 215 N 0.09 1.13 -0.41 3.11 2.04 -1.77 -1.38 117.51 120.32 2qkb h ILE 215 Ca 0.05 -0.26 -0.14 0.00 1.00 0.00 0.00 64.86 65.51 2qkb h ILE 215 Cb 0.42 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2qkb h ILE 215 CO 0.01 0.14 -0.30 0.78 0.00 0.00 0.00 178.15 178.78 2qkb h ASN 216 N 0.75 0.94 -0.22 1.72 -0.26 -1.79 -0.93 115.58 115.80 2qkb h ASN 216 Ca 0.21 -0.39 -0.01 0.00 -0.56 0.00 0.00 56.30 55.56 2qkb h ASN 216 Cb -0.06 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 36.92 2qkb h ASN 216 CO -0.06 1.16 0.10 1.23 -1.06 0.00 0.00 177.43 178.80 2qkb h GLY 217 N 0.87 0.34 2.00 2.83 0.00 -0.97 -0.84 103.07 107.31 2qkb h GLY 217 Ca 0.08 -0.18 -0.20 0.00 0.00 0.00 0.00 47.33 47.04 2qkb h GLY 217 CO 0.08 0.17 -0.93 1.19 0.00 0.00 0.00 176.54 177.05 2qkb h ILE 218 N 0.21 1.63 0.00 2.60 6.09 -1.22 -1.48 117.51 125.35 2qkb h ILE 218 Ca 0.07 -3.23 0.00 0.00 -1.37 0.00 0.00 64.86 60.34 2qkb h ILE 218 Cb 0.14 2.76 0.00 0.00 0.47 0.00 0.00 36.82 40.19 2qkb h ILE 218 CO -0.01 0.91 -1.00 0.35 -3.07 0.00 0.00 178.15 175.33 2qkb n THR 219 N -3.38 0.21 -0.88 2.19 -2.24 -0.36 -4.79 114.28 105.03 2qkb n THR 219 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2qkb n THR 219 Cb 0.90 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 2qkb n THR 219 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2qkb n ASN 220 N -2.02 0.00 -0.03 3.42 6.94 -0.76 -4.98 115.26 117.84 2qkb n ASN 220 Ca 0.02 -0.04 -0.12 0.00 -0.02 0.00 0.00 54.58 54.41 2qkb n ASN 220 Cb 0.45 0.00 -0.14 0.00 -2.36 0.00 0.00 39.78 37.72 2qkb n ASN 220 CO 0.00 0.00 0.00 0.79 -1.03 0.00 0.00 177.26 177.02 2qkb n TRP 221 N 0.00 0.92 0.30 -2.53 8.01 -0.39 -3.99 117.44 119.76 2qkb n TRP 221 Ca 0.00 0.28 0.17 0.00 -1.31 0.00 0.00 57.50 56.65 2qkb n TRP 221 Cb 0.01 -1.15 0.99 0.00 -2.01 0.00 0.00 31.31 29.15 2qkb n TRP 221 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.69 176.29 2qkb h VAL 222 N 0.02 0.38 -0.17 -0.99 -1.51 -1.53 -1.82 116.25 110.63 2qkb h VAL 222 Ca -0.36 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 2qkb h VAL 222 Cb 2.04 0.98 -0.01 0.00 -2.13 0.00 0.00 31.29 32.17 2qkb h VAL 222 CO 0.07 0.00 0.11 1.56 -1.23 0.00 0.00 177.57 178.07 2qkb h GLN 223 N 0.00 0.22 -0.12 5.19 4.20 -1.84 -2.37 115.11 120.39 2qkb h GLN 223 Ca 0.01 -0.02 -0.19 0.00 0.06 0.00 0.00 58.65 58.51 2qkb h GLN 223 Cb 0.06 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2qkb h GLN 223 CO -0.00 0.17 -0.71 0.78 -0.67 0.00 0.00 178.83 178.39 2qkb h GLY 224 N 0.21 0.61 1.43 3.46 0.00 -1.57 -3.23 103.07 103.97 2qkb h GLY 224 Ca 0.06 -0.83 -0.06 0.00 0.00 0.00 0.00 47.33 46.50 2qkb h GLY 224 CO -0.01 0.74 0.01 1.49 0.00 0.00 0.00 176.54 178.76 2qkb h TRP 225 N 0.38 0.74 0.00 5.60 6.55 -1.32 0.16 115.95 128.07 2qkb h TRP 225 Ca -0.03 -0.09 0.00 0.00 0.95 0.00 0.00 58.89 59.72 2qkb h TRP 225 Cb 1.30 -0.21 0.00 0.00 -0.86 0.00 0.00 29.16 29.39 2qkb h TRP 225 CO 0.06 0.70 0.00 1.63 -1.05 0.00 0.00 178.44 179.77 2qkb n LYS 226 N -4.24 0.12 -0.06 0.49 5.02 -0.90 0.03 118.16 118.62 2qkb n LYS 226 Ca 0.02 0.29 -0.16 0.00 -2.02 0.00 0.00 58.31 56.45 2qkb n LYS 226 Cb 0.28 -1.71 -0.14 0.00 -0.02 0.00 0.00 35.03 33.44 2qkb n LYS 226 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qkb n LYS 227 N -1.93 0.69 -0.81 1.97 4.76 -0.21 -4.50 118.16 118.13 2qkb n LYS 227 Ca 0.04 0.18 -0.01 0.00 -2.87 0.00 0.00 58.31 55.65 2qkb n LYS 227 Cb 0.25 -1.62 0.28 0.00 -1.84 0.00 0.00 35.03 32.10 2qkb n LYS 227 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2qkb n ASN 228 N -3.19 4.17 -0.88 4.39 0.23 0.40 -4.94 115.26 115.44 2qkb n ASN 228 Ca -0.34 -3.25 -0.09 0.00 -0.53 0.00 0.00 54.58 50.36 2qkb n ASN 228 Cb 1.05 -0.67 -0.02 0.00 -2.08 0.00 0.00 39.78 38.06 2qkb n ASN 228 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2qkb n GLY 229 N -0.41 0.53 3.28 4.83 0.00 -1.06 -3.71 105.19 108.65 2qkb n GLY 229 Ca 0.33 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 2qkb n GLY 229 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2qkb n TRP 230 N -3.38 -2.32 -4.76 1.61 7.02 0.10 -4.94 117.44 110.78 2qkb n TRP 230 Ca -0.10 0.87 -0.33 0.00 -1.02 0.00 0.00 57.50 56.93 2qkb n TRP 230 Cb 0.44 -4.45 -0.12 0.00 -2.42 0.00 0.00 31.31 24.76 2qkb n TRP 230 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2qkb s LYS 231 N -4.73 2.48 0.90 -0.99 3.01 -1.24 -1.47 119.74 117.70 2qkb s LYS 231 Ca 0.28 -0.72 -0.12 0.00 -1.01 0.00 0.00 55.97 54.40 2qkb s LYS 231 Cb -0.04 -2.40 0.13 0.00 -1.01 0.00 0.00 37.83 34.52 2qkb s LYS 231 CO 0.72 0.61 1.14 -0.08 0.51 0.00 0.00 175.35 178.25 2qkb s THR 232 N -0.81 2.07 0.37 2.17 -1.32 0.61 -4.83 115.64 113.90 2qkb s THR 232 Ca 0.13 0.02 0.35 0.00 -1.21 0.00 0.00 61.69 60.99 2qkb s THR 232 Cb -0.11 -2.78 0.38 0.00 -1.51 0.00 0.00 72.50 68.49 2qkb s THR 232 CO 0.02 -0.03 2.13 0.77 -2.21 0.00 0.00 174.62 175.30 2qkb h SER 233 N -1.46 0.00 -0.28 8.08 4.64 -2.00 -1.08 113.55 121.44 2qkb h SER 233 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2qkb h SER 233 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2qkb h SER 233 CO 0.62 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.62 2qkb n ALA 234 N -2.14 2.84 -1.01 5.18 0.00 -1.26 -4.88 120.51 119.23 2qkb n ALA 234 Ca -0.01 -0.73 -0.00 0.00 0.00 0.00 0.00 53.44 52.69 2qkb n ALA 234 Cb 0.22 -1.02 -0.00 0.00 0.00 0.00 0.00 19.45 18.64 2qkb n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkb n GLY 235 N 0.58 0.32 4.02 0.00 0.00 -0.41 -5.01 105.19 104.69 2qkb n GLY 235 Ca 0.12 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 2qkb n GLY 235 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkb s LYS 236 N -0.97 2.52 0.18 1.61 3.01 -1.26 -4.73 119.74 120.11 2qkb s LYS 236 Ca 0.00 -1.41 -0.30 0.00 -1.01 0.00 0.00 55.97 53.25 2qkb s LYS 236 Cb 0.00 -2.68 -0.08 0.00 -1.01 0.00 0.00 37.83 34.06 2qkb s LYS 236 CO 0.00 -0.62 0.97 -1.21 0.51 0.00 0.00 175.35 175.00 2qkb s GLU 237 N -4.55 4.77 -0.22 1.68 2.02 -1.26 0.23 118.70 121.36 2qkb s GLU 237 Ca 0.59 1.50 -0.29 0.00 0.02 0.00 0.00 54.97 56.79 2qkb s GLU 237 Cb -0.08 -3.32 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 2qkb s GLU 237 CO 0.37 0.35 1.93 0.08 0.02 0.00 0.00 175.26 178.00 2qkb s VAL 238 N -0.63 3.31 0.17 2.63 1.01 -0.54 -4.73 120.40 121.60 2qkb s VAL 238 Ca 0.44 0.33 -0.14 0.00 0.00 0.00 0.00 61.98 62.61 2qkb s VAL 238 Cb -0.25 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 32.82 2qkb s VAL 238 CO 0.32 -0.19 1.81 0.40 0.00 0.00 0.00 175.10 177.43 2qkb h ILE 239 N 6.63 1.15 -0.39 2.22 2.04 -1.93 -2.66 117.51 124.57 2qkb h ILE 239 Ca -0.38 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.11 2qkb h ILE 239 Cb 1.20 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 2qkb h ILE 239 CO 0.99 0.15 0.06 0.59 0.00 0.00 0.00 178.15 179.94 2qkb n ASN 240 N -4.70 3.85 -0.37 1.72 4.13 -1.26 -4.64 115.26 114.00 2qkb n ASN 240 Ca 0.02 -2.63 0.01 0.00 1.68 0.00 0.00 54.58 53.66 2qkb n ASN 240 Cb 0.05 -0.63 0.07 0.00 -1.54 0.00 0.00 39.78 37.72 2qkb n ASN 240 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 2qkb h LYS 241 N 2.19 -0.01 -0.57 3.52 3.64 -1.88 0.43 116.57 123.89 2qkb h LYS 241 Ca 0.06 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.54 2qkb h LYS 241 Cb 1.52 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 33.26 2qkb h LYS 241 CO 0.36 -0.00 0.14 0.93 -2.27 0.00 0.00 179.45 178.60 2qkb h GLU 242 N -0.01 0.27 -0.40 1.90 5.08 -1.87 -0.57 114.58 118.98 2qkb h GLU 242 Ca 0.38 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.65 2qkb h GLU 242 Cb 0.63 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2qkb h GLU 242 CO -0.99 0.18 -0.03 -0.44 -1.00 0.00 0.00 179.01 176.73 2qkb h ASP 243 N 0.28 0.73 0.69 1.42 3.32 -1.32 -1.75 116.42 119.79 2qkb h ASP 243 Ca 0.30 -0.33 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 2qkb h ASP 243 Cb 0.41 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2qkb h ASP 243 CO -0.36 0.88 -0.49 -0.26 -1.72 0.00 0.00 179.24 177.29 2qkb h PHE 244 N 0.56 0.00 -0.23 4.55 0.04 -0.86 -0.26 116.94 120.74 2qkb h PHE 244 Ca 0.11 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.72 2qkb h PHE 244 Cb 0.53 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.67 2qkb h PHE 244 CO 0.04 0.49 -0.49 0.28 -0.60 0.00 0.00 178.31 178.04 2qkb h VAL 245 N 0.00 1.30 -0.31 -0.55 2.07 -0.91 0.20 116.25 118.06 2qkb h VAL 245 Ca -0.00 -1.70 -0.18 0.00 0.82 0.00 0.00 66.70 65.64 2qkb h VAL 245 Cb 0.97 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 32.39 2qkb h VAL 245 CO 0.06 0.54 -0.50 0.00 0.02 0.00 0.00 177.57 177.69 2qkb h ALA 246 N 0.96 0.48 -0.49 1.67 0.00 -1.02 -1.58 119.26 119.28 2qkb h ALA 246 Ca 0.02 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 2qkb h ALA 246 Cb 1.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2qkb h ALA 246 CO 0.10 0.66 0.10 1.25 0.00 0.00 0.00 179.25 181.36 2qkb h LEU 247 N 0.68 0.76 -1.04 0.00 5.85 -0.76 -2.52 115.31 118.27 2qkb h LEU 247 Ca 0.03 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.52 2qkb h LEU 247 Cb 1.11 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.88 2qkb h LEU 247 CO 0.11 0.81 0.64 -0.08 -0.34 0.00 0.00 178.44 179.59 2qkb h GLU 248 N 0.68 1.24 -0.84 1.25 4.81 -0.48 -2.12 114.58 119.11 2qkb h GLU 248 Ca 0.15 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2qkb h GLU 248 Cb 0.36 -0.28 -0.05 0.00 0.63 0.00 0.00 28.75 29.41 2qkb h GLU 248 CO 0.01 0.82 0.55 -0.09 -0.73 0.00 0.00 179.01 179.56 2qkb h ARG 249 N 1.27 1.07 0.00 1.92 2.43 -1.03 -2.63 114.38 117.41 2qkb h ARG 249 Ca 0.37 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.41 2qkb h ARG 249 Cb -0.07 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.23 2qkb h ARG 249 CO -0.10 0.71 -0.33 -0.07 -1.51 0.00 0.00 179.97 178.66 2qkb h LEU 250 N 1.10 0.00 -0.03 3.80 -0.00 -0.97 -2.95 115.31 116.25 2qkb h LEU 250 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.20 2qkb h LEU 250 Cb -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.59 2qkb h LEU 250 CO -0.09 0.33 -0.08 0.35 -0.00 0.00 0.00 178.44 178.95 2qkb n THR 251 N -3.74 0.00 -1.78 0.22 -2.24 -0.94 -4.83 114.28 100.97 2qkb n THR 251 Ca -0.01 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 2qkb n THR 251 Cb 0.42 -0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.27 2qkb n THR 251 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qkb s GLN 252 N -2.85 4.15 -0.00 -0.78 -2.07 -1.12 -4.74 119.66 112.24 2qkb s GLN 252 Ca 0.18 2.52 -0.00 0.00 -1.82 0.00 0.00 55.36 56.24 2qkb s GLN 252 Cb 0.19 -3.51 -0.00 0.00 -1.09 0.00 0.00 33.01 28.60 2qkb s GLN 252 CO 0.53 -0.79 0.00 0.41 -1.32 0.00 0.00 175.29 174.12 2qkb n GLY 253 N 4.12 -0.18 2.92 2.60 0.00 -1.26 -5.11 105.19 108.29 2qkb n GLY 253 Ca 0.17 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 2qkb n GLY 253 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qkb s ASP 255 N -2.11 0.31 -0.13 1.61 -1.08 0.13 -4.86 116.67 110.54 2qkb s ASP 255 Ca 0.00 -0.37 0.01 0.00 -0.52 0.00 0.00 52.55 51.68 2qkb s ASP 255 Cb -0.00 1.14 -0.00 0.00 -1.46 0.00 0.00 42.92 42.60 2qkb s ASP 255 CO 0.00 -0.35 -0.17 -0.63 0.52 0.00 0.00 175.17 174.54 2qkb s ILE 256 N 2.55 2.57 -0.31 4.11 1.01 -1.26 -0.78 121.20 129.10 2qkb s ILE 256 Ca 0.10 -0.82 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 2qkb s ILE 256 Cb -0.12 -2.06 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 2qkb s ILE 256 CO -0.30 0.53 0.48 -1.10 0.00 0.00 0.00 174.94 174.55 2qkb s GLN 257 N 0.57 3.81 0.58 2.79 -1.52 0.06 -4.99 119.66 120.97 2qkb s GLN 257 Ca -0.10 -0.02 0.03 0.00 -1.95 0.00 0.00 55.36 53.32 2qkb s GLN 257 Cb -0.16 -3.74 0.06 0.00 -0.22 0.00 0.00 33.01 28.95 2qkb s GLN 257 CO 0.04 -0.49 0.81 -1.58 -0.25 0.00 0.00 175.29 173.82 2qkb s TRP 258 N 2.28 2.31 -0.11 0.91 0.52 -1.26 0.29 118.94 123.89 2qkb s TRP 258 Ca 0.18 -0.23 -0.04 0.00 0.02 0.00 0.00 56.10 56.03 2qkb s TRP 258 Cb -0.16 -2.70 0.05 0.00 -1.15 0.00 0.00 33.47 29.52 2qkb s TRP 258 CO 0.11 -1.08 0.23 -1.58 0.02 0.00 0.00 176.95 174.65 2qkb s HIS 260 N -2.80 -0.33 -0.41 -1.98 2.46 -1.26 -4.96 115.29 106.01 2qkb s HIS 260 Ca 0.60 0.81 -0.18 0.00 0.47 0.00 0.00 55.06 56.76 2qkb s HIS 260 Cb -0.08 -0.06 0.02 0.00 -0.13 0.00 0.00 32.58 32.33 2qkb s HIS 260 CO 0.39 -0.29 0.46 0.54 -2.47 0.00 0.00 174.74 173.38 2qkb s VAL 261 N 1.94 5.06 1.24 0.89 0.11 -0.25 -4.91 120.40 124.48 2qkb s VAL 261 Ca -0.03 -0.21 -0.18 0.00 -2.93 0.00 0.00 61.98 58.64 2qkb s VAL 261 Cb -0.11 -4.03 0.26 0.00 -1.53 0.00 0.00 36.38 30.97 2qkb s VAL 261 CO -0.08 -0.39 0.62 -0.81 -3.33 0.00 0.00 175.10 171.11 2qkb n PRO 262 N 5.66 -3.03 0.00 1.54 -0.04 -1.26 -4.26 135.00 133.61 2qkb n PRO 262 Ca -0.07 -0.88 0.00 0.00 -0.04 0.00 0.00 63.50 62.51 2qkb n PRO 262 Cb 0.48 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2qkb n PRO 262 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qkb n GLY 263 N 1.77 -0.08 2.95 0.55 0.00 -1.26 -4.38 105.19 104.75 2qkb n GLY 263 Ca 0.06 0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2qkb n GLY 263 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qkb s HIS 264 N -0.27 -0.19 0.30 1.61 3.76 -1.26 -5.13 115.29 114.11 2qkb s HIS 264 Ca 0.00 0.52 0.06 0.00 -0.15 0.00 0.00 55.06 55.49 2qkb s HIS 264 Cb 0.00 -0.06 -0.02 0.00 1.11 0.00 0.00 32.58 33.61 2qkb s HIS 264 CO 0.00 -0.17 0.21 -1.13 -0.85 0.00 0.00 174.74 172.80 2qkb n SER 265 N 4.14 -0.11 0.00 1.40 3.41 -1.26 -5.13 113.62 116.06 2qkb n SER 265 Ca -0.25 -2.85 0.00 0.00 -0.26 0.00 0.00 58.87 55.50 2qkb n SER 265 Cb 0.52 1.27 0.00 0.00 -0.26 0.00 0.00 64.21 65.74 2qkb n SER 265 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qkb n GLY 266 N -0.49 0.15 2.99 5.00 0.00 -1.26 -4.93 105.19 106.65 2qkb n GLY 266 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2qkb n GLY 266 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qkb n PHE 267 N 0.00 -3.25 0.33 1.61 0.99 -1.26 -4.74 117.46 111.14 2qkb n PHE 267 Ca 0.00 1.30 0.22 0.00 -0.00 0.00 0.00 57.45 58.96 2qkb n PHE 267 Cb 0.00 -3.88 1.17 0.00 -1.00 0.00 0.00 39.48 35.77 2qkb n PHE 267 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 2qkb h ILE 268 N 1.51 0.05 -0.02 4.37 6.09 -2.00 -2.00 117.51 125.51 2qkb h ILE 268 Ca -0.06 0.00 0.03 0.00 -1.37 0.00 0.00 64.86 63.46 2qkb h ILE 268 Cb 1.04 0.98 -0.04 0.00 0.47 0.00 0.00 36.82 39.27 2qkb h ILE 268 CO 0.23 0.00 -0.21 1.23 -3.07 0.00 0.00 178.15 176.33 2qkb h GLY 269 N 0.00 -0.29 1.05 8.18 0.00 -1.99 0.14 103.07 110.17 2qkb h GLY 269 Ca 0.00 0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.54 2qkb h GLY 269 CO -0.00 -0.19 0.29 -0.57 0.00 0.00 0.00 176.54 176.07 2qkb h ASN 270 N -0.33 1.10 -0.65 0.19 -0.73 -1.67 -0.30 115.58 113.19 2qkb h ASN 270 Ca 0.07 -0.19 -0.05 0.00 1.87 0.00 0.00 56.30 58.00 2qkb h ASN 270 Cb 0.42 -0.29 -0.03 0.00 0.27 0.00 0.00 38.32 38.69 2qkb h ASN 270 CO -0.21 0.99 0.21 -0.33 -0.37 0.00 0.00 177.43 177.72 2qkb h GLU 271 N 1.15 1.01 -0.02 6.67 5.08 -1.33 1.00 114.58 128.14 2qkb h GLU 271 Ca 0.26 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2qkb h GLU 271 Cb 0.25 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2qkb h GLU 271 CO -0.02 0.88 0.01 0.93 -1.00 0.00 0.00 179.01 179.81 2qkb h GLU 272 N 0.94 0.03 -0.80 2.33 4.39 -0.42 0.29 114.58 121.33 2qkb h GLU 272 Ca 0.21 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.97 2qkb h GLU 272 Cb 0.29 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.87 2qkb h GLU 272 CO -0.01 0.19 0.48 0.00 -1.16 0.00 0.00 179.01 178.51 2qkb h ALA 273 N 0.84 1.11 0.07 3.43 0.00 -0.80 0.14 119.26 124.06 2qkb h ALA 273 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qkb h ALA 273 Cb 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2qkb h ALA 273 CO -0.00 0.18 -0.07 0.22 0.00 0.00 0.00 179.25 179.58 2qkb h ASP 274 N 0.86 -0.19 -0.91 0.00 1.82 -0.22 -0.90 116.42 116.88 2qkb h ASP 274 Ca 0.36 0.02 0.16 0.00 -0.39 0.00 0.00 57.03 57.18 2qkb h ASP 274 Cb 0.22 0.07 -0.10 0.00 0.68 0.00 0.00 39.33 40.20 2qkb h ASP 274 CO -0.19 -0.11 0.50 -0.09 -1.61 0.00 0.00 179.24 177.74 2qkb h ARG 275 N -0.16 0.67 -0.58 0.28 2.43 0.89 -0.53 114.38 117.39 2qkb h ARG 275 Ca 0.00 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 2qkb h ARG 275 Cb 0.15 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2qkb h ARG 275 CO -0.02 0.44 0.21 -0.07 -1.51 0.00 0.00 179.97 179.02 2qkb h LEU 276 N 0.69 0.81 -0.14 3.80 -0.00 0.04 -2.42 115.31 118.08 2qkb h LEU 276 Ca 0.50 -0.19 -0.01 0.00 -0.00 0.00 0.00 57.88 58.19 2qkb h LEU 276 Cb 0.73 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.17 2qkb h LEU 276 CO -0.37 0.78 0.05 0.00 -0.00 0.00 0.00 178.44 178.91 2qkb h ALA 277 N 1.06 0.19 0.00 1.53 0.00 0.22 -1.70 119.26 120.56 2qkb h ALA 277 Ca 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2qkb h ALA 277 Cb 0.24 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2qkb h ALA 277 CO -0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 179.25 178.99 2qkb h ARG 278 N 0.07 0.00 -0.03 0.00 3.08 -1.20 0.43 114.38 116.72 2qkb h ARG 278 Ca 0.05 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.91 2qkb h ARG 278 Cb 0.19 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.26 2qkb h ARG 278 CO -0.00 0.03 -0.71 0.93 -1.07 0.00 0.00 179.97 179.16 2qkb h GLU 279 N 0.00 0.54 0.00 0.04 5.08 -1.05 -3.03 114.58 116.16 2qkb h GLU 279 Ca -0.00 -0.53 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 2qkb h GLU 279 Cb 0.11 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2qkb h GLU 279 CO 0.00 1.16 0.00 0.41 -1.00 0.00 0.00 179.01 179.59 2qkb n GLY 280 N 0.97 -1.29 0.34 -3.84 0.00 -0.52 -3.11 105.19 97.73 2qkb n GLY 280 Ca -0.10 -0.06 0.22 0.00 0.00 0.00 0.00 46.02 46.08 2qkb n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkb h ALA 281 N 2.70 1.07 -3.47 4.61 0.00 -0.83 -3.11 119.26 120.23 2qkb h ALA 281 Ca 0.00 -0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.27 2qkb h ALA 281 Cb 0.41 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.79 2qkb h ALA 281 CO 0.00 -0.01 -0.71 -1.59 0.00 0.00 0.00 179.25 176.94 2qkb s LYS 282 N -4.20 1.39 0.00 0.00 0.00 -1.18 -4.49 119.74 111.25 2qkb s LYS 282 Ca -0.05 -1.85 0.00 0.00 0.00 0.00 0.00 55.97 54.07 2qkb s LYS 282 Cb 0.13 -2.90 0.00 0.00 0.00 0.00 0.00 37.83 35.06 2qkb s LYS 282 CO 0.42 -1.00 0.00 0.00 0.00 0.00 0.00 175.35 174.78 2qkb n GLN 283 N 4.12 0.00 -0.23 1.78 10.64 -1.26 -5.05 117.38 127.39 2qkb n GLN 283 Ca 0.03 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.20 2qkb n GLN 283 Cb 0.40 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.78 2qkb n GLN 283 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66