#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 -0.67 0.00 1.55 0.11 -1.26 -5.05 120.40 115.07 1xyk s VAL 122 Ca 0.00 -0.10 0.00 0.00 -2.93 0.00 0.00 61.98 58.95 1xyk s VAL 122 Cb 0.00 -0.88 0.00 0.00 -1.53 0.00 0.00 36.38 33.97 1xyk s VAL 122 CO 0.00 -0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.25 1xyk n GLY 123 N 5.37 0.54 0.00 6.54 0.00 -1.26 -5.11 105.19 111.28 1xyk n GLY 123 Ca -0.02 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 0.52 3.81 -0.02 0.00 -1.26 -5.14 105.19 103.10 1xyk n GLY 124 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1xyk n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xyk s LEU 125 N 0.00 3.59 0.00 0.99 1.43 -1.26 -5.02 118.68 118.41 1xyk s LEU 125 Ca 0.00 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1xyk s LEU 125 Cb 0.00 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1xyk s LEU 125 CO 0.00 -0.22 0.48 0.61 0.23 0.00 0.00 176.35 177.45 1xyk n GLY 126 N -1.25 1.24 0.37 -3.19 0.00 -1.26 -4.79 105.19 96.31 1xyk n GLY 126 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.07 0.51 3.69 -0.02 0.00 -1.26 -5.07 105.19 103.10 1xyk n GLY 127 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1xyk n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyk s TYR 128 N -2.22 1.90 0.97 1.61 1.51 -1.26 -5.05 117.35 114.81 1xyk s TYR 128 Ca 0.00 1.64 -0.16 0.00 -1.01 0.00 0.00 57.07 57.54 1xyk s TYR 128 Cb 0.00 -3.23 0.21 0.00 -0.11 0.00 0.00 41.96 38.82 1xyk s TYR 128 CO 0.00 -2.61 1.33 -1.64 -1.11 0.00 0.00 175.55 171.52 1xyk s MET 129 N -4.72 0.58 -0.18 -0.62 -1.94 -0.07 -4.89 119.30 107.45 1xyk s MET 129 Ca 0.65 -0.44 -0.04 0.00 -1.71 0.00 0.00 55.69 54.15 1xyk s MET 129 Cb -0.21 -1.84 0.06 0.00 2.01 0.00 0.00 34.83 34.84 1xyk s MET 129 CO 0.58 -2.45 0.06 -1.17 -0.01 0.00 0.00 175.02 172.02 1xyk s LEU 130 N -5.91 0.77 1.27 -0.03 2.96 -1.26 -3.49 118.68 112.99 1xyk s LEU 130 Ca 0.75 -0.69 -0.17 0.00 -0.22 0.00 0.00 54.13 53.79 1xyk s LEU 130 Cb -0.03 -0.43 0.32 0.00 0.50 0.00 0.00 46.19 46.55 1xyk s LEU 130 CO 0.53 -0.32 1.00 -0.83 -1.32 0.00 0.00 176.35 175.41 1xyk s GLY 131 N 1.99 1.49 1.08 7.98 0.00 -0.28 -5.00 107.32 114.59 1xyk s GLY 131 Ca 0.01 -0.52 -0.18 0.00 0.00 0.00 0.00 44.72 44.02 1xyk s GLY 131 CO -0.08 0.33 1.23 -1.35 0.00 0.00 0.00 173.10 173.23 1xyk s SER 132 N -2.98 2.02 -0.28 1.64 1.04 -1.26 -4.64 113.70 109.24 1xyk s SER 132 Ca 0.69 0.39 -0.09 0.00 0.48 0.00 0.00 55.95 57.42 1xyk s SER 132 Cb -0.18 -0.49 -0.02 0.00 0.10 0.00 0.00 66.02 65.42 1xyk s SER 132 CO 0.61 -3.42 0.12 0.00 0.98 0.00 0.00 173.24 171.52 1xyk s ALA 133 N -3.51 3.27 0.31 5.32 0.00 -1.26 -4.36 121.76 121.53 1xyk s ALA 133 Ca 0.73 -1.21 0.10 0.00 0.00 0.00 0.00 51.96 51.58 1xyk s ALA 133 Cb -0.06 -2.26 -0.06 0.00 0.00 0.00 0.00 23.12 20.75 1xyk s ALA 133 CO 0.54 -0.64 -0.13 0.00 0.00 0.00 0.00 175.76 175.52 1xyk s MET 134 N 1.64 1.72 0.52 0.00 0.23 -1.11 -5.05 119.30 117.26 1xyk s MET 134 Ca 0.06 -1.85 -0.21 0.00 -1.03 0.00 0.00 55.69 52.66 1xyk s MET 134 Cb -0.16 -1.66 -0.06 0.00 -1.53 0.00 0.00 34.83 31.43 1xyk s MET 134 CO 0.06 0.21 1.19 0.45 -2.03 0.00 0.00 175.02 174.90 1xyk s SER 135 N -3.54 5.71 -0.48 -1.18 0.15 -1.26 -4.86 113.70 108.24 1xyk s SER 135 Ca 0.31 2.36 -0.45 0.00 0.70 0.00 0.00 55.95 58.87 1xyk s SER 135 Cb -0.00 -2.60 -0.19 0.00 -1.71 0.00 0.00 66.02 61.52 1xyk s SER 135 CO 0.15 -1.24 1.88 -2.11 1.20 0.00 0.00 173.24 173.12 1xyk n ARG 136 N -1.01 0.13 -2.09 5.44 1.85 -1.26 -4.90 116.66 114.83 1xyk n ARG 136 Ca 0.10 0.04 -0.40 0.00 -1.00 0.00 0.00 57.85 56.59 1xyk n ARG 136 Cb 0.49 -1.59 -0.03 0.00 -1.05 0.00 0.00 32.46 30.28 1xyk n ARG 136 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1xyk s PRO 137 N 4.54 2.97 -0.50 2.89 0.04 -1.26 -4.95 135.00 138.73 1xyk s PRO 137 Ca 1.11 0.85 -0.29 0.00 0.04 0.00 0.00 61.00 62.72 1xyk s PRO 137 Cb -1.44 -4.28 0.03 0.00 0.04 0.00 0.00 34.50 28.85 1xyk s PRO 137 CO 0.72 -2.32 1.18 -1.17 0.04 0.00 0.00 177.00 175.45 1xyk s LEU 138 N 7.88 3.59 -0.23 -3.56 1.98 -1.26 -4.84 118.68 122.24 1xyk s LEU 138 Ca 0.69 0.42 -0.24 0.00 -2.89 0.00 0.00 54.13 52.11 1xyk s LEU 138 Cb -0.15 -3.47 -0.01 0.00 0.66 0.00 0.00 46.19 43.22 1xyk s LEU 138 CO 0.26 -1.32 0.78 -0.63 -1.89 0.00 0.00 176.35 173.54 1xyk s ILE 139 N 4.67 4.88 -0.90 6.68 -1.09 -1.26 -4.98 121.20 129.19 1xyk s ILE 139 Ca 0.48 1.48 -0.26 0.00 -2.23 0.00 0.00 60.65 60.12 1xyk s ILE 139 Cb -0.08 -4.08 -0.21 0.00 -1.58 0.00 0.00 42.46 36.51 1xyk s ILE 139 CO 0.31 -0.02 1.96 0.00 -1.23 0.00 0.00 174.94 175.95 1xyk n HIS 140 N 5.74 1.35 0.25 3.97 1.44 -1.26 -4.68 115.22 122.02 1xyk n HIS 140 Ca 0.04 -0.73 0.08 0.00 -2.01 0.00 0.00 57.72 55.10 1xyk n HIS 140 Cb 0.48 -2.22 0.62 0.00 0.12 0.00 0.00 29.99 28.99 1xyk n HIS 140 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1xyk h PHE 141 N 10.50 0.00 0.00 -1.40 0.04 -1.97 -3.46 116.94 120.65 1xyk h PHE 141 Ca 0.14 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.91 1xyk h PHE 141 Cb 0.90 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.05 1xyk h PHE 141 CO 1.08 0.13 0.00 0.41 -0.60 0.00 0.00 178.31 179.33 1xyk n GLY 142 N -1.02 0.40 3.43 -1.45 0.00 -1.26 -5.00 105.19 100.29 1xyk n GLY 142 Ca -0.02 0.00 -0.30 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 -2.19 -0.09 -0.19 1.61 -0.87 -1.26 -5.03 114.94 106.91 1xyk s ASN 143 Ca 0.00 0.84 -0.15 0.00 -1.57 0.00 0.00 52.86 51.97 1xyk s ASN 143 Cb 0.00 -1.20 -0.08 0.00 -0.02 0.00 0.00 41.25 39.95 1xyk s ASN 143 CO 0.00 -4.77 -0.21 -0.67 -2.57 0.00 0.00 177.10 168.88 1xyk n ASP 144 N -5.23 1.89 0.23 -1.22 -0.08 -1.26 -4.42 116.55 106.46 1xyk n ASP 144 Ca 0.12 0.44 -0.18 0.00 -1.51 0.00 0.00 54.79 53.66 1xyk n ASP 144 Cb 0.59 -0.83 -0.10 0.00 2.34 0.00 0.00 41.12 43.12 1xyk n ASP 144 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1xyk h TYR 145 N -1.00 -1.46 -0.95 -0.67 3.20 -1.98 0.22 116.97 114.33 1xyk h TYR 145 Ca -0.19 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.74 1xyk h TYR 145 Cb 1.01 0.59 -0.06 0.00 1.54 0.00 0.00 36.73 39.81 1xyk h TYR 145 CO -0.22 -0.65 0.62 0.93 -1.64 0.00 0.00 178.16 177.20 1xyk h GLU 146 N -0.93 1.16 -0.20 1.82 5.08 -2.00 0.41 114.58 119.93 1xyk h GLU 146 Ca -0.04 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1xyk h GLU 146 Cb 0.84 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 1xyk h GLU 146 CO -0.14 0.77 -0.11 0.22 -1.00 0.00 0.00 179.01 178.74 1xyk h ASP 147 N 1.20 0.45 -0.36 1.42 1.82 -1.50 -3.20 116.42 116.24 1xyk h ASP 147 Ca 0.38 -0.42 -0.05 0.00 -0.39 0.00 0.00 57.03 56.54 1xyk h ASP 147 Cb 0.01 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 39.88 1xyk h ASP 147 CO -0.12 0.77 0.01 -0.09 -1.61 0.00 0.00 179.24 178.20 1xyk h ARG 148 N 0.12 0.62 -1.03 0.28 2.43 -0.38 -1.19 114.38 115.23 1xyk h ARG 148 Ca 0.04 -0.19 0.26 0.00 -0.81 0.00 0.00 59.98 59.28 1xyk h ARG 148 Cb 0.61 -0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 30.01 1xyk h ARG 148 CO 0.03 0.72 0.67 -0.92 -1.51 0.00 0.00 179.97 178.96 1xyk h TYR 149 N 0.44 0.62 0.00 2.20 3.20 -0.91 -0.26 116.97 122.26 1xyk h TYR 149 Ca 0.10 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 1xyk h TYR 149 Cb 0.43 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1xyk h TYR 149 CO 0.03 0.07 -1.65 0.66 -1.64 0.00 0.00 178.16 175.64 1xyk n TYR 150 N -4.60 0.00 0.27 -3.82 4.01 -1.23 -4.28 117.16 107.51 1xyk n TYR 150 Ca 0.25 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 58.16 1xyk n TYR 150 Cb 0.87 -0.36 0.84 0.00 -0.31 0.00 0.00 39.34 40.38 1xyk n TYR 150 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xyk h ARG 151 N 0.00 0.00 -0.74 -0.72 2.47 -0.03 0.15 114.38 115.51 1xyk h ARG 151 Ca -0.07 0.00 0.11 0.00 -1.26 0.00 0.00 59.98 58.76 1xyk h ARG 151 Cb 0.85 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.09 1xyk h ARG 151 CO 0.00 0.00 0.35 0.93 0.56 0.00 0.00 179.97 181.82 1xyk h GLU 152 N 0.00 0.55 -0.08 0.04 5.08 -1.28 -3.40 114.58 115.49 1xyk h GLU 152 Ca 0.05 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.15 1xyk h GLU 152 Cb 0.67 -0.12 -0.17 0.00 0.50 0.00 0.00 28.75 29.63 1xyk h GLU 152 CO -0.00 0.36 -0.42 0.09 -1.00 0.00 0.00 179.01 178.04 1xyk n ASN 153 N -4.90 -1.62 -0.04 1.42 3.02 0.14 -5.03 115.26 108.25 1xyk n ASN 153 Ca 0.13 -2.48 0.20 0.00 -0.03 0.00 0.00 54.58 52.40 1xyk n ASN 153 Cb 0.33 0.88 0.67 0.00 -0.61 0.00 0.00 39.78 41.06 1xyk n ASN 153 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1xyk h MET 154 N 2.08 0.05 0.00 3.52 2.86 -1.04 -1.67 114.93 120.73 1xyk h MET 154 Ca -0.27 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 1xyk h MET 154 Cb 1.29 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1xyk h MET 154 CO -0.02 0.04 0.18 0.10 1.06 0.00 0.00 176.91 178.26 1xyk h TYR 155 N 0.05 0.00 0.00 -0.22 -0.00 -1.96 -2.16 116.97 112.68 1xyk h TYR 155 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.01 1xyk h TYR 155 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.78 1xyk h TYR 155 CO -0.00 0.00 0.00 0.54 -0.00 0.00 0.00 178.16 178.70 1xyk n ARG 156 N -2.61 0.10 -1.78 0.10 1.74 -0.63 -4.83 116.66 108.75 1xyk n ARG 156 Ca -0.02 0.20 -0.31 0.00 -0.77 0.00 0.00 57.85 56.96 1xyk n ARG 156 Cb 0.22 -1.65 0.04 0.00 -1.02 0.00 0.00 32.46 30.05 1xyk n ARG 156 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1xyk s TYR 157 N -3.09 3.36 0.42 -1.55 2.02 -0.82 -5.01 117.35 112.69 1xyk s TYR 157 Ca 0.09 1.24 -0.26 0.00 -0.37 0.00 0.00 57.07 57.78 1xyk s TYR 157 Cb 0.13 -2.89 -0.08 0.00 -0.40 0.00 0.00 41.96 38.72 1xyk s TYR 157 CO 0.45 -1.05 1.33 -1.25 -1.57 0.00 0.00 175.55 173.46 1xyk s PRO 158 N -5.20 3.85 -0.25 -1.71 0.04 -1.26 -4.95 135.00 125.53 1xyk s PRO 158 Ca 0.57 2.21 0.09 0.00 0.04 0.00 0.00 61.00 63.92 1xyk s PRO 158 Cb -0.12 -2.70 0.45 0.00 0.04 0.00 0.00 34.50 32.17 1xyk s PRO 158 CO 0.54 -0.61 1.20 -0.40 0.04 0.00 0.00 177.00 177.77 1xyk n ASP 159 N -0.02 3.52 -3.87 6.66 5.75 -1.26 -4.98 116.55 122.34 1xyk n ASP 159 Ca 0.04 -3.72 -0.11 0.00 -0.01 0.00 0.00 54.79 50.99 1xyk n ASP 159 Cb 0.43 -0.42 -0.10 0.00 -1.03 0.00 0.00 41.12 40.01 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 -3.39 0.52 0.25 0.11 -0.21 -1.26 -2.75 119.66 112.93 1xyk s GLN 160 Ca 0.45 -0.42 0.02 0.00 0.02 0.00 0.00 55.36 55.43 1xyk s GLN 160 Cb 0.39 0.21 -0.05 0.00 1.00 0.00 0.00 33.01 34.56 1xyk s GLN 160 CO -0.01 -0.13 0.05 0.14 -2.12 0.00 0.00 175.29 173.23 1xyk s VAL 161 N -1.52 0.80 -0.05 1.09 -7.23 -1.26 -4.95 120.40 107.27 1xyk s VAL 161 Ca -0.14 -2.01 0.03 0.00 -1.81 0.00 0.00 61.98 58.06 1xyk s VAL 161 Cb -0.07 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.36 1xyk s VAL 161 CO 0.01 -0.14 -0.13 -0.31 -0.31 0.00 0.00 175.10 174.22 1xyk s TYR 162 N -3.58 1.42 0.29 2.82 2.02 -1.26 -1.12 117.35 117.94 1xyk s TYR 162 Ca 0.33 -0.45 -0.05 0.00 -0.37 0.00 0.00 57.07 56.53 1xyk s TYR 162 Cb 0.07 -1.00 0.02 0.00 -0.40 0.00 0.00 41.96 40.65 1xyk s TYR 162 CO 0.11 -0.20 0.48 2.48 -1.57 0.00 0.00 175.55 176.86 1xyk n TYR 163 N 3.46 -1.57 -4.56 2.71 4.11 -1.23 -4.72 117.16 115.36 1xyk n TYR 163 Ca -0.20 -1.74 -0.26 0.00 -0.00 0.00 0.00 57.90 55.71 1xyk n TYR 163 Cb 0.53 0.56 -0.10 0.00 -0.00 0.00 0.00 39.34 40.32 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 -2.43 1.86 -0.54 -3.48 3.00 -1.26 -0.90 118.95 115.21 1xyk s ARG 164 Ca 0.19 -2.07 -0.26 0.00 0.00 0.00 0.00 55.73 53.59 1xyk s ARG 164 Cb -0.02 -1.22 -0.08 0.00 0.00 0.00 0.00 34.95 33.63 1xyk s ARG 164 CO 0.14 -0.18 2.40 -1.25 0.00 0.00 0.00 175.30 176.41 1xyk s PRO 165 N -3.80 2.04 0.05 3.54 0.04 -1.26 -4.78 135.00 130.83 1xyk s PRO 165 Ca 0.31 1.26 -0.13 0.00 0.04 0.00 0.00 61.00 62.49 1xyk s PRO 165 Cb 0.08 -4.61 -0.31 0.00 0.04 0.00 0.00 34.50 29.70 1xyk s PRO 165 CO 0.15 -3.44 1.08 -0.24 0.04 0.00 0.00 177.00 174.59 1xyk h VAL 166 N 7.68 1.32 -3.47 -0.36 3.04 -2.05 -3.51 116.25 118.90 1xyk h VAL 166 Ca -0.21 -2.67 0.34 0.00 -1.01 0.00 0.00 66.70 63.16 1xyk h VAL 166 Cb 1.23 2.88 -0.19 0.00 -2.01 0.00 0.00 31.29 33.20 1xyk h VAL 166 CO 1.14 0.80 -1.23 0.47 -1.01 0.00 0.00 177.57 177.74 1xyk n ASP 167 N -3.71 -7.69 -1.18 3.17 8.00 -1.26 -5.05 116.55 108.83 1xyk n ASP 167 Ca -0.14 1.41 0.10 0.00 0.71 0.00 0.00 54.79 56.87 1xyk n ASP 167 Cb 1.04 -4.92 -0.02 0.00 -0.02 0.00 0.00 41.12 37.20 1xyk n ASP 167 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1xyk n GLN 168 N -4.33 -1.45 0.00 -1.24 -0.06 -1.26 -4.85 117.38 104.19 1xyk n GLN 168 Ca -0.09 0.95 0.00 0.00 -2.00 0.00 0.00 57.00 55.86 1xyk n GLN 168 Cb 0.67 -1.77 0.00 0.00 -4.06 0.00 0.00 30.24 25.09 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 -3.06 0.00 0.00 3.69 4.01 -1.26 -4.83 117.16 115.71 1xyk n TYR 169 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1xyk n TYR 169 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 1xyk n TYR 169 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1xyk n SER 170 N 1.88 0.00 -3.53 7.72 7.64 -1.26 -4.16 113.62 121.91 1xyk n SER 170 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 1xyk n SER 170 Cb 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.08 1xyk n SER 170 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1xyk s ASN 171 N 0.00 0.80 0.00 6.43 2.20 -1.26 -5.04 114.94 118.07 1xyk s ASN 171 Ca 0.00 0.16 0.00 0.00 -0.94 0.00 0.00 52.86 52.08 1xyk s ASN 171 Cb 0.00 0.63 0.00 0.00 -2.00 0.00 0.00 41.25 39.88 1xyk s ASN 171 CO 0.00 -0.29 0.00 1.67 -2.94 0.00 0.00 177.10 175.54 1xyk n GLN 172 N 5.34 0.00 0.03 3.55 -0.06 -1.26 -5.12 117.38 119.86 1xyk n GLN 172 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.95 1xyk n GLN 172 Cb 0.50 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.68 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 0.39 -0.12 1.69 4.05 -1.26 -4.88 115.26 115.13 1xyk n ASN 173 Ca 0.00 0.09 0.14 0.00 0.45 0.00 0.00 54.58 55.26 1xyk n ASN 173 Cb 0.00 -0.09 0.51 0.00 1.23 0.00 0.00 39.78 41.43 1xyk n ASN 173 CO 0.00 0.00 0.00 -1.13 -3.05 0.00 0.00 177.26 173.08 1xyk h ASN 174 N 0.00 0.36 -0.03 1.20 -0.00 -2.00 -2.82 115.58 112.29 1xyk h ASN 174 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 1xyk h ASN 174 Cb 0.00 -0.06 -0.01 0.00 -0.00 0.00 0.00 38.32 38.25 1xyk h ASN 174 CO 0.00 0.20 -0.06 2.19 -0.00 0.00 0.00 177.43 179.76 1xyk h PHE 175 N 0.39 -0.18 -0.20 0.67 -0.00 -1.97 0.20 116.94 115.84 1xyk h PHE 175 Ca 0.32 0.01 0.03 0.00 -0.00 0.00 0.00 57.97 58.33 1xyk h PHE 175 Cb 0.72 0.08 -0.03 0.00 -0.00 0.00 0.00 35.95 36.73 1xyk h PHE 175 CO -0.00 -0.06 0.04 -0.39 -0.00 0.00 0.00 178.31 177.90 1xyk h VAL 176 N -0.06 0.91 -0.81 0.88 -1.51 -1.90 -2.23 116.25 111.54 1xyk h VAL 176 Ca 0.01 -0.04 0.08 0.00 -1.23 0.00 0.00 66.70 65.52 1xyk h VAL 176 Cb 0.07 0.78 -0.07 0.00 -2.13 0.00 0.00 31.29 29.94 1xyk h VAL 176 CO -0.05 0.02 0.47 -0.09 -1.23 0.00 0.00 177.57 176.69 1xyk h ARG 177 N 0.12 0.79 0.08 5.19 1.12 -1.20 0.31 114.38 120.79 1xyk h ARG 177 Ca 0.09 -0.05 -0.26 0.00 -1.11 0.00 0.00 59.98 58.66 1xyk h ARG 177 Cb 0.08 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 29.86 1xyk h ARG 177 CO -0.12 0.52 -1.20 0.22 -3.11 0.00 0.00 179.97 176.28 1xyk h ASP 178 N 0.81 0.27 -0.49 -3.80 3.58 -0.59 -1.04 116.42 115.16 1xyk h ASP 178 Ca 0.38 -0.30 -0.06 0.00 0.42 0.00 0.00 57.03 57.46 1xyk h ASP 178 Cb 0.30 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 1xyk h ASP 178 CO -0.22 1.24 0.06 0.00 -2.88 0.00 0.00 179.24 177.44 1xyk h VAL 180 N 0.69 0.91 -0.09 0.00 2.07 -0.42 0.27 116.25 119.68 1xyk h VAL 180 Ca 0.15 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1xyk h VAL 180 Cb 0.42 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 1xyk h VAL 180 CO 0.01 0.07 -0.23 0.78 0.02 0.00 0.00 177.57 178.22 1xyk h ASN 181 N 0.37 -0.71 -0.38 0.57 2.35 -0.89 0.43 115.58 117.31 1xyk h ASN 181 Ca 0.20 0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 56.01 1xyk h ASN 181 Cb 0.15 0.31 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1xyk h ASN 181 CO -0.17 -0.29 0.07 0.40 -1.65 0.00 0.00 177.43 175.78 1xyk h ILE 182 N -0.32 1.24 -0.14 2.81 1.08 -0.72 0.14 117.51 121.59 1xyk h ILE 182 Ca 0.09 -0.84 -0.03 0.00 -0.39 0.00 0.00 64.86 63.70 1xyk h ILE 182 Cb 0.45 1.05 -0.00 0.00 -3.07 0.00 0.00 36.82 35.24 1xyk h ILE 182 CO -0.27 0.28 -0.02 0.74 -0.69 0.00 0.00 178.15 178.20 1xyk h THR 183 N 0.47 1.27 -0.81 -0.27 2.02 -0.78 0.05 112.91 114.86 1xyk h THR 183 Ca 0.12 -0.90 0.01 0.00 0.77 0.00 0.00 66.41 66.40 1xyk h THR 183 Cb 0.35 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 1xyk h THR 183 CO 0.01 0.26 0.53 1.62 0.37 0.00 0.00 175.52 178.31 1xyk h VAL 184 N -0.03 1.21 -0.60 3.16 3.04 -0.89 -2.39 116.25 119.76 1xyk h VAL 184 Ca 0.04 -0.40 0.03 0.00 -1.01 0.00 0.00 66.70 65.36 1xyk h VAL 184 Cb 0.41 0.03 -0.03 0.00 -2.01 0.00 0.00 31.29 29.69 1xyk h VAL 184 CO 0.01 0.21 0.40 0.11 -1.01 0.00 0.00 177.57 177.29 1xyk h LYS 185 N 1.10 0.69 0.00 4.17 1.57 -0.20 0.26 116.57 124.16 1xyk h LYS 185 Ca 0.30 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 1xyk h LYS 185 Cb -0.11 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 1xyk h LYS 185 CO -0.06 0.46 -0.28 1.96 -0.57 0.00 0.00 179.45 180.95 1xyk h GLN 186 N 0.71 0.00 0.01 3.15 4.20 -0.48 -3.21 115.11 119.49 1xyk h GLN 186 Ca 0.24 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.59 1xyk h GLN 186 Cb 0.08 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.81 1xyk h GLN 186 CO -0.06 0.28 -2.01 0.72 -0.67 0.00 0.00 178.83 177.09 1xyk n HIS 187 N -3.42 0.51 -0.26 2.96 8.25 -0.42 -3.38 115.22 119.46 1xyk n HIS 187 Ca 0.00 0.19 0.07 0.00 -0.26 0.00 0.00 57.72 57.72 1xyk n HIS 187 Cb 0.47 -1.05 0.20 0.00 1.12 0.00 0.00 29.99 30.73 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 -0.79 0.51 -0.08 1.59 1.35 -0.68 -0.05 112.91 114.76 1xyk h THR 188 Ca -0.53 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 65.22 1xyk h THR 188 Cb 1.57 0.19 -0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1xyk h THR 188 CO -0.26 0.05 0.02 0.58 -0.25 0.00 0.00 175.52 175.66 1xyk h VAL 189 N 0.29 1.19 -0.73 6.82 2.07 -1.73 -0.07 116.25 124.08 1xyk h VAL 189 Ca 0.43 -0.57 0.14 0.00 0.82 0.00 0.00 66.70 67.53 1xyk h VAL 189 Cb 0.75 1.42 -0.14 0.00 -1.52 0.00 0.00 31.29 31.80 1xyk h VAL 189 CO -0.51 0.16 -0.22 0.74 0.02 0.00 0.00 177.57 177.76 1xyk h THR 190 N -0.08 0.23 0.00 2.57 2.02 -1.06 0.13 112.91 116.72 1xyk h THR 190 Ca 0.02 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.09 1xyk h THR 190 Cb 0.23 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 1xyk h THR 190 CO -0.00 0.00 -1.02 0.74 0.37 0.00 0.00 175.52 175.61 1xyk h THR 191 N -0.03 0.51 0.00 3.16 2.02 -1.19 -2.79 112.91 114.59 1xyk h THR 191 Ca 0.34 -1.87 -0.04 0.00 0.77 0.00 0.00 66.41 65.61 1xyk h THR 191 Cb 0.55 2.07 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 1xyk h THR 191 CO -0.76 0.29 -0.20 0.74 0.37 0.00 0.00 175.52 175.96 1xyk h THR 192 N 0.00 0.88 0.00 3.16 2.02 -0.33 0.27 112.91 118.90 1xyk h THR 192 Ca -0.08 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.35 1xyk h THR 192 Cb 1.41 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 69.26 1xyk h THR 192 CO 0.04 0.19 0.00 0.41 0.37 0.00 0.00 175.52 176.53 1xyk n THR 193 N -3.92 0.67 0.00 3.16 -1.04 0.39 -4.27 114.28 109.26 1xyk n THR 193 Ca -0.02 0.16 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 1xyk n THR 193 Cb 0.28 -0.84 0.00 0.00 -1.82 0.00 0.00 70.33 67.95 1xyk n THR 193 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1xyk n LYS 194 N -1.53 0.00 0.00 -2.82 4.76 -0.42 -5.10 118.16 113.05 1xyk n LYS 194 Ca 0.05 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.49 1xyk n LYS 194 Cb 0.23 -0.16 0.00 0.00 -1.84 0.00 0.00 35.03 33.26 1xyk n LYS 194 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xyk n GLY 195 N 2.70 -0.78 2.53 0.72 0.00 0.81 -5.11 105.19 106.06 1xyk n GLY 195 Ca 0.00 0.69 -0.14 0.00 0.00 0.00 0.00 46.02 46.57 1xyk n GLY 195 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xyk n GLU 196 N 0.00 0.39 -4.00 1.61 4.07 -1.10 -4.95 120.64 116.67 1xyk n GLU 196 Ca 0.00 -2.45 -0.11 0.00 -0.06 0.00 0.00 57.16 54.54 1xyk n GLU 196 Cb 0.00 2.12 -0.04 0.00 -0.06 0.00 0.00 31.44 33.46 1xyk n GLU 196 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1xyk s ASN 197 N -2.77 0.19 -0.26 4.31 3.84 -1.26 -4.81 114.94 114.18 1xyk s ASN 197 Ca 0.28 -1.10 -0.01 0.00 0.21 0.00 0.00 52.86 52.23 1xyk s ASN 197 Cb 0.01 0.64 0.03 0.00 -0.55 0.00 0.00 41.25 41.38 1xyk s ASN 197 CO 0.20 -1.24 -0.05 -0.36 -2.79 0.00 0.00 177.10 172.86 1xyk s PHE 198 N -3.57 3.11 0.32 0.43 0.08 -1.26 -5.09 117.98 112.00 1xyk s PHE 198 Ca 0.24 -1.64 -0.26 0.00 0.12 0.00 0.00 56.93 55.38 1xyk s PHE 198 Cb -0.01 -2.06 -0.10 0.00 -0.57 0.00 0.00 43.02 40.28 1xyk s PHE 198 CO 0.12 -0.75 0.94 0.95 -0.10 0.00 0.00 175.22 176.39 1xyk s THR 199 N 1.30 4.21 -2.00 0.64 -4.23 -1.26 -4.94 115.64 109.36 1xyk s THR 199 Ca -0.01 1.83 0.06 0.00 -1.18 0.00 0.00 61.69 62.39 1xyk s THR 199 Cb -0.17 -4.02 0.18 0.00 1.34 0.00 0.00 72.50 69.83 1xyk s THR 199 CO -0.04 0.15 0.84 1.21 -0.54 0.00 0.00 174.62 176.24 1xyk n GLU 200 N 0.57 0.20 0.03 3.99 2.13 -1.26 -1.53 120.64 124.78 1xyk n GLU 200 Ca 0.02 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.83 1xyk n GLU 200 Cb 0.50 -1.49 -0.00 0.00 0.27 0.00 0.00 31.44 30.72 1xyk n GLU 200 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1xyk n THR 201 N -0.99 0.88 -0.28 6.31 -1.04 -1.26 -4.07 114.28 113.82 1xyk n THR 201 Ca 0.05 0.27 0.13 0.00 -2.04 0.00 0.00 64.05 62.46 1xyk n THR 201 Cb 0.02 -1.59 0.39 0.00 -1.82 0.00 0.00 70.33 67.33 1xyk n THR 201 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1xyk h ASP 202 N -0.04 0.64 0.27 8.00 3.58 -1.97 0.21 116.42 127.11 1xyk h ASP 202 Ca -0.01 0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 1xyk h ASP 202 Cb 0.35 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.33 1xyk h ASP 202 CO -0.01 0.30 -0.15 0.24 -2.88 0.00 0.00 179.24 176.74 1xyk h MET 203 N 0.66 0.00 -0.04 0.28 2.86 -1.51 0.20 114.93 117.39 1xyk h MET 203 Ca 0.47 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 58.02 1xyk h MET 203 Cb 0.82 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 1xyk h MET 203 CO -0.23 0.15 -0.39 -0.22 1.06 0.00 0.00 176.91 177.28 1xyk h LYS 204 N 0.00 0.09 0.00 1.72 1.63 -1.10 -1.98 116.57 116.93 1xyk h LYS 204 Ca -0.00 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1xyk h LYS 204 Cb 0.33 -0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.95 1xyk h LYS 204 CO 0.02 0.47 -0.08 0.82 -3.45 0.00 0.00 179.45 177.23 1xyk h ILE 205 N 0.08 0.21 -0.95 2.00 2.04 -1.21 -3.36 117.51 116.32 1xyk h ILE 205 Ca 0.01 -1.17 0.06 0.00 1.00 0.00 0.00 64.86 64.75 1xyk h ILE 205 Cb 0.73 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 1xyk h ILE 205 CO 0.05 0.07 0.61 0.24 0.00 0.00 0.00 178.15 179.12 1xyk h MET 206 N -1.00 1.09 0.23 2.37 2.86 -0.68 -1.56 114.93 118.25 1xyk h MET 206 Ca -0.01 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1xyk h MET 206 Cb 0.19 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1xyk h MET 206 CO -0.00 0.72 -0.20 1.49 1.06 0.00 0.00 176.91 179.98 1xyk h GLU 207 N 1.13 -0.43 -0.69 1.72 4.81 -1.57 -0.67 114.58 118.88 1xyk h GLU 207 Ca 0.40 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.62 1xyk h GLU 207 Cb 0.12 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1xyk h GLU 207 CO -0.16 -0.29 0.26 0.00 -0.73 0.00 0.00 179.01 178.09 1xyk h ARG 208 N -0.45 1.03 -0.17 1.92 -0.00 -1.47 0.26 114.38 115.49 1xyk h ARG 208 Ca -0.01 -0.18 -0.06 0.00 -0.50 0.00 0.00 59.98 59.23 1xyk h ARG 208 Cb 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 29.97 30.21 1xyk h ARG 208 CO -0.03 0.85 -0.11 0.28 0.00 0.00 0.00 179.97 180.96 1xyk h VAL 209 N 1.00 1.32 -0.54 2.04 2.07 -1.17 0.11 116.25 121.09 1xyk h VAL 209 Ca 0.23 -1.20 -0.10 0.00 0.82 0.00 0.00 66.70 66.45 1xyk h VAL 209 Cb 0.22 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 1xyk h VAL 209 CO -0.02 0.36 -0.05 0.58 0.02 0.00 0.00 177.57 178.46 1xyk h VAL 210 N 0.05 1.27 0.27 2.57 2.07 -0.84 0.16 116.25 121.80 1xyk h VAL 210 Ca 0.03 -1.18 0.01 0.00 0.82 0.00 0.00 66.70 66.38 1xyk h VAL 210 Cb 0.61 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1xyk h VAL 210 CO 0.03 0.42 -0.37 -0.08 0.02 0.00 0.00 177.57 177.59 1xyk h GLU 211 N 0.85 -0.68 -0.05 1.57 4.81 -0.47 0.33 114.58 120.94 1xyk h GLU 211 Ca 0.15 0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.29 1xyk h GLU 211 Cb 0.60 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 1xyk h GLU 211 CO 0.04 -0.45 -0.57 0.37 -0.73 0.00 0.00 179.01 177.66 1xyk h GLN 212 N -0.70 0.17 -0.61 1.92 4.15 -0.59 -1.13 115.11 118.31 1xyk h GLN 212 Ca -0.01 -0.11 -0.04 0.00 0.77 0.00 0.00 58.65 59.26 1xyk h GLN 212 Cb 0.67 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1xyk h GLN 212 CO -0.13 0.69 0.21 0.52 -1.93 0.00 0.00 178.83 178.20 1xyk h MET 213 N 0.13 0.93 -0.51 1.69 2.86 -0.46 0.26 114.93 119.83 1xyk h MET 213 Ca -0.00 -0.19 0.02 0.00 -2.06 0.00 0.00 59.70 57.47 1xyk h MET 213 Cb 1.05 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.53 1xyk h MET 213 CO 0.08 0.82 0.31 0.00 1.06 0.00 0.00 176.91 179.19 1xyk h VAL 215 N 0.63 1.09 0.04 0.00 2.07 -1.04 -2.53 116.25 116.51 1xyk h VAL 215 Ca 0.20 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1xyk h VAL 215 Cb 0.00 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1xyk h VAL 215 CO -0.08 0.08 -0.04 0.74 0.02 0.00 0.00 177.57 178.29 1xyk h THR 216 N 0.03 0.91 -0.84 2.57 2.02 0.44 0.92 112.91 118.96 1xyk h THR 216 Ca 0.03 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.34 1xyk h THR 216 Cb 0.09 0.91 -0.09 0.00 -1.74 0.00 0.00 68.15 67.33 1xyk h THR 216 CO -0.00 0.00 0.44 -0.61 0.37 0.00 0.00 175.52 175.72 1xyk h GLN 217 N -0.09 0.65 -0.37 6.66 5.75 -0.74 0.14 115.11 127.11 1xyk h GLN 217 Ca 0.00 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.36 1xyk h GLN 217 Cb 0.09 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 1xyk h GLN 217 CO -0.01 0.43 -0.17 1.88 -2.65 0.00 0.00 178.83 178.30 1xyk h TYR 218 N 0.67 0.89 0.00 3.99 -1.99 -0.69 -2.56 116.97 117.28 1xyk h TYR 218 Ca 0.44 -0.22 0.00 0.00 2.00 0.00 0.00 58.73 60.95 1xyk h TYR 218 Cb 0.57 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.09 1xyk h TYR 218 CO -0.08 0.96 0.00 1.04 -0.00 0.00 0.00 178.16 180.07 1xyk n GLN 219 N -4.29 0.72 0.14 4.88 1.13 0.17 -0.20 117.38 119.93 1xyk n GLN 219 Ca -0.02 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.91 1xyk n GLN 219 Cb 0.41 -1.47 -0.08 0.00 0.11 0.00 0.00 30.24 29.21 1xyk n GLN 219 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1xyk h LYS 220 N 0.00 -0.34 0.00 -1.09 1.79 -0.34 -3.44 116.57 113.15 1xyk h LYS 220 Ca 0.00 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1xyk h LYS 220 Cb 0.00 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1xyk h LYS 220 CO 0.00 -0.03 0.00 -0.85 -1.08 0.00 0.00 179.45 177.49 1xyk n GLU 221 N -5.11 0.00 0.11 3.15 0.28 -1.23 -4.94 120.64 112.90 1xyk n GLU 221 Ca -0.09 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.78 1xyk n GLU 221 Cb 0.25 -0.26 -0.06 0.00 1.43 0.00 0.00 31.44 32.81 1xyk n GLU 221 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 177.13 177.74 1xyk h SER 222 N 0.00 -0.51 1.43 -1.84 0.02 -1.56 0.99 113.55 112.09 1xyk h SER 222 Ca 0.00 0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 60.89 1xyk h SER 222 Cb 0.00 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1xyk h SER 222 CO 0.00 -0.27 -0.58 -0.33 -1.14 0.00 0.00 176.83 174.52 1xyk h GLU 223 N -0.36 0.00 -0.41 3.45 4.39 -0.91 -1.54 114.58 119.20 1xyk h GLU 223 Ca 0.02 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.79 1xyk h GLU 223 Cb 0.37 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 1xyk h GLU 223 CO -0.09 0.54 0.28 0.00 -1.16 0.00 0.00 179.01 178.58 1xyk h ALA 224 N 1.45 2.06 0.12 3.43 0.00 -1.39 0.28 119.26 125.21 1xyk h ALA 224 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xyk h ALA 224 Cb 1.43 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1xyk h ALA 224 CO 0.07 -0.15 -0.06 -0.92 0.00 0.00 0.00 179.25 178.20 1xyk h TYR 225 N 0.25 -0.15 -0.00 0.00 5.03 -0.66 -3.39 116.97 118.05 1xyk h TYR 225 Ca 0.18 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.49 1xyk h TYR 225 Cb 0.41 0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.74 1xyk h TYR 225 CO -0.00 0.33 -0.16 0.98 -1.32 0.00 0.00 178.16 177.99 1xyk n TYR 226 N -4.90 0.00 0.00 -3.82 9.36 -0.52 -4.91 117.16 112.37 1xyk n TYR 226 Ca -0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.14 1xyk n TYR 226 Cb 0.27 -0.26 0.00 0.00 -0.63 0.00 0.00 39.34 38.72 1xyk n TYR 226 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1xyk n GLN 227 N -1.18 0.00 0.00 2.98 10.64 0.87 -5.02 117.38 125.67 1xyk n GLN 227 Ca 0.11 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.28 1xyk n GLN 227 Cb 0.30 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.68 1xyk n GLN 227 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 1xyk n ARG 228 N 0.00 0.64 0.00 2.61 3.00 -1.21 -4.72 116.66 116.98 1xyk n ARG 228 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1xyk n ARG 228 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1xyk n ARG 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1xyk n GLY 229 N 2.39 0.50 2.68 -0.13 0.00 -1.26 -3.57 105.19 105.79 1xyk n GLY 229 Ca 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 1xyk n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xyk n ALA 230 N 0.00 -2.90 1.97 4.61 0.00 -1.26 -4.97 120.51 117.96 1xyk n ALA 230 Ca 0.00 -0.55 0.16 0.00 0.00 0.00 0.00 53.44 53.04 1xyk n ALA 230 Cb 0.00 -2.83 0.94 0.00 0.00 0.00 0.00 19.45 17.56 1xyk n ALA 230 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37