#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dx1 n LEU 125 N 0.00 0.00 -1.44 0.99 4.32 -1.26 -5.05 117.00 114.56 1dx1 n LEU 125 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1dx1 n LEU 125 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1dx1 n LEU 125 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1dx1 n GLY 126 N 3.94 0.38 0.76 -0.72 0.00 -1.26 -4.75 105.19 103.54 1dx1 n GLY 126 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1dx1 n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dx1 n GLY 127 N -1.22 1.31 3.76 -0.02 0.00 -1.26 -5.04 105.19 102.73 1dx1 n GLY 127 Ca 0.00 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1dx1 n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dx1 s TYR 128 N -2.05 3.20 -0.49 1.61 1.51 -1.26 -4.72 117.35 115.15 1dx1 s TYR 128 Ca 0.00 1.43 -0.26 0.00 -1.01 0.00 0.00 57.07 57.23 1dx1 s TYR 128 Cb 0.00 -3.59 0.03 0.00 -0.11 0.00 0.00 41.96 38.29 1dx1 s TYR 128 CO 0.00 -1.61 0.99 -1.64 -1.11 0.00 0.00 175.55 172.18 1dx1 s MET 129 N -1.38 3.54 -0.22 -0.62 -1.94 0.14 -4.91 119.30 113.91 1dx1 s MET 129 Ca 0.50 0.19 -0.29 0.00 -1.71 0.00 0.00 55.69 54.37 1dx1 s MET 129 Cb -0.38 -3.95 0.00 0.00 2.01 0.00 0.00 34.83 32.52 1dx1 s MET 129 CO 0.48 -1.33 1.13 -1.17 -0.01 0.00 0.00 175.02 174.12 1dx1 s LEU 130 N 4.02 4.11 0.96 -0.03 2.96 -1.26 -2.16 118.68 127.27 1dx1 s LEU 130 Ca 0.39 1.46 -0.11 0.00 -0.22 0.00 0.00 54.13 55.65 1dx1 s LEU 130 Cb -0.10 -3.54 0.17 0.00 0.50 0.00 0.00 46.19 43.22 1dx1 s LEU 130 CO 0.26 -0.73 1.11 -0.83 -1.32 0.00 0.00 176.35 174.84 1dx1 s GLY 131 N 1.56 1.64 0.95 7.98 0.00 0.52 -4.98 107.32 114.99 1dx1 s GLY 131 Ca 0.48 0.31 -0.11 0.00 0.00 0.00 0.00 44.72 45.40 1dx1 s GLY 131 CO 0.10 0.80 1.10 -0.56 0.00 0.00 0.00 173.10 174.54 1dx1 s SER 132 N -2.80 2.86 -0.19 1.64 0.01 -1.26 -4.43 113.70 109.53 1dx1 s SER 132 Ca 0.66 1.78 -0.29 0.00 1.31 0.00 0.00 55.95 59.41 1dx1 s SER 132 Cb -0.22 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 1dx1 s SER 132 CO 0.59 -3.07 1.58 0.00 0.41 0.00 0.00 173.24 172.76 1dx1 s ALA 133 N -2.73 3.36 0.56 1.44 0.00 -1.26 -4.45 121.76 118.68 1dx1 s ALA 133 Ca 0.65 0.52 0.06 0.00 0.00 0.00 0.00 51.96 53.20 1dx1 s ALA 133 Cb -0.21 -3.81 0.07 0.00 0.00 0.00 0.00 23.12 19.16 1dx1 s ALA 133 CO 0.59 -1.80 0.77 -1.64 0.00 0.00 0.00 175.76 173.68 1dx1 s MET 134 N 4.47 2.35 0.79 0.00 -1.94 0.66 -5.01 119.30 120.62 1dx1 s MET 134 Ca 0.70 -1.33 -0.13 0.00 -1.71 0.00 0.00 55.69 53.21 1dx1 s MET 134 Cb -0.26 -2.60 0.19 0.00 2.01 0.00 0.00 34.83 34.18 1dx1 s MET 134 CO 0.28 -0.80 0.70 0.45 -0.01 0.00 0.00 175.02 175.64 1dx1 n SER 135 N -2.26 -1.67 -3.85 3.03 2.88 -1.26 -4.92 113.62 105.56 1dx1 n SER 135 Ca 0.13 -0.94 -0.30 0.00 -1.33 0.00 0.00 58.87 56.43 1dx1 n SER 135 Cb 0.60 -0.64 -0.14 0.00 -0.75 0.00 0.00 64.21 63.28 1dx1 n SER 135 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1dx1 s ARG 136 N -4.60 1.56 -0.63 -1.46 0.52 -1.26 -4.98 118.95 108.11 1dx1 s ARG 136 Ca 0.46 -2.19 -0.27 0.00 -0.52 0.00 0.00 55.73 53.20 1dx1 s ARG 136 Cb -0.04 -2.83 0.02 0.00 0.52 0.00 0.00 34.95 32.62 1dx1 s ARG 136 CO 0.35 -1.10 1.40 -1.25 0.02 0.00 0.00 175.30 174.72 1dx1 s PRO 137 N 0.22 3.21 -0.12 3.54 0.04 -1.26 -4.98 135.00 135.64 1dx1 s PRO 137 Ca 0.16 0.23 -0.29 0.00 0.04 0.00 0.00 61.00 61.14 1dx1 s PRO 137 Cb -0.24 -4.16 -0.05 0.00 0.04 0.00 0.00 34.50 30.09 1dx1 s PRO 137 CO -0.02 -2.07 1.72 -0.51 0.04 0.00 0.00 177.00 176.15 1dx1 s LEU 138 N 6.20 4.09 0.48 -3.56 2.01 -1.26 -4.83 118.68 121.82 1dx1 s LEU 138 Ca 0.48 2.01 -0.10 0.00 0.01 0.00 0.00 54.13 56.53 1dx1 s LEU 138 Cb -0.10 -3.53 -0.05 0.00 0.01 0.00 0.00 46.19 42.52 1dx1 s LEU 138 CO 0.21 -1.16 0.85 -0.63 1.01 0.00 0.00 176.35 176.64 1dx1 s ILE 139 N 4.90 4.77 0.00 -0.59 -1.09 -1.26 -4.97 121.20 122.96 1dx1 s ILE 139 Ca 0.76 0.62 -0.05 0.00 -2.23 0.00 0.00 60.65 59.76 1dx1 s ILE 139 Cb -0.31 -3.80 -0.22 0.00 -1.58 0.00 0.00 42.46 36.55 1dx1 s ILE 139 CO 0.31 -0.76 3.22 0.00 -1.23 0.00 0.00 174.94 176.48 1dx1 n HIS 140 N -1.88 0.00 -0.34 3.97 1.44 -1.26 -4.67 115.22 112.48 1dx1 n HIS 140 Ca 0.03 -1.33 0.26 0.00 -2.01 0.00 0.00 57.72 54.67 1dx1 n HIS 140 Cb 0.54 -1.40 0.55 0.00 0.12 0.00 0.00 29.99 29.80 1dx1 n HIS 140 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1dx1 h PHE 141 N 3.06 0.59 0.00 -1.40 0.04 -1.97 -3.45 116.94 113.82 1dx1 h PHE 141 Ca 0.16 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.95 1dx1 h PHE 141 Cb 1.35 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1dx1 h PHE 141 CO 1.58 0.02 0.00 0.41 -0.60 0.00 0.00 178.31 179.72 1dx1 n GLY 142 N -1.50 2.32 3.71 -1.45 0.00 -1.26 -4.98 105.19 102.02 1dx1 n GLY 142 Ca 0.27 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1dx1 n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dx1 s SER 143 N 0.00 7.20 0.53 1.61 0.01 -1.26 -4.90 113.70 116.89 1dx1 s SER 143 Ca 0.00 1.85 0.24 0.00 1.31 0.00 0.00 55.95 59.35 1dx1 s SER 143 Cb 0.00 -2.57 1.39 0.00 0.21 0.00 0.00 66.02 65.05 1dx1 s SER 143 CO 0.00 -0.39 2.03 -0.78 0.41 0.00 0.00 173.24 174.51 1dx1 h ASP 144 N 6.84 0.00 0.85 2.44 3.58 -2.01 -1.23 116.42 126.89 1dx1 h ASP 144 Ca -0.41 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.00 1dx1 h ASP 144 Cb 1.21 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.27 1dx1 h ASP 144 CO 0.79 0.00 -0.41 1.88 -2.88 0.00 0.00 179.24 178.62 1dx1 h TYR 145 N 0.00 -1.06 0.00 0.28 0.05 -2.00 -3.24 116.97 111.00 1dx1 h TYR 145 Ca 0.19 -0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.92 1dx1 h TYR 145 Cb 0.79 0.35 -0.00 0.00 1.01 0.00 0.00 36.73 38.88 1dx1 h TYR 145 CO 0.00 -0.66 -0.15 0.93 -1.05 0.00 0.00 178.16 177.23 1dx1 h GLU 146 N -1.16 0.00 -0.89 4.88 5.08 -1.61 0.51 114.58 121.39 1dx1 h GLU 146 Ca -0.12 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.35 1dx1 h GLU 146 Cb 0.88 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.05 1dx1 h GLU 146 CO 0.19 0.15 0.53 0.22 -1.00 0.00 0.00 179.01 179.10 1dx1 h ASP 147 N 0.00 0.76 0.07 1.42 1.82 -1.56 -1.54 116.42 117.39 1dx1 h ASP 147 Ca -0.00 0.05 -0.36 0.00 -0.39 0.00 0.00 57.03 56.33 1dx1 h ASP 147 Cb 0.41 -0.10 -0.07 0.00 0.68 0.00 0.00 39.33 40.25 1dx1 h ASP 147 CO 0.02 0.42 -2.30 -1.14 -1.61 0.00 0.00 179.24 174.63 1dx1 n ARG 148 N -4.70 0.68 -0.28 0.28 0.63 -0.24 -4.17 116.66 108.85 1dx1 n ARG 148 Ca 0.16 0.04 -0.04 0.00 -0.92 0.00 0.00 57.85 57.09 1dx1 n ARG 148 Cb 0.31 -1.56 0.07 0.00 0.45 0.00 0.00 32.46 31.74 1dx1 n ARG 148 CO 0.00 0.00 0.00 -0.92 -2.51 0.00 0.00 177.63 174.20 1dx1 h TYR 149 N 0.00 0.97 -0.02 -0.14 5.03 0.22 0.12 116.97 123.14 1dx1 h TYR 149 Ca -0.51 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 60.82 1dx1 h TYR 149 Cb 2.20 -0.33 -0.00 0.00 1.55 0.00 0.00 36.73 40.15 1dx1 h TYR 149 CO 0.00 0.60 0.01 -0.92 -1.32 0.00 0.00 178.16 176.53 1dx1 h TYR 150 N 1.03 0.04 -0.82 -3.82 3.20 -1.52 -3.23 116.97 111.85 1dx1 h TYR 150 Ca 0.29 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.13 1dx1 h TYR 150 Cb -0.09 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.13 1dx1 h TYR 150 CO -0.02 0.24 0.40 0.00 -1.64 0.00 0.00 178.16 177.14 1dx1 h ARG 151 N -0.17 1.18 0.87 1.82 3.08 -1.21 0.14 114.38 120.08 1dx1 h ARG 151 Ca 0.01 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.85 1dx1 h ARG 151 Cb 0.22 -0.21 0.01 0.00 0.08 0.00 0.00 29.97 30.06 1dx1 h ARG 151 CO -0.00 0.90 -0.42 0.93 -1.07 0.00 0.00 179.97 180.32 1dx1 h GLU 152 N 1.17 -1.12 -0.64 0.04 5.08 -0.96 -3.32 114.58 114.83 1dx1 h GLU 152 Ca 0.28 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1dx1 h GLU 152 Cb 0.11 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1dx1 h GLU 152 CO -0.04 -0.75 0.00 0.09 -1.00 0.00 0.00 179.01 177.31 1dx1 n ASN 153 N -5.30 4.91 -0.29 1.42 3.02 -1.15 -4.69 115.26 113.18 1dx1 n ASN 153 Ca -0.14 -2.61 0.08 0.00 -0.03 0.00 0.00 54.58 51.87 1dx1 n ASN 153 Cb 0.46 -0.61 0.19 0.00 -0.61 0.00 0.00 39.78 39.21 1dx1 n ASN 153 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 1dx1 h MET 154 N 3.81 0.06 0.00 3.52 4.05 -0.83 0.41 114.93 125.95 1dx1 h MET 154 Ca 0.00 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1dx1 h MET 154 Cb 1.60 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 32.39 1dx1 h MET 154 CO 0.33 0.04 0.00 1.25 0.23 0.00 0.00 176.91 178.76 1dx1 h HIS 155 N 0.07 0.00 0.00 1.39 6.17 -1.85 -2.01 115.15 118.92 1dx1 h HIS 155 Ca 0.47 0.00 -0.08 0.00 0.71 0.00 0.00 60.37 61.47 1dx1 h HIS 155 Cb 0.85 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.77 1dx1 h HIS 155 CO -0.48 0.00 -0.37 0.00 0.71 0.00 0.00 177.93 177.79 1dx1 h ARG 156 N 0.00 0.00 -7.00 5.26 3.08 -1.29 -3.44 114.38 110.99 1dx1 h ARG 156 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.56 1dx1 h ARG 156 Cb 0.14 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.23 1dx1 h ARG 156 CO 0.00 0.37 0.15 0.71 -1.07 0.00 0.00 179.97 180.12 1dx1 s TYR 157 N -4.17 3.51 0.39 3.04 2.02 -0.76 -5.01 117.35 116.39 1dx1 s TYR 157 Ca -0.03 0.82 -0.26 0.00 -0.37 0.00 0.00 57.07 57.24 1dx1 s TYR 157 Cb 0.14 -2.41 -0.11 0.00 -0.40 0.00 0.00 41.96 39.18 1dx1 s TYR 157 CO 0.72 -0.41 1.09 -2.30 -1.57 0.00 0.00 175.55 173.09 1dx1 n PRO 158 N -2.36 1.55 0.00 -1.71 -0.02 -1.26 -4.91 135.00 126.30 1dx1 n PRO 158 Ca 0.02 0.55 0.11 0.00 -2.02 0.00 0.00 63.50 62.16 1dx1 n PRO 158 Cb 0.55 -2.11 -0.01 0.00 -0.02 0.00 0.00 33.50 31.92 1dx1 n PRO 158 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1dx1 n ASN 159 N 0.61 0.79 -4.34 2.55 3.02 -1.26 -4.97 115.26 111.65 1dx1 n ASN 159 Ca 0.08 -0.68 -0.27 0.00 -0.03 0.00 0.00 54.58 53.68 1dx1 n ASN 159 Cb 0.38 0.83 -0.08 0.00 -0.61 0.00 0.00 39.78 40.29 1dx1 n ASN 159 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1dx1 s GLN 160 N -3.04 1.95 -0.19 3.52 -0.21 -1.26 -0.24 119.66 120.19 1dx1 s GLN 160 Ca 0.08 -2.19 -0.05 0.00 0.02 0.00 0.00 55.36 53.22 1dx1 s GLN 160 Cb 0.16 -0.91 0.07 0.00 1.00 0.00 0.00 33.01 33.32 1dx1 s GLN 160 CO 0.82 -0.39 0.09 0.14 -2.12 0.00 0.00 175.29 173.84 1dx1 s VAL 161 N -3.12 -0.07 -0.38 1.09 -7.23 -1.26 -5.00 120.40 104.43 1dx1 s VAL 161 Ca 0.22 -0.26 -0.19 0.00 -1.81 0.00 0.00 61.98 59.94 1dx1 s VAL 161 Cb 0.04 -0.64 0.01 0.00 0.56 0.00 0.00 36.38 36.34 1dx1 s VAL 161 CO 0.12 -0.34 0.53 -0.47 -0.31 0.00 0.00 175.10 174.63 1dx1 s TYR 162 N 2.13 3.15 0.25 2.82 6.14 -1.26 -0.35 117.35 130.22 1dx1 s TYR 162 Ca 0.03 0.04 -0.20 0.00 0.64 0.00 0.00 57.07 57.59 1dx1 s TYR 162 Cb -0.16 -3.02 0.02 0.00 0.42 0.00 0.00 41.96 39.22 1dx1 s TYR 162 CO -0.13 -0.64 0.65 1.52 0.64 0.00 0.00 175.55 177.59 1dx1 s TYR 163 N 2.45 -0.15 0.42 4.97 1.13 -0.92 -4.06 117.35 121.20 1dx1 s TYR 163 Ca 0.19 -0.25 -0.22 0.00 -1.41 0.00 0.00 57.07 55.37 1dx1 s TYR 163 Cb -0.15 0.58 -0.10 0.00 -1.10 0.00 0.00 41.96 41.19 1dx1 s TYR 163 CO 0.15 -1.12 0.98 -0.98 -2.51 0.00 0.00 175.55 172.06 1dx1 s ARG 164 N -3.91 4.21 1.09 -3.49 1.70 -1.26 0.25 118.95 117.53 1dx1 s ARG 164 Ca 0.11 1.25 -0.12 0.00 -0.47 0.00 0.00 55.73 56.49 1dx1 s ARG 164 Cb -0.04 -2.32 0.24 0.00 -0.57 0.00 0.00 34.95 32.26 1dx1 s ARG 164 CO 0.04 -0.06 1.06 -1.25 -1.08 0.00 0.00 175.30 174.00 1dx1 s PRO 165 N -2.91 -0.28 0.04 3.89 0.04 -1.26 -4.85 135.00 129.67 1dx1 s PRO 165 Ca 0.60 0.73 -0.15 0.00 0.04 0.00 0.00 61.00 62.23 1dx1 s PRO 165 Cb -0.14 -1.64 -0.07 0.00 0.04 0.00 0.00 34.50 32.70 1dx1 s PRO 165 CO 0.18 -3.27 1.23 -0.39 0.04 0.00 0.00 177.00 174.80 1dx1 h VAL 166 N -2.29 0.00 0.00 -0.36 -1.51 -1.97 -3.43 116.25 106.68 1dx1 h VAL 166 Ca -0.58 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 1dx1 h VAL 166 Cb 1.33 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.49 1dx1 h VAL 166 CO 0.53 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.20 1dx1 n ASP 167 N -3.65 0.00 -3.48 4.19 2.03 -1.26 -4.63 116.55 109.75 1dx1 n ASP 167 Ca -0.05 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.05 1dx1 n ASP 167 Cb 0.19 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.53 1dx1 n ASP 167 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dx1 n GLN 168 N 0.00 0.54 -1.17 -0.67 6.02 -1.26 -4.97 117.38 115.87 1dx1 n GLN 168 Ca 0.00 -3.11 -0.09 0.00 -0.01 0.00 0.00 57.00 53.79 1dx1 n GLN 168 Cb 0.00 1.92 -0.04 0.00 1.02 0.00 0.00 30.24 33.14 1dx1 n GLN 168 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 1dx1 n TYR 169 N -0.76 -0.09 -1.64 1.08 4.11 -1.26 -4.85 117.16 113.74 1dx1 n TYR 169 Ca -0.02 0.00 -0.49 0.00 -0.00 0.00 0.00 57.90 57.39 1dx1 n TYR 169 Cb 0.55 -2.41 -0.05 0.00 -0.00 0.00 0.00 39.34 37.43 1dx1 n TYR 169 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 1dx1 n SER 170 N -0.63 2.46 -3.76 9.48 3.41 -1.26 -4.95 113.62 118.37 1dx1 n SER 170 Ca -0.09 1.10 -0.18 0.00 -0.26 0.00 0.00 58.87 59.44 1dx1 n SER 170 Cb 0.49 -1.32 -0.17 0.00 -0.26 0.00 0.00 64.21 62.96 1dx1 n SER 170 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1dx1 s ASN 171 N 0.88 0.64 0.36 4.04 0.02 -1.26 -5.04 114.94 114.58 1dx1 s ASN 171 Ca 0.82 0.02 0.07 0.00 -1.02 0.00 0.00 52.86 52.75 1dx1 s ASN 171 Cb -0.81 -0.17 0.77 0.00 0.02 0.00 0.00 41.25 41.06 1dx1 s ASN 171 CO 0.43 -0.16 1.94 -0.61 0.02 0.00 0.00 177.10 178.72 1dx1 h GLN 172 N 7.72 0.70 0.00 -0.60 -0.00 -2.00 -3.24 115.11 117.70 1dx1 h GLN 172 Ca -0.32 -0.04 -0.08 0.00 -0.00 0.00 0.00 58.65 58.21 1dx1 h GLN 172 Cb 1.12 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 28.43 1dx1 h GLN 172 CO 0.36 0.47 -1.04 -1.71 0.00 0.00 0.00 178.83 176.91 1dx1 n ASN 173 N -4.49 1.64 -0.00 -0.69 5.15 -1.26 -4.11 115.26 111.49 1dx1 n ASN 173 Ca 0.12 0.27 -0.09 0.00 -0.60 0.00 0.00 54.58 54.28 1dx1 n ASN 173 Cb 0.28 -0.62 -0.03 0.00 -0.53 0.00 0.00 39.78 38.88 1dx1 n ASN 173 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 1dx1 h ASN 174 N -0.72 -0.39 -0.78 1.20 -1.24 -2.00 -1.29 115.58 110.36 1dx1 h ASN 174 Ca -0.12 0.08 -0.04 0.00 0.71 0.00 0.00 56.30 56.93 1dx1 h ASN 174 Cb 0.88 0.19 -0.04 0.00 0.73 0.00 0.00 38.32 40.09 1dx1 h ASN 174 CO -0.07 -0.16 0.34 0.15 -1.29 0.00 0.00 177.43 176.39 1dx1 h PHE 175 N -0.15 1.18 -0.44 0.67 3.04 -1.84 -0.96 116.94 118.44 1dx1 h PHE 175 Ca 0.09 -0.07 -0.06 0.00 3.98 0.00 0.00 57.97 61.91 1dx1 h PHE 175 Cb 0.28 -0.36 -0.02 0.00 2.56 0.00 0.00 35.95 38.41 1dx1 h PHE 175 CO -0.25 0.87 0.03 0.28 -2.02 0.00 0.00 178.31 177.23 1dx1 h VAL 176 N 1.14 1.22 -0.29 1.41 2.07 -1.59 0.15 116.25 120.36 1dx1 h VAL 176 Ca 0.27 -0.88 -0.14 0.00 0.82 0.00 0.00 66.70 66.77 1dx1 h VAL 176 Cb 0.18 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1dx1 h VAL 176 CO -0.03 0.31 -0.35 0.45 0.02 0.00 0.00 177.57 177.98 1dx1 h HIS 177 N 0.67 0.91 -0.64 1.57 3.86 -0.87 -0.45 115.15 120.20 1dx1 h HIS 177 Ca 0.14 -0.29 -0.03 0.00 -1.16 0.00 0.00 60.37 59.03 1dx1 h HIS 177 Cb 0.37 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 1dx1 h HIS 177 CO 0.02 1.06 0.28 0.22 0.86 0.00 0.00 177.93 180.37 1dx1 h ASP 178 N 0.50 0.84 0.46 2.45 1.82 -0.65 0.65 116.42 122.48 1dx1 h ASP 178 Ca 0.04 -0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.56 1dx1 h ASP 178 Cb 0.93 -0.21 -0.00 0.00 0.68 0.00 0.00 39.33 40.73 1dx1 h ASP 178 CO 0.08 0.73 -0.27 0.00 -1.61 0.00 0.00 179.24 178.18 1dx1 h VAL 180 N -0.68 0.61 -0.56 0.00 2.07 -0.90 -2.75 116.25 114.04 1dx1 h VAL 180 Ca -0.06 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.55 1dx1 h VAL 180 Cb 0.54 0.61 -0.11 0.00 -1.52 0.00 0.00 31.29 30.81 1dx1 h VAL 180 CO 0.07 0.00 -0.41 -1.13 0.02 0.00 0.00 177.57 176.12 1dx1 h ASN 181 N -0.04 -1.40 -0.06 0.57 -0.73 -0.91 -0.20 115.58 112.80 1dx1 h ASN 181 Ca 0.16 0.24 0.01 0.00 1.87 0.00 0.00 56.30 58.58 1dx1 h ASN 181 Cb 0.29 0.65 -0.01 0.00 0.27 0.00 0.00 38.32 39.52 1dx1 h ASN 181 CO -0.36 -0.33 -0.01 0.40 -0.37 0.00 0.00 177.43 176.75 1dx1 h ILE 182 N -0.22 0.94 0.04 2.57 1.08 -1.41 -1.08 117.51 119.43 1dx1 h ILE 182 Ca 0.19 -0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.66 1dx1 h ILE 182 Cb 0.56 0.94 0.00 0.00 -3.07 0.00 0.00 36.82 35.25 1dx1 h ILE 182 CO -0.67 0.00 -0.02 0.74 -0.69 0.00 0.00 178.15 177.51 1dx1 h THR 183 N 0.00 1.00 -0.91 -0.27 2.02 -0.97 0.79 112.91 114.57 1dx1 h THR 183 Ca 0.03 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1dx1 h THR 183 Cb 0.04 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.47 1dx1 h THR 183 CO -0.06 0.03 0.61 0.58 0.37 0.00 0.00 175.52 177.04 1dx1 h VAL 184 N -0.10 1.23 0.04 3.16 2.07 -1.01 -2.93 116.25 118.72 1dx1 h VAL 184 Ca -0.01 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 1dx1 h VAL 184 Cb 0.08 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 29.74 1dx1 h VAL 184 CO 0.01 0.23 -0.02 0.11 0.02 0.00 0.00 177.57 177.91 1dx1 h LYS 185 N 1.24 -0.05 -2.06 1.57 1.57 -0.79 -2.51 116.57 115.54 1dx1 h LYS 185 Ca 0.34 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.04 1dx1 h LYS 185 Cb -0.14 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1dx1 h LYS 185 CO -0.07 -0.04 -0.14 0.39 -0.57 0.00 0.00 179.45 179.03 1dx1 n GLU 186 N -2.16 1.30 0.00 3.15 -0.58 0.24 -0.87 120.64 121.72 1dx1 n GLU 186 Ca -0.01 -0.42 0.00 0.00 -0.42 0.00 0.00 57.16 56.32 1dx1 n GLU 186 Cb 0.02 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 1dx1 n GLU 186 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 1dx1 n HIS 187 N 2.03 -0.04 -0.35 -0.32 -0.00 -1.11 -4.93 115.22 110.50 1dx1 n HIS 187 Ca 0.18 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.38 1dx1 n HIS 187 Cb 0.62 0.17 0.16 0.00 -0.12 0.00 0.00 29.99 30.81 1dx1 n HIS 187 CO 0.00 0.00 0.00 1.15 0.46 0.00 0.00 176.34 177.95 1dx1 h THR 188 N 0.00 1.08 0.68 3.57 2.02 -1.36 -2.49 112.91 116.40 1dx1 h THR 188 Ca 0.00 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.77 1dx1 h THR 188 Cb 0.00 -0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 66.28 1dx1 h THR 188 CO 0.00 0.20 -0.40 0.58 0.37 0.00 0.00 175.52 176.27 1dx1 h VAL 189 N 1.10 0.00 -0.34 3.16 2.07 -1.16 0.21 116.25 121.29 1dx1 h VAL 189 Ca 0.41 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.00 1dx1 h VAL 189 Cb 0.16 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.86 1dx1 h VAL 189 CO -0.17 0.00 -0.10 0.74 0.02 0.00 0.00 177.57 178.06 1dx1 h THR 190 N -1.01 0.63 -0.61 2.57 2.02 -1.73 -0.37 112.91 114.40 1dx1 h THR 190 Ca -0.09 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 1dx1 h THR 190 Cb 0.80 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 1dx1 h THR 190 CO 0.11 0.00 0.19 0.74 0.37 0.00 0.00 175.52 176.93 1dx1 h THR 191 N -0.02 1.24 -0.69 3.16 2.02 -1.30 -0.53 112.91 116.79 1dx1 h THR 191 Ca 0.17 -0.84 0.02 0.00 0.77 0.00 0.00 66.41 66.53 1dx1 h THR 191 Cb 0.27 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 1dx1 h THR 191 CO -0.36 0.32 0.44 0.74 0.37 0.00 0.00 175.52 177.03 1dx1 h THR 192 N 0.88 1.12 0.00 3.16 2.02 -0.16 -0.45 112.91 119.47 1dx1 h THR 192 Ca 0.20 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1dx1 h THR 192 Cb 0.29 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 1dx1 h THR 192 CO -0.01 0.16 0.00 0.74 0.37 0.00 0.00 175.52 176.78 1dx1 h THR 193 N 0.87 0.00 -0.71 3.16 2.02 -0.17 -0.02 112.91 118.07 1dx1 h THR 193 Ca 0.27 -0.18 -0.28 0.00 0.77 0.00 0.00 66.41 66.99 1dx1 h THR 193 Cb -0.01 0.91 -0.16 0.00 -1.74 0.00 0.00 68.15 67.14 1dx1 h THR 193 CO -0.09 0.00 0.35 0.29 0.37 0.00 0.00 175.52 176.44 1dx1 n LYS 194 N -2.46 2.87 -0.90 6.66 5.02 -0.24 -4.91 118.16 124.22 1dx1 n LYS 194 Ca 0.00 -2.58 0.00 0.00 -2.02 0.00 0.00 58.31 53.72 1dx1 n LYS 194 Cb 0.17 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.13 1dx1 n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dx1 n GLY 195 N -0.37 0.57 3.90 0.72 0.00 -0.03 -5.02 105.19 104.96 1dx1 n GLY 195 Ca 0.40 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.13 1dx1 n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1dx1 s GLU 196 N -0.10 2.24 0.11 1.61 2.56 -0.83 -4.99 118.70 119.29 1dx1 s GLU 196 Ca 0.00 0.19 0.06 0.00 0.00 0.00 0.00 54.97 55.23 1dx1 s GLU 196 Cb 0.00 -1.98 -0.03 0.00 2.00 0.00 0.00 34.13 34.11 1dx1 s GLU 196 CO 0.00 -1.41 -0.16 1.21 -0.56 0.00 0.00 175.26 174.34 1dx1 s ASN 197 N -4.51 2.09 -0.08 -1.70 2.47 -1.26 -4.35 114.94 107.60 1dx1 s ASN 197 Ca 0.61 -0.73 -0.02 0.00 0.42 0.00 0.00 52.86 53.14 1dx1 s ASN 197 Cb -0.11 -0.09 0.03 0.00 -1.45 0.00 0.00 41.25 39.64 1dx1 s ASN 197 CO 0.50 -0.07 0.02 -0.36 -3.72 0.00 0.00 177.10 173.47 1dx1 s PHE 198 N -1.65 0.53 0.68 0.43 0.40 -1.26 -5.01 117.98 112.09 1dx1 s PHE 198 Ca 0.06 -0.12 -0.11 0.00 -0.60 0.00 0.00 56.93 56.15 1dx1 s PHE 198 Cb -0.08 -0.74 -0.00 0.00 0.51 0.00 0.00 43.02 42.71 1dx1 s PHE 198 CO 0.03 -0.32 1.06 0.95 0.70 0.00 0.00 175.22 177.64 1dx1 s THR 199 N 2.02 4.10 0.43 0.64 -4.23 -1.26 -4.85 115.64 112.49 1dx1 s THR 199 Ca 0.04 0.68 0.10 0.00 -1.18 0.00 0.00 61.69 61.33 1dx1 s THR 199 Cb -0.13 -3.56 0.24 0.00 1.34 0.00 0.00 72.50 70.39 1dx1 s THR 199 CO -0.05 -0.89 2.05 -0.08 -0.54 0.00 0.00 174.62 175.11 1dx1 h GLU 200 N -0.59 0.34 -0.92 3.99 4.81 -2.01 0.19 114.58 120.39 1dx1 h GLU 200 Ca -0.44 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 58.78 1dx1 h GLU 200 Cb 1.22 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.47 1dx1 h GLU 200 CO 0.60 0.28 0.61 1.15 -0.73 0.00 0.00 179.01 180.91 1dx1 h THR 201 N 0.35 1.18 -0.15 0.32 2.02 -1.98 -0.32 112.91 114.32 1dx1 h THR 201 Ca 0.09 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 1dx1 h THR 201 Cb 0.05 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1dx1 h THR 201 CO -0.01 0.22 0.09 0.44 0.37 0.00 0.00 175.52 176.63 1dx1 h ASP 202 N 1.18 0.18 -0.20 4.18 5.19 -0.98 0.34 116.42 126.31 1dx1 h ASP 202 Ca 0.36 -0.05 0.05 0.00 -0.62 0.00 0.00 57.03 56.76 1dx1 h ASP 202 Cb -0.03 -0.05 -0.04 0.00 0.18 0.00 0.00 39.33 39.38 1dx1 h ASP 202 CO -0.10 0.18 -0.08 0.40 -3.12 0.00 0.00 179.24 176.52 1dx1 h ILE 203 N 0.17 0.72 -0.12 0.35 1.08 -0.94 -0.45 117.51 118.32 1dx1 h ILE 203 Ca 0.05 0.00 -0.16 0.00 -0.39 0.00 0.00 64.86 64.37 1dx1 h ILE 203 Cb 0.03 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.50 1dx1 h ILE 203 CO -0.01 0.00 -0.59 0.11 -0.69 0.00 0.00 178.15 176.97 1dx1 h LYS 204 N -0.05 0.40 0.18 2.37 1.57 -0.88 -2.70 116.57 117.47 1dx1 h LYS 204 Ca 0.11 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1dx1 h LYS 204 Cb 0.21 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1dx1 h LYS 204 CO -0.24 0.87 -0.17 0.52 -0.57 0.00 0.00 179.45 179.87 1dx1 h MET 205 N 0.30 -0.36 -0.79 3.15 2.86 0.07 -3.01 114.93 117.15 1dx1 h MET 205 Ca -0.00 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1dx1 h MET 205 Cb 1.11 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.81 1dx1 h MET 205 CO 0.10 -0.24 0.52 0.52 1.06 0.00 0.00 176.91 178.87 1dx1 h MET 206 N -0.38 1.02 0.00 1.72 2.86 -1.01 0.33 114.93 119.47 1dx1 h MET 206 Ca -0.00 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1dx1 h MET 206 Cb 0.35 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1dx1 h MET 206 CO -0.04 0.67 0.00 0.39 1.06 0.00 0.00 176.91 179.00 1dx1 n GLU 207 N -4.55 0.20 0.00 1.72 -0.58 -1.03 -0.95 120.64 115.44 1dx1 n GLU 207 Ca 0.08 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1dx1 n GLU 207 Cb 0.04 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.41 1dx1 n GLU 207 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1dx1 n ARG 208 N -1.02 3.24 -0.05 3.49 5.12 0.01 -4.54 116.66 122.91 1dx1 n ARG 208 Ca 0.05 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.90 1dx1 n ARG 208 Cb 0.02 -0.94 -0.06 0.00 -1.16 0.00 0.00 32.46 30.32 1dx1 n ARG 208 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 1dx1 h VAL 209 N 0.00 0.86 0.00 1.55 3.04 -0.08 -2.86 116.25 118.76 1dx1 h VAL 209 Ca 0.00 -1.60 -0.05 0.00 -1.01 0.00 0.00 66.70 64.03 1dx1 h VAL 209 Cb 0.79 1.62 -0.01 0.00 -2.01 0.00 0.00 31.29 31.68 1dx1 h VAL 209 CO 0.00 0.29 -0.25 0.58 -1.01 0.00 0.00 177.57 177.18 1dx1 h VAL 210 N -0.99 1.03 0.30 1.51 2.07 -1.26 -1.15 116.25 117.75 1dx1 h VAL 210 Ca -0.00 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 1dx1 h VAL 210 Cb 0.49 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1dx1 h VAL 210 CO 0.00 0.25 -0.43 -0.08 0.02 0.00 0.00 177.57 177.33 1dx1 h GLU 211 N 0.00 -0.74 -0.96 1.57 4.81 -1.65 0.13 114.58 117.74 1dx1 h GLU 211 Ca -0.00 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1dx1 h GLU 211 Cb 0.49 0.17 -0.05 0.00 0.63 0.00 0.00 28.75 29.99 1dx1 h GLU 211 CO 0.03 -0.49 0.63 1.96 -0.73 0.00 0.00 179.01 180.42 1dx1 h GLN 212 N -0.77 1.25 -0.38 1.92 1.08 -1.14 0.35 115.11 117.42 1dx1 h GLN 212 Ca -0.04 -0.08 -0.05 0.00 -1.45 0.00 0.00 58.65 57.04 1dx1 h GLN 212 Cb 0.70 -0.28 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 1dx1 h GLN 212 CO -0.12 0.83 0.05 0.52 -0.95 0.00 0.00 178.83 179.15 1dx1 h MET 213 N 1.29 0.65 0.22 1.46 2.86 -1.06 0.04 114.93 120.39 1dx1 h MET 213 Ca 0.36 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1dx1 h MET 213 Cb -0.13 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.46 1dx1 h MET 213 CO -0.08 0.72 -0.11 0.00 1.06 0.00 0.00 176.91 178.50 1dx1 h ILE 215 N -0.29 0.74 -0.32 0.00 2.04 -0.87 -1.45 117.51 117.36 1dx1 h ILE 215 Ca -0.03 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.77 1dx1 h ILE 215 Cb 0.23 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 1dx1 h ILE 215 CO 0.05 0.06 0.02 0.74 0.00 0.00 0.00 178.15 179.02 1dx1 h THR 216 N 0.35 0.78 -0.51 -0.27 2.02 -0.70 0.29 112.91 114.87 1dx1 h THR 216 Ca 0.29 -0.04 -0.07 0.00 0.77 0.00 0.00 66.41 67.37 1dx1 h THR 216 Cb 0.38 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1dx1 h THR 216 CO -0.32 0.02 0.06 1.56 0.37 0.00 0.00 175.52 177.20 1dx1 h GLN 217 N 0.11 0.86 -0.85 6.66 1.08 -1.24 -2.89 115.11 118.84 1dx1 h GLN 217 Ca 0.15 -0.25 0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1dx1 h GLN 217 Cb 0.20 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 1dx1 h GLN 217 CO -0.24 0.86 0.56 -0.92 -0.95 0.00 0.00 178.83 178.14 1dx1 h TYR 218 N 0.73 1.06 0.00 2.96 3.20 -0.45 0.89 116.97 125.36 1dx1 h TYR 218 Ca 0.15 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 1dx1 h TYR 218 Cb 0.44 -0.36 -0.00 0.00 1.54 0.00 0.00 36.73 38.35 1dx1 h TYR 218 CO 0.03 0.66 -0.00 1.96 -1.64 0.00 0.00 178.16 179.17 1dx1 h GLN 219 N 1.14 0.00 0.00 1.82 4.20 -0.27 0.26 115.11 122.26 1dx1 h GLN 219 Ca 0.31 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.99 1dx1 h GLN 219 Cb -0.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1dx1 h GLN 219 CO -0.07 0.00 -0.49 0.00 -0.67 0.00 0.00 178.83 177.60 1dx1 h ARG 220 N 0.00 0.00 -0.41 1.46 3.08 -1.08 -3.39 114.38 114.04 1dx1 h ARG 220 Ca -0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1dx1 h ARG 220 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 1dx1 h ARG 220 CO 0.00 0.22 0.04 0.93 -1.07 0.00 0.00 179.97 180.09 1dx1 h GLU 221 N -1.00 0.63 -0.19 0.04 4.39 -0.46 -1.15 114.58 116.84 1dx1 h GLU 221 Ca -0.06 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 1dx1 h GLU 221 Cb 0.55 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1dx1 h GLU 221 CO -0.03 0.63 0.07 1.03 -1.16 0.00 0.00 179.01 179.54 1dx1 h SER 222 N 0.61 0.23 -0.43 1.42 0.87 -0.71 -0.83 113.55 114.71 1dx1 h SER 222 Ca 0.13 -0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.62 1dx1 h SER 222 Cb 0.33 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 1dx1 h SER 222 CO 0.01 0.22 0.04 1.56 -0.53 0.00 0.00 176.83 178.13 1dx1 h GLN 223 N 0.26 0.73 -0.81 2.24 4.20 -1.40 0.54 115.11 120.88 1dx1 h GLN 223 Ca 0.07 -0.21 0.04 0.00 0.06 0.00 0.00 58.65 58.61 1dx1 h GLN 223 Cb 0.07 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.72 1dx1 h GLN 223 CO -0.01 0.78 0.51 0.00 -0.67 0.00 0.00 178.83 179.44 1dx1 h ALA 224 N 0.92 1.07 -0.24 3.87 0.00 -1.29 0.15 119.26 123.74 1dx1 h ALA 224 Ca 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1dx1 h ALA 224 Cb 0.42 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1dx1 h ALA 224 CO 0.01 0.30 0.07 -0.92 0.00 0.00 0.00 179.25 178.72 1dx1 h TYR 225 N 0.98 0.33 -0.75 0.00 3.20 -0.73 -3.23 116.97 116.77 1dx1 h TYR 225 Ca 0.33 -0.01 -0.45 0.00 3.14 0.00 0.00 58.73 61.74 1dx1 h TYR 225 Cb 0.05 -0.11 -0.42 0.00 1.54 0.00 0.00 36.73 37.80 1dx1 h TYR 225 CO -0.03 0.29 -0.92 0.98 -1.64 0.00 0.00 178.16 176.84 1dx1 n TYR 226 N -4.41 2.29 1.89 -3.82 4.19 0.14 -5.08 117.16 112.36 1dx1 n TYR 226 Ca 0.01 -2.33 0.15 0.00 3.31 0.00 0.00 57.90 59.04 1dx1 n TYR 226 Cb 0.15 -0.28 0.90 0.00 0.49 0.00 0.00 39.34 40.59 1dx1 n TYR 226 CO 0.00 0.00 0.00 1.04 0.91 0.00 0.00 176.86 178.81