#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dwz n LEU 125 N 0.00 4.77 0.00 0.99 4.77 -1.26 -5.05 117.00 121.22 1dwz n LEU 125 Ca 0.00 -5.50 0.00 0.00 -0.03 0.00 0.00 56.01 50.48 1dwz n LEU 125 Cb 0.00 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 1dwz n LEU 125 CO 0.00 2.29 0.00 0.61 -1.33 0.00 0.00 177.39 178.96 1dwz n GLY 126 N -0.32 0.67 2.74 -0.72 0.00 -1.26 -2.67 105.19 103.63 1dwz n GLY 126 Ca 0.35 0.58 -0.06 0.00 0.00 0.00 0.00 46.02 46.89 1dwz n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dwz n GLY 127 N 0.00 -0.23 3.72 -0.02 0.00 -1.26 -5.16 105.19 102.24 1dwz n GLY 127 Ca 0.00 0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.96 1dwz n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dwz s TYR 128 N 0.75 2.04 -0.83 1.61 2.02 -1.09 -4.98 117.35 116.88 1dwz s TYR 128 Ca 0.31 1.63 -0.18 0.00 -0.37 0.00 0.00 57.07 58.46 1dwz s TYR 128 Cb 0.09 -3.39 0.14 0.00 -0.40 0.00 0.00 41.96 38.40 1dwz s TYR 128 CO -0.13 -2.52 0.96 -1.64 -1.57 0.00 0.00 175.55 170.65 1dwz s MET 129 N -4.16 3.48 -0.56 -0.62 -1.94 0.30 -4.94 119.30 110.86 1dwz s MET 129 Ca 0.71 -1.81 -0.28 0.00 -1.71 0.00 0.00 55.69 52.60 1dwz s MET 129 Cb -0.26 -4.65 0.02 0.00 2.01 0.00 0.00 34.83 31.95 1dwz s MET 129 CO 0.48 -1.62 1.29 -1.17 -0.01 0.00 0.00 175.02 174.00 1dwz s LEU 130 N 2.15 3.44 0.61 -0.03 2.96 -1.26 -0.52 118.68 126.03 1dwz s LEU 130 Ca 0.25 0.23 -0.19 0.00 -0.22 0.00 0.00 54.13 54.20 1dwz s LEU 130 Cb -0.10 -3.16 -0.03 0.00 0.50 0.00 0.00 46.19 43.40 1dwz s LEU 130 CO -0.06 -1.56 1.27 -0.83 -1.32 0.00 0.00 176.35 173.85 1dwz s GLY 131 N 3.58 2.82 0.97 7.98 0.00 -0.74 -4.99 107.32 116.94 1dwz s GLY 131 Ca 0.48 1.15 -0.11 0.00 0.00 0.00 0.00 44.72 46.24 1dwz s GLY 131 CO 0.26 1.58 1.09 -0.56 0.00 0.00 0.00 173.10 175.47 1dwz s SER 132 N -1.40 2.66 0.16 1.64 0.01 -1.26 -4.40 113.70 111.11 1dwz s SER 132 Ca 0.79 1.68 -0.33 0.00 1.31 0.00 0.00 55.95 59.39 1dwz s SER 132 Cb -0.35 -2.31 -0.16 0.00 0.21 0.00 0.00 66.02 63.41 1dwz s SER 132 CO 0.38 -3.18 1.23 0.00 0.41 0.00 0.00 173.24 172.08 1dwz n ALA 133 N -4.25 -0.59 -2.01 1.44 0.00 -1.26 -4.81 120.51 109.03 1dwz n ALA 133 Ca 0.07 0.47 -0.18 0.00 0.00 0.00 0.00 53.44 53.80 1dwz n ALA 133 Cb 0.54 -2.07 0.03 0.00 0.00 0.00 0.00 19.45 17.95 1dwz n ALA 133 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1dwz s MET 134 N -0.19 2.65 0.16 0.00 -1.94 0.11 -5.02 119.30 115.07 1dwz s MET 134 Ca 0.75 -1.30 -0.28 0.00 -1.71 0.00 0.00 55.69 53.15 1dwz s MET 134 Cb -0.85 -2.70 -0.07 0.00 2.01 0.00 0.00 34.83 33.22 1dwz s MET 134 CO 0.51 -0.48 0.88 0.45 -0.01 0.00 0.00 175.02 176.37 1dwz s SER 135 N -4.44 7.49 0.01 3.03 0.15 -1.26 -5.00 113.70 113.67 1dwz s SER 135 Ca 0.57 1.77 -0.29 0.00 0.70 0.00 0.00 55.95 58.70 1dwz s SER 135 Cb -0.09 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.63 1dwz s SER 135 CO 0.35 0.09 0.92 -0.13 1.20 0.00 0.00 173.24 175.67 1dwz s ARG 136 N -0.71 4.55 0.88 5.44 0.52 -1.26 -4.96 118.95 123.42 1dwz s ARG 136 Ca 0.41 1.31 -0.12 0.00 -0.52 0.00 0.00 55.73 56.81 1dwz s ARG 136 Cb -0.24 -3.44 0.12 0.00 0.52 0.00 0.00 34.95 31.91 1dwz s ARG 136 CO 0.29 0.02 1.12 -1.25 0.02 0.00 0.00 175.30 175.50 1dwz s PRO 137 N 0.78 1.37 -0.70 3.54 0.04 -1.26 -5.03 135.00 133.74 1dwz s PRO 137 Ca 0.48 0.47 0.01 0.00 0.04 0.00 0.00 61.00 62.00 1dwz s PRO 137 Cb -0.21 -1.85 0.17 0.00 0.04 0.00 0.00 34.50 32.65 1dwz s PRO 137 CO 0.26 -2.08 0.51 -1.17 0.04 0.00 0.00 177.00 174.56 1dwz s LEU 138 N -6.01 5.02 -0.00 -3.56 0.20 -1.26 -5.07 118.68 107.99 1dwz s LEU 138 Ca 0.63 -3.39 -0.23 0.00 0.69 0.00 0.00 54.13 51.82 1dwz s LEU 138 Cb -0.15 -1.77 -0.05 0.00 -0.43 0.00 0.00 46.19 43.79 1dwz s LEU 138 CO 0.54 -0.21 0.70 -0.63 -0.29 0.00 0.00 176.35 176.46 1dwz s ILE 139 N -0.83 4.87 0.67 6.68 1.01 -1.26 -5.08 121.20 127.26 1dwz s ILE 139 Ca 0.22 1.48 -0.07 0.00 0.00 0.00 0.00 60.65 62.28 1dwz s ILE 139 Cb -0.14 -4.05 0.04 0.00 0.01 0.00 0.00 42.46 38.33 1dwz s ILE 139 CO -0.09 0.34 0.99 -1.38 0.00 0.00 0.00 174.94 174.81 1dwz s HIS 140 N 0.17 3.03 0.04 3.97 -3.43 -1.26 -5.00 115.29 112.82 1dwz s HIS 140 Ca 0.36 0.53 0.00 0.00 -0.80 0.00 0.00 55.06 55.16 1dwz s HIS 140 Cb -0.19 -3.06 0.00 0.00 -1.43 0.00 0.00 32.58 27.90 1dwz s HIS 140 CO 0.20 -1.23 0.00 1.19 -2.00 0.00 0.00 174.74 172.90 1dwz n PHE 141 N -2.83 -0.10 0.00 0.38 3.01 -1.26 -5.09 117.46 111.56 1dwz n PHE 141 Ca 0.07 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1dwz n PHE 141 Cb 0.59 0.06 0.00 0.00 -0.01 0.00 0.00 39.48 40.13 1dwz n PHE 141 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dwz n GLY 142 N 3.27 0.27 3.52 1.37 0.00 -1.26 -5.15 105.19 107.20 1dwz n GLY 142 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1dwz n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dwz s SER 143 N 0.00 3.75 0.42 1.61 0.01 -1.26 -5.05 113.70 113.18 1dwz s SER 143 Ca 0.00 -1.05 0.18 0.00 1.31 0.00 0.00 55.95 56.39 1dwz s SER 143 Cb 0.00 -0.37 0.92 0.00 0.21 0.00 0.00 66.02 66.78 1dwz s SER 143 CO 0.00 -0.06 1.89 0.44 0.41 0.00 0.00 173.24 175.92 1dwz h ASP 144 N 2.13 0.00 -0.31 2.44 5.19 -2.01 -3.11 116.42 120.75 1dwz h ASP 144 Ca -0.41 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.00 1dwz h ASP 144 Cb 1.26 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.75 1dwz h ASP 144 CO 0.64 0.29 0.20 0.22 -3.12 0.00 0.00 179.24 177.47 1dwz h TYR 145 N 0.00 0.38 0.00 4.55 3.20 -2.00 -2.23 116.97 120.87 1dwz h TYR 145 Ca -0.00 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.82 1dwz h TYR 145 Cb 0.59 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1dwz h TYR 145 CO 0.00 0.24 -0.26 0.93 -1.64 0.00 0.00 178.16 177.42 1dwz h GLU 146 N 0.41 0.00 -0.23 1.82 5.08 -1.96 -0.61 114.58 119.10 1dwz h GLU 146 Ca 0.12 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 1dwz h GLU 146 Cb -0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1dwz h GLU 146 CO -0.03 0.26 -0.26 0.22 -1.00 0.00 0.00 179.01 178.20 1dwz h ASP 147 N 0.00 0.63 -0.17 1.42 3.58 -1.46 0.24 116.42 120.66 1dwz h ASP 147 Ca -0.00 -0.49 -0.00 0.00 0.42 0.00 0.00 57.03 56.96 1dwz h ASP 147 Cb 0.72 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.59 1dwz h ASP 147 CO 0.03 0.99 0.10 0.03 -2.88 0.00 0.00 179.24 177.52 1dwz h ARG 148 N 0.28 0.23 -0.88 0.28 -0.00 -1.41 0.60 114.38 113.47 1dwz h ARG 148 Ca 0.03 -0.02 0.14 0.00 -0.50 0.00 0.00 59.98 59.63 1dwz h ARG 148 Cb 0.83 -0.05 -0.07 0.00 0.00 0.00 0.00 29.97 30.68 1dwz h ARG 148 CO 0.06 0.20 0.57 -0.92 0.00 0.00 0.00 179.97 179.89 1dwz h TYR 149 N 0.19 0.82 0.00 3.04 5.03 -0.74 -0.68 116.97 124.65 1dwz h TYR 149 Ca 0.06 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.39 1dwz h TYR 149 Cb 0.03 -0.26 0.00 0.00 1.55 0.00 0.00 36.73 38.05 1dwz h TYR 149 CO -0.05 0.32 0.00 0.98 -1.32 0.00 0.00 178.16 178.09 1dwz n TYR 150 N -4.56 0.00 0.05 -3.82 9.36 0.81 -3.36 117.16 115.65 1dwz n TYR 150 Ca 0.17 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.40 1dwz n TYR 150 Cb 0.45 -0.28 0.03 0.00 -0.63 0.00 0.00 39.34 38.91 1dwz n TYR 150 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1dwz n ARG 151 N -1.34 0.00 -0.07 2.98 1.74 0.19 -1.74 116.66 118.43 1dwz n ARG 151 Ca 0.00 0.46 -0.13 0.00 -0.77 0.00 0.00 57.85 57.41 1dwz n ARG 151 Cb 0.00 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 29.90 1dwz n ARG 151 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1dwz n GLU 152 N -1.49 0.36 0.00 5.56 1.02 -0.38 -4.62 120.64 121.10 1dwz n GLU 152 Ca 0.00 0.15 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 1dwz n GLU 152 Cb 0.02 -1.12 0.67 0.00 -0.02 0.00 0.00 31.44 30.99 1dwz n GLU 152 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1dwz n ASN 153 N -3.95 0.00 -0.26 1.62 3.02 -1.07 -4.53 115.26 110.08 1dwz n ASN 153 Ca -0.23 -0.50 0.18 0.00 -0.03 0.00 0.00 54.58 53.99 1dwz n ASN 153 Cb 0.55 -0.10 0.33 0.00 -0.61 0.00 0.00 39.78 39.95 1dwz n ASN 153 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1dwz n MET 154 N -1.10 -0.06 -0.06 3.52 2.81 -0.71 -0.70 117.12 120.82 1dwz n MET 154 Ca 0.16 1.14 0.17 0.00 -1.81 0.00 0.00 57.70 57.36 1dwz n MET 154 Cb 0.12 -1.91 0.60 0.00 -0.71 0.00 0.00 33.22 31.33 1dwz n MET 154 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1dwz h HIS 155 N 0.00 0.21 0.00 2.03 -0.00 -1.90 -1.35 115.15 114.15 1dwz h HIS 155 Ca 0.56 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.93 1dwz h HIS 155 Cb 1.32 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 28.66 1dwz h HIS 155 CO -0.23 0.09 -0.01 0.00 -0.00 0.00 0.00 177.93 177.78 1dwz h ARG 156 N 0.19 0.00 -5.80 5.26 2.47 -1.29 -3.43 114.38 111.77 1dwz h ARG 156 Ca 0.29 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 58.36 1dwz h ARG 156 Cb 0.86 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 29.12 1dwz h ARG 156 CO -0.05 0.01 -0.51 0.71 0.56 0.00 0.00 179.97 180.69 1dwz s TYR 157 N -4.46 3.51 0.34 3.04 2.02 -0.51 -5.05 117.35 116.24 1dwz s TYR 157 Ca -0.05 0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 56.73 1dwz s TYR 157 Cb 0.14 -1.84 -0.11 0.00 -0.40 0.00 0.00 41.96 39.76 1dwz s TYR 157 CO 0.51 0.65 1.39 -1.25 -1.57 0.00 0.00 175.55 175.28 1dwz s PRO 158 N -1.66 4.26 -0.07 -1.71 0.04 -1.26 -4.92 135.00 129.67 1dwz s PRO 158 Ca 0.23 2.36 0.14 0.00 0.04 0.00 0.00 61.00 63.77 1dwz s PRO 158 Cb -0.12 -3.04 0.43 0.00 0.04 0.00 0.00 34.50 31.81 1dwz s PRO 158 CO 0.14 -0.34 1.35 -1.71 0.04 0.00 0.00 177.00 176.48 1dwz n ASN 159 N 0.86 3.45 -3.94 6.66 5.15 -1.26 -4.93 115.26 121.25 1dwz n ASN 159 Ca 0.01 -2.40 -0.10 0.00 -0.60 0.00 0.00 54.58 51.49 1dwz n ASN 159 Cb 0.41 -0.38 -0.11 0.00 -0.53 0.00 0.00 39.78 39.17 1dwz n ASN 159 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1dwz s GLN 160 N -1.72 0.28 0.21 1.20 -0.21 -1.26 -0.71 119.66 117.44 1dwz s GLN 160 Ca 0.33 -0.45 0.11 0.00 0.02 0.00 0.00 55.36 55.37 1dwz s GLN 160 Cb 0.22 0.10 -0.05 0.00 1.00 0.00 0.00 33.01 34.29 1dwz s GLN 160 CO 0.14 -0.05 -0.23 0.14 -2.12 0.00 0.00 175.29 173.17 1dwz s VAL 161 N -1.15 2.39 -0.54 1.09 -7.23 -1.26 -5.00 120.40 108.70 1dwz s VAL 161 Ca -0.13 -2.09 -0.14 0.00 -1.81 0.00 0.00 61.98 57.81 1dwz s VAL 161 Cb -0.08 -2.17 0.13 0.00 0.56 0.00 0.00 36.38 34.83 1dwz s VAL 161 CO -0.00 -0.17 0.48 -0.31 -0.31 0.00 0.00 175.10 174.79 1dwz s TYR 162 N -1.82 3.31 0.51 2.82 1.51 -1.26 -1.80 117.35 120.62 1dwz s TYR 162 Ca 0.22 -1.45 0.03 0.00 -1.01 0.00 0.00 57.07 54.87 1dwz s TYR 162 Cb -0.07 -3.74 -0.00 0.00 -0.11 0.00 0.00 41.96 38.03 1dwz s TYR 162 CO 0.11 -1.01 0.12 1.52 -1.11 0.00 0.00 175.55 175.17 1dwz s TYR 163 N 1.48 1.86 0.14 2.71 1.13 0.33 -4.68 117.35 120.31 1dwz s TYR 163 Ca 0.04 -0.90 0.05 0.00 -1.41 0.00 0.00 57.07 54.86 1dwz s TYR 163 Cb -0.28 -1.71 -0.04 0.00 -1.10 0.00 0.00 41.96 38.82 1dwz s TYR 163 CO 0.02 0.05 -0.12 1.03 -2.51 0.00 0.00 175.55 174.01 1dwz s ARG 164 N -3.98 1.05 0.93 -3.49 0.52 -1.26 -0.54 118.95 112.18 1dwz s ARG 164 Ca 0.16 -1.34 -0.12 0.00 -0.52 0.00 0.00 55.73 53.91 1dwz s ARG 164 Cb 0.01 -0.79 0.08 0.00 0.52 0.00 0.00 34.95 34.77 1dwz s ARG 164 CO 0.09 0.13 0.74 -2.30 0.02 0.00 0.00 175.30 173.98 1dwz n PRO 165 N 0.19 -0.35 -0.18 3.54 -0.02 -1.26 -4.93 135.00 131.99 1dwz n PRO 165 Ca -0.13 -0.05 -0.07 0.00 -2.02 0.00 0.00 63.50 61.23 1dwz n PRO 165 Cb 0.59 -2.09 0.02 0.00 -0.02 0.00 0.00 33.50 32.00 1dwz n PRO 165 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1dwz h VAL 166 N -1.68 1.14 0.00 -1.45 -1.51 -1.88 -3.46 116.25 107.41 1dwz h VAL 166 Ca -0.43 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 1dwz h VAL 166 Cb 1.28 0.37 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 1dwz h VAL 166 CO 0.37 0.13 0.00 -0.67 -1.23 0.00 0.00 177.57 176.18 1dwz n ASP 167 N -4.72 0.00 0.00 4.19 -0.08 -1.26 -1.23 116.55 113.45 1dwz n ASP 167 Ca 0.03 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.31 1dwz n ASP 167 Cb 0.02 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.48 1dwz n ASP 167 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1dwz n GLN 168 N 0.00 -0.00 -4.39 -0.67 -0.00 -1.26 -5.06 117.38 106.00 1dwz n GLN 168 Ca 0.00 -0.70 -0.24 0.00 -0.00 0.00 0.00 57.00 56.07 1dwz n GLN 168 Cb 0.00 -0.96 -0.09 0.00 -0.00 0.00 0.00 30.24 29.20 1dwz n GLN 168 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.06 176.59 1dwz s TYR 169 N -0.23 2.47 0.22 2.61 5.04 -0.37 -5.14 117.35 121.95 1dwz s TYR 169 Ca 0.00 -0.28 -0.01 0.00 -2.44 0.00 0.00 57.07 54.34 1dwz s TYR 169 Cb 0.00 -1.08 0.00 0.00 0.35 0.00 0.00 41.96 41.23 1dwz s TYR 169 CO 0.00 0.68 0.30 -1.13 -1.34 0.00 0.00 175.55 174.06 1dwz n SER 170 N -0.74 -0.84 0.00 4.32 3.41 -1.26 -4.71 113.62 113.80 1dwz n SER 170 Ca -0.06 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.34 1dwz n SER 170 Cb 0.60 1.59 0.00 0.00 -0.26 0.00 0.00 64.21 66.13 1dwz n SER 170 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1dwz n ASN 171 N -1.83 -1.25 -0.02 4.04 5.03 -1.26 -4.77 115.26 115.19 1dwz n ASN 171 Ca 0.01 0.00 -0.13 0.00 0.87 0.00 0.00 54.58 55.33 1dwz n ASN 171 Cb 0.37 0.90 -0.10 0.00 -1.02 0.00 0.00 39.78 39.92 1dwz n ASN 171 CO 0.00 0.00 0.00 -0.61 -1.83 0.00 0.00 177.26 174.82 1dwz h GLN 172 N 0.00 -0.04 -0.32 3.52 -0.00 -2.00 -3.38 115.11 112.90 1dwz h GLN 172 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 58.65 58.68 1dwz h GLN 172 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 27.48 27.46 1dwz h GLN 172 CO 0.00 0.63 0.14 -0.91 0.00 0.00 0.00 178.83 178.68 1dwz h ASN 173 N -0.76 0.18 0.02 -0.69 2.35 -1.99 -0.48 115.58 114.21 1dwz h ASN 173 Ca -0.00 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1dwz h ASN 173 Cb 0.68 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1dwz h ASN 173 CO 0.01 0.14 -0.01 0.78 -1.65 0.00 0.00 177.43 176.70 1dwz h ASN 174 N 0.29 -0.02 -0.60 5.81 2.35 -1.90 -0.55 115.58 120.96 1dwz h ASN 174 Ca 0.14 -0.18 0.08 0.00 -0.55 0.00 0.00 56.30 55.78 1dwz h ASN 174 Cb 0.08 0.01 -0.06 0.00 0.05 0.00 0.00 38.32 38.39 1dwz h ASN 174 CO -0.12 0.17 0.26 0.15 -1.65 0.00 0.00 177.43 176.24 1dwz h PHE 175 N -0.21 0.47 -0.59 1.19 3.04 -1.63 -1.27 116.94 117.94 1dwz h PHE 175 Ca -0.00 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.90 1dwz h PHE 175 Cb 0.20 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.57 1dwz h PHE 175 CO -0.01 0.17 0.09 0.28 -2.02 0.00 0.00 178.31 176.81 1dwz h VAL 176 N 0.48 1.26 -0.58 1.41 2.07 -0.89 0.14 116.25 120.14 1dwz h VAL 176 Ca 0.29 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1dwz h VAL 176 Cb 0.30 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1dwz h VAL 176 CO -0.25 0.37 0.31 -0.74 0.02 0.00 0.00 177.57 177.28 1dwz h HIS 177 N 0.88 0.80 -0.48 1.57 2.76 -0.39 0.17 115.15 120.47 1dwz h HIS 177 Ca 0.18 -0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.21 1dwz h HIS 177 Cb 0.44 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.13 1dwz h HIS 177 CO 0.03 0.58 -0.18 0.22 -1.30 0.00 0.00 177.93 177.28 1dwz h ASP 178 N 0.78 0.95 -0.29 3.26 3.58 -1.09 0.03 116.42 123.64 1dwz h ASP 178 Ca 0.20 -0.34 -0.01 0.00 0.42 0.00 0.00 57.03 57.31 1dwz h ASP 178 Cb 0.05 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.83 1dwz h ASP 178 CO -0.03 1.11 0.16 0.00 -2.88 0.00 0.00 179.24 177.60 1dwz h VAL 180 N 0.35 0.37 -0.31 0.00 2.07 -0.60 0.14 116.25 118.27 1dwz h VAL 180 Ca 0.10 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.69 1dwz h VAL 180 Cb 0.06 0.37 -0.08 0.00 -1.52 0.00 0.00 31.29 30.12 1dwz h VAL 180 CO -0.02 0.00 -0.37 -1.13 0.02 0.00 0.00 177.57 176.08 1dwz h ASN 181 N -0.68 -1.19 -0.11 0.57 -1.24 -0.71 0.14 115.58 112.37 1dwz h ASN 181 Ca -0.03 0.19 -0.02 0.00 0.71 0.00 0.00 56.30 57.15 1dwz h ASN 181 Cb 0.59 0.53 -0.00 0.00 0.73 0.00 0.00 38.32 40.17 1dwz h ASN 181 CO -0.02 -0.36 -0.00 0.40 -1.29 0.00 0.00 177.43 176.16 1dwz h ILE 182 N -0.33 1.26 -0.41 2.57 1.08 -1.08 -1.07 117.51 119.53 1dwz h ILE 182 Ca 0.14 -0.82 -0.03 0.00 -0.39 0.00 0.00 64.86 63.75 1dwz h ILE 182 Cb 0.57 1.59 -0.02 0.00 -3.07 0.00 0.00 36.82 35.89 1dwz h ILE 182 CO -0.49 0.23 0.12 0.74 -0.69 0.00 0.00 178.15 178.07 1dwz h THR 183 N -0.08 1.22 0.24 -0.27 2.02 -0.51 0.32 112.91 115.84 1dwz h THR 183 Ca 0.03 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1dwz h THR 183 Cb 0.36 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1dwz h THR 183 CO 0.01 0.25 -0.27 0.58 0.37 0.00 0.00 175.52 176.46 1dwz h VAL 184 N 0.51 0.00 -0.33 3.16 2.07 -1.03 -2.56 116.25 118.07 1dwz h VAL 184 Ca 0.13 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.68 1dwz h VAL 184 Cb 0.26 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 1dwz h VAL 184 CO -0.00 0.00 0.16 0.50 0.02 0.00 0.00 177.57 178.24 1dwz h LYS 185 N -0.52 0.32 0.00 1.57 3.64 -0.88 0.21 116.57 120.91 1dwz h LYS 185 Ca -0.03 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1dwz h LYS 185 Cb 0.46 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1dwz h LYS 185 CO -0.05 0.21 -0.08 0.93 -2.27 0.00 0.00 179.45 178.19 1dwz h GLU 186 N 0.33 0.00 0.03 1.90 4.39 -1.00 0.08 114.58 120.30 1dwz h GLU 186 Ca 0.14 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 1dwz h GLU 186 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1dwz h GLU 186 CO -0.10 0.08 -0.01 0.45 -1.16 0.00 0.00 179.01 178.26 1dwz h HIS 187 N 0.00 -0.03 -0.96 4.33 3.86 -0.69 -3.20 115.15 118.46 1dwz h HIS 187 Ca -0.00 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.30 1dwz h HIS 187 Cb 0.34 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 28.75 1dwz h HIS 187 CO 0.00 0.65 0.61 1.15 0.86 0.00 0.00 177.93 181.20 1dwz h THR 188 N -0.94 1.00 0.07 2.45 2.02 -0.04 0.19 112.91 117.66 1dwz h THR 188 Ca -0.00 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 1dwz h THR 188 Cb 0.70 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1dwz h THR 188 CO 0.01 0.19 -0.03 0.58 0.37 0.00 0.00 175.52 176.63 1dwz h VAL 189 N 1.04 1.02 -0.38 3.16 2.07 -1.20 -1.99 116.25 119.98 1dwz h VAL 189 Ca 0.44 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.74 1dwz h VAL 189 Cb 0.30 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 1dwz h VAL 189 CO -0.21 0.07 0.04 0.74 0.02 0.00 0.00 177.57 178.23 1dwz h THR 190 N -0.22 0.77 0.21 2.57 2.02 -1.25 -0.68 112.91 116.34 1dwz h THR 190 Ca -0.01 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1dwz h THR 190 Cb 0.18 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1dwz h THR 190 CO 0.01 0.03 -0.10 0.71 0.37 0.00 0.00 175.52 176.54 1dwz h THR 191 N 0.16 0.80 0.00 3.16 1.35 -0.51 -1.70 112.91 116.17 1dwz h THR 191 Ca 0.18 -0.05 -0.03 0.00 -0.55 0.00 0.00 66.41 65.96 1dwz h THR 191 Cb 0.23 0.83 -0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1dwz h THR 191 CO -0.26 0.01 -0.16 0.71 -0.25 0.00 0.00 175.52 175.57 1dwz h THR 192 N -0.31 0.64 -0.00 6.82 1.35 -1.22 0.08 112.91 120.27 1dwz h THR 192 Ca -0.03 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1dwz h THR 192 Cb 0.24 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 1dwz h THR 192 CO 0.05 0.15 -0.11 1.07 -0.25 0.00 0.00 175.52 176.43 1dwz n THR 193 N -3.66 0.00 -1.57 6.82 5.66 -0.28 -4.13 114.28 117.13 1dwz n THR 193 Ca -0.02 -0.04 0.04 0.00 -3.05 0.00 0.00 64.05 60.98 1dwz n THR 193 Cb 0.28 -0.19 0.05 0.00 -1.55 0.00 0.00 70.33 68.92 1dwz n THR 193 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1dwz n LYS 194 N -1.13 0.54 -3.27 1.09 5.02 -0.22 -5.03 118.16 115.15 1dwz n LYS 194 Ca 0.13 -1.55 -0.15 0.00 -2.02 0.00 0.00 58.31 54.72 1dwz n LYS 194 Cb 0.28 -0.87 0.08 0.00 -0.02 0.00 0.00 35.03 34.51 1dwz n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dwz n GLY 195 N -0.52 -0.42 3.12 0.72 0.00 -0.32 -4.98 105.19 102.78 1dwz n GLY 195 Ca 0.06 0.14 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1dwz n GLY 195 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dwz s GLU 196 N -5.06 0.67 0.17 1.61 2.02 -0.15 -5.02 118.70 112.94 1dwz s GLU 196 Ca 0.08 -0.90 -0.01 0.00 0.02 0.00 0.00 54.97 54.16 1dwz s GLU 196 Cb -0.01 -0.48 -0.04 0.00 0.10 0.00 0.00 34.13 33.70 1dwz s GLU 196 CO 0.67 0.09 0.11 0.54 0.02 0.00 0.00 175.26 176.69 1dwz s ASN 197 N -1.82 0.21 -0.02 -0.19 4.22 -1.26 -3.12 114.94 112.96 1dwz s ASN 197 Ca -0.04 -1.31 0.02 0.00 -2.14 0.00 0.00 52.86 49.38 1dwz s ASN 197 Cb -0.08 0.35 0.00 0.00 1.28 0.00 0.00 41.25 42.80 1dwz s ASN 197 CO 0.01 -0.80 -0.07 -0.36 -2.04 0.00 0.00 177.10 173.84 1dwz s PHE 198 N -4.11 0.69 0.82 1.54 0.08 -1.26 -5.10 117.98 110.63 1dwz s PHE 198 Ca 0.33 -0.15 -0.12 0.00 0.12 0.00 0.00 56.93 57.11 1dwz s PHE 198 Cb 0.07 -0.49 0.08 0.00 -0.57 0.00 0.00 43.02 42.11 1dwz s PHE 198 CO 0.08 -0.06 1.16 0.95 -0.10 0.00 0.00 175.22 177.25 1dwz s THR 199 N 0.11 2.21 0.26 0.64 -4.23 -1.26 -4.87 115.64 108.50 1dwz s THR 199 Ca -0.01 0.07 -0.05 0.00 -1.18 0.00 0.00 61.69 60.52 1dwz s THR 199 Cb -0.06 -3.01 0.26 0.00 1.34 0.00 0.00 72.50 71.03 1dwz s THR 199 CO -0.00 -0.09 1.92 -0.08 -0.54 0.00 0.00 174.62 175.83 1dwz h GLU 200 N -1.10 1.26 -0.65 3.99 4.81 -2.02 -0.25 114.58 120.63 1dwz h GLU 200 Ca -0.47 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 58.64 1dwz h GLU 200 Cb 1.32 -0.28 -0.03 0.00 0.63 0.00 0.00 28.75 30.39 1dwz h GLU 200 CO 0.65 0.84 0.22 1.15 -0.73 0.00 0.00 179.01 181.13 1dwz h THR 201 N 1.30 1.24 -0.60 0.32 2.02 -1.97 -1.23 112.91 113.97 1dwz h THR 201 Ca 0.39 -0.79 -0.05 0.00 0.77 0.00 0.00 66.41 66.73 1dwz h THR 201 Cb -0.06 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 66.83 1dwz h THR 201 CO -0.11 0.31 0.18 0.44 0.37 0.00 0.00 175.52 176.71 1dwz h ASP 202 N 0.95 0.85 0.15 4.18 5.19 -1.45 0.34 116.42 126.61 1dwz h ASP 202 Ca 0.21 -0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.47 1dwz h ASP 202 Cb 0.24 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.53 1dwz h ASP 202 CO -0.01 0.81 -0.07 0.40 -3.12 0.00 0.00 179.24 177.24 1dwz h ILE 203 N 0.89 0.87 0.00 0.35 1.08 -0.89 -1.86 117.51 117.95 1dwz h ILE 203 Ca 0.20 -0.06 -0.05 0.00 -0.39 0.00 0.00 64.86 64.56 1dwz h ILE 203 Cb 0.27 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 1dwz h ILE 203 CO -0.01 0.01 -0.23 0.11 -0.69 0.00 0.00 178.15 177.35 1dwz h LYS 204 N -0.23 0.00 0.74 2.37 6.56 -0.78 -2.19 116.57 123.05 1dwz h LYS 204 Ca -0.02 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.53 1dwz h LYS 204 Cb 0.18 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.84 1dwz h LYS 204 CO 0.03 0.23 -0.36 0.52 -2.06 0.00 0.00 179.45 177.81 1dwz h MET 205 N 0.00 -0.96 -0.44 3.15 2.86 -0.22 -3.33 114.93 116.00 1dwz h MET 205 Ca -0.00 0.07 0.09 0.00 -2.06 0.00 0.00 59.70 57.79 1dwz h MET 205 Cb 0.63 0.22 -0.09 0.00 0.06 0.00 0.00 31.60 32.41 1dwz h MET 205 CO 0.03 -0.63 -0.26 0.52 1.06 0.00 0.00 176.91 177.63 1dwz h MET 206 N -1.24 -0.16 -0.70 1.72 2.07 -1.04 -2.31 114.93 113.27 1dwz h MET 206 Ca -0.10 0.01 0.06 0.00 -2.07 0.00 0.00 59.70 57.60 1dwz h MET 206 Cb 0.77 0.04 -0.08 0.00 -1.87 0.00 0.00 31.60 30.46 1dwz h MET 206 CO 0.17 -0.11 -0.42 0.39 1.07 0.00 0.00 176.91 178.01 1dwz n GLU 207 N -5.41 -0.31 0.34 1.72 1.02 -0.85 -0.54 120.64 116.61 1dwz n GLU 207 Ca 0.02 1.10 -0.15 0.00 -0.02 0.00 0.00 57.16 58.11 1dwz n GLU 207 Cb 0.32 -1.62 -0.08 0.00 -0.02 0.00 0.00 31.44 30.04 1dwz n GLU 207 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dwz h ARG 208 N 0.00 -0.86 0.03 3.49 3.08 -1.53 -2.33 114.38 116.26 1dwz h ARG 208 Ca 0.11 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1dwz h ARG 208 Cb 0.29 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1dwz h ARG 208 CO -0.66 -0.54 -0.04 -0.39 -1.07 0.00 0.00 179.97 177.27 1dwz h VAL 209 N -1.13 0.91 -0.58 2.04 -1.51 -1.23 -1.23 116.25 113.51 1dwz h VAL 209 Ca -0.09 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.34 1dwz h VAL 209 Cb 0.72 0.91 -0.03 0.00 -2.13 0.00 0.00 31.29 30.76 1dwz h VAL 209 CO 0.15 0.00 0.20 0.58 -1.23 0.00 0.00 177.57 177.27 1dwz h VAL 210 N -0.08 1.22 -0.01 7.19 2.07 -0.90 0.10 116.25 125.85 1dwz h VAL 210 Ca 0.01 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1dwz h VAL 210 Cb 0.08 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1dwz h VAL 210 CO -0.02 0.29 0.00 1.05 0.02 0.00 0.00 177.57 178.91 1dwz h GLU 211 N 0.85 0.01 -0.15 1.57 4.11 -1.18 -2.69 114.58 117.10 1dwz h GLU 211 Ca 0.20 -0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.62 1dwz h GLU 211 Cb 0.22 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1dwz h GLU 211 CO -0.01 0.12 0.09 1.96 0.07 0.00 0.00 179.01 181.24 1dwz h GLN 212 N -0.10 0.20 -0.85 1.06 1.08 -0.06 0.25 115.11 116.70 1dwz h GLN 212 Ca 0.00 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1dwz h GLN 212 Cb 0.11 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.46 1dwz h GLN 212 CO -0.00 0.17 0.56 0.52 -0.95 0.00 0.00 178.83 179.13 1dwz h MET 213 N 0.17 1.12 -0.31 1.46 2.86 -0.94 -0.29 114.93 119.00 1dwz h MET 213 Ca 0.05 -0.07 -0.18 0.00 -2.06 0.00 0.00 59.70 57.45 1dwz h MET 213 Cb 0.02 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 31.42 1dwz h MET 213 CO -0.01 0.74 -0.51 0.00 1.06 0.00 0.00 176.91 178.19 1dwz h ILE 215 N 0.69 0.82 -0.11 0.00 2.04 -0.33 0.39 117.51 121.02 1dwz h ILE 215 Ca 0.02 -0.20 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1dwz h ILE 215 Cb 1.11 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1dwz h ILE 215 CO 0.12 0.11 -0.02 0.74 0.00 0.00 0.00 178.15 179.09 1dwz h THR 216 N 0.58 0.90 -0.22 -0.27 2.02 -0.75 0.19 112.91 115.36 1dwz h THR 216 Ca 0.36 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.54 1dwz h THR 216 Cb 0.41 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1dwz h THR 216 CO -0.29 0.00 0.14 1.56 0.37 0.00 0.00 175.52 177.30 1dwz h GLN 217 N 0.01 0.28 -0.60 6.66 4.20 -0.86 -2.49 115.11 122.31 1dwz h GLN 217 Ca 0.05 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.76 1dwz h GLN 217 Cb 0.08 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 1dwz h GLN 217 CO -0.11 0.19 0.38 -0.92 -0.67 0.00 0.00 178.83 177.71 1dwz h TYR 218 N 0.29 0.72 0.00 2.96 5.03 -0.64 -1.70 116.97 123.63 1dwz h TYR 218 Ca 0.08 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.41 1dwz h TYR 218 Cb -0.03 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 38.01 1dwz h TYR 218 CO -0.06 0.43 0.00 1.04 -1.32 0.00 0.00 178.16 178.25 1dwz n GLN 219 N -4.70 0.00 -0.06 1.82 6.02 0.65 -0.00 117.38 121.10 1dwz n GLN 219 Ca 0.05 0.32 -0.04 0.00 -0.01 0.00 0.00 57.00 57.33 1dwz n GLN 219 Cb 0.05 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.80 1dwz n GLN 219 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1dwz h ARG 220 N 0.00 0.00 -0.31 -1.09 3.08 -0.94 -3.29 114.38 111.83 1dwz h ARG 220 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1dwz h ARG 220 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1dwz h ARG 220 CO 0.00 0.00 0.13 1.49 -1.07 0.00 0.00 179.97 180.52 1dwz h GLU 221 N -0.84 0.43 -0.11 0.04 4.22 -1.01 -0.40 114.58 116.90 1dwz h GLU 221 Ca 0.00 -0.05 -0.11 0.00 0.08 0.00 0.00 59.36 59.29 1dwz h GLU 221 Cb 0.41 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1dwz h GLU 221 CO 0.00 0.35 -0.35 1.03 -2.18 0.00 0.00 179.01 177.86 1dwz h SER 222 N 0.43 0.50 -0.92 1.04 0.87 -0.67 -2.96 113.55 111.83 1dwz h SER 222 Ca 0.11 -0.61 0.04 0.00 -1.23 0.00 0.00 61.79 60.10 1dwz h SER 222 Cb 0.08 -0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 61.84 1dwz h SER 222 CO -0.01 1.02 0.60 1.56 -0.53 0.00 0.00 176.83 179.46 1dwz h GLN 223 N 0.00 1.10 0.00 2.24 1.08 -1.44 0.12 115.11 118.22 1dwz h GLN 223 Ca -0.01 -0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 1dwz h GLN 223 Cb 0.97 -0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 28.15 1dwz h GLN 223 CO 0.07 0.73 -0.02 0.00 -0.95 0.00 0.00 178.83 178.66 1dwz h ALA 224 N 1.39 1.96 0.13 3.87 0.00 -1.07 -1.51 119.26 124.04 1dwz h ALA 224 Ca 0.38 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1dwz h ALA 224 Cb 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1dwz h ALA 224 CO -0.14 0.02 -0.06 -0.92 0.00 0.00 0.00 179.25 178.16 1dwz h TYR 225 N 0.00 -0.16 0.00 0.00 5.03 -1.09 -3.37 116.97 117.38 1dwz h TYR 225 Ca -0.00 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1dwz h TYR 225 Cb 0.04 0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.37 1dwz h TYR 225 CO 0.00 0.06 0.00 0.66 -1.32 0.00 0.00 178.16 177.56 1dwz n TYR 226 N -4.87 0.00 0.64 -3.82 4.01 0.31 -5.12 117.16 108.31 1dwz n TYR 226 Ca -0.04 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.75 1dwz n TYR 226 Cb 0.15 0.00 0.30 0.00 -0.31 0.00 0.00 39.34 39.48 1dwz n TYR 226 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34