#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyk n VAL 122 N 0.00 -2.21 -2.69 1.55 3.14 -1.26 -4.90 118.33 111.96 1xyk n VAL 122 Ca 0.00 -0.46 -0.08 0.00 -2.96 0.00 0.00 64.34 60.85 1xyk n VAL 122 Cb 0.00 -1.89 0.04 0.00 -1.06 0.00 0.00 33.84 30.93 1xyk n VAL 122 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1xyk n GLY 123 N -1.89 1.54 0.00 7.55 0.00 -1.26 -5.09 105.19 106.04 1xyk n GLY 123 Ca -0.11 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.20 0.66 1.33 -0.02 0.00 -1.26 -4.72 105.19 100.98 1xyk n GLY 124 Ca 0.07 -2.16 0.16 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.77 0.00 0.99 -0.00 -1.26 -5.05 117.00 110.91 1xyk n LEU 125 Ca 0.00 1.76 0.00 0.00 -0.00 0.00 0.00 56.01 57.77 1xyk n LEU 125 Cb 0.00 -4.23 0.00 0.00 -0.00 0.00 0.00 43.42 39.19 1xyk n LEU 125 CO 0.00 -2.59 0.00 0.61 -0.00 0.00 0.00 177.39 175.41 1xyk n GLY 126 N -4.01 1.18 0.26 1.47 0.00 -1.26 -5.07 105.19 97.76 1xyk n GLY 126 Ca -0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 -0.37 3.84 -0.02 0.00 -1.26 -5.06 105.19 102.31 1xyk n GLY 127 Ca 0.00 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.43 2.10 0.84 1.61 1.51 -1.26 -5.12 117.35 114.60 1xyk s TYR 128 Ca -0.32 -0.72 -0.12 0.00 -1.01 0.00 0.00 57.07 54.89 1xyk s TYR 128 Cb 0.12 -1.94 0.10 0.00 -0.11 0.00 0.00 41.96 40.13 1xyk s TYR 128 CO 0.42 -0.16 1.18 -1.64 -1.11 0.00 0.00 175.55 174.25 1xyk s MET 129 N -4.11 1.72 0.08 -0.62 -1.94 -0.53 -4.91 119.30 108.99 1xyk s MET 129 Ca 0.35 0.10 0.06 0.00 -1.71 0.00 0.00 55.69 54.50 1xyk s MET 129 Cb -0.00 -1.92 -0.04 0.00 2.01 0.00 0.00 34.83 34.88 1xyk s MET 129 CO 0.21 -1.77 -0.08 -1.17 -0.01 0.00 0.00 175.02 172.20 1xyk s LEU 130 N -5.68 3.11 0.66 -0.03 2.96 -1.26 -2.77 118.68 115.66 1xyk s LEU 130 Ca 0.63 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.23 1xyk s LEU 130 Cb -0.11 -1.87 0.10 0.00 0.50 0.00 0.00 46.19 44.81 1xyk s LEU 130 CO 0.50 0.20 0.91 -0.83 -1.32 0.00 0.00 176.35 175.81 1xyk s GLY 131 N -2.07 1.77 0.79 7.98 0.00 0.10 -4.86 107.32 111.03 1xyk s GLY 131 Ca 0.21 -1.71 -0.13 0.00 0.00 0.00 0.00 44.72 43.09 1xyk s GLY 131 CO 0.13 -1.22 1.16 -0.56 0.00 0.00 0.00 173.10 172.61 1xyk s SER 132 N -4.66 3.91 -1.01 1.64 0.01 -1.26 -4.70 113.70 107.63 1xyk s SER 132 Ca 0.64 2.20 -0.23 0.00 1.31 0.00 0.00 55.95 59.87 1xyk s SER 132 Cb -0.06 -2.57 0.05 0.00 0.21 0.00 0.00 66.02 63.64 1xyk s SER 132 CO 0.42 -2.45 1.44 0.00 0.41 0.00 0.00 173.24 173.07 1xyk s ALA 133 N -2.35 2.71 0.88 1.44 0.00 -1.26 -4.63 121.76 118.55 1xyk s ALA 133 Ca 0.70 -2.21 0.00 0.00 0.00 0.00 0.00 51.96 50.44 1xyk s ALA 133 Cb -0.25 -4.52 0.00 0.00 0.00 0.00 0.00 23.12 18.36 1xyk s ALA 133 CO 0.50 -3.61 0.00 0.00 0.00 0.00 0.00 175.76 172.66 1xyk n MET 134 N 8.91 1.91 -4.34 0.00 0.00 -1.26 -5.12 117.12 117.22 1xyk n MET 134 Ca 0.32 0.00 -0.21 0.00 0.00 0.00 0.00 57.70 57.80 1xyk n MET 134 Cb 0.51 0.00 -0.13 0.00 0.00 0.00 0.00 33.22 33.60 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 -1.00 1.98 -0.13 3.17 0.15 -1.26 -5.01 113.70 111.59 1xyk s SER 135 Ca 0.00 -0.55 -0.32 0.00 0.70 0.00 0.00 55.95 55.78 1xyk s SER 135 Cb 0.00 -0.11 -0.09 0.00 -1.71 0.00 0.00 66.02 64.10 1xyk s SER 135 CO 0.00 0.03 2.04 -2.11 1.20 0.00 0.00 173.24 174.40 1xyk n ARG 136 N 1.57 2.13 -0.41 5.44 -4.01 -1.26 -5.00 116.66 115.12 1xyk n ARG 136 Ca -0.19 0.72 -0.03 0.00 -1.04 0.00 0.00 57.85 57.31 1xyk n ARG 136 Cb 0.54 -2.86 0.02 0.00 -3.04 0.00 0.00 32.46 27.12 1xyk n ARG 136 CO 0.00 0.00 0.00 -0.35 -3.04 0.00 0.00 177.63 174.24 1xyk n PRO 137 N 7.62 0.06 -3.50 2.89 -0.04 -1.26 -5.10 135.00 135.68 1xyk n PRO 137 Ca 0.26 -0.26 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1xyk n PRO 137 Cb 0.35 -0.13 -0.10 0.00 -0.04 0.00 0.00 33.50 33.58 1xyk n PRO 137 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1xyk s LEU 138 N 0.00 -0.50 0.26 1.53 1.98 -1.26 -5.12 118.68 115.57 1xyk s LEU 138 Ca 0.08 0.41 -0.29 0.00 -2.89 0.00 0.00 54.13 51.44 1xyk s LEU 138 Cb -0.00 0.99 -0.09 0.00 0.66 0.00 0.00 46.19 47.75 1xyk s LEU 138 CO 0.06 -0.28 0.95 -0.63 -1.89 0.00 0.00 176.35 174.56 1xyk s ILE 139 N 2.51 4.05 -0.62 6.68 1.09 -1.26 -5.02 121.20 128.64 1xyk s ILE 139 Ca 0.07 2.00 -0.27 0.00 -1.10 0.00 0.00 60.65 61.35 1xyk s ILE 139 Cb -0.14 -4.24 -0.01 0.00 -1.06 0.00 0.00 42.46 37.00 1xyk s ILE 139 CO -0.13 0.42 1.77 -1.38 -0.10 0.00 0.00 174.94 175.52 1xyk s HIS 140 N -1.26 1.77 -0.07 3.97 -3.43 -1.26 -4.85 115.29 110.16 1xyk s HIS 140 Ca 0.43 0.66 -0.06 0.00 -0.80 0.00 0.00 55.06 55.29 1xyk s HIS 140 Cb -0.25 -4.17 -0.03 0.00 -1.43 0.00 0.00 32.58 26.69 1xyk s HIS 140 CO 0.31 -2.29 0.25 0.74 -2.00 0.00 0.00 174.74 171.75 1xyk h PHE 141 N 14.09 -0.20 0.00 0.38 0.04 -2.01 -3.49 116.94 125.75 1xyk h PHE 141 Ca -0.27 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.50 1xyk h PHE 141 Cb 1.14 0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.36 1xyk h PHE 141 CO 1.05 -0.13 0.00 0.41 -0.60 0.00 0.00 178.31 179.05 1xyk n GLY 142 N 1.23 1.38 3.84 -1.45 0.00 -1.26 -5.12 105.19 103.80 1xyk n GLY 142 Ca -0.03 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 1xyk n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xyk s ASN 143 N 0.00 3.50 -0.01 1.61 2.20 -1.26 -5.02 114.94 115.96 1xyk s ASN 143 Ca 0.00 0.72 0.02 0.00 -0.94 0.00 0.00 52.86 52.66 1xyk s ASN 143 Cb 0.00 -1.12 -0.03 0.00 -2.00 0.00 0.00 41.25 38.10 1xyk s ASN 143 CO 0.00 -2.53 0.04 -0.67 -2.94 0.00 0.00 177.10 171.00 1xyk n ASP 144 N -3.72 4.48 0.26 3.54 -0.08 -1.26 -4.47 116.55 115.31 1xyk n ASP 144 Ca 0.09 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.22 1xyk n ASP 144 Cb 0.60 0.96 -0.08 0.00 2.34 0.00 0.00 41.12 44.93 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 0.00 -0.81 0.02 -0.67 3.20 -1.98 -0.61 116.97 116.11 1xyk h TYR 145 Ca -0.02 -0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.63 1xyk h TYR 145 Cb 0.38 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1xyk h TYR 145 CO 0.00 -0.46 -0.94 1.49 -1.64 0.00 0.00 178.16 176.61 1xyk h GLU 146 N -0.72 0.27 -0.10 1.82 4.81 -1.99 0.51 114.58 119.17 1xyk h GLU 146 Ca -0.04 -0.31 0.02 0.00 -0.13 0.00 0.00 59.36 58.89 1xyk h GLU 146 Cb 0.61 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.04 1xyk h GLU 146 CO 0.02 1.03 -0.34 0.22 -0.73 0.00 0.00 179.01 179.22 1xyk h ASP 147 N 0.14 -1.08 -0.02 1.04 1.82 -1.78 -2.96 116.42 113.57 1xyk h ASP 147 Ca -0.06 0.13 -0.01 0.00 -0.39 0.00 0.00 57.03 56.70 1xyk h ASP 147 Cb 1.59 0.42 -0.00 0.00 0.68 0.00 0.00 39.33 42.02 1xyk h ASP 147 CO 0.15 -0.29 -0.00 -0.09 -1.61 0.00 0.00 179.24 177.40 1xyk h ARG 148 N -0.35 0.09 -0.34 0.28 2.43 -0.64 0.58 114.38 116.43 1xyk h ARG 148 Ca 0.02 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.27 1xyk h ARG 148 Cb 0.42 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1xyk h ARG 148 CO -0.28 0.10 0.24 -0.92 -1.51 0.00 0.00 179.97 177.60 1xyk h TYR 149 N 0.09 0.04 0.00 2.20 3.20 -0.73 -1.19 116.97 120.58 1xyk h TYR 149 Ca 0.02 0.00 -0.36 0.00 3.14 0.00 0.00 58.73 61.54 1xyk h TYR 149 Cb 0.07 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.26 1xyk h TYR 149 CO 0.00 0.02 -2.28 0.66 -1.64 0.00 0.00 178.16 174.92 1xyk n TYR 150 N -4.45 0.18 0.25 -3.82 4.02 -0.78 -4.65 117.16 107.91 1xyk n TYR 150 Ca 0.05 0.06 0.11 0.00 -0.01 0.00 0.00 57.90 58.11 1xyk n TYR 150 Cb 0.39 -1.03 0.64 0.00 -0.02 0.00 0.00 39.34 39.32 1xyk n TYR 150 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1xyk h ARG 151 N 0.00 0.00 0.00 -0.72 2.43 0.33 0.32 114.38 116.74 1xyk h ARG 151 Ca -0.51 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1xyk h ARG 151 Cb 2.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.74 1xyk h ARG 151 CO 0.03 0.16 0.00 0.39 -1.51 0.00 0.00 179.97 179.04 1xyk n GLU 152 N -3.72 0.03 -0.41 0.20 1.02 -0.97 -3.75 120.64 113.03 1xyk n GLU 152 Ca -0.02 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 1xyk n GLU 152 Cb 0.27 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 1xyk n GLU 152 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1xyk n ASN 153 N -1.47 0.00 -0.36 1.62 0.23 0.01 -5.00 115.26 110.30 1xyk n ASN 153 Ca 0.04 -1.77 0.07 0.00 -0.53 0.00 0.00 54.58 52.39 1xyk n ASN 153 Cb 0.15 -0.15 0.24 0.00 -2.08 0.00 0.00 39.78 37.93 1xyk n ASN 153 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 1xyk h MET 154 N 0.00 0.93 -0.44 -3.83 0.00 -1.39 0.12 114.93 110.32 1xyk h MET 154 Ca 0.00 -0.06 0.13 0.00 0.00 0.00 0.00 59.70 59.77 1xyk h MET 154 Cb 1.31 -0.21 -0.02 0.00 0.00 0.00 0.00 31.60 32.68 1xyk h MET 154 CO 0.00 0.61 0.33 0.10 0.00 0.00 0.00 176.91 177.96 1xyk h TYR 155 N 0.96 0.00 0.00 -0.22 -0.00 -1.91 -0.31 116.97 115.48 1xyk h TYR 155 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.23 1xyk h TYR 155 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.25 1xyk h TYR 155 CO -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 178.16 178.09 1xyk h ARG 156 N 0.00 0.00 -6.80 0.10 3.08 -1.16 -3.45 114.38 106.15 1xyk h ARG 156 Ca 0.21 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.77 1xyk h ARG 156 Cb 0.88 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 1xyk h ARG 156 CO -0.00 0.00 0.36 1.52 -1.07 0.00 0.00 179.97 180.78 1xyk s TYR 157 N -3.12 3.84 -0.50 3.04 -0.85 -0.13 -4.99 117.35 114.65 1xyk s TYR 157 Ca 0.10 1.85 -0.28 0.00 -0.52 0.00 0.00 57.07 58.22 1xyk s TYR 157 Cb 0.12 -3.00 -0.00 0.00 0.38 0.00 0.00 41.96 39.46 1xyk s TYR 157 CO 0.61 0.26 1.63 -1.25 -1.52 0.00 0.00 175.55 175.28 1xyk s PRO 158 N -1.50 3.16 -0.29 -3.49 0.04 -1.26 -4.86 135.00 126.79 1xyk s PRO 158 Ca 0.45 0.80 -0.00 0.00 0.04 0.00 0.00 61.00 62.28 1xyk s PRO 158 Cb -0.24 -4.20 0.23 0.00 0.04 0.00 0.00 34.50 30.33 1xyk s PRO 158 CO 0.30 -2.09 1.90 -0.40 0.04 0.00 0.00 177.00 176.75 1xyk n ASP 159 N 10.52 5.80 -4.05 6.66 5.75 -1.26 -4.84 116.55 135.13 1xyk n ASP 159 Ca 0.18 -2.99 -0.08 0.00 -0.01 0.00 0.00 54.79 51.89 1xyk n ASP 159 Cb 0.49 -0.98 -0.10 0.00 -1.03 0.00 0.00 41.12 39.50 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 -1.73 0.50 0.33 0.11 -0.21 -1.26 -4.28 119.66 113.12 1xyk s GLN 160 Ca 0.29 -0.99 0.07 0.00 0.02 0.00 0.00 55.36 54.75 1xyk s GLN 160 Cb 0.23 0.17 -0.03 0.00 1.00 0.00 0.00 33.01 34.39 1xyk s GLN 160 CO 0.01 -0.09 0.25 1.33 -2.12 0.00 0.00 175.29 174.67 1xyk n VAL 161 N 0.67 0.00 -4.67 1.09 0.24 -1.26 -4.96 118.33 109.43 1xyk n VAL 161 Ca -0.18 -2.32 -0.24 0.00 -2.04 0.00 0.00 64.34 59.57 1xyk n VAL 161 Cb 0.59 1.11 -0.15 0.00 -1.47 0.00 0.00 33.84 33.92 1xyk n VAL 161 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1xyk s TYR 162 N -3.25 1.49 0.28 6.34 1.51 -1.26 0.02 117.35 122.47 1xyk s TYR 162 Ca 0.35 -0.31 -0.04 0.00 -1.01 0.00 0.00 57.07 56.07 1xyk s TYR 162 Cb 0.02 -0.93 0.02 0.00 -0.11 0.00 0.00 41.96 40.95 1xyk s TYR 162 CO 0.25 0.01 0.43 2.48 -1.11 0.00 0.00 175.55 177.60 1xyk n TYR 163 N 2.38 -1.41 -4.30 2.71 0.18 -1.11 -4.92 117.16 110.69 1xyk n TYR 163 Ca -0.16 -1.72 -0.24 0.00 1.88 0.00 0.00 57.90 57.66 1xyk n TYR 163 Cb 0.54 0.49 -0.08 0.00 -0.38 0.00 0.00 39.34 39.91 1xyk n TYR 163 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1xyk s ARG 164 N -2.49 2.12 -1.33 -3.48 3.00 -1.26 -1.46 118.95 114.05 1xyk s ARG 164 Ca 0.20 -1.72 -0.11 0.00 0.00 0.00 0.00 55.73 54.11 1xyk s ARG 164 Cb -0.01 -1.96 -0.06 0.00 0.00 0.00 0.00 34.95 32.91 1xyk s ARG 164 CO 0.14 0.13 2.51 -0.35 0.00 0.00 0.00 175.30 177.74 1xyk n PRO 165 N -0.98 2.92 -0.10 3.54 -0.04 -1.26 -4.61 135.00 134.48 1xyk n PRO 165 Ca -0.04 -2.04 -0.11 0.00 -0.04 0.00 0.00 63.50 61.27 1xyk n PRO 165 Cb 0.62 -2.81 -0.03 0.00 -0.04 0.00 0.00 33.50 31.24 1xyk n PRO 165 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1xyk h VAL 166 N 3.43 1.27 -5.95 0.52 3.04 -2.00 -3.48 116.25 113.07 1xyk h VAL 166 Ca 0.68 -1.00 -0.35 0.00 -1.01 0.00 0.00 66.70 65.02 1xyk h VAL 166 Cb 0.35 1.33 0.01 0.00 -2.01 0.00 0.00 31.29 30.97 1xyk h VAL 166 CO 1.73 0.32 -0.93 0.47 -1.01 0.00 0.00 177.57 178.15 1xyk n ASP 167 N -4.54 -4.06 0.00 3.17 9.92 -1.26 -4.85 116.55 114.92 1xyk n ASP 167 Ca -0.03 -0.42 0.00 0.00 -0.53 0.00 0.00 54.79 53.82 1xyk n ASP 167 Cb 0.28 -1.25 0.00 0.00 -0.64 0.00 0.00 41.12 39.51 1xyk n ASP 167 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1xyk n GLN 168 N -1.04 0.00 -3.89 -1.24 -0.06 -1.26 -5.01 117.38 104.89 1xyk n GLN 168 Ca -0.15 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.55 1xyk n GLN 168 Cb 0.55 -0.02 -0.12 0.00 -4.06 0.00 0.00 30.24 26.58 1xyk n GLN 168 CO 0.00 0.00 0.00 0.71 -0.20 0.00 0.00 177.06 177.57 1xyk s TYR 169 N -1.44 3.45 0.12 3.69 2.02 -1.26 -4.95 117.35 118.98 1xyk s TYR 169 Ca 0.00 -3.23 -0.23 0.00 -0.37 0.00 0.00 57.07 53.24 1xyk s TYR 169 Cb 0.00 -2.82 -0.07 0.00 -0.40 0.00 0.00 41.96 38.67 1xyk s TYR 169 CO 0.00 -0.65 1.68 0.77 -1.57 0.00 0.00 175.55 175.79 1xyk h SER 170 N 5.93 -0.37 -0.05 2.29 0.02 -1.98 -3.42 113.55 115.97 1xyk h SER 170 Ca 0.06 0.06 -0.23 0.00 -0.84 0.00 0.00 61.79 60.84 1xyk h SER 170 Cb 0.82 0.16 -0.15 0.00 0.14 0.00 0.00 62.40 63.37 1xyk h SER 170 CO 0.72 -0.18 -0.50 -0.46 -1.14 0.00 0.00 176.83 175.27 1xyk n ASN 171 N -5.26 -2.77 0.00 3.07 6.94 -1.26 -4.94 115.26 111.04 1xyk n ASN 171 Ca -0.05 -3.34 0.00 0.00 -0.02 0.00 0.00 54.58 51.18 1xyk n ASN 171 Cb 0.18 1.79 0.00 0.00 -2.36 0.00 0.00 39.78 39.39 1xyk n ASN 171 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 1xyk n GLN 172 N 1.51 0.00 0.00 -3.83 -0.06 -1.26 -5.13 117.38 108.61 1xyk n GLN 172 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.09 1xyk n GLN 172 Cb 0.63 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.81 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 0.00 0.14 1.69 5.15 -1.26 -4.89 115.26 116.08 1xyk n ASN 173 Ca 0.00 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 54.11 1xyk n ASN 173 Cb 0.00 0.00 0.44 0.00 -0.53 0.00 0.00 39.78 39.69 1xyk n ASN 173 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1xyk h ASN 174 N 0.00 0.00 -0.65 1.20 7.08 -1.99 -3.30 115.58 117.92 1xyk h ASN 174 Ca 0.00 0.00 0.08 0.00 -3.08 0.00 0.00 56.30 53.30 1xyk h ASN 174 Cb 0.00 0.00 -0.11 0.00 -2.08 0.00 0.00 38.32 36.13 1xyk h ASN 174 CO 0.00 0.00 -0.49 2.19 -2.08 0.00 0.00 177.43 177.05 1xyk h PHE 175 N 0.00 -1.49 -0.24 4.14 -0.00 -1.90 0.11 116.94 117.56 1xyk h PHE 175 Ca 0.00 0.09 -0.17 0.00 -0.00 0.00 0.00 57.97 57.90 1xyk h PHE 175 Cb 0.61 0.74 0.00 0.00 -0.00 0.00 0.00 35.95 37.30 1xyk h PHE 175 CO 0.00 -0.43 -0.50 -0.24 -0.00 0.00 0.00 178.31 177.14 1xyk h VAL 176 N -0.21 1.30 -0.18 0.88 3.04 -1.92 -3.17 116.25 115.98 1xyk h VAL 176 Ca 0.16 -1.70 0.05 0.00 -1.01 0.00 0.00 66.70 64.20 1xyk h VAL 176 Cb 0.55 1.75 -0.07 0.00 -2.01 0.00 0.00 31.29 31.51 1xyk h VAL 176 CO -0.74 0.54 -0.37 -0.09 -1.01 0.00 0.00 177.57 175.91 1xyk h ARG 177 N 0.51 -0.40 -0.17 4.17 9.65 -1.31 0.17 114.38 127.00 1xyk h ARG 177 Ca 0.01 0.03 -0.15 0.00 -1.10 0.00 0.00 59.98 58.76 1xyk h ARG 177 Cb 1.11 0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.77 1xyk h ARG 177 CO 0.11 -0.27 -0.53 0.22 2.80 0.00 0.00 179.97 182.31 1xyk h ASP 178 N -0.42 0.54 -0.67 -3.80 3.58 -1.13 -2.74 116.42 111.78 1xyk h ASP 178 Ca 0.10 -0.28 -0.06 0.00 0.42 0.00 0.00 57.03 57.21 1xyk h ASP 178 Cb 0.59 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.45 1xyk h ASP 178 CO -0.41 0.97 0.19 0.00 -2.88 0.00 0.00 179.24 177.11 1xyk h VAL 180 N 1.03 1.03 0.18 0.00 2.07 -0.57 0.11 116.25 120.11 1xyk h VAL 180 Ca 0.22 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 1xyk h VAL 180 Cb 0.33 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1xyk h VAL 180 CO -0.00 0.04 -0.09 0.78 0.02 0.00 0.00 177.57 178.31 1xyk h ASN 181 N 0.06 -0.21 -0.71 0.57 2.35 -0.89 -3.11 115.58 113.65 1xyk h ASN 181 Ca 0.02 -0.32 0.11 0.00 -0.55 0.00 0.00 56.30 55.56 1xyk h ASN 181 Cb 0.04 0.05 -0.08 0.00 0.05 0.00 0.00 38.32 38.38 1xyk h ASN 181 CO -0.00 0.32 0.31 0.40 -1.65 0.00 0.00 177.43 176.81 1xyk h ILE 182 N -0.87 0.75 -0.49 2.81 1.08 -0.30 0.19 117.51 120.69 1xyk h ILE 182 Ca -0.03 -0.17 -0.08 0.00 -0.39 0.00 0.00 64.86 64.19 1xyk h ILE 182 Cb 0.52 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 34.46 1xyk h ILE 182 CO 0.04 0.09 -0.01 0.74 -0.69 0.00 0.00 178.15 178.32 1xyk h THR 183 N 0.50 1.26 -0.21 -0.27 2.02 -0.93 0.18 112.91 115.47 1xyk h THR 183 Ca 0.37 -1.09 -0.13 0.00 0.77 0.00 0.00 66.41 66.32 1xyk h THR 183 Cb 0.47 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1xyk h THR 183 CO -0.33 0.38 -0.44 1.62 0.37 0.00 0.00 175.52 177.12 1xyk h VAL 184 N 0.73 1.31 -0.94 3.16 3.04 -1.37 -3.13 116.25 119.04 1xyk h VAL 184 Ca 0.14 -1.62 -0.01 0.00 -1.01 0.00 0.00 66.70 64.20 1xyk h VAL 184 Cb 0.53 1.63 -0.05 0.00 -2.01 0.00 0.00 31.29 31.39 1xyk h VAL 184 CO 0.03 0.50 0.56 0.11 -1.01 0.00 0.00 177.57 177.77 1xyk h LYS 185 N 0.41 1.28 0.00 4.17 1.57 0.01 0.32 116.57 124.33 1xyk h LYS 185 Ca 0.03 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1xyk h LYS 185 Cb 0.93 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1xyk h LYS 185 CO 0.08 0.90 0.00 1.04 -0.57 0.00 0.00 179.45 180.90 1xyk n GLN 186 N -4.36 0.46 -0.02 3.15 6.02 0.57 -3.09 117.38 120.12 1xyk n GLN 186 Ca 0.10 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 57.07 1xyk n GLN 186 Cb 0.06 -1.44 -0.02 0.00 1.02 0.00 0.00 30.24 29.86 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 -0.94 0.00 0.06 1.08 8.25 0.32 -4.51 115.22 119.48 1xyk n HIS 187 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1xyk n HIS 187 Cb 0.04 -0.15 0.31 0.00 1.12 0.00 0.00 29.99 31.31 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 0.00 1.22 -0.10 1.59 1.35 -0.44 0.12 112.91 116.65 1xyk h THR 188 Ca -0.08 -0.98 -0.02 0.00 -0.55 0.00 0.00 66.41 64.78 1xyk h THR 188 Cb 1.16 1.23 -0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1xyk h THR 188 CO -0.00 0.31 -0.03 0.58 -0.25 0.00 0.00 175.52 176.13 1xyk h VAL 189 N 0.33 1.29 -0.56 6.82 2.07 -1.82 -2.41 116.25 121.97 1xyk h VAL 189 Ca 0.06 -0.97 0.11 0.00 0.82 0.00 0.00 66.70 66.73 1xyk h VAL 189 Cb 0.48 1.73 -0.09 0.00 -1.52 0.00 0.00 31.29 31.89 1xyk h VAL 189 CO 0.03 0.27 0.02 0.74 0.02 0.00 0.00 177.57 178.65 1xyk h THR 190 N -0.13 0.56 -0.35 2.57 2.02 -1.57 0.35 112.91 116.37 1xyk h THR 190 Ca 0.03 -0.05 -0.07 0.00 0.77 0.00 0.00 66.41 67.08 1xyk h THR 190 Cb 0.44 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1xyk h THR 190 CO 0.01 0.03 -0.07 0.71 0.37 0.00 0.00 175.52 176.57 1xyk h THR 191 N 0.14 1.28 0.00 3.16 1.35 -0.80 0.08 112.91 118.12 1xyk h THR 191 Ca 0.29 -1.12 -0.02 0.00 -0.55 0.00 0.00 66.41 65.01 1xyk h THR 191 Cb 0.45 1.29 -0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1xyk h THR 191 CO -0.46 0.37 -0.10 0.74 -0.25 0.00 0.00 175.52 175.82 1xyk h THR 192 N 0.46 0.49 0.00 6.82 2.02 -0.88 0.31 112.91 122.13 1xyk h THR 192 Ca 0.09 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1xyk h THR 192 Cb 0.57 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 1xyk h THR 192 CO 0.03 0.10 -0.08 0.74 0.37 0.00 0.00 175.52 176.68 1xyk h THR 193 N 0.00 0.00 0.00 3.16 2.02 0.68 -3.38 112.91 115.39 1xyk h THR 193 Ca -0.00 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1xyk h THR 193 Cb 0.32 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1xyk h THR 193 CO 0.01 0.00 -0.85 0.29 0.37 0.00 0.00 175.52 175.34 1xyk n LYS 194 N -2.38 0.90 -1.33 6.66 4.76 -0.08 -5.04 118.16 121.65 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 0.45 -0.93 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 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 2.14 -0.36 3.53 0.72 0.00 0.99 -5.06 105.19 107.15 1xyk n GLY 195 Ca 0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 1xyk n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xyk s GLU 196 N -1.90 1.40 0.39 1.61 2.12 -1.05 -5.04 118.70 116.24 1xyk s GLU 196 Ca 0.00 -0.96 0.04 0.00 0.36 0.00 0.00 54.97 54.41 1xyk s GLU 196 Cb 0.00 0.50 -0.04 0.00 0.26 0.00 0.00 34.13 34.85 1xyk s GLU 196 CO 0.00 -0.59 0.09 1.21 -0.54 0.00 0.00 175.26 175.43 1xyk s ASN 197 N -2.91 2.80 0.50 -1.70 3.84 -1.26 -4.40 114.94 111.81 1xyk s ASN 197 Ca 0.12 -1.55 0.07 0.00 0.21 0.00 0.00 52.86 51.71 1xyk s ASN 197 Cb -0.01 0.27 0.03 0.00 -0.55 0.00 0.00 41.25 40.99 1xyk s ASN 197 CO -0.00 -0.79 0.51 -0.36 -2.79 0.00 0.00 177.10 173.67 1xyk s PHE 198 N -3.20 2.01 0.11 0.43 0.40 -1.26 -5.15 117.98 111.32 1xyk s PHE 198 Ca 0.27 -0.66 0.06 0.00 -0.60 0.00 0.00 56.93 56.00 1xyk s PHE 198 Cb 0.05 -2.11 -0.03 0.00 0.51 0.00 0.00 43.02 41.43 1xyk s PHE 198 CO 0.14 -0.54 -0.16 0.95 0.70 0.00 0.00 175.22 176.31 1xyk s THR 199 N -2.61 1.38 0.38 0.64 -4.23 -1.26 -5.04 115.64 104.89 1xyk s THR 199 Ca 0.48 -1.58 0.05 0.00 -1.18 0.00 0.00 61.69 59.46 1xyk s THR 199 Cb -0.04 -1.43 0.23 0.00 1.34 0.00 0.00 72.50 72.60 1xyk s THR 199 CO 0.29 -0.29 1.99 -0.33 -0.54 0.00 0.00 174.62 175.74 1xyk h GLU 200 N 3.82 0.57 -0.02 3.99 4.39 -2.01 -0.28 114.58 125.05 1xyk h GLU 200 Ca -0.41 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.22 1xyk h GLU 200 Cb 1.19 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1xyk h GLU 200 CO 0.46 0.45 0.01 1.15 -1.16 0.00 0.00 179.01 179.92 1xyk h THR 201 N 0.58 1.07 -0.50 1.13 2.02 -1.99 -1.10 112.91 114.12 1xyk h THR 201 Ca 0.15 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 1xyk h THR 201 Cb 0.07 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1xyk h THR 201 CO -0.02 0.06 0.16 -0.78 0.37 0.00 0.00 175.52 175.31 1xyk h ASP 202 N -0.06 0.72 0.08 4.18 3.58 -1.90 -2.51 116.42 120.52 1xyk h ASP 202 Ca 0.01 -0.20 -0.02 0.00 0.42 0.00 0.00 57.03 57.24 1xyk h ASP 202 Cb 0.09 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 40.94 1xyk h ASP 202 CO -0.00 0.73 -0.08 0.24 -2.88 0.00 0.00 179.24 177.25 1xyk h MET 203 N 0.67 0.00 0.00 0.28 2.86 -0.97 0.25 114.93 118.02 1xyk h MET 203 Ca 0.16 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1xyk h MET 203 Cb 0.27 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.92 1xyk h MET 203 CO -0.01 0.08 -0.07 -0.22 1.06 0.00 0.00 176.91 177.76 1xyk h LYS 204 N 0.00 0.00 0.00 1.72 1.63 -0.72 0.71 116.57 119.90 1xyk h LYS 204 Ca -0.00 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.72 1xyk h LYS 204 Cb 0.14 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.76 1xyk h LYS 204 CO 0.01 0.07 -0.69 0.82 -3.45 0.00 0.00 179.45 176.21 1xyk h ILE 205 N 0.00 0.47 0.00 2.00 2.04 -1.24 -3.37 117.51 117.40 1xyk h ILE 205 Ca -0.00 -1.53 -0.00 0.00 1.00 0.00 0.00 64.86 64.33 1xyk h ILE 205 Cb 0.14 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1xyk h ILE 205 CO 0.01 0.16 -0.01 0.24 0.00 0.00 0.00 178.15 178.54 1xyk h MET 206 N -1.00 0.00 0.36 2.37 2.86 -0.72 0.04 114.93 118.84 1xyk h MET 206 Ca -0.13 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1xyk h MET 206 Cb 0.78 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.44 1xyk h MET 206 CO -0.08 0.01 -0.17 1.49 1.06 0.00 0.00 176.91 179.22 1xyk h GLU 207 N 0.00 -0.47 -0.57 1.72 4.81 -1.09 -2.93 114.58 116.04 1xyk h GLU 207 Ca -0.00 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.37 1xyk h GLU 207 Cb 0.07 0.11 -0.09 0.00 0.63 0.00 0.00 28.75 29.47 1xyk h GLU 207 CO 0.00 -0.23 0.08 -0.09 -0.73 0.00 0.00 179.01 178.03 1xyk h ARG 208 N -1.08 0.19 -0.02 1.92 9.65 -1.31 0.25 114.38 123.98 1xyk h ARG 208 Ca -0.05 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.81 1xyk h ARG 208 Cb 0.45 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.99 1xyk h ARG 208 CO 0.08 0.13 -0.03 0.28 2.80 0.00 0.00 179.97 183.23 1xyk h VAL 209 N 0.20 1.40 -0.40 0.20 2.07 -1.22 -0.58 116.25 117.91 1xyk h VAL 209 Ca 0.30 -1.22 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 1xyk h VAL 209 Cb 0.45 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 1xyk h VAL 209 CO -0.42 0.32 0.13 0.58 0.02 0.00 0.00 177.57 178.20 1xyk h VAL 210 N -0.42 1.17 0.39 2.57 2.07 -1.28 0.57 116.25 121.31 1xyk h VAL 210 Ca 0.00 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1xyk h VAL 210 Cb 0.54 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1xyk h VAL 210 CO 0.01 0.21 -0.19 -0.08 0.02 0.00 0.00 177.57 177.54 1xyk h GLU 211 N 0.57 -0.50 -0.76 1.57 4.81 -0.39 -0.60 114.58 119.29 1xyk h GLU 211 Ca 0.14 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1xyk h GLU 211 Cb 0.17 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 1xyk h GLU 211 CO -0.01 -0.29 0.49 0.37 -0.73 0.00 0.00 179.01 178.83 1xyk h GLN 212 N -0.59 0.93 -0.45 1.92 4.15 -0.59 -0.84 115.11 119.65 1xyk h GLN 212 Ca -0.05 -0.06 0.04 0.00 0.77 0.00 0.00 58.65 59.35 1xyk h GLN 212 Cb 0.44 -0.21 -0.04 0.00 0.21 0.00 0.00 27.48 27.88 1xyk h GLN 212 CO 0.09 0.62 0.21 0.52 -1.93 0.00 0.00 178.83 178.34 1xyk h MET 213 N 0.96 0.41 -0.54 1.69 2.86 -0.74 0.26 114.93 119.84 1xyk h MET 213 Ca 0.30 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.94 1xyk h MET 213 Cb -0.02 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.51 1xyk h MET 213 CO -0.10 0.27 0.32 0.00 1.06 0.00 0.00 176.91 178.46 1xyk h VAL 215 N 0.63 0.00 -0.84 0.00 2.07 -0.83 -2.83 116.25 114.45 1xyk h VAL 215 Ca 0.22 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.63 1xyk h VAL 215 Cb 0.03 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.76 1xyk h VAL 215 CO -0.10 0.00 0.56 0.74 0.02 0.00 0.00 177.57 178.79 1xyk h THR 216 N -1.01 1.18 -0.52 2.57 2.02 -0.32 0.18 112.91 117.00 1xyk h THR 216 Ca -0.09 -0.38 0.10 0.00 0.77 0.00 0.00 66.41 66.81 1xyk h THR 216 Cb 0.68 -0.01 -0.11 0.00 -1.74 0.00 0.00 68.15 66.97 1xyk h THR 216 CO 0.15 0.20 -0.28 -0.61 0.37 0.00 0.00 175.52 175.35 1xyk h GLN 217 N 1.09 -0.15 0.73 6.66 5.75 -0.45 0.84 115.11 129.58 1xyk h GLN 217 Ca 0.32 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.80 1xyk h GLN 217 Cb -0.05 0.03 0.01 0.00 1.07 0.00 0.00 27.48 28.54 1xyk h GLN 217 CO -0.08 -0.10 -0.35 1.88 -2.65 0.00 0.00 178.83 177.53 1xyk h TYR 218 N -0.16 -0.91 -0.67 3.99 -1.99 -0.74 -3.21 116.97 113.28 1xyk h TYR 218 Ca 0.23 -0.02 0.14 0.00 2.00 0.00 0.00 58.73 61.08 1xyk h TYR 218 Cb 0.52 0.30 -0.04 0.00 2.00 0.00 0.00 36.73 39.51 1xyk h TYR 218 CO -0.56 -0.55 0.46 1.96 -0.00 0.00 0.00 178.16 179.47 1xyk h GLN 219 N -1.05 0.28 -0.71 4.88 1.08 0.07 0.55 115.11 120.21 1xyk h GLN 219 Ca -0.10 -0.02 0.14 0.00 -1.45 0.00 0.00 58.65 57.22 1xyk h GLN 219 Cb 0.77 -0.06 -0.14 0.00 -0.05 0.00 0.00 27.48 28.00 1xyk h GLN 219 CO 0.16 0.19 -0.19 0.87 -0.95 0.00 0.00 178.83 178.92 1xyk h LYS 220 N 0.29 -0.01 0.00 1.46 6.56 -0.86 -2.26 116.57 121.75 1xyk h LYS 220 Ca 0.32 0.00 -0.18 0.00 -1.06 0.00 0.00 60.65 59.74 1xyk h LYS 220 Cb 0.86 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.50 1xyk h LYS 220 CO -0.08 -0.00 -1.59 -0.85 -2.06 0.00 0.00 179.45 174.87 1xyk n GLU 221 N -5.48 0.22 0.30 3.15 -0.00 -1.09 -4.74 120.64 113.01 1xyk n GLU 221 Ca 0.09 0.10 0.18 0.00 -0.00 0.00 0.00 57.16 57.53 1xyk n GLU 221 Cb 0.37 -0.89 0.94 0.00 -0.00 0.00 0.00 31.44 31.86 1xyk n GLU 221 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 1xyk h SER 222 N -0.36 0.00 0.57 -1.84 0.02 -0.99 -1.04 113.55 109.92 1xyk h SER 222 Ca -0.27 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.52 1xyk h SER 222 Cb 1.24 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 1xyk h SER 222 CO -0.16 0.03 -0.74 -0.08 -1.14 0.00 0.00 176.83 174.75 1xyk h GLU 223 N 0.00 0.13 0.00 3.45 4.81 -1.48 0.25 114.58 121.74 1xyk h GLU 223 Ca -0.00 -0.12 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 1xyk h GLU 223 Cb 0.21 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1xyk h GLU 223 CO 0.00 0.81 -0.30 0.00 -0.73 0.00 0.00 179.01 178.79 1xyk h ALA 224 N 1.16 1.09 0.00 2.92 0.00 -1.36 -2.52 119.26 120.54 1xyk h ALA 224 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1xyk h ALA 224 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1xyk h ALA 224 CO 0.11 0.38 -0.28 -0.92 0.00 0.00 0.00 179.25 178.54 1xyk h TYR 225 N 0.00 0.00 -0.00 0.00 5.03 -1.33 -3.42 116.97 117.25 1xyk h TYR 225 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1xyk h TYR 225 Cb 0.75 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.03 1xyk h TYR 225 CO 0.00 0.00 -0.28 0.66 -1.32 0.00 0.00 178.16 177.22 1xyk n TYR 226 N -4.15 0.00 -3.92 -3.82 4.02 0.85 -4.91 117.16 105.24 1xyk n TYR 226 Ca -0.04 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.80 1xyk n TYR 226 Cb 0.15 -0.20 -0.02 0.00 -0.02 0.00 0.00 39.34 39.25 1xyk n TYR 226 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1xyk n GLN 227 N -1.03 0.17 -3.93 -0.72 1.13 -0.95 -5.03 117.38 107.02 1xyk n GLN 227 Ca 0.10 -0.93 -0.31 0.00 -1.94 0.00 0.00 57.00 53.92 1xyk n GLN 227 Cb 0.33 0.82 -0.15 0.00 0.11 0.00 0.00 30.24 31.35 1xyk n GLN 227 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1xyk s ARG 228 N -2.33 1.44 -0.05 -1.09 3.00 -1.21 -4.53 118.95 114.17 1xyk s ARG 228 Ca 0.11 -1.29 0.02 0.00 0.00 0.00 0.00 55.73 54.57 1xyk s ARG 228 Cb 0.00 -2.67 0.06 0.00 0.00 0.00 0.00 34.95 32.35 1xyk s ARG 228 CO 0.08 -0.77 0.65 0.41 0.00 0.00 0.00 175.30 175.66 1xyk n GLY 229 N 4.57 -0.48 0.13 -3.53 0.00 -1.25 -5.02 105.19 99.60 1xyk n GLY 229 Ca -0.05 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 45.90 1xyk n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xyk h ALA 230 N 0.16 -0.38 -0.03 4.61 0.00 -1.89 -3.41 119.26 118.32 1xyk h ALA 230 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xyk h ALA 230 Cb 1.03 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1xyk h ALA 230 CO -0.03 -0.36 0.00 -1.13 0.00 0.00 0.00 179.25 177.73