#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyx n VAL 122 N 0.00 -0.50 0.00 2.52 0.24 -1.26 -0.92 118.33 118.41 1xyx n VAL 122 Ca 0.00 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 1xyx n VAL 122 Cb 0.00 -0.77 0.00 0.00 -1.47 0.00 0.00 33.84 31.60 1xyx n VAL 122 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xyx n GLY 123 N -1.76 2.11 0.00 7.63 0.00 -1.26 -4.25 105.19 107.65 1xyx n GLY 123 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1xyx n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyx n GLY 124 N 0.00 -1.96 0.00 -0.02 0.00 -0.09 -5.03 105.19 98.08 1xyx n GLY 124 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.94 1xyx n GLY 124 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xyx n LEU 125 N 0.00 0.76 0.00 0.99 7.99 -1.02 -5.03 117.00 120.69 1xyx n LEU 125 Ca 0.00 -0.84 0.00 0.00 -0.01 0.00 0.00 56.01 55.16 1xyx n LEU 125 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1xyx n LEU 125 CO 0.00 0.19 0.00 0.61 -1.51 0.00 0.00 177.39 176.68 1xyx n GLY 126 N 0.15 1.31 0.00 -0.72 0.00 -1.26 -4.08 105.19 100.59 1xyx n GLY 126 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1xyx n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyx n GLY 127 N 0.00 -1.81 3.83 -0.02 0.00 -1.26 -4.97 105.19 100.96 1xyx n GLY 127 Ca 0.00 0.80 -0.38 0.00 0.00 0.00 0.00 46.02 46.44 1xyx n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyx s TYR 128 N 0.00 3.67 -0.31 1.61 1.51 -1.26 -5.00 117.35 117.57 1xyx s TYR 128 Ca 0.00 0.86 -0.28 0.00 -1.01 0.00 0.00 57.07 56.64 1xyx s TYR 128 Cb 0.00 -2.23 -0.05 0.00 -0.11 0.00 0.00 41.96 39.57 1xyx s TYR 128 CO 0.00 0.61 2.20 -1.64 -1.11 0.00 0.00 175.55 175.60 1xyx s MET 129 N -0.86 2.89 -0.09 -0.62 -1.94 0.41 -4.80 119.30 114.29 1xyx s MET 129 Ca 0.21 1.75 -0.22 0.00 -1.71 0.00 0.00 55.69 55.72 1xyx s MET 129 Cb -0.15 -4.40 -0.04 0.00 2.01 0.00 0.00 34.83 32.25 1xyx s MET 129 CO 0.10 -2.38 0.65 -1.17 -0.01 0.00 0.00 175.02 172.22 1xyx s LEU 130 N 9.08 4.29 0.00 -0.03 2.96 -1.26 -0.44 118.68 133.27 1xyx s LEU 130 Ca 0.96 1.08 -0.05 0.00 -0.22 0.00 0.00 54.13 55.91 1xyx s LEU 130 Cb -0.27 -2.99 0.10 0.00 0.50 0.00 0.00 46.19 43.52 1xyx s LEU 130 CO 0.32 -0.12 0.60 0.61 -1.32 0.00 0.00 176.35 176.44 1xyx n GLY 131 N 3.21 -0.38 3.88 7.98 0.00 0.07 -5.00 105.19 114.95 1xyx n GLY 131 Ca -0.02 -1.83 -0.31 0.00 0.00 0.00 0.00 46.02 43.86 1xyx n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xyx s SER 132 N -3.28 6.56 -0.04 1.61 1.04 -1.26 -4.62 113.70 113.72 1xyx s SER 132 Ca 0.36 0.92 -0.30 0.00 0.48 0.00 0.00 55.95 57.41 1xyx s SER 132 Cb -0.01 -2.23 -0.07 0.00 0.10 0.00 0.00 66.02 63.81 1xyx s SER 132 CO 0.25 -0.19 1.83 0.00 0.98 0.00 0.00 173.24 176.11 1xyx s ALA 133 N -2.02 3.51 0.51 5.32 0.00 -1.26 -4.41 121.76 123.41 1xyx s ALA 133 Ca 0.47 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1xyx s ALA 133 Cb -0.11 -3.82 0.00 0.00 0.00 0.00 0.00 23.12 19.19 1xyx s ALA 133 CO 0.26 -1.62 0.00 -1.33 0.00 0.00 0.00 175.76 173.06 1xyx n MET 134 N 7.48 2.68 -4.69 0.00 2.81 -0.37 -4.98 117.12 120.04 1xyx n MET 134 Ca 0.19 0.00 -0.31 0.00 -1.81 0.00 0.00 57.70 55.78 1xyx n MET 134 Cb 0.42 0.00 -0.09 0.00 -0.71 0.00 0.00 33.22 32.85 1xyx n MET 134 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1xyx s SER 135 N -1.00 3.91 -0.45 7.83 0.15 -1.26 -5.00 113.70 117.87 1xyx s SER 135 Ca 0.00 -1.56 -0.40 0.00 0.70 0.00 0.00 55.95 54.69 1xyx s SER 135 Cb 0.00 0.22 -0.17 0.00 -1.71 0.00 0.00 66.02 64.36 1xyx s SER 135 CO 0.00 -0.73 1.89 0.54 1.20 0.00 0.00 173.24 176.14 1xyx n ARG 136 N -1.13 0.00 -1.32 5.44 1.74 -1.26 -4.94 116.66 115.18 1xyx n ARG 136 Ca -0.13 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.65 1xyx n ARG 136 Cb 0.67 -1.36 0.19 0.00 -1.02 0.00 0.00 32.46 30.94 1xyx n ARG 136 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1xyx s PRO 137 N 5.14 -0.03 -0.99 5.56 0.04 -1.26 -4.98 135.00 138.48 1xyx s PRO 137 Ca 1.07 0.11 -0.12 0.00 0.04 0.00 0.00 61.00 62.10 1xyx s PRO 137 Cb -1.36 -1.72 0.24 0.00 0.04 0.00 0.00 34.50 31.69 1xyx s PRO 137 CO 0.62 -2.95 1.00 -1.64 0.04 0.00 0.00 177.00 174.06 1xyx s MET 138 N -5.33 3.91 0.46 4.56 -1.94 -1.26 -5.01 119.30 114.68 1xyx s MET 138 Ca 0.68 -2.76 -0.19 0.00 -1.71 0.00 0.00 55.69 51.71 1xyx s MET 138 Cb -0.12 -4.57 -0.10 0.00 2.01 0.00 0.00 34.83 32.05 1xyx s MET 138 CO 0.55 -1.34 0.96 0.42 -0.01 0.00 0.00 175.02 175.60 1xyx s ILE 139 N -0.17 4.45 -0.04 2.53 -1.09 -1.26 -5.07 121.20 120.54 1xyx s ILE 139 Ca 0.27 1.38 -0.00 0.00 -2.23 0.00 0.00 60.65 60.06 1xyx s ILE 139 Cb -0.09 -3.65 0.03 0.00 -1.58 0.00 0.00 42.46 37.17 1xyx s ILE 139 CO -0.08 -0.46 0.00 -1.00 -1.23 0.00 0.00 174.94 172.18 1xyx s HIS 140 N -2.35 0.36 -1.05 3.97 3.76 -1.26 -5.04 115.29 113.69 1xyx s HIS 140 Ca 0.61 -0.01 0.10 0.00 -0.15 0.00 0.00 55.06 55.61 1xyx s HIS 140 Cb -0.09 -0.49 0.02 0.00 1.11 0.00 0.00 32.58 33.13 1xyx s HIS 140 CO 0.20 -0.17 0.70 1.19 -0.85 0.00 0.00 174.74 175.81 1xyx n PHE 141 N 4.40 0.00 -1.02 1.40 3.72 -1.26 -5.00 117.46 119.70 1xyx n PHE 141 Ca -0.21 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.18 1xyx n PHE 141 Cb 0.50 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.04 1xyx n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xyx n GLY 142 N 0.81 0.35 3.46 1.37 0.00 -1.26 -5.00 105.19 104.92 1xyx n GLY 142 Ca 0.05 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1xyx n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xyx n ASN 143 N -0.33 2.92 -0.04 1.61 3.02 -1.26 -5.08 115.26 116.10 1xyx n ASN 143 Ca -0.01 -2.88 -0.02 0.00 -0.03 0.00 0.00 54.58 51.64 1xyx n ASN 143 Cb 0.21 0.12 -0.01 0.00 -0.61 0.00 0.00 39.78 39.49 1xyx n ASN 143 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1xyx h ASP 144 N 0.83 0.00 0.59 6.41 3.32 -2.02 -3.43 116.42 122.12 1xyx h ASP 144 Ca -0.35 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.68 1xyx h ASP 144 Cb 1.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.73 1xyx h ASP 144 CO 0.57 0.37 -0.10 4.11 -1.72 0.00 0.00 179.24 182.47 1xyx h TRP 145 N -0.55 0.00 -0.52 4.55 5.08 -1.99 -2.04 115.95 120.48 1xyx h TRP 145 Ca 0.00 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.86 1xyx h TRP 145 Cb 0.19 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.34 1xyx h TRP 145 CO -0.08 0.10 -0.12 0.93 -1.28 0.00 0.00 178.44 177.99 1xyx h GLU 146 N 0.00 0.97 -0.43 0.12 5.08 -1.97 0.15 114.58 118.50 1xyx h GLU 146 Ca -0.00 -0.35 -0.10 0.00 -1.00 0.00 0.00 59.36 57.91 1xyx h GLU 146 Cb 0.42 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1xyx h GLU 146 CO 0.01 1.03 -0.11 0.22 -1.00 0.00 0.00 179.01 179.16 1xyx h ASP 147 N 0.86 0.84 0.14 1.42 3.58 -1.63 -0.84 116.42 120.79 1xyx h ASP 147 Ca 0.13 -0.36 0.01 0.00 0.42 0.00 0.00 57.03 57.24 1xyx h ASP 147 Cb 0.67 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.46 1xyx h ASP 147 CO 0.05 1.01 -0.25 -0.09 -2.88 0.00 0.00 179.24 177.08 1xyx h ARG 148 N 0.66 -0.44 -0.06 0.28 2.43 -1.36 -0.61 114.38 115.28 1xyx h ARG 148 Ca 0.11 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1xyx h ARG 148 Cb 0.64 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.26 1xyx h ARG 148 CO 0.04 -0.30 -0.14 -0.92 -1.51 0.00 0.00 179.97 177.14 1xyx h TYR 149 N -0.46 -0.37 -0.61 2.20 3.20 -0.59 -2.24 116.97 118.10 1xyx h TYR 149 Ca 0.02 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.01 1xyx h TYR 149 Cb 0.48 0.17 -0.07 0.00 1.54 0.00 0.00 36.73 38.85 1xyx h TYR 149 CO -0.22 -0.21 0.22 -0.92 -1.64 0.00 0.00 178.16 175.39 1xyx h TYR 150 N -0.21 0.38 0.00 -3.82 3.20 -1.08 -0.68 116.97 114.76 1xyx h TYR 150 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 1xyx h TYR 150 Cb 0.31 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.50 1xyx h TYR 150 CO -0.23 0.09 0.00 0.00 -1.64 0.00 0.00 178.16 176.38 1xyx h ARG 151 N 0.40 0.00 -0.03 1.82 3.08 -0.49 -1.28 114.38 117.89 1xyx h ARG 151 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 1xyx h ARG 151 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1xyx h ARG 151 CO -0.31 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 178.98 1xyx n GLU 152 N -2.55 0.15 0.00 0.04 1.02 -0.34 -4.65 120.64 114.32 1xyx n GLU 152 Ca -0.01 -0.96 0.00 0.00 -0.02 0.00 0.00 57.16 56.17 1xyx n GLU 152 Cb 0.10 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.39 1xyx n GLU 152 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xyx n ASN 153 N 0.33 0.42 -0.09 1.62 3.02 -0.76 -4.88 115.26 114.93 1xyx n ASN 153 Ca 0.04 -0.80 0.24 0.00 -0.03 0.00 0.00 54.58 54.03 1xyx n ASN 153 Cb 0.18 0.17 0.71 0.00 -0.61 0.00 0.00 39.78 40.22 1xyx n ASN 153 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xyx h MET 154 N 0.00 0.00 -0.04 3.52 -0.00 -1.51 -2.00 114.93 114.90 1xyx h MET 154 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.71 1xyx h MET 154 Cb 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.75 1xyx h MET 154 CO 0.00 0.00 0.05 0.10 -0.00 0.00 0.00 176.91 177.06 1xyx h TYR 155 N 0.00 0.00 0.00 -0.10 -0.00 -1.89 -2.11 116.97 112.87 1xyx h TYR 155 Ca 0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 59.07 1xyx h TYR 155 Cb 1.37 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.10 1xyx h TYR 155 CO 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 178.16 178.15 1xyx h ARG 156 N 0.00 0.00 -6.19 0.10 3.08 -1.77 -3.45 114.38 106.15 1xyx h ARG 156 Ca 0.02 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.51 1xyx h ARG 156 Cb 0.12 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.10 1xyx h ARG 156 CO -0.00 0.01 -0.55 0.71 -1.07 0.00 0.00 179.97 179.06 1xyx s TYR 157 N -3.77 3.16 0.91 3.04 2.02 -0.80 -5.11 117.35 116.80 1xyx s TYR 157 Ca -0.00 -0.02 -0.11 0.00 -0.37 0.00 0.00 57.07 56.56 1xyx s TYR 157 Cb 0.10 -1.50 0.14 0.00 -0.40 0.00 0.00 41.96 40.29 1xyx s TYR 157 CO 0.52 0.52 1.10 -1.25 -1.57 0.00 0.00 175.55 174.87 1xyx s PRO 158 N -3.23 1.15 0.00 -1.71 0.04 -1.26 -4.99 135.00 125.01 1xyx s PRO 158 Ca 0.31 1.09 0.02 0.00 0.04 0.00 0.00 61.00 62.46 1xyx s PRO 158 Cb -0.10 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1xyx s PRO 158 CO 0.24 -2.39 0.41 -1.71 0.04 0.00 0.00 177.00 173.59 1xyx n ASN 159 N -4.02 0.83 -4.45 6.66 5.15 -1.26 -5.00 115.26 113.16 1xyx n ASN 159 Ca 0.08 -0.91 -0.22 0.00 -0.60 0.00 0.00 54.58 52.93 1xyx n ASN 159 Cb 0.54 0.30 -0.10 0.00 -0.53 0.00 0.00 39.78 39.98 1xyx n ASN 159 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1xyx s GLN 160 N -0.45 1.61 0.08 1.20 -0.21 -1.26 -1.24 119.66 119.39 1xyx s GLN 160 Ca 0.02 -1.83 0.03 0.00 0.02 0.00 0.00 55.36 53.60 1xyx s GLN 160 Cb 0.01 -1.21 -0.03 0.00 1.00 0.00 0.00 33.01 32.79 1xyx s GLN 160 CO 0.03 0.02 -0.10 0.14 -2.12 0.00 0.00 175.29 173.27 1xyx s VAL 161 N -2.98 0.82 0.51 1.09 -7.23 -1.26 -4.96 120.40 106.38 1xyx s VAL 161 Ca 0.31 -1.44 -0.06 0.00 -1.81 0.00 0.00 61.98 58.98 1xyx s VAL 161 Cb 0.04 -1.11 -0.03 0.00 0.56 0.00 0.00 36.38 35.84 1xyx s VAL 161 CO 0.13 -0.48 0.82 -0.31 -0.31 0.00 0.00 175.10 174.95 1xyx s TYR 162 N -2.04 3.51 0.00 2.82 2.02 -1.26 -0.75 117.35 121.65 1xyx s TYR 162 Ca 0.00 0.81 0.00 0.00 -0.37 0.00 0.00 57.07 57.51 1xyx s TYR 162 Cb -0.05 -2.40 0.00 0.00 -0.40 0.00 0.00 41.96 39.10 1xyx s TYR 162 CO 0.00 -0.40 0.00 2.48 -1.57 0.00 0.00 175.55 176.06 1xyx n TYR 163 N -2.35 -0.03 -4.13 2.71 4.11 0.41 -4.68 117.16 113.20 1xyx n TYR 163 Ca 0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.83 1xyx n TYR 163 Cb 0.55 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.79 1xyx n TYR 163 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.86 175.88 1xyx s ARG 164 N 0.65 0.74 0.74 -3.48 3.03 -1.26 -0.44 118.95 118.93 1xyx s ARG 164 Ca 0.00 -1.30 -0.13 0.00 2.03 0.00 0.00 55.73 56.33 1xyx s ARG 164 Cb 0.00 0.07 0.04 0.00 -1.03 0.00 0.00 34.95 34.03 1xyx s ARG 164 CO 0.00 -0.10 1.12 -1.25 -1.13 0.00 0.00 175.30 173.94 1xyx s PRO 165 N -3.91 2.31 -0.02 3.89 0.04 -1.26 -4.94 135.00 131.12 1xyx s PRO 165 Ca 0.12 1.37 -0.23 0.00 0.04 0.00 0.00 61.00 62.30 1xyx s PRO 165 Cb 0.07 -1.89 -0.16 0.00 0.04 0.00 0.00 34.50 32.56 1xyx s PRO 165 CO -0.06 -1.63 1.04 -0.39 0.04 0.00 0.00 177.00 176.00 1xyx h VAL 166 N -0.65 0.69 -2.58 -0.36 -1.51 -1.97 -3.47 116.25 106.39 1xyx h VAL 166 Ca -0.45 -0.80 -0.04 0.00 -1.23 0.00 0.00 66.70 64.18 1xyx h VAL 166 Cb 1.25 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 1xyx h VAL 166 CO 0.51 0.15 -0.25 0.47 -1.23 0.00 0.00 177.57 177.21 1xyx n ASP 167 N -5.05 -1.43 -3.11 4.19 9.92 -1.26 -2.08 116.55 117.73 1xyx n ASP 167 Ca -0.09 0.04 -0.20 0.00 -0.53 0.00 0.00 54.79 54.02 1xyx n ASP 167 Cb 0.26 -0.37 0.02 0.00 -0.64 0.00 0.00 41.12 40.40 1xyx n ASP 167 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xyx n GLN 168 N 0.39 -2.21 -0.72 -1.24 6.02 -1.26 -5.04 117.38 113.32 1xyx n GLN 168 Ca -0.01 1.85 -0.30 0.00 -0.01 0.00 0.00 57.00 58.53 1xyx n GLN 168 Cb 0.13 -4.19 0.26 0.00 1.02 0.00 0.00 30.24 27.47 1xyx n GLN 168 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1xyx s TYR 169 N -2.11 -0.06 0.37 1.08 5.04 -0.88 -5.03 117.35 115.75 1xyx s TYR 169 Ca 0.29 0.55 0.00 0.00 -2.44 0.00 0.00 57.07 55.47 1xyx s TYR 169 Cb -0.06 -3.18 0.00 0.00 0.35 0.00 0.00 41.96 39.08 1xyx s TYR 169 CO 0.80 -4.44 0.00 0.43 -1.34 0.00 0.00 175.55 171.00 1xyx n SER 170 N -5.20 -2.32 -3.36 4.32 7.64 -1.26 -5.13 113.62 108.29 1xyx n SER 170 Ca 0.13 0.68 -0.14 0.00 1.01 0.00 0.00 58.87 60.54 1xyx n SER 170 Cb 0.60 2.27 -0.08 0.00 -1.01 0.00 0.00 64.21 65.99 1xyx n SER 170 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1xyx s ASN 171 N -3.18 1.21 0.21 6.43 2.20 -1.26 -5.02 114.94 115.52 1xyx s ASN 171 Ca 0.00 -0.67 -0.10 0.00 -0.94 0.00 0.00 52.86 51.16 1xyx s ASN 171 Cb 0.00 0.72 0.15 0.00 -2.00 0.00 0.00 41.25 40.12 1xyx s ASN 171 CO 0.00 -0.37 1.84 -0.61 -2.94 0.00 0.00 177.10 175.01 1xyx h GLN 172 N 8.18 1.04 -0.32 3.55 4.15 -2.00 -1.91 115.11 127.79 1xyx h GLN 172 Ca -0.11 -0.11 -0.02 0.00 0.77 0.00 0.00 58.65 59.18 1xyx h GLN 172 Cb 1.09 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.56 1xyx h GLN 172 CO 0.31 0.75 0.11 -0.91 -1.93 0.00 0.00 178.83 177.16 1xyx h ASN 173 N 1.04 0.46 -0.23 -0.69 2.35 -1.98 0.19 115.58 116.71 1xyx h ASN 173 Ca 0.27 -0.19 -0.10 0.00 -0.55 0.00 0.00 56.30 55.72 1xyx h ASN 173 Cb 0.00 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 1xyx h ASN 173 CO -0.05 0.53 -0.25 0.78 -1.65 0.00 0.00 177.43 176.80 1xyx h ASN 174 N 0.36 0.62 0.20 5.81 4.21 -1.96 -0.58 115.58 124.25 1xyx h ASN 174 Ca 0.10 -0.48 0.01 0.00 1.21 0.00 0.00 56.30 57.14 1xyx h ASN 174 Cb 0.23 -0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 37.21 1xyx h ASN 174 CO -0.00 0.98 -0.47 0.15 -1.29 0.00 0.00 177.43 176.79 1xyx h PHE 175 N 0.28 -1.33 0.10 1.19 3.04 -1.10 -0.96 116.94 118.15 1xyx h PHE 175 Ca 0.04 0.03 0.01 0.00 3.98 0.00 0.00 57.97 62.03 1xyx h PHE 175 Cb 0.81 0.56 -0.05 0.00 2.56 0.00 0.00 35.95 39.83 1xyx h PHE 175 CO 0.08 -0.58 -0.53 0.28 -2.02 0.00 0.00 178.31 175.54 1xyx h VAL 176 N -0.76 0.01 -0.39 1.41 2.07 -0.58 0.03 116.25 118.03 1xyx h VAL 176 Ca -0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1xyx h VAL 176 Cb 0.75 0.01 -0.08 0.00 -1.52 0.00 0.00 31.29 30.44 1xyx h VAL 176 CO -0.22 0.00 -0.15 -0.74 0.02 0.00 0.00 177.57 176.48 1xyx h HIS 177 N -0.74 -0.37 0.34 1.57 -0.00 -1.02 0.12 115.15 115.05 1xyx h HIS 177 Ca -0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 60.37 60.39 1xyx h HIS 177 Cb 0.75 0.22 0.00 0.00 -0.00 0.00 0.00 27.41 28.39 1xyx h HIS 177 CO -0.46 -0.23 -0.16 0.22 -0.00 0.00 0.00 177.93 177.29 1xyx h ASP 178 N -0.07 -0.38 0.85 3.26 3.58 -0.55 -0.14 116.42 122.96 1xyx h ASP 178 Ca 0.19 -0.05 -0.15 0.00 0.42 0.00 0.00 57.03 57.45 1xyx h ASP 178 Cb 0.37 0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.50 1xyx h ASP 178 CO -0.45 -0.19 -0.70 0.00 -2.88 0.00 0.00 179.24 175.02 1xyx h VAL 180 N 0.00 1.12 -0.21 0.00 2.07 -0.76 -0.73 116.25 117.75 1xyx h VAL 180 Ca -0.01 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1xyx h VAL 180 Cb 1.31 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1xyx h VAL 180 CO 0.09 0.13 0.04 -1.13 0.02 0.00 0.00 177.57 176.72 1xyx h ASN 181 N 0.47 0.32 -0.60 0.57 -1.24 -0.40 -0.14 115.58 114.56 1xyx h ASN 181 Ca 0.13 -0.25 -0.05 0.00 0.71 0.00 0.00 56.30 56.85 1xyx h ASN 181 Cb 0.01 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 38.95 1xyx h ASN 181 CO -0.02 0.49 0.21 0.40 -1.29 0.00 0.00 177.43 177.22 1xyx h ILE 182 N 0.15 1.23 -0.10 2.57 1.08 -0.88 0.46 117.51 122.02 1xyx h ILE 182 Ca 0.06 -0.78 -0.04 0.00 -0.39 0.00 0.00 64.86 63.71 1xyx h ILE 182 Cb 0.29 0.52 -0.00 0.00 -3.07 0.00 0.00 36.82 34.56 1xyx h ILE 182 CO 0.00 0.31 -0.09 0.74 -0.69 0.00 0.00 178.15 178.42 1xyx h THR 183 N 0.93 1.35 -0.45 -0.27 2.02 -0.87 -1.93 112.91 113.69 1xyx h THR 183 Ca 0.21 -1.22 0.06 0.00 0.77 0.00 0.00 66.41 66.23 1xyx h THR 183 Cb 0.24 1.95 -0.05 0.00 -1.74 0.00 0.00 68.15 68.55 1xyx h THR 183 CO -0.01 0.34 0.16 0.40 0.37 0.00 0.00 175.52 176.78 1xyx h ILE 184 N -0.17 0.85 -0.17 3.11 2.04 -0.78 -1.39 117.51 121.01 1xyx h ILE 184 Ca 0.02 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.80 1xyx h ILE 184 Cb 0.59 0.49 -0.07 0.00 -0.74 0.00 0.00 36.82 37.10 1xyx h ILE 184 CO 0.02 0.06 -0.47 0.50 0.00 0.00 0.00 178.15 178.26 1xyx h LYS 185 N 0.33 -0.49 0.14 2.37 3.64 -0.06 -0.21 116.57 122.28 1xyx h LYS 185 Ca 0.21 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1xyx h LYS 185 Cb 0.21 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1xyx h LYS 185 CO -0.22 -0.33 -0.21 1.96 -2.27 0.00 0.00 179.45 178.39 1xyx h GLN 186 N -0.51 -0.40 0.00 1.90 1.08 -0.56 0.36 115.11 116.98 1xyx h GLN 186 Ca 0.07 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 1xyx h GLN 186 Cb 0.65 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 1xyx h GLN 186 CO -0.44 -0.26 0.00 0.72 -0.95 0.00 0.00 178.83 177.90 1xyx n HIS 187 N -5.33 0.26 0.09 2.96 8.25 -0.60 -0.48 115.22 120.37 1xyx n HIS 187 Ca -0.07 0.13 0.04 0.00 -0.26 0.00 0.00 57.72 57.57 1xyx n HIS 187 Cb 0.25 -0.71 0.08 0.00 1.12 0.00 0.00 29.99 30.73 1xyx n HIS 187 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1xyx n THR 188 N -1.77 0.55 0.07 1.59 -1.04 0.08 -4.50 114.28 109.25 1xyx n THR 188 Ca -0.00 -0.77 0.00 0.00 -2.04 0.00 0.00 64.05 61.24 1xyx n THR 188 Cb 0.03 0.81 0.00 0.00 -1.82 0.00 0.00 70.33 69.35 1xyx n THR 188 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1xyx n VAL 189 N 0.39 0.12 1.07 12.58 0.31 0.10 -4.46 118.33 128.45 1xyx n VAL 189 Ca 0.07 0.04 0.07 0.00 -0.01 0.00 0.00 64.34 64.51 1xyx n VAL 189 Cb 0.31 -0.46 0.39 0.00 -0.91 0.00 0.00 33.84 33.17 1xyx n VAL 189 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1xyx n THR 190 N -3.01 0.00 -0.03 2.52 5.66 0.37 -0.88 114.28 118.90 1xyx n THR 190 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 1xyx n THR 190 Cb 0.00 -0.62 -0.03 0.00 -1.55 0.00 0.00 70.33 68.14 1xyx n THR 190 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1xyx n THR 191 N -0.88 0.36 0.22 1.09 -1.04 -1.23 -4.70 114.28 108.09 1xyx n THR 191 Ca 0.10 -0.12 0.05 0.00 -2.04 0.00 0.00 64.05 62.04 1xyx n THR 191 Cb 0.05 -0.92 0.50 0.00 -1.82 0.00 0.00 70.33 68.13 1xyx n THR 191 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1xyx h THR 192 N -0.06 1.13 -0.29 12.58 2.02 -1.10 -0.40 112.91 126.79 1xyx h THR 192 Ca -0.14 -0.64 0.08 0.00 0.77 0.00 0.00 66.41 66.48 1xyx h THR 192 Cb 1.20 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 1xyx h THR 192 CO -0.04 0.18 0.24 0.00 0.37 0.00 0.00 175.52 176.27 1xyx h THR 193 N 0.00 0.69 0.00 3.16 1.03 -1.29 -3.21 112.91 113.29 1xyx h THR 193 Ca -0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 66.41 66.38 1xyx h THR 193 Cb 0.33 0.83 -0.00 0.00 -1.07 0.00 0.00 68.15 68.23 1xyx h THR 193 CO 0.02 0.00 -0.88 0.29 -0.01 0.00 0.00 175.52 174.94 1xyx n LYS 194 N -4.19 0.51 0.00 0.00 5.02 -0.22 -5.00 118.16 114.27 1xyx n LYS 194 Ca 0.04 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1xyx n LYS 194 Cb 0.40 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1xyx n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xyx n GLY 195 N 1.51 -1.53 3.02 0.72 0.00 -0.83 -5.15 105.19 102.93 1xyx n GLY 195 Ca -0.13 0.64 -0.13 0.00 0.00 0.00 0.00 46.02 46.40 1xyx n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xyx s GLU 196 N 0.00 0.16 0.00 1.61 2.56 -1.07 -4.93 118.70 117.03 1xyx s GLU 196 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 54.97 55.73 1xyx s GLU 196 Cb 0.00 -0.02 0.00 0.00 2.00 0.00 0.00 34.13 36.11 1xyx s GLU 196 CO 0.00 -0.28 0.00 -1.71 -0.56 0.00 0.00 175.26 172.71 1xyx n ASN 197 N 5.30 0.00 -3.93 -1.70 2.85 -1.26 -2.62 115.26 113.90 1xyx n ASN 197 Ca -0.07 -0.98 -0.09 0.00 -0.11 0.00 0.00 54.58 53.32 1xyx n ASN 197 Cb 0.50 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.45 1xyx n ASN 197 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1xyx s PHE 198 N -4.83 0.32 0.45 1.20 0.40 -1.26 -5.13 117.98 109.13 1xyx s PHE 198 Ca 0.00 -0.71 -0.02 0.00 -0.60 0.00 0.00 56.93 55.60 1xyx s PHE 198 Cb 0.00 -0.07 -0.02 0.00 0.51 0.00 0.00 43.02 43.44 1xyx s PHE 198 CO 0.00 -0.66 0.70 0.95 0.70 0.00 0.00 175.22 176.91 1xyx s THR 199 N -3.93 4.58 0.41 0.64 -4.23 -1.26 -4.86 115.64 106.98 1xyx s THR 199 Ca 0.13 -0.20 0.20 0.00 -1.18 0.00 0.00 61.69 60.64 1xyx s THR 199 Cb 0.04 -3.71 0.41 0.00 1.34 0.00 0.00 72.50 70.57 1xyx s THR 199 CO -0.04 -0.58 1.78 -0.08 -0.54 0.00 0.00 174.62 175.16 1xyx h GLU 200 N 0.37 0.34 0.31 3.99 4.81 -2.02 0.14 114.58 122.52 1xyx h GLU 200 Ca -0.47 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 1xyx h GLU 200 Cb 1.23 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1xyx h GLU 200 CO 0.60 0.23 -0.15 1.15 -0.73 0.00 0.00 179.01 180.11 1xyx h THR 201 N 0.35 0.72 -0.30 0.32 2.02 -1.99 0.13 112.91 114.16 1xyx h THR 201 Ca 0.59 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 67.47 1xyx h THR 201 Cb 1.56 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 1xyx h THR 201 CO -0.27 0.05 -0.15 0.44 0.37 0.00 0.00 175.52 175.96 1xyx h ASP 202 N -0.53 0.50 0.12 4.18 3.32 -1.37 -2.64 116.42 119.99 1xyx h ASP 202 Ca -0.04 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 56.88 1xyx h ASP 202 Cb 0.40 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1xyx h ASP 202 CO 0.07 0.68 -0.17 0.58 -1.72 0.00 0.00 179.24 178.68 1xyx h VAL 203 N 0.47 0.61 -0.48 -1.35 2.07 -0.57 -0.68 116.25 116.32 1xyx h VAL 203 Ca 0.08 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 1xyx h VAL 203 Cb 0.54 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1xyx h VAL 203 CO 0.03 0.00 0.23 0.07 0.02 0.00 0.00 177.57 177.92 1xyx h LYS 204 N -0.35 0.67 -0.10 1.57 2.10 -0.64 -0.63 116.57 119.19 1xyx h LYS 204 Ca 0.02 -0.08 -0.12 0.00 -2.00 0.00 0.00 60.65 58.47 1xyx h LYS 204 Cb 0.35 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 31.54 1xyx h LYS 204 CO -0.08 0.53 -0.46 0.52 -2.00 0.00 0.00 179.45 177.96 1xyx h MET 205 N 0.68 0.25 -0.44 0.07 2.86 -1.09 -1.47 114.93 115.79 1xyx h MET 205 Ca 0.17 -0.13 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 1xyx h MET 205 Cb 0.08 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1xyx h MET 205 CO -0.02 0.66 -0.15 0.52 1.06 0.00 0.00 176.91 178.98 1xyx h MET 206 N 0.20 0.88 -0.02 1.72 2.86 -0.24 -1.31 114.93 119.02 1xyx h MET 206 Ca 0.01 -0.36 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 1xyx h MET 206 Cb 0.89 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.51 1xyx h MET 206 CO 0.07 1.00 0.03 0.93 1.06 0.00 0.00 176.91 180.00 1xyx h GLU 207 N 0.71 0.00 0.26 1.72 5.08 -0.58 0.22 114.58 122.00 1xyx h GLU 207 Ca 0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1xyx h GLU 207 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1xyx h GLU 207 CO 0.05 0.00 -0.13 -0.09 -1.00 0.00 0.00 179.01 177.85 1xyx h ARG 208 N 0.00 -0.34 -0.12 2.33 9.65 -0.87 -3.25 114.38 121.78 1xyx h ARG 208 Ca 0.01 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 1xyx h ARG 208 Cb 0.07 0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.72 1xyx h ARG 208 CO -0.00 -0.08 0.05 -0.24 2.80 0.00 0.00 179.97 182.50 1xyx h VAL 209 N -1.02 1.13 -0.13 0.20 3.04 -0.30 -1.59 116.25 117.57 1xyx h VAL 209 Ca -0.04 -0.38 -0.11 0.00 -1.01 0.00 0.00 66.70 65.17 1xyx h VAL 209 Cb 0.42 1.17 -0.01 0.00 -2.01 0.00 0.00 31.29 30.86 1xyx h VAL 209 CO 0.06 0.12 -0.40 0.58 -1.01 0.00 0.00 177.57 176.91 1xyx h VAL 210 N 0.05 1.31 0.70 1.51 2.07 -0.81 0.27 116.25 121.35 1xyx h VAL 210 Ca 0.04 -1.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.01 1xyx h VAL 210 Cb 0.14 1.65 0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1xyx h VAL 210 CO -0.00 0.46 -0.34 -0.08 0.02 0.00 0.00 177.57 177.63 1xyx h GLU 211 N 0.25 -0.91 -0.15 1.57 4.81 -1.53 0.04 114.58 118.65 1xyx h GLU 211 Ca 0.02 0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1xyx h GLU 211 Cb 0.82 0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1xyx h GLU 211 CO 0.07 -0.60 0.09 1.96 -0.73 0.00 0.00 179.01 179.80 1xyx h GLN 212 N -0.97 0.21 -0.28 1.92 1.08 -0.93 0.18 115.11 116.32 1xyx h GLN 212 Ca -0.10 -0.02 0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1xyx h GLN 212 Cb 0.73 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 28.06 1xyx h GLN 212 CO 0.16 0.17 -0.09 0.52 -0.95 0.00 0.00 178.83 178.64 1xyx h MET 213 N 0.18 -0.02 -0.43 1.46 2.86 -1.00 -1.99 114.93 115.99 1xyx h MET 213 Ca 0.06 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.78 1xyx h MET 213 Cb 0.01 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.61 1xyx h MET 213 CO -0.01 -0.02 -0.03 0.00 1.06 0.00 0.00 176.91 177.91 1xyx h VAL 215 N 0.07 0.78 -0.11 0.00 2.07 -0.26 0.21 116.25 119.02 1xyx h VAL 215 Ca 0.21 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 1xyx h VAL 215 Cb 0.32 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1xyx h VAL 215 CO -0.38 0.00 0.07 0.74 0.02 0.00 0.00 177.57 178.01 1xyx h THR 216 N -0.17 1.07 -0.72 2.57 2.02 -1.28 -1.07 112.91 115.34 1xyx h THR 216 Ca 0.03 -0.18 -0.04 0.00 0.77 0.00 0.00 66.41 66.99 1xyx h THR 216 Cb 0.19 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 1xyx h THR 216 CO -0.07 0.06 0.30 -0.61 0.37 0.00 0.00 175.52 175.57 1xyx h GLN 217 N 0.11 1.05 0.18 6.66 5.75 -0.31 0.16 115.11 128.71 1xyx h GLN 217 Ca 0.04 -0.17 -0.01 0.00 -0.15 0.00 0.00 58.65 58.36 1xyx h GLN 217 Cb 0.04 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.41 1xyx h GLN 217 CO -0.01 0.84 -0.09 -0.92 -2.65 0.00 0.00 178.83 176.01 1xyx h TYR 218 N 1.03 -0.22 -1.01 3.99 3.20 -0.55 -2.08 116.97 121.33 1xyx h TYR 218 Ca 0.24 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.21 1xyx h TYR 218 Cb 0.18 0.07 -0.08 0.00 1.54 0.00 0.00 36.73 38.44 1xyx h TYR 218 CO 0.02 0.03 0.64 1.96 -1.64 0.00 0.00 178.16 179.17 1xyx h GLN 219 N -0.46 1.01 -0.24 1.82 4.20 -0.57 0.32 115.11 121.20 1xyx h GLN 219 Ca -0.02 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1xyx h GLN 219 Cb 0.35 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1xyx h GLN 219 CO 0.04 0.67 0.15 0.87 -0.67 0.00 0.00 178.83 179.89 1xyx h LYS 220 N 1.04 0.32 -0.49 1.46 1.57 -0.62 0.21 116.57 120.08 1xyx h LYS 220 Ca 0.48 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 59.11 1xyx h LYS 220 Cb 0.41 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1xyx h LYS 220 CO -0.24 0.24 -0.20 0.93 -0.57 0.00 0.00 179.45 179.61 1xyx h GLU 221 N 0.30 0.98 -0.67 3.15 4.39 -0.58 -2.34 114.58 119.82 1xyx h GLU 221 Ca 0.09 -0.41 0.04 0.00 0.34 0.00 0.00 59.36 59.42 1xyx h GLU 221 Cb 0.00 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.56 1xyx h GLU 221 CO -0.02 1.08 0.40 1.03 -1.16 0.00 0.00 179.01 180.34 1xyx h SER 222 N 0.85 0.64 -0.19 1.42 0.87 -0.20 -2.25 113.55 114.69 1xyx h SER 222 Ca 0.11 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.71 1xyx h SER 222 Cb 0.77 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.58 1xyx h SER 222 CO 0.06 0.43 0.05 -0.61 -0.53 0.00 0.00 176.83 176.23 1xyx h GLN 223 N 0.77 0.13 -0.82 2.24 4.15 -0.27 -0.14 115.11 121.16 1xyx h GLN 223 Ca 0.28 -0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.76 1xyx h GLN 223 Cb 0.08 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.69 1xyx h GLN 223 CO -0.13 0.08 0.54 0.00 -1.93 0.00 0.00 178.83 177.39 1xyx h ALA 224 N 1.13 1.60 -0.03 3.38 0.00 -0.88 0.43 119.26 124.88 1xyx h ALA 224 Ca 0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xyx h ALA 224 Cb 0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xyx h ALA 224 CO -0.10 0.28 0.01 -0.92 0.00 0.00 0.00 179.25 178.52 1xyx h TYR 225 N 0.91 0.05 -0.16 0.00 5.03 -1.07 -3.25 116.97 118.49 1xyx h TYR 225 Ca 0.35 -0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.57 1xyx h TYR 225 Cb 0.22 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.47 1xyx h TYR 225 CO -0.00 0.23 -0.30 1.88 -1.32 0.00 0.00 178.16 178.65 1xyx h TYR 226 N -0.15 0.34 0.00 -3.82 0.05 0.35 -3.13 116.97 110.61 1xyx h TYR 226 Ca 0.01 -0.07 -0.02 0.00 0.05 0.00 0.00 58.73 58.69 1xyx h TYR 226 Cb 0.21 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 37.86 1xyx h TYR 226 CO -0.01 0.58 -0.12 -0.44 -1.05 0.00 0.00 178.16 177.13 1xyx h ASP 227 N 0.27 0.00 0.00 3.88 5.19 -0.25 -2.92 116.42 122.59 1xyx h ASP 227 Ca 0.04 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1xyx h ASP 227 Cb 0.67 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.18 1xyx h ASP 227 CO 0.05 0.12 -0.00 0.61 -3.12 0.00 0.00 179.24 176.89 1xyx n GLY 228 N -0.17 1.91 0.05 2.75 0.00 -1.18 -3.05 105.19 105.50 1xyx n GLY 228 Ca -0.00 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.02 1xyx n GLY 228 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xyx n ARG 229 N 1.67 1.81 -2.83 1.61 -4.01 -1.10 -4.94 116.66 108.86 1xyx n ARG 229 Ca 0.00 -1.44 -0.36 0.00 -1.04 0.00 0.00 57.85 55.01 1xyx n ARG 229 Cb 0.36 -0.95 -0.01 0.00 -3.04 0.00 0.00 32.46 28.82 1xyx n ARG 229 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 1xyx n ARG 230 N -0.53 4.46 -0.80 2.89 5.12 -1.17 -4.73 116.66 121.90 1xyx n ARG 230 Ca 0.03 -4.72 -0.09 0.00 -1.93 0.00 0.00 57.85 51.14 1xyx n ARG 230 Cb 0.41 -2.39 -0.03 0.00 -1.16 0.00 0.00 32.46 29.29 1xyx n ARG 230 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1xyx n SER 231 N 0.11 5.71 0.00 0.55 7.64 -1.26 -5.20 113.62 121.18 1xyx n SER 231 Ca 0.38 -2.66 0.00 0.00 1.01 0.00 0.00 58.87 57.60 1xyx n SER 231 Cb 0.32 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 1xyx n SER 231 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83