#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkk n HIS 135 N 0.00 0.00 0.00 7.33 -0.00 -1.26 -5.15 115.22 116.14 2qkk n HIS 135 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2qkk n HIS 135 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2qkk n HIS 135 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2qkk n MET 136 N 0.00 0.00 -1.41 -0.41 -0.00 -1.26 -5.20 117.12 108.84 2qkk n MET 136 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 2qkk n MET 136 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 33.22 33.22 2qkk n MET 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2qkk n GLY 137 N 0.00 4.01 3.00 3.17 0.00 -1.26 -5.15 105.19 108.97 2qkk n GLY 137 Ca 0.00 -2.16 -0.16 0.00 0.00 0.00 0.00 46.02 43.70 2qkk n GLY 137 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2qkk s ASP 138 N -0.75 0.83 0.00 1.61 1.47 -1.26 -5.11 116.67 113.46 2qkk s ASP 138 Ca 0.00 -0.21 0.00 0.00 1.18 0.00 0.00 52.55 53.52 2qkk s ASP 138 Cb 0.00 -0.07 0.00 0.00 -0.34 0.00 0.00 42.92 42.51 2qkk s ASP 138 CO 0.00 0.03 0.00 2.22 0.68 0.00 0.00 175.17 178.10 2qkk n PHE 139 N 2.61 0.00 -2.84 2.11 -1.74 -1.26 -4.91 117.46 111.42 2qkk n PHE 139 Ca -0.15 0.00 -0.23 0.00 -0.56 0.00 0.00 57.45 56.51 2qkk n PHE 139 Cb 0.57 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.59 2qkk n PHE 139 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2qkk s VAL 140 N -0.65 3.62 0.06 1.97 -7.23 -1.20 -4.88 120.40 112.08 2qkk s VAL 140 Ca 0.00 -0.50 0.09 0.00 -1.81 0.00 0.00 61.98 59.77 2qkk s VAL 140 Cb 0.00 -3.35 -0.03 0.00 0.56 0.00 0.00 36.38 33.56 2qkk s VAL 140 CO 0.00 -0.26 -0.26 -0.69 -0.31 0.00 0.00 175.10 173.58 2qkk s VAL 141 N -2.65 2.11 -0.10 1.32 1.01 -1.26 -1.07 120.40 119.76 2qkk s VAL 141 Ca 0.51 -1.42 -0.11 0.00 0.00 0.00 0.00 61.98 60.96 2qkk s VAL 141 Cb -0.10 -1.81 0.03 0.00 0.00 0.00 0.00 36.38 34.50 2qkk s VAL 141 CO 0.39 0.31 0.31 0.54 0.00 0.00 0.00 175.10 176.65 2qkk s VAL 142 N -0.84 0.01 -0.11 2.92 0.11 -0.80 -4.68 120.40 117.01 2qkk s VAL 142 Ca 0.12 -0.09 -0.03 0.00 -2.93 0.00 0.00 61.98 59.05 2qkk s VAL 142 Cb -0.10 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.25 2qkk s VAL 142 CO 0.03 -0.05 -0.00 -0.31 -3.33 0.00 0.00 175.10 171.44 2qkk s TYR 143 N -0.09 3.14 0.09 1.54 2.02 0.53 -1.17 117.35 123.41 2qkk s TYR 143 Ca -0.02 0.08 0.06 0.00 -0.37 0.00 0.00 57.07 56.81 2qkk s TYR 143 Cb -0.03 -1.85 -0.03 0.00 -0.40 0.00 0.00 41.96 39.65 2qkk s TYR 143 CO 0.01 0.33 -0.15 0.95 -1.57 0.00 0.00 175.55 175.12 2qkk s THR 144 N -0.49 1.27 -0.29 -0.71 -4.23 -0.30 -0.97 115.64 109.93 2qkk s THR 144 Ca 0.09 -1.49 -0.16 0.00 -1.18 0.00 0.00 61.69 58.94 2qkk s THR 144 Cb -0.12 -1.31 0.12 0.00 1.34 0.00 0.00 72.50 72.53 2qkk s THR 144 CO 0.02 -0.28 0.84 -0.62 -0.54 0.00 0.00 174.62 174.05 2qkk s ASP 145 N -2.03 -0.72 -0.22 3.99 2.15 -0.98 -4.36 116.67 114.50 2qkk s ASP 145 Ca 0.03 1.14 -0.03 0.00 0.43 0.00 0.00 52.55 54.12 2qkk s ASP 145 Cb -0.08 1.32 -0.00 0.00 -0.30 0.00 0.00 42.92 43.85 2qkk s ASP 145 CO 0.03 -0.18 -0.05 -0.83 -0.17 0.00 0.00 175.17 173.97 2qkk s GLY 146 N 1.52 1.60 0.23 2.66 0.00 -1.26 -2.38 107.32 109.70 2qkk s GLY 146 Ca -0.09 -1.21 0.05 0.00 0.00 0.00 0.00 44.72 43.47 2qkk s GLY 146 CO -0.17 0.44 0.33 0.00 0.00 0.00 0.00 173.10 173.69 2qkk s SER 149 N 1.91 6.68 -0.61 0.00 0.15 0.71 -4.74 113.70 117.79 2qkk s SER 149 Ca 0.15 0.95 -0.01 0.00 0.70 0.00 0.00 55.95 57.74 2qkk s SER 149 Cb -0.06 -2.54 0.46 0.00 -1.71 0.00 0.00 66.02 62.16 2qkk s SER 149 CO -0.09 -1.12 1.92 -1.54 1.20 0.00 0.00 173.24 173.61 2qkk n SER 150 N 7.66 7.24 -4.72 5.45 3.41 -1.26 -1.29 113.62 130.10 2qkk n SER 150 Ca 0.14 -3.78 -0.42 0.00 -0.26 0.00 0.00 58.87 54.55 2qkk n SER 150 Cb 0.47 -0.89 -0.03 0.00 -0.26 0.00 0.00 64.21 63.50 2qkk n SER 150 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2qkk s ASN 151 N -2.06 7.09 0.80 4.04 0.02 -1.26 -4.86 114.94 118.70 2qkk s ASN 151 Ca 0.63 2.05 0.00 0.00 -1.02 0.00 0.00 52.86 54.52 2qkk s ASN 151 Cb 0.50 -2.58 0.00 0.00 0.02 0.00 0.00 41.25 39.18 2qkk s ASN 151 CO -0.00 -0.44 0.00 0.61 0.02 0.00 0.00 177.10 177.29 2qkk n GLY 152 N 3.00 1.87 0.23 0.66 0.00 -1.26 -3.33 105.19 106.36 2qkk n GLY 152 Ca 0.08 -0.56 0.09 0.00 0.00 0.00 0.00 46.02 45.63 2qkk n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkk n ARG 153 N 8.81 1.33 0.02 1.61 3.00 -1.26 -4.58 116.66 125.59 2qkk n ARG 153 Ca 0.00 -2.74 0.13 0.00 -0.01 0.00 0.00 57.85 55.24 2qkk n ARG 153 Cb 0.00 -1.50 0.50 0.00 0.00 0.00 0.00 32.46 31.46 2qkk n ARG 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2qkk n ARG 154 N -1.31 0.05 0.00 5.56 1.74 -1.21 -5.03 116.66 116.46 2qkk n ARG 154 Ca 0.16 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 2qkk n ARG 154 Cb 0.66 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 2qkk n ARG 154 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2qkk n ARG 155 N -1.65 0.00 -0.61 5.56 1.85 -1.26 -5.04 116.66 115.51 2qkk n ARG 155 Ca 0.06 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.60 2qkk n ARG 155 Cb 0.36 0.00 0.19 0.00 -1.05 0.00 0.00 32.46 31.96 2qkk n ARG 155 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2qkk n PRO 156 N -0.24 -1.94 -3.64 2.89 -0.02 -1.25 -4.56 135.00 126.23 2qkk n PRO 156 Ca 0.00 -0.55 -0.05 0.00 -2.02 0.00 0.00 63.50 60.89 2qkk n PRO 156 Cb 0.00 -1.78 -0.07 0.00 -0.02 0.00 0.00 33.50 31.63 2qkk n PRO 156 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qkk s ARG 157 N -3.65 0.47 0.05 -0.52 0.52 -0.41 -4.92 118.95 110.47 2qkk s ARG 157 Ca 0.58 0.75 0.02 0.00 -0.52 0.00 0.00 55.73 56.56 2qkk s ARG 157 Cb -0.14 0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.43 2qkk s ARG 157 CO 0.65 -0.09 -0.07 0.00 0.02 0.00 0.00 175.30 175.81 2qkk s ALA 158 N 1.18 0.57 0.13 2.13 0.00 -1.26 0.25 121.76 124.77 2qkk s ALA 158 Ca -0.07 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.15 2qkk s ALA 158 Cb -0.04 0.06 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 2qkk s ALA 158 CO -0.14 -0.05 -0.14 0.20 0.00 0.00 0.00 175.76 175.63 2qkk s GLY 159 N -1.70 1.11 -0.12 0.00 0.00 -0.45 -2.52 107.32 103.64 2qkk s GLY 159 Ca -0.08 -1.35 -0.14 0.00 0.00 0.00 0.00 44.72 43.15 2qkk s GLY 159 CO -0.00 -1.41 0.32 -0.42 0.00 0.00 0.00 173.10 171.59 2qkk s ILE 160 N -2.31 5.26 -0.08 0.90 -1.09 0.14 -3.22 121.20 120.79 2qkk s ILE 160 Ca 0.11 0.61 -0.01 0.00 -2.23 0.00 0.00 60.65 59.13 2qkk s ILE 160 Cb -0.04 -3.64 0.03 0.00 -1.58 0.00 0.00 42.46 37.22 2qkk s ILE 160 CO 0.03 0.44 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.33 2qkk s GLY 161 N 0.02 0.57 -0.03 6.18 0.00 -1.00 -3.06 107.32 110.00 2qkk s GLY 161 Ca 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 44.72 44.65 2qkk s GLY 161 CO 0.06 0.97 0.05 0.54 0.00 0.00 0.00 173.10 174.72 2qkk s VAL 162 N 1.78 -0.09 -0.14 1.40 0.11 -0.92 -2.31 120.40 120.22 2qkk s VAL 162 Ca 0.03 0.36 0.01 0.00 -2.93 0.00 0.00 61.98 59.45 2qkk s VAL 162 Cb -0.13 -0.13 0.02 0.00 -1.53 0.00 0.00 36.38 34.61 2qkk s VAL 162 CO -0.05 0.15 -0.15 -0.47 -3.33 0.00 0.00 175.10 171.25 2qkk s TYR 163 N 1.83 2.13 -0.03 1.54 6.14 -0.15 -1.79 117.35 127.03 2qkk s TYR 163 Ca 0.01 -1.15 0.17 0.00 0.64 0.00 0.00 57.07 56.75 2qkk s TYR 163 Cb -0.12 -1.56 -0.27 0.00 0.42 0.00 0.00 41.96 40.43 2qkk s TYR 163 CO -0.03 -0.62 0.37 0.91 0.64 0.00 0.00 175.55 176.82 2qkk n TRP 164 N 4.59 0.00 0.00 4.97 7.02 -1.26 -0.35 117.44 132.42 2qkk n TRP 164 Ca -0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.30 2qkk n TRP 164 Cb 0.50 -0.42 0.00 0.00 -2.42 0.00 0.00 31.31 28.98 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 1.53 2.50 3.59 6.99 0.00 -1.26 -4.84 105.19 113.70 2qkk n GLY 165 Ca -0.04 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.99 0.87 -0.16 1.61 -0.02 -1.26 -1.81 135.00 133.25 2qkk n PRO 166 Ca 0.00 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2qkk n PRO 166 Cb 0.00 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 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 1.36 0.00 3.52 -1.23 0.00 -1.26 -4.83 105.19 102.74 2qkk n GLY 167 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 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 0.07 0.50 0.91 1.61 -0.00 -0.75 -4.89 115.22 112.67 2qkk n HIS 168 Ca 0.00 0.76 0.14 0.00 0.46 0.00 0.00 57.72 59.07 2qkk n HIS 168 Cb 0.00 -2.13 0.53 0.00 -0.12 0.00 0.00 29.99 28.27 2qkk n HIS 168 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2qkk n PRO 169 N 0.77 0.07 0.00 1.57 -0.04 -1.26 -3.47 135.00 132.63 2qkk n PRO 169 Ca 0.12 0.05 0.11 0.00 -0.04 0.00 0.00 63.50 63.74 2qkk n PRO 169 Cb 0.31 -1.57 0.05 0.00 -0.04 0.00 0.00 33.50 32.26 2qkk n PRO 169 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2qkk n LEU 170 N -1.68 0.78 -4.73 1.53 4.32 -1.26 -4.95 117.00 111.00 2qkk n LEU 170 Ca 0.06 -0.27 -0.42 0.00 -0.02 0.00 0.00 56.01 55.36 2qkk n LEU 170 Cb 0.36 -0.12 -0.02 0.00 -1.62 0.00 0.00 43.42 42.03 2qkk n LEU 170 CO 0.29 0.19 1.20 0.59 -1.22 0.00 0.00 177.39 178.44 2qkk n ASN 171 N -1.49 3.64 -3.89 -1.43 4.13 -1.23 -4.93 115.26 110.06 2qkk n ASN 171 Ca 0.05 1.14 -0.11 0.00 1.68 0.00 0.00 54.58 57.34 2qkk n ASN 171 Cb 0.33 -1.56 -0.13 0.00 -1.54 0.00 0.00 39.78 36.89 2qkk n ASN 171 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2qkk s VAL 172 N 0.00 0.04 -0.41 2.41 1.01 -0.74 -5.03 120.40 117.68 2qkk s VAL 172 Ca 0.65 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.33 2qkk s VAL 172 Cb -0.53 -0.15 0.15 0.00 0.00 0.00 0.00 36.38 35.86 2qkk s VAL 172 CO 0.48 -0.17 0.28 -0.83 0.00 0.00 0.00 175.10 174.86 2qkk s GLY 173 N -0.52 1.27 0.14 4.51 0.00 -1.26 -2.18 107.32 109.29 2qkk s GLY 173 Ca -0.06 -2.34 0.10 0.00 0.00 0.00 0.00 44.72 42.42 2qkk s GLY 173 CO -0.00 1.93 -0.18 -0.26 0.00 0.00 0.00 173.10 174.59 2qkk s ILE 174 N 0.42 2.77 0.02 0.90 -4.36 -1.17 -3.40 121.20 116.38 2qkk s ILE 174 Ca 0.23 -1.65 -0.30 0.00 -0.26 0.00 0.00 60.65 58.68 2qkk s ILE 174 Cb -0.13 -2.30 -0.04 0.00 1.25 0.00 0.00 42.46 41.25 2qkk s ILE 174 CO -0.07 0.02 0.96 -0.60 0.24 0.00 0.00 174.94 175.49 2qkk s ARG 175 N -2.36 4.58 0.14 0.37 3.52 -1.20 0.24 118.95 124.24 2qkk s ARG 175 Ca 0.19 1.40 -0.31 0.00 -0.13 0.00 0.00 55.73 56.88 2qkk s ARG 175 Cb -0.10 -3.44 -0.10 0.00 -1.56 0.00 0.00 34.95 29.76 2qkk s ARG 175 CO 0.11 0.01 1.61 -1.17 -0.81 0.00 0.00 175.30 175.05 2qkk s LEU 176 N 0.79 4.37 0.17 -0.88 2.96 -1.05 -4.85 118.68 120.19 2qkk s LEU 176 Ca 0.50 2.59 -0.13 0.00 -0.22 0.00 0.00 54.13 56.87 2qkk s LEU 176 Cb -0.21 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 42.82 2qkk s LEU 176 CO 0.28 -0.86 0.56 -2.16 -1.32 0.00 0.00 176.35 172.85 2qkk s PRO 177 N 1.67 3.94 0.00 0.98 0.04 -1.26 -4.84 135.00 135.53 2qkk s PRO 177 Ca 0.72 0.45 0.00 0.00 0.04 0.00 0.00 61.00 62.21 2qkk s PRO 177 Cb -0.43 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.26 2qkk s PRO 177 CO 0.32 0.43 0.00 0.41 0.04 0.00 0.00 177.00 178.20 2qkk n GLY 178 N 0.55 0.81 3.74 0.56 0.00 -1.26 -4.95 105.19 104.65 2qkk n GLY 178 Ca -0.04 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 2qkk n GLY 178 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qkk s ARG 179 N 0.00 4.23 -1.09 1.61 0.52 -1.26 -4.94 118.95 118.01 2qkk s ARG 179 Ca 0.00 2.38 -0.11 0.00 -0.52 0.00 0.00 55.73 57.47 2qkk s ARG 179 Cb 0.00 -3.09 0.24 0.00 0.52 0.00 0.00 34.95 32.62 2qkk s ARG 179 CO 0.00 -0.49 1.14 -0.65 0.02 0.00 0.00 175.30 175.32 2qkk s GLN 180 N -0.23 4.08 0.18 3.54 -1.52 -1.26 -4.92 119.66 119.52 2qkk s GLN 180 Ca 0.61 -2.91 0.07 0.00 -1.95 0.00 0.00 55.36 51.19 2qkk s GLN 180 Cb -0.44 -4.68 -0.04 0.00 -0.22 0.00 0.00 33.01 27.63 2qkk s GLN 180 CO 0.43 -1.40 -0.14 0.95 -0.25 0.00 0.00 175.29 174.88 2qkk s THR 181 N -0.23 1.61 0.00 -0.19 -4.23 -1.26 -4.64 115.64 106.69 2qkk s THR 181 Ca 0.32 -2.08 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 2qkk s THR 181 Cb -0.08 -1.91 0.00 0.00 1.34 0.00 0.00 72.50 71.85 2qkk s THR 181 CO -0.06 -0.55 0.14 -3.20 -0.54 0.00 0.00 174.62 170.41 2qkk n ASN 182 N -0.12 0.00 -0.69 3.99 4.05 -1.26 -2.48 115.26 118.75 2qkk n ASN 182 Ca -0.10 0.14 0.00 0.00 0.45 0.00 0.00 54.58 55.07 2qkk n ASN 182 Cb 0.59 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.60 2qkk n ASN 182 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2qkk n GLN 183 N -0.25 0.21 -0.00 1.20 6.02 -1.26 -2.15 117.38 121.14 2qkk n GLN 183 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2qkk n GLN 183 Cb 0.00 -1.21 -0.00 0.00 1.02 0.00 0.00 30.24 30.04 2qkk n GLN 183 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2qkk n ARG 184 N 0.58 2.06 -0.05 -1.09 0.63 -1.03 -4.54 116.66 113.22 2qkk n ARG 184 Ca 0.00 -0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.89 2qkk n ARG 184 Cb 0.07 -1.02 -0.04 0.00 0.45 0.00 0.00 32.46 31.93 2qkk n ARG 184 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qkk h ALA 185 N 0.04 -0.02 -0.83 5.13 0.00 -1.20 -2.99 119.26 119.41 2qkk h ALA 185 Ca -0.01 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 54.88 2qkk h ALA 185 Cb 0.56 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.22 2qkk h ALA 185 CO 0.00 -0.02 -0.43 1.49 0.00 0.00 0.00 179.25 180.29 2qkk h GLU 186 N -1.00 -0.08 -0.74 0.00 4.57 -1.70 0.12 114.58 115.75 2qkk h GLU 186 Ca -0.00 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2qkk h GLU 186 Cb 0.28 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 2qkk h GLU 186 CO 0.00 -0.06 0.48 0.97 -1.18 0.00 0.00 179.01 179.22 2qkk h ILE 187 N -0.09 1.15 0.00 2.32 2.10 -1.80 -1.31 117.51 119.88 2qkk h ILE 187 Ca 0.25 -0.33 0.00 0.00 1.08 0.00 0.00 64.86 65.86 2qkk h ILE 187 Cb 0.55 0.11 0.00 0.00 -1.09 0.00 0.00 36.82 36.39 2qkk h ILE 187 CO -0.86 0.17 0.00 1.41 -1.08 0.00 0.00 178.15 177.80 2qkk n HIS 188 N -4.60 0.37 0.08 2.19 8.25 0.31 -1.74 115.22 120.07 2qkk n HIS 188 Ca 0.08 0.15 -0.22 0.00 -0.26 0.00 0.00 57.72 57.46 2qkk n HIS 188 Cb 0.05 -0.74 -0.15 0.00 1.12 0.00 0.00 29.99 30.27 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 2.36 -0.10 -0.83 -1.41 0.00 -0.05 -2.56 119.26 116.66 2qkk h ALA 189 Ca 0.00 -0.78 0.15 0.00 0.00 0.00 0.00 54.91 54.28 2qkk h ALA 189 Cb 0.27 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2qkk h ALA 189 CO 0.00 0.52 0.54 0.00 0.00 0.00 0.00 179.25 180.32 2qkk h ALA 190 N 0.10 2.00 -0.75 0.00 0.00 -1.03 -1.08 119.26 118.49 2qkk h ALA 190 Ca -0.20 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2qkk h ALA 190 Cb 1.85 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.55 2qkk h ALA 190 CO 0.19 -0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.22 2qkk n LYS 192 N -1.63 -0.06 0.28 0.00 3.00 -0.98 0.32 118.16 119.09 2qkk n LYS 192 Ca 0.00 1.35 -0.11 0.00 -0.00 0.00 0.00 58.31 59.55 2qkk n LYS 192 Cb 0.00 -2.38 -0.06 0.00 0.00 0.00 0.00 35.03 32.60 2qkk n LYS 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qkk h ALA 193 N 1.93 -1.17 0.00 3.14 0.00 -1.04 -0.26 119.26 121.86 2qkk h ALA 193 Ca 0.78 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2qkk h ALA 193 Cb 2.00 0.34 0.00 0.00 0.00 0.00 0.00 17.79 20.12 2qkk h ALA 193 CO -0.77 -1.12 0.00 1.51 0.00 0.00 0.00 179.25 178.86 2qkk n ILE 194 N -4.06 1.62 -0.04 0.00 3.06 0.75 -0.55 119.36 120.13 2qkk n ILE 194 Ca -0.09 0.41 -0.00 0.00 -2.50 0.00 0.00 62.75 60.56 2qkk n ILE 194 Cb 0.29 -1.33 -0.00 0.00 0.54 0.00 0.00 39.64 39.14 2qkk n ILE 194 CO 0.00 0.00 0.00 -0.08 -2.50 0.00 0.00 176.55 173.97 2qkk h GLU 195 N 0.00 -0.01 -0.70 9.51 4.81 0.48 -3.19 114.58 125.48 2qkk h GLU 195 Ca 0.00 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.36 2qkk h GLU 195 Cb 0.07 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.36 2qkk h GLU 195 CO 0.00 -0.01 0.26 1.96 -0.73 0.00 0.00 179.01 180.50 2qkk h GLN 196 N -0.90 0.41 -1.00 1.92 4.20 -0.49 0.10 115.11 119.34 2qkk h GLN 196 Ca -0.00 -0.02 0.38 0.00 0.06 0.00 0.00 58.65 59.06 2qkk h GLN 196 Cb 0.01 -0.09 -0.17 0.00 0.30 0.00 0.00 27.48 27.52 2qkk h GLN 196 CO 0.00 0.27 0.50 0.00 -0.67 0.00 0.00 178.83 178.93 2qkk h ALA 197 N 1.51 2.01 0.00 3.87 0.00 -0.90 1.99 119.26 127.74 2qkk h ALA 197 Ca 0.37 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2qkk h ALA 197 Cb 0.54 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2qkk h ALA 197 CO -0.38 -0.81 0.00 1.63 0.00 0.00 0.00 179.25 179.70 2qkk n LYS 198 N -5.21 0.06 0.00 0.00 5.02 0.02 -0.92 118.16 117.12 2qkk n LYS 198 Ca 0.35 0.10 0.12 0.00 -2.02 0.00 0.00 58.31 56.86 2qkk n LYS 198 Cb 1.15 -1.58 0.25 0.00 -0.02 0.00 0.00 35.03 34.83 2qkk n LYS 198 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2qkk n THR 199 N -1.69 0.00 0.18 -0.18 -2.24 0.67 -3.17 114.28 107.85 2qkk n THR 199 Ca 0.06 -0.02 0.07 0.00 -2.27 0.00 0.00 64.05 61.89 2qkk n THR 199 Cb 0.33 0.32 0.13 0.00 -2.10 0.00 0.00 70.33 69.02 2qkk n THR 199 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qkk n GLN 200 N -1.34 1.96 -3.26 -0.78 1.13 -1.10 -4.94 117.38 109.05 2qkk n GLN 200 Ca 0.07 -1.81 -0.22 0.00 -1.94 0.00 0.00 57.00 53.09 2qkk n GLN 200 Cb 0.34 -1.32 0.05 0.00 0.11 0.00 0.00 30.24 29.42 2qkk n GLN 200 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2qkk n ASN 201 N 0.83 -6.13 -4.65 1.08 4.05 -1.19 -4.93 115.26 104.32 2qkk n ASN 201 Ca 0.12 -0.39 -0.43 0.00 0.45 0.00 0.00 54.58 54.33 2qkk n ASN 201 Cb 0.43 -4.86 -0.02 0.00 1.23 0.00 0.00 39.78 36.55 2qkk n ASN 201 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 2qkk s ILE 202 N -3.23 4.63 -0.54 -1.44 -1.16 -0.10 -4.87 121.20 114.49 2qkk s ILE 202 Ca 0.42 1.81 0.23 0.00 -0.51 0.00 0.00 60.65 62.61 2qkk s ILE 202 Cb -0.19 -4.33 -0.06 0.00 0.61 0.00 0.00 42.46 38.50 2qkk s ILE 202 CO 0.52 -0.30 1.09 -0.46 -2.81 0.00 0.00 174.94 172.98 2qkk n ASN 203 N 6.52 0.65 -3.28 4.50 0.23 -1.26 -4.54 115.26 118.08 2qkk n ASN 203 Ca 0.11 -0.02 -0.05 0.00 -0.53 0.00 0.00 54.58 54.09 2qkk n ASN 203 Cb 0.47 0.60 -0.05 0.00 -2.08 0.00 0.00 39.78 38.72 2qkk n ASN 203 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 2qkk s LYS 204 N -3.23 0.43 0.25 -3.83 -2.85 -1.26 -1.53 119.74 107.72 2qkk s LYS 204 Ca 0.03 0.63 0.09 0.00 -1.00 0.00 0.00 55.97 55.72 2qkk s LYS 204 Cb 0.13 -0.13 -0.05 0.00 -2.06 0.00 0.00 37.83 35.72 2qkk s LYS 204 CO 0.78 -0.69 -0.14 -0.48 0.10 0.00 0.00 175.35 174.92 2qkk s LEU 205 N 2.65 2.56 -0.20 2.77 2.34 -1.15 -3.22 118.68 124.43 2qkk s LEU 205 Ca 0.15 -1.07 -0.05 0.00 0.06 0.00 0.00 54.13 53.22 2qkk s LEU 205 Cb -0.15 -0.81 -0.03 0.00 -0.56 0.00 0.00 46.19 44.65 2qkk s LEU 205 CO -0.19 -0.15 0.01 -0.69 -1.06 0.00 0.00 176.35 174.27 2qkk s VAL 206 N -2.83 4.07 -0.29 1.48 1.01 -0.23 -1.97 120.40 121.65 2qkk s VAL 206 Ca 0.27 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 2qkk s VAL 206 Cb -0.01 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.56 2qkk s VAL 206 CO 0.11 0.43 0.02 -0.22 0.00 0.00 0.00 175.10 175.43 2qkk s LEU 207 N 0.91 3.70 -0.23 3.92 0.20 -0.58 -1.90 118.68 124.70 2qkk s LEU 207 Ca 0.01 -0.95 -0.18 0.00 0.69 0.00 0.00 54.13 53.70 2qkk s LEU 207 Cb -0.14 -1.77 -0.03 0.00 -0.43 0.00 0.00 46.19 43.82 2qkk s LEU 207 CO 0.02 -0.20 0.52 -0.31 -0.29 0.00 0.00 176.35 176.09 2qkk s TYR 208 N 1.37 3.32 -0.11 5.38 1.51 -0.32 -0.92 117.35 127.59 2qkk s TYR 208 Ca -0.01 0.71 -0.20 0.00 -1.01 0.00 0.00 57.07 56.56 2qkk s TYR 208 Cb -0.18 -2.70 0.05 0.00 -0.11 0.00 0.00 41.96 39.02 2qkk s TYR 208 CO -0.01 -0.18 0.50 -0.08 -1.11 0.00 0.00 175.55 174.67 2qkk s THR 209 N 1.95 0.02 -0.73 -0.71 -1.32 -0.59 -1.15 115.64 113.11 2qkk s THR 209 Ca 0.23 -0.14 0.09 0.00 -1.21 0.00 0.00 61.69 60.66 2qkk s THR 209 Cb -0.15 -0.76 0.47 0.00 -1.51 0.00 0.00 72.50 70.54 2qkk s THR 209 CO 0.09 -0.07 1.23 -0.46 -2.21 0.00 0.00 174.62 173.20 2qkk n ASN 210 N 1.88 3.58 -4.30 8.08 6.94 -1.26 -1.77 115.26 128.42 2qkk n ASN 210 Ca -0.17 -2.48 -0.44 0.00 -0.02 0.00 0.00 54.58 51.47 2qkk n ASN 210 Cb 0.56 -0.57 -0.01 0.00 -2.36 0.00 0.00 39.78 37.40 2qkk n ASN 210 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2qkk n SER 211 N 0.41 5.37 -0.35 0.53 2.88 -1.26 -4.87 113.62 116.33 2qkk n SER 211 Ca 0.16 -3.07 0.18 0.00 -1.33 0.00 0.00 58.87 54.81 2qkk n SER 211 Cb 0.75 -1.33 0.39 0.00 -0.75 0.00 0.00 64.21 63.27 2qkk n SER 211 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2qkk h MET 212 N 6.50 0.56 -0.30 -1.46 2.86 -1.93 0.19 114.93 121.35 2qkk h MET 212 Ca 0.18 -0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.85 2qkk h MET 212 Cb 0.85 -0.13 -0.06 0.00 0.06 0.00 0.00 31.60 32.32 2qkk h MET 212 CO 1.01 0.37 -0.11 0.35 1.06 0.00 0.00 176.91 179.59 2qkk h PHE 213 N 0.58 -0.24 0.41 -0.22 3.57 -1.96 0.56 116.94 119.64 2qkk h PHE 213 Ca 0.65 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 62.16 2qkk h PHE 213 Cb 1.23 0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.13 2qkk h PHE 213 CO -0.01 -0.17 -0.23 1.15 -2.23 0.00 0.00 178.31 176.83 2qkk h THR 214 N -0.05 0.00 -0.39 4.41 2.02 -1.35 -0.81 112.91 116.74 2qkk h THR 214 Ca 0.15 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.39 2qkk h THR 214 Cb 0.28 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.60 2qkk h THR 214 CO -0.34 0.00 -0.49 0.40 0.37 0.00 0.00 175.52 175.47 2qkk h ILE 215 N -0.59 0.06 0.00 3.11 2.04 -1.28 1.25 117.51 122.10 2qkk h ILE 215 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2qkk h ILE 215 Cb 0.47 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2qkk h ILE 215 CO 0.07 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.81 2qkk n ASN 216 N -5.40 0.00 -0.09 1.72 5.03 0.19 -1.84 115.26 114.88 2qkk n ASN 216 Ca -0.02 0.41 -0.23 0.00 0.87 0.00 0.00 54.58 55.61 2qkk n ASN 216 Cb 0.35 -0.41 -0.12 0.00 -1.02 0.00 0.00 39.78 38.58 2qkk n ASN 216 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qkk n GLY 217 N -1.40 -0.61 0.22 7.41 0.00 0.41 -2.77 105.19 108.45 2qkk n GLY 217 Ca 0.00 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.08 2qkk n GLY 217 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qkk n ILE 218 N -3.98 0.00 0.10 -0.61 0.13 -0.18 -0.63 119.36 114.19 2qkk n ILE 218 Ca -0.39 -0.12 0.01 0.00 -1.10 0.00 0.00 62.75 61.16 2qkk n ILE 218 Cb 0.87 0.11 -0.02 0.00 -0.84 0.00 0.00 39.64 39.76 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 -0.61 0.00 0.00 9.51 -2.24 -0.76 -4.84 114.28 115.34 2qkk n THR 219 Ca 0.16 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2qkk n THR 219 Cb 0.29 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 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 -1.19 0.00 0.17 3.42 2.85 -1.24 -4.92 115.26 114.36 2qkk n ASN 220 Ca 0.00 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.59 2qkk n ASN 220 Cb 0.05 0.00 0.62 0.00 1.24 0.00 0.00 39.78 41.69 2qkk n ASN 220 CO 0.00 0.00 0.00 -0.50 -2.11 0.00 0.00 177.26 174.65 2qkk h TRP 221 N 0.00 0.00 0.38 1.20 6.55 -1.55 -3.20 115.95 119.33 2qkk h TRP 221 Ca 0.00 0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.82 2qkk h TRP 221 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.30 2qkk h TRP 221 CO 0.00 0.00 -0.18 -0.39 -1.05 0.00 0.00 178.44 176.82 2qkk h VAL 222 N 0.00 0.08 -0.90 1.49 -1.51 -1.16 -2.95 116.25 111.30 2qkk h VAL 222 Ca 0.00 -0.66 0.26 0.00 -1.23 0.00 0.00 66.70 65.08 2qkk h VAL 222 Cb 0.02 0.13 -0.04 0.00 -2.13 0.00 0.00 31.29 29.27 2qkk h VAL 222 CO 0.00 0.02 0.66 1.56 -1.23 0.00 0.00 177.57 178.58 2qkk h GLN 223 N -1.12 0.00 0.40 5.19 4.20 -1.83 -2.24 115.11 119.72 2qkk h GLN 223 Ca -0.05 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2qkk h GLN 223 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2qkk h GLN 223 CO 0.08 0.00 -0.19 0.78 -0.67 0.00 0.00 178.83 178.83 2qkk h GLY 224 N 0.00 -0.56 -0.44 3.46 0.00 -1.65 -3.26 103.07 100.62 2qkk h GLY 224 Ca 0.43 0.21 0.34 0.00 0.00 0.00 0.00 47.33 48.31 2qkk h GLY 224 CO -0.00 -0.20 0.83 1.49 0.00 0.00 0.00 176.54 178.65 2qkk h TRP 225 N -1.08 0.21 0.53 5.60 6.55 -1.22 -0.88 115.95 125.66 2qkk h TRP 225 Ca -0.06 0.01 -0.03 0.00 0.95 0.00 0.00 58.89 59.77 2qkk h TRP 225 Cb 0.49 -0.06 0.01 0.00 -0.86 0.00 0.00 29.16 28.74 2qkk h TRP 225 CO 0.02 0.00 -0.25 0.87 -1.05 0.00 0.00 178.44 178.02 2qkk h LYS 226 N 0.11 -0.69 -0.96 0.49 1.57 -1.56 0.83 116.57 116.36 2qkk h LYS 226 Ca 0.61 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.43 2qkk h LYS 226 Cb 2.16 0.16 0.00 0.00 0.08 0.00 0.00 32.23 34.63 2qkk h LYS 226 CO -0.11 -0.46 0.00 0.36 -0.57 0.00 0.00 179.45 178.67 2qkk n LYS 227 N -3.94 0.81 0.00 3.15 2.85 -0.42 -2.93 118.16 117.68 2qkk n LYS 227 Ca -0.09 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.17 2qkk n LYS 227 Cb 0.28 -1.28 0.00 0.00 -0.65 0.00 0.00 35.03 33.38 2qkk n LYS 227 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2qkk n ASN 228 N 0.29 0.05 0.00 -5.58 2.85 -0.70 -5.02 115.26 107.15 2qkk n ASN 228 Ca 0.00 -0.58 0.00 0.00 -0.11 0.00 0.00 54.58 53.89 2qkk n ASN 228 Cb 0.28 0.04 0.00 0.00 1.24 0.00 0.00 39.78 41.34 2qkk n ASN 228 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2qkk n GLY 229 N 0.04 0.75 3.13 8.20 0.00 0.02 -4.19 105.19 113.13 2qkk n GLY 229 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.22 -2.14 -4.79 1.61 7.02 0.27 -4.96 117.44 112.22 2qkk n TRP 230 Ca 0.00 0.81 -0.31 0.00 -1.02 0.00 0.00 57.50 56.97 2qkk n TRP 230 Cb 0.00 -4.29 -0.13 0.00 -2.42 0.00 0.00 31.31 24.47 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 -4.63 2.16 0.86 -0.99 -0.14 -1.26 -2.41 119.74 113.34 2qkk s LYS 231 Ca 0.26 -0.91 -0.12 0.00 -1.36 0.00 0.00 55.97 53.83 2qkk s LYS 231 Cb -0.03 -2.21 0.11 0.00 -1.68 0.00 0.00 37.83 34.02 2qkk s LYS 231 CO 0.67 0.56 1.10 0.99 -0.76 0.00 0.00 175.35 177.91 2qkk s THR 232 N -0.84 2.68 0.00 2.17 2.01 0.68 -4.80 115.64 117.54 2qkk s THR 232 Ca 0.13 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.35 2qkk s THR 232 Cb -0.10 -2.89 0.00 0.00 0.01 0.00 0.00 72.50 69.52 2qkk s THR 232 CO 0.03 -0.29 0.99 -0.24 -0.69 0.00 0.00 174.62 174.43 2qkk n SER 233 N -3.66 2.80 -0.09 3.53 2.88 -1.26 -0.21 113.62 117.61 2qkk n SER 233 Ca 0.07 -1.66 0.00 0.00 -1.33 0.00 0.00 58.87 55.95 2qkk n SER 233 Cb 0.57 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2qkk n SER 233 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qkk n ALA 234 N 1.01 1.18 -0.79 -1.46 0.00 -1.26 -4.99 120.51 114.20 2qkk n ALA 234 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2qkk n ALA 234 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.73 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 0.00 0.34 3.98 0.00 0.00 0.71 -4.98 105.19 105.24 2qkk n GLY 235 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.78 2.96 0.06 1.61 1.02 -1.26 -4.71 119.74 118.64 2qkk s LYS 236 Ca 0.00 -0.81 -0.30 0.00 0.02 0.00 0.00 55.97 54.88 2qkk s LYS 236 Cb 0.00 -2.66 -0.05 0.00 -0.52 0.00 0.00 37.83 34.60 2qkk s LYS 236 CO 0.00 -0.24 1.10 -1.21 -0.92 0.00 0.00 175.35 174.08 2qkk s GLU 237 N -4.44 4.51 -0.33 1.68 2.02 -1.26 0.25 118.70 121.12 2qkk s GLU 237 Ca 0.50 1.63 -0.33 0.00 0.02 0.00 0.00 54.97 56.79 2qkk s GLU 237 Cb -0.10 -3.37 -0.10 0.00 0.10 0.00 0.00 34.13 30.66 2qkk s GLU 237 CO 0.35 -0.11 2.22 1.55 0.02 0.00 0.00 175.26 179.29 2qkk n VAL 238 N 3.60 0.21 -0.17 2.63 3.14 -1.01 -4.77 118.33 121.96 2qkk n VAL 238 Ca 0.07 -0.34 -0.08 0.00 -2.96 0.00 0.00 64.34 61.02 2qkk n VAL 238 Cb 0.48 -1.95 -0.06 0.00 -1.06 0.00 0.00 33.84 31.25 2qkk n VAL 238 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 2qkk h ILE 239 N 7.17 0.00 -0.94 1.55 1.08 -1.93 -2.93 117.51 121.51 2qkk h ILE 239 Ca -0.30 0.00 -0.46 0.00 -0.39 0.00 0.00 64.86 63.70 2qkk h ILE 239 Cb 1.29 0.00 -0.17 0.00 -3.07 0.00 0.00 36.82 34.88 2qkk h ILE 239 CO 1.02 0.00 0.33 0.59 -0.69 0.00 0.00 178.15 179.39 2qkk n ASN 240 N -4.43 6.37 0.14 1.72 4.13 -1.26 -4.69 115.26 117.24 2qkk n ASN 240 Ca -0.01 -3.14 -0.08 0.00 1.68 0.00 0.00 54.58 53.03 2qkk n ASN 240 Cb 0.20 -1.24 -0.05 0.00 -1.54 0.00 0.00 39.78 37.15 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 2.90 -0.43 0.00 3.52 3.64 -1.92 -2.67 116.57 121.62 2qkk h LYS 241 Ca 0.37 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2qkk h LYS 241 Cb 0.80 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2qkk h LYS 241 CO 0.81 -0.21 0.26 -1.91 -2.27 0.00 0.00 179.45 176.14 2qkk n GLU 242 N -5.07 0.01 -0.11 1.90 2.13 -1.26 -0.12 120.64 118.11 2qkk n GLU 242 Ca -0.07 0.29 -0.18 0.00 0.66 0.00 0.00 57.16 57.87 2qkk n GLU 242 Cb 0.21 -1.79 -0.06 0.00 0.27 0.00 0.00 31.44 30.07 2qkk n GLU 242 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2qkk n ASP 243 N -1.35 1.95 -0.28 4.31 8.00 -1.23 -3.75 116.55 124.20 2qkk n ASP 243 Ca -0.00 0.33 0.21 0.00 0.71 0.00 0.00 54.79 56.04 2qkk n ASP 243 Cb 0.26 -0.78 0.51 0.00 -0.02 0.00 0.00 41.12 41.09 2qkk n ASP 243 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2qkk h PHE 244 N -1.00 0.58 -0.42 1.24 0.04 -0.76 1.28 116.94 117.91 2qkk h PHE 244 Ca -0.32 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.43 2qkk h PHE 244 Cb 1.27 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 39.23 2qkk h PHE 244 CO -0.28 0.12 0.07 0.28 -0.60 0.00 0.00 178.31 177.89 2qkk h VAL 245 N 0.40 1.20 0.93 -0.55 2.07 -0.72 -2.87 116.25 116.72 2qkk h VAL 245 Ca 0.52 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2qkk h VAL 245 Cb 1.31 0.81 0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2qkk h VAL 245 CO -0.22 0.27 -0.45 0.00 0.02 0.00 0.00 177.57 177.20 2qkk h ALA 246 N 1.46 -1.25 -0.63 1.67 0.00 0.15 -3.05 119.26 117.61 2qkk h ALA 246 Ca 0.14 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2qkk h ALA 246 Cb 0.29 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 2qkk h ALA 246 CO 0.00 -1.18 -0.37 -0.11 0.00 0.00 0.00 179.25 177.59 2qkk n LEU 247 N -5.61 -0.67 -0.13 0.00 7.94 -0.82 -1.09 117.00 116.62 2qkk n LEU 247 Ca -0.16 1.39 -0.03 0.00 -1.11 0.00 0.00 56.01 56.10 2qkk n LEU 247 Cb 0.49 -0.28 -0.03 0.00 0.53 0.00 0.00 43.42 44.13 2qkk n LEU 247 CO 0.39 -1.05 0.35 -0.62 -1.11 0.00 0.00 177.39 175.35 2qkk n GLU 248 N -4.45 -0.14 0.32 1.96 -0.58 -1.10 0.15 120.64 116.81 2qkk n GLU 248 Ca 0.01 0.87 0.10 0.00 -0.42 0.00 0.00 57.16 57.72 2qkk n GLU 248 Cb 0.16 -1.29 0.53 0.00 -0.57 0.00 0.00 31.44 30.27 2qkk n GLU 248 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2qkk h ARG 249 N 0.00 0.00 0.00 3.49 2.43 -1.00 0.78 114.38 120.07 2qkk h ARG 249 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2qkk h ARG 249 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2qkk h ARG 249 CO -0.30 0.00 -1.43 1.28 -1.51 0.00 0.00 179.97 178.01 2qkk n LEU 250 N -2.71 0.44 0.12 3.80 4.32 0.41 -4.41 117.00 118.97 2qkk n LEU 250 Ca -0.01 -0.04 -0.19 0.00 -0.02 0.00 0.00 56.01 55.75 2qkk n LEU 250 Cb 0.58 -0.04 -0.14 0.00 -1.62 0.00 0.00 43.42 42.20 2qkk n LEU 250 CO 0.09 0.03 -0.10 0.74 -1.22 0.00 0.00 177.39 176.92 2qkk h THR 251 N 0.00 1.41 -0.11 -5.08 2.02 0.14 -3.43 112.91 107.86 2qkk h THR 251 Ca 0.00 -2.88 -0.67 0.00 0.77 0.00 0.00 66.41 63.63 2qkk h THR 251 Cb 0.84 2.94 -0.05 0.00 -1.74 0.00 0.00 68.15 70.14 2qkk h THR 251 CO 0.00 0.85 1.48 0.00 0.37 0.00 0.00 175.52 178.22 2qkk n GLN 252 N -3.62 0.10 0.00 6.66 3.00 -1.16 0.13 117.38 122.49 2qkk n GLN 252 Ca -0.11 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2qkk n GLN 252 Cb 1.04 -1.61 0.00 0.00 0.00 0.00 0.00 30.24 29.67 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 7.07 1.86 3.73 1.08 0.00 -1.26 -5.07 105.19 112.61 2qkk n GLY 253 Ca 0.57 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.08 4.42 -0.55 1.61 -1.94 0.35 -4.87 119.30 118.24 2qkk s MET 254 Ca 0.00 0.83 -0.17 0.00 -1.71 0.00 0.00 55.69 54.65 2qkk s MET 254 Cb 0.00 -3.42 0.12 0.00 2.01 0.00 0.00 34.83 33.54 2qkk s MET 254 CO 0.00 0.14 0.55 0.34 -0.01 0.00 0.00 175.02 176.04 2qkk s ASP 255 N 0.55 6.19 -0.25 3.03 2.15 -0.58 -4.96 116.67 122.81 2qkk s ASP 255 Ca 0.35 -1.72 -0.10 0.00 0.43 0.00 0.00 52.55 51.51 2qkk s ASP 255 Cb -0.18 -2.23 -0.05 0.00 -0.30 0.00 0.00 42.92 40.16 2qkk s ASP 255 CO 0.18 -0.91 0.15 -0.63 -0.17 0.00 0.00 175.17 173.78 2qkk s ILE 256 N 1.83 5.21 -0.46 4.11 1.01 -1.26 -2.95 121.20 128.69 2qkk s ILE 256 Ca 0.05 0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.66 2qkk s ILE 256 Cb -0.29 -3.44 0.05 0.00 0.01 0.00 0.00 42.46 38.79 2qkk s ILE 256 CO 0.04 0.33 0.47 -1.10 0.00 0.00 0.00 174.94 174.67 2qkk s GLN 257 N 1.23 3.06 -0.14 2.79 -1.52 -0.83 -5.00 119.66 119.24 2qkk s GLN 257 Ca 0.07 -1.00 -0.25 0.00 -1.95 0.00 0.00 55.36 52.24 2qkk s GLN 257 Cb -0.14 -4.06 -0.02 0.00 -0.22 0.00 0.00 33.01 28.57 2qkk s GLN 257 CO 0.06 -1.00 0.80 -1.58 -0.25 0.00 0.00 175.29 173.31 2qkk s TRP 258 N 2.09 3.46 -0.25 0.91 0.52 -1.26 -1.53 118.94 122.89 2qkk s TRP 258 Ca 0.10 1.25 -0.00 0.00 0.02 0.00 0.00 56.10 57.47 2qkk s TRP 258 Cb -0.20 -2.96 0.04 0.00 -1.15 0.00 0.00 33.47 29.20 2qkk s TRP 258 CO 0.11 -0.15 -0.09 -1.64 0.02 0.00 0.00 176.95 175.20 2qkk s MET 259 N 1.79 2.68 -0.40 4.98 -1.94 -0.09 -4.96 119.30 121.35 2qkk s MET 259 Ca 0.38 -1.07 -0.21 0.00 -1.71 0.00 0.00 55.69 53.08 2qkk s MET 259 Cb -0.17 -2.92 0.01 0.00 2.01 0.00 0.00 34.83 33.76 2qkk s MET 259 CO 0.14 -0.43 0.65 -1.58 -0.01 0.00 0.00 175.02 173.79 2qkk s HIS 260 N 1.26 3.10 -0.18 -0.03 2.46 -1.26 -1.54 115.29 119.11 2qkk s HIS 260 Ca -0.02 0.16 -0.13 0.00 0.47 0.00 0.00 55.06 55.54 2qkk s HIS 260 Cb -0.17 -3.27 -0.05 0.00 -0.13 0.00 0.00 32.58 28.97 2qkk s HIS 260 CO -0.06 -0.76 0.27 0.08 -2.47 0.00 0.00 174.74 171.81 2qkk s VAL 261 N 2.80 5.31 0.00 0.89 1.01 -0.73 -4.98 120.40 124.71 2qkk s VAL 261 Ca 0.24 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2qkk s VAL 261 Cb -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2qkk s VAL 261 CO 0.17 0.38 0.00 -0.81 0.00 0.00 0.00 175.10 174.84 2qkk n PRO 262 N 3.72 0.14 0.00 2.72 -0.04 -1.26 -4.07 135.00 136.21 2qkk n PRO 262 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2qkk n PRO 262 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 2qkk n PRO 262 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qkk n GLY 263 N 0.28 -1.33 0.68 0.55 0.00 -1.26 -4.19 105.19 99.93 2qkk n GLY 263 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 0.00 -3.02 1.61 8.25 -1.26 -4.60 115.22 116.20 2qkk n HIS 264 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 2qkk n HIS 264 Cb 0.00 -0.02 0.02 0.00 1.12 0.00 0.00 29.99 31.12 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 0.49 0.79 0.00 0.41 3.41 -1.26 -5.05 113.62 112.41 2qkk n SER 265 Ca 0.00 -1.57 0.00 0.00 -0.26 0.00 0.00 58.87 57.04 2qkk n SER 265 Cb 0.00 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 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 2.38 -1.78 3.95 5.00 0.00 -1.26 -4.83 105.19 108.64 2qkk n GLY 266 Ca 0.06 -1.96 -0.24 0.00 0.00 0.00 0.00 46.02 43.88 2qkk n GLY 266 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qkk s PHE 267 N 0.00 3.24 1.01 1.61 0.08 -1.26 -5.08 117.98 117.59 2qkk s PHE 267 Ca 0.00 0.32 -0.17 0.00 0.12 0.00 0.00 56.93 57.20 2qkk s PHE 267 Cb 0.00 -2.38 0.24 0.00 -0.57 0.00 0.00 43.02 40.32 2qkk s PHE 267 CO 0.00 -0.42 1.06 -0.89 -0.10 0.00 0.00 175.22 174.86 2qkk n ILE 268 N -2.16 0.00 -1.47 0.64 -0.00 -1.26 -3.44 119.36 111.67 2qkk n ILE 268 Ca 0.02 -0.60 -0.15 0.00 -0.00 0.00 0.00 62.75 62.02 2qkk n ILE 268 Cb 0.58 -1.35 -0.06 0.00 -0.00 0.00 0.00 39.64 38.81 2qkk n ILE 268 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2qkk n GLY 269 N -3.51 1.41 0.00 7.39 0.00 -1.26 -4.54 105.19 104.68 2qkk n GLY 269 Ca 0.14 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2qkk n GLY 269 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qkk n ASN 270 N -0.38 2.20 -0.46 1.61 5.15 -1.22 -4.31 115.26 117.84 2qkk n ASN 270 Ca -0.15 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 53.90 2qkk n ASN 270 Cb 0.49 0.32 0.04 0.00 -0.53 0.00 0.00 39.78 40.09 2qkk n ASN 270 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2qkk n GLU 271 N -0.93 1.28 0.00 1.20 -0.58 -1.26 -3.86 120.64 116.48 2qkk n GLU 271 Ca 0.00 -1.11 -0.22 0.00 -0.42 0.00 0.00 57.16 55.42 2qkk n GLU 271 Cb 0.12 -1.24 -0.14 0.00 -0.57 0.00 0.00 31.44 29.62 2qkk n GLU 271 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2qkk h GLU 272 N 2.27 0.25 -0.90 3.49 5.08 -1.88 -2.34 114.58 120.56 2qkk h GLU 272 Ca 0.00 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2qkk h GLU 272 Cb 0.53 0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 2qkk h GLU 272 CO 0.00 1.21 0.58 0.00 -1.00 0.00 0.00 179.01 179.80 2qkk h ALA 273 N 0.01 1.33 0.25 3.43 0.00 -1.75 1.13 119.26 123.66 2qkk h ALA 273 Ca -0.40 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2qkk h ALA 273 Cb 1.95 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 2qkk h ALA 273 CO 0.07 0.61 -0.16 -0.44 0.00 0.00 0.00 179.25 179.32 2qkk h ASP 274 N 1.22 -0.40 0.33 0.00 5.19 -1.67 0.74 116.42 121.83 2qkk h ASP 274 Ca 0.33 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.76 2qkk h ASP 274 Cb -0.11 0.12 -0.00 0.00 0.18 0.00 0.00 39.33 39.52 2qkk h ASP 274 CO -0.07 -0.26 -0.03 0.03 -3.12 0.00 0.00 179.24 175.79 2qkk h ARG 275 N -0.40 0.00 0.14 3.56 -0.00 -0.52 -2.44 114.38 114.71 2qkk h ARG 275 Ca -0.02 0.00 -0.28 0.00 -0.50 0.00 0.00 59.98 59.18 2qkk h ARG 275 Cb 0.34 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.32 2qkk h ARG 275 CO 0.02 0.03 -1.28 -0.07 0.00 0.00 0.00 179.97 178.68 2qkk h LEU 276 N 0.00 0.46 -0.36 3.04 3.38 0.25 -3.30 115.31 118.78 2qkk h LEU 276 Ca -0.00 -0.49 -0.17 0.00 0.09 0.00 0.00 57.88 57.30 2qkk h LEU 276 Cb 0.21 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2qkk h LEU 276 CO 0.00 1.39 -0.82 0.00 0.09 0.00 0.00 178.44 179.10 2qkk h ALA 277 N 0.54 0.64 -0.23 1.53 0.00 -0.44 -2.98 119.26 118.32 2qkk h ALA 277 Ca -0.15 -0.74 -0.04 0.00 0.00 0.00 0.00 54.91 53.97 2qkk h ALA 277 Cb 1.99 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 2qkk h ALA 277 CO 0.21 1.02 -0.05 0.00 0.00 0.00 0.00 179.25 180.43 2qkk h ARG 278 N 0.00 0.35 0.64 0.00 2.47 -1.58 -1.46 114.38 114.81 2qkk h ARG 278 Ca -0.01 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.61 2qkk h ARG 278 Cb 1.45 -0.05 0.01 0.00 -1.65 0.00 0.00 29.97 29.72 2qkk h ARG 278 CO 0.11 0.42 -0.31 0.93 0.56 0.00 0.00 179.97 181.68 2qkk h GLU 279 N 0.34 -0.82 -0.77 0.04 4.39 -1.60 -2.73 114.58 113.43 2qkk h GLU 279 Ca 0.07 0.06 0.16 0.00 0.34 0.00 0.00 59.36 59.99 2qkk h GLU 279 Cb 0.31 0.19 -0.10 0.00 -0.10 0.00 0.00 28.75 29.04 2qkk h GLU 279 CO 0.01 -0.51 0.29 0.78 -1.16 0.00 0.00 179.01 178.42 2qkk h GLY 280 N -1.04 1.17 -0.48 -3.84 0.00 -1.40 0.42 103.07 97.89 2qkk h GLY 280 Ca -0.09 -0.13 0.19 0.00 0.00 0.00 0.00 47.33 47.31 2qkk h GLY 280 CO 0.14 -0.14 0.02 0.00 0.00 0.00 0.00 176.54 176.56 2qkk h ALA 281 N 1.58 0.87 0.00 3.60 0.00 -1.04 0.34 119.26 124.62 2qkk h ALA 281 Ca 0.43 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.60 2qkk h ALA 281 Cb 0.70 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2qkk h ALA 281 CO -0.44 -0.44 0.00 1.63 0.00 0.00 0.00 179.25 179.99 2qkk n LYS 282 N -5.37 0.08 -1.16 0.00 5.02 0.13 -4.75 118.16 112.12 2qkk n LYS 282 Ca 0.16 0.57 -0.29 0.00 -2.02 0.00 0.00 58.31 56.73 2qkk n LYS 282 Cb 0.53 -1.76 0.18 0.00 -0.02 0.00 0.00 35.03 33.96 2qkk n LYS 282 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2qkk s GLN 283 N -3.31 0.25 0.00 1.97 -0.21 0.12 -5.14 119.66 113.34 2qkk s GLN 283 Ca -0.01 0.45 0.26 0.00 0.02 0.00 0.00 55.36 56.08 2qkk s GLN 283 Cb 0.04 -1.72 0.65 0.00 1.00 0.00 0.00 33.01 32.97 2qkk s GLN 283 CO 0.13 -2.84 1.52 -1.13 -2.12 0.00 0.00 175.29 170.84