#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkk n MET 136 N 0.00 -0.65 -1.47 -0.41 0.00 -1.26 -5.05 117.12 108.29 2qkk n MET 136 Ca 0.00 0.94 -0.31 0.00 0.00 0.00 0.00 57.70 58.33 2qkk n MET 136 Cb 0.00 -2.51 0.06 0.00 0.00 0.00 0.00 33.22 30.77 2qkk n MET 136 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2qkk s GLY 137 N -1.28 1.67 -0.28 3.03 0.00 -1.26 -5.08 107.32 104.12 2qkk s GLY 137 Ca 0.06 0.14 0.01 0.00 0.00 0.00 0.00 44.72 44.93 2qkk s GLY 137 CO 0.20 0.46 0.40 -0.35 0.00 0.00 0.00 173.10 173.81 2qkk s ASP 138 N -3.66 0.40 0.00 1.64 2.15 -1.26 -5.12 116.67 110.81 2qkk s ASP 138 Ca 0.59 -0.26 0.00 0.00 0.43 0.00 0.00 52.55 53.31 2qkk s ASP 138 Cb -0.15 1.09 0.00 0.00 -0.30 0.00 0.00 42.92 43.56 2qkk s ASP 138 CO 0.55 -0.34 0.00 2.22 -0.17 0.00 0.00 175.17 177.43 2qkk n PHE 139 N 5.35 0.00 -3.72 -5.34 1.16 -1.26 -4.89 117.46 108.76 2qkk n PHE 139 Ca -0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.31 2qkk n PHE 139 Cb 0.49 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.33 2qkk n PHE 139 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 2qkk s VAL 140 N -0.70 5.21 0.26 1.97 0.11 -1.21 -4.88 120.40 121.15 2qkk s VAL 140 Ca 0.00 -0.45 0.07 0.00 -2.93 0.00 0.00 61.98 58.68 2qkk s VAL 140 Cb 0.00 -3.75 -0.04 0.00 -1.53 0.00 0.00 36.38 31.06 2qkk s VAL 140 CO 0.00 -0.20 0.17 -0.69 -3.33 0.00 0.00 175.10 171.05 2qkk s VAL 141 N -1.89 4.27 -0.13 2.04 1.01 -1.26 -2.45 120.40 121.99 2qkk s VAL 141 Ca 0.38 -1.47 -0.19 0.00 0.00 0.00 0.00 61.98 60.69 2qkk s VAL 141 Cb -0.11 -3.32 0.05 0.00 0.00 0.00 0.00 36.38 33.00 2qkk s VAL 141 CO 0.29 -0.35 0.49 0.54 0.00 0.00 0.00 175.10 176.08 2qkk s VAL 142 N -2.17 0.01 -0.21 2.92 0.11 -0.97 -4.71 120.40 115.39 2qkk s VAL 142 Ca 0.33 -0.11 -0.04 0.00 -2.93 0.00 0.00 61.98 59.23 2qkk s VAL 142 Cb -0.08 -0.73 -0.02 0.00 -1.53 0.00 0.00 36.38 34.03 2qkk s VAL 142 CO 0.24 -0.06 -0.03 -0.31 -3.33 0.00 0.00 175.10 171.62 2qkk s TYR 143 N -0.34 2.98 -0.01 1.54 2.02 0.24 -1.88 117.35 121.91 2qkk s TYR 143 Ca -0.05 -0.72 0.08 0.00 -0.37 0.00 0.00 57.07 56.02 2qkk s TYR 143 Cb -0.03 -2.09 -0.02 0.00 -0.40 0.00 0.00 41.96 39.41 2qkk s TYR 143 CO 0.03 -0.41 -0.26 0.95 -1.57 0.00 0.00 175.55 174.29 2qkk s THR 144 N 1.26 2.08 -0.31 -0.71 -4.23 -1.00 0.23 115.64 112.95 2qkk s THR 144 Ca 0.03 -1.16 0.04 0.00 -1.18 0.00 0.00 61.69 59.42 2qkk s THR 144 Cb -0.14 -1.73 0.17 0.00 1.34 0.00 0.00 72.50 72.14 2qkk s THR 144 CO -0.00 0.54 0.48 -0.62 -0.54 0.00 0.00 174.62 174.47 2qkk s ASP 145 N -0.73 -0.26 0.55 3.99 3.68 0.29 -4.54 116.67 119.65 2qkk s ASP 145 Ca 0.10 -0.43 -0.16 0.00 2.13 0.00 0.00 52.55 54.19 2qkk s ASP 145 Cb -0.10 1.38 -0.06 0.00 -1.45 0.00 0.00 42.92 42.69 2qkk s ASP 145 CO -0.00 -0.31 1.02 -0.83 0.13 0.00 0.00 175.17 175.18 2qkk s GLY 146 N 2.40 2.07 0.27 2.66 0.00 -1.26 -3.74 107.32 109.72 2qkk s GLY 146 Ca 0.11 0.26 -0.04 0.00 0.00 0.00 0.00 44.72 45.05 2qkk s GLY 146 CO -0.23 0.55 0.35 0.00 0.00 0.00 0.00 173.10 173.76 2qkk s SER 149 N 1.89 6.28 -0.30 0.00 0.01 -0.41 -4.92 113.70 116.26 2qkk s SER 149 Ca -0.07 2.21 -0.16 0.00 1.31 0.00 0.00 55.95 59.24 2qkk s SER 149 Cb -0.06 -2.59 0.18 0.00 0.21 0.00 0.00 66.02 63.76 2qkk s SER 149 CO -0.17 -0.83 1.16 -0.55 0.41 0.00 0.00 173.24 173.25 2qkk s SER 150 N -1.47 -0.25 0.00 2.44 0.15 -1.26 -4.30 113.70 109.01 2qkk s SER 150 Ca 0.63 0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.46 2qkk s SER 150 Cb -0.26 1.22 0.00 0.00 -1.71 0.00 0.00 66.02 65.27 2qkk s SER 150 CO 0.32 -0.05 0.00 0.54 1.20 0.00 0.00 173.24 175.25 2qkk n ARG 154 N 5.38 0.00 0.00 5.44 5.12 -1.26 -5.16 116.66 126.18 2qkk n ARG 154 Ca -0.08 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.84 2qkk n ARG 154 Cb 0.54 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.84 2qkk n ARG 154 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2qkk n ARG 155 N 0.00 0.00 -1.91 5.56 5.12 -1.26 -4.78 116.66 119.39 2qkk n ARG 155 Ca 0.00 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.53 2qkk n ARG 155 Cb 0.00 0.00 0.01 0.00 -1.16 0.00 0.00 32.46 31.31 2qkk n ARG 155 CO 0.00 0.00 0.00 -2.14 -1.93 0.00 0.00 177.63 173.56 2qkk s PRO 156 N 0.00 3.64 -0.30 5.56 0.02 -1.26 -4.99 135.00 137.68 2qkk s PRO 156 Ca 0.00 2.25 -0.10 0.00 0.02 0.00 0.00 61.00 63.17 2qkk s PRO 156 Cb 0.00 -2.57 -0.02 0.00 0.02 0.00 0.00 34.50 31.93 2qkk s PRO 156 CO 0.00 -0.79 0.15 0.50 -0.33 0.00 0.00 177.00 176.54 2qkk s ARG 157 N -2.52 3.55 0.05 5.54 3.52 -1.26 -4.88 118.95 122.95 2qkk s ARG 157 Ca 0.62 -0.58 0.05 0.00 -0.13 0.00 0.00 55.73 55.69 2qkk s ARG 157 Cb -0.40 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.39 2qkk s ARG 157 CO 0.50 -0.33 -0.07 0.00 -0.81 0.00 0.00 175.30 174.60 2qkk s ALA 158 N 1.66 3.05 0.25 6.12 0.00 -1.26 -1.29 121.76 130.28 2qkk s ALA 158 Ca 0.06 -1.11 0.02 0.00 0.00 0.00 0.00 51.96 50.92 2qkk s ALA 158 Cb -0.16 -1.06 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 2qkk s ALA 158 CO 0.07 0.64 0.07 0.20 0.00 0.00 0.00 175.76 176.74 2qkk s GLY 159 N -1.85 1.69 0.12 0.00 0.00 -0.89 -2.99 107.32 103.40 2qkk s GLY 159 Ca 0.20 -1.84 0.10 0.00 0.00 0.00 0.00 44.72 43.18 2qkk s GLY 159 CO 0.12 -1.62 -0.23 -0.42 0.00 0.00 0.00 173.10 170.94 2qkk s ILE 160 N -3.64 2.49 -0.30 0.90 -1.09 0.15 -1.96 121.20 117.75 2qkk s ILE 160 Ca 0.35 -1.62 -0.04 0.00 -2.23 0.00 0.00 60.65 57.10 2qkk s ILE 160 Cb 0.07 -2.11 0.17 0.00 -1.58 0.00 0.00 42.46 39.02 2qkk s ILE 160 CO 0.12 0.12 0.65 -0.83 -1.23 0.00 0.00 174.94 173.77 2qkk s GLY 161 N -2.01 -0.88 -0.01 6.18 0.00 -1.25 -1.73 107.32 107.63 2qkk s GLY 161 Ca 0.15 2.05 0.03 0.00 0.00 0.00 0.00 44.72 46.96 2qkk s GLY 161 CO 0.07 3.32 -0.07 0.54 0.00 0.00 0.00 173.10 176.96 2qkk s VAL 162 N 2.86 3.60 -0.07 1.40 0.11 -0.92 -0.54 120.40 126.84 2qkk s VAL 162 Ca 0.12 -0.74 -0.01 0.00 -2.93 0.00 0.00 61.98 58.43 2qkk s VAL 162 Cb -0.14 -2.54 0.03 0.00 -1.53 0.00 0.00 36.38 32.19 2qkk s VAL 162 CO -0.20 0.43 -0.02 -0.47 -3.33 0.00 0.00 175.10 171.51 2qkk s TYR 163 N -0.95 0.82 -0.09 1.54 6.14 0.62 -2.91 117.35 122.52 2qkk s TYR 163 Ca 0.16 -0.27 0.15 0.00 0.64 0.00 0.00 57.07 57.75 2qkk s TYR 163 Cb -0.11 -0.83 -0.23 0.00 0.42 0.00 0.00 41.96 41.21 2qkk s TYR 163 CO 0.06 -0.32 0.36 0.91 0.64 0.00 0.00 175.55 177.20 2qkk n TRP 164 N 4.82 0.00 0.00 4.97 7.02 -1.26 0.82 117.44 133.80 2qkk n TRP 164 Ca -0.13 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.35 2qkk n TRP 164 Cb 0.50 -0.31 0.00 0.00 -2.42 0.00 0.00 31.31 29.08 2qkk n TRP 164 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2qkk n GLY 165 N 1.62 3.02 3.63 6.99 0.00 -1.26 -4.87 105.19 114.32 2qkk n GLY 165 Ca -0.02 -1.00 -0.55 0.00 0.00 0.00 0.00 46.02 44.45 2qkk n GLY 165 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qkk n PRO 166 N -1.10 1.04 0.00 1.61 -0.02 -1.26 -1.41 135.00 133.87 2qkk n PRO 166 Ca 0.00 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2qkk n PRO 166 Cb 0.00 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 2qkk n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qkk n GLY 167 N 3.03 0.01 1.84 -1.23 0.00 -1.26 -4.87 105.19 102.71 2qkk n GLY 167 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 2qkk n GLY 167 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2qkk n HIS 168 N -1.46 0.49 0.56 1.61 -0.00 -0.50 -4.67 115.22 111.26 2qkk n HIS 168 Ca 0.00 0.56 0.00 0.00 -0.00 0.00 0.00 57.72 58.28 2qkk n HIS 168 Cb 0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 29.99 28.89 2qkk n HIS 168 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2qkk n PRO 169 N 1.14 0.31 -0.12 1.57 -0.04 -1.26 -2.53 135.00 134.07 2qkk n PRO 169 Ca 0.12 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.64 2qkk n PRO 169 Cb 0.02 -1.03 0.09 0.00 -0.04 0.00 0.00 33.50 32.53 2qkk n PRO 169 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2qkk n LEU 170 N -0.32 1.80 -4.84 1.53 7.94 -1.26 -5.04 117.00 116.81 2qkk n LEU 170 Ca 0.00 -2.42 -0.37 0.00 -1.11 0.00 0.00 56.01 52.11 2qkk n LEU 170 Cb 0.02 -0.27 -0.06 0.00 0.53 0.00 0.00 43.42 43.64 2qkk n LEU 170 CO 0.00 0.57 0.14 0.20 -1.11 0.00 0.00 177.39 177.19 2qkk s ASN 171 N -2.12 6.80 0.05 1.96 0.01 -1.05 -4.74 114.94 115.85 2qkk s ASN 171 Ca 0.20 0.98 0.01 0.00 -0.71 0.00 0.00 52.86 53.33 2qkk s ASN 171 Cb 0.17 -2.25 -0.03 0.00 0.41 0.00 0.00 41.25 39.55 2qkk s ASN 171 CO 0.02 0.24 -0.05 -0.69 -1.51 0.00 0.00 177.10 175.11 2qkk s VAL 172 N -1.23 0.37 -0.41 1.60 1.01 -1.15 -5.03 120.40 115.56 2qkk s VAL 172 Ca 0.29 -1.37 0.06 0.00 0.00 0.00 0.00 61.98 60.96 2qkk s VAL 172 Cb -0.16 -0.93 0.21 0.00 0.00 0.00 0.00 36.38 35.49 2qkk s VAL 172 CO 0.16 -0.66 0.46 0.61 0.00 0.00 0.00 175.10 175.67 2qkk n GLY 173 N 0.88 2.13 3.36 4.51 0.00 -1.26 -2.16 105.19 112.66 2qkk n GLY 173 Ca -0.19 -1.22 -0.19 0.00 0.00 0.00 0.00 46.02 44.42 2qkk n GLY 173 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qkk n ILE 174 N 2.24 0.00 -4.59 -0.61 -5.35 -0.70 -3.89 119.36 106.45 2qkk n ILE 174 Ca 0.25 -1.45 -0.34 0.00 -0.27 0.00 0.00 62.75 60.94 2qkk n ILE 174 Cb 0.51 -0.84 -0.11 0.00 -1.74 0.00 0.00 39.64 37.46 2qkk n ILE 174 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2qkk s ARG 175 N -4.59 2.72 0.02 6.28 3.52 -1.26 0.33 118.95 125.97 2qkk s ARG 175 Ca 0.56 -0.57 -0.30 0.00 -0.13 0.00 0.00 55.73 55.28 2qkk s ARG 175 Cb -0.04 -2.58 -0.06 0.00 -1.56 0.00 0.00 34.95 30.71 2qkk s ARG 175 CO 0.37 0.65 1.45 -1.17 -0.81 0.00 0.00 175.30 175.79 2qkk s LEU 176 N -0.92 4.33 0.81 -0.88 2.96 -1.16 -4.80 118.68 119.01 2qkk s LEU 176 Ca 0.13 2.20 -0.12 0.00 -0.22 0.00 0.00 54.13 56.12 2qkk s LEU 176 Cb -0.11 -3.56 0.08 0.00 0.50 0.00 0.00 46.19 43.09 2qkk s LEU 176 CO 0.02 -0.75 1.14 -2.84 -1.32 0.00 0.00 176.35 172.60 2qkk s PRO 177 N 2.40 2.00 3.72 0.98 0.02 -1.26 -4.87 135.00 137.98 2qkk s PRO 177 Ca 0.66 0.31 0.00 0.00 0.02 0.00 0.00 61.00 61.98 2qkk s PRO 177 Cb -0.33 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.25 2qkk s PRO 177 CO 0.28 -1.61 0.00 0.41 -0.33 0.00 0.00 177.00 175.75 2qkk n GLY 178 N -2.83 2.44 2.64 0.52 0.00 -1.26 -4.73 105.19 101.98 2qkk n GLY 178 Ca 0.07 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2qkk n GLY 178 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2qkk n ARG 179 N 14.00 0.00 -3.44 1.61 3.00 -1.26 -4.96 116.66 125.61 2qkk n ARG 179 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.57 2qkk n ARG 179 Cb 0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 32.46 31.48 2qkk n ARG 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2qkk s GLN 180 N -1.62 0.76 0.25 -0.14 2.00 -1.26 -4.97 119.66 114.67 2qkk s GLN 180 Ca 0.37 -1.74 0.03 0.00 -2.00 0.00 0.00 55.36 52.01 2qkk s GLN 180 Cb -0.19 -1.40 -0.05 0.00 0.80 0.00 0.00 33.01 32.16 2qkk s GLN 180 CO 0.70 -1.30 0.02 0.95 -0.50 0.00 0.00 175.29 175.17 2qkk s THR 181 N 0.54 0.96 0.00 -0.34 -4.23 -1.26 -4.80 115.64 106.51 2qkk s THR 181 Ca 0.25 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 2qkk s THR 181 Cb -0.10 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.30 2qkk s THR 181 CO -0.09 -0.23 0.53 -3.20 -0.54 0.00 0.00 174.62 171.08 2qkk n ASN 182 N -0.46 0.00 -0.94 3.99 2.85 -1.26 -3.34 115.26 116.10 2qkk n ASN 182 Ca -0.04 0.53 0.06 0.00 -0.11 0.00 0.00 54.58 55.03 2qkk n ASN 182 Cb 0.65 -0.03 0.21 0.00 1.24 0.00 0.00 39.78 41.84 2qkk n ASN 182 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2qkk n GLN 183 N -1.00 2.36 0.18 1.20 10.64 -1.26 -3.21 117.38 126.28 2qkk n GLN 183 Ca 0.00 -1.65 0.07 0.00 -1.83 0.00 0.00 57.00 53.59 2qkk n GLN 183 Cb 0.00 -1.50 0.15 0.00 -0.86 0.00 0.00 30.24 28.03 2qkk n GLN 183 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 2qkk h ARG 184 N 2.50 0.00 0.12 2.61 2.43 -1.96 -3.09 114.38 116.99 2qkk h ARG 184 Ca 0.00 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.83 2qkk h ARG 184 Cb 0.79 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 2qkk h ARG 184 CO 0.08 0.31 -1.81 0.00 -1.51 0.00 0.00 179.97 177.04 2qkk h ALA 185 N 1.69 0.35 -0.41 2.80 0.00 -1.57 -3.19 119.26 118.94 2qkk h ALA 185 Ca -0.00 -1.31 0.12 0.00 0.00 0.00 0.00 54.91 53.72 2qkk h ALA 185 Cb 1.16 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.59 2qkk h ALA 185 CO 0.04 1.15 0.40 1.49 0.00 0.00 0.00 179.25 182.33 2qkk h GLU 186 N -0.10 0.00 0.13 0.00 4.57 -1.55 -1.49 114.58 116.14 2qkk h GLU 186 Ca -0.39 0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 57.43 2qkk h GLU 186 Cb 1.92 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.50 2qkk h GLU 186 CO 0.06 0.00 -1.90 -0.84 -1.18 0.00 0.00 179.01 175.15 2qkk h ILE 187 N 0.00 0.74 0.00 2.32 3.07 -1.65 -3.33 117.51 118.66 2qkk h ILE 187 Ca 0.20 -2.43 0.00 0.00 1.55 0.00 0.00 64.86 64.18 2qkk h ILE 187 Cb 0.99 2.58 0.00 0.00 -0.27 0.00 0.00 36.82 40.13 2qkk h ILE 187 CO -0.00 0.86 0.00 1.41 -1.05 0.00 0.00 178.15 179.37 2qkk n HIS 188 N -3.48 0.05 0.03 0.16 8.25 -0.79 -2.00 115.22 117.44 2qkk n HIS 188 Ca -0.28 0.02 -0.19 0.00 -0.26 0.00 0.00 57.72 57.00 2qkk n HIS 188 Cb 1.06 -0.53 -0.11 0.00 1.12 0.00 0.00 29.99 31.53 2qkk n HIS 188 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qkk h ALA 189 N 2.65 0.11 0.00 -1.41 0.00 -1.43 -1.53 119.26 117.65 2qkk h ALA 189 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2qkk h ALA 189 Cb 0.34 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qkk h ALA 189 CO 0.00 0.57 0.00 0.00 0.00 0.00 0.00 179.25 179.82 2qkk n ALA 190 N -2.63 1.98 -0.12 0.00 0.00 -0.85 -2.58 120.51 116.32 2qkk n ALA 190 Ca -0.11 -0.09 -0.25 0.00 0.00 0.00 0.00 53.44 52.99 2qkk n ALA 190 Cb 0.81 -1.27 -0.09 0.00 0.00 0.00 0.00 19.45 18.90 2qkk n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qkk h LYS 192 N -1.00 0.37 0.00 0.00 1.63 -1.09 0.20 116.57 116.68 2qkk h LYS 192 Ca -0.52 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.25 2qkk h LYS 192 Cb 1.44 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.99 2qkk h LYS 192 CO -0.32 0.24 0.00 0.00 -3.45 0.00 0.00 179.45 175.92 2qkk n ALA 193 N -2.45 -0.12 0.30 5.00 0.00 -1.06 -2.17 120.51 120.00 2qkk n ALA 193 Ca 0.27 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.80 2qkk n ALA 193 Cb 0.93 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.86 2qkk n ALA 193 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2qkk h ILE 194 N 0.00 0.00 0.39 0.00 3.07 -1.57 0.53 117.51 119.93 2qkk h ILE 194 Ca 0.00 0.00 -0.02 0.00 1.55 0.00 0.00 64.86 66.39 2qkk h ILE 194 Cb 0.00 0.39 0.00 0.00 -0.27 0.00 0.00 36.82 36.94 2qkk h ILE 194 CO 0.00 0.00 -0.19 -0.08 -1.05 0.00 0.00 178.15 176.83 2qkk h GLU 195 N 0.00 -0.50 -0.75 0.16 4.81 -0.52 -2.89 114.58 114.90 2qkk h GLU 195 Ca 0.00 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2qkk h GLU 195 Cb 1.08 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.54 2qkk h GLU 195 CO 0.00 -0.19 0.46 1.96 -0.73 0.00 0.00 179.01 180.51 2qkk h GLN 196 N -0.94 1.01 -0.65 1.92 4.20 0.36 -2.74 115.11 118.27 2qkk h GLN 196 Ca -0.05 -0.09 0.06 0.00 0.06 0.00 0.00 58.65 58.63 2qkk h GLN 196 Cb 0.54 -0.21 -0.08 0.00 0.30 0.00 0.00 27.48 28.03 2qkk h GLN 196 CO 0.09 0.70 -0.38 0.00 -0.67 0.00 0.00 178.83 178.57 2qkk n ALA 197 N -2.33 -0.41 0.06 3.87 0.00 0.86 0.21 120.51 122.77 2qkk n ALA 197 Ca 0.07 0.55 -0.00 0.00 0.00 0.00 0.00 53.44 54.06 2qkk n ALA 197 Cb 0.05 -0.04 0.29 0.00 0.00 0.00 0.00 19.45 19.75 2qkk n ALA 197 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qkk h LYS 198 N 0.00 0.38 0.00 0.00 1.57 -1.33 -1.51 116.57 115.68 2qkk h LYS 198 Ca 0.10 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qkk h LYS 198 Cb 0.27 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2qkk h LYS 198 CO -0.61 0.54 0.00 -2.37 -0.57 0.00 0.00 179.45 176.44 2qkk n THR 199 N -4.20 1.91 -0.24 -0.16 5.66 0.58 0.16 114.28 117.97 2qkk n THR 199 Ca -0.00 0.48 0.02 0.00 -3.05 0.00 0.00 64.05 61.49 2qkk n THR 199 Cb 0.32 -1.47 0.02 0.00 -1.55 0.00 0.00 70.33 67.66 2qkk n THR 199 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qkk n GLN 200 N -1.49 2.53 -3.60 1.09 1.13 -0.43 -5.01 117.38 111.61 2qkk n GLN 200 Ca 0.00 -1.60 -0.21 0.00 -1.94 0.00 0.00 57.00 53.25 2qkk n GLN 200 Cb 0.01 -1.04 0.05 0.00 0.11 0.00 0.00 30.24 29.36 2qkk n GLN 200 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2qkk n ASN 201 N -0.61 -2.40 -4.22 1.08 3.02 0.12 -4.99 115.26 107.27 2qkk n ASN 201 Ca 0.02 -0.80 -0.34 0.00 -0.03 0.00 0.00 54.58 53.44 2qkk n ASN 201 Cb 0.33 -4.29 -0.15 0.00 -0.61 0.00 0.00 39.78 35.06 2qkk n ASN 201 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2qkk s ILE 202 N -3.57 2.77 -0.12 2.41 -1.16 -0.95 -5.01 121.20 115.58 2qkk s ILE 202 Ca 0.11 -0.77 0.17 0.00 -0.51 0.00 0.00 60.65 59.65 2qkk s ILE 202 Cb -0.03 -2.26 -0.22 0.00 0.61 0.00 0.00 42.46 40.56 2qkk s ILE 202 CO 0.80 0.42 0.50 -0.46 -2.81 0.00 0.00 174.94 173.39 2qkk n ASN 203 N 4.70 0.45 -3.80 4.50 6.94 -1.26 -4.14 115.26 122.65 2qkk n ASN 203 Ca -0.19 0.20 -0.23 0.00 -0.02 0.00 0.00 54.58 54.34 2qkk n ASN 203 Cb 0.50 0.69 -0.17 0.00 -2.36 0.00 0.00 39.78 38.43 2qkk n ASN 203 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 2qkk s LYS 204 N -2.83 0.75 0.26 -3.83 -2.85 -1.26 -0.49 119.74 109.49 2qkk s LYS 204 Ca -0.06 0.04 0.02 0.00 -1.00 0.00 0.00 55.97 54.97 2qkk s LYS 204 Cb 0.08 -1.04 -0.03 0.00 -2.06 0.00 0.00 37.83 34.78 2qkk s LYS 204 CO 0.83 -0.27 0.21 -0.48 0.10 0.00 0.00 175.35 175.74 2qkk s LEU 205 N 1.82 1.40 -0.09 2.77 2.34 -1.22 -3.36 118.68 122.35 2qkk s LEU 205 Ca 0.03 -1.55 0.01 0.00 0.06 0.00 0.00 54.13 52.68 2qkk s LEU 205 Cb -0.12 0.50 -0.03 0.00 -0.56 0.00 0.00 46.19 45.98 2qkk s LEU 205 CO -0.05 -0.95 -0.10 -0.69 -1.06 0.00 0.00 176.35 173.50 2qkk s VAL 206 N -3.82 3.41 -0.27 1.48 1.01 -1.03 -1.99 120.40 119.19 2qkk s VAL 206 Ca 0.39 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.83 2qkk s VAL 206 Cb 0.05 -2.40 0.06 0.00 0.00 0.00 0.00 36.38 34.09 2qkk s VAL 206 CO 0.19 0.57 -0.09 -0.22 0.00 0.00 0.00 175.10 175.55 2qkk s LEU 207 N -0.42 3.58 -0.26 3.92 0.20 0.42 -2.29 118.68 123.83 2qkk s LEU 207 Ca 0.05 -1.45 -0.19 0.00 0.69 0.00 0.00 54.13 53.24 2qkk s LEU 207 Cb -0.12 -1.57 -0.02 0.00 -0.43 0.00 0.00 46.19 44.05 2qkk s LEU 207 CO 0.02 -0.21 0.55 -0.31 -0.29 0.00 0.00 176.35 176.11 2qkk s TYR 208 N 1.09 3.27 0.08 5.38 1.51 -0.79 0.13 117.35 128.02 2qkk s TYR 208 Ca -0.07 0.68 -0.10 0.00 -1.01 0.00 0.00 57.07 56.57 2qkk s TYR 208 Cb -0.20 -2.76 0.00 0.00 -0.11 0.00 0.00 41.96 38.89 2qkk s TYR 208 CO -0.05 -0.30 0.21 -0.08 -1.11 0.00 0.00 175.55 174.22 2qkk s THR 209 N 2.37 0.13 -2.75 -0.71 -1.32 0.43 -2.38 115.64 111.41 2qkk s THR 209 Ca 0.23 -1.05 0.23 0.00 -1.21 0.00 0.00 61.69 59.89 2qkk s THR 209 Cb -0.16 -1.20 0.28 0.00 -1.51 0.00 0.00 72.50 69.91 2qkk s THR 209 CO 0.09 -0.58 1.30 -0.46 -2.21 0.00 0.00 174.62 172.77 2qkk n ASN 210 N 0.16 3.16 -4.42 8.08 0.23 -1.26 0.42 115.26 121.62 2qkk n ASN 210 Ca -0.16 -1.99 -0.44 0.00 -0.53 0.00 0.00 54.58 51.46 2qkk n ASN 210 Cb 0.61 -0.10 -0.08 0.00 -2.08 0.00 0.00 39.78 38.14 2qkk n ASN 210 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2qkk s SER 211 N -1.77 6.16 0.00 0.53 1.04 -1.26 -4.69 113.70 113.71 2qkk s SER 211 Ca 0.32 -1.10 0.03 0.00 0.48 0.00 0.00 55.95 55.68 2qkk s SER 211 Cb 0.21 -2.21 0.21 0.00 0.10 0.00 0.00 66.02 64.33 2qkk s SER 211 CO 0.30 -0.66 0.56 0.23 0.98 0.00 0.00 173.24 174.66 2qkk n MET 212 N 5.44 0.17 -0.00 4.02 2.81 -1.26 -2.44 117.12 125.86 2qkk n MET 212 Ca -0.10 0.00 -0.00 0.00 -1.81 0.00 0.00 57.70 55.79 2qkk n MET 212 Cb 0.45 -1.31 -0.00 0.00 -0.71 0.00 0.00 33.22 31.65 2qkk n MET 212 CO 0.00 0.00 0.00 0.35 1.51 0.00 0.00 175.97 177.83 2qkk h PHE 213 N 0.00 0.00 -1.08 2.03 3.57 -1.97 -2.03 116.94 117.46 2qkk h PHE 213 Ca 0.00 0.00 0.30 0.00 3.53 0.00 0.00 57.97 61.80 2qkk h PHE 213 Cb 0.00 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 38.63 2qkk h PHE 213 CO 0.00 0.00 0.68 1.15 -2.23 0.00 0.00 178.31 177.91 2qkk h THR 214 N -0.01 0.44 0.00 4.41 2.02 -1.89 1.66 112.91 119.54 2qkk h THR 214 Ca 0.00 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.06 2qkk h THR 214 Cb 0.00 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.47 2qkk h THR 214 CO 0.00 0.06 0.00 -0.38 0.37 0.00 0.00 175.52 175.57 2qkk n ILE 215 N -4.69 0.00 -0.31 3.11 5.41 -1.02 -2.03 119.36 119.82 2qkk n ILE 215 Ca 0.28 0.73 0.16 0.00 1.00 0.00 0.00 62.75 64.91 2qkk n ILE 215 Cb 0.96 -1.46 0.33 0.00 -0.71 0.00 0.00 39.64 38.76 2qkk n ILE 215 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 2qkk h ASN 216 N 0.00 -0.11 -0.05 4.38 -0.26 -0.81 -0.85 115.58 117.88 2qkk h ASN 216 Ca 0.00 0.23 0.03 0.00 -0.56 0.00 0.00 56.30 56.00 2qkk h ASN 216 Cb 0.00 0.34 -0.03 0.00 -1.06 0.00 0.00 38.32 37.56 2qkk h ASN 216 CO 0.00 -0.25 -0.14 1.23 -1.06 0.00 0.00 177.43 177.21 2qkk h GLY 217 N 0.12 -0.13 0.83 2.83 0.00 0.24 -1.36 103.07 105.60 2qkk h GLY 217 Ca 0.60 0.16 0.00 0.00 0.00 0.00 0.00 47.33 48.10 2qkk h GLY 217 CO -0.75 -0.14 -0.03 4.51 0.00 0.00 0.00 176.54 180.13 2qkk n ILE 218 N -5.27 0.00 0.08 2.60 0.13 -0.39 -1.07 119.36 115.44 2qkk n ILE 218 Ca -0.04 -0.05 0.02 0.00 -1.10 0.00 0.00 62.75 61.57 2qkk n ILE 218 Cb 0.19 -0.24 -0.03 0.00 -0.84 0.00 0.00 39.64 38.72 2qkk n ILE 218 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 2qkk n THR 219 N -0.84 0.00 0.05 9.51 -2.24 -0.79 -4.82 114.28 115.14 2qkk n THR 219 Ca 0.19 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2qkk n THR 219 Cb 0.21 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 2qkk n THR 219 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2qkk n ASN 220 N -1.47 0.03 0.03 3.42 5.15 -0.53 -4.91 115.26 116.98 2qkk n ASN 220 Ca -0.00 0.15 -0.06 0.00 -0.60 0.00 0.00 54.58 54.07 2qkk n ASN 220 Cb 0.10 0.09 0.13 0.00 -0.53 0.00 0.00 39.78 39.58 2qkk n ASN 220 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 2qkk h TRP 221 N 0.00 0.54 -0.12 1.20 6.55 -1.56 -3.18 115.95 119.38 2qkk h TRP 221 Ca 0.00 -0.16 0.01 0.00 0.95 0.00 0.00 58.89 59.68 2qkk h TRP 221 Cb 0.14 -0.11 -0.01 0.00 -0.86 0.00 0.00 29.16 28.32 2qkk h TRP 221 CO 0.00 0.81 0.06 -0.39 -1.05 0.00 0.00 178.44 177.87 2qkk h VAL 222 N 0.37 1.00 -1.06 1.49 -1.51 -1.37 0.29 116.25 115.45 2qkk h VAL 222 Ca 0.03 -0.04 0.31 0.00 -1.23 0.00 0.00 66.70 65.76 2qkk h VAL 222 Cb 0.92 0.86 -0.12 0.00 -2.13 0.00 0.00 31.29 30.81 2qkk h VAL 222 CO 0.08 0.02 0.65 1.56 -1.23 0.00 0.00 177.57 178.65 2qkk h GLN 223 N 0.13 0.35 0.07 5.19 4.20 -1.83 -0.35 115.11 122.87 2qkk h GLN 223 Ca 0.05 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 2qkk h GLN 223 Cb 0.01 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 27.72 2qkk h GLN 223 CO -0.03 0.23 -0.48 0.78 -0.67 0.00 0.00 178.83 178.66 2qkk h GLY 224 N 0.36 0.16 0.20 3.46 0.00 -1.33 -3.36 103.07 102.57 2qkk h GLY 224 Ca 0.69 -0.41 0.23 0.00 0.00 0.00 0.00 47.33 47.84 2qkk h GLY 224 CO -0.46 0.36 0.62 1.49 0.00 0.00 0.00 176.54 178.55 2qkk h TRP 225 N -0.70 0.44 0.00 5.60 6.55 0.12 0.75 115.95 128.71 2qkk h TRP 225 Ca -0.09 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.76 2qkk h TRP 225 Cb 1.33 -0.13 0.00 0.00 -0.86 0.00 0.00 29.16 29.50 2qkk h TRP 225 CO 0.23 0.10 0.00 1.63 -1.05 0.00 0.00 178.44 179.35 2qkk n LYS 226 N -4.47 0.20 0.00 0.49 5.02 -0.62 0.22 118.16 118.99 2qkk n LYS 226 Ca 0.20 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.93 2qkk n LYS 226 Cb 0.79 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 2qkk n LYS 226 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qkk n LYS 227 N -2.25 0.00 0.00 1.97 5.02 0.26 -4.25 118.16 118.90 2qkk n LYS 227 Ca 0.02 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 2qkk n LYS 227 Cb 0.22 -0.65 0.00 0.00 -0.02 0.00 0.00 35.03 34.58 2qkk n LYS 227 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2qkk n ASN 228 N -2.27 0.00 -1.14 4.39 6.94 -1.01 -4.68 115.26 117.49 2qkk n ASN 228 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 54.58 54.50 2qkk n ASN 228 Cb 0.00 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.43 2qkk n ASN 228 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qkk n GLY 229 N -0.71 0.41 2.85 4.83 0.00 -1.08 -4.38 105.19 107.11 2qkk n GLY 229 Ca 0.00 -0.49 -0.07 0.00 0.00 0.00 0.00 46.02 45.46 2qkk n GLY 229 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2qkk n TRP 230 N -3.46 -3.54 -3.72 1.61 7.02 0.58 -4.94 117.44 110.98 2qkk n TRP 230 Ca -0.02 1.48 -0.12 0.00 -1.02 0.00 0.00 57.50 57.82 2qkk n TRP 230 Cb 0.53 -3.87 -0.10 0.00 -2.42 0.00 0.00 31.31 25.44 2qkk n TRP 230 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2qkk s LYS 231 N -2.23 0.45 1.06 -0.99 -0.14 -1.25 -3.19 119.74 113.45 2qkk s LYS 231 Ca 0.17 0.63 -0.18 0.00 -1.36 0.00 0.00 55.97 55.23 2qkk s LYS 231 Cb -0.04 0.15 0.26 0.00 -1.68 0.00 0.00 37.83 36.52 2qkk s LYS 231 CO 0.76 -0.09 1.03 -2.37 -0.76 0.00 0.00 175.35 173.92 2qkk n THR 232 N 3.29 0.00 1.03 2.17 5.66 0.56 -4.75 114.28 122.23 2qkk n THR 232 Ca -0.16 -0.53 0.04 0.00 -3.05 0.00 0.00 64.05 60.35 2qkk n THR 232 Cb 0.57 -1.29 0.26 0.00 -1.55 0.00 0.00 70.33 68.32 2qkk n THR 232 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2qkk n SER 233 N -4.50 0.00 -0.08 1.09 7.64 -1.26 -0.34 113.62 116.17 2qkk n SER 233 Ca 0.14 -0.76 0.08 0.00 1.01 0.00 0.00 58.87 59.35 2qkk n SER 233 Cb 0.53 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.85 2qkk n SER 233 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qkk n ALA 234 N -0.76 2.24 0.00 -0.43 0.00 -1.26 -4.97 120.51 115.32 2qkk n ALA 234 Ca 0.06 -2.37 0.00 0.00 0.00 0.00 0.00 53.44 51.13 2qkk n ALA 234 Cb 0.03 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.15 2qkk n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkk n GLY 235 N -1.27 0.96 3.76 0.00 0.00 0.54 -4.94 105.19 104.24 2qkk n GLY 235 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2qkk n GLY 235 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkk s LYS 236 N 0.00 2.77 0.02 1.61 1.02 -1.26 -4.42 119.74 119.48 2qkk s LYS 236 Ca 0.00 1.45 -0.30 0.00 0.02 0.00 0.00 55.97 57.14 2qkk s LYS 236 Cb 0.00 -1.94 -0.07 0.00 -0.52 0.00 0.00 37.83 35.30 2qkk s LYS 236 CO 0.00 -1.29 1.66 -1.21 -0.92 0.00 0.00 175.35 173.59 2qkk s GLU 237 N -4.00 4.19 -0.20 1.68 2.02 -1.26 0.21 118.70 121.34 2qkk s GLU 237 Ca 0.68 2.29 -0.38 0.00 0.02 0.00 0.00 54.97 57.58 2qkk s GLU 237 Cb -0.22 -3.76 -0.14 0.00 0.10 0.00 0.00 34.13 30.11 2qkk s GLU 237 CO 0.41 -0.77 1.79 1.55 0.02 0.00 0.00 175.26 178.25 2qkk n VAL 238 N 5.02 0.40 0.00 2.63 3.14 -1.19 -4.76 118.33 123.56 2qkk n VAL 238 Ca 0.16 -0.07 0.00 0.00 -2.96 0.00 0.00 64.34 61.47 2qkk n VAL 238 Cb 0.41 -1.47 0.00 0.00 -1.06 0.00 0.00 33.84 31.73 2qkk n VAL 238 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 2qkk n ILE 239 N 4.75 0.00 -1.19 1.55 5.41 -1.26 -3.09 119.36 125.53 2qkk n ILE 239 Ca 0.25 1.38 -0.18 0.00 1.00 0.00 0.00 62.75 65.20 2qkk n ILE 239 Cb 0.19 -1.94 -0.10 0.00 -0.71 0.00 0.00 39.64 37.08 2qkk n ILE 239 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2qkk n ASN 240 N -2.43 5.85 0.12 4.38 4.13 -1.26 -4.67 115.26 121.38 2qkk n ASN 240 Ca 0.00 -2.83 -0.05 0.00 1.68 0.00 0.00 54.58 53.38 2qkk n ASN 240 Cb 0.00 -1.31 -0.03 0.00 -1.54 0.00 0.00 39.78 36.91 2qkk n ASN 240 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 2qkk h LYS 241 N 2.83 -0.32 -0.07 3.52 3.64 -1.93 -1.63 116.57 122.61 2qkk h LYS 241 Ca 0.28 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.68 2qkk h LYS 241 Cb 1.11 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 2qkk h LYS 241 CO 0.53 -0.21 -0.04 -1.91 -2.27 0.00 0.00 179.45 175.55 2qkk n GLU 242 N -3.08 -0.03 -0.31 1.90 2.13 -1.26 0.54 120.64 120.53 2qkk n GLU 242 Ca -0.04 0.52 -0.11 0.00 0.66 0.00 0.00 57.16 58.18 2qkk n GLU 242 Cb 0.14 -0.78 -0.10 0.00 0.27 0.00 0.00 31.44 30.98 2qkk n GLU 242 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2qkk h ASP 243 N 0.00 -1.98 -1.01 4.31 3.32 -1.92 0.46 116.42 119.60 2qkk h ASP 243 Ca 0.01 0.29 0.09 0.00 0.02 0.00 0.00 57.03 57.43 2qkk h ASP 243 Cb 0.03 0.85 -0.07 0.00 0.22 0.00 0.00 39.33 40.36 2qkk h ASP 243 CO -0.06 -0.27 0.65 -0.26 -1.72 0.00 0.00 179.24 177.57 2qkk h PHE 244 N -0.12 1.19 0.48 4.55 0.04 0.65 0.25 116.94 123.97 2qkk h PHE 244 Ca 0.13 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 2qkk h PHE 244 Cb 0.45 -0.39 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 2qkk h PHE 244 CO -0.93 0.56 -0.30 0.28 -0.60 0.00 0.00 178.31 177.33 2qkk h VAL 245 N 1.12 0.00 -0.78 -0.55 2.07 0.34 -0.33 116.25 118.12 2qkk h VAL 245 Ca 0.46 0.00 0.15 0.00 0.82 0.00 0.00 66.70 68.13 2qkk h VAL 245 Cb 0.28 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.91 2qkk h VAL 245 CO -0.21 0.00 -0.25 0.00 0.02 0.00 0.00 177.57 177.13 2qkk h ALA 246 N -1.45 0.35 -0.35 1.67 0.00 0.35 0.35 119.26 120.19 2qkk h ALA 246 Ca -0.06 0.27 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2qkk h ALA 246 Cb 0.59 0.70 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2qkk h ALA 246 CO 0.06 -0.49 0.23 1.25 0.00 0.00 0.00 179.25 180.30 2qkk h LEU 247 N -0.04 0.35 -0.77 0.00 5.85 -0.30 -1.83 115.31 118.57 2qkk h LEU 247 Ca 0.35 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.95 2qkk h LEU 247 Cb 0.58 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2qkk h LEU 247 CO -0.81 0.25 -0.27 -0.08 -0.34 0.00 0.00 178.44 177.18 2qkk h GLU 248 N 0.41 0.62 0.26 1.25 4.22 0.15 -2.97 114.58 118.52 2qkk h GLU 248 Ca 0.14 -0.26 -0.01 0.00 0.08 0.00 0.00 59.36 59.31 2qkk h GLU 248 Cb 0.04 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2qkk h GLU 248 CO -0.03 0.83 -0.27 -0.09 -2.18 0.00 0.00 179.01 177.28 2qkk h ARG 249 N 0.54 -0.51 -0.94 1.92 2.43 -0.67 -1.90 114.38 115.26 2qkk h ARG 249 Ca 0.07 0.03 0.27 0.00 -0.81 0.00 0.00 59.98 59.55 2qkk h ARG 249 Cb 0.75 0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.38 2qkk h ARG 249 CO 0.06 -0.34 0.75 -0.07 -1.51 0.00 0.00 179.97 178.86 2qkk h LEU 250 N -0.53 0.00 -1.87 3.80 4.07 -1.58 0.39 115.31 119.60 2qkk h LEU 250 Ca -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 2qkk h LEU 250 Cb 0.46 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.19 2qkk h LEU 250 CO -0.03 0.00 0.01 0.74 -1.08 0.00 0.00 178.44 178.07 2qkk h THR 251 N 0.00 1.04 -2.06 0.22 2.02 -1.18 -3.44 112.91 109.52 2qkk h THR 251 Ca 0.44 -0.15 -0.62 0.00 0.77 0.00 0.00 66.41 66.86 2qkk h THR 251 Cb 1.94 0.98 0.03 0.00 -1.74 0.00 0.00 68.15 69.36 2qkk h THR 251 CO -0.00 0.05 0.96 0.00 0.37 0.00 0.00 175.52 176.90 2qkk n GLN 252 N -4.49 2.06 -2.59 6.66 3.00 0.14 -2.35 117.38 119.80 2qkk n GLN 252 Ca -0.02 0.75 -0.09 0.00 -0.01 0.00 0.00 57.00 57.63 2qkk n GLN 252 Cb 0.11 -2.55 0.04 0.00 0.00 0.00 0.00 30.24 27.85 2qkk n GLN 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2qkk n GLY 253 N 3.99 -0.38 3.63 1.08 0.00 -1.26 -5.05 105.19 107.19 2qkk n GLY 253 Ca 0.21 0.26 -0.02 0.00 0.00 0.00 0.00 46.02 46.47 2qkk n GLY 253 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qkk s MET 254 N -3.86 0.57 -1.17 1.61 -1.94 -0.99 -4.91 119.30 108.61 2qkk s MET 254 Ca 0.28 1.35 -0.06 0.00 -1.71 0.00 0.00 55.69 55.55 2qkk s MET 254 Cb -0.04 0.72 0.24 0.00 2.01 0.00 0.00 34.83 37.77 2qkk s MET 254 CO 0.46 -0.18 1.68 -3.47 -0.01 0.00 0.00 175.02 173.50 2qkk n ASP 255 N 5.21 5.88 -4.66 3.03 2.03 0.35 -4.99 116.55 123.40 2qkk n ASP 255 Ca -0.13 -3.28 -0.29 0.00 0.52 0.00 0.00 54.79 51.61 2qkk n ASP 255 Cb 0.51 -1.36 0.17 0.00 -0.72 0.00 0.00 41.12 39.72 2qkk n ASP 255 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2qkk s ILE 256 N -1.39 2.27 -0.28 5.18 -1.09 -1.26 -3.39 121.20 121.24 2qkk s ILE 256 Ca 0.35 0.09 -0.04 0.00 -2.23 0.00 0.00 60.65 58.82 2qkk s ILE 256 Cb 0.08 -2.50 0.16 0.00 -1.58 0.00 0.00 42.46 38.62 2qkk s ILE 256 CO 0.06 -0.11 0.54 -1.58 -1.23 0.00 0.00 174.94 172.62 2qkk s GLN 257 N -4.87 0.50 -0.03 2.79 0.74 -0.84 -4.90 119.66 113.05 2qkk s GLN 257 Ca 0.65 0.99 -0.15 0.00 0.05 0.00 0.00 55.36 56.90 2qkk s GLN 257 Cb -0.19 0.37 -0.05 0.00 1.10 0.00 0.00 33.01 34.23 2qkk s GLN 257 CO 0.58 -0.51 0.42 -1.58 -0.55 0.00 0.00 175.29 173.65 2qkk s TRP 258 N 2.78 3.67 -0.09 1.67 0.52 -1.26 0.16 118.94 126.38 2qkk s TRP 258 Ca 0.12 0.95 0.03 0.00 0.02 0.00 0.00 56.10 57.22 2qkk s TRP 258 Cb -0.14 -2.35 0.01 0.00 -1.15 0.00 0.00 33.47 29.83 2qkk s TRP 258 CO -0.19 0.52 -0.18 1.41 0.02 0.00 0.00 176.95 178.53 2qkk s MET 259 N -0.63 2.42 -0.29 4.98 1.75 0.35 -4.88 119.30 123.00 2qkk s MET 259 Ca 0.24 -0.66 -0.13 0.00 -1.25 0.00 0.00 55.69 53.89 2qkk s MET 259 Cb -0.16 -1.90 -0.04 0.00 2.84 0.00 0.00 34.83 35.57 2qkk s MET 259 CO 0.12 0.09 0.25 -1.58 -0.65 0.00 0.00 175.02 173.26 2qkk s HIS 260 N 0.54 3.23 -0.45 4.11 2.46 -1.25 -0.43 115.29 123.51 2qkk s HIS 260 Ca -0.16 0.12 -0.14 0.00 0.47 0.00 0.00 55.06 55.35 2qkk s HIS 260 Cb -0.17 -2.47 0.06 0.00 -0.13 0.00 0.00 32.58 29.88 2qkk s HIS 260 CO 0.06 -0.23 0.34 0.14 -2.47 0.00 0.00 174.74 172.58 2qkk s VAL 261 N 1.85 5.04 -0.37 0.89 -7.23 0.17 -4.93 120.40 115.81 2qkk s VAL 261 Ca 0.09 -1.03 -0.36 0.00 -1.81 0.00 0.00 61.98 58.87 2qkk s VAL 261 Cb -0.16 -3.97 -0.12 0.00 0.56 0.00 0.00 36.38 32.69 2qkk s VAL 261 CO 0.11 -0.50 2.20 -2.65 -0.31 0.00 0.00 175.10 173.95 2qkk n PRO 262 N 5.14 0.99 -0.33 4.82 -0.02 -1.26 -4.27 135.00 140.07 2qkk n PRO 262 Ca -0.12 0.26 -0.13 0.00 -2.02 0.00 0.00 63.50 61.49 2qkk n PRO 262 Cb 0.44 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.50 2qkk n PRO 262 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qkk n GLY 263 N 6.61 -0.06 2.32 -1.23 0.00 -1.26 0.89 105.19 112.46 2qkk n GLY 263 Ca 0.42 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.50 2qkk n GLY 263 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qkk n HIS 264 N 0.34 -0.82 -0.42 1.61 8.25 -1.26 -4.99 115.22 117.92 2qkk n HIS 264 Ca 0.04 0.16 -0.05 0.00 -0.26 0.00 0.00 57.72 57.62 2qkk n HIS 264 Cb 0.02 -2.72 0.04 0.00 1.12 0.00 0.00 29.99 28.45 2qkk n HIS 264 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2qkk n SER 265 N -0.32 -1.53 0.00 0.41 3.41 0.26 -5.07 113.62 110.77 2qkk n SER 265 Ca -0.09 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 2qkk n SER 265 Cb 0.58 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 2qkk n SER 265 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qkk n GLY 266 N 0.65 -2.89 2.39 5.00 0.00 -1.26 -4.86 105.19 104.22 2qkk n GLY 266 Ca 0.02 -0.30 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 2qkk n GLY 266 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qkk n PHE 267 N 0.00 0.23 0.11 1.61 3.72 -1.26 -4.81 117.46 117.05 2qkk n PHE 267 Ca 0.00 0.71 0.06 0.00 -0.05 0.00 0.00 57.45 58.17 2qkk n PHE 267 Cb 0.00 -1.42 0.30 0.00 -0.94 0.00 0.00 39.48 37.43 2qkk n PHE 267 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 2qkk n ILE 268 N 0.75 1.47 0.27 4.37 -0.00 -1.26 -2.28 119.36 122.70 2qkk n ILE 268 Ca 0.13 0.59 0.16 0.00 -0.00 0.00 0.00 62.75 63.63 2qkk n ILE 268 Cb 0.09 -1.58 0.89 0.00 -0.00 0.00 0.00 39.64 39.04 2qkk n ILE 268 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 2qkk h GLY 269 N 0.19 0.00 0.58 3.28 0.00 -1.99 -1.77 103.07 103.36 2qkk h GLY 269 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2qkk h GLY 269 CO 0.00 0.00 -0.19 3.43 0.00 0.00 0.00 176.54 179.78 2qkk h ASN 270 N 0.00 -0.45 0.00 0.19 -0.26 -1.79 -2.29 115.58 110.98 2qkk h ASN 270 Ca 0.02 -0.12 0.00 0.00 -0.56 0.00 0.00 56.30 55.64 2qkk h ASN 270 Cb 0.12 0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 2qkk h ASN 270 CO -0.00 -0.04 0.00 -0.62 -1.06 0.00 0.00 177.43 175.71 2qkk n GLU 271 N -5.16 0.85 -0.10 0.81 1.02 -0.84 -2.06 120.64 115.17 2qkk n GLU 271 Ca -0.09 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.87 2qkk n GLU 271 Cb 0.28 -1.32 -0.06 0.00 -0.02 0.00 0.00 31.44 30.32 2qkk n GLU 271 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2qkk n GLU 272 N -0.07 0.48 -0.13 3.49 -0.58 -0.73 -3.82 120.64 119.28 2qkk n GLU 272 Ca 0.00 0.20 -0.04 0.00 -0.42 0.00 0.00 57.16 56.90 2qkk n GLU 272 Cb 0.16 -1.31 0.04 0.00 -0.57 0.00 0.00 31.44 29.76 2qkk n GLU 272 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qkk h ALA 273 N -0.85 0.45 -1.03 0.62 0.00 -1.22 0.23 119.26 117.47 2qkk h ALA 273 Ca -0.33 0.09 0.26 0.00 0.00 0.00 0.00 54.91 54.93 2qkk h ALA 273 Cb 1.21 0.12 -0.11 0.00 0.00 0.00 0.00 17.79 19.01 2qkk h ALA 273 CO -0.20 -0.33 0.63 0.22 0.00 0.00 0.00 179.25 179.57 2qkk h ASP 274 N 0.20 0.58 -0.39 0.00 3.58 -1.63 0.20 116.42 118.97 2qkk h ASP 274 Ca 0.20 0.12 -0.16 0.00 0.42 0.00 0.00 57.03 57.61 2qkk h ASP 274 Cb 0.26 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2qkk h ASP 274 CO -0.28 0.08 -0.39 0.03 -2.88 0.00 0.00 179.24 175.81 2qkk h ARG 275 N 0.49 0.94 -0.29 0.28 2.47 -0.67 -2.91 114.38 114.70 2qkk h ARG 275 Ca 0.64 -0.50 -0.01 0.00 -1.26 0.00 0.00 59.98 58.85 2qkk h ARG 275 Cb 1.38 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.71 2qkk h ARG 275 CO -0.42 1.16 0.15 -0.07 0.56 0.00 0.00 179.97 181.35 2qkk h LEU 276 N 0.77 0.38 -0.27 3.04 3.38 0.11 -2.06 115.31 120.65 2qkk h LEU 276 Ca 0.06 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 57.98 2qkk h LEU 276 Cb 0.99 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 2qkk h LEU 276 CO 0.10 0.38 -0.11 0.00 0.09 0.00 0.00 178.44 178.89 2qkk h ALA 277 N 1.01 0.12 -0.57 1.53 0.00 -1.09 0.17 119.26 120.42 2qkk h ALA 277 Ca 0.10 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2qkk h ALA 277 Cb 0.10 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2qkk h ALA 277 CO -0.01 -0.51 0.38 0.00 0.00 0.00 0.00 179.25 179.10 2qkk h ARG 278 N -0.07 0.69 0.00 0.00 2.47 -1.40 0.87 114.38 116.94 2qkk h ARG 278 Ca 0.14 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 2qkk h ARG 278 Cb 0.28 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.45 2qkk h ARG 278 CO -0.32 0.45 0.00 0.93 0.56 0.00 0.00 179.97 181.59 2qkk h GLU 279 N 0.71 0.00 0.00 0.04 4.39 -0.20 -3.35 114.58 116.17 2qkk h GLU 279 Ca 0.22 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.92 2qkk h GLU 279 Cb 0.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2qkk h GLU 279 CO -0.06 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.20 2qkk n GLY 280 N 0.11 -0.74 0.69 -3.84 0.00 0.30 -4.59 105.19 97.13 2qkk n GLY 280 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2qkk n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkk n ALA 281 N -3.00 -0.24 -3.34 4.61 0.00 -1.20 -4.79 120.51 112.55 2qkk n ALA 281 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2qkk n ALA 281 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2qkk n ALA 281 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qkk s LYS 282 N -0.70 0.23 2.47 0.00 -0.14 -1.26 -5.02 119.74 115.33 2qkk s LYS 282 Ca 0.00 0.58 0.00 0.00 -1.36 0.00 0.00 55.97 55.19 2qkk s LYS 282 Cb 0.00 0.35 0.00 0.00 -1.68 0.00 0.00 37.83 36.50 2qkk s LYS 282 CO 0.00 -0.09 0.00 0.94 -0.76 0.00 0.00 175.35 175.44 2qkk n GLN 283 N 4.93 0.00 -4.00 1.68 -0.06 -1.26 -4.82 117.38 113.84 2qkk n GLN 283 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.92 2qkk n GLN 283 Cb 0.53 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.71 2qkk n GLN 283 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2qkk n SER 284 N 2.48 0.00 0.00 1.69 2.88 -1.26 -5.06 113.62 114.36 2qkk n SER 284 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2qkk n SER 284 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2qkk n SER 284 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19