#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyk s VAL 122 N 0.00 -0.52 -0.43 1.55 0.11 -1.26 -5.08 120.40 114.77 1xyk s VAL 122 Ca 0.00 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 58.99 1xyk s VAL 122 Cb 0.00 -0.76 0.21 0.00 -1.53 0.00 0.00 36.38 34.30 1xyk s VAL 122 CO 0.00 -0.13 0.93 0.61 -3.33 0.00 0.00 175.10 173.18 1xyk n GLY 123 N 5.35 -1.13 0.00 6.54 0.00 -1.26 -4.99 105.19 109.71 1xyk n GLY 123 Ca -0.04 0.86 0.00 0.00 0.00 0.00 0.00 46.02 46.84 1xyk n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyk n GLY 124 N 2.65 3.34 3.71 -0.02 0.00 -1.26 -4.23 105.19 109.38 1xyk n GLY 124 Ca 0.14 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 1xyk n GLY 124 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1xyk n LEU 125 N 0.00 5.50 -0.10 0.99 -0.00 -1.26 -4.38 117.00 117.76 1xyk n LEU 125 Ca 0.00 0.84 -0.18 0.00 -0.00 0.00 0.00 56.01 56.67 1xyk n LEU 125 Cb 0.00 -1.52 -0.09 0.00 -0.00 0.00 0.00 43.42 41.81 1xyk n LEU 125 CO 0.00 -1.14 -0.52 0.61 -0.00 0.00 0.00 177.39 176.33 1xyk n GLY 126 N 0.99 -0.85 0.00 1.47 0.00 -1.26 -5.07 105.19 100.47 1xyk n GLY 126 Ca 0.15 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1xyk n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyk n GLY 127 N 1.47 -1.66 7.00 -0.02 0.00 -1.26 -5.15 105.19 105.58 1xyk n GLY 127 Ca -0.26 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1xyk n GLY 127 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1xyk n TYR 128 N 0.00 0.00 -4.03 1.61 4.02 -1.26 -4.86 117.16 112.64 1xyk n TYR 128 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 1xyk n TYR 128 Cb 0.00 0.01 -0.09 0.00 -0.02 0.00 0.00 39.34 39.24 1xyk n TYR 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xyk s MET 129 N 0.00 0.91 -0.09 -0.72 0.23 -1.25 -5.02 119.30 113.36 1xyk s MET 129 Ca 0.00 -1.22 0.04 0.00 -1.03 0.00 0.00 55.69 53.47 1xyk s MET 129 Cb 0.00 0.29 0.00 0.00 -1.53 0.00 0.00 34.83 33.60 1xyk s MET 129 CO 0.00 -0.28 -0.21 -1.17 -2.03 0.00 0.00 175.02 171.33 1xyk s LEU 130 N -2.96 1.99 1.04 0.18 2.96 -1.26 -1.59 118.68 119.04 1xyk s LEU 130 Ca 0.15 -0.50 -0.16 0.00 -0.22 0.00 0.00 54.13 53.40 1xyk s LEU 130 Cb 0.06 -1.28 0.22 0.00 0.50 0.00 0.00 46.19 45.69 1xyk s LEU 130 CO -0.04 0.13 1.20 -0.83 -1.32 0.00 0.00 176.35 175.50 1xyk s GLY 131 N 0.39 1.66 0.69 7.98 0.00 0.29 -4.99 107.32 113.35 1xyk s GLY 131 Ca -0.17 -0.95 -0.13 0.00 0.00 0.00 0.00 44.72 43.46 1xyk s GLY 131 CO 0.08 -0.19 1.09 -0.56 0.00 0.00 0.00 173.10 173.52 1xyk s SER 132 N -4.32 5.03 0.73 1.64 0.01 -1.26 -4.57 113.70 110.96 1xyk s SER 132 Ca 0.70 1.88 -0.12 0.00 1.31 0.00 0.00 55.95 59.73 1xyk s SER 132 Cb -0.09 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.64 1xyk s SER 132 CO 0.54 -1.68 1.11 0.00 0.41 0.00 0.00 173.24 173.62 1xyk s ALA 133 N -2.61 2.77 0.00 1.44 0.00 -1.26 -4.63 121.76 117.47 1xyk s ALA 133 Ca 0.64 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1xyk s ALA 133 Cb -0.18 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.91 1xyk s ALA 133 CO 0.47 -1.29 0.00 0.00 0.00 0.00 0.00 175.76 174.94 1xyk n MET 134 N -3.11 0.00 -2.02 0.00 0.00 -1.26 -5.07 117.12 105.67 1xyk n MET 134 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 57.70 57.48 1xyk n MET 134 Cb 0.58 0.00 0.06 0.00 0.00 0.00 0.00 33.22 33.85 1xyk n MET 134 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1xyk s SER 135 N -0.26 5.19 -0.07 3.17 0.15 -1.26 -4.97 113.70 115.64 1xyk s SER 135 Ca 0.00 0.90 -0.30 0.00 0.70 0.00 0.00 55.95 57.26 1xyk s SER 135 Cb 0.00 -1.65 -0.05 0.00 -1.71 0.00 0.00 66.02 62.61 1xyk s SER 135 CO 0.00 -1.45 1.70 0.00 1.20 0.00 0.00 173.24 174.69 1xyk s ARG 136 N -5.33 4.10 0.64 5.44 1.04 -1.26 -4.93 118.95 118.64 1xyk s ARG 136 Ca 0.58 2.16 -0.18 0.00 -1.04 0.00 0.00 55.73 57.26 1xyk s ARG 136 Cb -0.11 -4.02 -0.01 0.00 -2.04 0.00 0.00 34.95 28.77 1xyk s ARG 136 CO 0.49 -0.95 1.23 -2.14 -0.04 0.00 0.00 175.30 173.90 1xyk s PRO 137 N 4.23 2.69 -0.32 3.89 0.02 -1.26 -5.00 135.00 139.24 1xyk s PRO 137 Ca 0.75 1.89 -0.00 0.00 0.02 0.00 0.00 61.00 63.66 1xyk s PRO 137 Cb -0.33 -1.89 0.13 0.00 0.02 0.00 0.00 34.50 32.44 1xyk s PRO 137 CO 0.31 -1.44 0.26 -1.17 -0.33 0.00 0.00 177.00 174.62 1xyk s LEU 138 N -4.36 0.24 0.80 -5.54 1.98 -1.26 -4.98 118.68 105.55 1xyk s LEU 138 Ca 0.78 -1.38 -0.12 0.00 -2.89 0.00 0.00 54.13 50.53 1xyk s LEU 138 Cb -0.32 0.13 0.07 0.00 0.66 0.00 0.00 46.19 46.73 1xyk s LEU 138 CO 0.37 -0.35 1.16 -0.63 -1.89 0.00 0.00 176.35 175.01 1xyk s ILE 139 N 1.81 2.25 -0.34 6.68 1.09 -1.26 -5.06 121.20 126.37 1xyk s ILE 139 Ca 0.13 0.08 -0.00 0.00 -1.10 0.00 0.00 60.65 59.76 1xyk s ILE 139 Cb -0.17 -3.07 0.08 0.00 -1.06 0.00 0.00 42.46 38.24 1xyk s ILE 139 CO -0.20 -0.11 0.06 -1.00 -0.10 0.00 0.00 174.94 173.59 1xyk s HIS 140 N -3.53 3.48 -0.94 3.97 3.76 -1.26 -4.96 115.29 115.80 1xyk s HIS 140 Ca 0.61 -2.35 0.25 0.00 -0.15 0.00 0.00 55.06 53.43 1xyk s HIS 140 Cb -0.11 -2.61 0.57 0.00 1.11 0.00 0.00 32.58 31.55 1xyk s HIS 140 CO 0.50 -0.90 1.46 1.19 -0.85 0.00 0.00 174.74 176.14 1xyk n PHE 141 N 4.51 0.09 0.00 1.40 3.72 -1.26 -4.94 117.46 120.97 1xyk n PHE 141 Ca -0.06 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1xyk n PHE 141 Cb 0.42 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 1xyk n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xyk n GLY 142 N 1.47 1.67 3.82 1.37 0.00 -1.26 -4.96 105.19 107.31 1xyk n GLY 142 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1xyk n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xyk s ASN 143 N -1.90 6.51 -0.00 1.61 0.01 -1.26 -5.00 114.94 114.91 1xyk s ASN 143 Ca 0.00 0.61 0.10 0.00 -0.71 0.00 0.00 52.86 52.85 1xyk s ASN 143 Cb 0.00 -2.15 -0.11 0.00 0.41 0.00 0.00 41.25 39.40 1xyk s ASN 143 CO 0.00 0.30 0.40 -0.67 -1.51 0.00 0.00 177.10 175.61 1xyk n ASP 144 N 2.42 0.71 0.23 -1.22 2.03 -1.26 -1.53 116.55 117.93 1xyk n ASP 144 Ca -0.16 -0.65 -0.12 0.00 0.52 0.00 0.00 54.79 54.38 1xyk n ASP 144 Cb 0.53 1.05 -0.06 0.00 -0.72 0.00 0.00 41.12 41.92 1xyk n ASP 144 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1xyk h TYR 145 N 0.00 -0.59 -0.87 -0.67 3.20 -1.99 -3.06 116.97 113.00 1xyk h TYR 145 Ca 0.00 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.94 1xyk h TYR 145 Cb 0.26 0.19 -0.07 0.00 1.54 0.00 0.00 36.73 38.65 1xyk h TYR 145 CO 0.00 -0.30 0.52 0.93 -1.64 0.00 0.00 178.16 177.67 1xyk h GLU 146 N -1.09 0.86 0.56 1.82 5.08 -2.00 -0.36 114.58 119.46 1xyk h GLU 146 Ca -0.06 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1xyk h GLU 146 Cb 0.55 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1xyk h GLU 146 CO 0.11 0.57 -0.32 0.22 -1.00 0.00 0.00 179.01 178.59 1xyk h ASP 147 N 0.89 -0.78 -0.56 1.42 3.58 -1.43 -3.11 116.42 116.43 1xyk h ASP 147 Ca 0.41 0.04 0.11 0.00 0.42 0.00 0.00 57.03 58.01 1xyk h ASP 147 Cb 0.32 0.22 -0.09 0.00 1.72 0.00 0.00 39.33 41.50 1xyk h ASP 147 CO -0.22 -0.51 0.05 -0.09 -2.88 0.00 0.00 179.24 175.58 1xyk h ARG 148 N -0.82 0.16 -1.00 0.28 9.65 -1.25 0.19 114.38 121.59 1xyk h ARG 148 Ca -0.07 -0.01 0.12 0.00 -1.10 0.00 0.00 59.98 58.92 1xyk h ARG 148 Cb 0.66 -0.04 -0.09 0.00 -1.39 0.00 0.00 29.97 29.11 1xyk h ARG 148 CO 0.09 0.11 0.63 -0.92 2.80 0.00 0.00 179.97 182.68 1xyk h TYR 149 N 0.17 1.14 0.00 2.20 3.20 -1.03 -1.44 116.97 121.21 1xyk h TYR 149 Ca 0.29 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.93 1xyk h TYR 149 Cb 0.44 -0.36 -0.05 0.00 1.54 0.00 0.00 36.73 38.30 1xyk h TYR 149 CO -0.30 0.44 -1.68 0.66 -1.64 0.00 0.00 178.16 175.64 1xyk n TYR 150 N -4.62 0.91 -0.12 -3.82 4.02 -1.08 -4.40 117.16 108.05 1xyk n TYR 150 Ca 0.19 0.32 -0.05 0.00 -0.01 0.00 0.00 57.90 58.35 1xyk n TYR 150 Cb 0.36 -1.14 0.03 0.00 -0.02 0.00 0.00 39.34 38.57 1xyk n TYR 150 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xyk h ARG 151 N 0.00 0.24 -0.83 -0.72 2.47 0.08 -0.49 114.38 115.14 1xyk h ARG 151 Ca -0.27 -0.01 0.12 0.00 -1.26 0.00 0.00 59.98 58.56 1xyk h ARG 151 Cb 1.90 -0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 30.11 1xyk h ARG 151 CO 0.07 0.16 0.54 0.93 0.56 0.00 0.00 179.97 182.22 1xyk h GLU 152 N 0.24 0.65 0.00 0.04 5.08 -1.60 -2.81 114.58 116.18 1xyk h GLU 152 Ca 0.19 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1xyk h GLU 152 Cb 0.20 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1xyk h GLU 152 CO -0.22 0.43 -0.23 0.27 -1.00 0.00 0.00 179.01 178.26 1xyk n ASN 153 N -4.52 1.68 -0.04 1.42 0.23 -1.16 -4.85 115.26 108.02 1xyk n ASN 153 Ca 0.15 -2.92 0.11 0.00 -0.53 0.00 0.00 54.58 51.39 1xyk n ASN 153 Cb 0.41 -0.39 0.51 0.00 -2.08 0.00 0.00 39.78 38.23 1xyk n ASN 153 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xyk h MET 154 N 0.19 0.37 0.00 -3.83 -0.00 -0.80 0.38 114.93 111.25 1xyk h MET 154 Ca -0.01 -0.02 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 1xyk h MET 154 Cb 1.13 -0.08 0.00 0.00 -0.00 0.00 0.00 31.60 32.65 1xyk h MET 154 CO 0.01 0.25 0.00 2.48 -0.00 0.00 0.00 176.91 179.64 1xyk n TYR 155 N -4.47 0.00 0.12 -0.10 4.11 -1.26 -2.75 117.16 112.80 1xyk n TYR 155 Ca 0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.90 58.07 1xyk n TYR 155 Cb 0.30 -0.28 0.26 0.00 -0.00 0.00 0.00 39.34 39.63 1xyk n TYR 155 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1xyk n ARG 156 N -1.28 2.37 -2.65 -3.48 1.74 0.12 -5.00 116.66 108.50 1xyk n ARG 156 Ca 0.04 -2.13 -0.38 0.00 -0.77 0.00 0.00 57.85 54.61 1xyk n ARG 156 Cb 0.06 -1.46 -0.05 0.00 -1.02 0.00 0.00 32.46 29.99 1xyk n ARG 156 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1xyk s TYR 157 N -1.21 3.58 -0.71 -1.55 -0.85 -1.11 -4.97 117.35 110.52 1xyk s TYR 157 Ca 0.40 1.74 -0.26 0.00 -0.52 0.00 0.00 57.07 58.43 1xyk s TYR 157 Cb 0.21 -3.06 -0.01 0.00 0.38 0.00 0.00 41.96 39.48 1xyk s TYR 157 CO 0.27 -0.15 1.74 -1.25 -1.52 0.00 0.00 175.55 174.63 1xyk s PRO 158 N -1.98 2.78 -0.16 -3.49 0.04 -1.26 -4.83 135.00 126.10 1xyk s PRO 158 Ca 0.50 0.18 -0.00 0.00 0.04 0.00 0.00 61.00 61.72 1xyk s PRO 158 Cb -0.23 -4.53 0.13 0.00 0.04 0.00 0.00 34.50 29.91 1xyk s PRO 158 CO 0.29 -2.71 1.82 -0.40 0.04 0.00 0.00 177.00 176.04 1xyk n ASP 159 N 12.09 5.27 -4.14 6.66 5.75 -1.26 -4.84 116.55 136.08 1xyk n ASP 159 Ca 0.21 -2.67 -0.12 0.00 -0.01 0.00 0.00 54.79 52.20 1xyk n ASP 159 Cb 0.50 -0.97 -0.11 0.00 -1.03 0.00 0.00 41.12 39.52 1xyk n ASP 159 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1xyk s GLN 160 N -0.94 0.74 0.22 0.11 -0.21 -1.26 -4.04 119.66 114.28 1xyk s GLN 160 Ca 0.16 -1.10 -0.01 0.00 0.02 0.00 0.00 55.36 54.43 1xyk s GLN 160 Cb 0.13 -0.31 -0.03 0.00 1.00 0.00 0.00 33.01 33.79 1xyk s GLN 160 CO 0.01 0.03 0.19 0.14 -2.12 0.00 0.00 175.29 173.53 1xyk s VAL 161 N -2.61 0.00 -0.13 1.09 -7.23 -1.26 -4.98 120.40 105.28 1xyk s VAL 161 Ca 0.03 -1.94 -0.01 0.00 -1.81 0.00 0.00 61.98 58.25 1xyk s VAL 161 Cb -0.02 -2.48 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 1xyk s VAL 161 CO -0.02 0.00 -0.09 -0.31 -0.31 0.00 0.00 175.10 174.37 1xyk s TYR 162 N -4.03 2.90 0.00 2.82 1.51 -1.26 -0.55 117.35 118.74 1xyk s TYR 162 Ca 0.38 -0.44 0.00 0.00 -1.01 0.00 0.00 57.07 56.00 1xyk s TYR 162 Cb 0.06 -1.87 0.00 0.00 -0.11 0.00 0.00 41.96 40.04 1xyk s TYR 162 CO 0.14 -0.08 0.00 2.48 -1.11 0.00 0.00 175.55 176.98 1xyk n TYR 163 N 3.37 -0.41 -3.97 2.71 4.11 -0.62 -4.79 117.16 117.55 1xyk n TYR 163 Ca -0.18 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.63 1xyk n TYR 163 Cb 0.53 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.77 1xyk n TYR 163 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 1xyk s ARG 164 N -0.77 0.53 -1.42 -3.48 3.00 -1.26 -3.74 118.95 111.81 1xyk s ARG 164 Ca 0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 55.73 54.79 1xyk s ARG 164 Cb 0.00 0.20 0.07 0.00 0.00 0.00 0.00 34.95 35.22 1xyk s ARG 164 CO 0.00 -0.12 2.15 -0.35 0.00 0.00 0.00 175.30 176.98 1xyk n PRO 165 N 0.82 3.02 0.00 3.54 -0.04 -1.26 -4.62 135.00 136.46 1xyk n PRO 165 Ca -0.19 -2.80 0.00 0.00 -0.04 0.00 0.00 63.50 60.47 1xyk n PRO 165 Cb 0.58 -3.21 0.00 0.00 -0.04 0.00 0.00 33.50 30.83 1xyk n PRO 165 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1xyk n VAL 166 N 4.71 0.00 0.00 0.52 3.14 -1.26 -5.13 118.33 120.31 1xyk n VAL 166 Ca 0.49 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.87 1xyk n VAL 166 Cb 0.38 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.16 1xyk n VAL 166 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1xyk n ASP 167 N 0.00 0.00 -3.24 6.55 2.03 -1.26 -4.94 116.55 115.69 1xyk n ASP 167 Ca 0.00 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.92 1xyk n ASP 167 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 1xyk n ASP 167 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1xyk n GLN 168 N 0.00 4.07 -0.08 -0.67 -0.06 -1.26 -4.81 117.38 114.57 1xyk n GLN 168 Ca 0.00 -3.80 0.00 0.00 -2.00 0.00 0.00 57.00 51.20 1xyk n GLN 168 Cb 0.00 -2.39 0.00 0.00 -4.06 0.00 0.00 30.24 23.79 1xyk n GLN 168 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1xyk n TYR 169 N 0.21 -0.23 -2.14 3.69 4.02 -1.26 -2.91 117.16 118.54 1xyk n TYR 169 Ca 0.52 0.13 -0.30 0.00 -0.01 0.00 0.00 57.90 58.23 1xyk n TYR 169 Cb 0.29 -1.06 -0.05 0.00 -0.02 0.00 0.00 39.34 38.50 1xyk n TYR 169 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1xyk s SER 170 N -2.24 5.33 -1.73 7.72 1.04 -1.26 -3.89 113.70 118.67 1xyk s SER 170 Ca 0.00 -1.49 -0.13 0.00 0.48 0.00 0.00 55.95 54.81 1xyk s SER 170 Cb 0.00 -2.58 0.13 0.00 0.10 0.00 0.00 66.02 63.67 1xyk s SER 170 CO 0.00 -2.71 0.32 0.59 0.98 0.00 0.00 173.24 172.42 1xyk n ASN 171 N 13.35 -0.52 0.00 7.02 3.02 -1.26 -4.94 115.26 131.92 1xyk n ASN 171 Ca 0.43 -1.26 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1xyk n ASN 171 Cb 0.47 -1.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.03 1xyk n ASN 171 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1xyk n GLN 172 N -4.31 0.00 0.03 3.52 -0.06 -1.25 -5.02 117.38 110.29 1xyk n GLN 172 Ca -0.09 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.91 1xyk n GLN 172 Cb 0.57 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.75 1xyk n GLN 172 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 1xyk n ASN 173 N 0.00 0.69 -0.03 1.69 5.15 -1.26 -4.68 115.26 116.82 1xyk n ASN 173 Ca 0.00 0.09 0.01 0.00 -0.60 0.00 0.00 54.58 54.08 1xyk n ASN 173 Cb 0.00 -0.21 0.32 0.00 -0.53 0.00 0.00 39.78 39.37 1xyk n ASN 173 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 1xyk h ASN 174 N 0.00 0.55 0.00 1.20 -1.24 -1.97 0.69 115.58 114.80 1xyk h ASN 174 Ca 0.00 -0.06 0.00 0.00 0.71 0.00 0.00 56.30 56.95 1xyk h ASN 174 Cb 0.00 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 38.91 1xyk h ASN 174 CO 0.00 0.52 0.00 0.33 -1.29 0.00 0.00 177.43 176.99 1xyk n PHE 175 N -4.36 0.00 -0.21 0.67 7.35 -1.14 -0.71 117.46 119.06 1xyk n PHE 175 Ca 0.03 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.67 1xyk n PHE 175 Cb 0.16 0.00 0.10 0.00 0.35 0.00 0.00 39.48 40.10 1xyk n PHE 175 CO 0.00 0.00 0.00 -0.39 -0.76 0.00 0.00 176.76 175.61 1xyk h VAL 176 N 0.00 1.25 -0.87 -2.13 -1.51 -1.61 -2.82 116.25 108.56 1xyk h VAL 176 Ca 0.00 -0.91 0.02 0.00 -1.23 0.00 0.00 66.70 64.58 1xyk h VAL 176 Cb 0.00 0.56 -0.05 0.00 -2.13 0.00 0.00 31.29 29.68 1xyk h VAL 176 CO 0.00 0.35 0.57 0.08 -1.23 0.00 0.00 177.57 177.34 1xyk h ARG 177 N 0.98 1.12 0.14 5.19 -0.00 -0.43 0.19 114.38 121.57 1xyk h ARG 177 Ca 0.21 -0.07 -0.28 0.00 -0.00 0.00 0.00 59.98 59.84 1xyk h ARG 177 Cb 0.33 -0.25 0.01 0.00 -0.00 0.00 0.00 29.97 30.06 1xyk h ARG 177 CO -0.00 0.74 -1.28 0.22 -0.00 0.00 0.00 179.97 179.65 1xyk h ASP 178 N 1.15 0.47 0.31 0.08 3.58 -0.96 -2.67 116.42 118.38 1xyk h ASP 178 Ca 0.33 -0.50 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 1xyk h ASP 178 Cb -0.09 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.81 1xyk h ASP 178 CO -0.08 1.40 -0.15 0.00 -2.88 0.00 0.00 179.24 177.52 1xyk h VAL 180 N -0.54 0.93 0.61 0.00 2.07 -0.78 0.32 116.25 118.86 1xyk h VAL 180 Ca -0.04 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1xyk h VAL 180 Cb 0.40 0.38 0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1xyk h VAL 180 CO 0.07 0.09 -0.29 0.78 0.02 0.00 0.00 177.57 178.24 1xyk h ASN 181 N 0.51 -0.69 -0.21 0.57 2.35 -1.15 -0.57 115.58 116.40 1xyk h ASN 181 Ca 0.29 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 56.07 1xyk h ASN 181 Cb 0.45 0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1xyk h ASN 181 CO -0.09 -0.48 0.08 0.40 -1.65 0.00 0.00 177.43 175.69 1xyk h ILE 182 N -0.83 0.96 0.63 2.81 1.08 -0.72 0.81 117.51 122.25 1xyk h ILE 182 Ca -0.08 -0.06 -0.02 0.00 -0.39 0.00 0.00 64.86 64.30 1xyk h ILE 182 Cb 0.63 0.76 -0.01 0.00 -3.07 0.00 0.00 36.82 35.13 1xyk h ILE 182 CO 0.14 0.03 -0.45 0.74 -0.69 0.00 0.00 178.15 177.92 1xyk h THR 183 N 0.18 0.11 -0.58 -0.27 2.02 -0.89 -0.14 112.91 113.33 1xyk h THR 183 Ca 0.09 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.33 1xyk h THR 183 Cb 0.05 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.51 1xyk h THR 183 CO -0.09 0.00 0.28 0.58 0.37 0.00 0.00 175.52 176.66 1xyk h VAL 184 N -1.04 0.91 -0.76 3.16 2.07 -1.01 -2.29 116.25 117.29 1xyk h VAL 184 Ca -0.08 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 1xyk h VAL 184 Cb 0.86 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1xyk h VAL 184 CO 0.04 0.10 0.26 0.50 0.02 0.00 0.00 177.57 178.49 1xyk h LYS 185 N 0.52 1.16 0.00 1.57 3.64 -0.49 0.28 116.57 123.24 1xyk h LYS 185 Ca 0.27 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1xyk h LYS 185 Cb 0.22 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1xyk h LYS 185 CO -0.21 0.96 0.00 1.04 -2.27 0.00 0.00 179.45 178.98 1xyk n GLN 186 N -4.28 0.19 -0.13 1.90 6.02 -0.10 -1.33 117.38 119.66 1xyk n GLN 186 Ca 0.06 0.16 -0.27 0.00 -0.01 0.00 0.00 57.00 56.94 1xyk n GLN 186 Cb 0.21 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 29.88 1xyk n GLN 186 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1xyk n HIS 187 N -1.24 0.00 -0.13 1.08 8.25 0.26 -4.23 115.22 119.21 1xyk n HIS 187 Ca 0.06 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.41 1xyk n HIS 187 Cb 0.08 -0.90 -0.02 0.00 1.12 0.00 0.00 29.99 30.27 1xyk n HIS 187 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1xyk h THR 188 N -0.94 1.27 -0.52 1.59 1.35 -0.26 0.13 112.91 115.53 1xyk h THR 188 Ca -0.62 -1.08 -0.08 0.00 -0.55 0.00 0.00 66.41 64.08 1xyk h THR 188 Cb 1.53 1.20 -0.02 0.00 -1.73 0.00 0.00 68.15 69.13 1xyk h THR 188 CO -0.37 0.36 -0.00 0.58 -0.25 0.00 0.00 175.52 175.83 1xyk h VAL 189 N 0.52 1.26 -0.43 6.82 2.07 -1.45 -0.92 116.25 124.12 1xyk h VAL 189 Ca 0.10 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.61 1xyk h VAL 189 Cb 0.53 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 1xyk h VAL 189 CO 0.03 0.39 0.02 0.74 0.02 0.00 0.00 177.57 178.77 1xyk h THR 190 N 0.78 0.70 -0.37 2.57 2.02 -1.59 0.19 112.91 117.21 1xyk h THR 190 Ca 0.15 -0.05 -0.15 0.00 0.77 0.00 0.00 66.41 67.12 1xyk h THR 190 Cb 0.53 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1xyk h THR 190 CO 0.03 0.03 -0.37 0.71 0.37 0.00 0.00 175.52 176.28 1xyk h THR 191 N 0.14 1.27 -0.76 3.16 1.35 -0.59 -1.33 112.91 116.16 1xyk h THR 191 Ca 0.21 -1.54 0.05 0.00 -0.55 0.00 0.00 66.41 64.59 1xyk h THR 191 Cb 0.30 1.40 -0.05 0.00 -1.73 0.00 0.00 68.15 68.08 1xyk h THR 191 CO -0.33 0.51 0.50 0.74 -0.25 0.00 0.00 175.52 176.69 1xyk h THR 192 N 0.72 1.06 -0.09 6.82 2.02 -0.69 -0.30 112.91 122.46 1xyk h THR 192 Ca 0.06 -0.29 -0.14 0.00 0.77 0.00 0.00 66.41 66.81 1xyk h THR 192 Cb 0.96 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1xyk h THR 192 CO 0.09 0.15 -0.56 0.74 0.37 0.00 0.00 175.52 176.32 1xyk h THR 193 N 0.84 1.36 0.00 3.16 2.02 -0.32 -3.43 112.91 116.55 1xyk h THR 193 Ca 0.32 -1.86 0.00 0.00 0.77 0.00 0.00 66.41 65.64 1xyk h THR 193 Cb 0.19 1.91 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1xyk h THR 193 CO -0.10 0.55 0.00 0.29 0.37 0.00 0.00 175.52 176.63 1xyk n LYS 194 N -3.91 0.00 -2.71 6.66 4.76 -0.40 -5.09 118.16 117.46 1xyk n LYS 194 Ca -0.02 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.41 1xyk n LYS 194 Cb 0.59 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.80 1xyk n LYS 194 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1xyk s GLY 195 N 0.00 -1.74 0.10 0.72 0.00 -0.26 -5.02 107.32 101.13 1xyk s GLY 195 Ca 0.00 0.96 -0.13 0.00 0.00 0.00 0.00 44.72 45.55 1xyk s GLY 195 CO 0.00 4.32 0.32 1.85 0.00 0.00 0.00 173.10 179.59 1xyk s GLU 196 N 1.48 0.95 0.10 2.90 2.56 -1.18 -5.04 118.70 120.47 1xyk s GLU 196 Ca 0.19 -0.76 0.02 0.00 0.00 0.00 0.00 54.97 54.42 1xyk s GLU 196 Cb 0.08 0.41 -0.04 0.00 2.00 0.00 0.00 34.13 36.58 1xyk s GLU 196 CO -0.13 -0.34 -0.07 -0.80 -0.56 0.00 0.00 175.26 173.36 1xyk s ASN 197 N -2.71 1.21 -0.02 -1.70 0.02 -1.26 -4.46 114.94 106.01 1xyk s ASN 197 Ca 0.02 -1.00 0.04 0.00 -1.02 0.00 0.00 52.86 50.90 1xyk s ASN 197 Cb 0.03 0.08 -0.01 0.00 0.02 0.00 0.00 41.25 41.37 1xyk s ASN 197 CO -0.10 -0.45 -0.14 -0.36 0.02 0.00 0.00 177.10 176.07 1xyk s PHE 198 N -3.56 1.30 0.33 2.20 0.08 -1.26 -5.14 117.98 111.92 1xyk s PHE 198 Ca 0.12 -0.30 -0.24 0.00 0.12 0.00 0.00 56.93 56.63 1xyk s PHE 198 Cb 0.05 -0.87 -0.10 0.00 -0.57 0.00 0.00 43.02 41.53 1xyk s PHE 198 CO -0.04 -0.08 0.91 0.95 -0.10 0.00 0.00 175.22 176.86 1xyk s THR 199 N -0.11 4.31 0.26 0.64 -4.23 -1.26 -4.95 115.64 110.29 1xyk s THR 199 Ca 0.01 1.66 0.34 0.00 -1.18 0.00 0.00 61.69 62.52 1xyk s THR 199 Cb -0.08 -3.91 0.37 0.00 1.34 0.00 0.00 72.50 70.23 1xyk s THR 199 CO 0.00 0.06 2.06 -0.33 -0.54 0.00 0.00 174.62 175.88 1xyk h GLU 200 N 2.97 0.00 0.12 3.99 3.07 -2.00 -0.09 114.58 122.64 1xyk h GLU 200 Ca -0.47 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.11 1xyk h GLU 200 Cb 1.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1xyk h GLU 200 CO 0.64 0.04 -1.31 1.15 -1.40 0.00 0.00 179.01 178.13 1xyk h THR 201 N 0.00 1.41 -0.42 1.13 2.02 -2.01 -3.09 112.91 111.96 1xyk h THR 201 Ca -0.00 -3.00 -0.04 0.00 0.77 0.00 0.00 66.41 64.14 1xyk h THR 201 Cb 0.41 2.90 -0.02 0.00 -1.74 0.00 0.00 68.15 69.70 1xyk h THR 201 CO 0.01 0.87 0.11 -0.78 0.37 0.00 0.00 175.52 176.09 1xyk h ASP 202 N 0.07 0.64 -0.85 4.18 1.82 -1.71 -3.05 116.42 117.52 1xyk h ASP 202 Ca -0.16 -0.23 0.18 0.00 -0.39 0.00 0.00 57.03 56.44 1xyk h ASP 202 Cb 1.98 -0.17 -0.06 0.00 0.68 0.00 0.00 39.33 41.76 1xyk h ASP 202 CO 0.19 0.70 0.57 0.24 -1.61 0.00 0.00 179.24 179.33 1xyk h MET 203 N 0.54 0.39 -0.19 0.28 2.86 -1.11 0.20 114.93 117.90 1xyk h MET 203 Ca 0.13 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.80 1xyk h MET 203 Cb 0.31 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 1xyk h MET 203 CO 0.00 0.26 -0.10 -0.22 1.06 0.00 0.00 176.91 177.90 1xyk h LYS 204 N 0.40 -0.09 -0.06 1.72 1.63 -1.44 -0.85 116.57 117.89 1xyk h LYS 204 Ca 0.43 0.01 -0.21 0.00 -0.85 0.00 0.00 60.65 60.03 1xyk h LYS 204 Cb 1.07 0.02 0.01 0.00 -0.60 0.00 0.00 32.23 32.73 1xyk h LYS 204 CO -0.15 -0.06 -0.77 0.82 -3.45 0.00 0.00 179.45 175.84 1xyk h ILE 205 N -0.09 1.33 -0.24 2.00 2.04 -1.08 -3.17 117.51 118.30 1xyk h ILE 205 Ca 0.11 -2.05 0.05 0.00 1.00 0.00 0.00 64.86 63.97 1xyk h ILE 205 Cb 0.25 2.29 -0.05 0.00 -0.74 0.00 0.00 36.82 38.57 1xyk h ILE 205 CO -0.25 0.63 -0.11 -0.03 0.00 0.00 0.00 178.15 178.38 1xyk h MET 206 N 0.27 -0.08 -0.25 2.37 4.05 -0.48 -1.60 114.93 119.22 1xyk h MET 206 Ca -0.08 0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.39 1xyk h MET 206 Cb 1.43 0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 32.20 1xyk h MET 206 CO 0.16 -0.05 -0.04 1.49 0.23 0.00 0.00 176.91 178.69 1xyk h GLU 207 N -0.08 0.02 -0.68 0.39 4.81 -1.24 -0.49 114.58 117.31 1xyk h GLU 207 Ca 0.13 -0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.48 1xyk h GLU 207 Cb 0.27 -0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.56 1xyk h GLU 207 CO -0.29 0.01 0.24 0.00 -0.73 0.00 0.00 179.01 178.24 1xyk h ARG 208 N 0.02 0.38 -0.03 1.92 -0.00 -1.28 0.32 114.38 115.71 1xyk h ARG 208 Ca 0.12 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.98 59.54 1xyk h ARG 208 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 29.97 30.06 1xyk h ARG 208 CO -0.24 0.25 -0.11 0.28 0.00 0.00 0.00 179.97 180.16 1xyk h VAL 209 N 0.39 1.47 -0.06 2.04 2.07 -1.07 -1.48 116.25 119.62 1xyk h VAL 209 Ca 0.36 -1.55 -0.05 0.00 0.82 0.00 0.00 66.70 66.28 1xyk h VAL 209 Cb 0.52 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 1xyk h VAL 209 CO -0.38 0.42 -0.19 0.58 0.02 0.00 0.00 177.57 178.02 1xyk h VAL 210 N -0.45 1.17 0.10 2.57 2.07 -0.65 0.12 116.25 121.19 1xyk h VAL 210 Ca -0.00 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1xyk h VAL 210 Cb 0.74 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1xyk h VAL 210 CO 0.02 0.23 -0.05 -0.08 0.02 0.00 0.00 177.57 177.72 1xyk h GLU 211 N 0.08 -0.13 -0.68 1.57 4.81 -0.37 -1.72 114.58 118.15 1xyk h GLU 211 Ca 0.02 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1xyk h GLU 211 Cb 0.40 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1xyk h GLU 211 CO 0.03 0.26 0.21 0.37 -0.73 0.00 0.00 179.01 179.14 1xyk h GLN 212 N -0.56 1.04 -0.99 1.92 4.15 -0.89 -1.58 115.11 118.19 1xyk h GLN 212 Ca -0.01 -0.21 0.04 0.00 0.77 0.00 0.00 58.65 59.23 1xyk h GLN 212 Cb 0.45 -0.16 -0.06 0.00 0.21 0.00 0.00 27.48 27.93 1xyk h GLN 212 CO 0.02 0.89 0.65 0.52 -1.93 0.00 0.00 178.83 178.98 1xyk h MET 213 N 1.00 1.21 0.13 1.69 2.86 -0.76 0.13 114.93 121.19 1xyk h MET 213 Ca 0.22 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.80 1xyk h MET 213 Cb 0.29 -0.27 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1xyk h MET 213 CO -0.01 0.80 -0.25 0.00 1.06 0.00 0.00 176.91 178.51 1xyk h VAL 215 N -0.46 0.93 0.00 0.00 2.07 -1.02 -1.47 116.25 116.31 1xyk h VAL 215 Ca 0.03 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 1xyk h VAL 215 Cb 0.48 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1xyk h VAL 215 CO -0.14 0.01 -0.21 0.74 0.02 0.00 0.00 177.57 177.99 1xyk h THR 216 N 0.05 0.84 -0.02 2.57 2.02 -0.54 -0.26 112.91 117.56 1xyk h THR 216 Ca 0.05 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 1xyk h THR 216 Cb 0.06 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1xyk h THR 216 CO -0.09 0.21 0.01 -0.61 0.37 0.00 0.00 175.52 175.41 1xyk h GLN 217 N 0.00 0.04 -0.61 6.66 -0.00 0.45 -3.23 115.11 118.43 1xyk h GLN 217 Ca -0.00 -0.01 -0.06 0.00 -0.00 0.00 0.00 58.65 58.58 1xyk h GLN 217 Cb 0.47 -0.01 -0.03 0.00 0.00 0.00 0.00 27.48 27.91 1xyk h GLN 217 CO 0.03 0.21 0.13 1.88 0.00 0.00 0.00 178.83 181.08 1xyk h TYR 218 N -0.14 0.99 -0.21 3.99 -1.99 -0.15 -1.56 116.97 117.90 1xyk h TYR 218 Ca 0.01 -0.11 0.06 0.00 2.00 0.00 0.00 58.73 60.69 1xyk h TYR 218 Cb 0.19 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 38.63 1xyk h TYR 218 CO -0.01 0.83 0.24 1.96 -0.00 0.00 0.00 178.16 181.17 1xyk h GLN 219 N 0.91 0.00 -0.03 4.88 1.08 -1.12 0.30 115.11 121.13 1xyk h GLN 219 Ca 0.19 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.36 1xyk h GLN 219 Cb 0.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1xyk h GLN 219 CO 0.00 0.00 -0.12 0.87 -0.95 0.00 0.00 178.83 178.63 1xyk h LYS 220 N 0.00 0.13 0.00 1.46 1.57 -1.34 -3.30 116.57 115.09 1xyk h LYS 220 Ca 0.10 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xyk h LYS 220 Cb 0.57 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1xyk h LYS 220 CO -0.00 0.75 -0.11 0.39 -0.57 0.00 0.00 179.45 179.91 1xyk n GLU 221 N -4.64 0.00 0.32 3.15 1.02 -1.08 -4.61 120.64 114.80 1xyk n GLU 221 Ca -0.09 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.93 1xyk n GLU 221 Cb 0.39 -0.35 -0.06 0.00 -0.02 0.00 0.00 31.44 31.39 1xyk n GLU 221 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1xyk h SER 222 N 0.00 -0.70 0.69 1.62 0.02 -1.55 -2.84 113.55 110.79 1xyk h SER 222 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1xyk h SER 222 Cb 0.11 0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1xyk h SER 222 CO 0.00 -0.44 0.00 -0.62 -1.14 0.00 0.00 176.83 174.63 1xyk n GLU 223 N -4.57 0.06 0.00 3.45 4.71 0.97 -1.08 120.64 124.18 1xyk n GLU 223 Ca -0.10 0.12 0.11 0.00 -0.01 0.00 0.00 57.16 57.28 1xyk n GLU 223 Cb 0.33 -1.50 0.55 0.00 -1.01 0.00 0.00 31.44 29.81 1xyk n GLU 223 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1xyk n ALA 224 N -1.46 2.14 0.01 0.62 0.00 -1.11 -3.19 120.51 117.51 1xyk n ALA 224 Ca 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 53.44 53.39 1xyk n ALA 224 Cb 0.24 -1.37 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 1xyk n ALA 224 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1xyk n TYR 225 N -1.35 0.00 1.28 0.00 9.36 -0.27 -4.73 117.16 121.45 1xyk n TYR 225 Ca 0.09 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.46 1xyk n TYR 225 Cb 0.21 -0.06 0.68 0.00 -0.63 0.00 0.00 39.34 39.54 1xyk n TYR 225 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1xyk n TYR 226 N -3.29 0.00 -4.09 2.98 4.02 -0.24 -4.87 117.16 111.67 1xyk n TYR 226 Ca -0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.75 1xyk n TYR 226 Cb 0.32 -0.34 -0.07 0.00 -0.02 0.00 0.00 39.34 39.23 1xyk n TYR 226 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1xyk s GLN 227 N -2.71 1.42 0.00 -0.72 -1.52 -1.19 -5.03 119.66 109.91 1xyk s GLN 227 Ca 0.23 -1.45 0.00 0.00 -1.95 0.00 0.00 55.36 52.19 1xyk s GLN 227 Cb 0.20 0.38 0.00 0.00 -0.22 0.00 0.00 33.01 33.37 1xyk s GLN 227 CO 0.49 -0.54 0.57 0.54 -0.25 0.00 0.00 175.29 176.10 1xyk n ARG 228 N -0.35 0.58 -0.11 2.91 5.12 -1.25 -4.40 116.66 119.16 1xyk n ARG 228 Ca 0.00 -0.73 -0.07 0.00 -1.93 0.00 0.00 57.85 55.13 1xyk n ARG 228 Cb 0.64 -0.84 0.01 0.00 -1.16 0.00 0.00 32.46 31.11 1xyk n ARG 228 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1xyk h GLY 229 N 0.00 0.51 -6.39 -0.13 0.00 -1.96 -3.47 103.07 91.63 1xyk h GLY 229 Ca 0.00 -0.14 -0.48 0.00 0.00 0.00 0.00 47.33 46.71 1xyk h GLY 229 CO 0.00 0.11 -0.89 0.00 0.00 0.00 0.00 176.54 175.76 1xyk n ALA 230 N -2.26 -2.09 0.51 3.60 0.00 -1.26 -5.20 120.51 113.80 1xyk n ALA 230 Ca 0.01 -0.25 0.04 0.00 0.00 0.00 0.00 53.44 53.24 1xyk n ALA 230 Cb 0.08 -1.93 0.24 0.00 0.00 0.00 0.00 19.45 17.84 1xyk n ALA 230 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37