#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkk n SER 134 N 0.00 0.00 0.00 1.61 3.41 -1.26 -4.90 113.62 112.48 2qkk n SER 134 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2qkk n SER 134 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2qkk n SER 134 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2qkk n HIS 135 N 0.00 0.00 0.00 7.33 -0.00 -1.26 -5.04 115.22 116.25 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 -1.27 0.00 0.00 -0.00 0.00 0.00 29.99 28.72 2qkk n HIS 135 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2qkk n MET 136 N -0.59 0.00 0.00 -0.41 2.00 -1.26 -5.06 117.12 111.80 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 2.52 0.00 3.03 0.00 -1.26 -5.19 105.19 104.29 2qkk n GLY 137 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2qkk n GLY 137 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qkk n ASP 138 N 0.00 0.00 0.00 1.61 2.03 -1.26 -5.18 116.55 113.75 2qkk n ASP 138 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2qkk n ASP 138 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2qkk n ASP 138 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 2qkk n PHE 139 N -0.04 0.00 -5.26 -0.67 -1.74 -1.26 -5.02 117.46 103.48 2qkk n PHE 139 Ca 0.00 0.00 -0.31 0.00 -0.56 0.00 0.00 57.45 56.58 2qkk n PHE 139 Cb 0.00 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 40.84 2qkk n PHE 139 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 2qkk s VAL 140 N -2.00 2.03 0.52 1.97 0.11 -1.07 -4.95 120.40 117.01 2qkk s VAL 140 Ca 0.00 -1.06 -0.04 0.00 -2.93 0.00 0.00 61.98 57.95 2qkk s VAL 140 Cb 0.00 -1.71 -0.01 0.00 -1.53 0.00 0.00 36.38 33.13 2qkk s VAL 140 CO 0.00 0.57 0.81 -0.69 -3.33 0.00 0.00 175.10 172.46 2qkk s VAL 141 N -0.23 4.16 -0.29 2.04 1.01 -1.26 0.03 120.40 125.87 2qkk s VAL 141 Ca -0.01 -0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 2qkk s VAL 141 Cb -0.13 -3.60 0.13 0.00 0.00 0.00 0.00 36.38 32.78 2qkk s VAL 141 CO 0.03 -0.57 0.98 0.54 0.00 0.00 0.00 175.10 176.07 2qkk s VAL 142 N -2.82 0.00 -0.18 2.92 0.11 -0.72 -4.85 120.40 114.87 2qkk s VAL 142 Ca 0.50 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.49 2qkk s VAL 142 Cb -0.10 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.71 2qkk s VAL 142 CO 0.44 0.00 0.04 -0.31 -3.33 0.00 0.00 175.10 171.93 2qkk s TYR 143 N 1.02 3.19 0.29 1.54 2.02 0.09 -0.90 117.35 124.59 2qkk s TYR 143 Ca -0.05 -0.04 0.12 0.00 -0.37 0.00 0.00 57.07 56.72 2qkk s TYR 143 Cb -0.04 -2.06 -0.05 0.00 -0.40 0.00 0.00 41.96 39.41 2qkk s TYR 143 CO -0.13 0.08 -0.18 0.95 -1.57 0.00 0.00 175.55 174.70 2qkk s THR 144 N 0.43 2.48 -0.30 -0.71 -4.23 -0.23 0.62 115.64 113.71 2qkk s THR 144 Ca 0.01 -2.38 -0.20 0.00 -1.18 0.00 0.00 61.69 57.95 2qkk s THR 144 Cb -0.13 -2.35 0.19 0.00 1.34 0.00 0.00 72.50 71.55 2qkk s THR 144 CO 0.01 -0.38 1.27 -0.62 -0.54 0.00 0.00 174.62 174.36 2qkk s ASP 145 N -3.52 -0.15 -0.14 3.99 2.15 -0.91 -4.53 116.67 113.56 2qkk s ASP 145 Ca 0.30 0.26 -0.00 0.00 0.43 0.00 0.00 52.55 53.54 2qkk s ASP 145 Cb -0.04 0.72 0.03 0.00 -0.30 0.00 0.00 42.92 43.33 2qkk s ASP 145 CO 0.15 -0.04 -0.10 -0.83 -0.17 0.00 0.00 175.17 174.18 2qkk s GLY 146 N 0.67 0.99 0.58 2.66 0.00 -1.26 -0.98 107.32 109.97 2qkk s GLY 146 Ca -0.02 -0.76 0.07 0.00 0.00 0.00 0.00 44.72 44.01 2qkk s GLY 146 CO -0.12 0.69 0.79 0.00 0.00 0.00 0.00 173.10 174.46 2qkk n SER 149 N 0.00 -1.35 0.00 0.00 2.88 -1.17 -4.62 113.62 109.37 2qkk n SER 149 Ca 0.00 -1.43 0.00 0.00 -1.33 0.00 0.00 58.87 56.11 2qkk n SER 149 Cb 0.00 2.12 0.00 0.00 -0.75 0.00 0.00 64.21 65.58 2qkk n SER 149 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2qkk n SER 150 N -1.14 0.00 -0.82 -3.46 2.88 -1.26 -3.22 113.62 106.61 2qkk n SER 150 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2qkk n SER 150 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 2qkk n SER 150 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2qkk n ASN 151 N 0.00 0.00 -3.29 -3.46 4.13 -1.26 -4.53 115.26 106.85 2qkk n ASN 151 Ca 0.00 -0.11 -0.08 0.00 1.68 0.00 0.00 54.58 56.06 2qkk n ASN 151 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 2qkk n ASN 151 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 2qkk n ARG 153 N 0.58 -0.94 -0.95 3.52 1.85 -1.26 -5.16 116.66 114.30 2qkk n ARG 153 Ca 0.00 -0.16 -0.11 0.00 -1.00 0.00 0.00 57.85 56.58 2qkk n ARG 153 Cb 0.00 -0.36 -0.04 0.00 -1.05 0.00 0.00 32.46 31.01 2qkk n ARG 153 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 2qkk n ARG 154 N -1.81 0.01 -2.71 2.89 0.63 -1.26 -4.48 116.66 109.93 2qkk n ARG 154 Ca -0.05 -0.39 -0.21 0.00 -0.92 0.00 0.00 57.85 56.28 2qkk n ARG 154 Cb 0.14 -1.62 -0.00 0.00 0.45 0.00 0.00 32.46 31.43 2qkk n ARG 154 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2qkk n ARG 155 N 5.15 2.47 -1.65 -0.14 5.12 -1.26 -5.09 116.66 121.26 2qkk n ARG 155 Ca 0.14 -4.10 -0.55 0.00 -1.93 0.00 0.00 57.85 51.42 2qkk n ARG 155 Cb 0.36 -1.91 -0.07 0.00 -1.16 0.00 0.00 32.46 29.69 2qkk n ARG 155 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2qkk n PRO 156 N -0.23 1.14 -4.53 5.56 -0.04 -1.26 -4.92 135.00 130.72 2qkk n PRO 156 Ca 0.28 0.41 -0.26 0.00 -0.04 0.00 0.00 63.50 63.89 2qkk n PRO 156 Cb 0.65 -2.08 -0.17 0.00 -0.04 0.00 0.00 33.50 31.87 2qkk n PRO 156 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2qkk s ARG 157 N 2.00 1.92 0.02 0.54 1.70 -1.20 -4.81 118.95 119.13 2qkk s ARG 157 Ca 0.91 -0.47 0.01 0.00 -0.47 0.00 0.00 55.73 55.71 2qkk s ARG 157 Cb -1.02 -1.61 -0.04 0.00 -0.57 0.00 0.00 34.95 31.71 2qkk s ARG 157 CO 0.56 -0.01 0.08 0.00 -1.08 0.00 0.00 175.30 174.84 2qkk s ALA 158 N 0.83 3.56 0.08 7.88 0.00 -1.26 -3.02 121.76 129.83 2qkk s ALA 158 Ca -0.11 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 50.95 2qkk s ALA 158 Cb -0.15 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.42 2qkk s ALA 158 CO 0.02 0.71 -0.09 0.20 0.00 0.00 0.00 175.76 176.60 2qkk s GLY 159 N -1.95 0.73 0.16 0.00 0.00 -0.72 -2.05 107.32 103.50 2qkk s GLY 159 Ca 0.25 -1.12 0.10 0.00 0.00 0.00 0.00 44.72 43.95 2qkk s GLY 159 CO 0.17 -1.19 -0.20 -0.42 0.00 0.00 0.00 173.10 171.46 2qkk s ILE 160 N -2.46 2.65 -0.19 0.90 -1.09 -0.69 -1.74 121.20 118.59 2qkk s ILE 160 Ca 0.03 -1.76 -0.11 0.00 -2.23 0.00 0.00 60.65 56.58 2qkk s ILE 160 Cb -0.03 -2.25 0.06 0.00 -1.58 0.00 0.00 42.46 38.66 2qkk s ILE 160 CO -0.01 -0.02 0.47 -0.83 -1.23 0.00 0.00 174.94 173.32 2qkk s GLY 161 N -2.45 -0.39 -0.17 6.18 0.00 -0.16 -3.21 107.32 107.12 2qkk s GLY 161 Ca 0.20 1.68 0.00 0.00 0.00 0.00 0.00 44.72 46.60 2qkk s GLY 161 CO 0.10 1.76 -0.12 0.14 0.00 0.00 0.00 173.10 174.99 2qkk s VAL 162 N 1.31 1.54 -0.23 1.40 1.01 -0.89 -2.14 120.40 122.39 2qkk s VAL 162 Ca -0.09 -0.76 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 2qkk s VAL 162 Cb -0.07 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2qkk s VAL 162 CO -0.13 0.32 0.06 -0.47 0.00 0.00 0.00 175.10 174.88 2qkk s TYR 163 N 1.48 3.09 -0.79 5.22 6.04 0.20 -2.39 117.35 130.20 2qkk s TYR 163 Ca 0.02 -0.39 0.13 0.00 0.04 0.00 0.00 57.07 56.88 2qkk s TYR 163 Cb -0.14 -2.20 -0.09 0.00 -1.04 0.00 0.00 41.96 38.49 2qkk s TYR 163 CO -0.09 -0.29 0.60 0.91 -1.54 0.00 0.00 175.55 175.14 2qkk n TRP 164 N 4.69 0.00 0.00 4.97 7.02 -1.26 -0.73 117.44 132.13 2qkk n TRP 164 Ca -0.16 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.32 2qkk n TRP 164 Cb 0.52 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.41 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 1.21 3.83 3.12 6.99 0.00 -1.26 -4.93 105.19 114.15 2qkk n GLY 165 Ca 0.03 -1.71 -0.55 0.00 0.00 0.00 0.00 46.02 43.79 2qkk n GLY 165 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qkk n PRO 166 N -1.47 0.00 -0.40 1.61 -0.04 -1.26 -0.94 135.00 132.49 2qkk n PRO 166 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2qkk n PRO 166 Cb 0.00 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 2qkk n PRO 166 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qkk n GLY 167 N 2.51 0.00 3.62 0.55 0.00 -1.26 -4.91 105.19 105.69 2qkk n GLY 167 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.61 1.34 -0.35 1.61 -0.00 -0.12 -4.90 115.22 111.19 2qkk n HIS 168 Ca 0.00 0.58 -0.02 0.00 -0.00 0.00 0.00 57.72 58.29 2qkk n HIS 168 Cb 0.00 -2.26 0.13 0.00 -0.00 0.00 0.00 29.99 27.87 2qkk n HIS 168 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2qkk h PRO 169 N 1.76 1.27 -0.01 1.57 0.11 -1.91 -3.13 132.00 131.65 2qkk h PRO 169 Ca -0.44 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2qkk h PRO 169 Cb 1.33 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2qkk h PRO 169 CO 0.58 0.84 0.00 1.28 -0.21 0.00 0.00 178.00 180.50 2qkk n LEU 170 N -4.38 0.09 -4.75 2.35 7.99 -1.26 -4.87 117.00 112.17 2qkk n LEU 170 Ca 0.11 -0.04 -0.41 0.00 -0.01 0.00 0.00 56.01 55.66 2qkk n LEU 170 Cb 0.02 -0.01 -0.03 0.00 -0.11 0.00 0.00 43.42 43.30 2qkk n LEU 170 CO 0.37 0.02 1.04 0.20 -1.51 0.00 0.00 177.39 177.50 2qkk s ASN 171 N -1.61 6.77 0.15 -1.43 0.01 -1.19 -4.87 114.94 112.79 2qkk s ASN 171 Ca 0.29 2.56 0.06 0.00 -0.71 0.00 0.00 52.86 55.06 2qkk s ASN 171 Cb 0.14 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 39.13 2qkk s ASN 171 CO 0.23 -0.60 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.40 2qkk s VAL 172 N -0.13 1.35 -0.46 1.60 1.01 -1.00 -4.97 120.40 117.79 2qkk s VAL 172 Ca 0.57 -2.00 0.06 0.00 0.00 0.00 0.00 61.98 60.61 2qkk s VAL 172 Cb -0.39 -1.80 0.29 0.00 0.00 0.00 0.00 36.38 34.48 2qkk s VAL 172 CO 0.43 -0.62 0.99 0.61 0.00 0.00 0.00 175.10 176.51 2qkk n GLY 173 N -0.03 0.63 3.04 4.51 0.00 -1.26 -2.10 105.19 109.99 2qkk n GLY 173 Ca -0.11 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.66 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 0.87 0.00 -4.44 -0.61 -5.35 -1.20 -3.33 119.36 105.30 2qkk n ILE 174 Ca 0.09 -1.36 -0.34 0.00 -0.27 0.00 0.00 62.75 60.86 2qkk n ILE 174 Cb 0.67 -0.82 -0.10 0.00 -1.74 0.00 0.00 39.64 37.64 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 -4.30 3.07 -0.00 6.28 3.52 -1.10 -1.70 118.95 124.72 2qkk s ARG 175 Ca 0.50 -0.47 -0.30 0.00 -0.13 0.00 0.00 55.73 55.33 2qkk s ARG 175 Cb -0.03 -2.77 -0.06 0.00 -1.56 0.00 0.00 34.95 30.53 2qkk s ARG 175 CO 0.32 0.59 1.56 -1.17 -0.81 0.00 0.00 175.30 175.80 2qkk s LEU 176 N -0.59 4.33 0.53 -0.88 2.96 -0.87 -4.86 118.68 119.30 2qkk s LEU 176 Ca 0.09 2.26 -0.06 0.00 -0.22 0.00 0.00 54.13 56.21 2qkk s LEU 176 Cb -0.12 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 2qkk s LEU 176 CO 0.02 -0.84 0.84 -2.16 -1.32 0.00 0.00 176.35 172.89 2qkk s PRO 177 N 3.06 3.26 1.34 0.98 0.04 -1.26 -4.70 135.00 137.72 2qkk s PRO 177 Ca 0.70 0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.85 2qkk s PRO 177 Cb -0.34 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 31.87 2qkk s PRO 177 CO 0.29 -0.43 0.00 0.41 0.04 0.00 0.00 177.00 177.30 2qkk n GLY 178 N -2.41 -1.80 3.62 0.56 0.00 -1.26 -4.85 105.19 99.05 2qkk n GLY 178 Ca 0.02 -1.45 -0.56 0.00 0.00 0.00 0.00 46.02 44.04 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 0.00 0.88 -2.83 1.61 0.63 -1.26 -4.85 116.66 110.84 2qkk n ARG 179 Ca 0.00 0.32 -0.43 0.00 -0.92 0.00 0.00 57.85 56.82 2qkk n ARG 179 Cb 0.00 -1.94 -0.03 0.00 0.45 0.00 0.00 32.46 30.94 2qkk n ARG 179 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2qkk s GLN 180 N 1.45 3.55 -0.01 -0.14 1.11 -1.26 -4.88 119.66 119.48 2qkk s GLN 180 Ca 0.91 -1.50 0.00 0.00 0.01 0.00 0.00 55.36 54.78 2qkk s GLN 180 Cb -1.08 -4.95 0.01 0.00 -1.01 0.00 0.00 33.01 25.98 2qkk s GLN 180 CO 0.56 -1.89 -0.01 0.95 0.01 0.00 0.00 175.29 174.92 2qkk s THR 181 N 3.40 0.11 0.13 -0.19 -4.23 -1.26 -4.83 115.64 108.77 2qkk s THR 181 Ca 0.35 -0.01 -0.27 0.00 -1.18 0.00 0.00 61.69 60.57 2qkk s THR 181 Cb -0.05 -0.12 -0.04 0.00 1.34 0.00 0.00 72.50 73.63 2qkk s THR 181 CO -0.07 0.05 1.60 -0.55 -0.54 0.00 0.00 174.62 175.11 2qkk h ASN 182 N 6.38 -1.09 -0.45 3.99 -1.07 -1.83 0.21 115.58 121.72 2qkk h ASN 182 Ca -0.30 0.15 0.07 0.00 0.07 0.00 0.00 56.30 56.29 2qkk h ASN 182 Cb 1.19 0.45 -0.09 0.00 -2.07 0.00 0.00 38.32 37.79 2qkk h ASN 182 CO 0.50 -0.39 -0.46 -0.61 0.07 0.00 0.00 177.43 176.54 2qkk h GLN 183 N -0.46 -0.31 -0.41 4.14 5.75 -1.95 0.36 115.11 122.24 2qkk h GLN 183 Ca 0.08 0.02 -0.14 0.00 -0.15 0.00 0.00 58.65 58.46 2qkk h GLN 183 Cb 0.58 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 2qkk h GLN 183 CO -0.34 -0.20 -0.30 0.07 -2.65 0.00 0.00 178.83 175.41 2qkk h ARG 184 N -0.32 0.91 -0.90 1.69 0.11 -1.90 -2.61 114.38 111.35 2qkk h ARG 184 Ca 0.13 -0.43 0.18 0.00 0.10 0.00 0.00 59.98 59.96 2qkk h ARG 184 Cb 0.58 -0.01 -0.11 0.00 1.11 0.00 0.00 29.97 31.55 2qkk h ARG 184 CO -0.61 1.08 0.47 0.00 0.10 0.00 0.00 179.97 181.01 2qkk h ALA 185 N 0.88 1.42 -0.26 0.08 0.00 0.83 0.14 119.26 122.36 2qkk h ALA 185 Ca 0.08 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2qkk h ALA 185 Cb 0.87 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2qkk h ALA 185 CO 0.08 -0.15 -0.07 1.49 0.00 0.00 0.00 179.25 180.60 2qkk h GLU 186 N 0.60 0.51 -0.02 0.00 4.57 -0.05 -2.13 114.58 118.06 2qkk h GLU 186 Ca 0.52 -0.20 -0.00 0.00 -1.18 0.00 0.00 59.36 58.50 2qkk h GLU 186 Cb 0.83 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.39 2qkk h GLU 186 CO -0.41 0.73 0.00 0.97 -1.18 0.00 0.00 179.01 179.12 2qkk h ILE 187 N 0.26 1.21 -0.16 2.32 2.10 -0.70 -2.13 117.51 120.40 2qkk h ILE 187 Ca 0.07 -0.62 0.05 0.00 1.08 0.00 0.00 64.86 65.44 2qkk h ILE 187 Cb 0.55 1.59 -0.01 0.00 -1.09 0.00 0.00 36.82 37.86 2qkk h ILE 187 CO 0.03 0.16 0.18 0.45 -1.08 0.00 0.00 178.15 177.89 2qkk h HIS 188 N -0.22 0.00 -0.66 2.19 3.86 -0.85 0.79 115.15 120.26 2qkk h HIS 188 Ca 0.01 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 2qkk h HIS 188 Cb 0.26 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 2qkk h HIS 188 CO 0.01 0.00 0.19 0.00 0.86 0.00 0.00 177.93 178.99 2qkk h ALA 189 N 1.78 0.87 0.00 2.45 0.00 -0.70 -1.55 119.26 122.11 2qkk h ALA 189 Ca 0.08 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2qkk h ALA 189 Cb 0.44 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2qkk h ALA 189 CO -0.00 0.56 -0.15 0.00 0.00 0.00 0.00 179.25 179.66 2qkk h ALA 190 N 1.07 0.96 0.39 0.00 0.00 -0.65 -3.12 119.26 117.92 2qkk h ALA 190 Ca 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2qkk h ALA 190 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2qkk h ALA 190 CO -0.00 0.19 -0.19 0.00 0.00 0.00 0.00 179.25 179.26 2qkk h LYS 192 N -0.77 0.00 0.29 0.00 1.63 -1.31 -0.46 116.57 115.95 2qkk h LYS 192 Ca -0.05 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 2qkk h LYS 192 Cb 0.52 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 2qkk h LYS 192 CO 0.09 0.00 -0.14 0.00 -3.45 0.00 0.00 179.45 175.95 2qkk h ALA 193 N 1.51 -0.39 -0.07 5.00 0.00 -1.46 -2.78 119.26 121.07 2qkk h ALA 193 Ca 0.30 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2qkk h ALA 193 Cb 1.38 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 2qkk h ALA 193 CO -0.00 -0.39 -0.15 -0.84 0.00 0.00 0.00 179.25 177.87 2qkk h ILE 194 N -1.04 1.15 -0.49 0.00 -0.00 -1.35 -0.59 117.51 115.18 2qkk h ILE 194 Ca -0.04 -0.67 0.04 0.00 -0.00 0.00 0.00 64.86 64.19 2qkk h ILE 194 Cb 0.41 1.26 -0.04 0.00 -0.00 0.00 0.00 36.82 38.45 2qkk h ILE 194 CO 0.07 0.20 0.24 -0.08 -0.00 0.00 0.00 178.15 178.58 2qkk h GLU 195 N 0.11 0.47 -0.64 0.16 4.81 -1.16 0.17 114.58 118.50 2qkk h GLU 195 Ca 0.02 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 2qkk h GLU 195 Cb 0.33 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2qkk h GLU 195 CO 0.02 0.31 0.06 1.96 -0.73 0.00 0.00 179.01 180.63 2qkk h GLN 196 N 0.48 1.09 -0.91 1.92 4.20 -0.89 -2.76 115.11 118.23 2qkk h GLN 196 Ca 0.22 -0.32 0.09 0.00 0.06 0.00 0.00 58.65 58.70 2qkk h GLN 196 Cb 0.13 -0.11 -0.07 0.00 0.30 0.00 0.00 27.48 27.72 2qkk h GLN 196 CO -0.15 1.03 0.56 0.00 -0.67 0.00 0.00 178.83 179.59 2qkk h ALA 197 N 1.02 1.31 -0.01 3.87 0.00 0.06 -0.90 119.26 124.61 2qkk h ALA 197 Ca 0.19 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2qkk h ALA 197 Cb 0.50 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2qkk h ALA 197 CO 0.02 0.22 -0.07 0.87 0.00 0.00 0.00 179.25 180.30 2qkk h LYS 198 N 0.95 -0.12 0.00 0.00 1.79 -0.74 -0.70 116.57 117.75 2qkk h LYS 198 Ca 0.43 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.91 2qkk h LYS 198 Cb 0.34 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 2qkk h LYS 198 CO -0.23 -0.08 0.00 2.41 -1.08 0.00 0.00 179.45 180.48 2qkk n THR 199 N -5.19 0.00 -2.83 -0.16 -1.04 -0.36 -2.06 114.28 102.64 2qkk n THR 199 Ca -0.06 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.84 2qkk n THR 199 Cb 0.12 -0.78 0.04 0.00 -1.82 0.00 0.00 70.33 67.89 2qkk n THR 199 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2qkk n GLN 200 N -0.67 1.08 -0.88 -2.82 6.02 -0.28 -5.02 117.38 114.82 2qkk n GLN 200 Ca 0.00 -2.71 0.00 0.00 -0.01 0.00 0.00 57.00 54.28 2qkk n GLN 200 Cb 0.00 -1.07 0.00 0.00 1.02 0.00 0.00 30.24 30.19 2qkk n GLN 200 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2qkk n ASN 201 N 0.01 0.00 -4.00 1.08 4.13 -0.88 -4.80 115.26 110.80 2qkk n ASN 201 Ca 0.10 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 56.09 2qkk n ASN 201 Cb 0.76 0.00 -0.17 0.00 -1.54 0.00 0.00 39.78 38.83 2qkk n ASN 201 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2qkk s ILE 202 N -1.15 1.26 -0.21 2.41 -1.16 -1.19 -5.05 121.20 116.11 2qkk s ILE 202 Ca 0.00 -0.49 -0.03 0.00 -0.51 0.00 0.00 60.65 59.62 2qkk s ILE 202 Cb 0.00 -1.19 -0.12 0.00 0.61 0.00 0.00 42.46 41.76 2qkk s ILE 202 CO 0.00 0.40 -0.22 -0.46 -2.81 0.00 0.00 174.94 171.85 2qkk n ASN 203 N 4.34 2.10 -4.55 4.50 0.23 -1.26 -4.39 115.26 116.23 2qkk n ASN 203 Ca -0.18 0.02 -0.40 0.00 -0.53 0.00 0.00 54.58 53.49 2qkk n ASN 203 Cb 0.51 -0.44 -0.10 0.00 -2.08 0.00 0.00 39.78 37.67 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 -2.41 3.62 0.07 -3.83 -2.85 -1.26 -2.68 119.74 110.40 2qkk s LYS 204 Ca -0.29 -0.45 -0.01 0.00 -1.00 0.00 0.00 55.97 54.22 2qkk s LYS 204 Cb 0.09 -3.78 -0.04 0.00 -2.06 0.00 0.00 37.83 32.04 2qkk s LYS 204 CO 0.45 -0.43 -0.02 -0.48 0.10 0.00 0.00 175.35 174.96 2qkk s LEU 205 N 1.88 2.39 -0.13 2.77 2.34 -1.10 -2.61 118.68 124.23 2qkk s LEU 205 Ca 0.09 -1.03 -0.04 0.00 0.06 0.00 0.00 54.13 53.21 2qkk s LEU 205 Cb -0.17 0.17 -0.03 0.00 -0.56 0.00 0.00 46.19 45.60 2qkk s LEU 205 CO 0.11 -0.60 0.02 -0.69 -1.06 0.00 0.00 176.35 174.14 2qkk s VAL 206 N -3.89 4.47 -0.22 1.48 1.01 0.11 -2.07 120.40 121.28 2qkk s VAL 206 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.91 2qkk s VAL 206 Cb 0.08 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.55 2qkk s VAL 206 CO -0.07 0.54 -0.12 -0.22 0.00 0.00 0.00 175.10 175.23 2qkk s LEU 207 N -0.30 2.84 -0.18 3.92 0.20 -0.97 -1.75 118.68 122.45 2qkk s LEU 207 Ca 0.07 -0.87 -0.11 0.00 0.69 0.00 0.00 54.13 53.91 2qkk s LEU 207 Cb -0.12 -1.58 -0.05 0.00 -0.43 0.00 0.00 46.19 44.01 2qkk s LEU 207 CO 0.02 -0.09 0.19 -0.31 -0.29 0.00 0.00 176.35 175.87 2qkk s TYR 208 N 1.27 3.45 0.19 5.38 1.51 -0.08 0.21 117.35 129.29 2qkk s TYR 208 Ca 0.00 0.44 -0.23 0.00 -1.01 0.00 0.00 57.07 56.28 2qkk s TYR 208 Cb -0.16 -2.20 0.05 0.00 -0.11 0.00 0.00 41.96 39.54 2qkk s TYR 208 CO -0.08 0.32 0.73 -0.08 -1.11 0.00 0.00 175.55 175.34 2qkk s THR 209 N 0.25 0.00 -0.19 -0.71 -1.32 -0.02 -1.06 115.64 112.59 2qkk s THR 209 Ca 0.12 -0.53 0.13 0.00 -1.21 0.00 0.00 61.69 60.20 2qkk s THR 209 Cb -0.12 -1.58 0.28 0.00 -1.51 0.00 0.00 72.50 69.57 2qkk s THR 209 CO 0.01 0.00 1.18 0.59 -2.21 0.00 0.00 174.62 174.19 2qkk n ASN 210 N -0.41 2.65 -4.33 8.08 5.03 -1.26 -0.76 115.26 124.26 2qkk n ASN 210 Ca -0.09 -2.72 -0.47 0.00 0.87 0.00 0.00 54.58 52.17 2qkk n ASN 210 Cb 0.61 -0.34 -0.02 0.00 -1.02 0.00 0.00 39.78 39.02 2qkk n ASN 210 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2qkk s SER 211 N -2.07 6.83 0.35 6.41 1.04 -1.26 -4.73 113.70 120.27 2qkk s SER 211 Ca 0.26 -2.83 0.15 0.00 0.48 0.00 0.00 55.95 54.01 2qkk s SER 211 Cb 0.21 -2.21 1.14 0.00 0.10 0.00 0.00 66.02 65.27 2qkk s SER 211 CO 0.05 -0.53 1.62 0.24 0.98 0.00 0.00 173.24 175.60 2qkk h MET 212 N 7.61 0.16 -0.02 4.02 2.86 -1.98 0.93 114.93 128.50 2qkk h MET 212 Ca 0.12 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2qkk h MET 212 Cb 1.02 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.63 2qkk h MET 212 CO 0.79 0.10 -0.05 0.35 1.06 0.00 0.00 176.91 179.16 2qkk h PHE 213 N 0.16 -0.16 -0.63 -0.22 3.57 -1.98 0.62 116.94 118.30 2qkk h PHE 213 Ca 0.76 0.01 0.07 0.00 3.53 0.00 0.00 57.97 62.34 2qkk h PHE 213 Cb 1.83 0.07 -0.10 0.00 2.79 0.00 0.00 35.95 40.54 2qkk h PHE 213 CO -0.07 -0.05 -0.53 1.15 -2.23 0.00 0.00 178.31 176.59 2qkk h THR 214 N -0.05 0.02 0.05 4.41 2.02 -1.18 0.27 112.91 118.45 2qkk h THR 214 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.19 2qkk h THR 214 Cb 0.06 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.49 2qkk h THR 214 CO -0.05 0.00 -0.14 0.40 0.37 0.00 0.00 175.52 176.10 2qkk h ILE 215 N -0.23 0.00 -1.00 3.11 2.04 -1.00 -1.23 117.51 119.20 2qkk h ILE 215 Ca 0.14 0.00 0.38 0.00 1.00 0.00 0.00 64.86 66.38 2qkk h ILE 215 Cb 0.54 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.45 2qkk h ILE 215 CO -0.73 0.00 0.53 0.78 0.00 0.00 0.00 178.15 178.73 2qkk h ASN 216 N -0.21 0.35 0.00 1.72 -0.26 0.70 -2.08 115.58 115.79 2qkk h ASN 216 Ca -0.00 0.24 0.00 0.00 -0.56 0.00 0.00 56.30 55.98 2qkk h ASN 216 Cb 0.21 0.24 0.00 0.00 -1.06 0.00 0.00 38.32 37.71 2qkk h ASN 216 CO -0.07 -0.34 0.00 0.61 -1.06 0.00 0.00 177.43 176.57 2qkk n GLY 217 N -1.28 -2.15 0.00 2.83 0.00 0.92 -2.19 105.19 103.32 2qkk n GLY 217 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 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 -1.30 0.59 0.00 -0.61 0.13 -0.54 -1.83 119.36 115.79 2qkk n ILE 218 Ca 0.00 0.32 0.00 0.00 -1.10 0.00 0.00 62.75 61.97 2qkk n ILE 218 Cb 0.00 -1.32 0.00 0.00 -0.84 0.00 0.00 39.64 37.48 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 -1.05 0.00 0.00 9.51 -2.24 -0.91 -4.86 114.28 114.73 2qkk n THR 219 Ca 0.00 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2qkk n THR 219 Cb 0.17 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 2qkk n THR 219 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2qkk n ASN 220 N -1.10 0.00 0.17 3.42 4.13 -0.76 -4.88 115.26 116.24 2qkk n ASN 220 Ca 0.00 0.00 0.16 0.00 1.68 0.00 0.00 54.58 56.42 2qkk n ASN 220 Cb 0.00 0.00 0.54 0.00 -1.54 0.00 0.00 39.78 38.78 2qkk n ASN 220 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 2qkk h TRP 221 N 0.00 0.00 0.28 3.10 6.55 -1.51 -1.54 115.95 122.82 2qkk h TRP 221 Ca 0.00 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 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 -0.13 -0.39 -1.05 0.00 0.00 178.44 176.87 2qkk h VAL 222 N 0.00 0.72 -0.92 1.49 -1.51 -1.66 -1.99 116.25 112.38 2qkk h VAL 222 Ca 0.15 -0.70 0.05 0.00 -1.23 0.00 0.00 66.70 64.97 2qkk h VAL 222 Cb 1.53 1.07 -0.06 0.00 -2.13 0.00 0.00 31.29 31.69 2qkk h VAL 222 CO -0.00 0.13 0.59 0.06 -1.23 0.00 0.00 177.57 177.12 2qkk h GLN 223 N -0.78 1.07 -0.01 5.19 3.07 -1.57 -2.22 115.11 119.87 2qkk h GLN 223 Ca -0.04 -0.06 0.03 0.00 0.09 0.00 0.00 58.65 58.67 2qkk h GLN 223 Cb 0.51 -0.24 -0.04 0.00 0.08 0.00 0.00 27.48 27.78 2qkk h GLN 223 CO 0.06 0.71 -0.23 0.78 0.09 0.00 0.00 178.83 180.25 2qkk h GLY 224 N 1.11 -0.33 1.95 0.06 0.00 -1.44 -1.23 103.07 103.19 2qkk h GLY 224 Ca 0.38 0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.99 2qkk h GLY 224 CO -0.15 -0.20 0.02 1.49 0.00 0.00 0.00 176.54 177.70 2qkk h TRP 225 N -0.36 0.00 0.00 5.60 6.55 -0.93 -0.67 115.95 126.15 2qkk h TRP 225 Ca 0.06 0.00 -0.08 0.00 0.95 0.00 0.00 58.89 59.82 2qkk h TRP 225 Cb 0.44 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.73 2qkk h TRP 225 CO -0.27 0.00 -0.37 0.87 -1.05 0.00 0.00 178.44 177.61 2qkk h LYS 226 N 0.00 0.00 -0.46 0.49 1.57 -0.64 0.61 116.57 118.14 2qkk h LYS 226 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qkk h LYS 226 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2qkk h LYS 226 CO -0.00 0.37 0.00 1.63 -0.57 0.00 0.00 179.45 180.88 2qkk n LYS 227 N -3.56 3.22 0.00 3.15 5.02 -0.29 -4.52 118.16 121.19 2qkk n LYS 227 Ca -0.00 -2.60 0.00 0.00 -2.02 0.00 0.00 58.31 53.69 2qkk n LYS 227 Cb 0.50 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 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 0.56 0.00 0.00 4.39 6.94 -1.02 -5.03 115.26 121.10 2qkk n ASN 228 Ca 0.20 -1.00 0.00 0.00 -0.02 0.00 0.00 54.58 53.76 2qkk n ASN 228 Cb 0.73 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.15 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 0.00 0.49 3.45 4.83 0.00 -0.94 -4.22 105.19 108.80 2qkk n GLY 229 Ca 0.00 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.84 -2.21 -4.67 1.61 7.02 0.16 -4.97 117.44 111.54 2qkk n TRP 230 Ca 0.00 0.83 -0.31 0.00 -1.02 0.00 0.00 57.50 57.00 2qkk n TRP 230 Cb 0.00 -4.39 -0.12 0.00 -2.42 0.00 0.00 31.31 24.37 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 -5.19 2.23 0.81 -0.99 1.02 -1.26 -2.49 119.74 113.86 2qkk s LYS 231 Ca 0.23 -0.89 -0.04 0.00 0.02 0.00 0.00 55.97 55.29 2qkk s LYS 231 Cb -0.04 -2.27 0.17 0.00 -0.52 0.00 0.00 37.83 35.16 2qkk s LYS 231 CO 0.77 0.56 1.11 -0.08 -0.92 0.00 0.00 175.35 176.79 2qkk s THR 232 N -0.90 2.01 0.54 2.17 -1.32 0.45 -4.79 115.64 113.80 2qkk s THR 232 Ca 0.15 -0.47 0.37 0.00 -1.21 0.00 0.00 61.69 60.53 2qkk s THR 232 Cb -0.11 -2.54 0.37 0.00 -1.51 0.00 0.00 72.50 68.71 2qkk s THR 232 CO 0.05 0.00 2.14 0.28 -2.21 0.00 0.00 174.62 174.87 2qkk h SER 233 N -0.90 0.00 -0.47 8.08 0.02 -2.01 2.04 113.55 120.31 2qkk h SER 233 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2qkk h SER 233 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2qkk h SER 233 CO 0.36 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.05 2qkk n ALA 234 N -1.98 2.43 -0.94 3.77 0.00 -1.26 -4.90 120.51 117.63 2qkk n ALA 234 Ca -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.48 2qkk n ALA 234 Cb 0.15 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 1.40 0.22 3.90 0.00 0.00 0.69 -4.98 105.19 106.42 2qkk n GLY 235 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.14 3.62 -0.12 1.61 1.02 -1.25 -4.47 119.74 119.01 2qkk s LYS 236 Ca 0.00 0.14 -0.29 0.00 0.02 0.00 0.00 55.97 55.84 2qkk s LYS 236 Cb 0.00 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.77 2qkk s LYS 236 CO 0.00 0.01 1.60 -2.00 -0.92 0.00 0.00 175.35 174.04 2qkk s GLU 237 N -4.11 4.06 -0.01 1.68 2.12 -1.26 0.17 118.70 121.36 2qkk s GLU 237 Ca 0.46 1.97 -0.34 0.00 0.36 0.00 0.00 54.97 57.42 2qkk s GLU 237 Cb -0.10 -3.98 -0.13 0.00 0.26 0.00 0.00 34.13 30.18 2qkk s GLU 237 CO 0.36 -0.97 1.76 1.33 -0.54 0.00 0.00 175.26 177.20 2qkk n VAL 238 N 5.76 0.36 -0.12 3.70 0.24 -1.04 -4.85 118.33 122.38 2qkk n VAL 238 Ca 0.17 -0.06 0.05 0.00 -2.04 0.00 0.00 64.34 62.46 2qkk n VAL 238 Cb 0.44 -1.71 0.37 0.00 -1.47 0.00 0.00 33.84 31.47 2qkk n VAL 238 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2qkk h ILE 239 N 4.77 1.07 -1.46 1.34 2.04 -1.93 -2.72 117.51 120.62 2qkk h ILE 239 Ca -0.47 -0.24 -0.70 0.00 1.00 0.00 0.00 64.86 64.44 2qkk h ILE 239 Cb 1.27 0.30 -0.30 0.00 -0.74 0.00 0.00 36.82 37.34 2qkk h ILE 239 CO 0.92 0.13 0.73 0.59 0.00 0.00 0.00 178.15 180.52 2qkk n ASN 240 N -4.47 7.22 0.00 1.72 4.13 -1.26 -4.65 115.26 117.96 2qkk n ASN 240 Ca 0.08 -3.80 0.00 0.00 1.68 0.00 0.00 54.58 52.53 2qkk n ASN 240 Cb 0.15 -0.94 0.00 0.00 -1.54 0.00 0.00 39.78 37.45 2qkk n ASN 240 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 2qkk n LYS 241 N -0.70 0.00 -0.01 3.52 0.00 -1.03 -0.76 118.16 119.17 2qkk n LYS 241 Ca 0.56 0.35 -0.00 0.00 0.00 0.00 0.00 58.31 59.22 2qkk n LYS 241 Cb 0.49 -1.24 -0.00 0.00 0.00 0.00 0.00 35.03 34.28 2qkk n LYS 241 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2qkk n GLU 242 N -1.56 -0.01 -0.39 1.64 2.13 -1.26 -0.25 120.64 120.94 2qkk n GLU 242 Ca 0.00 0.89 -0.07 0.00 0.66 0.00 0.00 57.16 58.63 2qkk n GLU 242 Cb 0.00 -1.33 -0.04 0.00 0.27 0.00 0.00 31.44 30.34 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 -1.86 -0.60 4.31 3.32 -1.88 0.17 116.42 119.88 2qkk h ASP 243 Ca 0.00 0.32 -0.03 0.00 0.02 0.00 0.00 57.03 57.34 2qkk h ASP 243 Cb 0.01 0.87 -0.03 0.00 0.22 0.00 0.00 39.33 40.40 2qkk h ASP 243 CO -0.02 -0.26 0.27 -0.26 -1.72 0.00 0.00 179.24 177.24 2qkk h PHE 244 N -0.02 0.91 0.09 4.55 0.04 0.48 -3.02 116.94 119.96 2qkk h PHE 244 Ca 0.23 -0.05 0.02 0.00 2.80 0.00 0.00 57.97 60.98 2qkk h PHE 244 Cb 0.49 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 2qkk h PHE 244 CO -0.95 0.69 -0.35 0.28 -0.60 0.00 0.00 178.31 177.38 2qkk h VAL 245 N 0.90 0.26 -0.02 -0.55 2.07 0.15 -2.06 116.25 117.00 2qkk h VAL 245 Ca 0.22 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.74 2qkk h VAL 245 Cb 0.15 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2qkk h VAL 245 CO -0.02 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.74 2qkk h ALA 246 N 0.06 1.22 0.00 1.67 0.00 -1.33 -1.61 119.26 119.27 2qkk h ALA 246 Ca 0.04 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qkk h ALA 246 Cb 0.61 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2qkk h ALA 246 CO -0.23 -0.18 -0.01 1.25 0.00 0.00 0.00 179.25 180.08 2qkk h LEU 247 N 0.00 0.00 -0.76 0.00 5.85 -1.30 -3.28 115.31 115.82 2qkk h LEU 247 Ca 0.01 -0.67 0.17 0.00 0.84 0.00 0.00 57.88 58.23 2qkk h LEU 247 Cb 0.35 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.27 2qkk h LEU 247 CO -0.00 0.84 0.22 -0.08 -0.34 0.00 0.00 178.44 179.08 2qkk h GLU 248 N -1.00 0.30 -0.61 1.25 4.81 -0.98 0.29 114.58 118.64 2qkk h GLU 248 Ca -0.00 -0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.33 2qkk h GLU 248 Cb 0.67 -0.07 -0.12 0.00 0.63 0.00 0.00 28.75 29.87 2qkk h GLU 248 CO -0.00 0.20 -0.24 -0.09 -0.73 0.00 0.00 179.01 178.15 2qkk h ARG 249 N 0.31 -0.08 -0.18 1.92 9.65 -1.44 0.64 114.38 125.20 2qkk h ARG 249 Ca 0.43 0.01 -0.11 0.00 -1.10 0.00 0.00 59.98 59.21 2qkk h ARG 249 Cb 0.75 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.33 2qkk h ARG 249 CO -0.50 -0.05 -0.35 -0.07 2.80 0.00 0.00 179.97 181.80 2qkk h LEU 250 N -0.08 0.39 -1.36 3.80 4.07 -0.68 -2.08 115.31 119.37 2qkk h LEU 250 Ca 0.27 -0.15 0.21 0.00 0.08 0.00 0.00 57.88 58.29 2qkk h LEU 250 Cb 0.51 -0.11 -0.08 0.00 1.08 0.00 0.00 40.66 42.06 2qkk h LEU 250 CO -0.66 0.72 0.61 0.74 -1.08 0.00 0.00 178.44 178.77 2qkk h THR 251 N 0.32 0.67 -2.00 0.22 2.02 0.34 -3.43 112.91 111.06 2qkk h THR 251 Ca 0.04 -0.17 -0.64 0.00 0.77 0.00 0.00 66.41 66.40 2qkk h THR 251 Cb 0.77 0.12 0.07 0.00 -1.74 0.00 0.00 68.15 67.37 2qkk h THR 251 CO 0.06 0.09 0.46 0.00 0.37 0.00 0.00 175.52 176.51 2qkk n GLN 252 N -4.59 1.43 -1.63 6.66 1.13 -0.03 -1.91 117.38 118.44 2qkk n GLN 252 Ca 0.21 0.51 -0.09 0.00 -1.94 0.00 0.00 57.00 55.69 2qkk n GLN 252 Cb 0.69 -2.12 -0.03 0.00 0.11 0.00 0.00 30.24 28.89 2qkk n GLN 252 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qkk n GLY 253 N 2.43 0.65 3.11 1.08 0.00 -1.26 -5.01 105.19 106.19 2qkk n GLY 253 Ca 0.16 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.46 0.55 -0.87 1.61 -1.94 -0.80 -4.94 119.30 109.44 2qkk s MET 254 Ca 0.00 -0.63 -0.04 0.00 -1.71 0.00 0.00 55.69 53.31 2qkk s MET 254 Cb 0.00 0.22 0.22 0.00 2.01 0.00 0.00 34.83 37.28 2qkk s MET 254 CO 0.00 -0.14 0.76 0.34 -0.01 0.00 0.00 175.02 175.98 2qkk s ASP 255 N -1.87 6.07 0.35 3.03 -1.08 -1.09 -5.00 116.67 117.08 2qkk s ASP 255 Ca -0.08 -3.50 -0.16 0.00 -0.52 0.00 0.00 52.55 48.29 2qkk s ASP 255 Cb -0.04 -1.95 -0.09 0.00 -1.46 0.00 0.00 42.92 39.38 2qkk s ASP 255 CO -0.02 -0.25 0.78 -0.63 0.52 0.00 0.00 175.17 175.56 2qkk s ILE 256 N -1.04 4.64 -0.38 4.11 1.01 -1.26 -2.72 121.20 125.56 2qkk s ILE 256 Ca 0.25 1.01 0.01 0.00 0.00 0.00 0.00 60.65 61.92 2qkk s ILE 256 Cb -0.10 -3.62 0.14 0.00 0.01 0.00 0.00 42.46 38.89 2qkk s ILE 256 CO -0.10 -0.25 0.23 -1.58 0.00 0.00 0.00 174.94 173.25 2qkk s GLN 257 N -3.11 0.79 0.31 2.79 0.74 -0.88 -4.97 119.66 115.33 2qkk s GLN 257 Ca 0.55 -1.60 -0.29 0.00 0.05 0.00 0.00 55.36 54.08 2qkk s GLN 257 Cb -0.10 -1.59 -0.12 0.00 1.10 0.00 0.00 33.01 32.30 2qkk s GLN 257 CO 0.18 -1.22 1.43 0.91 -0.55 0.00 0.00 175.29 176.04 2qkk n TRP 258 N 3.78 2.54 -3.93 1.67 7.02 -1.26 -2.29 117.44 124.96 2qkk n TRP 258 Ca 0.13 0.43 -0.28 0.00 -1.02 0.00 0.00 57.50 56.76 2qkk n TRP 258 Cb 0.37 -2.49 -0.17 0.00 -2.42 0.00 0.00 31.31 26.61 2qkk n TRP 258 CO 0.00 0.00 0.00 1.41 -2.02 0.00 0.00 177.69 177.08 2qkk s MET 259 N -1.26 1.68 0.34 -0.99 1.75 0.57 -4.87 119.30 116.52 2qkk s MET 259 Ca 0.60 -0.43 -0.14 0.00 -1.25 0.00 0.00 55.69 54.47 2qkk s MET 259 Cb -0.55 -1.86 -0.08 0.00 2.84 0.00 0.00 34.83 35.17 2qkk s MET 259 CO 0.56 -0.32 0.74 -1.58 -0.65 0.00 0.00 175.02 173.78 2qkk s HIS 260 N 1.62 3.39 -0.27 4.11 2.46 -1.25 -0.84 115.29 124.52 2qkk s HIS 260 Ca 0.03 1.18 -0.04 0.00 0.47 0.00 0.00 55.06 56.70 2qkk s HIS 260 Cb -0.14 -2.52 0.09 0.00 -0.13 0.00 0.00 32.58 29.89 2qkk s HIS 260 CO -0.09 0.05 0.12 0.14 -2.47 0.00 0.00 174.74 172.50 2qkk s VAL 261 N -2.06 -0.02 0.07 0.89 -7.23 0.06 -4.84 120.40 107.27 2qkk s VAL 261 Ca 0.54 -0.67 -0.24 0.00 -1.81 0.00 0.00 61.98 59.80 2qkk s VAL 261 Cb -0.10 -0.93 -0.13 0.00 0.56 0.00 0.00 36.38 35.77 2qkk s VAL 261 CO 0.20 -0.63 0.55 -2.65 -0.31 0.00 0.00 175.10 172.26 2qkk n PRO 262 N 5.23 0.00 0.00 4.82 -0.02 -1.26 -4.49 135.00 139.28 2qkk n PRO 262 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2qkk n PRO 262 Cb 0.43 -0.87 0.00 0.00 -0.02 0.00 0.00 33.50 33.05 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 1.24 0.00 2.55 -1.23 0.00 -1.26 -3.02 105.19 103.47 2qkk n GLY 263 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2qkk n GLY 263 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qkk s HIS 264 N -2.33 0.37 -3.61 1.61 3.76 -1.26 -5.10 115.29 108.74 2qkk s HIS 264 Ca 0.00 -0.90 0.00 0.00 -0.15 0.00 0.00 55.06 54.01 2qkk s HIS 264 Cb 0.00 -0.93 0.00 0.00 1.11 0.00 0.00 32.58 32.76 2qkk s HIS 264 CO 0.00 -0.82 0.00 -1.13 -0.85 0.00 0.00 174.74 171.94 2qkk n SER 265 N 5.23 0.00 0.00 1.40 3.41 -1.17 -5.13 113.62 117.37 2qkk n SER 265 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2qkk n SER 265 Cb 0.42 0.00 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 -0.59 0.84 3.15 5.00 0.00 -1.26 -4.80 105.19 107.53 2qkk n GLY 266 Ca 0.00 -1.09 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 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 0.98 0.32 1.61 0.08 -1.26 -5.02 117.98 114.69 2qkk s PHE 267 Ca 0.00 -0.61 0.09 0.00 0.12 0.00 0.00 56.93 56.53 2qkk s PHE 267 Cb 0.00 -0.55 0.94 0.00 -0.57 0.00 0.00 43.02 42.84 2qkk s PHE 267 CO 0.00 -0.02 1.64 0.82 -0.10 0.00 0.00 175.22 177.56 2qkk h ILE 268 N 3.82 0.26 -1.42 0.64 2.04 -2.02 -1.29 117.51 119.54 2qkk h ILE 268 Ca -0.37 -0.08 0.43 0.00 1.00 0.00 0.00 64.86 65.84 2qkk h ILE 268 Cb 1.19 0.01 -0.08 0.00 -0.74 0.00 0.00 36.82 37.20 2qkk h ILE 268 CO 0.49 0.04 1.00 0.61 0.00 0.00 0.00 178.15 180.29 2qkk n GLY 269 N -1.33 -0.75 0.20 5.37 0.00 -1.26 0.23 105.19 107.65 2qkk n GLY 269 Ca 0.28 0.56 -0.13 0.00 0.00 0.00 0.00 46.02 46.73 2qkk n GLY 269 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2qkk h ASN 270 N 0.00 0.68 -0.43 1.61 2.35 -1.60 -2.42 115.58 115.77 2qkk h ASN 270 Ca 0.73 -0.44 -0.13 0.00 -0.55 0.00 0.00 56.30 55.90 2qkk h ASN 270 Cb 2.76 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 40.92 2qkk h ASN 270 CO -0.12 1.21 -0.24 -0.08 -1.65 0.00 0.00 177.43 176.55 2qkk h GLU 271 N 0.39 0.95 0.19 0.81 4.57 0.27 -2.35 114.58 119.41 2qkk h GLU 271 Ca -0.04 -0.41 0.01 0.00 -1.18 0.00 0.00 59.36 57.74 2qkk h GLU 271 Cb 1.35 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.89 2qkk h GLU 271 CO 0.14 1.08 -0.23 0.93 -1.18 0.00 0.00 179.01 179.75 2qkk h GLU 272 N 0.81 -0.45 -0.52 1.92 4.39 -1.40 0.26 114.58 119.59 2qkk h GLU 272 Ca 0.10 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.94 2qkk h GLU 272 Cb 0.81 0.10 -0.10 0.00 -0.10 0.00 0.00 28.75 29.46 2qkk h GLU 272 CO 0.07 -0.30 -0.13 0.00 -1.16 0.00 0.00 179.01 177.49 2qkk h ALA 273 N 0.26 0.34 -0.06 3.43 0.00 -1.37 0.51 119.26 122.37 2qkk h ALA 273 Ca 0.01 0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2qkk h ALA 273 Cb 0.45 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 2qkk h ALA 273 CO -0.08 -0.44 -0.49 -0.44 0.00 0.00 0.00 179.25 177.81 2qkk h ASP 274 N -0.00 -1.51 -0.53 0.00 3.45 -0.70 0.42 116.42 117.56 2qkk h ASP 274 Ca 0.25 0.18 0.10 0.00 0.43 0.00 0.00 57.03 57.99 2qkk h ASP 274 Cb 0.38 0.59 -0.11 0.00 -0.56 0.00 0.00 39.33 39.63 2qkk h ASP 274 CO -0.54 -0.48 -0.33 0.03 -1.57 0.00 0.00 179.24 176.35 2qkk h ARG 275 N -0.59 -0.18 -0.70 3.56 2.47 0.10 -0.66 114.38 118.37 2qkk h ARG 275 Ca 0.04 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.82 2qkk h ARG 275 Cb 0.68 0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 28.99 2qkk h ARG 275 CO -0.38 -0.12 0.42 -0.07 0.56 0.00 0.00 179.97 180.38 2qkk h LEU 276 N -0.19 0.68 0.14 3.04 3.38 0.07 -2.44 115.31 119.97 2qkk h LEU 276 Ca 0.21 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.21 2qkk h LEU 276 Cb 0.54 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2qkk h LEU 276 CO -0.63 0.46 -0.44 0.00 0.09 0.00 0.00 178.44 177.91 2qkk h ALA 277 N 1.32 -0.81 0.00 1.53 0.00 0.13 -0.77 119.26 120.66 2qkk h ALA 277 Ca 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2qkk h ALA 277 Cb 0.09 0.74 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2qkk h ALA 277 CO -0.14 -1.02 0.00 0.07 0.00 0.00 0.00 179.25 178.16 2qkk h ARG 278 N -0.69 0.00 0.02 0.00 0.11 -1.32 -0.36 114.38 112.15 2qkk h ARG 278 Ca 0.01 0.00 -0.24 0.00 0.10 0.00 0.00 59.98 59.85 2qkk h ARG 278 Cb 0.71 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.79 2qkk h ARG 278 CO -0.25 0.00 -1.01 0.93 0.10 0.00 0.00 179.97 179.74 2qkk h GLU 279 N 0.00 0.46 0.00 0.08 4.39 -0.77 -3.07 114.58 115.67 2qkk h GLU 279 Ca 0.00 -0.52 -0.05 0.00 0.34 0.00 0.00 59.36 59.13 2qkk h GLU 279 Cb 0.27 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2qkk h GLU 279 CO 0.00 1.17 -0.23 0.78 -1.16 0.00 0.00 179.01 179.58 2qkk h GLY 280 N 1.07 0.00 1.91 -3.84 0.00 0.28 -3.01 103.07 99.48 2qkk h GLY 280 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 2qkk h GLY 280 CO 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 176.54 176.30 2qkk h ALA 281 N 1.77 1.21 0.00 3.60 0.00 -1.25 -2.63 119.26 121.96 2qkk h ALA 281 Ca -0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2qkk h ALA 281 Cb 0.82 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2qkk h ALA 281 CO 0.03 0.56 0.00 0.87 0.00 0.00 0.00 179.25 180.71 2qkk h LYS 282 N 0.09 0.00 -7.05 0.00 1.57 -1.53 -3.45 116.57 106.20 2qkk h LYS 282 Ca 0.01 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2qkk h LYS 282 Cb 0.79 0.00 0.13 0.00 0.08 0.00 0.00 32.23 33.23 2qkk h LYS 282 CO 0.06 0.00 0.58 -0.65 -0.57 0.00 0.00 179.45 178.87 2qkk s GLN 283 N -3.56 3.14 0.44 3.15 -0.21 -1.01 -4.95 119.66 116.66 2qkk s GLN 283 Ca 0.03 2.14 -0.24 0.00 0.02 0.00 0.00 55.36 57.31 2qkk s GLN 283 Cb 0.08 -2.21 -0.08 0.00 1.00 0.00 0.00 33.01 31.80 2qkk s GLN 283 CO 0.56 -1.16 1.16 -1.54 -2.12 0.00 0.00 175.29 172.19 2qkk s SER 284 N -1.08 6.33 0.00 5.90 1.04 -1.26 -4.89 113.70 119.73 2qkk s SER 284 Ca 0.72 2.30 0.05 0.00 0.48 0.00 0.00 55.95 59.50 2qkk s SER 284 Cb -0.38 -2.60 0.29 0.00 0.10 0.00 0.00 66.02 63.42 2qkk s SER 284 CO 0.44 -0.80 0.76 -0.62 0.98 0.00 0.00 173.24 174.00