#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkb s SER 134 N 0.00 2.64 0.00 1.61 0.01 -1.26 -5.06 113.70 111.65 2qkb s SER 134 Ca 0.00 -0.62 0.00 0.00 1.31 0.00 0.00 55.95 56.64 2qkb s SER 134 Cb 0.00 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2qkb s SER 134 CO 0.00 0.13 0.00 0.00 0.41 0.00 0.00 173.24 173.78 2qkb n HIS 135 N 1.43 0.00 0.00 2.43 -0.00 -1.26 -1.15 115.22 116.67 2qkb n HIS 135 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 2qkb n HIS 135 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 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 1.28 -1.39 0.00 -1.26 -4.90 105.19 98.93 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 2.09 0.00 0.00 0.00 173.32 175.41 2qkb n ASP 138 N 0.00 3.76 -4.62 1.61 5.75 -1.26 -4.90 116.55 116.89 2qkb n ASP 138 Ca 0.00 -2.00 -0.35 0.00 -0.01 0.00 0.00 54.79 52.43 2qkb n ASP 138 Cb 0.00 -0.40 -0.10 0.00 -1.03 0.00 0.00 41.12 39.59 2qkb n ASP 138 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 2qkb s PHE 139 N -1.20 3.24 0.07 2.11 0.40 -1.26 -4.70 117.98 116.64 2qkb s PHE 139 Ca 0.45 0.04 -0.26 0.00 -0.60 0.00 0.00 56.93 56.57 2qkb s PHE 139 Cb 0.25 -2.14 -0.06 0.00 0.51 0.00 0.00 43.02 41.58 2qkb s PHE 139 CO 0.33 0.08 0.79 0.54 0.70 0.00 0.00 175.22 177.66 2qkb s VAL 140 N 0.65 4.66 0.02 -0.44 0.11 -1.14 -4.45 120.40 119.81 2qkb s VAL 140 Ca 0.04 1.69 -0.24 0.00 -2.93 0.00 0.00 61.98 60.55 2qkb s VAL 140 Cb -0.13 -4.14 -0.05 0.00 -1.53 0.00 0.00 36.38 30.53 2qkb s VAL 140 CO 0.01 0.38 0.73 -0.69 -3.33 0.00 0.00 175.10 172.21 2qkb s VAL 141 N -0.19 4.82 0.03 2.04 1.01 -0.30 -2.07 120.40 125.74 2qkb s VAL 141 Ca 0.39 1.55 0.02 0.00 0.00 0.00 0.00 61.98 63.94 2qkb s VAL 141 Cb -0.21 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.07 2qkb s VAL 141 CO 0.24 0.35 -0.06 0.54 0.00 0.00 0.00 175.10 176.17 2qkb s VAL 142 N 0.10 0.41 -0.06 2.92 0.11 0.06 -4.66 120.40 119.28 2qkb s VAL 142 Ca 0.38 -0.83 0.03 0.00 -2.93 0.00 0.00 61.98 58.63 2qkb s VAL 142 Cb -0.20 -0.46 -0.02 0.00 -1.53 0.00 0.00 36.38 34.17 2qkb s VAL 142 CO 0.21 -0.29 -0.16 -0.31 -3.33 0.00 0.00 175.10 171.22 2qkb s TYR 143 N -1.09 2.66 0.13 1.54 2.02 -0.41 -0.48 117.35 121.73 2qkb s TYR 143 Ca -0.08 -0.35 0.04 0.00 -0.37 0.00 0.00 57.07 56.31 2qkb s TYR 143 Cb -0.08 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 39.78 2qkb s TYR 143 CO 0.00 0.04 -0.10 0.95 -1.57 0.00 0.00 175.55 174.87 2qkb s THR 144 N -0.43 1.04 -0.16 -0.71 -4.23 -0.63 -0.60 115.64 109.92 2qkb s THR 144 Ca 0.05 -1.93 -0.29 0.00 -1.18 0.00 0.00 61.69 58.33 2qkb s THR 144 Cb -0.12 -1.70 0.11 0.00 1.34 0.00 0.00 72.50 72.13 2qkb s THR 144 CO 0.02 -0.72 0.92 -0.62 -0.54 0.00 0.00 174.62 173.68 2qkb s ASP 145 N -2.96 -0.46 0.32 3.99 3.68 -0.08 -4.43 116.67 116.73 2qkb s ASP 145 Ca 0.13 0.57 0.09 0.00 2.13 0.00 0.00 52.55 55.47 2qkb s ASP 145 Cb 0.02 0.47 -0.06 0.00 -1.45 0.00 0.00 42.92 41.89 2qkb s ASP 145 CO -0.00 -0.37 -0.10 -0.83 0.13 0.00 0.00 175.17 174.00 2qkb s GLY 146 N -0.90 2.08 0.26 2.66 0.00 -1.26 -0.87 107.32 109.30 2qkb s GLY 146 Ca -0.03 -2.03 -0.10 0.00 0.00 0.00 0.00 44.72 42.56 2qkb s GLY 146 CO 0.02 -1.98 0.46 0.00 0.00 0.00 0.00 173.10 171.60 2qkb s SER 149 N 2.91 6.91 -1.22 0.00 1.04 0.30 -3.24 113.70 120.41 2qkb s SER 149 Ca 0.11 2.30 -0.08 0.00 0.48 0.00 0.00 55.95 58.76 2qkb s SER 149 Cb -0.10 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.41 2qkb s SER 149 CO -0.17 -0.40 1.06 -1.20 0.98 0.00 0.00 173.24 173.51 2qkb n SER 150 N 0.62 -5.86 -4.66 7.02 7.64 -1.26 -1.77 113.62 115.35 2qkb n SER 150 Ca 0.02 -0.49 -0.42 0.00 1.01 0.00 0.00 58.87 58.99 2qkb n SER 150 Cb 0.46 -4.57 -0.03 0.00 -1.01 0.00 0.00 64.21 59.06 2qkb n SER 150 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2qkb s ASN 151 N -3.31 6.54 0.00 6.43 2.47 -1.20 -1.43 114.94 124.44 2qkb s ASN 151 Ca 0.52 2.38 0.00 0.00 0.42 0.00 0.00 52.86 56.18 2qkb s ASN 151 Cb -0.23 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 2qkb s ASN 151 CO 0.65 -1.02 0.00 0.61 -3.72 0.00 0.00 177.10 173.63 2qkb n GLY 152 N 4.36 0.44 0.00 1.21 0.00 -1.26 -5.03 105.19 104.91 2qkb n GLY 152 Ca 0.19 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2qkb n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkb n ARG 153 N -2.96 3.79 -0.00 1.61 1.74 -0.51 -5.07 116.66 115.26 2qkb n ARG 153 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 2qkb n ARG 153 Cb 0.00 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.32 2qkb n ARG 153 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2qkb h ARG 154 N 0.00 0.00 -2.54 5.56 2.43 -1.96 -3.41 114.38 114.46 2qkb h ARG 154 Ca 0.00 0.00 -0.60 0.00 -0.81 0.00 0.00 59.98 58.57 2qkb h ARG 154 Cb 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 29.97 29.15 2qkb h ARG 154 CO 0.00 0.48 -0.79 0.54 -1.51 0.00 0.00 179.97 178.69 2qkb n ARG 155 N -3.03 1.23 -2.31 0.20 1.74 -1.26 -5.10 116.66 108.12 2qkb n ARG 155 Ca -0.14 -3.89 -0.40 0.00 -0.77 0.00 0.00 57.85 52.65 2qkb n ARG 155 Cb 0.99 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 30.48 2qkb n ARG 155 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2qkb s PRO 156 N -1.08 4.41 -0.19 5.56 0.02 -1.26 -4.68 135.00 137.77 2qkb s PRO 156 Ca 0.32 1.96 -0.01 0.00 0.02 0.00 0.00 61.00 63.28 2qkb s PRO 156 Cb 0.05 -3.03 0.05 0.00 0.02 0.00 0.00 34.50 31.59 2qkb s PRO 156 CO -0.15 -0.05 -0.02 1.03 -0.33 0.00 0.00 177.00 177.48 2qkb s ARG 157 N -1.77 1.23 -0.05 5.54 0.52 -0.73 -4.89 118.95 118.80 2qkb s ARG 157 Ca 0.49 -0.62 0.01 0.00 -0.52 0.00 0.00 55.73 55.09 2qkb s ARG 157 Cb -0.34 -2.19 -0.03 0.00 0.52 0.00 0.00 34.95 32.90 2qkb s ARG 157 CO 0.45 -0.54 -0.07 0.00 0.02 0.00 0.00 175.30 175.15 2qkb s ALA 158 N 1.64 2.99 0.09 2.13 0.00 -1.26 -0.54 121.76 126.81 2qkb s ALA 158 Ca -0.02 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.05 2qkb s ALA 158 Cb -0.17 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 2qkb s ALA 158 CO -0.07 0.58 -0.07 0.20 0.00 0.00 0.00 175.76 176.40 2qkb s GLY 159 N -0.93 0.72 0.17 0.00 0.00 -0.27 -1.41 107.32 105.60 2qkb s GLY 159 Ca 0.13 -1.25 0.09 0.00 0.00 0.00 0.00 44.72 43.69 2qkb s GLY 159 CO 0.03 -1.34 -0.09 -0.26 0.00 0.00 0.00 173.10 171.43 2qkb s ILE 160 N -3.23 3.23 -0.19 0.90 -4.36 -0.07 -1.46 121.20 116.02 2qkb s ILE 160 Ca 0.08 -1.59 -0.12 0.00 -0.26 0.00 0.00 60.65 58.77 2qkb s ILE 160 Cb 0.03 -2.59 0.06 0.00 1.25 0.00 0.00 42.46 41.21 2qkb s ILE 160 CO -0.04 -0.07 0.47 -0.83 0.24 0.00 0.00 174.94 174.71 2qkb s GLY 161 N -2.73 -0.39 -0.05 6.27 0.00 -0.05 -2.16 107.32 108.22 2qkb s GLY 161 Ca 0.24 1.65 0.02 0.00 0.00 0.00 0.00 44.72 46.63 2qkb s GLY 161 CO 0.15 1.71 -0.09 0.54 0.00 0.00 0.00 173.10 175.42 2qkb s VAL 162 N 1.23 0.83 -0.15 1.40 0.11 -0.55 -0.90 120.40 122.37 2qkb s VAL 162 Ca -0.08 -0.32 0.02 0.00 -2.93 0.00 0.00 61.98 58.67 2qkb s VAL 162 Cb -0.07 -0.78 0.01 0.00 -1.53 0.00 0.00 36.38 34.02 2qkb s VAL 162 CO -0.12 0.28 -0.19 -0.47 -3.33 0.00 0.00 175.10 171.27 2qkb s TYR 163 N 0.62 2.52 -0.05 1.54 6.14 0.23 -1.12 117.35 127.23 2qkb s TYR 163 Ca -0.11 -1.33 0.15 0.00 0.64 0.00 0.00 57.07 56.42 2qkb s TYR 163 Cb -0.13 -1.75 -0.22 0.00 0.42 0.00 0.00 41.96 40.28 2qkb s TYR 163 CO 0.02 -0.65 0.33 0.91 0.64 0.00 0.00 175.55 176.80 2qkb n TRP 164 N 4.31 0.00 0.00 4.97 7.02 -1.26 -1.29 117.44 131.20 2qkb n TRP 164 Ca -0.20 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.28 2qkb n TRP 164 Cb 0.51 -0.32 0.00 0.00 -2.42 0.00 0.00 31.31 29.08 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 1.66 0.34 3.70 6.99 0.00 -1.26 -3.99 105.19 112.64 2qkb n GLY 165 Ca -0.02 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.38 2qkb n GLY 165 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2qkb s PRO 166 N -2.00 4.21 -2.14 1.61 0.02 -1.26 -2.36 135.00 133.08 2qkb s PRO 166 Ca 0.00 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.35 2qkb s PRO 166 Cb 0.00 -3.41 0.00 0.00 0.02 0.00 0.00 34.50 31.11 2qkb s PRO 166 CO 0.00 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.41 2qkb n GLY 167 N 3.88 1.71 3.75 0.52 0.00 -1.26 -4.79 105.19 109.00 2qkb n GLY 167 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.77 3.12 0.54 1.61 2.46 -1.00 -4.88 115.29 114.37 2qkb s HIS 168 Ca 0.00 1.23 0.19 0.00 0.47 0.00 0.00 55.06 56.95 2qkb s HIS 168 Cb 0.00 -3.69 1.41 0.00 -0.13 0.00 0.00 32.58 30.17 2qkb s HIS 168 CO 0.00 -2.10 2.18 -1.00 -2.47 0.00 0.00 174.74 171.35 2qkb h PRO 169 N 4.58 0.00 -0.00 2.88 0.13 -1.92 -2.74 132.00 134.93 2qkb h PRO 169 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2qkb h PRO 169 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2qkb h PRO 169 CO 0.73 0.00 -0.05 1.28 -0.23 0.00 0.00 178.00 179.74 2qkb n LEU 170 N -4.37 0.25 -4.75 1.56 4.32 -1.26 -4.92 117.00 107.83 2qkb n LEU 170 Ca -0.03 0.09 -0.41 0.00 -0.02 0.00 0.00 56.01 55.64 2qkb n LEU 170 Cb 0.09 -0.18 -0.02 0.00 -1.62 0.00 0.00 43.42 41.68 2qkb n LEU 170 CO 0.32 0.05 1.06 0.20 -1.22 0.00 0.00 177.39 177.80 2qkb s ASN 171 N -2.41 6.73 0.03 -1.43 0.01 -1.04 -4.84 114.94 111.98 2qkb s ASN 171 Ca 0.32 2.61 -0.01 0.00 -0.71 0.00 0.00 52.86 55.07 2qkb s ASN 171 Cb 0.20 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.22 2qkb s ASN 171 CO 0.45 -0.64 -0.01 0.68 -1.51 0.00 0.00 177.10 176.07 2qkb s VAL 172 N -0.15 0.14 -0.28 1.60 -7.23 -0.28 -4.98 120.40 109.22 2qkb s VAL 172 Ca 0.57 -1.14 -0.01 0.00 -1.81 0.00 0.00 61.98 59.59 2qkb s VAL 172 Cb -0.40 -0.64 0.13 0.00 0.56 0.00 0.00 36.38 36.03 2qkb s VAL 172 CO 0.44 -0.63 0.29 -0.83 -0.31 0.00 0.00 175.10 174.06 2qkb s GLY 173 N -1.88 -0.14 0.28 2.32 0.00 -1.26 -1.48 107.32 105.16 2qkb s GLY 173 Ca -0.09 -0.19 0.03 0.00 0.00 0.00 0.00 44.72 44.46 2qkb s GLY 173 CO -0.03 2.60 0.05 -0.26 0.00 0.00 0.00 173.10 175.45 2qkb s ILE 174 N 2.37 0.95 0.11 0.90 -4.36 -0.92 -3.96 121.20 116.28 2qkb s ILE 174 Ca 0.09 -2.01 -0.30 0.00 -0.26 0.00 0.00 60.65 58.17 2qkb s ILE 174 Cb -0.14 -2.62 -0.06 0.00 1.25 0.00 0.00 42.46 40.89 2qkb s ILE 174 CO -0.30 -0.09 1.04 -0.60 0.24 0.00 0.00 174.94 175.23 2qkb s ARG 175 N -3.93 4.60 -0.26 0.37 6.06 -0.70 -0.90 118.95 124.19 2qkb s ARG 175 Ca 0.35 1.58 -0.29 0.00 -2.50 0.00 0.00 55.73 54.87 2qkb s ARG 175 Cb 0.08 -3.35 0.00 0.00 0.06 0.00 0.00 34.95 31.73 2qkb s ARG 175 CO 0.13 0.06 1.23 -1.17 -2.50 0.00 0.00 175.30 173.05 2qkb s LEU 176 N 0.20 3.99 0.56 -0.88 2.96 -0.50 -4.85 118.68 120.16 2qkb s LEU 176 Ca 0.50 1.32 -0.17 0.00 -0.22 0.00 0.00 54.13 55.56 2qkb s LEU 176 Cb -0.26 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.84 2qkb s LEU 176 CO 0.31 -0.93 1.07 -2.84 -1.32 0.00 0.00 176.35 172.64 2qkb s PRO 177 N 3.83 3.39 0.65 0.98 0.02 -1.26 -4.83 135.00 137.78 2qkb s PRO 177 Ca 0.53 1.34 0.00 0.00 0.02 0.00 0.00 61.00 62.89 2qkb s PRO 177 Cb -0.17 -2.03 0.00 0.00 0.02 0.00 0.00 34.50 32.31 2qkb s PRO 177 CO 0.18 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 2qkb n GLY 178 N -0.53 -1.65 3.68 0.52 0.00 -1.26 -4.92 105.19 101.04 2qkb n GLY 178 Ca 0.10 -1.77 -0.44 0.00 0.00 0.00 0.00 46.02 43.90 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 2.56 -2.85 1.61 0.63 -1.26 -4.94 116.66 112.42 2qkb n ARG 179 Ca 0.00 0.93 -0.43 0.00 -0.92 0.00 0.00 57.85 57.44 2qkb n ARG 179 Cb 0.00 -2.81 -0.04 0.00 0.45 0.00 0.00 32.46 30.06 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 3.07 3.30 0.10 -0.14 -1.52 -1.26 -4.89 119.66 118.31 2qkb s GLN 180 Ca 0.85 -0.35 -0.13 0.00 -1.95 0.00 0.00 55.36 53.79 2qkb s GLN 180 Cb -0.55 -4.08 0.02 0.00 -0.22 0.00 0.00 33.01 28.18 2qkb s GLN 180 CO 0.42 -1.52 0.30 0.95 -0.25 0.00 0.00 175.29 175.19 2qkb s THR 181 N 3.94 0.10 0.12 -0.19 -4.23 -1.26 -4.82 115.64 109.30 2qkb s THR 181 Ca 0.29 -0.83 -0.20 0.00 -1.18 0.00 0.00 61.69 59.77 2qkb s THR 181 Cb -0.13 -1.20 -0.08 0.00 1.34 0.00 0.00 72.50 72.43 2qkb s THR 181 CO 0.18 -0.46 1.76 -0.55 -0.54 0.00 0.00 174.62 175.01 2qkb h ASN 182 N 2.65 0.14 -0.46 3.99 -1.07 -1.90 -2.50 115.58 116.43 2qkb h ASN 182 Ca -0.34 0.00 0.09 0.00 0.07 0.00 0.00 56.30 56.13 2qkb h ASN 182 Cb 1.22 -0.02 -0.09 0.00 -2.07 0.00 0.00 38.32 37.36 2qkb h ASN 182 CO 0.50 0.11 -0.12 1.56 0.07 0.00 0.00 177.43 179.56 2qkb h GLN 183 N 0.19 -0.00 -0.48 4.14 1.08 -1.97 0.23 115.11 118.31 2qkb h GLN 183 Ca 0.07 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.17 2qkb h GLN 183 Cb 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 2qkb h GLN 183 CO -0.04 -0.00 -0.09 0.00 -0.95 0.00 0.00 178.83 177.75 2qkb h ARG 184 N -0.00 0.87 -0.61 1.46 3.08 -1.89 -1.28 114.38 116.01 2qkb h ARG 184 Ca 0.22 -0.29 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 2qkb h ARG 184 Cb 0.34 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 2qkb h ARG 184 CO -0.48 0.92 0.15 0.00 -1.07 0.00 0.00 179.97 179.49 2qkb h ALA 185 N 1.11 1.11 -0.26 0.04 0.00 -0.79 0.64 119.26 121.10 2qkb h ALA 185 Ca 0.13 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2qkb h ALA 185 Cb 0.60 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2qkb h ALA 185 CO 0.04 0.60 -0.12 0.93 0.00 0.00 0.00 179.25 180.70 2qkb h GLU 186 N 0.91 0.54 -0.06 0.00 4.39 -0.74 0.27 114.58 119.89 2qkb h GLU 186 Ca 0.20 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2qkb h GLU 186 Cb 0.33 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2qkb h GLU 186 CO 0.00 0.79 -0.01 0.82 -1.16 0.00 0.00 179.01 179.44 2qkb h ILE 187 N 0.28 1.29 0.00 3.13 2.04 -0.84 -3.01 117.51 120.40 2qkb h ILE 187 Ca 0.06 -0.91 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 2qkb h ILE 187 Cb 0.62 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 2qkb h ILE 187 CO 0.04 0.25 -0.17 0.45 0.00 0.00 0.00 178.15 178.71 2qkb h HIS 188 N -0.22 0.00 -0.09 1.37 3.86 0.32 -0.94 115.15 119.46 2qkb h HIS 188 Ca 0.02 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.08 2qkb h HIS 188 Cb 0.40 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 2qkb h HIS 188 CO 0.05 0.17 -0.59 0.00 0.86 0.00 0.00 177.93 178.43 2qkb h ALA 189 N 1.83 0.83 -0.09 2.45 0.00 -0.46 -2.04 119.26 121.78 2qkb h ALA 189 Ca -0.00 -0.53 -0.16 0.00 0.00 0.00 0.00 54.91 54.21 2qkb h ALA 189 Cb 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qkb h ALA 189 CO 0.02 0.71 -0.65 0.00 0.00 0.00 0.00 179.25 179.34 2qkb h ALA 190 N 1.16 0.73 0.09 0.00 0.00 -1.14 -2.89 119.26 117.21 2qkb h ALA 190 Ca -0.00 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 2qkb h ALA 190 Cb 1.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2qkb h ALA 190 CO 0.09 0.74 -0.04 0.00 0.00 0.00 0.00 179.25 180.05 2qkb h LYS 192 N -0.18 0.11 -0.89 0.00 1.63 -1.30 -0.71 116.57 115.24 2qkb h LYS 192 Ca -0.01 -0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.84 2qkb h LYS 192 Cb 0.15 -0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.69 2qkb h LYS 192 CO 0.02 0.08 0.56 0.00 -3.45 0.00 0.00 179.45 176.65 2qkb h ALA 193 N 1.54 1.21 -0.33 5.00 0.00 -1.42 -0.70 119.26 124.56 2qkb h ALA 193 Ca 0.31 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 2qkb h ALA 193 Cb 0.49 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2qkb h ALA 193 CO -0.50 0.33 -0.04 0.82 0.00 0.00 0.00 179.25 179.86 2qkb h ILE 194 N 1.03 1.27 0.10 0.00 1.08 -0.95 -1.34 117.51 118.70 2qkb h ILE 194 Ca 0.38 -1.04 0.02 0.00 -0.39 0.00 0.00 64.86 63.83 2qkb h ILE 194 Cb 0.14 1.29 -0.03 0.00 -3.07 0.00 0.00 36.82 35.15 2qkb h ILE 194 CO -0.16 0.34 -0.22 -0.33 -0.69 0.00 0.00 178.15 177.09 2qkb h GLU 195 N 0.39 -0.39 -0.73 2.37 5.08 -0.73 -1.00 114.58 119.58 2qkb h GLU 195 Ca 0.09 0.03 0.16 0.00 -1.00 0.00 0.00 59.36 58.63 2qkb h GLU 195 Cb 0.51 0.09 -0.11 0.00 0.50 0.00 0.00 28.75 29.74 2qkb h GLU 195 CO 0.02 -0.26 0.17 1.96 -1.00 0.00 0.00 179.01 179.91 2qkb h GLN 196 N -0.40 0.26 0.09 2.33 4.20 -1.06 -0.98 115.11 119.55 2qkb h GLN 196 Ca 0.03 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.73 2qkb h GLN 196 Cb 0.43 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2qkb h GLN 196 CO -0.13 0.17 -0.12 0.00 -0.67 0.00 0.00 178.83 178.09 2qkb h ALA 197 N 1.60 -0.21 -0.88 3.87 0.00 -0.30 -1.27 119.26 122.07 2qkb h ALA 197 Ca 0.41 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.41 2qkb h ALA 197 Cb 0.69 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2qkb h ALA 197 CO -0.50 -0.64 0.51 0.87 0.00 0.00 0.00 179.25 179.49 2qkb h LYS 198 N -0.25 0.77 -0.55 0.00 1.57 -0.56 0.40 116.57 117.95 2qkb h LYS 198 Ca 0.01 -0.05 0.16 0.00 -1.87 0.00 0.00 60.65 58.91 2qkb h LYS 198 Cb 0.25 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 2qkb h LYS 198 CO -0.05 0.51 0.46 1.15 -0.57 0.00 0.00 179.45 180.95 2qkb h THR 199 N 0.79 0.54 -0.50 -0.16 2.02 -0.04 0.27 112.91 115.83 2qkb h THR 199 Ca 0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.63 2qkb h THR 199 Cb 0.50 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2qkb h THR 199 CO -0.29 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.60 2qkb n GLN 200 N -4.06 3.45 -3.73 6.66 1.13 0.13 -4.94 117.38 116.01 2qkb n GLN 200 Ca 0.10 -2.73 -0.25 0.00 -1.94 0.00 0.00 57.00 52.18 2qkb n GLN 200 Cb 0.68 -1.77 0.05 0.00 0.11 0.00 0.00 30.24 29.31 2qkb n GLN 200 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2qkb n ASN 201 N 0.64 -4.28 -4.75 1.08 4.13 0.95 -4.96 115.26 108.07 2qkb n ASN 201 Ca 0.22 -0.70 -0.36 0.00 1.68 0.00 0.00 54.58 55.42 2qkb n ASN 201 Cb 0.81 -4.38 -0.08 0.00 -1.54 0.00 0.00 39.78 34.59 2qkb n ASN 201 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2qkb s ILE 202 N -3.38 4.97 0.00 2.41 1.01 -0.39 -4.96 121.20 120.85 2qkb s ILE 202 Ca 0.45 0.01 0.00 0.00 0.00 0.00 0.00 60.65 61.11 2qkb s ILE 202 Cb -0.21 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.09 2qkb s ILE 202 CO 0.79 0.56 0.00 -0.46 0.00 0.00 0.00 174.94 175.83 2qkb n ASN 203 N 2.54 1.34 -4.29 3.58 6.94 -1.26 -4.17 115.26 119.94 2qkb n ASN 203 Ca -0.18 -0.23 -0.33 0.00 -0.02 0.00 0.00 54.58 53.82 2qkb n ASN 203 Cb 0.54 0.72 -0.15 0.00 -2.36 0.00 0.00 39.78 38.52 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 -0.99 3.24 -0.15 -3.83 1.02 -1.26 0.02 119.74 117.79 2qkb s LYS 204 Ca 0.00 -0.76 -0.11 0.00 0.02 0.00 0.00 55.97 55.12 2qkb s LYS 204 Cb 0.00 -2.56 0.04 0.00 -0.52 0.00 0.00 37.83 34.80 2qkb s LYS 204 CO 0.00 0.12 0.38 -1.17 -0.92 0.00 0.00 175.35 173.76 2qkb s LEU 205 N 0.55 0.35 -0.37 3.17 2.96 -0.30 -2.88 118.68 122.17 2qkb s LEU 205 Ca -0.10 0.78 -0.06 0.00 -0.22 0.00 0.00 54.13 54.53 2qkb s LEU 205 Cb -0.16 1.27 0.06 0.00 0.50 0.00 0.00 46.19 47.86 2qkb s LEU 205 CO 0.04 -0.15 0.15 -0.69 -1.32 0.00 0.00 176.35 174.38 2qkb s VAL 206 N 0.63 3.73 -0.34 1.68 1.01 -0.88 -0.16 120.40 126.08 2qkb s VAL 206 Ca -0.03 -1.38 -0.13 0.00 0.00 0.00 0.00 61.98 60.43 2qkb s VAL 206 Cb -0.05 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 2qkb s VAL 206 CO -0.04 -0.34 0.27 -0.22 0.00 0.00 0.00 175.10 174.77 2qkb s LEU 207 N 1.35 4.47 -0.26 3.92 0.20 -0.83 -0.76 118.68 126.77 2qkb s LEU 207 Ca 0.01 -0.34 -0.11 0.00 0.69 0.00 0.00 54.13 54.37 2qkb s LEU 207 Cb -0.21 -2.19 -0.05 0.00 -0.43 0.00 0.00 46.19 43.31 2qkb s LEU 207 CO 0.01 -0.25 0.19 -0.31 -0.29 0.00 0.00 176.35 175.70 2qkb s TYR 208 N 1.81 3.26 0.02 5.38 4.12 0.37 -4.47 117.35 127.84 2qkb s TYR 208 Ca 0.08 0.18 -0.03 0.00 0.02 0.00 0.00 57.07 57.32 2qkb s TYR 208 Cb -0.17 -2.35 -0.02 0.00 -1.52 0.00 0.00 41.96 37.90 2qkb s TYR 208 CO 0.11 -0.07 0.04 -0.08 0.02 0.00 0.00 175.55 175.56 2qkb s THR 209 N 1.50 0.12 -1.55 -0.71 -1.32 -1.26 -1.61 115.64 110.82 2qkb s THR 209 Ca 0.08 -1.00 0.13 0.00 -1.21 0.00 0.00 61.69 59.68 2qkb s THR 209 Cb -0.15 -0.59 0.45 0.00 -1.51 0.00 0.00 72.50 70.70 2qkb s THR 209 CO 0.08 -0.55 1.33 -0.46 -2.21 0.00 0.00 174.62 172.81 2qkb n ASN 210 N 1.21 2.97 -4.98 8.08 0.23 -1.23 -0.95 115.26 120.59 2qkb n ASN 210 Ca -0.21 -2.18 -0.18 0.00 -0.53 0.00 0.00 54.58 51.47 2qkb n ASN 210 Cb 0.57 -0.41 -0.00 0.00 -2.08 0.00 0.00 39.78 37.86 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 -0.84 5.68 0.00 0.53 0.15 -1.26 -4.79 113.70 113.16 2qkb s SER 211 Ca 0.32 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2qkb s SER 211 Cb 0.19 -0.86 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 2qkb s SER 211 CO 0.18 -0.62 0.00 0.33 1.20 0.00 0.00 173.24 174.33 2qkb n PHE 213 N -1.72 0.00 0.09 3.44 7.35 -1.26 -1.78 117.46 123.58 2qkb n PHE 213 Ca 0.04 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.60 2qkb n PHE 213 Cb 0.59 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 40.35 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 0.92 0.60 -2.13 2.02 -1.94 0.22 112.91 112.59 2qkb h THR 214 Ca 0.00 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.07 2qkb h THR 214 Cb 0.00 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 67.38 2qkb h THR 214 CO 0.00 0.02 -0.38 0.40 0.37 0.00 0.00 175.52 175.93 2qkb h ILE 215 N -0.19 0.00 -0.73 3.11 2.04 -1.76 -0.54 117.51 119.43 2qkb h ILE 215 Ca -0.02 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.99 2qkb h ILE 215 Cb 0.15 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.13 2qkb h ILE 215 CO 0.02 0.00 0.23 0.78 0.00 0.00 0.00 178.15 179.19 2qkb h ASN 216 N -0.92 0.13 0.42 1.72 -0.26 -1.83 0.18 115.58 115.02 2qkb h ASN 216 Ca -0.08 0.13 -0.01 0.00 -0.56 0.00 0.00 56.30 55.78 2qkb h ASN 216 Cb 0.74 0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 38.13 2qkb h ASN 216 CO 0.07 0.03 -0.34 1.23 -1.06 0.00 0.00 177.43 177.36 2qkb h GLY 217 N 0.34 -0.84 2.00 2.83 0.00 -0.71 -0.41 103.07 106.29 2qkb h GLY 217 Ca 0.41 0.39 -0.11 0.00 0.00 0.00 0.00 47.33 48.02 2qkb h GLY 217 CO -0.45 -0.30 -0.50 1.19 0.00 0.00 0.00 176.54 176.47 2qkb h ILE 218 N -0.76 1.08 -0.00 2.60 6.09 -0.35 -2.15 117.51 124.02 2qkb h ILE 218 Ca -0.04 -1.93 0.00 0.00 -1.37 0.00 0.00 64.86 61.52 2qkb h ILE 218 Cb 0.66 2.14 0.00 0.00 0.47 0.00 0.00 36.82 40.09 2qkb h ILE 218 CO -0.02 0.49 -0.77 0.35 -3.07 0.00 0.00 178.15 175.14 2qkb n THR 219 N -3.53 0.00 0.00 2.19 -2.24 0.56 -4.76 114.28 106.50 2qkb n THR 219 Ca -0.00 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2qkb n THR 219 Cb 0.61 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 2qkb n THR 219 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2qkb n ASN 220 N -1.05 0.00 -0.21 3.42 3.02 -0.21 -4.99 115.26 115.23 2qkb n ASN 220 Ca 0.06 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.67 2qkb n ASN 220 Cb 0.37 0.00 0.13 0.00 -0.61 0.00 0.00 39.78 39.67 2qkb n ASN 220 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2qkb n TRP 221 N -0.41 0.29 0.17 3.10 8.01 -0.89 -1.64 117.44 126.07 2qkb n TRP 221 Ca 0.00 0.71 0.10 0.00 -1.31 0.00 0.00 57.50 57.00 2qkb n TRP 221 Cb 0.00 -0.89 0.62 0.00 -2.01 0.00 0.00 31.31 29.03 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 0.00 0.96 0.27 -0.99 -1.51 -1.64 0.96 116.25 114.30 2qkb h VAL 222 Ca 0.32 -0.03 -0.01 0.00 -1.23 0.00 0.00 66.70 65.75 2qkb h VAL 222 Cb 0.58 0.87 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 2qkb h VAL 222 CO -0.58 0.01 -0.13 1.56 -1.23 0.00 0.00 177.57 177.21 2qkb h GLN 223 N 0.08 -0.35 -0.28 5.19 4.20 -1.59 -2.07 115.11 120.29 2qkb h GLN 223 Ca 0.07 0.02 -0.15 0.00 0.06 0.00 0.00 58.65 58.66 2qkb h GLN 223 Cb 0.20 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 2qkb h GLN 223 CO -0.01 -0.20 -0.44 0.78 -0.67 0.00 0.00 178.83 178.29 2qkb h GLY 224 N -0.41 0.76 2.00 3.46 0.00 -1.56 -2.90 103.07 104.42 2qkb h GLY 224 Ca -0.04 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.49 2qkb h GLY 224 CO 0.06 0.72 -0.02 1.49 0.00 0.00 0.00 176.54 178.80 2qkb h TRP 225 N 0.56 0.00 0.00 5.60 6.55 -0.64 -1.49 115.95 126.53 2qkb h TRP 225 Ca 0.04 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.82 2qkb h TRP 225 Cb 0.99 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.28 2qkb h TRP 225 CO 0.05 0.02 -0.28 0.87 -1.05 0.00 0.00 178.44 178.05 2qkb h LYS 226 N 0.00 0.00 -1.69 0.49 1.79 -1.16 0.32 116.57 116.32 2qkb h LYS 226 Ca -0.00 0.00 -0.69 0.00 -2.18 0.00 0.00 60.65 57.78 2qkb h LYS 226 Cb 0.06 0.00 -0.33 0.00 -1.58 0.00 0.00 32.23 30.38 2qkb h LYS 226 CO 0.00 0.24 0.33 1.63 -1.08 0.00 0.00 179.45 180.58 2qkb n LYS 227 N -3.15 3.03 -0.12 3.15 5.02 -0.56 -4.44 118.16 121.08 2qkb n LYS 227 Ca 0.03 -3.88 -0.00 0.00 -2.02 0.00 0.00 58.31 52.44 2qkb n LYS 227 Cb 0.63 -2.27 -0.00 0.00 -0.02 0.00 0.00 35.03 33.38 2qkb n LYS 227 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2qkb n ASN 228 N -0.56 -0.01 -2.66 4.39 6.94 -1.23 -5.00 115.26 117.14 2qkb n ASN 228 Ca 0.49 -0.04 -0.20 0.00 -0.02 0.00 0.00 54.58 54.81 2qkb n ASN 228 Cb 0.45 0.00 0.03 0.00 -2.36 0.00 0.00 39.78 37.91 2qkb n ASN 228 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qkb n GLY 229 N 0.00 -0.37 3.52 4.83 0.00 -1.23 -3.42 105.19 108.52 2qkb n GLY 229 Ca -0.00 0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 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 -4.37 -2.16 -5.16 1.61 7.02 0.11 -4.92 117.44 109.58 2qkb n TRP 230 Ca -0.10 0.63 -0.30 0.00 -1.02 0.00 0.00 57.50 56.71 2qkb n TRP 230 Cb 0.61 -3.64 -0.17 0.00 -2.42 0.00 0.00 31.31 25.69 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 -5.25 2.54 1.21 -0.99 3.01 -1.22 -2.47 119.74 116.58 2qkb s LYS 231 Ca 0.41 -0.83 -0.13 0.00 -1.01 0.00 0.00 55.97 54.40 2qkb s LYS 231 Cb -0.12 -2.08 0.31 0.00 -1.01 0.00 0.00 37.83 34.94 2qkb s LYS 231 CO 0.82 0.28 1.01 -0.08 0.51 0.00 0.00 175.35 177.89 2qkb s THR 232 N 0.06 1.98 -1.29 2.17 -1.32 0.58 -4.83 115.64 112.99 2qkb s THR 232 Ca -0.09 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 60.59 2qkb s THR 232 Cb -0.15 -2.01 0.29 0.00 -1.51 0.00 0.00 72.50 69.13 2qkb s THR 232 CO 0.05 0.00 1.63 -1.54 -2.21 0.00 0.00 174.62 172.55 2qkb n SER 233 N -5.09 0.00 -2.36 8.08 3.41 -1.26 -2.32 113.62 114.08 2qkb n SER 233 Ca 0.02 0.16 -0.31 0.00 -0.26 0.00 0.00 58.87 58.48 2qkb n SER 233 Cb 0.54 -0.35 0.04 0.00 -0.26 0.00 0.00 64.21 64.18 2qkb n SER 233 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qkb n ALA 234 N -1.35 5.76 -0.14 7.33 0.00 -1.26 -4.93 120.51 125.92 2qkb n ALA 234 Ca 0.08 -3.82 0.00 0.00 0.00 0.00 0.00 53.44 49.70 2qkb n ALA 234 Cb 0.18 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 -0.72 0.00 4.01 0.00 0.00 -0.98 -4.89 105.19 102.61 2qkb n GLY 235 Ca 0.52 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.30 2qkb n GLY 235 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qkb s LYS 236 N -0.27 1.60 -0.13 1.61 2.20 -1.26 -4.73 119.74 118.76 2qkb s LYS 236 Ca 0.00 -1.33 -0.18 0.00 -0.36 0.00 0.00 55.97 54.10 2qkb s LYS 236 Cb 0.00 -2.37 -0.04 0.00 -1.51 0.00 0.00 37.83 33.91 2qkb s LYS 236 CO 0.00 -1.50 0.49 -1.83 -0.36 0.00 0.00 175.35 172.16 2qkb s GLU 237 N -5.13 4.32 -0.31 4.03 -1.05 -1.26 0.22 118.70 119.52 2qkb s GLU 237 Ca 0.68 0.47 -0.38 0.00 -0.15 0.00 0.00 54.97 55.58 2qkb s GLU 237 Cb -0.04 -3.46 -0.14 0.00 -0.44 0.00 0.00 34.13 30.06 2qkb s GLU 237 CO 0.45 0.11 1.99 0.28 0.95 0.00 0.00 175.26 179.03 2qkb n VAL 238 N 3.81 0.26 0.05 1.83 0.31 -1.03 -4.79 118.33 118.77 2qkb n VAL 238 Ca -0.06 -0.15 0.02 0.00 -0.01 0.00 0.00 64.34 64.14 2qkb n VAL 238 Cb 0.51 -1.42 0.37 0.00 -0.91 0.00 0.00 33.84 32.39 2qkb n VAL 238 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2qkb h ILE 239 N 6.21 1.16 -0.78 2.52 2.04 -1.94 -3.14 117.51 123.59 2qkb h ILE 239 Ca -0.35 -0.61 -0.35 0.00 1.00 0.00 0.00 64.86 64.54 2qkb h ILE 239 Cb 1.32 0.93 -0.21 0.00 -0.74 0.00 0.00 36.82 38.12 2qkb h ILE 239 CO 1.00 0.21 0.39 0.59 0.00 0.00 0.00 178.15 180.34 2qkb n ASN 240 N -4.33 3.82 -0.24 1.72 4.13 -1.26 -4.70 115.26 114.39 2qkb n ASN 240 Ca 0.01 -3.51 0.04 0.00 1.68 0.00 0.00 54.58 52.80 2qkb n ASN 240 Cb 0.20 -0.76 0.14 0.00 -1.54 0.00 0.00 39.78 37.82 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 1.50 0.11 0.00 3.52 3.64 -1.94 0.33 116.57 123.72 2qkb h LYS 241 Ca 0.43 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.77 2qkb h LYS 241 Cb 2.45 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 34.24 2qkb h LYS 241 CO 0.84 0.07 -0.16 0.93 -2.27 0.00 0.00 179.45 178.86 2qkb h GLU 242 N 0.11 0.00 0.10 1.90 5.08 -1.90 0.39 114.58 120.26 2qkb h GLU 242 Ca 0.39 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.46 2qkb h GLU 242 Cb 0.67 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.95 2qkb h GLU 242 CO -0.63 0.16 -1.20 -0.44 -1.00 0.00 0.00 179.01 175.90 2qkb h ASP 243 N 0.00 0.83 0.89 1.42 3.32 -0.80 -2.41 116.42 119.67 2qkb h ASP 243 Ca -0.00 -0.75 -0.19 0.00 0.02 0.00 0.00 57.03 56.10 2qkb h ASP 243 Cb 0.35 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 2qkb h ASP 243 CO 0.02 1.56 -0.91 -0.26 -1.72 0.00 0.00 179.24 177.93 2qkb h PHE 244 N 0.28 0.01 -0.40 4.55 0.04 -0.54 -1.62 116.94 119.26 2qkb h PHE 244 Ca -0.17 -0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.48 2qkb h PHE 244 Cb 1.87 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 40.01 2qkb h PHE 244 CO 0.11 0.91 -0.18 0.28 -0.60 0.00 0.00 178.31 178.83 2qkb h VAL 245 N 0.00 1.28 -0.60 -0.55 2.07 -0.30 0.33 116.25 118.48 2qkb h VAL 245 Ca -0.01 -1.31 -0.05 0.00 0.82 0.00 0.00 66.70 66.15 2qkb h VAL 245 Cb 1.60 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 32.61 2qkb h VAL 245 CO 0.12 0.44 0.16 0.00 0.02 0.00 0.00 177.57 178.31 2qkb h ALA 246 N 0.82 1.14 0.24 1.67 0.00 -1.43 -0.53 119.26 121.18 2qkb h ALA 246 Ca 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2qkb h ALA 246 Cb 0.73 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2qkb h ALA 246 CO 0.06 0.58 -0.11 1.25 0.00 0.00 0.00 179.25 181.02 2qkb h LEU 247 N 0.89 -0.27 -1.00 0.00 5.85 -0.91 -2.71 115.31 117.17 2qkb h LEU 247 Ca 0.19 -0.26 0.14 0.00 0.84 0.00 0.00 57.88 58.80 2qkb h LEU 247 Cb 0.30 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.31 2qkb h LEU 247 CO -0.00 0.20 0.62 -0.08 -0.34 0.00 0.00 178.44 178.83 2qkb h GLU 248 N -0.83 0.89 -0.35 1.25 4.81 -0.30 0.99 114.58 121.04 2qkb h GLU 248 Ca -0.03 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.20 2qkb h GLU 248 Cb 0.51 -0.20 -0.05 0.00 0.63 0.00 0.00 28.75 29.64 2qkb h GLU 248 CO 0.05 0.59 0.06 0.07 -0.73 0.00 0.00 179.01 179.05 2qkb h ARG 249 N 0.92 0.17 -0.78 1.92 0.11 -0.99 -1.77 114.38 113.95 2qkb h ARG 249 Ca 0.52 -0.01 0.09 0.00 0.10 0.00 0.00 59.98 60.68 2qkb h ARG 249 Cb 0.61 -0.04 -0.07 0.00 1.11 0.00 0.00 29.97 31.58 2qkb h ARG 249 CO -0.30 0.11 0.43 -0.07 0.10 0.00 0.00 179.97 180.24 2qkb h LEU 250 N 0.17 0.60 0.00 0.08 -0.00 -0.51 -1.97 115.31 113.68 2qkb h LEU 250 Ca 0.17 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 58.10 2qkb h LEU 250 Cb 0.20 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 40.80 2qkb h LEU 250 CO -0.23 0.35 0.00 0.35 -0.00 0.00 0.00 178.44 178.91 2qkb n THR 251 N -4.78 1.87 -1.91 0.22 -2.24 -0.67 -4.70 114.28 102.07 2qkb n THR 251 Ca 0.12 0.47 -0.42 0.00 -2.27 0.00 0.00 64.05 61.95 2qkb n THR 251 Cb 0.27 -1.45 -0.03 0.00 -2.10 0.00 0.00 70.33 67.01 2qkb n THR 251 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2qkb s GLN 252 N -2.97 4.20 -0.11 -0.78 -1.52 -0.74 -4.82 119.66 112.91 2qkb s GLN 252 Ca 0.01 2.39 -0.01 0.00 -1.95 0.00 0.00 55.36 55.80 2qkb s GLN 252 Cb 0.01 -3.15 0.00 0.00 -0.22 0.00 0.00 33.01 29.65 2qkb s GLN 252 CO 0.02 -0.63 0.12 0.41 -0.25 0.00 0.00 175.29 174.96 2qkb n GLY 253 N 3.78 -0.58 2.66 3.09 0.00 -1.26 -5.12 105.19 107.77 2qkb n GLY 253 Ca 0.14 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.89 2.39 -0.07 1.61 -1.08 0.10 -4.84 116.67 112.89 2qkb s ASP 255 Ca 0.01 -0.84 0.05 0.00 -0.52 0.00 0.00 52.55 51.25 2qkb s ASP 255 Cb -0.00 0.09 -0.00 0.00 -1.46 0.00 0.00 42.92 41.54 2qkb s ASP 255 CO 0.14 -0.39 -0.22 -0.63 0.52 0.00 0.00 175.17 174.58 2qkb s ILE 256 N 2.23 1.85 -0.46 4.11 1.01 -1.26 -1.15 121.20 127.54 2qkb s ILE 256 Ca 0.08 -0.92 -0.14 0.00 0.00 0.00 0.00 60.65 59.66 2qkb s ILE 256 Cb -0.15 -1.59 0.07 0.00 0.01 0.00 0.00 42.46 40.80 2qkb s ILE 256 CO -0.28 0.52 0.37 -1.10 0.00 0.00 0.00 174.94 174.44 2qkb s GLN 257 N 0.15 2.92 0.53 2.79 -0.21 0.78 -4.98 119.66 121.64 2qkb s GLN 257 Ca -0.11 -1.35 -0.13 0.00 0.02 0.00 0.00 55.36 53.79 2qkb s GLN 257 Cb -0.15 -4.06 -0.06 0.00 1.00 0.00 0.00 33.01 29.73 2qkb s GLN 257 CO 0.05 -1.00 0.96 -1.58 -2.12 0.00 0.00 175.29 171.60 2qkb s TRP 258 N 1.61 3.52 -0.02 0.91 0.52 -1.26 -1.96 118.94 122.25 2qkb s TRP 258 Ca 0.04 1.31 0.00 0.00 0.02 0.00 0.00 56.10 57.47 2qkb s TRP 258 Cb -0.24 -2.69 0.03 0.00 -1.15 0.00 0.00 33.47 29.42 2qkb s TRP 258 CO 0.06 -0.43 0.03 -1.58 0.02 0.00 0.00 176.95 175.05 2qkb s HIS 260 N -2.77 0.04 -0.16 -1.98 2.46 -1.26 -5.02 115.29 106.60 2qkb s HIS 260 Ca 0.56 0.11 -0.03 0.00 0.47 0.00 0.00 55.06 56.17 2qkb s HIS 260 Cb -0.10 -0.23 -0.02 0.00 -0.13 0.00 0.00 32.58 32.10 2qkb s HIS 260 CO 0.39 -0.08 -0.06 0.08 -2.47 0.00 0.00 174.74 172.60 2qkb s VAL 261 N 0.99 3.57 0.09 0.89 1.01 -0.13 -4.87 120.40 121.95 2qkb s VAL 261 Ca -0.08 -0.46 -0.31 0.00 0.00 0.00 0.00 61.98 61.13 2qkb s VAL 261 Cb -0.12 -2.56 -0.07 0.00 0.00 0.00 0.00 36.38 33.63 2qkb s VAL 261 CO -0.03 0.49 1.29 -2.84 0.00 0.00 0.00 175.10 174.01 2qkb s PRO 262 N 0.56 4.38 0.47 2.72 0.02 -1.26 -3.50 135.00 138.39 2qkb s PRO 262 Ca -0.04 1.92 -0.21 0.00 0.02 0.00 0.00 61.00 62.69 2qkb s PRO 262 Cb -0.15 -3.29 -0.09 0.00 0.02 0.00 0.00 34.50 30.99 2qkb s PRO 262 CO 0.03 -0.34 1.02 0.20 -0.33 0.00 0.00 177.00 177.58 2qkb s GLY 263 N 1.04 2.50 -1.27 0.52 0.00 -1.26 -4.07 107.32 104.78 2qkb s GLY 263 Ca 0.61 0.57 -0.01 0.00 0.00 0.00 0.00 44.72 45.90 2qkb s GLY 263 CO 0.30 0.89 0.79 1.42 0.00 0.00 0.00 173.10 176.50 2qkb n HIS 264 N -0.86 -2.00 -2.72 1.90 8.25 -1.26 -4.94 115.22 113.59 2qkb n HIS 264 Ca 0.09 0.86 0.01 0.00 -0.26 0.00 0.00 57.72 58.41 2qkb n HIS 264 Cb 0.53 -4.57 0.05 0.00 1.12 0.00 0.00 29.99 27.11 2qkb n HIS 264 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2qkb n SER 265 N -3.08 1.12 -0.43 0.41 7.64 -1.26 -5.02 113.62 113.01 2qkb n SER 265 Ca -0.29 -2.03 -0.06 0.00 1.01 0.00 0.00 58.87 57.51 2qkb n SER 265 Cb 0.67 -0.32 -0.02 0.00 -1.01 0.00 0.00 64.21 63.53 2qkb n SER 265 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qkb n GLY 266 N -0.40 0.81 3.41 0.23 0.00 -1.26 -5.00 105.19 102.98 2qkb n GLY 266 Ca 0.04 -0.74 -0.44 0.00 0.00 0.00 0.00 46.02 44.88 2qkb n GLY 266 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qkb s PHE 267 N -2.19 3.15 0.27 1.61 0.08 -1.26 -4.92 117.98 114.72 2qkb s PHE 267 Ca 0.00 -0.78 -0.06 0.00 0.12 0.00 0.00 56.93 56.21 2qkb s PHE 267 Cb 0.00 -3.40 0.50 0.00 -0.57 0.00 0.00 43.02 39.56 2qkb s PHE 267 CO 0.00 -0.93 1.58 0.82 -0.10 0.00 0.00 175.22 176.59 2qkb h ILE 268 N 5.81 0.09 -0.24 0.64 2.04 -1.99 0.39 117.51 124.26 2qkb h ILE 268 Ca -0.28 -0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.63 2qkb h ILE 268 Cb 1.10 0.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.19 2qkb h ILE 268 CO 0.93 0.00 -0.25 1.23 0.00 0.00 0.00 178.15 180.06 2qkb h GLY 269 N 0.01 -0.19 1.53 5.37 0.00 -1.98 0.16 103.07 107.96 2qkb h GLY 269 Ca 0.48 0.32 -0.13 0.00 0.00 0.00 0.00 47.33 48.00 2qkb h GLY 269 CO -0.91 -0.20 -0.40 -0.57 0.00 0.00 0.00 176.54 174.46 2qkb h ASN 270 N -0.26 0.55 -0.23 0.19 -0.73 -1.55 -1.12 115.58 112.43 2qkb h ASN 270 Ca 0.13 -0.24 -0.03 0.00 1.87 0.00 0.00 56.30 58.04 2qkb h ASN 270 Cb 0.47 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.90 2qkb h ASN 270 CO -0.39 0.89 0.04 -0.33 -0.37 0.00 0.00 177.43 177.28 2qkb h GLU 271 N 0.44 0.38 -0.84 6.67 5.08 -0.22 -1.14 114.58 124.95 2qkb h GLU 271 Ca 0.04 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2qkb h GLU 271 Cb 0.88 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.04 2qkb h GLU 271 CO 0.08 0.51 0.55 0.93 -1.00 0.00 0.00 179.01 180.08 2qkb h GLU 272 N 0.19 1.11 -0.30 2.33 4.39 -0.64 0.79 114.58 122.45 2qkb h GLU 272 Ca 0.07 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 2qkb h GLU 272 Cb 0.31 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 2qkb h GLU 272 CO 0.00 0.74 -0.07 0.00 -1.16 0.00 0.00 179.01 178.52 2qkb h ALA 273 N 1.31 1.32 -0.32 3.43 0.00 -1.01 0.45 119.26 124.43 2qkb h ALA 273 Ca 0.31 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 2qkb h ALA 273 Cb -0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2qkb h ALA 273 CO -0.07 0.46 -0.47 0.22 0.00 0.00 0.00 179.25 179.39 2qkb h ASP 274 N 0.46 0.95 -0.39 0.00 1.82 0.10 -1.03 116.42 118.34 2qkb h ASP 274 Ca 0.09 -0.47 0.03 0.00 -0.39 0.00 0.00 57.03 56.29 2qkb h ASP 274 Cb 0.41 -0.27 -0.03 0.00 0.68 0.00 0.00 39.33 40.12 2qkb h ASP 274 CO 0.02 1.26 0.20 -0.09 -1.61 0.00 0.00 179.24 179.02 2qkb h ARG 275 N 0.69 0.40 -0.33 0.28 2.43 0.19 -0.49 114.38 117.54 2qkb h ARG 275 Ca 0.04 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2qkb h ARG 275 Cb 1.06 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.51 2qkb h ARG 275 CO 0.11 0.26 0.05 -0.07 -1.51 0.00 0.00 179.97 178.81 2qkb h LEU 276 N 0.41 0.45 -0.03 3.80 4.07 0.08 -2.23 115.31 121.86 2qkb h LEU 276 Ca 0.16 -0.07 -0.25 0.00 0.08 0.00 0.00 57.88 57.81 2qkb h LEU 276 Cb 0.06 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2qkb h LEU 276 CO -0.10 0.49 -1.09 0.00 -1.08 0.00 0.00 178.44 176.65 2qkb h ALA 277 N 1.58 0.24 -0.70 1.53 0.00 -0.75 -2.15 119.26 119.01 2qkb h ALA 277 Ca 0.11 -0.80 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 2qkb h ALA 277 Cb 0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2qkb h ALA 277 CO 0.00 0.91 0.27 -0.09 0.00 0.00 0.00 179.25 180.34 2qkb h ARG 278 N 0.14 1.04 -0.52 0.00 9.65 -0.77 0.13 114.38 124.03 2qkb h ARG 278 Ca -0.10 -0.18 -0.10 0.00 -1.10 0.00 0.00 59.98 58.50 2qkb h ARG 278 Cb 1.77 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 30.16 2qkb h ARG 278 CO 0.18 0.85 -0.06 0.93 2.80 0.00 0.00 179.97 184.68 2qkb h GLU 279 N 1.02 0.93 0.00 0.20 5.08 -1.38 -2.58 114.58 117.84 2qkb h GLU 279 Ca 0.23 -0.30 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 2qkb h GLU 279 Cb 0.21 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2qkb h GLU 279 CO -0.02 0.96 -0.44 0.78 -1.00 0.00 0.00 179.01 179.29 2qkb h GLY 280 N 0.98 0.00 2.00 -3.84 0.00 -0.69 -2.36 103.07 99.16 2qkb h GLY 280 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2qkb h GLY 280 CO 0.04 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.58 2qkb n ALA 281 N -2.33 2.30 0.13 3.60 0.00 -0.03 -1.73 120.51 122.45 2qkb n ALA 281 Ca -0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 53.44 53.37 2qkb n ALA 281 Cb 0.54 -1.47 0.15 0.00 0.00 0.00 0.00 19.45 18.67 2qkb n ALA 281 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2qkb n LYS 282 N -1.97 2.38 -1.12 0.00 3.00 -0.89 -4.71 118.16 114.84 2qkb n LYS 282 Ca 0.06 -1.36 0.00 0.00 -0.00 0.00 0.00 58.31 57.01 2qkb n LYS 282 Cb 0.40 -1.74 0.00 0.00 0.00 0.00 0.00 35.03 33.68 2qkb n LYS 282 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2qkb n GLN 283 N 0.13 2.18 0.00 1.64 6.02 -1.07 -5.06 117.38 121.22 2qkb n GLN 283 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 2qkb n GLN 283 Cb 0.77 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.03 2qkb n GLN 283 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48