#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 -0.27 -0.90 1.55 0.24 -1.26 -0.58 118.33 117.11 1xyx n VAL 122 Ca 0.00 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 1xyx n VAL 122 Cb 0.00 -0.50 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 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 -1.37 0.84 0.00 7.63 0.00 -1.26 -3.93 105.19 107.10 1xyx n GLY 123 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.24 1.53 0.12 -0.02 0.00 0.25 -5.01 105.19 99.83 1xyx n GLY 124 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.54 0.00 0.99 7.99 -1.18 -4.95 117.00 120.40 1xyx n LEU 125 Ca 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 56.01 55.99 1xyx n LEU 125 Cb 0.00 -0.20 0.00 0.00 -0.11 0.00 0.00 43.42 43.11 1xyx n LEU 125 CO 0.00 0.10 0.00 0.61 -1.51 0.00 0.00 177.39 176.59 1xyx n GLY 126 N 1.33 1.42 0.00 -0.72 0.00 -1.26 -4.02 105.19 101.95 1xyx n GLY 126 Ca 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 3.77 -0.02 0.00 -1.26 -4.96 105.19 102.72 1xyx n GLY 127 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 2.84 -0.06 1.61 1.51 -1.26 -4.97 117.35 117.02 1xyx s TYR 128 Ca 0.00 1.33 -0.30 0.00 -1.01 0.00 0.00 57.07 57.09 1xyx s TYR 128 Cb 0.00 -3.80 -0.05 0.00 -0.11 0.00 0.00 41.96 38.01 1xyx s TYR 128 CO 0.00 -2.30 1.53 1.41 -1.11 0.00 0.00 175.55 175.08 1xyx s MET 129 N -2.00 4.21 -0.22 -0.62 -2.45 0.27 -4.85 119.30 113.65 1xyx s MET 129 Ca 0.52 2.06 -0.07 0.00 -1.25 0.00 0.00 55.69 56.95 1xyx s MET 129 Cb -0.42 -3.84 -0.03 0.00 1.25 0.00 0.00 34.83 31.79 1xyx s MET 129 CO 0.56 -0.76 0.05 -1.17 1.05 0.00 0.00 175.02 174.74 1xyx s LEU 130 N 3.54 3.49 0.00 4.11 2.96 -1.26 -0.68 118.68 130.84 1xyx s LEU 130 Ca 0.68 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.46 1xyx s LEU 130 Cb -0.31 -1.90 0.00 0.00 0.50 0.00 0.00 46.19 44.47 1xyx s LEU 130 CO 0.26 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.95 1xyx n GLY 131 N 4.34 -1.16 3.36 7.98 0.00 -0.55 -5.01 105.19 114.14 1xyx n GLY 131 Ca -0.16 -0.13 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 1xyx n GLY 131 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xyx s SER 132 N -1.54 0.87 0.51 1.61 0.15 -1.26 -5.01 113.70 109.04 1xyx s SER 132 Ca 0.00 -1.50 -0.21 0.00 0.70 0.00 0.00 55.95 54.95 1xyx s SER 132 Cb 0.00 0.55 -0.09 0.00 -1.71 0.00 0.00 66.02 64.77 1xyx s SER 132 CO 0.00 -1.09 0.82 0.00 1.20 0.00 0.00 173.24 174.17 1xyx n ALA 133 N -0.49 -0.35 -2.40 5.45 0.00 -1.26 -4.10 120.51 117.36 1xyx n ALA 133 Ca 0.03 0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.34 1xyx n ALA 133 Cb 0.63 -1.99 -0.08 0.00 0.00 0.00 0.00 19.45 18.01 1xyx n ALA 133 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1xyx s MET 134 N -2.20 1.81 0.61 0.00 -1.94 0.08 -4.91 119.30 112.74 1xyx s MET 134 Ca 0.68 -2.08 -0.05 0.00 -1.71 0.00 0.00 55.69 52.54 1xyx s MET 134 Cb -0.49 -0.15 0.03 0.00 2.01 0.00 0.00 34.83 36.23 1xyx s MET 134 CO 0.53 -0.55 0.90 0.45 -0.01 0.00 0.00 175.02 176.34 1xyx s SER 135 N -3.48 5.34 -0.24 3.03 0.15 -1.26 -4.87 113.70 112.38 1xyx s SER 135 Ca 0.32 0.51 -0.28 0.00 0.70 0.00 0.00 55.95 57.20 1xyx s SER 135 Cb 0.03 -1.41 -0.04 0.00 -1.71 0.00 0.00 66.02 62.88 1xyx s SER 135 CO 0.20 -1.20 2.07 -0.13 1.20 0.00 0.00 173.24 175.38 1xyx s ARG 136 N -5.00 3.26 1.06 5.44 0.52 -1.26 -4.99 118.95 117.98 1xyx s ARG 136 Ca 0.56 1.88 -0.15 0.00 -0.52 0.00 0.00 55.73 57.50 1xyx s ARG 136 Cb -0.11 -4.30 0.22 0.00 0.52 0.00 0.00 34.95 31.28 1xyx s ARG 136 CO 0.44 -1.95 1.11 -1.25 0.02 0.00 0.00 175.30 173.66 1xyx s PRO 137 N 6.01 -0.09 -0.40 3.54 0.04 -1.26 -4.99 135.00 137.85 1xyx s PRO 137 Ca 0.93 0.25 -0.14 0.00 0.04 0.00 0.00 61.00 62.08 1xyx s PRO 137 Cb -0.30 -1.70 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1xyx s PRO 137 CO 0.35 -3.02 0.28 -1.64 0.04 0.00 0.00 177.00 173.01 1xyx s MET 138 N -5.18 3.03 0.01 4.56 -1.94 -1.26 -5.05 119.30 113.48 1xyx s MET 138 Ca 0.67 -0.97 0.07 0.00 -1.71 0.00 0.00 55.69 53.75 1xyx s MET 138 Cb -0.15 -3.94 -0.03 0.00 2.01 0.00 0.00 34.83 32.73 1xyx s MET 138 CO 0.56 -0.70 -0.22 0.42 -0.01 0.00 0.00 175.02 175.08 1xyx s ILE 139 N 1.68 2.49 -0.41 2.53 -1.09 -1.26 -5.09 121.20 120.04 1xyx s ILE 139 Ca 0.05 -1.14 0.07 0.00 -2.23 0.00 0.00 60.65 57.39 1xyx s ILE 139 Cb -0.19 -1.97 0.22 0.00 -1.58 0.00 0.00 42.46 38.94 1xyx s ILE 139 CO 0.10 0.45 0.52 0.00 -1.23 0.00 0.00 174.94 174.78 1xyx n HIS 140 N 1.95 -1.05 0.52 3.97 1.44 -1.26 -4.94 115.22 115.85 1xyx n HIS 140 Ca -0.16 -3.17 0.05 0.00 -2.01 0.00 0.00 57.72 52.43 1xyx n HIS 140 Cb 0.52 0.13 0.28 0.00 0.12 0.00 0.00 29.99 31.04 1xyx n HIS 140 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1xyx n PHE 141 N 1.91 0.00 -0.99 -1.40 3.72 -1.26 -4.75 117.46 114.69 1xyx n PHE 141 Ca 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.62 1xyx n PHE 141 Cb 0.53 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 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 -0.34 0.48 2.83 1.37 0.00 -1.26 -5.00 105.19 103.27 1xyx n GLY 142 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.10 1.00 0.15 1.61 0.01 -1.26 -5.03 114.94 109.32 1xyx s ASN 143 Ca 0.00 -0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.07 1xyx s ASN 143 Cb 0.00 -0.37 -0.06 0.00 0.41 0.00 0.00 41.25 41.23 1xyx s ASN 143 CO 0.00 -0.12 1.34 -0.78 -1.51 0.00 0.00 177.10 176.03 1xyx h ASP 144 N 7.59 0.34 0.51 -1.22 3.58 -1.98 -0.71 116.42 124.54 1xyx h ASP 144 Ca -0.33 -0.28 -0.16 0.00 0.42 0.00 0.00 57.03 56.68 1xyx h ASP 144 Cb 1.14 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 42.07 1xyx h ASP 144 CO 0.40 1.10 -0.69 4.11 -2.88 0.00 0.00 179.24 181.27 1xyx h TRP 145 N 0.14 0.22 -0.01 0.28 5.08 -1.98 -0.63 115.95 119.05 1xyx h TRP 145 Ca -0.06 -0.10 -0.00 0.00 1.08 0.00 0.00 58.89 59.81 1xyx h TRP 145 Cb 1.56 -0.03 -0.00 0.00 -3.00 0.00 0.00 29.16 27.69 1xyx h TRP 145 CO 0.04 0.80 -0.01 0.93 -1.28 0.00 0.00 178.44 178.92 1xyx h GLU 146 N 0.11 0.02 -0.72 0.12 5.08 -1.97 0.11 114.58 117.33 1xyx h GLU 146 Ca -0.02 -0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.51 1xyx h GLU 146 Cb 1.24 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.45 1xyx h GLU 146 CO 0.10 0.53 0.50 -0.44 -1.00 0.00 0.00 179.01 178.70 1xyx h ASP 147 N -0.49 0.20 0.01 1.42 3.32 -1.06 -0.56 116.42 119.25 1xyx h ASP 147 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1xyx h ASP 147 Cb 0.53 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1xyx h ASP 147 CO 0.00 0.10 -0.06 -0.09 -1.72 0.00 0.00 179.24 177.47 1xyx h ARG 148 N 0.21 0.03 -0.68 3.56 2.43 -0.98 -3.31 114.38 115.65 1xyx h ARG 148 Ca 0.35 -0.04 0.14 0.00 -0.81 0.00 0.00 59.98 59.63 1xyx h ARG 148 Cb 1.08 0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.54 1xyx h ARG 148 CO -0.07 0.91 0.13 -0.92 -1.51 0.00 0.00 179.97 178.51 1xyx h TYR 149 N -0.83 0.20 -0.58 2.20 5.03 0.72 0.06 116.97 123.77 1xyx h TYR 149 Ca -0.01 0.04 0.12 0.00 2.58 0.00 0.00 58.73 61.46 1xyx h TYR 149 Cb 0.93 0.02 -0.10 0.00 1.55 0.00 0.00 36.73 39.12 1xyx h TYR 149 CO 0.23 -0.08 -0.07 -0.92 -1.32 0.00 0.00 178.16 176.00 1xyx h TYR 150 N 0.24 -0.17 0.00 -3.82 3.20 -1.39 -0.91 116.97 114.12 1xyx h TYR 150 Ca 0.37 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.29 1xyx h TYR 150 Cb 0.61 0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.04 1xyx h TYR 150 CO -0.28 -0.20 0.00 0.00 -1.64 0.00 0.00 178.16 176.04 1xyx h ARG 151 N 0.05 0.00 -0.01 1.82 3.08 -1.07 -0.19 114.38 118.07 1xyx h ARG 151 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1xyx h ARG 151 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1xyx h ARG 151 CO -0.55 0.00 -0.49 0.39 -1.07 0.00 0.00 179.97 178.25 1xyx n GLU 152 N -2.97 0.55 -3.02 0.04 -0.58 -0.47 -4.52 120.64 109.68 1xyx n GLU 152 Ca 0.00 -0.39 -0.19 0.00 -0.42 0.00 0.00 57.16 56.17 1xyx n GLU 152 Cb 0.26 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.61 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 -0.89 1.82 -0.31 1.62 3.02 -0.12 -4.76 115.26 115.64 1xyx n ASN 153 Ca 0.08 -3.12 0.06 0.00 -0.03 0.00 0.00 54.58 51.57 1xyx n ASN 153 Cb 0.37 -0.59 0.08 0.00 -0.61 0.00 0.00 39.78 39.03 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 0.08 0.72 0.00 3.52 0.00 -0.96 -4.72 117.12 115.77 1xyx n MET 154 Ca 0.24 -1.93 0.00 0.00 0.00 0.00 0.00 57.70 56.01 1xyx n MET 154 Cb 0.64 -1.05 0.00 0.00 0.00 0.00 0.00 33.22 32.81 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 -0.78 0.00 0.61 3.17 4.11 -1.26 -4.62 117.16 118.39 1xyx n TYR 155 Ca 0.09 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 58.06 1xyx n TYR 155 Cb 0.68 0.00 0.02 0.00 -0.00 0.00 0.00 39.34 40.04 1xyx n TYR 155 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1xyx n ARG 156 N -0.38 1.61 -3.90 -3.48 1.74 -1.26 -5.00 116.66 105.99 1xyx n ARG 156 Ca 0.00 -0.91 -0.22 0.00 -0.77 0.00 0.00 57.85 55.95 1xyx n ARG 156 Cb 0.02 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 1xyx n ARG 156 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1xyx s TYR 157 N -1.56 3.46 0.90 -1.55 2.02 -1.26 -5.10 117.35 114.26 1xyx s TYR 157 Ca 0.13 0.05 -0.11 0.00 -0.37 0.00 0.00 57.07 56.76 1xyx s TYR 157 Cb 0.11 -1.62 0.13 0.00 -0.40 0.00 0.00 41.96 40.18 1xyx s TYR 157 CO 0.30 0.42 1.09 -1.25 -1.57 0.00 0.00 175.55 174.54 1xyx s PRO 158 N -3.89 1.17 0.02 -1.71 0.05 -1.26 -4.98 135.00 124.39 1xyx s PRO 158 Ca 0.35 1.00 0.22 0.00 0.05 0.00 0.00 61.00 62.62 1xyx s PRO 158 Cb -0.09 -1.78 -0.21 0.00 0.05 0.00 0.00 34.50 32.46 1xyx s PRO 158 CO 0.30 -2.35 0.71 0.09 0.05 0.00 0.00 177.00 175.80 1xyx n ASN 159 N -3.99 0.37 -4.52 6.66 3.02 -1.26 -5.00 115.26 110.55 1xyx n ASN 159 Ca 0.08 -0.17 -0.25 0.00 -0.03 0.00 0.00 54.58 54.21 1xyx n ASN 159 Cb 0.54 1.44 -0.10 0.00 -0.61 0.00 0.00 39.78 41.05 1xyx n ASN 159 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1xyx s GLN 160 N -3.36 1.76 0.16 3.52 -0.21 -1.26 -0.74 119.66 119.54 1xyx s GLN 160 Ca -0.02 -1.91 -0.07 0.00 0.02 0.00 0.00 55.36 53.37 1xyx s GLN 160 Cb 0.14 -1.56 -0.02 0.00 1.00 0.00 0.00 33.01 32.57 1xyx s GLN 160 CO 0.87 0.10 0.25 0.14 -2.12 0.00 0.00 175.29 174.53 1xyx s VAL 161 N -2.72 0.07 0.11 1.09 -7.23 -1.26 -5.00 120.40 105.45 1xyx s VAL 161 Ca 0.32 -1.51 0.04 0.00 -1.81 0.00 0.00 61.98 59.02 1xyx s VAL 161 Cb 0.03 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 35.01 1xyx s VAL 161 CO 0.16 -0.30 0.11 -0.31 -0.31 0.00 0.00 175.10 174.45 1xyx s TYR 162 N -3.99 3.19 0.00 2.82 2.02 -1.26 -1.49 117.35 118.64 1xyx s TYR 162 Ca 0.20 0.05 0.00 0.00 -0.37 0.00 0.00 57.07 56.95 1xyx s TYR 162 Cb 0.04 -1.59 0.00 0.00 -0.40 0.00 0.00 41.96 40.01 1xyx s TYR 162 CO 0.01 0.52 0.00 2.48 -1.57 0.00 0.00 175.55 177.00 1xyx n TYR 163 N 0.16 -0.36 -4.24 2.71 4.11 0.15 -4.75 117.16 114.95 1xyx n TYR 163 Ca -0.08 0.00 -0.21 0.00 -0.00 0.00 0.00 57.90 57.61 1xyx n TYR 163 Cb 0.53 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.74 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 -0.58 0.95 0.55 -3.48 3.03 -1.26 -0.57 118.95 117.58 1xyx s ARG 164 Ca 0.00 -1.01 -0.19 0.00 2.03 0.00 0.00 55.73 56.56 1xyx s ARG 164 Cb 0.00 -1.05 -0.06 0.00 -1.03 0.00 0.00 34.95 32.82 1xyx s ARG 164 CO 0.00 0.24 1.13 -1.25 -1.13 0.00 0.00 175.30 174.29 1xyx s PRO 165 N -1.72 3.33 0.27 3.89 0.04 -1.26 -4.93 135.00 134.62 1xyx s PRO 165 Ca 0.01 1.62 0.25 0.00 0.04 0.00 0.00 61.00 62.92 1xyx s PRO 165 Cb -0.10 -2.00 0.97 0.00 0.04 0.00 0.00 34.50 33.41 1xyx s PRO 165 CO 0.03 -0.87 1.74 -0.39 0.04 0.00 0.00 177.00 177.55 1xyx h VAL 166 N 1.18 0.00 0.00 -0.36 -1.51 -1.95 -1.37 116.25 112.23 1xyx h VAL 166 Ca -0.50 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.67 1xyx h VAL 166 Cb 1.26 1.10 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1xyx h VAL 166 CO 0.57 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.01 1xyx n ASP 167 N -2.30 0.48 -2.18 4.19 5.68 -1.26 -4.80 116.55 116.36 1xyx n ASP 167 Ca 0.03 0.60 -0.02 0.00 -0.50 0.00 0.00 54.79 54.90 1xyx n ASP 167 Cb 0.27 -0.71 0.00 0.00 -1.14 0.00 0.00 41.12 39.55 1xyx n ASP 167 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xyx n GLN 168 N -2.01 1.36 0.00 0.11 1.13 -0.52 -5.11 117.38 112.35 1xyx n GLN 168 Ca 0.03 -0.21 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 1xyx n GLN 168 Cb 0.26 0.02 0.00 0.00 0.11 0.00 0.00 30.24 30.62 1xyx n GLN 168 CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 1xyx n TYR 169 N -0.67 -1.66 0.00 1.08 4.11 -1.26 -4.94 117.16 113.82 1xyx n TYR 169 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1xyx n TYR 169 Cb 0.04 0.20 0.00 0.00 -0.00 0.00 0.00 39.34 39.58 1xyx n TYR 169 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 1xyx n SER 170 N -3.33 0.00 -4.58 9.48 7.64 -1.26 -5.10 113.62 116.46 1xyx n SER 170 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1xyx n SER 170 Cb 0.00 0.11 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 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 -1.47 5.88 0.06 6.43 4.22 -1.26 -4.89 114.94 123.91 1xyx s ASN 171 Ca 0.00 0.77 -0.14 0.00 -2.14 0.00 0.00 52.86 51.35 1xyx s ASN 171 Cb 0.00 -2.53 -0.29 0.00 1.28 0.00 0.00 41.25 39.71 1xyx s ASN 171 CO 0.00 -1.82 1.10 -0.61 -2.04 0.00 0.00 177.10 173.74 1xyx h GLN 172 N 12.58 0.58 -0.05 3.55 -0.00 -1.99 -3.36 115.11 126.42 1xyx h GLN 172 Ca -0.29 -0.81 -0.00 0.00 -0.00 0.00 0.00 58.65 57.55 1xyx h GLN 172 Cb 1.14 0.27 -0.00 0.00 0.00 0.00 0.00 27.48 28.89 1xyx h GLN 172 CO 1.12 1.37 0.02 -0.91 0.00 0.00 0.00 178.83 180.42 1xyx h ASN 173 N 0.24 0.07 0.11 -0.69 2.35 -1.99 0.10 115.58 115.77 1xyx h ASN 173 Ca -0.19 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.37 1xyx h ASN 173 Cb 1.95 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 40.30 1xyx h ASN 173 CO 0.24 0.22 -0.10 -0.55 -1.65 0.00 0.00 177.43 175.59 1xyx h ASN 174 N -0.09 0.00 0.14 5.81 -1.07 -2.00 -2.37 115.58 115.99 1xyx h ASN 174 Ca 0.02 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.16 1xyx h ASN 174 Cb 0.17 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.43 1xyx h ASN 174 CO -0.00 0.10 -0.87 0.15 0.07 0.00 0.00 177.43 176.88 1xyx h PHE 175 N 0.00 0.79 0.00 4.14 3.57 -1.24 -1.45 116.94 122.75 1xyx h PHE 175 Ca -0.00 -0.39 0.00 0.00 3.53 0.00 0.00 57.97 61.11 1xyx h PHE 175 Cb 0.19 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.82 1xyx h PHE 175 CO 0.00 1.20 0.05 0.28 -2.23 0.00 0.00 178.31 177.61 1xyx h VAL 176 N 0.35 0.00 0.00 1.41 2.07 -0.33 0.16 116.25 119.92 1xyx h VAL 176 Ca -0.07 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1xyx h VAL 176 Cb 1.50 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1xyx h VAL 176 CO 0.16 0.00 -0.29 -0.74 0.02 0.00 0.00 177.57 176.73 1xyx h HIS 177 N 0.00 0.00 -0.89 1.57 -0.00 -1.41 -3.37 115.15 111.04 1xyx h HIS 177 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 1xyx h HIS 177 Cb 0.10 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.47 1xyx h HIS 177 CO 0.00 0.18 0.52 0.22 -0.00 0.00 0.00 177.93 178.85 1xyx h ASP 178 N -1.00 1.09 -0.24 3.26 3.58 0.08 0.33 116.42 123.52 1xyx h ASP 178 Ca -0.02 -0.07 -0.14 0.00 0.42 0.00 0.00 57.03 57.21 1xyx h ASP 178 Cb 0.36 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.14 1xyx h ASP 178 CO -0.01 0.85 -0.41 0.00 -2.88 0.00 0.00 179.24 176.78 1xyx h VAL 180 N 0.41 0.89 -0.59 0.00 2.07 -1.51 0.15 116.25 117.68 1xyx h VAL 180 Ca 0.02 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1xyx h VAL 180 Cb 1.01 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 1xyx h VAL 180 CO 0.09 0.08 0.24 -1.13 0.02 0.00 0.00 177.57 176.87 1xyx h ASN 181 N 0.41 0.77 0.05 0.57 -1.24 -0.99 -0.72 115.58 114.43 1xyx h ASN 181 Ca 0.23 -0.09 -0.11 0.00 0.71 0.00 0.00 56.30 57.04 1xyx h ASN 181 Cb 0.19 -0.20 0.01 0.00 0.73 0.00 0.00 38.32 39.06 1xyx h ASN 181 CO -0.20 0.68 -0.46 0.40 -1.29 0.00 0.00 177.43 176.57 1xyx h ILE 182 N 0.84 1.57 -0.36 2.57 1.08 -1.15 0.26 117.51 122.31 1xyx h ILE 182 Ca 0.20 -2.26 0.05 0.00 -0.39 0.00 0.00 64.86 62.46 1xyx h ILE 182 Cb 0.15 3.02 -0.04 0.00 -3.07 0.00 0.00 36.82 36.88 1xyx h ILE 182 CO -0.02 0.63 0.10 0.74 -0.69 0.00 0.00 178.15 178.91 1xyx h THR 183 N -0.49 0.86 0.23 -0.27 2.02 -0.87 0.18 112.91 114.57 1xyx h THR 183 Ca -0.07 -0.08 0.01 0.00 0.77 0.00 0.00 66.41 67.04 1xyx h THR 183 Cb 1.28 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.27 1xyx h THR 183 CO 0.09 0.04 -0.35 0.40 0.37 0.00 0.00 175.52 176.07 1xyx h ILE 184 N 0.24 0.27 -0.21 3.11 2.04 -1.18 -1.36 117.51 120.42 1xyx h ILE 184 Ca 0.16 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.07 1xyx h ILE 184 Cb 0.16 0.27 -0.07 0.00 -0.74 0.00 0.00 36.82 36.44 1xyx h ILE 184 CO -0.19 0.00 -0.44 0.50 0.00 0.00 0.00 178.15 178.02 1xyx h LYS 185 N -0.65 -0.44 -0.14 2.37 3.11 -0.10 0.74 116.57 121.46 1xyx h LYS 185 Ca 0.00 0.03 0.03 0.00 -2.81 0.00 0.00 60.65 57.91 1xyx h LYS 185 Cb 0.63 0.10 -0.03 0.00 -1.00 0.00 0.00 32.23 31.93 1xyx h LYS 185 CO -0.14 -0.29 -0.06 1.96 -2.81 0.00 0.00 179.45 178.11 1xyx h GLN 186 N -0.46 -0.04 0.00 1.90 7.50 -0.33 0.46 115.11 124.15 1xyx h GLN 186 Ca 0.09 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 59.19 1xyx h GLN 186 Cb 0.62 0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.15 1xyx h GLN 186 CO -0.45 -0.03 -0.23 0.45 -1.50 0.00 0.00 178.83 177.07 1xyx h HIS 187 N -0.04 0.00 -0.26 2.96 3.86 -0.84 0.41 115.15 121.25 1xyx h HIS 187 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1xyx h HIS 187 Cb 0.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.62 1xyx h HIS 187 CO -0.19 0.23 0.00 2.41 0.86 0.00 0.00 177.93 181.24 1xyx n THR 188 N -3.74 0.33 0.04 2.45 -1.04 0.22 -3.75 114.28 108.79 1xyx n THR 188 Ca -0.01 -0.48 0.00 0.00 -2.04 0.00 0.00 64.05 61.52 1xyx n THR 188 Cb 0.34 0.52 0.00 0.00 -1.82 0.00 0.00 70.33 69.37 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 0.68 0.10 0.02 12.58 0.31 0.15 -4.44 118.33 127.73 1xyx n VAL 189 Ca 0.17 0.03 0.02 0.00 -0.01 0.00 0.00 64.34 64.54 1xyx n VAL 189 Cb 0.40 -0.40 0.09 0.00 -0.91 0.00 0.00 33.84 33.01 1xyx n VAL 189 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1xyx n THR 190 N -2.83 1.76 -0.06 2.52 -1.04 0.14 0.01 114.28 114.78 1xyx n THR 190 Ca 0.00 0.54 -0.07 0.00 -2.04 0.00 0.00 64.05 62.47 1xyx n THR 190 Cb 0.00 -1.54 -0.06 0.00 -1.82 0.00 0.00 70.33 66.92 1xyx n THR 190 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1xyx n THR 191 N -1.59 0.66 0.21 12.58 -1.04 -1.19 -4.70 114.28 119.22 1xyx n THR 191 Ca -0.00 -0.28 0.05 0.00 -2.04 0.00 0.00 64.05 61.78 1xyx n THR 191 Cb 0.03 -0.88 0.46 0.00 -1.82 0.00 0.00 70.33 68.12 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 0.00 1.06 -0.82 12.58 2.02 -0.55 -1.47 112.91 125.74 1xyx h THR 192 Ca -0.26 -1.03 0.18 0.00 0.77 0.00 0.00 66.41 66.08 1xyx h THR 192 Cb 1.44 1.58 -0.05 0.00 -1.74 0.00 0.00 68.15 69.37 1xyx h THR 192 CO -0.03 0.28 0.55 0.00 0.37 0.00 0.00 175.52 176.69 1xyx h THR 193 N 0.00 0.72 0.07 3.16 1.03 -0.70 -2.76 112.91 114.44 1xyx h THR 193 Ca -0.00 -0.12 -0.35 0.00 -0.01 0.00 0.00 66.41 65.92 1xyx h THR 193 Cb 0.55 0.33 -0.03 0.00 -1.07 0.00 0.00 68.15 67.93 1xyx h THR 193 CO 0.04 0.07 -1.96 0.29 -0.01 0.00 0.00 175.52 173.94 1xyx n LYS 194 N -4.47 0.69 0.00 0.00 4.01 -0.62 -4.96 118.16 112.81 1xyx n LYS 194 Ca 0.17 0.31 0.00 0.00 -0.51 0.00 0.00 58.31 58.28 1xyx n LYS 194 Cb 0.64 -1.67 0.00 0.00 -0.51 0.00 0.00 35.03 33.49 1xyx n LYS 194 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xyx n GLY 195 N 1.87 0.00 3.16 0.72 0.00 -0.95 -5.15 105.19 104.84 1xyx n GLY 195 Ca -0.36 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 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 2.35 0.00 1.61 2.12 -0.83 -4.93 118.70 119.02 1xyx s GLU 196 Ca 0.00 -1.34 0.00 0.00 0.36 0.00 0.00 54.97 53.99 1xyx s GLU 196 Cb 0.00 -3.19 0.00 0.00 0.26 0.00 0.00 34.13 31.20 1xyx s GLU 196 CO 0.00 -0.66 0.00 -1.71 -0.54 0.00 0.00 175.26 172.35 1xyx n ASN 197 N 4.59 0.98 -4.06 -1.70 2.85 -1.26 -1.98 115.26 114.69 1xyx n ASN 197 Ca -0.12 -0.86 -0.10 0.00 -0.11 0.00 0.00 54.58 53.39 1xyx n ASN 197 Cb 0.43 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.37 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 -1.30 0.65 0.50 1.20 0.40 -1.26 -5.09 117.98 113.07 1xyx s PHE 198 Ca 0.00 -0.98 -0.02 0.00 -0.60 0.00 0.00 56.93 55.34 1xyx s PHE 198 Cb 0.00 -0.19 0.00 0.00 0.51 0.00 0.00 43.02 43.35 1xyx s PHE 198 CO 0.00 -0.74 0.75 0.95 0.70 0.00 0.00 175.22 176.88 1xyx s THR 199 N -4.04 3.86 0.27 0.64 -4.23 -1.26 -4.84 115.64 106.05 1xyx s THR 199 Ca 0.25 -0.34 0.01 0.00 -1.18 0.00 0.00 61.69 60.43 1xyx s THR 199 Cb 0.04 -3.46 0.26 0.00 1.34 0.00 0.00 72.50 70.68 1xyx s THR 199 CO 0.06 -0.37 1.72 -0.08 -0.54 0.00 0.00 174.62 175.40 1xyx h GLU 200 N 0.21 0.45 0.31 3.99 4.81 -2.02 0.17 114.58 122.49 1xyx h GLU 200 Ca -0.46 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1xyx h GLU 200 Cb 1.25 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1xyx h GLU 200 CO 0.58 0.30 -0.27 1.15 -0.73 0.00 0.00 179.01 180.03 1xyx h THR 201 N 0.46 0.42 -0.06 0.32 2.02 -1.99 0.52 112.91 114.61 1xyx h THR 201 Ca 0.51 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.71 1xyx h THR 201 Cb 0.87 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1xyx h THR 201 CO -0.47 0.00 -0.06 0.44 0.37 0.00 0.00 175.52 175.80 1xyx h ASP 202 N -0.60 -0.19 -0.65 4.18 3.32 -1.31 0.60 116.42 121.77 1xyx h ASP 202 Ca -0.02 0.04 0.14 0.00 0.02 0.00 0.00 57.03 57.21 1xyx h ASP 202 Cb 0.54 0.10 -0.11 0.00 0.22 0.00 0.00 39.33 40.08 1xyx h ASP 202 CO -0.03 -0.09 0.02 0.58 -1.72 0.00 0.00 179.24 178.00 1xyx h VAL 203 N -0.08 0.47 -0.20 -1.35 2.07 -0.60 0.19 116.25 116.74 1xyx h VAL 203 Ca 0.05 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1xyx h VAL 203 Cb 0.15 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1xyx h VAL 203 CO -0.11 0.02 -0.07 0.50 0.02 0.00 0.00 177.57 177.94 1xyx h LYS 204 N 0.13 0.41 -0.07 1.57 3.64 -0.40 -2.86 116.57 118.99 1xyx h LYS 204 Ca 0.35 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.50 1xyx h LYS 204 Cb 0.58 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 1xyx h LYS 204 CO -0.55 0.67 -0.27 0.52 -2.27 0.00 0.00 179.45 177.55 1xyx h MET 205 N 0.12 0.13 0.20 1.90 2.86 -0.15 -2.49 114.93 117.49 1xyx h MET 205 Ca 0.05 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1xyx h MET 205 Cb 0.53 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1xyx h MET 205 CO 0.02 0.40 -0.14 0.52 1.06 0.00 0.00 176.91 178.77 1xyx h MET 206 N 0.12 -0.33 -1.00 1.72 2.86 -0.54 -2.22 114.93 115.54 1xyx h MET 206 Ca 0.02 0.02 0.27 0.00 -2.06 0.00 0.00 59.70 57.95 1xyx h MET 206 Cb 0.55 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.23 1xyx h MET 206 CO 0.04 -0.22 0.69 0.93 1.06 0.00 0.00 176.91 179.41 1xyx h GLU 207 N -0.34 0.16 -0.28 1.72 5.08 -1.22 0.34 114.58 120.04 1xyx h GLU 207 Ca -0.01 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 1xyx h GLU 207 Cb 0.29 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1xyx h GLU 207 CO 0.01 0.11 -0.07 -0.09 -1.00 0.00 0.00 179.01 177.96 1xyx h ARG 208 N 0.16 0.55 0.15 2.33 9.65 -1.36 -2.90 114.38 122.96 1xyx h ARG 208 Ca 0.51 -0.21 -0.29 0.00 -1.10 0.00 0.00 59.98 58.89 1xyx h ARG 208 Cb 1.70 -0.03 0.01 0.00 -1.39 0.00 0.00 29.97 30.26 1xyx h ARG 208 CO -0.11 0.75 -1.31 -0.24 2.80 0.00 0.00 179.97 181.86 1xyx h VAL 209 N 0.31 1.43 -0.23 0.20 3.04 -0.53 -3.18 116.25 117.29 1xyx h VAL 209 Ca 0.07 -2.98 -0.03 0.00 -1.01 0.00 0.00 66.70 62.76 1xyx h VAL 209 Cb 0.55 2.95 -0.01 0.00 -2.01 0.00 0.00 31.29 32.77 1xyx h VAL 209 CO 0.03 0.87 0.02 0.58 -1.01 0.00 0.00 177.57 178.07 1xyx h VAL 210 N 0.09 1.24 -0.44 1.51 2.07 -0.49 -0.44 116.25 119.79 1xyx h VAL 210 Ca -0.17 -0.81 0.05 0.00 0.82 0.00 0.00 66.70 66.60 1xyx h VAL 210 Cb 2.01 1.33 -0.09 0.00 -1.52 0.00 0.00 31.29 33.02 1xyx h VAL 210 CO 0.21 0.25 -0.54 -0.08 0.02 0.00 0.00 177.57 177.43 1xyx h GLU 211 N 0.18 -0.36 -0.33 1.57 4.81 -1.62 0.03 114.58 118.86 1xyx h GLU 211 Ca 0.07 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1xyx h GLU 211 Cb 0.35 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1xyx h GLU 211 CO 0.01 -0.24 0.13 1.96 -0.73 0.00 0.00 179.01 180.14 1xyx h GLN 212 N -0.37 0.49 -0.44 1.92 1.08 -1.44 0.38 115.11 116.73 1xyx h GLN 212 Ca 0.09 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1xyx h GLN 212 Cb 0.59 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 1xyx h GLN 212 CO -0.61 0.50 0.20 0.52 -0.95 0.00 0.00 178.83 178.48 1xyx h MET 213 N 0.38 0.65 -0.52 1.46 2.86 -0.89 0.17 114.93 119.04 1xyx h MET 213 Ca 0.11 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1xyx h MET 213 Cb 0.19 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1xyx h MET 213 CO -0.01 0.57 0.27 0.00 1.06 0.00 0.00 176.91 178.80 1xyx h VAL 215 N 0.70 1.20 -0.52 0.00 2.07 -0.76 -1.27 116.25 117.67 1xyx h VAL 215 Ca 0.18 -0.65 -0.10 0.00 0.82 0.00 0.00 66.70 66.95 1xyx h VAL 215 Cb 0.09 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1xyx h VAL 215 CO -0.03 0.23 -0.06 0.74 0.02 0.00 0.00 177.57 178.47 1xyx h THR 216 N 0.40 1.26 0.19 2.57 2.02 -0.39 0.44 112.91 119.41 1xyx h THR 216 Ca 0.11 -1.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 1xyx h THR 216 Cb 0.24 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1xyx h THR 216 CO -0.00 0.41 -0.09 1.56 0.37 0.00 0.00 175.52 177.76 1xyx h GLN 217 N 0.84 -0.25 -0.22 6.66 1.08 -0.48 0.19 115.11 122.93 1xyx h GLN 217 Ca 0.14 0.02 0.04 0.00 -1.45 0.00 0.00 58.65 57.40 1xyx h GLN 217 Cb 0.58 0.06 -0.07 0.00 -0.05 0.00 0.00 27.48 28.00 1xyx h GLN 217 CO 0.04 -0.16 -0.52 -0.92 -0.95 0.00 0.00 178.83 176.32 1xyx h TYR 218 N -0.27 -1.54 -0.02 2.96 3.20 -0.93 -1.69 116.97 118.68 1xyx h TYR 218 Ca -0.03 0.06 -0.09 0.00 3.14 0.00 0.00 58.73 61.82 1xyx h TYR 218 Cb 0.20 0.70 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1xyx h TYR 218 CO -0.06 -0.52 -0.40 1.96 -1.64 0.00 0.00 178.16 177.50 1xyx h GLN 219 N -0.51 0.04 0.15 1.82 4.20 -0.76 0.10 115.11 120.15 1xyx h GLN 219 Ca 0.06 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.76 1xyx h GLN 219 Cb 0.65 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 1xyx h GLN 219 CO -0.48 0.44 -0.17 0.87 -0.67 0.00 0.00 178.83 178.82 1xyx h LYS 220 N 0.03 -0.34 -0.09 1.46 1.57 -0.28 0.78 116.57 119.71 1xyx h LYS 220 Ca 0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1xyx h LYS 220 Cb 0.72 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.11 1xyx h LYS 220 CO 0.05 -0.23 0.00 0.93 -0.57 0.00 0.00 179.45 179.64 1xyx h GLU 221 N -0.36 0.15 0.00 3.15 4.39 -0.85 -0.45 114.58 120.62 1xyx h GLU 221 Ca 0.01 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.68 1xyx h GLU 221 Cb 0.35 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 1xyx h GLU 221 CO -0.06 0.41 -0.12 1.03 -1.16 0.00 0.00 179.01 179.11 1xyx h SER 222 N -0.12 -0.35 -0.55 1.42 0.87 -0.77 -0.52 113.55 113.52 1xyx h SER 222 Ca 0.02 0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.58 1xyx h SER 222 Cb 0.34 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 1xyx h SER 222 CO 0.00 -0.17 0.12 -0.61 -0.53 0.00 0.00 176.83 175.64 1xyx h GLN 223 N -0.21 0.90 -0.54 2.24 4.15 -0.85 0.14 115.11 120.94 1xyx h GLN 223 Ca 0.04 -0.23 0.08 0.00 0.77 0.00 0.00 58.65 59.31 1xyx h GLN 223 Cb 0.26 -0.11 -0.06 0.00 0.21 0.00 0.00 27.48 27.78 1xyx h GLN 223 CO -0.12 0.85 0.19 0.00 -1.93 0.00 0.00 178.83 177.82 1xyx h ALA 224 N 1.01 0.67 0.69 3.38 0.00 -0.66 0.14 119.26 124.50 1xyx h ALA 224 Ca 0.17 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1xyx h ALA 224 Cb 0.37 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.22 1xyx h ALA 224 CO 0.01 -0.21 -0.33 -0.92 0.00 0.00 0.00 179.25 177.79 1xyx h TYR 225 N 0.37 -0.86 -0.06 0.00 5.03 -0.84 -1.78 116.97 118.83 1xyx h TYR 225 Ca 0.26 -0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.57 1xyx h TYR 225 Cb 0.30 0.29 -0.00 0.00 1.55 0.00 0.00 36.73 38.87 1xyx h TYR 225 CO -0.17 -0.51 0.05 1.88 -1.32 0.00 0.00 178.16 178.09 1xyx h TYR 226 N -1.03 0.00 0.00 -3.82 0.05 -0.32 -0.27 116.97 111.57 1xyx h TYR 226 Ca -0.10 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.68 1xyx h TYR 226 Cb 0.74 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.48 1xyx h TYR 226 CO -0.01 0.00 -0.78 -0.25 -1.05 0.00 0.00 178.16 176.07 1xyx n ASP 227 N -4.23 0.63 -1.71 3.88 8.00 0.46 -4.34 116.55 119.24 1xyx n ASP 227 Ca -0.02 -0.14 -0.16 0.00 0.71 0.00 0.00 54.79 55.19 1xyx n ASP 227 Cb 0.15 0.47 0.17 0.00 -0.02 0.00 0.00 41.12 41.89 1xyx n ASP 227 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xyx n GLY 228 N 1.39 4.96 0.23 0.44 0.00 -0.12 -4.42 105.19 107.67 1xyx n GLY 228 Ca 0.03 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.09 0.00 -1.83 1.61 1.85 -1.21 -4.95 116.66 111.04 1xyx n ARG 229 Ca 0.46 -0.53 -0.35 0.00 -1.00 0.00 0.00 57.85 56.43 1xyx n ARG 229 Cb 1.22 -0.37 -0.01 0.00 -1.05 0.00 0.00 32.46 32.25 1xyx n ARG 229 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1xyx n ARG 230 N 0.00 3.19 0.00 2.89 5.12 -1.26 -4.70 116.66 121.90 1xyx n ARG 230 Ca 0.00 -3.14 0.00 0.00 -1.93 0.00 0.00 57.85 52.78 1xyx n ARG 230 Cb 0.57 -2.29 0.00 0.00 -1.16 0.00 0.00 32.46 29.57 1xyx n ARG 230 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1xyx n SER 231 N 0.46 0.36 0.00 0.55 3.41 -1.26 -5.20 113.62 111.94 1xyx n SER 231 Ca 0.52 -1.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.66 1xyx n SER 231 Cb 0.37 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 1xyx n SER 231 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64