#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 -0.52 0.00 2.52 0.24 -1.26 -0.63 118.33 118.67 1xyx n VAL 122 Ca 0.00 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1xyx n VAL 122 Cb 0.00 -0.84 0.00 0.00 -1.47 0.00 0.00 33.84 31.53 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 -1.62 2.19 0.00 7.63 0.00 -1.26 -4.21 105.19 107.92 1xyx n GLY 123 Ca -0.04 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.81 0.29 -0.02 0.00 0.20 -5.03 105.19 98.82 1xyx n GLY 124 Ca 0.00 0.85 0.05 0.00 0.00 0.00 0.00 46.02 46.92 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 1.43 0.00 0.99 7.99 -1.13 -5.01 117.00 121.27 1xyx n LEU 125 Ca 0.00 -0.83 0.00 0.00 -0.01 0.00 0.00 56.01 55.17 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 0.28 0.00 0.61 -1.51 0.00 0.00 177.39 176.77 1xyx n GLY 126 N 0.82 1.51 0.00 -0.72 0.00 -1.26 -4.03 105.19 101.50 1xyx n GLY 126 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.79 3.76 -0.02 0.00 -1.26 -4.82 105.19 101.06 1xyx n GLY 127 Ca 0.00 0.71 -0.41 0.00 0.00 0.00 0.00 46.02 46.32 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 3.05 -0.32 1.61 1.51 -1.26 -4.93 117.35 117.01 1xyx s TYR 128 Ca 0.00 1.31 -0.28 0.00 -1.01 0.00 0.00 57.07 57.09 1xyx s TYR 128 Cb 0.00 -3.71 -0.04 0.00 -0.11 0.00 0.00 41.96 38.10 1xyx s TYR 128 CO 0.00 -2.06 2.12 1.41 -1.11 0.00 0.00 175.55 175.90 1xyx s MET 129 N -1.35 2.98 0.24 -0.62 -2.45 0.62 -4.78 119.30 113.94 1xyx s MET 129 Ca 0.52 1.67 -0.30 0.00 -1.25 0.00 0.00 55.69 56.33 1xyx s MET 129 Cb -0.40 -4.36 -0.09 0.00 1.25 0.00 0.00 34.83 31.23 1xyx s MET 129 CO 0.50 -2.28 1.03 -1.17 1.05 0.00 0.00 175.02 174.15 1xyx s LEU 130 N 8.64 4.58 0.00 4.11 2.96 -1.26 -0.90 118.68 136.81 1xyx s LEU 130 Ca 0.92 2.10 -0.01 0.00 -0.22 0.00 0.00 54.13 56.93 1xyx s LEU 130 Cb -0.26 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 42.83 1xyx s LEU 130 CO 0.32 -0.03 0.08 0.61 -1.32 0.00 0.00 176.35 176.01 1xyx n GLY 131 N 1.47 -1.05 3.80 7.98 0.00 0.69 -4.97 105.19 113.11 1xyx n GLY 131 Ca -0.01 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 1xyx n GLY 131 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xyx s SER 132 N -1.31 5.64 -0.00 1.61 0.01 -1.26 -4.71 113.70 113.68 1xyx s SER 132 Ca 0.05 0.02 -0.30 0.00 1.31 0.00 0.00 55.95 57.03 1xyx s SER 132 Cb -0.00 -1.55 -0.07 0.00 0.21 0.00 0.00 66.02 64.61 1xyx s SER 132 CO 0.03 0.16 1.75 0.00 0.41 0.00 0.00 173.24 175.60 1xyx s ALA 133 N -1.43 3.62 0.00 1.44 0.00 -1.26 -4.54 121.76 119.59 1xyx s ALA 133 Ca 0.30 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.37 1xyx s ALA 133 Cb -0.12 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1xyx s ALA 133 CO 0.23 -1.40 0.00 -1.33 0.00 0.00 0.00 175.76 173.26 1xyx n MET 134 N 6.99 1.75 -4.01 0.00 2.81 -0.73 -4.99 117.12 118.94 1xyx n MET 134 Ca 0.18 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.85 1xyx n MET 134 Cb 0.42 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.90 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 -0.90 5.89 -0.37 7.83 0.15 -1.26 -5.02 113.70 120.01 1xyx s SER 135 Ca 0.00 -0.12 -0.40 0.00 0.70 0.00 0.00 55.95 56.13 1xyx s SER 135 Cb 0.00 -1.58 -0.15 0.00 -1.71 0.00 0.00 66.02 62.57 1xyx s SER 135 CO 0.00 -0.08 1.97 -2.11 1.20 0.00 0.00 173.24 174.22 1xyx n ARG 136 N -1.31 0.76 -1.01 5.44 1.85 -1.26 -4.95 116.66 116.19 1xyx n ARG 136 Ca -0.08 0.25 -0.29 0.00 -1.00 0.00 0.00 57.85 56.73 1xyx n ARG 136 Cb 0.58 -2.03 0.21 0.00 -1.05 0.00 0.00 32.46 30.17 1xyx n ARG 136 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1xyx s PRO 137 N 4.94 -0.39 -0.33 2.89 0.04 -1.26 -4.99 135.00 135.90 1xyx s PRO 137 Ca 1.08 0.39 -0.17 0.00 0.04 0.00 0.00 61.00 62.34 1xyx s PRO 137 Cb -1.14 -1.65 -0.01 0.00 0.04 0.00 0.00 34.50 31.74 1xyx s PRO 137 CO 0.62 -3.26 0.48 -1.64 0.04 0.00 0.00 177.00 173.24 1xyx s MET 138 N -4.98 3.73 0.07 4.56 -1.94 -1.26 -5.05 119.30 114.42 1xyx s MET 138 Ca 0.67 -0.09 0.08 0.00 -1.71 0.00 0.00 55.69 54.64 1xyx s MET 138 Cb -0.18 -3.77 -0.04 0.00 2.01 0.00 0.00 34.83 32.86 1xyx s MET 138 CO 0.58 -0.55 -0.18 0.42 -0.01 0.00 0.00 175.02 175.29 1xyx s ILE 139 N 2.31 2.82 -0.42 2.53 -1.09 -1.26 -5.02 121.20 121.06 1xyx s ILE 139 Ca 0.18 -1.31 0.05 0.00 -2.23 0.00 0.00 60.65 57.33 1xyx s ILE 139 Cb -0.16 -2.23 0.18 0.00 -1.58 0.00 0.00 42.46 38.67 1xyx s ILE 139 CO 0.12 0.24 0.38 0.00 -1.23 0.00 0.00 174.94 174.45 1xyx n HIS 140 N 1.24 -0.63 0.26 3.97 1.44 -1.26 -4.96 115.22 115.28 1xyx n HIS 140 Ca -0.16 -3.39 0.13 0.00 -2.01 0.00 0.00 57.72 52.29 1xyx n HIS 140 Cb 0.52 0.13 0.73 0.00 0.12 0.00 0.00 29.99 31.49 1xyx n HIS 140 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1xyx h PHE 141 N 5.36 0.00 0.00 -1.40 0.04 -1.98 -3.46 116.94 115.50 1xyx h PHE 141 Ca 0.23 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.00 1xyx h PHE 141 Cb 0.90 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.05 1xyx h PHE 141 CO 0.30 0.11 0.00 0.41 -0.60 0.00 0.00 178.31 178.53 1xyx n GLY 142 N -0.67 0.58 3.05 -1.45 0.00 -1.26 -5.05 105.19 100.39 1xyx n GLY 142 Ca -0.02 -0.46 -0.24 0.00 0.00 0.00 0.00 46.02 45.30 1xyx n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xyx s ASN 143 N -2.42 1.81 0.51 1.61 0.01 -1.26 -5.03 114.94 110.17 1xyx s ASN 143 Ca 0.00 -0.30 0.21 0.00 -0.71 0.00 0.00 52.86 52.07 1xyx s ASN 143 Cb 0.00 -0.68 1.36 0.00 0.41 0.00 0.00 41.25 42.34 1xyx s ASN 143 CO 0.00 0.08 2.11 0.44 -1.51 0.00 0.00 177.10 178.21 1xyx h ASP 144 N 6.65 0.00 0.42 -1.22 3.32 -2.00 -1.08 116.42 122.52 1xyx h ASP 144 Ca -0.32 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.42 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 0.48 0.09 -1.54 4.11 -1.72 0.00 0.00 179.24 180.65 1xyx h TRP 145 N 0.00 0.50 -0.04 4.55 5.08 -1.99 -3.29 115.95 120.76 1xyx h TRP 145 Ca -0.00 -0.37 -0.02 0.00 1.08 0.00 0.00 58.89 59.58 1xyx h TRP 145 Cb 0.18 -0.02 -0.00 0.00 -3.00 0.00 0.00 29.16 26.32 1xyx h TRP 145 CO 0.00 1.41 -0.06 0.93 -1.28 0.00 0.00 178.44 179.45 1xyx h GLU 146 N 0.08 0.11 -0.45 0.12 5.08 -1.70 0.16 114.58 117.98 1xyx h GLU 146 Ca -0.25 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.00 1xyx h GLU 146 Cb 2.03 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 31.26 1xyx h GLU 146 CO 0.17 0.61 0.10 -0.44 -1.00 0.00 0.00 179.01 178.45 1xyx h ASP 147 N -0.38 0.62 -0.03 1.42 3.32 -1.44 -1.91 116.42 118.02 1xyx h ASP 147 Ca 0.00 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1xyx h ASP 147 Cb 0.60 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 1xyx h ASP 147 CO 0.01 0.63 -0.04 -0.09 -1.72 0.00 0.00 179.24 178.04 1xyx h ARG 148 N 0.65 0.09 -0.53 3.56 2.43 -1.62 -3.22 114.38 115.74 1xyx h ARG 148 Ca 0.15 -0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.37 1xyx h ARG 148 Cb 0.26 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 29.71 1xyx h ARG 148 CO -0.00 0.56 -0.29 -0.92 -1.51 0.00 0.00 179.97 177.81 1xyx h TYR 149 N -0.38 -0.76 -0.83 2.20 3.20 -0.24 0.15 116.97 120.30 1xyx h TYR 149 Ca 0.01 0.06 0.17 0.00 3.14 0.00 0.00 58.73 62.10 1xyx h TYR 149 Cb 0.54 0.41 -0.10 0.00 1.54 0.00 0.00 36.73 39.12 1xyx h TYR 149 CO 0.10 -0.35 0.37 -0.92 -1.64 0.00 0.00 178.16 175.71 1xyx h TYR 150 N -0.16 0.63 -0.43 -3.82 3.20 -1.46 -1.15 116.97 113.79 1xyx h TYR 150 Ca 0.23 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1xyx h TYR 150 Cb 0.52 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1xyx h TYR 150 CO -0.57 0.07 0.24 0.00 -1.64 0.00 0.00 178.16 176.26 1xyx h ARG 151 N 0.49 0.58 -0.00 1.82 3.08 -0.97 -0.96 114.38 118.41 1xyx h ARG 151 Ca 0.47 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.47 1xyx h ARG 151 Cb 0.77 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1xyx h ARG 151 CO -0.43 0.42 -0.25 0.39 -1.07 0.00 0.00 179.97 179.04 1xyx n GLU 152 N -4.43 0.07 -2.97 0.04 -0.58 -0.50 -4.39 120.64 107.88 1xyx n GLU 152 Ca 0.03 -0.03 -0.16 0.00 -0.42 0.00 0.00 57.16 56.58 1xyx n GLU 152 Cb 0.09 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.45 1xyx n GLU 152 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xyx n ASN 153 N -1.44 1.54 -0.81 1.62 3.02 -0.39 -4.80 115.26 114.00 1xyx n ASN 153 Ca 0.07 -3.01 0.05 0.00 -0.03 0.00 0.00 54.58 51.66 1xyx n ASN 153 Cb 0.33 -0.58 0.13 0.00 -0.61 0.00 0.00 39.78 39.05 1xyx n ASN 153 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1xyx n MET 154 N 0.09 0.98 0.00 3.52 0.00 -1.05 -4.73 117.12 115.93 1xyx n MET 154 Ca 0.21 -2.69 0.00 0.00 0.00 0.00 0.00 57.70 55.22 1xyx n MET 154 Cb 0.69 -1.05 0.00 0.00 0.00 0.00 0.00 33.22 32.86 1xyx n MET 154 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 175.97 178.45 1xyx n TYR 155 N -0.59 0.00 0.09 3.17 0.18 -1.26 -4.65 117.16 114.10 1xyx n TYR 155 Ca 0.14 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.77 1xyx n TYR 155 Cb 0.82 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.65 1xyx n TYR 155 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1xyx h ARG 156 N 0.00 0.24 -7.32 -3.48 3.08 -1.96 -3.46 114.38 101.48 1xyx h ARG 156 Ca 0.00 -0.41 -0.51 0.00 0.07 0.00 0.00 59.98 59.13 1xyx h ARG 156 Cb 0.21 0.15 0.09 0.00 0.08 0.00 0.00 29.97 30.50 1xyx h ARG 156 CO 0.00 1.18 0.37 0.71 -1.07 0.00 0.00 179.97 181.16 1xyx s TYR 157 N -2.66 3.09 1.06 3.04 2.02 -1.26 -5.05 117.35 117.59 1xyx s TYR 157 Ca -0.04 1.43 -0.15 0.00 -0.37 0.00 0.00 57.07 57.95 1xyx s TYR 157 Cb 0.07 -2.90 0.22 0.00 -0.40 0.00 0.00 41.96 38.96 1xyx s TYR 157 CO 0.87 -1.23 1.11 -1.25 -1.57 0.00 0.00 175.55 173.49 1xyx s PRO 158 N -4.93 -0.11 0.00 -1.71 0.04 -1.26 -5.01 135.00 122.02 1xyx s PRO 158 Ca 0.59 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1xyx s PRO 158 Cb -0.14 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1xyx s PRO 158 CO 0.53 -3.03 0.26 -1.71 0.04 0.00 0.00 177.00 173.09 1xyx n ASN 159 N -4.33 0.45 -4.51 6.66 2.85 -1.26 -5.00 115.26 110.12 1xyx n ASN 159 Ca 0.08 -1.05 -0.24 0.00 -0.11 0.00 0.00 54.58 53.27 1xyx n ASN 159 Cb 0.58 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.51 1xyx n ASN 159 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1xyx s GLN 160 N -0.05 1.79 0.12 1.20 -0.21 -1.26 -1.77 119.66 119.48 1xyx s GLN 160 Ca 0.00 -1.74 0.00 0.00 0.02 0.00 0.00 55.36 53.64 1xyx s GLN 160 Cb 0.00 -1.82 -0.04 0.00 1.00 0.00 0.00 33.01 32.15 1xyx s GLN 160 CO 0.00 0.31 0.01 0.14 -2.12 0.00 0.00 175.29 173.63 1xyx s VAL 161 N -2.50 0.35 -0.09 1.09 -7.23 -1.26 -4.92 120.40 105.84 1xyx s VAL 161 Ca 0.31 -1.91 0.01 0.00 -1.81 0.00 0.00 61.98 58.57 1xyx s VAL 161 Cb -0.04 -1.92 -0.02 0.00 0.56 0.00 0.00 36.38 34.96 1xyx s VAL 161 CO 0.16 -0.62 -0.11 -0.31 -0.31 0.00 0.00 175.10 173.91 1xyx s TYR 162 N -3.87 2.84 0.00 2.82 2.02 -1.26 -0.22 117.35 119.68 1xyx s TYR 162 Ca 0.19 -0.25 0.00 0.00 -0.37 0.00 0.00 57.07 56.64 1xyx s TYR 162 Cb 0.07 -1.75 0.00 0.00 -0.40 0.00 0.00 41.96 39.88 1xyx s TYR 162 CO -0.01 0.10 0.00 2.48 -1.57 0.00 0.00 175.55 176.55 1xyx n TYR 163 N 2.74 -0.78 -4.60 2.71 4.11 -0.08 -4.57 117.16 116.69 1xyx n TYR 163 Ca -0.18 0.00 -0.27 0.00 -0.00 0.00 0.00 57.90 57.46 1xyx n TYR 163 Cb 0.53 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.73 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 -1.82 1.44 0.24 -3.48 3.03 -1.26 -0.28 118.95 116.83 1xyx s ARG 164 Ca 0.00 -1.08 -0.30 0.00 2.03 0.00 0.00 55.73 56.38 1xyx s ARG 164 Cb 0.00 -1.65 -0.10 0.00 -1.03 0.00 0.00 34.95 32.17 1xyx s ARG 164 CO 0.00 0.41 1.43 -1.25 -1.13 0.00 0.00 175.30 174.76 1xyx s PRO 165 N -1.45 4.28 0.55 3.89 0.04 -1.26 -4.89 135.00 136.15 1xyx s PRO 165 Ca 0.09 2.27 0.38 0.00 0.04 0.00 0.00 61.00 63.78 1xyx s PRO 165 Cb -0.09 -3.12 1.56 0.00 0.04 0.00 0.00 34.50 32.89 1xyx s PRO 165 CO 0.03 -0.40 1.78 0.28 0.04 0.00 0.00 177.00 178.73 1xyx h VAL 166 N 3.57 0.37 0.00 -0.36 2.07 -1.94 -1.15 116.25 118.81 1xyx h VAL 166 Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1xyx h VAL 166 Cb 1.22 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1xyx h VAL 166 CO 0.78 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.84 1xyx n ASP 167 N -4.14 0.00 0.05 0.57 8.00 -1.26 -3.53 116.55 116.25 1xyx n ASP 167 Ca 0.27 0.33 0.00 0.00 0.71 0.00 0.00 54.79 56.10 1xyx n ASP 167 Cb 1.31 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 42.05 1xyx n ASP 167 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1xyx n GLN 168 N -1.36 0.00 -1.31 -1.24 7.27 -0.46 -5.17 117.38 115.12 1xyx n GLN 168 Ca 0.01 0.00 0.15 0.00 0.07 0.00 0.00 57.00 57.23 1xyx n GLN 168 Cb 0.03 -0.44 -0.08 0.00 2.41 0.00 0.00 30.24 32.16 1xyx n GLN 168 CO 0.00 0.00 0.00 0.98 0.07 0.00 0.00 177.06 178.11 1xyx n TYR 169 N -3.40 -3.28 0.00 3.69 9.36 -1.08 -5.06 117.16 117.39 1xyx n TYR 169 Ca 0.00 1.81 0.00 0.00 3.32 0.00 0.00 57.90 63.03 1xyx n TYR 169 Cb 0.08 -2.98 0.00 0.00 -0.63 0.00 0.00 39.34 35.80 1xyx n TYR 169 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1xyx n SER 170 N -4.18 0.00 -3.03 2.98 2.88 -1.26 -5.10 113.62 105.91 1xyx n SER 170 Ca -0.08 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.50 1xyx n SER 170 Cb 0.59 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.17 1xyx n SER 170 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1xyx s ASN 171 N -1.66 -0.53 0.25 -3.46 2.20 -1.26 -5.05 114.94 105.44 1xyx s ASN 171 Ca 0.00 -0.06 -0.03 0.00 -0.94 0.00 0.00 52.86 51.83 1xyx s ASN 171 Cb 0.00 1.07 0.46 0.00 -2.00 0.00 0.00 41.25 40.78 1xyx s ASN 171 CO 0.00 -0.08 1.79 -0.61 -2.94 0.00 0.00 177.10 175.26 1xyx h GLN 172 N 6.67 0.69 -0.38 3.55 4.15 -1.99 0.16 115.11 127.96 1xyx h GLN 172 Ca -0.06 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.28 1xyx h GLN 172 Cb 1.20 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 1xyx h GLN 172 CO -0.06 0.45 0.08 -0.97 -1.93 0.00 0.00 178.83 176.40 1xyx h ASN 173 N 0.71 0.59 0.68 -0.69 -1.24 -1.99 0.03 115.58 113.66 1xyx h ASN 173 Ca 0.43 -0.24 -0.18 0.00 0.71 0.00 0.00 56.30 57.01 1xyx h ASN 173 Cb 0.49 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.37 1xyx h ASN 173 CO -0.30 0.68 -0.81 -1.13 -1.29 0.00 0.00 177.43 174.58 1xyx h ASN 174 N 0.47 0.12 0.30 1.15 -0.73 -1.88 -2.90 115.58 112.10 1xyx h ASN 174 Ca 0.12 -0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.20 1xyx h ASN 174 Cb 0.33 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.86 1xyx h ASN 174 CO 0.00 0.87 -0.32 0.15 -0.37 0.00 0.00 177.43 177.77 1xyx h PHE 175 N 0.05 -0.86 -0.39 0.67 3.57 -0.52 -1.73 116.94 117.73 1xyx h PHE 175 Ca -0.02 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.55 1xyx h PHE 175 Cb 1.41 0.34 -0.09 0.00 2.79 0.00 0.00 35.95 40.40 1xyx h PHE 175 CO 0.01 -0.45 -0.42 0.28 -2.23 0.00 0.00 178.31 175.50 1xyx h VAL 176 N -0.65 0.12 -0.04 1.41 2.07 -0.84 0.12 116.25 118.43 1xyx h VAL 176 Ca -0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1xyx h VAL 176 Cb 0.60 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1xyx h VAL 176 CO -0.08 0.00 -0.13 -0.74 0.02 0.00 0.00 177.57 176.65 1xyx h HIS 177 N -0.33 -0.32 0.17 1.57 -0.00 -1.51 0.05 115.15 114.79 1xyx h HIS 177 Ca 0.14 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.51 1xyx h HIS 177 Cb 0.58 0.15 0.00 0.00 -0.00 0.00 0.00 27.41 28.14 1xyx h HIS 177 CO -0.61 -0.19 -0.08 0.22 -0.00 0.00 0.00 177.93 177.27 1xyx h ASP 178 N -0.19 -0.20 0.26 3.26 1.82 -0.32 0.92 116.42 121.96 1xyx h ASP 178 Ca 0.06 -0.03 0.01 0.00 -0.39 0.00 0.00 57.03 56.68 1xyx h ASP 178 Cb 0.27 0.05 -0.03 0.00 0.68 0.00 0.00 39.33 40.30 1xyx h ASP 178 CO -0.16 -0.10 -0.37 0.00 -1.61 0.00 0.00 179.24 177.00 1xyx h VAL 180 N -0.69 0.85 -0.74 0.00 2.07 -0.81 0.16 116.25 117.08 1xyx h VAL 180 Ca -0.00 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 1xyx h VAL 180 Cb 0.66 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1xyx h VAL 180 CO -0.14 0.10 0.36 -1.13 0.02 0.00 0.00 177.57 176.78 1xyx h ASN 181 N 0.53 0.97 0.04 0.57 -1.24 -0.54 -1.44 115.58 114.46 1xyx h ASN 181 Ca 0.31 -0.13 -0.15 0.00 0.71 0.00 0.00 56.30 57.04 1xyx h ASN 181 Cb 0.31 -0.25 0.01 0.00 0.73 0.00 0.00 38.32 39.13 1xyx h ASN 181 CO -0.25 0.83 -0.61 0.40 -1.29 0.00 0.00 177.43 176.50 1xyx h ILE 182 N 1.04 1.47 -0.15 2.57 1.08 0.58 0.46 117.51 124.56 1xyx h ILE 182 Ca 0.26 -2.20 0.01 0.00 -0.39 0.00 0.00 64.86 62.54 1xyx h ILE 182 Cb 0.11 2.80 -0.01 0.00 -3.07 0.00 0.00 36.82 36.65 1xyx h ILE 182 CO -0.03 0.63 0.06 0.74 -0.69 0.00 0.00 178.15 178.86 1xyx h THR 183 N -0.24 0.98 0.16 -0.27 2.02 -0.77 0.29 112.91 115.08 1xyx h THR 183 Ca -0.09 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.05 1xyx h THR 183 Cb 1.37 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.56 1xyx h THR 183 CO 0.12 0.03 -0.49 0.40 0.37 0.00 0.00 175.52 175.95 1xyx h ILE 184 N 0.15 0.06 -0.38 3.11 2.04 -1.29 0.52 117.51 121.72 1xyx h ILE 184 Ca 0.06 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.99 1xyx h ILE 184 Cb 0.02 0.06 -0.09 0.00 -0.74 0.00 0.00 36.82 36.08 1xyx h ILE 184 CO -0.05 0.00 -0.46 0.50 0.00 0.00 0.00 178.15 178.13 1xyx h LYS 185 N -0.74 -0.35 -0.53 2.37 3.11 0.08 0.22 116.57 120.72 1xyx h LYS 185 Ca -0.00 0.02 -0.07 0.00 -2.81 0.00 0.00 60.65 57.80 1xyx h LYS 185 Cb 0.75 0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 32.03 1xyx h LYS 185 CO -0.25 -0.23 0.06 0.37 -2.81 0.00 0.00 179.45 176.59 1xyx h GLN 186 N -0.36 0.86 0.00 1.90 5.75 0.04 0.67 115.11 123.97 1xyx h GLN 186 Ca 0.12 -0.21 -0.02 0.00 -0.15 0.00 0.00 58.65 58.39 1xyx h GLN 186 Cb 0.60 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 1xyx h GLN 186 CO -0.57 0.82 -0.08 0.45 -2.65 0.00 0.00 178.83 176.81 1xyx h HIS 187 N 0.81 0.00 -0.43 3.99 3.86 -0.22 0.45 115.15 123.60 1xyx h HIS 187 Ca 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 1xyx h HIS 187 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1xyx h HIS 187 CO 0.02 0.08 0.00 2.41 0.86 0.00 0.00 177.93 181.30 1xyx n THR 188 N -3.23 0.58 0.05 2.45 -1.04 0.71 -3.89 114.28 109.91 1xyx n THR 188 Ca 0.00 -0.79 0.00 0.00 -2.04 0.00 0.00 64.05 61.22 1xyx n THR 188 Cb 0.32 0.91 0.00 0.00 -1.82 0.00 0.00 70.33 69.74 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 1.47 0.14 0.24 12.58 0.31 0.20 -4.40 118.33 128.88 1xyx n VAL 189 Ca 0.20 0.05 0.11 0.00 -0.01 0.00 0.00 64.34 64.69 1xyx n VAL 189 Cb 0.60 -0.50 0.56 0.00 -0.91 0.00 0.00 33.84 33.59 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 -2.93 0.97 -0.09 2.52 5.66 0.15 -0.59 114.28 119.97 1xyx n THR 190 Ca 0.00 0.57 -0.13 0.00 -3.05 0.00 0.00 64.05 61.44 1xyx n THR 190 Cb 0.00 -1.55 -0.09 0.00 -1.55 0.00 0.00 70.33 67.14 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 -2.26 1.08 0.06 1.09 -1.04 -1.20 -4.63 114.28 107.38 1xyx n THR 191 Ca -0.00 -0.41 0.03 0.00 -2.04 0.00 0.00 64.05 61.63 1xyx n THR 191 Cb 0.10 -1.18 0.40 0.00 -1.82 0.00 0.00 70.33 67.83 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 -0.01 1.14 -0.77 12.58 2.02 -1.00 -1.49 112.91 125.38 1xyx h THR 192 Ca -0.42 -0.49 0.17 0.00 0.77 0.00 0.00 66.41 66.44 1xyx h THR 192 Cb 1.65 0.86 -0.11 0.00 -1.74 0.00 0.00 68.15 68.80 1xyx h THR 192 CO -0.07 0.17 0.21 0.00 0.37 0.00 0.00 175.52 176.20 1xyx h THR 193 N 0.40 0.50 0.18 3.16 1.03 -1.11 -2.86 112.91 114.21 1xyx h THR 193 Ca 0.10 -0.10 -0.35 0.00 -0.01 0.00 0.00 66.41 66.05 1xyx h THR 193 Cb 0.16 0.19 0.01 0.00 -1.07 0.00 0.00 68.15 67.44 1xyx h THR 193 CO -0.00 0.05 -1.76 0.11 -0.01 0.00 0.00 175.52 173.91 1xyx h LYS 194 N 0.28 0.38 0.00 0.00 6.56 -1.56 -3.47 116.57 118.76 1xyx h LYS 194 Ca 0.44 -0.64 0.00 0.00 -1.06 0.00 0.00 60.65 59.39 1xyx h LYS 194 Cb 0.77 0.24 0.00 0.00 -0.57 0.00 0.00 32.23 32.67 1xyx h LYS 194 CO -0.52 1.30 0.00 0.41 -2.06 0.00 0.00 179.45 178.57 1xyx n GLY 195 N 1.86 0.00 3.09 3.86 0.00 -0.93 -5.15 105.19 107.92 1xyx n GLY 195 Ca -0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 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 2.77 0.23 1.61 2.12 -0.84 -4.96 118.70 119.62 1xyx s GLU 196 Ca 0.00 -0.80 0.05 0.00 0.36 0.00 0.00 54.97 54.58 1xyx s GLU 196 Cb 0.00 -2.48 -0.02 0.00 0.26 0.00 0.00 34.13 31.89 1xyx s GLU 196 CO 0.00 -0.24 0.21 -1.71 -0.54 0.00 0.00 175.26 172.98 1xyx n ASN 197 N 4.65 -0.53 -3.87 -1.70 2.85 -1.26 -2.32 115.26 113.07 1xyx n ASN 197 Ca -0.20 -2.46 -0.09 0.00 -0.11 0.00 0.00 54.58 51.72 1xyx n ASN 197 Cb 0.49 1.20 -0.08 0.00 1.24 0.00 0.00 39.78 42.63 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 -2.99 0.15 0.65 1.20 0.40 -1.26 -5.12 117.98 111.02 1xyx s PHE 198 Ca 0.26 -0.50 -0.09 0.00 -0.60 0.00 0.00 56.93 56.00 1xyx s PHE 198 Cb 0.01 -0.08 0.01 0.00 0.51 0.00 0.00 43.02 43.47 1xyx s PHE 198 CO 0.19 -0.48 1.02 0.95 0.70 0.00 0.00 175.22 177.59 1xyx s THR 199 N -3.31 3.69 0.38 0.64 -4.23 -1.26 -4.78 115.64 106.76 1xyx s THR 199 Ca 0.01 0.35 0.13 0.00 -1.18 0.00 0.00 61.69 60.99 1xyx s THR 199 Cb 0.03 -3.52 0.35 0.00 1.34 0.00 0.00 72.50 70.70 1xyx s THR 199 CO -0.08 -0.63 1.86 -0.08 -0.54 0.00 0.00 174.62 175.15 1xyx h GLU 200 N -0.44 0.55 0.00 3.99 4.81 -2.02 0.28 114.58 121.74 1xyx h GLU 200 Ca -0.45 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 58.66 1xyx h GLU 200 Cb 1.25 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1xyx h GLU 200 CO 0.63 0.36 -0.39 1.15 -0.73 0.00 0.00 179.01 180.02 1xyx h THR 201 N 0.57 1.28 0.01 0.32 2.02 -2.00 0.11 112.91 115.22 1xyx h THR 201 Ca 0.46 -1.36 -0.08 0.00 0.77 0.00 0.00 66.41 66.21 1xyx h THR 201 Cb 0.93 1.73 0.01 0.00 -1.74 0.00 0.00 68.15 69.08 1xyx h THR 201 CO -0.21 0.39 -0.32 0.44 0.37 0.00 0.00 175.52 176.19 1xyx h ASP 202 N 0.00 0.26 -0.92 4.18 3.32 -1.21 -3.30 116.42 118.75 1xyx h ASP 202 Ca -0.00 -0.81 0.13 0.00 0.02 0.00 0.00 57.03 56.37 1xyx h ASP 202 Cb 0.70 -0.08 -0.09 0.00 0.22 0.00 0.00 39.33 40.08 1xyx h ASP 202 CO 0.05 1.04 0.54 0.58 -1.72 0.00 0.00 179.24 179.73 1xyx h VAL 203 N -0.49 0.83 -0.13 -1.35 2.07 0.12 0.20 116.25 117.50 1xyx h VAL 203 Ca -0.04 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.09 1xyx h VAL 203 Cb 1.10 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1xyx h VAL 203 CO 0.06 0.15 -0.40 0.07 0.02 0.00 0.00 177.57 177.47 1xyx h LYS 204 N 0.81 0.28 -0.51 1.57 2.10 -0.97 -0.93 116.57 118.91 1xyx h LYS 204 Ca 0.48 -0.13 -0.04 0.00 -2.00 0.00 0.00 60.65 58.96 1xyx h LYS 204 Cb 0.57 -0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.88 1xyx h LYS 204 CO -0.31 0.64 0.16 0.52 -2.00 0.00 0.00 179.45 178.46 1xyx h MET 205 N 0.23 0.80 -0.13 0.07 2.86 -0.75 -1.62 114.93 116.39 1xyx h MET 205 Ca 0.02 -0.17 0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1xyx h MET 205 Cb 0.82 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 1xyx h MET 205 CO 0.06 0.74 0.04 0.52 1.06 0.00 0.00 176.91 179.34 1xyx h MET 206 N 0.70 0.11 -0.81 1.72 2.86 -0.78 -0.57 114.93 118.17 1xyx h MET 206 Ca 0.17 -0.01 0.17 0.00 -2.06 0.00 0.00 59.70 57.97 1xyx h MET 206 Cb 0.28 -0.02 -0.11 0.00 0.06 0.00 0.00 31.60 31.81 1xyx h MET 206 CO -0.00 0.07 0.31 0.93 1.06 0.00 0.00 176.91 179.28 1xyx h GLU 207 N 0.11 0.39 0.59 1.72 5.08 -0.91 0.33 114.58 121.89 1xyx h GLU 207 Ca 0.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1xyx h GLU 207 Cb 0.03 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 1xyx h GLU 207 CO -0.05 0.26 -0.36 0.00 -1.00 0.00 0.00 179.01 177.86 1xyx h ARG 208 N 0.40 -0.86 0.01 2.33 -0.00 -0.60 -2.28 114.38 113.38 1xyx h ARG 208 Ca 0.47 0.06 -0.21 0.00 -0.50 0.00 0.00 59.98 59.80 1xyx h ARG 208 Cb 0.79 0.19 -0.03 0.00 0.00 0.00 0.00 29.97 30.93 1xyx h ARG 208 CO -0.47 -0.57 -0.97 -0.39 0.00 0.00 0.00 179.97 177.57 1xyx h VAL 209 N -0.89 1.67 -0.42 2.04 -1.51 -0.46 -0.96 116.25 115.72 1xyx h VAL 209 Ca -0.07 -3.24 -0.03 0.00 -1.23 0.00 0.00 66.70 62.13 1xyx h VAL 209 Cb 0.72 2.77 -0.02 0.00 -2.13 0.00 0.00 31.29 32.63 1xyx h VAL 209 CO 0.07 0.93 0.13 0.58 -1.23 0.00 0.00 177.57 178.05 1xyx h VAL 210 N 0.01 1.22 0.02 7.19 2.07 -0.44 0.41 116.25 126.73 1xyx h VAL 210 Ca -0.02 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1xyx h VAL 210 Cb 1.70 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1xyx h VAL 210 CO 0.13 0.25 -0.02 -0.08 0.02 0.00 0.00 177.57 177.88 1xyx h GLU 211 N 0.53 -0.04 -0.29 1.57 4.81 -1.40 -1.66 114.58 118.10 1xyx h GLU 211 Ca 0.13 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.42 1xyx h GLU 211 Cb 0.26 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.60 1xyx h GLU 211 CO -0.00 -0.02 0.00 1.96 -0.73 0.00 0.00 179.01 180.21 1xyx h GLN 212 N -0.04 0.09 0.21 1.92 1.08 -1.10 0.25 115.11 117.53 1xyx h GLN 212 Ca -0.00 -0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1xyx h GLN 212 Cb 0.03 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.41 1xyx h GLN 212 CO 0.00 0.06 -0.30 0.52 -0.95 0.00 0.00 178.83 178.16 1xyx h MET 213 N 0.09 -0.55 -0.00 1.46 2.86 -1.04 -1.90 114.93 115.85 1xyx h MET 213 Ca 0.14 0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.69 1xyx h MET 213 Cb 0.18 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 1xyx h MET 213 CO -0.23 -0.37 -0.59 0.00 1.06 0.00 0.00 176.91 176.79 1xyx h VAL 215 N 0.01 0.58 -0.07 0.00 2.07 -0.60 0.42 116.25 118.66 1xyx h VAL 215 Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1xyx h VAL 215 Cb 1.04 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1xyx h VAL 215 CO 0.08 0.00 0.02 0.74 0.02 0.00 0.00 177.57 178.43 1xyx h THR 216 N -0.22 0.98 -0.69 2.57 2.02 -0.58 0.93 112.91 117.92 1xyx h THR 216 Ca 0.08 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 1xyx h THR 216 Cb 0.34 0.93 -0.03 0.00 -1.74 0.00 0.00 68.15 67.64 1xyx h THR 216 CO -0.22 0.01 0.30 -0.61 0.37 0.00 0.00 175.52 175.37 1xyx h GLN 217 N 0.05 1.00 0.39 6.66 4.15 -0.42 0.19 115.11 127.13 1xyx h GLN 217 Ca 0.03 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.28 1xyx h GLN 217 Cb 0.02 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.53 1xyx h GLN 217 CO -0.03 0.80 -0.18 -0.92 -1.93 0.00 0.00 178.83 176.56 1xyx h TYR 218 N 0.99 -0.48 -0.90 3.99 3.20 -0.86 -2.77 116.97 120.14 1xyx h TYR 218 Ca 0.24 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.14 1xyx h TYR 218 Cb 0.15 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.53 1xyx h TYR 218 CO 0.01 -0.23 0.59 1.96 -1.64 0.00 0.00 178.16 178.85 1xyx h GLN 219 N -0.63 1.08 -0.08 1.82 4.20 0.16 0.77 115.11 122.43 1xyx h GLN 219 Ca -0.05 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.63 1xyx h GLN 219 Cb 0.46 -0.24 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 1xyx h GLN 219 CO 0.09 0.71 -0.20 0.87 -0.67 0.00 0.00 178.83 179.63 1xyx h LYS 220 N 1.11 -0.27 -0.32 1.46 1.57 -0.70 0.12 116.57 119.54 1xyx h LYS 220 Ca 0.36 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.16 1xyx h LYS 220 Cb 0.05 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1xyx h LYS 220 CO -0.11 -0.18 0.18 0.93 -0.57 0.00 0.00 179.45 179.69 1xyx h GLU 221 N -0.28 0.45 0.00 3.15 5.08 -0.89 -2.35 114.58 119.74 1xyx h GLU 221 Ca 0.08 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1xyx h GLU 221 Cb 0.40 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1xyx h GLU 221 CO -0.24 0.38 -0.08 0.66 -1.00 0.00 0.00 179.01 178.72 1xyx h SER 222 N 0.40 0.00 -0.70 1.42 4.64 -0.58 -1.80 113.55 116.92 1xyx h SER 222 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1xyx h SER 222 Cb 0.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.12 1xyx h SER 222 CO -0.02 0.08 0.45 -0.61 -0.87 0.00 0.00 176.83 175.86 1xyx h GLN 223 N 0.00 0.94 -0.80 4.77 4.15 -0.20 0.12 115.11 124.09 1xyx h GLN 223 Ca -0.00 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 1xyx h GLN 223 Cb 0.17 -0.21 -0.04 0.00 0.21 0.00 0.00 27.48 27.62 1xyx h GLN 223 CO 0.01 0.64 0.40 0.00 -1.93 0.00 0.00 178.83 177.95 1xyx h ALA 224 N 1.24 1.03 0.42 3.38 0.00 -1.31 0.23 119.26 124.25 1xyx h ALA 224 Ca 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xyx h ALA 224 Cb -0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1xyx h ALA 224 CO -0.05 0.57 -0.26 -0.92 0.00 0.00 0.00 179.25 178.59 1xyx h TYR 225 N 1.12 -0.68 0.00 0.00 3.20 -1.05 -2.52 116.97 117.04 1xyx h TYR 225 Ca 0.28 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 1xyx h TYR 225 Cb 0.09 0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 1xyx h TYR 225 CO 0.01 -0.40 -0.09 1.88 -1.64 0.00 0.00 178.16 177.92 1xyx h TYR 226 N -0.65 0.00 0.00 -3.82 0.05 -0.67 -1.90 116.97 109.97 1xyx h TYR 226 Ca -0.05 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.66 1xyx h TYR 226 Cb 0.54 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.27 1xyx h TYR 226 CO -0.09 0.09 -0.36 -0.44 -1.05 0.00 0.00 178.16 176.31 1xyx h ASP 227 N 0.00 0.00 0.00 3.88 3.32 -0.18 -3.34 116.42 120.10 1xyx h ASP 227 Ca -0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 1xyx h ASP 227 Cb 0.36 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1xyx h ASP 227 CO 0.01 0.36 -0.12 0.61 -1.72 0.00 0.00 179.24 178.38 1xyx n GLY 228 N 0.39 2.56 0.22 2.75 0.00 -0.72 -3.28 105.19 107.12 1xyx n GLY 228 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 1.88 0.00 -2.31 1.61 -4.01 -1.25 -4.95 116.66 107.63 1xyx n ARG 229 Ca 0.14 -0.70 -0.40 0.00 -1.04 0.00 0.00 57.85 55.86 1xyx n ARG 229 Cb 0.61 -0.49 0.02 0.00 -3.04 0.00 0.00 32.46 29.57 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 0.00 4.42 -1.03 2.89 5.12 -1.20 -4.79 116.66 122.06 1xyx n ARG 230 Ca 0.00 -4.10 -0.31 0.00 -1.93 0.00 0.00 57.85 51.51 1xyx n ARG 230 Cb 0.58 -2.41 -0.02 0.00 -1.16 0.00 0.00 32.46 29.45 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 0.01 6.15 0.00 0.55 7.64 -1.26 -5.22 113.62 121.49 1xyx n SER 231 Ca 0.51 -2.47 0.00 0.00 1.01 0.00 0.00 58.87 57.92 1xyx n SER 231 Cb 0.26 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 1xyx n SER 231 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83