#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 0.08 -2.11 3.34 0.11 -1.26 -5.03 120.40 115.53 1xyj s VAL 122 Ca 0.00 -0.65 0.30 0.00 -2.93 0.00 0.00 61.98 58.70 1xyj s VAL 122 Cb 0.00 -0.27 0.66 0.00 -1.53 0.00 0.00 36.38 35.24 1xyj s VAL 122 CO 0.00 -0.35 1.95 0.61 -3.33 0.00 0.00 175.10 173.97 1xyj n GLY 123 N 1.88 -0.60 1.05 6.54 0.00 -1.26 -4.98 105.19 107.83 1xyj n GLY 123 Ca -0.21 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 1.14 -2.02 1.05 -0.02 0.00 -1.26 -5.01 105.19 99.07 1xyj n GLY 124 Ca 0.20 -0.44 0.08 0.00 0.00 0.00 0.00 46.02 45.86 1xyj n GLY 124 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1xyj n LEU 125 N 0.00 3.86 0.00 0.99 -0.00 -1.26 -4.76 117.00 115.83 1xyj n LEU 125 Ca 0.00 -2.44 0.01 0.00 -0.00 0.00 0.00 56.01 53.59 1xyj n LEU 125 Cb 0.00 -0.44 0.09 0.00 -0.00 0.00 0.00 43.42 43.06 1xyj n LEU 125 CO 0.00 0.75 0.25 0.61 -0.00 0.00 0.00 177.39 179.00 1xyj n GLY 126 N 0.47 -0.17 0.00 1.47 0.00 -1.26 -1.11 105.19 104.59 1xyj n GLY 126 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.52 -0.74 3.76 -0.02 0.00 -1.26 -5.07 105.19 101.35 1xyj n GLY 127 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.10 3.00 0.45 1.61 2.02 -0.27 -5.02 117.35 119.04 1xyj s TYR 128 Ca 0.00 1.26 -0.20 0.00 -0.37 0.00 0.00 57.07 57.76 1xyj s TYR 128 Cb 0.00 -3.76 -0.10 0.00 -0.40 0.00 0.00 41.96 37.70 1xyj s TYR 128 CO 0.00 -2.23 0.97 -1.64 -1.57 0.00 0.00 175.55 171.08 1xyj s MET 129 N -1.31 4.12 -0.04 -0.62 -1.94 -0.81 -4.92 119.30 113.78 1xyj s MET 129 Ca 0.53 1.13 -0.07 0.00 -1.71 0.00 0.00 55.69 55.57 1xyj s MET 129 Cb -0.41 -2.16 0.01 0.00 2.01 0.00 0.00 34.83 34.28 1xyj s MET 129 CO 0.50 -0.12 0.16 -0.48 -0.01 0.00 0.00 175.02 175.07 1xyj s LEU 130 N -3.36 1.41 0.24 -0.03 -0.00 -1.26 -0.55 118.68 115.13 1xyj s LEU 130 Ca 0.62 0.14 -0.19 0.00 -0.00 0.00 0.00 54.13 54.70 1xyj s LEU 130 Cb -0.10 0.64 -0.08 0.00 -0.00 0.00 0.00 46.19 46.65 1xyj s LEU 130 CO 0.17 -0.19 0.73 -0.83 -0.00 0.00 0.00 176.35 176.23 1xyj s GLY 131 N -0.49 2.57 0.25 -3.48 0.00 -0.51 -4.97 107.32 100.70 1xyj s GLY 131 Ca -0.06 0.15 -0.30 0.00 0.00 0.00 0.00 44.72 44.51 1xyj s GLY 131 CO 0.01 0.48 1.40 -1.35 0.00 0.00 0.00 173.10 173.63 1xyj s SER 132 N -1.76 6.71 -0.16 1.64 1.04 -1.26 -4.16 113.70 115.74 1xyj s SER 132 Ca 0.45 2.63 -0.01 0.00 0.48 0.00 0.00 55.95 59.50 1xyj s SER 132 Cb -0.16 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.34 1xyj s SER 132 CO 0.20 -0.65 0.11 0.00 0.98 0.00 0.00 173.24 173.88 1xyj n ALA 133 N 2.12 -1.32 -3.47 5.32 0.00 -1.26 -4.92 120.51 116.98 1xyj n ALA 133 Ca 0.06 -0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1xyj n ALA 133 Cb 0.41 -0.19 -0.16 0.00 0.00 0.00 0.00 19.45 19.51 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 -3.12 0.52 0.00 0.00 0.23 -1.21 -5.03 119.30 110.69 1xyj s MET 134 Ca 0.02 -0.05 -0.00 0.00 -1.03 0.00 0.00 55.69 54.63 1xyj s MET 134 Cb -0.01 -0.59 0.00 0.00 -1.53 0.00 0.00 34.83 32.70 1xyj s MET 134 CO 0.16 -0.06 0.00 0.45 -2.03 0.00 0.00 175.02 173.55 1xyj n SER 135 N 3.82 -0.01 -3.72 -1.18 2.88 -1.26 -3.74 113.62 110.42 1xyj n SER 135 Ca -0.23 -1.00 -0.25 0.00 -1.33 0.00 0.00 58.87 56.05 1xyj n SER 135 Cb 0.52 0.01 0.03 0.00 -0.75 0.00 0.00 64.21 64.02 1xyj n SER 135 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1xyj n ARG 136 N -0.00 -3.12 0.20 -1.46 1.74 -1.26 -4.88 116.66 107.88 1xyj n ARG 136 Ca -0.00 0.53 0.14 0.00 -0.77 0.00 0.00 57.85 57.76 1xyj n ARG 136 Cb 0.00 -4.72 0.53 0.00 -1.02 0.00 0.00 32.46 27.25 1xyj n ARG 136 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xyj h PRO 137 N -1.81 0.00 -3.88 5.56 0.13 -1.95 -3.49 132.00 126.56 1xyj h PRO 137 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1xyj h PRO 137 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1xyj h PRO 137 CO 0.54 0.00 -0.91 -0.11 -0.23 0.00 0.00 178.00 177.29 1xyj n LEU 138 N -2.71 -5.75 -4.25 1.56 -0.00 -1.26 -5.00 117.00 99.59 1xyj n LEU 138 Ca 0.02 3.10 -0.18 0.00 -0.00 0.00 0.00 56.01 58.95 1xyj n LEU 138 Cb 0.32 -2.95 -0.11 0.00 -0.00 0.00 0.00 43.42 40.68 1xyj n LEU 138 CO 0.26 -0.48 -0.45 -0.63 -0.00 0.00 0.00 177.39 176.08 1xyj s ILE 139 N -2.14 1.39 0.32 1.96 1.01 -1.26 -5.05 121.20 117.43 1xyj s ILE 139 Ca 0.00 -1.74 0.09 0.00 0.00 0.00 0.00 60.65 59.00 1xyj s ILE 139 Cb 0.00 -1.57 0.31 0.00 0.01 0.00 0.00 42.46 41.21 1xyj s ILE 139 CO 0.00 -0.41 1.72 1.12 0.00 0.00 0.00 174.94 177.37 1xyj h HIS 140 N 3.48 0.98 -6.70 3.97 2.07 -2.03 -3.45 115.15 113.46 1xyj h HIS 140 Ca -0.40 0.04 -0.31 0.00 -2.85 0.00 0.00 60.37 56.84 1xyj h HIS 140 Cb 1.20 -0.28 -0.05 0.00 2.57 0.00 0.00 27.41 30.85 1xyj h HIS 140 CO 0.65 0.04 -0.51 1.19 -3.07 0.00 0.00 177.93 176.23 1xyj n PHE 141 N -4.91 -0.67 0.38 6.12 3.01 -1.26 -4.79 117.46 115.34 1xyj n PHE 141 Ca 0.27 0.15 0.08 0.00 1.01 0.00 0.00 57.45 58.95 1xyj n PHE 141 Cb 0.75 -1.41 0.33 0.00 -0.01 0.00 0.00 39.48 39.15 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 -1.66 -0.99 3.34 1.37 0.00 -1.26 -4.44 105.19 101.55 1xyj n GLY 142 Ca -0.11 0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1xyj n GLY 142 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xyj n ASN 143 N -1.73 5.02 -0.21 1.61 6.94 -1.26 -4.89 115.26 120.73 1xyj n ASN 143 Ca 0.02 -2.97 0.27 0.00 -0.02 0.00 0.00 54.58 51.88 1xyj n ASN 143 Cb 0.15 -1.61 0.67 0.00 -2.36 0.00 0.00 39.78 36.63 1xyj n ASN 143 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 1xyj h ASP 144 N 6.93 0.11 0.30 0.53 3.32 -1.97 0.77 116.42 126.39 1xyj h ASP 144 Ca 0.39 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 1xyj h ASP 144 Cb 0.81 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1xyj h ASP 144 CO 1.42 0.04 -0.14 0.22 -1.72 0.00 0.00 179.24 179.05 1xyj h TYR 145 N 0.10 -0.37 -0.54 4.55 3.20 -1.95 -1.97 116.97 119.99 1xyj h TYR 145 Ca 0.46 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.36 1xyj h TYR 145 Cb 1.63 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.98 1xyj h TYR 145 CO -0.00 -0.23 0.28 0.93 -1.64 0.00 0.00 178.16 177.50 1xyj h GLU 146 N -1.05 0.52 0.00 1.82 5.08 -1.86 -2.86 114.58 116.22 1xyj h GLU 146 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xyj h GLU 146 Cb 0.30 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1xyj h GLU 146 CO 0.07 0.34 0.00 -3.47 -1.00 0.00 0.00 179.01 174.95 1xyj n ASP 147 N -4.87 0.00 -0.31 1.42 2.03 0.22 -3.26 116.55 111.78 1xyj n ASP 147 Ca 0.05 0.87 0.03 0.00 0.52 0.00 0.00 54.79 56.26 1xyj n ASP 147 Cb 0.14 -0.37 0.22 0.00 -0.72 0.00 0.00 41.12 40.40 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 1.04 -0.98 -0.67 2.47 -1.30 0.33 114.38 115.27 1xyj h ARG 148 Ca 0.00 -0.06 0.18 0.00 -1.26 0.00 0.00 59.98 58.84 1xyj h ARG 148 Cb 0.00 -0.23 -0.09 0.00 -1.65 0.00 0.00 29.97 27.99 1xyj h ARG 148 CO 0.00 0.69 0.61 -0.92 0.56 0.00 0.00 179.97 180.91 1xyj h TYR 149 N 1.07 0.95 0.10 3.04 5.03 -1.58 -1.18 116.97 124.41 1xyj h TYR 149 Ca 0.38 0.03 -0.33 0.00 2.58 0.00 0.00 58.73 61.39 1xyj h TYR 149 Cb 0.14 -0.29 -0.02 0.00 1.55 0.00 0.00 36.73 38.11 1xyj h TYR 149 CO -0.00 0.25 -1.79 1.88 -1.32 0.00 0.00 178.16 177.18 1xyj h TYR 150 N 0.72 0.39 -0.35 -3.82 -1.99 -0.84 -3.27 116.97 107.80 1xyj h TYR 150 Ca 0.54 -0.28 -0.03 0.00 2.00 0.00 0.00 58.73 60.96 1xyj h TYR 150 Cb 0.89 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.59 1xyj h TYR 150 CO -0.00 1.50 0.11 -0.09 -0.00 0.00 0.00 178.16 179.67 1xyj h ARG 151 N 0.06 0.51 0.12 4.88 2.43 0.26 -2.34 114.38 120.30 1xyj h ARG 151 Ca -0.34 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.75 1xyj h ARG 151 Cb 2.03 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 31.49 1xyj h ARG 151 CO 0.11 0.45 -0.06 0.93 -1.51 0.00 0.00 179.97 179.90 1xyj h GLU 152 N 0.50 -0.16 -2.73 0.20 4.39 -1.45 -3.38 114.58 111.95 1xyj h GLU 152 Ca 0.12 0.01 -0.58 0.00 0.34 0.00 0.00 59.36 59.25 1xyj h GLU 152 Cb 0.16 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1xyj h GLU 152 CO -0.01 -0.10 2.78 0.09 -1.16 0.00 0.00 179.01 180.61 1xyj n ASN 153 N -2.61 7.95 -0.00 1.42 3.02 -0.92 -4.35 115.26 119.77 1xyj n ASN 153 Ca -0.02 -2.63 0.06 0.00 -0.03 0.00 0.00 54.58 51.96 1xyj n ASN 153 Cb 0.06 -1.50 -0.08 0.00 -0.61 0.00 0.00 39.78 37.65 1xyj n ASN 153 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1xyj n MET 154 N 3.10 2.16 0.00 3.52 0.00 -0.96 -4.37 117.12 120.57 1xyj n MET 154 Ca 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 57.70 58.37 1xyj n MET 154 Cb 0.38 -1.16 0.00 0.00 0.00 0.00 0.00 33.22 32.43 1xyj n MET 154 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 175.97 178.45 1xyj n TYR 155 N -1.46 0.00 -1.11 3.17 0.18 -1.26 -3.45 117.16 113.23 1xyj n TYR 155 Ca 0.01 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.88 1xyj n TYR 155 Cb 0.24 -0.01 0.19 0.00 -0.38 0.00 0.00 39.34 39.37 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 -0.42 1.84 -1.84 -3.48 -4.01 -1.26 -5.05 116.66 102.43 1xyj n ARG 156 Ca 0.00 -2.75 -0.31 0.00 -1.04 0.00 0.00 57.85 53.76 1xyj n ARG 156 Cb 0.03 -1.63 0.03 0.00 -3.04 0.00 0.00 32.46 27.84 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 -2.91 3.44 0.14 2.89 1.51 -1.22 -5.02 117.35 116.17 1xyj s TYR 157 Ca 0.36 1.21 -0.30 0.00 -1.01 0.00 0.00 57.07 57.32 1xyj s TYR 157 Cb 0.31 -2.88 -0.08 0.00 -0.11 0.00 0.00 41.96 39.21 1xyj s TYR 157 CO 0.04 -0.96 1.27 -1.25 -1.11 0.00 0.00 175.55 173.54 1xyj s PRO 158 N -5.23 4.41 0.50 -1.71 0.04 -1.26 -4.92 135.00 126.82 1xyj s PRO 158 Ca 0.57 1.94 0.21 0.00 0.04 0.00 0.00 61.00 63.76 1xyj s PRO 158 Cb -0.11 -3.26 1.27 0.00 0.04 0.00 0.00 34.50 32.44 1xyj s PRO 158 CO 0.53 -0.26 2.00 -0.91 0.04 0.00 0.00 177.00 178.40 1xyj h ASN 159 N 6.11 0.12 -2.77 6.66 4.21 -1.96 -3.45 115.58 124.51 1xyj h ASN 159 Ca -0.43 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 56.94 1xyj h ASN 159 Cb 1.21 -0.02 -0.04 0.00 -1.12 0.00 0.00 38.32 38.36 1xyj h ASN 159 CO 0.80 0.07 -0.12 0.00 -1.29 0.00 0.00 177.43 176.89 1xyj n GLN 160 N -4.42 0.19 -4.57 0.81 6.02 -1.24 -3.33 117.38 110.83 1xyj n GLN 160 Ca 0.09 -1.10 -0.22 0.00 -0.01 0.00 0.00 57.00 55.75 1xyj n GLN 160 Cb 0.50 0.97 -0.16 0.00 1.02 0.00 0.00 30.24 32.58 1xyj n GLN 160 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1xyj s VAL 161 N -2.52 1.04 0.16 5.09 0.11 -1.26 -4.96 120.40 118.06 1xyj s VAL 161 Ca 0.13 -0.51 -0.14 0.00 -2.93 0.00 0.00 61.98 58.53 1xyj s VAL 161 Cb 0.00 -0.90 -0.07 0.00 -1.53 0.00 0.00 36.38 33.88 1xyj s VAL 161 CO 0.09 0.31 0.55 -0.31 -3.33 0.00 0.00 175.10 172.41 1xyj s TYR 162 N 0.05 3.58 0.15 1.54 2.02 -1.26 -1.42 117.35 122.02 1xyj s TYR 162 Ca -0.02 1.04 -0.16 0.00 -0.37 0.00 0.00 57.07 57.56 1xyj s TYR 162 Cb -0.09 -2.36 0.03 0.00 -0.40 0.00 0.00 41.96 39.14 1xyj s TYR 162 CO 0.01 0.41 0.44 1.52 -1.57 0.00 0.00 175.55 176.35 1xyj s TYR 163 N -1.51 -0.13 0.28 2.71 1.13 0.29 -4.63 117.35 115.48 1xyj s TYR 163 Ca 0.39 -0.19 -0.17 0.00 -1.41 0.00 0.00 57.07 55.69 1xyj s TYR 163 Cb -0.14 0.29 -0.09 0.00 -1.10 0.00 0.00 41.96 40.92 1xyj s TYR 163 CO 0.19 -0.78 0.73 1.03 -2.51 0.00 0.00 175.55 174.22 1xyj s ARG 164 N -3.84 4.10 0.84 -3.49 0.52 -1.26 -1.92 118.95 113.90 1xyj s ARG 164 Ca 0.06 0.75 -0.13 0.00 -0.52 0.00 0.00 55.73 55.90 1xyj s ARG 164 Cb 0.01 -2.61 0.10 0.00 0.52 0.00 0.00 34.95 32.97 1xyj s ARG 164 CO -0.08 0.25 1.15 -0.35 0.02 0.00 0.00 175.30 176.29 1xyj n PRO 165 N 0.06 0.00 -2.41 3.54 -0.04 -1.26 -4.84 135.00 130.05 1xyj n PRO 165 Ca 0.01 0.08 -0.37 0.00 -0.04 0.00 0.00 63.50 63.18 1xyj n PRO 165 Cb 0.52 -2.39 -0.03 0.00 -0.04 0.00 0.00 33.50 31.56 1xyj n PRO 165 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xyj s VAL 166 N -2.26 3.83 -0.19 0.52 1.01 -1.26 -4.87 120.40 117.18 1xyj s VAL 166 Ca 0.71 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 1xyj s VAL 166 Cb -0.27 -4.82 0.06 0.00 0.00 0.00 0.00 36.38 31.35 1xyj s VAL 166 CO 0.53 -1.66 0.08 -0.62 0.00 0.00 0.00 175.10 173.43 1xyj s ASP 167 N 5.60 2.62 -0.10 3.32 2.15 -1.26 -5.06 116.67 123.94 1xyj s ASP 167 Ca 0.55 -0.74 -0.29 0.00 0.43 0.00 0.00 52.55 52.50 1xyj s ASP 167 Cb -0.01 -0.36 -0.05 0.00 -0.30 0.00 0.00 42.92 42.20 1xyj s ASP 167 CO -0.02 -0.34 1.61 0.00 -0.17 0.00 0.00 175.17 176.24 1xyj s GLN 168 N 2.04 4.11 -0.27 4.34 0.00 -1.26 -4.98 119.66 123.65 1xyj s GLN 168 Ca 0.02 2.04 -0.01 0.00 -0.00 0.00 0.00 55.36 57.40 1xyj s GLN 168 Cb -0.16 -3.97 0.13 0.00 0.00 0.00 0.00 33.01 29.00 1xyj s GLN 168 CO -0.11 -0.92 0.30 0.71 0.00 0.00 0.00 175.29 175.28 1xyj s TYR 169 N 4.22 -0.54 -0.08 9.60 2.02 -1.26 -5.10 117.35 126.21 1xyj s TYR 169 Ca 0.71 0.10 -0.07 0.00 -0.37 0.00 0.00 57.07 57.44 1xyj s TYR 169 Cb -0.31 -0.34 0.01 0.00 -0.40 0.00 0.00 41.96 40.92 1xyj s TYR 169 CO 0.28 -0.84 0.11 -1.13 -1.57 0.00 0.00 175.55 172.40 1xyj n SER 170 N 5.32 -1.52 -3.39 2.29 3.41 -1.26 -4.91 113.62 113.56 1xyj n SER 170 Ca -0.03 0.01 -0.26 0.00 -0.26 0.00 0.00 58.87 58.33 1xyj n SER 170 Cb 0.48 -0.41 -0.09 0.00 -0.26 0.00 0.00 64.21 63.92 1xyj n SER 170 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1xyj n ASN 171 N 0.96 0.20 0.00 4.04 2.85 -1.26 -4.97 115.26 117.09 1xyj n ASN 171 Ca -0.02 -2.58 0.00 0.00 -0.11 0.00 0.00 54.58 51.87 1xyj n ASN 171 Cb 0.16 -0.60 0.00 0.00 1.24 0.00 0.00 39.78 40.58 1xyj n ASN 171 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 1xyj n GLN 172 N 2.31 0.00 0.01 1.20 0.00 -1.26 -4.30 117.38 115.34 1xyj n GLN 172 Ca 0.27 0.10 0.11 0.00 -0.00 0.00 0.00 57.00 57.47 1xyj n GLN 172 Cb 0.48 -0.46 0.00 0.00 0.00 0.00 0.00 30.24 30.26 1xyj n GLN 172 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1xyj n ASN 173 N -1.29 0.70 -0.01 1.69 3.02 -1.26 -3.92 115.26 114.18 1xyj n ASN 173 Ca 0.00 -0.51 0.16 0.00 -0.03 0.00 0.00 54.58 54.20 1xyj n ASN 173 Cb 0.00 0.83 0.88 0.00 -0.61 0.00 0.00 39.78 40.88 1xyj n ASN 173 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1xyj n ASN 174 N -1.71 0.03 -0.13 6.41 4.13 -1.26 -2.65 115.26 120.08 1xyj n ASN 174 Ca 0.03 -0.73 0.13 0.00 1.68 0.00 0.00 54.58 55.69 1xyj n ASN 174 Cb 0.38 -0.09 0.38 0.00 -1.54 0.00 0.00 39.78 38.91 1xyj n ASN 174 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1xyj n PHE 175 N -1.07 0.00 -0.04 3.10 7.35 -1.25 -4.45 117.46 121.10 1xyj n PHE 175 Ca 0.21 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.86 1xyj n PHE 175 Cb 0.16 -0.19 -0.01 0.00 0.35 0.00 0.00 39.48 39.79 1xyj n PHE 175 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1xyj n VAL 176 N -1.02 0.73 -0.63 -2.13 0.31 -1.08 -4.53 118.33 109.97 1xyj n VAL 176 Ca 0.10 0.34 -0.29 0.00 -0.01 0.00 0.00 64.34 64.48 1xyj n VAL 176 Cb 0.33 -1.94 0.26 0.00 -0.91 0.00 0.00 33.84 31.58 1xyj n VAL 176 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1xyj s HIS 177 N -1.77 0.65 0.00 3.52 3.76 -1.25 0.10 115.29 120.30 1xyj s HIS 177 Ca -0.10 0.84 0.00 0.00 -0.15 0.00 0.00 55.06 55.65 1xyj s HIS 177 Cb 0.01 -3.09 0.00 0.00 1.11 0.00 0.00 32.58 30.61 1xyj s HIS 177 CO 0.16 -4.18 0.00 -0.25 -0.85 0.00 0.00 174.74 169.61 1xyj n ASP 178 N -5.08 0.00 0.07 1.40 8.00 -1.26 -4.45 116.55 115.23 1xyj n ASP 178 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.58 1xyj n ASP 178 Cb 0.57 -0.77 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 1xyj n ASP 178 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xyj h VAL 180 N 0.00 0.00 -0.83 0.00 2.07 -0.55 -3.30 116.25 113.64 1xyj h VAL 180 Ca 0.00 -0.33 0.18 0.00 0.82 0.00 0.00 66.70 67.38 1xyj h VAL 180 Cb 0.13 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.74 1xyj h VAL 180 CO 0.00 0.00 -0.11 -1.13 0.02 0.00 0.00 177.57 176.35 1xyj h ASN 181 N -0.72 -0.60 -0.61 0.57 -0.00 -1.87 0.25 115.58 112.61 1xyj h ASN 181 Ca -0.04 0.24 0.08 0.00 -0.00 0.00 0.00 56.30 56.58 1xyj h ASN 181 Cb 0.30 0.46 -0.06 0.00 -0.00 0.00 0.00 38.32 39.01 1xyj h ASN 181 CO 0.07 -0.26 0.27 -0.29 -0.00 0.00 0.00 177.43 177.22 1xyj h ILE 182 N 0.03 0.84 -0.12 2.57 6.09 -1.82 0.27 117.51 125.37 1xyj h ILE 182 Ca 0.43 -0.17 -0.11 0.00 -1.37 0.00 0.00 64.86 63.65 1xyj h ILE 182 Cb 0.73 0.32 0.00 0.00 0.47 0.00 0.00 36.82 38.34 1xyj h ILE 182 CO -0.80 0.09 -0.34 0.74 -3.07 0.00 0.00 178.15 174.76 1xyj h THR 183 N 0.48 1.38 -0.04 2.19 2.02 -1.05 -0.20 112.91 117.69 1xyj h THR 183 Ca 0.29 -1.65 0.00 0.00 0.77 0.00 0.00 66.41 65.83 1xyj h THR 183 Cb 0.31 2.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 1xyj h THR 183 CO -0.26 0.49 -0.04 1.62 0.37 0.00 0.00 175.52 177.70 1xyj h VAL 184 N 0.02 0.00 -0.84 3.16 3.04 -1.10 -2.98 116.25 117.56 1xyj h VAL 184 Ca -0.01 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.76 1xyj h VAL 184 Cb 0.96 0.00 -0.06 0.00 -2.01 0.00 0.00 31.29 30.18 1xyj h VAL 184 CO 0.07 0.00 0.55 0.08 -1.01 0.00 0.00 177.57 177.26 1xyj h ARG 185 N -0.02 0.83 0.00 4.17 0.11 -0.48 -0.18 114.38 118.81 1xyj h ARG 185 Ca 0.01 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.04 1xyj h ARG 185 Cb 0.04 -0.19 0.00 0.00 1.11 0.00 0.00 29.97 30.93 1xyj h ARG 185 CO -0.05 0.55 0.00 1.96 0.10 0.00 0.00 179.97 182.53 1xyj h GLN 186 N 0.85 0.00 0.00 0.08 1.08 -0.89 -3.15 115.11 113.08 1xyj h GLN 186 Ca 0.38 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.58 1xyj h GLN 186 Cb 0.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1xyj h GLN 186 CO -0.15 0.00 0.00 1.58 -0.95 0.00 0.00 178.83 179.31 1xyj n HIS 187 N -2.39 0.00 -0.04 2.96 -0.00 -0.09 -4.74 115.22 110.92 1xyj n HIS 187 Ca -0.01 -0.31 -0.07 0.00 0.46 0.00 0.00 57.72 57.79 1xyj n HIS 187 Cb 0.09 -0.03 -0.04 0.00 -0.12 0.00 0.00 29.99 29.89 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 -0.31 0.50 -0.19 3.57 5.66 -1.14 -4.59 114.28 117.78 1xyj n THR 188 Ca 0.00 -0.17 0.18 0.00 -3.05 0.00 0.00 64.05 61.01 1xyj n THR 188 Cb 0.17 -1.02 0.53 0.00 -1.55 0.00 0.00 70.33 68.46 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 -0.09 0.72 -0.85 1.08 2.07 -1.85 0.33 116.25 117.67 1xyj h VAL 189 Ca -0.20 -0.12 0.22 0.00 0.82 0.00 0.00 66.70 67.41 1xyj h VAL 189 Cb 1.28 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 1xyj h VAL 189 CO -0.06 0.07 0.59 0.00 0.02 0.00 0.00 177.57 178.18 1xyj h THR 190 N 0.36 0.64 0.00 2.57 1.03 -1.86 -1.09 112.91 114.56 1xyj h THR 190 Ca 0.41 -0.07 -0.24 0.00 -0.01 0.00 0.00 66.41 66.51 1xyj h THR 190 Cb 1.06 0.42 -0.04 0.00 -1.07 0.00 0.00 68.15 68.52 1xyj h THR 190 CO -0.13 0.04 -1.89 0.41 -0.01 0.00 0.00 175.52 173.93 1xyj n THR 191 N -4.40 0.89 0.08 0.00 -1.04 0.85 -4.43 114.28 106.23 1xyj n THR 191 Ca 0.18 -0.48 -0.05 0.00 -2.04 0.00 0.00 64.05 61.65 1xyj n THR 191 Cb 0.79 -0.80 0.12 0.00 -1.82 0.00 0.00 70.33 68.62 1xyj n THR 191 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1xyj h THR 192 N 0.00 1.39 0.00 12.58 2.02 -0.48 0.11 112.91 128.52 1xyj h THR 192 Ca -0.35 -1.98 0.00 0.00 0.77 0.00 0.00 66.41 64.85 1xyj h THR 192 Cb 1.71 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 70.12 1xyj h THR 192 CO -0.01 0.59 0.01 0.00 0.37 0.00 0.00 175.52 176.48 1xyj h THR 193 N 0.19 0.00 -1.83 3.16 1.03 -1.43 -2.59 112.91 111.43 1xyj h THR 193 Ca -0.01 0.00 -0.65 0.00 -0.01 0.00 0.00 66.41 65.74 1xyj h THR 193 Cb 1.11 0.56 -0.37 0.00 -1.07 0.00 0.00 68.15 68.39 1xyj h THR 193 CO 0.09 0.00 -0.11 0.29 -0.01 0.00 0.00 175.52 175.78 1xyj n LYS 194 N -2.40 3.40 -3.46 0.00 5.02 0.39 -4.97 118.16 116.15 1xyj n LYS 194 Ca -0.02 -4.34 -0.18 0.00 -2.02 0.00 0.00 58.31 51.75 1xyj n LYS 194 Cb 0.05 -2.27 0.07 0.00 -0.02 0.00 0.00 35.03 32.86 1xyj n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xyj n GLY 195 N -0.42 -0.50 3.34 0.72 0.00 -0.97 -4.98 105.19 102.37 1xyj n GLY 195 Ca 0.42 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.55 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 -5.34 1.13 -0.05 1.61 2.56 -1.24 -5.04 118.70 112.32 1xyj s GLU 196 Ca 0.09 -1.06 0.11 0.00 0.00 0.00 0.00 54.97 54.12 1xyj s GLU 196 Cb -0.02 0.40 0.22 0.00 2.00 0.00 0.00 34.13 36.73 1xyj s GLU 196 CO 0.75 -0.42 1.12 -1.71 -0.56 0.00 0.00 175.26 174.44 1xyj n ASN 197 N -0.21 -0.21 -1.88 -1.70 5.15 -1.26 -4.17 115.26 110.98 1xyj n ASN 197 Ca -0.10 -2.02 -0.01 0.00 -0.60 0.00 0.00 54.58 51.85 1xyj n ASN 197 Cb 0.63 0.08 0.00 0.00 -0.53 0.00 0.00 39.78 39.96 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 -0.02 -0.06 -0.67 1.20 3.01 -1.26 -4.88 117.46 114.78 1xyj n PHE 198 Ca -0.13 0.03 -0.30 0.00 1.01 0.00 0.00 57.45 58.06 1xyj n PHE 198 Cb 0.88 -0.52 0.21 0.00 -0.01 0.00 0.00 39.48 40.03 1xyj n PHE 198 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1xyj s THR 199 N -0.52 2.11 0.49 4.37 2.01 -1.26 -4.33 115.64 118.51 1xyj s THR 199 Ca 0.01 0.04 0.30 0.00 0.31 0.00 0.00 61.69 62.34 1xyj s THR 199 Cb -0.00 -2.12 0.33 0.00 0.01 0.00 0.00 72.50 70.72 1xyj s THR 199 CO 0.02 -0.05 2.16 -0.08 -0.69 0.00 0.00 174.62 175.98 1xyj h GLU 200 N -2.22 0.00 0.04 4.92 4.81 -1.98 0.12 114.58 120.27 1xyj h GLU 200 Ca -0.53 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.47 1xyj h GLU 200 Cb 1.30 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.67 1xyj h GLU 200 CO 0.47 0.07 -1.06 1.15 -0.73 0.00 0.00 179.01 178.91 1xyj h THR 201 N 0.00 1.62 0.13 0.32 2.02 -1.99 -1.69 112.91 113.32 1xyj h THR 201 Ca -0.00 -3.20 -0.01 0.00 0.77 0.00 0.00 66.41 63.97 1xyj h THR 201 Cb 0.20 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 1xyj h THR 201 CO 0.01 0.92 -0.06 -0.78 0.37 0.00 0.00 175.52 175.98 1xyj h ASP 202 N 0.04 -0.15 0.06 4.18 1.82 -1.13 -3.09 116.42 118.14 1xyj h ASP 202 Ca -0.05 -0.34 -0.03 0.00 -0.39 0.00 0.00 57.03 56.22 1xyj h ASP 202 Cb 1.80 0.04 -0.01 0.00 0.68 0.00 0.00 39.33 41.84 1xyj h ASP 202 CO 0.15 0.29 -0.09 0.24 -1.61 0.00 0.00 179.24 178.22 1xyj h MET 203 N -0.62 0.09 0.23 0.28 2.86 -1.29 -1.77 114.93 114.71 1xyj h MET 203 Ca -0.02 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1xyj h MET 203 Cb 0.48 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.08 1xyj h MET 203 CO 0.03 0.19 -0.49 -0.22 1.06 0.00 0.00 176.91 177.48 1xyj h LYS 204 N 0.09 -0.77 -0.45 1.72 1.63 -1.26 -1.22 116.57 116.31 1xyj h LYS 204 Ca 0.02 0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.81 1xyj h LYS 204 Cb 0.23 0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 32.01 1xyj h LYS 204 CO 0.01 -0.51 0.02 0.82 -3.45 0.00 0.00 179.45 176.34 1xyj h ILE 205 N -0.79 1.23 0.07 2.00 2.04 -1.38 -0.14 117.51 120.53 1xyj h ILE 205 Ca -0.01 -0.92 0.01 0.00 1.00 0.00 0.00 64.86 64.93 1xyj h ILE 205 Cb 0.77 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1xyj h ILE 205 CO -0.21 0.32 -0.31 0.24 0.00 0.00 0.00 178.15 178.20 1xyj h MET 206 N 0.68 -0.42 -0.16 2.37 2.86 -0.96 0.14 114.93 119.44 1xyj h MET 206 Ca 0.14 0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 1xyj h MET 206 Cb 0.40 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1xyj h MET 206 CO 0.01 -0.28 -0.21 0.93 1.06 0.00 0.00 176.91 178.43 1xyj h GLU 207 N -0.43 0.28 -0.29 1.72 5.08 -0.96 0.20 114.58 120.17 1xyj h GLU 207 Ca -0.00 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 1xyj h GLU 207 Cb 0.44 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1xyj h GLU 207 CO -0.17 0.48 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.18 1xyj h ARG 208 N 0.25 0.46 0.00 2.33 1.12 -0.77 -2.48 114.38 115.29 1xyj h ARG 208 Ca 0.04 -0.11 -0.32 0.00 -1.11 0.00 0.00 59.98 58.48 1xyj h ARG 208 Cb 0.51 -0.06 -0.06 0.00 -0.01 0.00 0.00 29.97 30.35 1xyj h ARG 208 CO 0.03 0.53 -2.22 1.55 -3.11 0.00 0.00 179.97 176.75 1xyj n VAL 209 N -4.26 1.23 0.25 0.20 3.14 0.45 -3.54 118.33 115.80 1xyj n VAL 209 Ca 0.01 -0.63 0.09 0.00 -2.96 0.00 0.00 64.34 60.84 1xyj n VAL 209 Cb 0.27 -0.85 0.65 0.00 -1.06 0.00 0.00 33.84 32.85 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 0.00 0.89 0.10 1.55 2.07 -0.75 -1.45 116.25 118.66 1xyj h VAL 210 Ca -0.48 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1xyj h VAL 210 Cb 1.95 1.19 -0.00 0.00 -1.52 0.00 0.00 31.29 32.90 1xyj h VAL 210 CO -0.02 0.09 -0.09 -0.08 0.02 0.00 0.00 177.57 177.50 1xyj h GLU 211 N 0.00 -0.18 -0.78 1.57 4.22 -1.57 -2.52 114.58 115.32 1xyj h GLU 211 Ca -0.00 0.01 0.15 0.00 0.08 0.00 0.00 59.36 59.60 1xyj h GLU 211 Cb 0.18 0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.37 1xyj h GLU 211 CO 0.01 -0.12 0.32 1.96 -2.18 0.00 0.00 179.01 179.00 1xyj h GLN 212 N -0.19 0.44 -0.33 1.92 1.08 -1.45 0.94 115.11 117.53 1xyj h GLN 212 Ca -0.01 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1xyj h GLN 212 Cb 0.16 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1xyj h GLN 212 CO -0.00 0.29 0.16 0.00 -0.95 0.00 0.00 178.83 178.33 1xyj h MET 213 N 0.46 0.47 0.00 1.46 -0.00 -1.38 -1.93 114.93 114.00 1xyj h MET 213 Ca 0.43 -0.07 -0.07 0.00 -0.00 0.00 0.00 59.70 59.99 1xyj h MET 213 Cb 0.68 -0.09 -0.01 0.00 -0.00 0.00 0.00 31.60 32.18 1xyj h MET 213 CO -0.42 0.43 -0.35 0.00 -0.00 0.00 0.00 176.91 176.57 1xyj h VAL 215 N 0.00 1.36 -0.10 0.00 3.04 -0.69 -3.13 116.25 116.73 1xyj h VAL 215 Ca -0.00 -1.47 0.04 0.00 -1.01 0.00 0.00 66.70 64.25 1xyj h VAL 215 Cb 0.74 1.96 -0.05 0.00 -2.01 0.00 0.00 31.29 31.92 1xyj h VAL 215 CO 0.05 0.44 -0.22 0.00 -1.01 0.00 0.00 177.57 176.83 1xyj h THR 216 N 0.04 0.47 0.00 3.17 1.03 -1.22 0.35 112.91 116.75 1xyj h THR 216 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.41 1xyj h THR 216 Cb 0.82 0.47 0.00 0.00 -1.07 0.00 0.00 68.15 68.37 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 -5.35 0.20 -0.07 0.00 -0.00 -1.17 -0.17 117.38 110.81 1xyj n GLN 217 Ca -0.03 0.14 -0.04 0.00 -0.00 0.00 0.00 57.00 57.07 1xyj n GLN 217 Cb 0.26 -1.50 -0.01 0.00 -0.00 0.00 0.00 30.24 28.99 1xyj n GLN 217 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 1xyj h TYR 218 N 0.00 0.00 0.00 2.61 3.20 -0.95 -3.36 116.97 118.48 1xyj h TYR 218 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1xyj h TYR 218 Cb 0.08 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.35 1xyj h TYR 218 CO 0.00 0.00 0.00 -0.56 -1.64 0.00 0.00 178.16 175.96 1xyj h GLN 219 N -0.97 0.00 -0.01 1.82 3.07 -0.39 -0.01 115.11 118.62 1xyj h GLN 219 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1xyj h GLN 219 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.00 1xyj h GLN 219 CO 0.00 0.00 -0.62 0.36 0.09 0.00 0.00 178.83 178.66 1xyj n LYS 220 N -3.03 0.96 0.00 0.06 -0.00 0.76 -4.39 118.16 112.52 1xyj n LYS 220 Ca 0.02 -0.68 0.00 0.00 -0.00 0.00 0.00 58.31 57.66 1xyj n LYS 220 Cb 0.40 -1.46 0.00 0.00 -0.00 0.00 0.00 35.03 33.98 1xyj n LYS 220 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1xyj n GLU 221 N -0.48 2.09 -0.17 -1.58 2.13 -1.07 -4.37 120.64 117.18 1xyj n GLU 221 Ca 0.07 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.87 1xyj n GLU 221 Cb 0.41 -0.77 0.04 0.00 0.27 0.00 0.00 31.44 31.40 1xyj n GLU 221 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1xyj h SER 222 N 0.00 -0.50 -1.00 4.31 0.87 -1.22 -0.44 113.55 115.57 1xyj h SER 222 Ca 0.00 0.16 0.14 0.00 -1.23 0.00 0.00 61.79 60.85 1xyj h SER 222 Cb 0.53 0.33 -0.09 0.00 -0.44 0.00 0.00 62.40 62.73 1xyj h SER 222 CO 0.00 -0.18 0.62 -0.33 -0.53 0.00 0.00 176.83 176.42 1xyj h GLU 223 N -0.00 0.91 -0.00 2.24 4.39 -1.78 0.29 114.58 120.62 1xyj h GLU 223 Ca 0.25 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.90 1xyj h GLU 223 Cb 0.39 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1xyj h GLU 223 CO -0.54 0.60 -0.00 0.00 -1.16 0.00 0.00 179.01 177.91 1xyj h ALA 224 N 1.56 0.01 -0.32 3.43 0.00 -1.50 -2.53 119.26 119.90 1xyj h ALA 224 Ca 0.52 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.30 1xyj h ALA 224 Cb 0.58 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1xyj h ALA 224 CO -0.29 -0.28 0.24 1.88 0.00 0.00 0.00 179.25 180.80 1xyj h TYR 225 N -0.42 0.00 0.00 0.00 -1.99 -0.04 -0.05 116.97 114.47 1xyj h TYR 225 Ca 0.00 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.65 1xyj h TYR 225 Cb 0.43 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.15 1xyj h TYR 225 CO 0.07 0.00 -0.39 1.88 -0.00 0.00 0.00 178.16 179.72 1xyj h TYR 226 N 0.00 0.00 0.00 4.88 0.05 -0.36 -3.42 116.97 118.12 1xyj h TYR 226 Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.93 1xyj h TYR 226 Cb 0.64 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.38 1xyj h TYR 226 CO 0.00 0.39 0.00 1.04 -1.05 0.00 0.00 178.16 178.54 1xyj n GLN 227 N -3.33 0.00 -1.49 4.88 6.02 -0.25 -4.95 117.38 118.26 1xyj n GLN 227 Ca 0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.60 1xyj n GLN 227 Cb 0.61 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.85 1xyj n GLN 227 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1xyj n ARG 228 N 0.00 3.63 -1.91 -1.09 1.85 -0.25 -4.92 116.66 113.96 1xyj n ARG 228 Ca 0.00 -2.45 -0.39 0.00 -1.00 0.00 0.00 57.85 54.01 1xyj n ARG 228 Cb 0.00 -2.88 -0.03 0.00 -1.05 0.00 0.00 32.46 28.50 1xyj n ARG 228 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1xyj s ARG 229 N 1.98 2.67 0.00 2.89 3.52 -0.20 -4.57 118.95 125.23 1xyj s ARG 229 Ca 0.63 0.99 0.29 0.00 -0.13 0.00 0.00 55.73 57.51 1xyj s ARG 229 Cb 0.17 -4.39 1.46 0.00 -1.56 0.00 0.00 34.95 30.63 1xyj s ARG 229 CO -0.07 -2.66 1.99 0.00 -0.81 0.00 0.00 175.30 173.76 1xyj n ALA 230 N 12.92 2.42 -1.69 6.12 0.00 -1.26 -4.99 120.51 134.03 1xyj n ALA 230 Ca 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1xyj n ALA 230 Cb 0.51 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1xyj n ALA 230 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95