#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 -0.34 0.00 3.34 0.11 -1.26 -5.09 120.40 117.15 1xyj s VAL 122 Ca 0.00 0.28 0.00 0.00 -2.93 0.00 0.00 61.98 59.33 1xyj s VAL 122 Cb 0.00 -0.40 0.00 0.00 -1.53 0.00 0.00 36.38 34.45 1xyj s VAL 122 CO 0.00 0.12 0.77 0.61 -3.33 0.00 0.00 175.10 173.27 1xyj n GLY 123 N 5.22 -2.10 0.00 6.54 0.00 -1.26 -4.95 105.19 108.64 1xyj n GLY 123 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1xyj n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyj n GLY 124 N -0.40 1.72 2.56 -0.02 0.00 -1.26 -5.11 105.19 102.69 1xyj n GLY 124 Ca 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 45.92 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 -6.42 -3.44 0.99 4.32 -1.26 -4.89 117.00 106.31 1xyj n LEU 125 Ca 0.00 1.98 -0.36 0.00 -0.02 0.00 0.00 56.01 57.61 1xyj n LEU 125 Cb 0.00 -3.19 -0.02 0.00 -1.62 0.00 0.00 43.42 38.58 1xyj n LEU 125 CO 0.00 -3.64 2.70 0.61 -1.22 0.00 0.00 177.39 175.84 1xyj n GLY 126 N 1.36 3.66 2.11 -0.72 0.00 -1.26 -4.37 105.19 105.97 1xyj n GLY 126 Ca -0.30 -1.30 -0.07 0.00 0.00 0.00 0.00 46.02 44.35 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 3.94 0.07 3.92 -0.02 0.00 -1.26 -5.05 105.19 106.79 1xyj n GLY 127 Ca 0.57 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 46.19 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 -3.16 2.98 0.25 1.61 1.51 -1.26 -5.00 117.35 114.29 1xyj s TYR 128 Ca 0.06 0.58 0.09 0.00 -1.01 0.00 0.00 57.07 56.79 1xyj s TYR 128 Cb -0.01 -3.23 -0.05 0.00 -0.11 0.00 0.00 41.96 38.56 1xyj s TYR 128 CO 0.32 -1.44 -0.15 -1.64 -1.11 0.00 0.00 175.55 171.53 1xyj s MET 129 N -5.32 1.52 0.27 -0.62 -1.94 -0.10 -4.99 119.30 108.11 1xyj s MET 129 Ca 0.60 -1.70 0.03 0.00 -1.71 0.00 0.00 55.69 52.90 1xyj s MET 129 Cb -0.11 -1.40 -0.06 0.00 2.01 0.00 0.00 34.83 35.28 1xyj s MET 129 CO 0.46 0.21 0.05 -0.48 -0.01 0.00 0.00 175.02 175.26 1xyj s LEU 130 N -3.42 2.01 0.00 -0.03 2.34 -1.26 -0.40 118.68 117.92 1xyj s LEU 130 Ca 0.27 -1.32 -0.18 0.00 0.06 0.00 0.00 54.13 52.95 1xyj s LEU 130 Cb -0.01 -0.22 0.27 0.00 -0.56 0.00 0.00 46.19 45.67 1xyj s LEU 130 CO 0.11 -0.61 0.96 0.61 -1.06 0.00 0.00 176.35 176.36 1xyj n GLY 131 N -0.52 -2.73 0.09 -3.48 0.00 0.15 -4.95 105.19 93.74 1xyj n GLY 131 Ca -0.02 -1.49 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 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 -4.64 0.46 -3.33 1.61 7.64 -1.26 -4.74 113.62 109.36 1xyj n SER 132 Ca 0.13 0.22 0.03 0.00 1.01 0.00 0.00 58.87 60.26 1xyj n SER 132 Cb 0.52 0.49 -0.05 0.00 -1.01 0.00 0.00 64.21 64.16 1xyj n SER 132 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xyj s ALA 133 N -2.61 -3.08 -0.30 -0.43 0.00 -1.26 -4.96 121.76 109.12 1xyj s ALA 133 Ca -0.07 1.86 -0.12 0.00 0.00 0.00 0.00 51.96 53.63 1xyj s ALA 133 Cb 0.07 -2.19 0.17 0.00 0.00 0.00 0.00 23.12 21.17 1xyj s ALA 133 CO 0.83 -0.78 0.93 0.00 0.00 0.00 0.00 175.76 176.73 1xyj s MET 134 N 1.78 0.31 0.56 0.00 0.23 0.44 -4.97 119.30 117.65 1xyj s MET 134 Ca -0.02 0.66 0.07 0.00 -1.03 0.00 0.00 55.69 55.37 1xyj s MET 134 Cb -0.01 0.38 0.06 0.00 -1.53 0.00 0.00 34.83 33.73 1xyj s MET 134 CO -0.14 -0.24 0.58 -1.54 -2.03 0.00 0.00 175.02 171.65 1xyj s SER 135 N 2.73 4.84 -0.14 -1.18 1.04 -1.23 -3.18 113.70 116.59 1xyj s SER 135 Ca 0.02 -1.07 -0.13 0.00 0.48 0.00 0.00 55.95 55.25 1xyj s SER 135 Cb -0.10 0.37 -0.05 0.00 0.10 0.00 0.00 66.02 66.34 1xyj s SER 135 CO -0.16 -1.21 0.45 -2.11 0.98 0.00 0.00 173.24 171.19 1xyj n ARG 136 N -1.98 0.00 -0.25 4.02 0.00 -1.26 -4.86 116.66 112.33 1xyj n ARG 136 Ca 0.06 0.00 0.01 0.00 -0.00 0.00 0.00 57.85 57.92 1xyj n ARG 136 Cb 0.63 -0.41 0.13 0.00 -0.00 0.00 0.00 32.46 32.82 1xyj n ARG 136 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1xyj h PRO 137 N 1.49 0.65 -4.95 2.89 0.11 -1.95 -3.48 132.00 126.77 1xyj h PRO 137 Ca -0.11 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.96 1xyj h PRO 137 Cb 0.37 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 1xyj h PRO 137 CO 0.27 0.43 -0.95 -0.11 -0.21 0.00 0.00 178.00 177.43 1xyj n LEU 138 N -4.81 -7.45 -4.81 2.35 -0.00 -1.26 -5.06 117.00 95.96 1xyj n LEU 138 Ca 0.11 1.38 -0.34 0.00 -0.00 0.00 0.00 56.01 57.15 1xyj n LEU 138 Cb 0.25 -3.17 -0.07 0.00 -0.00 0.00 0.00 43.42 40.43 1xyj n LEU 138 CO 0.26 -3.02 0.65 -0.63 -0.00 0.00 0.00 177.39 174.65 1xyj s ILE 139 N -1.45 4.30 0.18 1.96 1.01 -1.26 -4.99 121.20 120.95 1xyj s ILE 139 Ca -0.02 1.59 -0.13 0.00 0.00 0.00 0.00 60.65 62.10 1xyj s ILE 139 Cb 0.00 -3.74 0.09 0.00 0.01 0.00 0.00 42.46 38.82 1xyj s ILE 139 CO 0.72 -0.16 1.83 -0.74 0.00 0.00 0.00 174.94 176.60 1xyj h HIS 140 N 2.34 0.78 0.00 3.97 -0.00 -2.04 -3.46 115.15 116.74 1xyj h HIS 140 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.89 1xyj h HIS 140 Cb 1.19 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 28.34 1xyj h HIS 140 CO 0.62 0.52 0.00 1.19 -0.00 0.00 0.00 177.93 180.25 1xyj n PHE 141 N -4.63 0.00 -0.92 5.26 3.72 -1.26 -4.71 117.46 114.91 1xyj n PHE 141 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 1xyj n PHE 141 Cb 0.04 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.58 1xyj n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xyj n GLY 142 N 0.00 0.25 0.03 1.37 0.00 -1.26 -5.01 105.19 100.57 1xyj n GLY 142 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1xyj n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xyj n ASN 143 N -0.45 -1.81 0.00 1.61 4.13 -1.26 -5.05 115.26 112.43 1xyj n ASN 143 Ca 0.00 -0.11 0.00 0.00 1.68 0.00 0.00 54.58 56.15 1xyj n ASN 143 Cb 0.22 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.45 1xyj n ASN 143 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1xyj n ASP 144 N -3.02 0.00 -0.18 6.41 2.03 -1.26 -4.67 116.55 115.85 1xyj n ASP 144 Ca 0.00 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.24 1xyj n ASP 144 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.39 1xyj n ASP 144 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1xyj h TYR 145 N 0.00 -1.11 0.00 -0.67 3.20 -1.99 -1.22 116.97 115.19 1xyj h TYR 145 Ca 0.00 0.07 -0.08 0.00 3.14 0.00 0.00 58.73 61.86 1xyj h TYR 145 Cb 0.00 0.56 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1xyj h TYR 145 CO 0.00 -0.41 -0.40 0.93 -1.64 0.00 0.00 178.16 176.65 1xyj h GLU 146 N -0.22 0.00 0.26 1.82 5.08 -1.98 0.28 114.58 119.82 1xyj h GLU 146 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1xyj h GLU 146 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1xyj h GLU 146 CO -0.65 0.40 -0.12 0.22 -1.00 0.00 0.00 179.01 177.85 1xyj h ASP 147 N 0.00 -0.29 -0.63 1.42 1.82 -1.59 -3.14 116.42 114.01 1xyj h ASP 147 Ca -0.00 0.01 0.12 0.00 -0.39 0.00 0.00 57.03 56.77 1xyj h ASP 147 Cb 0.83 0.08 -0.09 0.00 0.68 0.00 0.00 39.33 40.83 1xyj h ASP 147 CO 0.05 -0.07 0.15 -0.09 -1.61 0.00 0.00 179.24 177.66 1xyj h ARG 148 N -0.62 0.27 -0.99 0.28 2.43 -1.24 0.24 114.38 114.75 1xyj h ARG 148 Ca -0.04 -0.02 0.21 0.00 -0.81 0.00 0.00 59.98 59.33 1xyj h ARG 148 Cb 0.27 -0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 29.66 1xyj h ARG 148 CO 0.06 0.18 0.62 -0.92 -1.51 0.00 0.00 179.97 178.39 1xyj h TYR 149 N 0.27 0.86 0.10 2.20 5.03 -1.03 -1.25 116.97 123.15 1xyj h TYR 149 Ca 0.33 0.03 -0.34 0.00 2.58 0.00 0.00 58.73 61.33 1xyj h TYR 149 Cb 0.51 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 38.51 1xyj h TYR 149 CO -0.25 0.17 -1.85 0.66 -1.32 0.00 0.00 178.16 175.58 1xyj n TYR 150 N -4.68 1.19 -0.29 -3.82 4.02 -0.37 -4.35 117.16 108.87 1xyj n TYR 150 Ca 0.23 0.30 0.12 0.00 -0.01 0.00 0.00 57.90 58.53 1xyj n TYR 150 Cb 0.67 -1.15 0.28 0.00 -0.02 0.00 0.00 39.34 39.12 1xyj n TYR 150 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xyj h ARG 151 N -0.18 0.32 -0.22 -0.72 3.08 -0.43 0.21 114.38 116.44 1xyj h ARG 151 Ca -0.41 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 59.66 1xyj h ARG 151 Cb 1.87 -0.07 -0.07 0.00 0.08 0.00 0.00 29.97 31.78 1xyj h ARG 151 CO 0.02 0.21 -0.50 0.93 -1.07 0.00 0.00 179.97 179.55 1xyj h GLU 152 N 0.33 -0.47 -0.51 0.04 4.39 -1.44 -3.08 114.58 113.82 1xyj h GLU 152 Ca 0.53 0.03 -0.25 0.00 0.34 0.00 0.00 59.36 60.01 1xyj h GLU 152 Cb 1.00 0.11 -0.15 0.00 -0.10 0.00 0.00 28.75 29.61 1xyj h GLU 152 CO -0.56 -0.32 0.11 0.27 -1.16 0.00 0.00 179.01 177.36 1xyj n ASN 153 N -5.42 2.97 0.00 1.42 0.23 -0.58 -4.59 115.26 109.28 1xyj n ASN 153 Ca -0.04 -3.66 0.04 0.00 -0.53 0.00 0.00 54.58 50.38 1xyj n ASN 153 Cb 0.37 -0.68 0.16 0.00 -2.08 0.00 0.00 39.78 37.54 1xyj n ASN 153 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1xyj n MET 154 N -1.04 0.00 -0.02 -3.83 2.81 0.64 -3.50 117.12 112.18 1xyj n MET 154 Ca 0.39 0.37 0.12 0.00 -1.81 0.00 0.00 57.70 56.78 1xyj n MET 154 Cb 1.19 -1.50 0.62 0.00 -0.71 0.00 0.00 33.22 32.82 1xyj n MET 154 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 1xyj n TYR 155 N -1.50 0.05 -1.36 2.03 0.18 -1.26 -3.78 117.16 111.52 1xyj n TYR 155 Ca 0.02 -0.02 0.04 0.00 1.88 0.00 0.00 57.90 59.81 1xyj n TYR 155 Cb 0.09 0.00 0.20 0.00 -0.38 0.00 0.00 39.34 39.25 1xyj n TYR 155 CO 0.00 0.00 0.00 2.89 -2.08 0.00 0.00 176.86 177.67 1xyj n ARG 156 N -0.39 1.79 -1.82 -3.48 -4.01 -1.23 -5.05 116.66 102.47 1xyj n ARG 156 Ca 0.18 -3.05 -0.30 0.00 -1.04 0.00 0.00 57.85 53.64 1xyj n ARG 156 Cb 0.20 -1.69 0.07 0.00 -3.04 0.00 0.00 32.46 28.00 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 -3.11 3.10 0.96 2.89 1.51 -1.25 -5.05 117.35 116.40 1xyj s TYR 157 Ca 0.39 0.97 -0.12 0.00 -1.01 0.00 0.00 57.07 57.30 1xyj s TYR 157 Cb 0.36 -3.22 0.17 0.00 -0.11 0.00 0.00 41.96 39.16 1xyj s TYR 157 CO -0.01 -1.51 1.09 -1.25 -1.11 0.00 0.00 175.55 172.76 1xyj s PRO 158 N -5.39 0.70 0.18 -1.71 0.04 -1.26 -4.89 135.00 122.68 1xyj s PRO 158 Ca 0.60 0.77 0.21 0.00 0.04 0.00 0.00 61.00 62.62 1xyj s PRO 158 Cb -0.12 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 1xyj s PRO 158 CO 0.51 -2.61 1.03 -0.91 0.04 0.00 0.00 177.00 175.06 1xyj h ASN 159 N -1.81 0.00 -5.66 6.66 4.21 -1.97 -3.38 115.58 113.62 1xyj h ASN 159 Ca -0.52 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 56.66 1xyj h ASN 159 Cb 1.30 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 38.39 1xyj h ASN 159 CO 0.54 0.15 -0.38 -1.10 -1.29 0.00 0.00 177.43 175.35 1xyj s GLN 160 N -3.24 1.69 0.01 0.81 -0.21 -1.19 -0.42 119.66 117.11 1xyj s GLN 160 Ca -0.01 -1.80 -0.05 0.00 0.02 0.00 0.00 55.36 53.53 1xyj s GLN 160 Cb 0.09 0.37 -0.01 0.00 1.00 0.00 0.00 33.01 34.46 1xyj s GLN 160 CO 0.79 -0.65 0.09 0.14 -2.12 0.00 0.00 175.29 173.54 1xyj s VAL 161 N -3.49 0.10 0.27 1.09 -7.23 -1.26 -4.91 120.40 104.97 1xyj s VAL 161 Ca 0.36 -0.81 0.02 0.00 -1.81 0.00 0.00 61.98 59.74 1xyj s VAL 161 Cb 0.02 -0.45 -0.03 0.00 0.56 0.00 0.00 36.38 36.48 1xyj s VAL 161 CO 0.21 -0.45 0.43 -0.31 -0.31 0.00 0.00 175.10 174.68 1xyj s TYR 162 N -1.58 3.48 -0.02 2.82 2.02 -1.26 -0.68 117.35 122.12 1xyj s TYR 162 Ca -0.14 0.18 -0.14 0.00 -0.37 0.00 0.00 57.07 56.60 1xyj s TYR 162 Cb -0.07 -1.74 0.05 0.00 -0.40 0.00 0.00 41.96 39.79 1xyj s TYR 162 CO 0.00 0.31 0.63 2.48 -1.57 0.00 0.00 175.55 177.40 1xyj n TYR 163 N -1.41 -0.19 -4.44 2.71 4.11 0.47 -4.61 117.16 113.79 1xyj n TYR 163 Ca -0.07 -0.31 -0.30 0.00 -0.00 0.00 0.00 57.90 57.22 1xyj n TYR 163 Cb 0.56 0.14 -0.12 0.00 -0.00 0.00 0.00 39.34 39.92 1xyj n TYR 163 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 1xyj s ARG 164 N -2.00 1.94 0.30 -3.48 0.52 -1.26 -0.93 118.95 114.03 1xyj s ARG 164 Ca 0.15 -1.08 -0.30 0.00 -0.52 0.00 0.00 55.73 53.98 1xyj s ARG 164 Cb -0.00 -2.16 -0.11 0.00 0.52 0.00 0.00 34.95 33.19 1xyj s ARG 164 CO -0.01 0.51 1.55 -1.25 0.02 0.00 0.00 175.30 176.13 1xyj s PRO 165 N -1.85 4.14 -0.33 3.54 0.04 -1.26 -4.92 135.00 134.37 1xyj s PRO 165 Ca 0.17 2.53 -0.29 0.00 0.04 0.00 0.00 61.00 63.45 1xyj s PRO 165 Cb -0.11 -3.03 -0.00 0.00 0.04 0.00 0.00 34.50 31.40 1xyj s PRO 165 CO 0.08 -0.58 1.48 0.08 0.04 0.00 0.00 177.00 178.11 1xyj s VAL 166 N -0.18 3.86 0.00 -0.36 1.01 -1.26 -4.71 120.40 118.75 1xyj s VAL 166 Ca 0.61 0.92 0.00 0.00 0.00 0.00 0.00 61.98 63.51 1xyj s VAL 166 Cb -0.47 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 31.91 1xyj s VAL 166 CO 0.50 -0.53 0.00 -0.67 0.00 0.00 0.00 175.10 174.39 1xyj n ASP 167 N 8.64 0.00 -0.81 3.32 2.03 -1.26 -4.96 116.55 123.51 1xyj n ASP 167 Ca 0.17 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.46 1xyj n ASP 167 Cb 0.47 0.25 -0.03 0.00 -0.72 0.00 0.00 41.12 41.09 1xyj n ASP 167 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xyj n GLN 168 N -2.31 0.00 -0.52 -0.67 10.64 -1.26 -5.11 117.38 118.14 1xyj n GLN 168 Ca 0.00 -0.69 0.00 0.00 -1.83 0.00 0.00 57.00 54.48 1xyj n GLN 168 Cb 0.00 0.19 0.00 0.00 -0.86 0.00 0.00 30.24 29.57 1xyj n GLN 168 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1xyj n TYR 169 N 0.04 0.00 -1.04 2.61 4.01 -1.26 -5.14 117.16 116.37 1xyj n TYR 169 Ca -0.12 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.76 1xyj n TYR 169 Cb 0.66 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.65 1xyj n TYR 169 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1xyj n SER 170 N -0.68 -6.21 0.00 7.72 7.64 -1.26 -5.05 113.62 115.79 1xyj n SER 170 Ca 0.00 0.46 0.00 0.00 1.01 0.00 0.00 58.87 60.34 1xyj n SER 170 Cb 0.00 -3.19 0.00 0.00 -1.01 0.00 0.00 64.21 60.01 1xyj n SER 170 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1xyj n ASN 171 N -3.41 0.00 0.09 6.43 5.15 -1.26 -4.92 115.26 117.33 1xyj n ASN 171 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1xyj n ASN 171 Cb 0.48 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 1xyj n ASN 171 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 1xyj n GLN 172 N 0.00 0.00 0.38 1.20 7.27 -1.26 -4.82 117.38 120.15 1xyj n GLN 172 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 57.00 56.92 1xyj n GLN 172 Cb 0.00 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 32.58 1xyj n GLN 172 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 1xyj h ASN 173 N 0.00 -0.89 -0.50 1.69 4.21 -2.00 0.17 115.58 118.26 1xyj h ASN 173 Ca 0.00 0.04 0.02 0.00 1.21 0.00 0.00 56.30 57.57 1xyj h ASN 173 Cb 0.00 0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 37.40 1xyj h ASN 173 CO 0.00 -0.61 0.30 0.78 -1.29 0.00 0.00 177.43 176.61 1xyj h ASN 174 N -1.00 0.48 0.06 5.81 4.21 -1.95 -3.10 115.58 120.10 1xyj h ASN 174 Ca -0.10 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.44 1xyj h ASN 174 Cb 0.77 -0.10 -0.03 0.00 -1.12 0.00 0.00 38.32 37.84 1xyj h ASN 174 CO 0.15 0.34 -0.22 0.15 -1.29 0.00 0.00 177.43 176.56 1xyj h PHE 175 N 0.59 -0.59 -0.81 1.19 3.57 -1.85 -2.17 116.94 116.87 1xyj h PHE 175 Ca 0.20 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.77 1xyj h PHE 175 Cb 0.02 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 1xyj h PHE 175 CO -0.07 -0.31 0.50 -0.24 -2.23 0.00 0.00 178.31 175.96 1xyj h VAL 176 N -0.39 1.04 0.00 1.41 3.04 -0.57 0.92 116.25 121.71 1xyj h VAL 176 Ca 0.04 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 1xyj h VAL 176 Cb 0.43 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.76 1xyj h VAL 176 CO -0.16 0.17 0.00 1.57 -1.01 0.00 0.00 177.57 178.14 1xyj n HIS 177 N -4.65 0.18 -2.79 3.17 -0.00 -1.14 -0.63 115.22 109.36 1xyj n HIS 177 Ca 0.11 0.05 -0.24 0.00 -0.00 0.00 0.00 57.72 57.64 1xyj n HIS 177 Cb 0.16 -0.58 -0.02 0.00 -0.00 0.00 0.00 29.99 29.55 1xyj n HIS 177 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 1xyj n ASP 178 N -1.65 3.73 0.20 0.26 2.03 -0.29 -4.33 116.55 116.50 1xyj n ASP 178 Ca 0.07 -3.50 0.00 0.00 0.52 0.00 0.00 54.79 51.88 1xyj n ASP 178 Cb 0.36 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 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 1.27 -0.46 0.00 2.07 -1.07 -2.87 116.25 115.20 1xyj h VAL 180 Ca 0.00 -0.96 0.09 0.00 0.82 0.00 0.00 66.70 66.65 1xyj h VAL 180 Cb 0.00 1.51 -0.10 0.00 -1.52 0.00 0.00 31.29 31.19 1xyj h VAL 180 CO 0.00 0.29 -0.21 -1.13 0.02 0.00 0.00 177.57 176.54 1xyj h ASN 181 N 0.10 -0.73 -0.24 0.57 -0.00 -1.68 0.28 115.58 113.88 1xyj h ASN 181 Ca 0.05 0.17 0.02 0.00 -0.00 0.00 0.00 56.30 56.55 1xyj h ASN 181 Cb 0.45 0.40 -0.02 0.00 -0.00 0.00 0.00 38.32 39.14 1xyj h ASN 181 CO 0.02 -0.24 0.09 0.40 -0.00 0.00 0.00 177.43 177.69 1xyj h ILE 182 N -0.12 0.95 -0.24 2.57 1.08 -1.80 0.11 117.51 120.06 1xyj h ILE 182 Ca 0.22 -0.07 -0.10 0.00 -0.39 0.00 0.00 64.86 64.52 1xyj h ILE 182 Cb 0.45 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 1xyj h ILE 182 CO -0.53 0.04 -0.26 0.74 -0.69 0.00 0.00 178.15 177.44 1xyj h THR 183 N 0.20 1.27 -0.14 -0.27 2.02 -1.03 -1.62 112.91 113.35 1xyj h THR 183 Ca 0.10 -1.28 -0.17 0.00 0.77 0.00 0.00 66.41 65.83 1xyj h THR 183 Cb 0.07 1.38 0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1xyj h THR 183 CO -0.10 0.41 -0.58 0.58 0.37 0.00 0.00 175.52 176.19 1xyj h VAL 184 N 0.41 1.33 -0.31 3.16 2.07 -0.16 -2.96 116.25 119.79 1xyj h VAL 184 Ca 0.06 -1.85 0.07 0.00 0.82 0.00 0.00 66.70 65.80 1xyj h VAL 184 Cb 0.68 2.07 -0.08 0.00 -1.52 0.00 0.00 31.29 32.44 1xyj h VAL 184 CO 0.05 0.57 -0.25 0.03 0.02 0.00 0.00 177.57 177.99 1xyj h ARG 185 N 0.29 -0.21 0.00 1.57 3.08 -0.61 0.02 114.38 118.52 1xyj h ARG 185 Ca -0.03 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1xyj h ARG 185 Cb 1.22 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1xyj h ARG 185 CO 0.12 -0.14 0.00 1.04 -1.07 0.00 0.00 179.97 179.92 1xyj n GLN 186 N -5.39 0.06 0.00 0.04 1.13 -0.63 -1.83 117.38 110.78 1xyj n GLN 186 Ca 0.00 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.31 1xyj n GLN 186 Cb 0.30 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.15 1xyj n GLN 186 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1xyj n HIS 187 N -1.29 0.00 -0.08 1.08 -0.00 -0.31 -4.74 115.22 109.88 1xyj n HIS 187 Ca 0.02 -0.06 -0.13 0.00 0.46 0.00 0.00 57.72 58.01 1xyj n HIS 187 Cb 0.04 -0.01 -0.07 0.00 -0.12 0.00 0.00 29.99 29.83 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 -0.06 0.91 -0.18 3.57 5.66 -0.16 -4.49 114.28 119.53 1xyj n THR 188 Ca 0.00 -0.31 0.12 0.00 -3.05 0.00 0.00 64.05 60.80 1xyj n THR 188 Cb 0.09 -1.24 0.44 0.00 -1.55 0.00 0.00 70.33 68.07 1xyj n THR 188 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 1xyj h VAL 189 N -0.16 0.88 -0.83 1.08 2.07 -1.63 0.42 116.25 118.07 1xyj h VAL 189 Ca -0.37 -0.19 0.13 0.00 0.82 0.00 0.00 66.70 67.09 1xyj h VAL 189 Cb 1.50 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 31.48 1xyj h VAL 189 CO -0.11 0.10 0.54 0.00 0.02 0.00 0.00 177.57 178.12 1xyj h THR 190 N 0.56 0.85 0.04 2.57 1.03 -1.80 -1.72 112.91 114.43 1xyj h THR 190 Ca 0.35 -0.22 -0.36 0.00 -0.01 0.00 0.00 66.41 66.18 1xyj h THR 190 Cb 0.61 0.17 -0.05 0.00 -1.07 0.00 0.00 68.15 67.81 1xyj h THR 190 CO -0.13 0.11 -2.19 0.41 -0.01 0.00 0.00 175.52 173.72 1xyj n THR 191 N -4.53 1.57 -0.03 0.00 -1.04 -0.02 -4.24 114.28 106.00 1xyj n THR 191 Ca 0.16 -0.70 -0.11 0.00 -2.04 0.00 0.00 64.05 61.36 1xyj n THR 191 Cb 0.45 -1.24 0.03 0.00 -1.82 0.00 0.00 70.33 67.75 1xyj n THR 191 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1xyj h THR 192 N 0.02 1.30 0.00 12.58 1.35 -0.81 0.17 112.91 127.53 1xyj h THR 192 Ca -0.48 -1.75 -0.00 0.00 -0.55 0.00 0.00 66.41 63.64 1xyj h THR 192 Cb 2.03 1.69 -0.00 0.00 -1.73 0.00 0.00 68.15 70.14 1xyj h THR 192 CO 0.02 0.55 -0.01 0.00 -0.25 0.00 0.00 175.52 175.83 1xyj h THR 193 N 0.52 0.38 -0.01 6.82 1.03 -1.55 0.88 112.91 120.98 1xyj h THR 193 Ca 0.02 -0.03 0.00 0.00 -0.01 0.00 0.00 66.41 66.38 1xyj h THR 193 Cb 1.09 1.02 0.00 0.00 -1.07 0.00 0.00 68.15 69.19 1xyj h THR 193 CO 0.11 0.01 -0.08 0.29 -0.01 0.00 0.00 175.52 175.83 1xyj n LYS 194 N -3.62 1.14 -0.32 0.00 4.76 0.00 -4.97 118.16 115.15 1xyj n LYS 194 Ca -0.03 -0.54 0.00 0.00 -2.87 0.00 0.00 58.31 54.88 1xyj n LYS 194 Cb 0.09 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 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 1.21 0.11 3.77 0.72 0.00 0.30 -5.10 105.19 106.21 1xyj n GLY 195 Ca 0.17 -0.56 -0.03 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.75 1.24 -0.44 1.61 2.56 -1.23 -4.95 118.70 116.73 1xyj s GLU 196 Ca 0.00 -0.71 0.07 0.00 0.00 0.00 0.00 54.97 54.34 1xyj s GLU 196 Cb 0.00 0.41 0.28 0.00 2.00 0.00 0.00 34.13 36.82 1xyj s GLU 196 CO 0.00 -0.57 0.85 -1.71 -0.56 0.00 0.00 175.26 173.27 1xyj n ASN 197 N -0.59 -1.56 -1.60 -1.70 5.15 -1.26 -4.32 115.26 109.37 1xyj n ASN 197 Ca -0.06 -3.24 -0.09 0.00 -0.60 0.00 0.00 54.58 50.60 1xyj n ASN 197 Cb 0.60 0.98 0.01 0.00 -0.53 0.00 0.00 39.78 40.84 1xyj n ASN 197 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1xyj n PHE 198 N 1.06 -0.57 -0.71 1.20 3.72 -1.26 -4.81 117.46 116.09 1xyj n PHE 198 Ca 0.13 0.24 -0.30 0.00 -0.05 0.00 0.00 57.45 57.47 1xyj n PHE 198 Cb 0.63 -0.44 0.19 0.00 -0.94 0.00 0.00 39.48 38.92 1xyj n PHE 198 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1xyj s THR 199 N -0.38 2.15 0.30 4.37 2.01 -1.26 -4.11 115.64 118.72 1xyj s THR 199 Ca 0.08 0.05 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1xyj s THR 199 Cb -0.01 -2.13 0.29 0.00 0.01 0.00 0.00 72.50 70.66 1xyj s THR 199 CO 0.19 -0.06 1.85 -0.08 -0.69 0.00 0.00 174.62 175.83 1xyj h GLU 200 N -2.04 0.93 -0.44 4.92 4.81 -1.98 0.23 114.58 121.01 1xyj h GLU 200 Ca -0.49 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 58.63 1xyj h GLU 200 Cb 1.29 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 1xyj h GLU 200 CO 0.45 0.62 0.07 1.15 -0.73 0.00 0.00 179.01 180.57 1xyj h THR 201 N 0.96 1.24 -0.08 0.32 2.02 -1.99 0.79 112.91 116.18 1xyj h THR 201 Ca 0.47 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 1xyj h THR 201 Cb 0.48 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1xyj h THR 201 CO -0.24 0.31 0.04 -0.78 0.37 0.00 0.00 175.52 175.22 1xyj h ASP 202 N 0.59 0.10 -0.03 4.18 1.82 -1.01 -1.27 116.42 120.80 1xyj h ASP 202 Ca 0.13 -0.13 0.02 0.00 -0.39 0.00 0.00 57.03 56.66 1xyj h ASP 202 Cb 0.38 -0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.34 1xyj h ASP 202 CO 0.01 0.21 -0.06 -0.03 -1.61 0.00 0.00 179.24 177.75 1xyj h MET 203 N -0.01 -0.10 0.08 0.28 4.05 -0.66 -0.17 114.93 118.41 1xyj h MET 203 Ca 0.03 0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.47 1xyj h MET 203 Cb 0.13 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.93 1xyj h MET 203 CO -0.00 -0.06 -0.20 -0.22 0.23 0.00 0.00 176.91 176.65 1xyj h LYS 204 N -0.10 -0.36 -0.36 0.39 3.64 -0.73 0.47 116.57 119.52 1xyj h LYS 204 Ca 0.04 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.49 1xyj h LYS 204 Cb 0.15 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 1xyj h LYS 204 CO -0.09 -0.24 0.11 0.82 -2.27 0.00 0.00 179.45 177.78 1xyj h ILE 205 N -0.37 0.87 -0.22 2.00 2.04 -1.07 0.89 117.51 121.65 1xyj h ILE 205 Ca 0.03 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 65.85 1xyj h ILE 205 Cb 0.40 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1xyj h ILE 205 CO -0.13 0.05 -0.03 -0.03 0.00 0.00 0.00 178.15 178.00 1xyj h MET 206 N 0.25 0.03 0.13 2.37 4.05 -0.32 0.18 114.93 121.62 1xyj h MET 206 Ca 0.17 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.58 1xyj h MET 206 Cb 0.16 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 1xyj h MET 206 CO -0.19 0.02 -0.06 0.93 0.23 0.00 0.00 176.91 177.84 1xyj h GLU 207 N 0.03 -0.17 -0.40 0.39 5.08 -0.70 -0.94 114.58 117.87 1xyj h GLU 207 Ca 0.10 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1xyj h GLU 207 Cb 0.15 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1xyj h GLU 207 CO -0.20 0.03 0.26 -0.09 -1.00 0.00 0.00 179.01 178.01 1xyj h ARG 208 N -0.36 0.52 0.14 2.33 1.12 -0.52 0.21 114.38 117.82 1xyj h ARG 208 Ca -0.02 -0.03 -0.35 0.00 -1.11 0.00 0.00 59.98 58.47 1xyj h ARG 208 Cb 0.29 -0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 30.13 1xyj h ARG 208 CO 0.03 0.35 -1.84 -0.24 -3.11 0.00 0.00 179.97 175.16 1xyj h VAL 209 N 0.54 0.78 0.00 0.20 3.04 -0.64 -3.29 116.25 116.88 1xyj h VAL 209 Ca 0.15 -2.40 -0.03 0.00 -1.01 0.00 0.00 66.70 63.40 1xyj h VAL 209 Cb -0.06 2.61 -0.00 0.00 -2.01 0.00 0.00 31.29 31.82 1xyj h VAL 209 CO -0.03 0.85 -0.15 0.58 -1.01 0.00 0.00 177.57 177.81 1xyj h VAL 210 N 0.02 0.75 0.08 1.51 2.07 -0.95 -2.05 116.25 117.67 1xyj h VAL 210 Ca -0.38 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 66.56 1xyj h VAL 210 Cb 2.01 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 33.10 1xyj h VAL 210 CO 0.11 0.15 -0.40 -0.33 0.02 0.00 0.00 177.57 177.12 1xyj h GLU 211 N 0.00 -0.53 -0.44 1.57 5.08 -0.66 0.19 114.58 119.79 1xyj h GLU 211 Ca -0.00 0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1xyj h GLU 211 Cb 0.34 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1xyj h GLU 211 CO 0.02 -0.35 0.29 1.96 -1.00 0.00 0.00 179.01 179.93 1xyj h GLN 212 N -0.55 0.52 0.00 2.33 1.08 -1.44 0.34 115.11 117.40 1xyj h GLN 212 Ca -0.00 -0.03 -0.22 0.00 -1.45 0.00 0.00 58.65 56.95 1xyj h GLN 212 Cb 0.56 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.84 1xyj h GLN 212 CO -0.22 0.35 -1.07 0.00 -0.95 0.00 0.00 178.83 176.93 1xyj h MET 213 N 0.54 0.00 -0.01 1.46 -0.00 -1.49 -3.12 114.93 112.32 1xyj h MET 213 Ca 0.17 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.86 1xyj h MET 213 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.62 1xyj h MET 213 CO -0.04 0.95 -0.20 0.00 -0.00 0.00 0.00 176.91 177.63 1xyj n VAL 215 N -0.69 1.44 -0.12 0.00 3.14 0.10 -4.26 118.33 117.93 1xyj n VAL 215 Ca 0.13 -0.70 -0.04 0.00 -2.96 0.00 0.00 64.34 60.77 1xyj n VAL 215 Cb 0.33 -0.98 0.16 0.00 -1.06 0.00 0.00 33.84 32.29 1xyj n VAL 215 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1xyj h THR 216 N 0.00 1.24 -0.87 1.55 1.03 -1.65 -0.27 112.91 113.94 1xyj h THR 216 Ca -0.56 -0.96 0.05 0.00 -0.01 0.00 0.00 66.41 64.93 1xyj h THR 216 Cb 2.05 0.81 -0.06 0.00 -1.07 0.00 0.00 68.15 69.89 1xyj h THR 216 CO -0.03 0.35 0.55 0.06 -0.01 0.00 0.00 175.52 176.43 1xyj h GLN 217 N 0.78 1.00 0.00 0.00 -0.00 -1.77 0.17 115.11 115.28 1xyj h GLN 217 Ca 0.16 -0.06 -0.09 0.00 -0.00 0.00 0.00 58.65 58.66 1xyj h GLN 217 Cb 0.41 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.48 27.66 1xyj h GLN 217 CO 0.01 0.66 -0.42 -0.92 -0.00 0.00 0.00 178.83 178.17 1xyj h TYR 218 N 1.03 0.00 0.00 0.06 3.20 -1.27 0.16 116.97 120.15 1xyj h TYR 218 Ca 0.37 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.24 1xyj h TYR 218 Cb 0.10 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1xyj h TYR 218 CO -0.03 0.42 0.00 1.04 -1.64 0.00 0.00 178.16 177.95 1xyj n GLN 219 N -3.43 0.00 0.24 1.82 6.02 -0.59 -3.61 117.38 117.83 1xyj n GLN 219 Ca 0.00 0.31 0.16 0.00 -0.01 0.00 0.00 57.00 57.46 1xyj n GLN 219 Cb 0.58 -1.02 0.59 0.00 1.02 0.00 0.00 30.24 31.41 1xyj n GLN 219 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 1xyj h LYS 220 N 0.00 0.00 0.09 -1.09 2.10 -0.39 0.23 116.57 117.51 1xyj h LYS 220 Ca 0.00 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.40 1xyj h LYS 220 Cb 0.00 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.32 1xyj h LYS 220 CO 0.00 0.00 -1.29 1.49 -2.00 0.00 0.00 179.45 177.65 1xyj h GLU 221 N 0.00 0.18 -0.65 0.07 4.81 -0.89 -3.23 114.58 114.88 1xyj h GLU 221 Ca 0.00 -0.32 -0.09 0.00 -0.13 0.00 0.00 59.36 58.82 1xyj h GLU 221 Cb 0.55 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 1xyj h GLU 221 CO 0.00 1.15 0.05 1.03 -0.73 0.00 0.00 179.01 180.51 1xyj h SER 222 N -0.46 1.07 0.41 1.04 0.87 -1.46 -1.87 113.55 113.14 1xyj h SER 222 Ca -0.29 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 59.96 1xyj h SER 222 Cb 1.63 -0.29 -0.00 0.00 -0.44 0.00 0.00 62.40 63.30 1xyj h SER 222 CO 0.01 1.09 -0.12 -0.33 -0.53 0.00 0.00 176.83 176.95 1xyj h GLU 223 N 1.02 0.00 0.26 2.24 5.08 -0.74 0.30 114.58 122.74 1xyj h GLU 223 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1xyj h GLU 223 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1xyj h GLU 223 CO 0.02 0.12 -0.12 0.00 -1.00 0.00 0.00 179.01 178.03 1xyj h ALA 224 N 1.88 -0.87 0.00 3.43 0.00 -1.40 -3.30 119.26 119.01 1xyj h ALA 224 Ca -0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xyj h ALA 224 Cb 0.35 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1xyj h ALA 224 CO 0.02 -0.84 -0.02 -0.92 0.00 0.00 0.00 179.25 177.48 1xyj h TYR 225 N -0.42 0.00 -0.43 0.00 3.20 -0.56 0.27 116.97 119.02 1xyj h TYR 225 Ca -0.04 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.76 1xyj h TYR 225 Cb 0.27 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 1xyj h TYR 225 CO 0.12 0.02 -0.05 1.88 -1.64 0.00 0.00 178.16 178.48 1xyj h TYR 226 N 0.00 0.79 0.00 -3.82 0.05 -0.58 -3.41 116.97 110.00 1xyj h TYR 226 Ca -0.00 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.66 1xyj h TYR 226 Cb 0.09 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 37.61 1xyj h TYR 226 CO 0.00 0.77 0.00 1.04 -1.05 0.00 0.00 178.16 178.92 1xyj n GLN 227 N -4.20 0.00 -0.76 4.88 6.02 -0.14 -4.89 117.38 118.29 1xyj n GLN 227 Ca 0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.87 1xyj n GLN 227 Cb 0.32 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.49 1xyj n GLN 227 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1xyj n ARG 228 N -1.97 1.72 -2.48 -1.09 1.74 0.75 -4.86 116.66 110.48 1xyj n ARG 228 Ca 0.00 -0.96 -0.39 0.00 -0.77 0.00 0.00 57.85 55.73 1xyj n ARG 228 Cb 0.00 -2.04 -0.03 0.00 -1.02 0.00 0.00 32.46 29.37 1xyj n ARG 228 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1xyj s ARG 229 N 1.96 3.42 0.44 5.56 3.52 -1.09 -4.21 118.95 128.54 1xyj s ARG 229 Ca 0.48 -0.94 0.21 0.00 -0.13 0.00 0.00 55.73 55.34 1xyj s ARG 229 Cb 0.20 -5.25 1.02 0.00 -1.56 0.00 0.00 34.95 29.36 1xyj s ARG 229 CO -0.01 -2.37 1.90 0.00 -0.81 0.00 0.00 175.30 174.01 1xyj h ALA 230 N 10.07 1.23 0.00 6.12 0.00 -1.89 -3.50 119.26 131.29 1xyj h ALA 230 Ca 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xyj h ALA 230 Cb 1.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1xyj h ALA 230 CO 1.39 0.32 0.00 0.43 0.00 0.00 0.00 179.25 181.39