#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyj s VAL 122 N 0.00 -0.51 0.09 3.34 0.11 -1.26 -5.03 120.40 117.14 1xyj s VAL 122 Ca 0.00 -0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 58.88 1xyj s VAL 122 Cb 0.00 -0.73 -0.14 0.00 -1.53 0.00 0.00 36.38 33.99 1xyj s VAL 122 CO 0.00 -0.11 1.32 1.23 -3.33 0.00 0.00 175.10 174.22 1xyj h GLY 123 N 8.23 0.81 0.00 6.54 0.00 -2.02 -3.46 103.07 113.16 1xyj h GLY 123 Ca -0.18 -1.05 0.00 0.00 0.00 0.00 0.00 47.33 46.10 1xyj h GLY 123 CO 0.25 0.94 0.00 0.61 0.00 0.00 0.00 176.54 178.34 1xyj n GLY 124 N 0.56 -0.30 0.74 4.60 0.00 -1.26 -5.03 105.19 104.50 1xyj n GLY 124 Ca -0.06 0.77 0.06 0.00 0.00 0.00 0.00 46.02 46.78 1xyj n GLY 124 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xyj n LEU 125 N 0.00 1.94 0.00 0.99 4.77 -1.26 -5.01 117.00 118.43 1xyj n LEU 125 Ca 0.00 -2.99 0.00 0.00 -0.03 0.00 0.00 56.01 52.99 1xyj n LEU 125 Cb 0.00 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 1xyj n LEU 125 CO 0.00 0.94 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 1xyj n GLY 126 N -0.64 0.92 2.19 -0.72 0.00 -1.26 -1.64 105.19 104.04 1xyj n GLY 126 Ca 0.13 0.02 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 1xyj n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyj n GLY 127 N 0.00 -0.57 3.75 -0.02 0.00 -1.26 -5.14 105.19 101.95 1xyj n GLY 127 Ca 0.00 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1xyj n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyj s TYR 128 N 0.03 3.06 0.59 1.61 2.02 -0.65 -4.98 117.35 119.02 1xyj s TYR 128 Ca 0.03 1.16 -0.06 0.00 -0.37 0.00 0.00 57.07 57.83 1xyj s TYR 128 Cb 0.07 -3.75 0.01 0.00 -0.40 0.00 0.00 41.96 37.89 1xyj s TYR 128 CO -0.02 -2.34 0.89 0.00 -1.57 0.00 0.00 175.55 172.51 1xyj s MET 129 N -0.72 2.92 0.15 -0.62 0.23 0.23 -4.89 119.30 116.60 1xyj s MET 129 Ca 0.56 -0.03 0.02 0.00 -1.03 0.00 0.00 55.69 55.21 1xyj s MET 129 Cb -0.41 -2.28 -0.04 0.00 -1.53 0.00 0.00 34.83 30.57 1xyj s MET 129 CO 0.45 -0.69 -0.04 -0.48 -2.03 0.00 0.00 175.02 172.24 1xyj s LEU 130 N -4.97 2.32 0.00 0.18 2.34 -1.26 -0.77 118.68 116.51 1xyj s LEU 130 Ca 0.54 -1.09 -0.14 0.00 0.06 0.00 0.00 54.13 53.49 1xyj s LEU 130 Cb -0.11 -0.13 0.21 0.00 -0.56 0.00 0.00 46.19 45.61 1xyj s LEU 130 CO 0.45 -0.49 0.75 0.61 -1.06 0.00 0.00 176.35 176.61 1xyj n GLY 131 N -0.18 -2.72 0.00 -3.48 0.00 -0.46 -4.98 105.19 93.37 1xyj n GLY 131 Ca -0.09 -1.47 0.05 0.00 0.00 0.00 0.00 46.02 44.51 1xyj n GLY 131 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xyj n SER 132 N -4.32 1.33 0.00 1.61 7.64 -1.26 -4.78 113.62 113.84 1xyj n SER 132 Ca 0.11 -0.43 0.00 0.00 1.01 0.00 0.00 58.87 59.56 1xyj n SER 132 Cb 0.41 1.23 0.00 0.00 -1.01 0.00 0.00 64.21 64.84 1xyj n SER 132 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xyj n ALA 133 N -1.54 0.00 -3.71 -0.43 0.00 -1.26 -5.01 120.51 108.56 1xyj n ALA 133 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1xyj n ALA 133 Cb 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.56 1xyj n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xyj s MET 134 N 0.00 0.29 0.22 0.00 0.23 -0.11 -5.00 119.30 114.93 1xyj s MET 134 Ca 0.00 0.66 -0.04 0.00 -1.03 0.00 0.00 55.69 55.27 1xyj s MET 134 Cb 0.00 -0.07 0.02 0.00 -1.53 0.00 0.00 34.83 33.25 1xyj s MET 134 CO 0.00 -0.17 0.37 -1.13 -2.03 0.00 0.00 175.02 172.06 1xyj n SER 135 N 4.30 -1.06 -3.54 -1.18 3.41 -1.24 -3.64 113.62 110.67 1xyj n SER 135 Ca -0.24 -2.06 -0.26 0.00 -0.26 0.00 0.00 58.87 56.06 1xyj n SER 135 Cb 0.54 1.86 0.05 0.00 -0.26 0.00 0.00 64.21 66.39 1xyj n SER 135 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1xyj n ARG 136 N -0.33 -1.50 0.06 4.33 3.00 -1.26 -4.87 116.66 116.09 1xyj n ARG 136 Ca -0.02 0.62 0.12 0.00 -0.00 0.00 0.00 57.85 58.57 1xyj n ARG 136 Cb 0.35 -4.60 0.46 0.00 0.00 0.00 0.00 32.46 28.67 1xyj n ARG 136 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1xyj n PRO 137 N -3.78 0.12 -2.88 -0.14 -0.04 -1.26 -4.95 135.00 122.07 1xyj n PRO 137 Ca -0.09 0.23 -0.03 0.00 -0.04 0.00 0.00 63.50 63.58 1xyj n PRO 137 Cb 0.60 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1xyj n PRO 137 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1xyj n LEU 138 N -1.90 -6.79 -4.88 1.53 -0.00 -1.26 -4.97 117.00 98.72 1xyj n LEU 138 Ca 0.04 1.04 -0.29 0.00 -0.00 0.00 0.00 56.01 56.80 1xyj n LEU 138 Cb 0.29 -2.89 0.16 0.00 -0.00 0.00 0.00 43.42 40.99 1xyj n LEU 138 CO 0.23 -2.59 0.82 -0.63 -0.00 0.00 0.00 177.39 175.22 1xyj s ILE 139 N -1.60 1.97 0.19 1.96 1.09 -1.26 -4.95 121.20 118.60 1xyj s ILE 139 Ca 0.05 0.00 -0.22 0.00 -1.10 0.00 0.00 60.65 59.38 1xyj s ILE 139 Cb -0.01 -2.94 0.10 0.00 -1.06 0.00 0.00 42.46 38.56 1xyj s ILE 139 CO 0.61 0.00 1.45 1.57 -0.10 0.00 0.00 174.94 178.47 1xyj n HIS 140 N -3.72 -0.16 -4.24 3.97 -0.00 -1.26 -4.82 115.22 104.99 1xyj n HIS 140 Ca 0.12 1.16 -0.32 0.00 -0.00 0.00 0.00 57.72 58.68 1xyj n HIS 140 Cb 0.60 -0.73 -0.06 0.00 -0.00 0.00 0.00 29.99 29.79 1xyj n HIS 140 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1xyj n PHE 141 N -5.29 -1.44 0.74 1.57 3.01 -1.26 -4.84 117.46 109.96 1xyj n PHE 141 Ca 0.06 0.69 0.09 0.00 1.01 0.00 0.00 57.45 59.31 1xyj n PHE 141 Cb 0.32 -2.94 0.27 0.00 -0.01 0.00 0.00 39.48 37.12 1xyj n PHE 141 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xyj n GLY 142 N -1.96 0.95 3.90 1.37 0.00 -1.26 -4.70 105.19 103.49 1xyj n GLY 142 Ca -0.18 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.04 1xyj n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xyj s ASN 143 N -1.30 6.37 -0.18 1.61 4.22 -1.26 -5.09 114.94 119.30 1xyj s ASN 143 Ca 0.33 0.92 -0.09 0.00 -2.14 0.00 0.00 52.86 51.87 1xyj s ASN 143 Cb 0.18 -2.24 -0.08 0.00 1.28 0.00 0.00 41.25 40.39 1xyj s ASN 143 CO 0.25 -0.44 -0.24 0.47 -2.04 0.00 0.00 177.10 175.10 1xyj n ASP 144 N -1.74 1.31 0.13 3.54 8.00 -1.26 -4.30 116.55 122.24 1xyj n ASP 144 Ca 0.00 0.23 -0.12 0.00 0.71 0.00 0.00 54.79 55.61 1xyj n ASP 144 Cb 0.55 -0.55 -0.07 0.00 -0.02 0.00 0.00 41.12 41.03 1xyj n ASP 144 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1xyj h TYR 145 N -0.66 -1.08 0.30 1.24 3.20 -1.98 -0.30 116.97 117.69 1xyj h TYR 145 Ca -0.46 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.44 1xyj h TYR 145 Cb 1.39 0.44 -0.02 0.00 1.54 0.00 0.00 36.73 40.08 1xyj h TYR 145 CO -0.07 -0.45 -0.30 0.93 -1.64 0.00 0.00 178.16 176.63 1xyj h GLU 146 N -0.61 -0.61 -0.03 1.82 5.08 -1.97 -1.01 114.58 117.25 1xyj h GLU 146 Ca -0.02 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1xyj h GLU 146 Cb 0.58 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1xyj h GLU 146 CO -0.15 -0.40 -0.02 -3.47 -1.00 0.00 0.00 179.01 173.97 1xyj n ASP 147 N -5.42 -0.03 0.08 1.42 2.03 -1.16 -1.88 116.55 111.59 1xyj n ASP 147 Ca -0.09 0.92 0.00 0.00 0.52 0.00 0.00 54.79 56.14 1xyj n ASP 147 Cb 0.32 -0.44 0.31 0.00 -0.72 0.00 0.00 41.12 40.59 1xyj n ASP 147 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1xyj h ARG 148 N 0.00 0.33 0.00 -0.67 3.08 -0.95 0.45 114.38 116.62 1xyj h ARG 148 Ca 0.00 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1xyj h ARG 148 Cb 0.01 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1xyj h ARG 148 CO -0.02 0.50 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.45 1xyj h TYR 149 N 0.30 0.00 0.00 3.04 5.03 -0.78 -2.79 116.97 121.78 1xyj h TYR 149 Ca 0.05 0.00 -0.42 0.00 2.58 0.00 0.00 58.73 60.94 1xyj h TYR 149 Cb 0.50 0.00 -0.06 0.00 1.55 0.00 0.00 36.73 38.71 1xyj h TYR 149 CO 0.01 0.01 -2.39 0.66 -1.32 0.00 0.00 178.16 175.13 1xyj n TYR 150 N -3.17 0.15 -0.16 -3.82 4.02 -0.38 -4.73 117.16 109.07 1xyj n TYR 150 Ca -0.02 0.06 0.05 0.00 -0.01 0.00 0.00 57.90 57.97 1xyj n TYR 150 Cb 0.13 -1.02 0.34 0.00 -0.02 0.00 0.00 39.34 38.78 1xyj n TYR 150 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1xyj h ARG 151 N -0.73 0.76 0.00 -0.72 2.43 0.10 0.50 114.38 116.71 1xyj h ARG 151 Ca -0.63 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.49 1xyj h ARG 151 Cb 1.67 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 31.05 1xyj h ARG 151 CO -0.31 0.50 0.00 0.93 -1.51 0.00 0.00 179.97 179.58 1xyj h GLU 152 N 0.78 0.00 0.00 0.20 5.08 -1.76 -3.24 114.58 115.64 1xyj h GLU 152 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1xyj h GLU 152 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1xyj h GLU 152 CO -0.08 0.00 -0.66 0.09 -1.00 0.00 0.00 179.01 177.36 1xyj n ASN 153 N -2.93 1.36 0.00 1.42 3.02 -0.02 -4.87 115.26 113.25 1xyj n ASN 153 Ca 0.01 -0.44 0.00 0.00 -0.03 0.00 0.00 54.58 54.13 1xyj n ASN 153 Cb 0.32 1.11 0.00 0.00 -0.61 0.00 0.00 39.78 40.60 1xyj n ASN 153 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1xyj n MET 154 N -1.36 0.00 -0.06 3.52 2.81 -0.13 -2.93 117.12 118.98 1xyj n MET 154 Ca 0.00 0.10 0.06 0.00 -1.81 0.00 0.00 57.70 56.05 1xyj n MET 154 Cb 0.13 -1.50 0.42 0.00 -0.71 0.00 0.00 33.22 31.56 1xyj n MET 154 CO 0.00 0.00 0.00 0.10 1.51 0.00 0.00 175.97 177.58 1xyj h TYR 155 N 0.00 0.56 0.00 2.03 -0.00 -1.88 -3.30 116.97 114.37 1xyj h TYR 155 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.74 1xyj h TYR 155 Cb 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 36.73 36.55 1xyj h TYR 155 CO 0.00 0.32 0.00 2.89 -0.00 0.00 0.00 178.16 181.37 1xyj n ARG 156 N -4.47 0.22 -1.81 0.10 -4.01 -1.15 -4.79 116.66 100.75 1xyj n ARG 156 Ca 0.06 0.00 -0.29 0.00 -1.04 0.00 0.00 57.85 56.58 1xyj n ARG 156 Cb 0.15 -1.08 0.12 0.00 -3.04 0.00 0.00 32.46 28.61 1xyj n ARG 156 CO 0.00 0.00 0.00 0.71 -3.04 0.00 0.00 177.63 175.30 1xyj s TYR 157 N -2.00 2.57 0.63 2.89 2.02 -1.25 -5.05 117.35 117.16 1xyj s TYR 157 Ca 0.02 0.69 -0.15 0.00 -0.37 0.00 0.00 57.07 57.26 1xyj s TYR 157 Cb 0.01 -3.58 -0.02 0.00 -0.40 0.00 0.00 41.96 37.97 1xyj s TYR 157 CO 0.01 -2.10 1.08 -1.25 -1.57 0.00 0.00 175.55 171.72 1xyj s PRO 158 N -5.56 3.06 0.14 -1.71 0.04 -1.26 -4.96 135.00 124.75 1xyj s PRO 158 Ca 0.65 1.24 0.21 0.00 0.04 0.00 0.00 61.00 63.14 1xyj s PRO 158 Cb -0.11 -1.99 0.86 0.00 0.04 0.00 0.00 34.50 33.30 1xyj s PRO 158 CO 0.51 -1.02 1.66 0.09 0.04 0.00 0.00 177.00 178.27 1xyj n ASN 159 N -2.33 0.39 -3.26 6.66 3.02 -1.26 -4.76 115.26 113.72 1xyj n ASN 159 Ca 0.09 0.58 -0.15 0.00 -0.03 0.00 0.00 54.58 55.07 1xyj n ASN 159 Cb 0.53 -0.67 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 1xyj n ASN 159 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1xyj s GLN 160 N -3.15 1.89 0.05 3.52 -0.21 -1.24 -0.94 119.66 119.59 1xyj s GLN 160 Ca 0.07 -1.79 0.00 0.00 0.02 0.00 0.00 55.36 53.67 1xyj s GLN 160 Cb 0.11 0.43 -0.03 0.00 1.00 0.00 0.00 33.01 34.51 1xyj s GLN 160 CO 0.39 -0.77 -0.05 0.14 -2.12 0.00 0.00 175.29 172.88 1xyj s VAL 161 N -3.10 0.35 -0.19 1.09 -7.23 -1.26 -4.97 120.40 105.10 1xyj s VAL 161 Ca 0.32 -1.46 -0.02 0.00 -1.81 0.00 0.00 61.98 59.01 1xyj s VAL 161 Cb -0.00 -1.05 -0.00 0.00 0.56 0.00 0.00 36.38 35.88 1xyj s VAL 161 CO 0.21 -0.72 -0.10 -0.31 -0.31 0.00 0.00 175.10 173.87 1xyj s TYR 162 N -2.73 2.88 0.33 2.82 2.02 -1.26 -1.35 117.35 120.05 1xyj s TYR 162 Ca -0.01 -0.98 -0.06 0.00 -0.37 0.00 0.00 57.07 55.64 1xyj s TYR 162 Cb -0.01 -1.99 0.01 0.00 -0.40 0.00 0.00 41.96 39.57 1xyj s TYR 162 CO -0.05 -0.50 0.50 1.52 -1.57 0.00 0.00 175.55 175.46 1xyj s TYR 163 N 1.10 0.81 0.18 2.71 1.13 0.05 -4.44 117.35 118.90 1xyj s TYR 163 Ca 0.01 -1.13 0.05 0.00 -1.41 0.00 0.00 57.07 54.59 1xyj s TYR 163 Cb -0.15 0.07 -0.04 0.00 -1.10 0.00 0.00 41.96 40.75 1xyj s TYR 163 CO -0.02 -1.15 0.22 0.50 -2.51 0.00 0.00 175.55 172.59 1xyj s ARG 164 N -3.18 3.15 0.66 -3.49 3.52 -1.26 -0.60 118.95 117.75 1xyj s ARG 164 Ca 0.27 -0.80 -0.17 0.00 -0.13 0.00 0.00 55.73 54.90 1xyj s ARG 164 Cb -0.01 -2.76 -0.04 0.00 -1.56 0.00 0.00 34.95 30.57 1xyj s ARG 164 CO 0.17 0.47 0.69 -2.30 -0.81 0.00 0.00 175.30 173.52 1xyj n PRO 165 N -0.69 0.50 -1.50 5.12 -0.02 -1.26 -4.87 135.00 132.27 1xyj n PRO 165 Ca -0.08 0.21 -0.48 0.00 -2.02 0.00 0.00 63.50 61.13 1xyj n PRO 165 Cb 0.55 -1.93 -0.06 0.00 -0.02 0.00 0.00 33.50 32.04 1xyj n PRO 165 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xyj n VAL 166 N -2.12 0.25 -4.36 -1.45 0.31 -1.26 -4.93 118.33 104.77 1xyj n VAL 166 Ca 0.12 -0.31 -0.20 0.00 -0.01 0.00 0.00 64.34 63.93 1xyj n VAL 166 Cb 0.49 -1.93 -0.09 0.00 -0.91 0.00 0.00 33.84 31.40 1xyj n VAL 166 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1xyj s ASP 167 N 7.50 1.76 0.78 4.52 -1.08 -1.26 -5.12 116.67 123.77 1xyj s ASP 167 Ca 1.06 -1.57 -0.11 0.00 -0.52 0.00 0.00 52.55 51.41 1xyj s ASP 167 Cb -0.69 0.39 0.06 0.00 -1.46 0.00 0.00 42.92 41.21 1xyj s ASP 167 CO 0.45 -0.89 1.09 -1.58 0.52 0.00 0.00 175.17 174.76 1xyj s GLN 168 N -3.79 2.21 -0.95 4.34 0.74 -1.26 -4.18 119.66 116.78 1xyj s GLN 168 Ca 0.34 1.13 -0.02 0.00 0.05 0.00 0.00 55.36 56.86 1xyj s GLN 168 Cb 0.05 -1.89 -0.03 0.00 1.10 0.00 0.00 33.01 32.23 1xyj s GLN 168 CO 0.17 -1.67 0.81 0.98 -0.55 0.00 0.00 175.29 175.04 1xyj n TYR 169 N -3.53 -1.96 -0.97 1.67 4.19 -1.26 -5.01 117.16 110.29 1xyj n TYR 169 Ca 0.09 0.76 -0.34 0.00 3.31 0.00 0.00 57.90 61.72 1xyj n TYR 169 Cb 0.53 -4.24 0.11 0.00 0.49 0.00 0.00 39.34 36.23 1xyj n TYR 169 CO 0.00 0.00 0.00 0.43 0.91 0.00 0.00 176.86 178.20 1xyj n SER 170 N -2.87 -1.51 -4.23 2.98 7.64 -1.26 -5.06 113.62 109.30 1xyj n SER 170 Ca -0.15 0.44 -0.24 0.00 1.01 0.00 0.00 58.87 59.92 1xyj n SER 170 Cb 0.62 -1.24 -0.09 0.00 -1.01 0.00 0.00 64.21 62.49 1xyj n SER 170 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xyj s ASN 171 N -1.86 2.64 0.12 6.43 0.02 -1.26 -5.10 114.94 115.94 1xyj s ASN 171 Ca 0.61 -1.58 0.00 0.00 -1.02 0.00 0.00 52.86 50.87 1xyj s ASN 171 Cb -0.26 0.34 0.00 0.00 0.02 0.00 0.00 41.25 41.35 1xyj s ASN 171 CO 0.63 -0.84 0.00 0.00 0.02 0.00 0.00 177.10 176.91 1xyj n GLN 172 N -0.84 0.00 0.04 -0.60 6.02 -1.26 -4.70 117.38 116.04 1xyj n GLN 172 Ca -0.05 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.03 1xyj n GLN 172 Cb 0.65 -0.09 0.38 0.00 1.02 0.00 0.00 30.24 32.20 1xyj n GLN 172 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1xyj n ASN 173 N -3.02 0.22 -0.13 1.08 2.85 -1.26 -0.52 115.26 114.48 1xyj n ASN 173 Ca 0.00 0.55 -0.22 0.00 -0.11 0.00 0.00 54.58 54.81 1xyj n ASN 173 Cb 0.05 -0.60 -0.10 0.00 1.24 0.00 0.00 39.78 40.36 1xyj n ASN 173 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1xyj n ASN 174 N -1.74 1.99 -0.01 1.20 3.02 -1.26 -4.62 115.26 113.85 1xyj n ASN 174 Ca 0.03 0.06 0.06 0.00 -0.03 0.00 0.00 54.58 54.70 1xyj n ASN 174 Cb 0.20 -0.54 0.46 0.00 -0.61 0.00 0.00 39.78 39.28 1xyj n ASN 174 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1xyj h PHE 175 N -0.39 0.46 0.06 3.10 3.57 -1.66 -0.08 116.94 122.00 1xyj h PHE 175 Ca -0.59 0.01 0.01 0.00 3.53 0.00 0.00 57.97 60.93 1xyj h PHE 175 Cb 1.73 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 40.30 1xyj h PHE 175 CO -0.02 0.27 -0.09 -0.24 -2.23 0.00 0.00 178.31 176.00 1xyj h VAL 176 N 0.48 0.79 0.00 1.41 3.04 -1.06 0.22 116.25 121.13 1xyj h VAL 176 Ca 0.18 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.74 1xyj h VAL 176 Cb 0.11 0.79 -0.02 0.00 -2.01 0.00 0.00 31.29 30.16 1xyj h VAL 176 CO -0.04 0.00 -0.59 0.45 -1.01 0.00 0.00 177.57 176.37 1xyj h HIS 177 N -0.18 0.00 0.00 3.17 3.86 -1.74 0.18 115.15 120.45 1xyj h HIS 177 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1xyj h HIS 177 Cb 0.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1xyj h HIS 177 CO -0.12 0.59 0.00 -3.47 0.86 0.00 0.00 177.93 175.79 1xyj n ASP 178 N -3.51 0.00 0.14 2.45 2.03 -0.08 -4.23 116.55 113.35 1xyj n ASP 178 Ca -0.00 0.39 0.00 0.00 0.52 0.00 0.00 54.79 55.70 1xyj n ASP 178 Cb 0.67 -0.46 0.00 0.00 -0.72 0.00 0.00 41.12 40.61 1xyj n ASP 178 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xyj h VAL 180 N 0.00 0.22 -1.02 0.00 2.07 -0.68 -2.60 116.25 114.25 1xyj h VAL 180 Ca 0.00 -0.03 0.25 0.00 0.82 0.00 0.00 66.70 67.73 1xyj h VAL 180 Cb 0.00 0.23 -0.11 0.00 -1.52 0.00 0.00 31.29 29.89 1xyj h VAL 180 CO 0.00 0.00 0.63 -1.13 0.02 0.00 0.00 177.57 177.09 1xyj h ASN 181 N -1.07 0.59 -0.70 0.57 -1.24 -1.32 -0.99 115.58 111.42 1xyj h ASN 181 Ca -0.11 0.11 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 1xyj h ASN 181 Cb 0.81 0.02 -0.03 0.00 0.73 0.00 0.00 38.32 39.84 1xyj h ASN 181 CO 0.18 0.11 0.43 -0.29 -1.29 0.00 0.00 177.43 176.57 1xyj h ILE 182 N 0.52 1.19 -0.10 2.57 -0.00 -1.64 0.31 117.51 120.37 1xyj h ILE 182 Ca 0.62 -0.41 -0.03 0.00 -0.00 0.00 0.00 64.86 65.04 1xyj h ILE 182 Cb 1.31 0.21 -0.00 0.00 -0.00 0.00 0.00 36.82 38.34 1xyj h ILE 182 CO -0.39 0.20 -0.05 0.74 -0.00 0.00 0.00 178.15 178.65 1xyj h THR 183 N 0.95 1.32 0.28 2.19 2.02 -1.06 -2.36 112.91 116.25 1xyj h THR 183 Ca 0.25 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 1xyj h THR 183 Cb -0.05 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 1xyj h THR 183 CO -0.05 0.30 -0.27 1.62 0.37 0.00 0.00 175.52 177.49 1xyj h VAL 184 N -0.16 0.00 -0.54 3.16 3.04 -1.30 -3.26 116.25 117.19 1xyj h VAL 184 Ca 0.02 0.00 0.11 0.00 -1.01 0.00 0.00 66.70 65.82 1xyj h VAL 184 Cb 0.51 0.00 -0.09 0.00 -2.01 0.00 0.00 31.29 29.69 1xyj h VAL 184 CO 0.01 0.00 -0.01 0.08 -1.01 0.00 0.00 177.57 176.64 1xyj h ARG 185 N -0.55 0.10 -2.00 4.17 0.11 -0.47 0.14 114.38 115.88 1xyj h ARG 185 Ca -0.03 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 1xyj h ARG 185 Cb 0.48 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.53 1xyj h ARG 185 CO -0.03 0.07 -0.01 0.94 0.10 0.00 0.00 179.97 181.03 1xyj n GLN 186 N -5.26 0.94 0.00 0.08 -0.06 -0.89 -1.12 117.38 111.07 1xyj n GLN 186 Ca 0.07 -0.03 0.00 0.00 -2.00 0.00 0.00 57.00 55.04 1xyj n GLN 186 Cb 0.30 -1.07 0.00 0.00 -4.06 0.00 0.00 30.24 25.41 1xyj n GLN 186 CO 0.00 0.00 0.00 1.58 -0.20 0.00 0.00 177.06 178.44 1xyj n HIS 187 N 1.57 0.00 -0.11 3.69 -0.00 -0.29 -4.95 115.22 115.13 1xyj n HIS 187 Ca 0.01 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 58.03 1xyj n HIS 187 Cb 0.47 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.24 1xyj n HIS 187 CO 0.00 0.00 0.00 -2.37 0.46 0.00 0.00 176.34 174.43 1xyj n THR 188 N -0.25 1.29 -0.27 3.57 5.66 -0.12 -3.65 114.28 120.52 1xyj n THR 188 Ca 0.00 -0.49 0.01 0.00 -3.05 0.00 0.00 64.05 60.52 1xyj n THR 188 Cb 0.00 -1.31 0.14 0.00 -1.55 0.00 0.00 70.33 67.61 1xyj n THR 188 CO 0.00 0.00 0.00 1.62 -3.05 0.00 0.00 175.07 173.64 1xyj h VAL 189 N -0.02 0.95 0.00 1.08 3.04 -1.34 0.23 116.25 120.18 1xyj h VAL 189 Ca -0.50 -0.26 -0.05 0.00 -1.01 0.00 0.00 66.70 64.87 1xyj h VAL 189 Cb 1.77 0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 31.16 1xyj h VAL 189 CO -0.08 0.14 -0.25 0.00 -1.01 0.00 0.00 177.57 176.36 1xyj h THR 190 N 0.77 0.66 0.17 3.17 1.03 -1.74 -0.93 112.91 116.04 1xyj h THR 190 Ca 0.35 -1.14 -0.35 0.00 -0.01 0.00 0.00 66.41 65.27 1xyj h THR 190 Cb 0.27 1.74 0.00 0.00 -1.07 0.00 0.00 68.15 69.09 1xyj h THR 190 CO -0.21 0.25 -1.76 0.74 -0.01 0.00 0.00 175.52 174.52 1xyj h THR 191 N 0.00 0.89 -0.18 0.00 2.02 -1.43 -3.31 112.91 110.90 1xyj h THR 191 Ca -0.00 -2.47 -0.12 0.00 0.77 0.00 0.00 66.41 64.59 1xyj h THR 191 Cb 0.72 2.71 -0.01 0.00 -1.74 0.00 0.00 68.15 69.83 1xyj h THR 191 CO 0.03 0.85 -0.42 0.74 0.37 0.00 0.00 175.52 177.09 1xyj h THR 192 N 0.05 1.31 0.00 3.16 2.02 -0.22 0.11 112.91 119.34 1xyj h THR 192 Ca -0.36 -1.58 0.00 0.00 0.77 0.00 0.00 66.41 65.24 1xyj h THR 192 Cb 2.05 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 70.09 1xyj h THR 192 CO 0.15 0.49 0.00 1.07 0.37 0.00 0.00 175.52 177.60 1xyj n THR 193 N -4.02 0.46 -1.39 3.16 5.66 -0.38 -1.68 114.28 116.09 1xyj n THR 193 Ca -0.02 0.11 -0.20 0.00 -3.05 0.00 0.00 64.05 60.89 1xyj n THR 193 Cb 0.51 -0.81 0.15 0.00 -1.55 0.00 0.00 70.33 68.63 1xyj n THR 193 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1xyj n LYS 194 N -1.29 2.33 -1.84 1.09 4.76 0.38 -4.96 118.16 118.63 1xyj n LYS 194 Ca 0.09 -3.23 -0.00 0.00 -2.87 0.00 0.00 58.31 52.29 1xyj n LYS 194 Cb 0.15 -2.10 0.00 0.00 -1.84 0.00 0.00 35.03 31.24 1xyj n LYS 194 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xyj n GLY 195 N -1.06 -0.42 3.27 0.72 0.00 -0.68 -5.02 105.19 102.01 1xyj n GLY 195 Ca 0.51 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 46.31 1xyj n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xyj s GLU 196 N -3.03 1.43 -0.28 1.61 2.56 -1.14 -4.96 118.70 114.89 1xyj s GLU 196 Ca 0.01 -1.79 0.01 0.00 0.00 0.00 0.00 54.97 53.20 1xyj s GLU 196 Cb -0.00 0.07 0.17 0.00 2.00 0.00 0.00 34.13 36.37 1xyj s GLU 196 CO 0.16 -0.43 0.49 1.21 -0.56 0.00 0.00 175.26 176.13 1xyj s ASN 197 N -3.28 -0.52 -0.51 -1.70 2.47 -1.26 -4.75 114.94 105.39 1xyj s ASN 197 Ca 0.38 0.17 -0.27 0.00 0.42 0.00 0.00 52.86 53.56 1xyj s ASN 197 Cb 0.06 1.56 -0.01 0.00 -1.45 0.00 0.00 41.25 41.41 1xyj s ASN 197 CO 0.16 -0.31 1.76 -0.36 -3.72 0.00 0.00 177.10 174.63 1xyj s PHE 198 N 2.68 1.82 1.11 0.43 0.40 -1.26 -4.98 117.98 118.18 1xyj s PHE 198 Ca 0.13 0.69 -0.14 0.00 -0.60 0.00 0.00 56.93 57.02 1xyj s PHE 198 Cb -0.13 -4.15 0.21 0.00 0.51 0.00 0.00 43.02 39.46 1xyj s PHE 198 CO -0.24 -2.43 0.78 2.41 0.70 0.00 0.00 175.22 176.44 1xyj n THR 199 N 7.22 0.00 -0.17 0.64 -1.04 -1.26 -4.58 114.28 115.09 1xyj n THR 199 Ca 0.20 -0.32 -0.07 0.00 -2.04 0.00 0.00 64.05 61.81 1xyj n THR 199 Cb 0.50 -0.88 0.02 0.00 -1.82 0.00 0.00 70.33 68.14 1xyj n THR 199 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1xyj h GLU 200 N -2.35 0.69 0.00 -2.82 4.81 -1.98 0.10 114.58 113.03 1xyj h GLU 200 Ca -0.56 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.61 1xyj h GLU 200 Cb 1.32 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.55 1xyj h GLU 200 CO 0.44 0.48 -0.06 1.15 -0.73 0.00 0.00 179.01 180.29 1xyj h THR 201 N 0.69 0.62 0.00 0.32 2.02 -2.00 0.11 112.91 114.68 1xyj h THR 201 Ca 0.19 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1xyj h THR 201 Cb -0.04 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1xyj h THR 201 CO -0.04 0.06 -0.00 -0.78 0.37 0.00 0.00 175.52 175.13 1xyj h ASP 202 N 0.00 0.00 -0.38 4.18 1.82 -1.56 -3.31 116.42 117.17 1xyj h ASP 202 Ca -0.00 -0.57 0.09 0.00 -0.39 0.00 0.00 57.03 56.16 1xyj h ASP 202 Cb 0.14 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.14 1xyj h ASP 202 CO 0.01 0.79 0.27 0.24 -1.61 0.00 0.00 179.24 178.93 1xyj h MET 203 N -1.00 0.08 0.75 0.28 2.86 -0.59 -0.99 114.93 116.33 1xyj h MET 203 Ca -0.00 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1xyj h MET 203 Cb 0.58 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 1xyj h MET 203 CO -0.00 0.06 -0.48 -0.22 1.06 0.00 0.00 176.91 177.32 1xyj h LYS 204 N 0.09 -1.12 -0.57 1.72 3.64 -0.91 -2.19 116.57 117.21 1xyj h LYS 204 Ca 0.18 0.08 0.07 0.00 -1.27 0.00 0.00 60.65 59.70 1xyj h LYS 204 Cb 0.60 0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 32.61 1xyj h LYS 204 CO -0.02 -0.75 0.26 0.82 -2.27 0.00 0.00 179.45 177.50 1xyj h ILE 205 N -1.16 0.87 0.17 2.00 2.04 -1.31 -1.41 117.51 118.72 1xyj h ILE 205 Ca -0.10 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 1xyj h ILE 205 Cb 0.94 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1xyj h ILE 205 CO 0.09 0.09 -0.28 0.24 0.00 0.00 0.00 178.15 178.29 1xyj h MET 206 N 0.48 -0.46 -0.23 2.37 2.86 -1.14 0.76 114.93 119.58 1xyj h MET 206 Ca 0.27 0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.87 1xyj h MET 206 Cb 0.25 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1xyj h MET 206 CO -0.23 -0.31 -0.17 0.93 1.06 0.00 0.00 176.91 178.19 1xyj h GLU 207 N -0.48 0.39 0.00 1.72 5.08 -1.38 -0.36 114.58 119.55 1xyj h GLU 207 Ca -0.02 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1xyj h GLU 207 Cb 0.44 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1xyj h GLU 207 CO -0.09 0.56 -0.10 -0.09 -1.00 0.00 0.00 179.01 178.29 1xyj h ARG 208 N 0.36 0.00 0.05 2.33 1.12 -0.87 0.27 114.38 117.64 1xyj h ARG 208 Ca 0.06 0.00 -0.37 0.00 -1.11 0.00 0.00 59.98 58.56 1xyj h ARG 208 Cb 0.52 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.43 1xyj h ARG 208 CO 0.03 0.10 -2.24 1.55 -3.11 0.00 0.00 179.97 176.31 1xyj n VAL 209 N -4.40 1.60 0.10 0.20 3.14 0.23 -3.17 118.33 116.03 1xyj n VAL 209 Ca -0.03 -0.65 0.04 0.00 -2.96 0.00 0.00 64.34 60.74 1xyj n VAL 209 Cb 0.18 -1.42 0.44 0.00 -1.06 0.00 0.00 33.84 31.98 1xyj n VAL 209 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1xyj h VAL 210 N 0.03 1.13 0.02 1.55 2.07 -0.99 -0.69 116.25 119.37 1xyj h VAL 210 Ca -0.50 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 66.59 1xyj h VAL 210 Cb 1.99 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 32.65 1xyj h VAL 210 CO 0.00 0.16 -0.36 -0.33 0.02 0.00 0.00 177.57 177.06 1xyj h GLU 211 N 0.30 -0.51 0.00 1.57 5.08 -0.58 -1.08 114.58 119.37 1xyj h GLU 211 Ca 0.07 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1xyj h GLU 211 Cb 0.17 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1xyj h GLU 211 CO 0.00 -0.34 -0.09 1.96 -1.00 0.00 0.00 179.01 179.54 1xyj h GLN 212 N -0.53 0.00 0.13 2.33 1.08 -1.12 0.13 115.11 117.12 1xyj h GLN 212 Ca 0.05 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.98 1xyj h GLN 212 Cb 0.60 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 1xyj h GLN 212 CO -0.27 0.09 -1.25 0.00 -0.95 0.00 0.00 178.83 176.45 1xyj h MET 213 N 0.00 0.27 0.00 1.46 -0.00 -1.27 -3.30 114.93 112.09 1xyj h MET 213 Ca -0.00 -0.46 -0.09 0.00 -0.00 0.00 0.00 59.70 59.15 1xyj h MET 213 Cb 0.76 0.17 -0.01 0.00 -0.00 0.00 0.00 31.60 32.52 1xyj h MET 213 CO 0.01 1.22 -0.44 0.00 -0.00 0.00 0.00 176.91 177.70 1xyj h VAL 215 N 0.00 1.48 -0.07 0.00 3.04 -0.91 -3.05 116.25 116.75 1xyj h VAL 215 Ca -0.00 -1.75 0.04 0.00 -1.01 0.00 0.00 66.70 63.97 1xyj h VAL 215 Cb 0.91 2.52 -0.05 0.00 -2.01 0.00 0.00 31.29 32.65 1xyj h VAL 215 CO 0.06 0.49 -0.27 0.00 -1.01 0.00 0.00 177.57 176.84 1xyj h THR 216 N -0.37 0.39 0.00 3.17 1.03 -1.62 0.10 112.91 115.60 1xyj h THR 216 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.38 1xyj h THR 216 Cb 0.91 0.39 0.00 0.00 -1.07 0.00 0.00 68.15 68.38 1xyj h THR 216 CO 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 175.52 175.56 1xyj n GLN 217 N -5.38 0.37 0.00 0.00 -0.00 -1.19 -0.04 117.38 111.14 1xyj n GLN 217 Ca -0.04 0.01 0.02 0.00 -0.00 0.00 0.00 57.00 56.98 1xyj n GLN 217 Cb 0.30 -1.50 0.01 0.00 -0.00 0.00 0.00 30.24 29.05 1xyj n GLN 217 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.06 178.04 1xyj n TYR 218 N -1.01 0.00 -0.02 2.61 9.36 0.19 -4.03 117.16 124.25 1xyj n TYR 218 Ca 0.09 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.24 1xyj n TYR 218 Cb 0.04 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 38.73 1xyj n TYR 218 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1xyj n GLN 219 N 0.15 0.17 0.05 2.98 10.64 -0.24 -4.57 117.38 126.56 1xyj n GLN 219 Ca 0.02 0.07 -0.20 0.00 -1.83 0.00 0.00 57.00 55.06 1xyj n GLN 219 Cb 0.08 -0.79 -0.13 0.00 -0.86 0.00 0.00 30.24 28.54 1xyj n GLN 219 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 1xyj h LYS 220 N -0.30 0.48 0.00 2.61 5.09 -0.70 0.22 116.57 123.98 1xyj h LYS 220 Ca -0.14 -0.63 -0.09 0.00 0.09 0.00 0.00 60.65 59.87 1xyj h LYS 220 Cb 0.89 0.21 -0.01 0.00 0.10 0.00 0.00 32.23 33.41 1xyj h LYS 220 CO -0.08 1.26 -0.44 1.49 -2.09 0.00 0.00 179.45 179.59 1xyj h GLU 221 N 0.00 0.00 0.40 0.07 4.57 -1.70 -2.11 114.58 115.81 1xyj h GLU 221 Ca -0.14 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 1xyj h GLU 221 Cb 1.66 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.25 1xyj h GLU 221 CO 0.18 0.44 -0.19 0.77 -1.18 0.00 0.00 179.01 179.03 1xyj h SER 222 N 0.00 -0.45 -0.66 1.04 0.02 -1.72 -3.22 113.55 108.55 1xyj h SER 222 Ca -0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 1xyj h SER 222 Cb 1.19 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.81 1xyj h SER 222 CO 0.06 -0.17 0.35 -0.33 -1.14 0.00 0.00 176.83 175.60 1xyj h GLU 223 N -0.73 0.95 0.00 3.45 5.08 -0.75 0.30 114.58 122.89 1xyj h GLU 223 Ca -0.05 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1xyj h GLU 223 Cb 0.51 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1xyj h GLU 223 CO 0.09 0.72 0.00 0.00 -1.00 0.00 0.00 179.01 178.82 1xyj n ALA 224 N -2.44 1.97 -0.00 3.43 0.00 -0.81 -3.02 120.51 119.63 1xyj n ALA 224 Ca 0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 53.44 53.42 1xyj n ALA 224 Cb 0.11 -1.27 -0.00 0.00 0.00 0.00 0.00 19.45 18.29 1xyj n ALA 224 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1xyj n TYR 225 N -1.20 0.00 -0.12 0.00 4.19 -0.49 -2.91 117.16 116.63 1xyj n TYR 225 Ca 0.09 0.00 -0.13 0.00 3.31 0.00 0.00 57.90 61.17 1xyj n TYR 225 Cb 0.11 -0.02 -0.09 0.00 0.49 0.00 0.00 39.34 39.83 1xyj n TYR 225 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 1xyj h TYR 226 N 0.00 -1.63 -1.63 2.98 0.05 -0.36 -3.40 116.97 112.97 1xyj h TYR 226 Ca -0.01 0.08 -0.56 0.00 0.05 0.00 0.00 58.73 58.29 1xyj h TYR 226 Cb 1.02 0.76 -0.08 0.00 1.01 0.00 0.00 36.73 39.44 1xyj h TYR 226 CO 0.00 -0.49 -0.50 -0.65 -1.05 0.00 0.00 178.16 175.47 1xyj s GLN 227 N -5.69 2.26 -0.59 4.88 -1.52 -1.23 -4.91 119.66 112.86 1xyj s GLN 227 Ca -0.15 -1.78 -0.07 0.00 -1.95 0.00 0.00 55.36 51.41 1xyj s GLN 227 Cb 0.09 -2.03 0.01 0.00 -0.22 0.00 0.00 33.01 30.86 1xyj s GLN 227 CO 0.62 -0.09 0.39 0.54 -0.25 0.00 0.00 175.29 176.50 1xyj n ARG 228 N -1.24 -0.82 -1.53 2.91 1.74 -1.26 -4.64 116.66 111.81 1xyj n ARG 228 Ca -0.01 0.26 -0.37 0.00 -0.77 0.00 0.00 57.85 56.96 1xyj n ARG 228 Cb 0.64 -1.29 -0.07 0.00 -1.02 0.00 0.00 32.46 30.71 1xyj n ARG 228 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1xyj n ARG 229 N -2.35 0.68 -2.81 5.56 3.00 -1.26 -4.69 116.66 114.80 1xyj n ARG 229 Ca -0.16 -0.02 -0.14 0.00 -0.01 0.00 0.00 57.85 57.51 1xyj n ARG 229 Cb 0.41 -2.81 0.01 0.00 0.00 0.00 0.00 32.46 30.07 1xyj n ARG 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xyj n ALA 230 N 14.18 3.26 -0.60 7.54 0.00 -1.15 -5.05 120.51 138.69 1xyj n ALA 230 Ca 0.47 -3.42 0.00 0.00 0.00 0.00 0.00 53.44 50.49 1xyj n ALA 230 Cb 0.38 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1xyj n ALA 230 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95