#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e1u n GLY 126 N 0.00 0.08 0.00 -0.72 0.00 -1.26 -4.60 105.19 98.70 1e1u n GLY 126 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1e1u n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1e1u n GLY 127 N -1.01 0.38 3.73 -0.02 0.00 -1.26 -5.15 105.19 101.86 1e1u n GLY 127 Ca -0.08 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1e1u n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1e1u s TYR 128 N 0.00 2.36 0.16 1.61 1.51 -1.26 -4.86 117.35 116.87 1e1u s TYR 128 Ca 0.00 1.37 0.06 0.00 -1.01 0.00 0.00 57.07 57.49 1e1u s TYR 128 Cb 0.00 -3.13 -0.04 0.00 -0.11 0.00 0.00 41.96 38.68 1e1u s TYR 128 CO 0.00 -2.25 -0.13 0.00 -1.11 0.00 0.00 175.55 172.06 1e1u s MET 129 N -4.91 1.15 0.04 -0.62 0.23 0.14 -4.94 119.30 110.39 1e1u s MET 129 Ca 0.63 -1.44 -0.30 0.00 -1.03 0.00 0.00 55.69 53.55 1e1u s MET 129 Cb -0.18 -0.89 -0.04 0.00 -1.53 0.00 0.00 34.83 32.19 1e1u s MET 129 CO 0.57 0.14 1.02 -1.17 -2.03 0.00 0.00 175.02 173.55 1e1u s LEU 130 N -3.02 4.40 0.76 0.18 2.96 -1.26 -0.82 118.68 121.87 1e1u s LEU 130 Ca 0.17 1.77 -0.05 0.00 -0.22 0.00 0.00 54.13 55.79 1e1u s LEU 130 Cb -0.01 -3.58 0.12 0.00 0.50 0.00 0.00 46.19 43.23 1e1u s LEU 130 CO 0.04 -0.25 1.05 -0.83 -1.32 0.00 0.00 176.35 175.03 1e1u s GLY 131 N 0.77 1.76 0.53 7.98 0.00 -0.49 -4.96 107.32 112.91 1e1u s GLY 131 Ca 0.52 -1.46 -0.21 0.00 0.00 0.00 0.00 44.72 43.57 1e1u s GLY 131 CO 0.29 -0.90 1.14 -1.14 0.00 0.00 0.00 173.10 172.49 1e1u n SER 132 N -3.01 1.71 -4.70 1.64 3.41 -1.26 -4.59 113.62 106.82 1e1u n SER 132 Ca 0.13 0.94 -0.30 0.00 -0.26 0.00 0.00 58.87 59.38 1e1u n SER 132 Cb 0.60 -1.46 0.14 0.00 -0.26 0.00 0.00 64.21 63.24 1e1u n SER 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1e1u s ALA 133 N -1.36 1.52 0.18 7.33 0.00 -1.26 -4.67 121.76 123.50 1e1u s ALA 133 Ca 0.70 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.80 1e1u s ALA 133 Cb -0.45 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 1e1u s ALA 133 CO 0.51 -2.44 0.17 0.00 0.00 0.00 0.00 175.76 174.00 1e1u s MET 134 N -4.81 1.17 0.07 0.00 0.23 -0.86 -5.00 119.30 110.10 1e1u s MET 134 Ca 0.64 -1.48 -0.31 0.00 -1.03 0.00 0.00 55.69 53.51 1e1u s MET 134 Cb -0.20 0.30 -0.07 0.00 -1.53 0.00 0.00 34.83 33.33 1e1u s MET 134 CO 0.58 -0.39 1.43 -1.12 -2.03 0.00 0.00 175.02 173.48 1e1u s SER 135 N -3.09 6.80 -0.34 -1.18 0.01 -1.26 -4.84 113.70 109.79 1e1u s SER 135 Ca 0.31 2.29 -0.30 0.00 1.31 0.00 0.00 55.95 59.55 1e1u s SER 135 Cb 0.06 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.63 1e1u s SER 135 CO 0.08 -0.71 2.28 -2.11 0.41 0.00 0.00 173.24 173.19 1e1u n ARG 136 N 4.59 1.43 -1.80 12.44 0.00 -1.26 -4.93 116.66 127.14 1e1u n ARG 136 Ca 0.13 0.33 -0.30 0.00 -0.00 0.00 0.00 57.85 58.00 1e1u n ARG 136 Cb 0.42 -2.99 0.05 0.00 -0.00 0.00 0.00 32.46 29.95 1e1u n ARG 136 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1e1u s PRO 137 N 6.84 2.76 -0.66 2.89 0.04 -1.26 -5.02 135.00 140.59 1e1u s PRO 137 Ca 1.04 0.54 0.02 0.00 0.04 0.00 0.00 61.00 62.65 1e1u s PRO 137 Cb -0.49 -2.00 0.16 0.00 0.04 0.00 0.00 34.50 32.21 1e1u s PRO 137 CO 0.38 -1.12 0.45 0.42 0.04 0.00 0.00 177.00 177.17 1e1u s ILE 138 N -3.29 3.16 0.45 0.56 1.09 -1.26 -5.03 121.20 116.88 1e1u s ILE 138 Ca 0.58 -3.68 -0.21 0.00 -1.10 0.00 0.00 60.65 56.24 1e1u s ILE 138 Cb -0.12 -3.08 -0.09 0.00 -1.06 0.00 0.00 42.46 38.11 1e1u s ILE 138 CO 0.53 -0.93 1.01 -0.63 -0.10 0.00 0.00 174.94 174.82 1e1u s ILE 139 N -0.82 3.95 -0.43 2.92 1.01 -1.26 -5.05 121.20 121.52 1e1u s ILE 139 Ca 0.21 1.27 -0.20 0.00 0.00 0.00 0.00 60.65 61.93 1e1u s ILE 139 Cb -0.15 -3.54 0.02 0.00 0.01 0.00 0.00 42.46 38.80 1e1u s ILE 139 CO -0.08 -0.21 0.59 -1.00 0.00 0.00 0.00 174.94 174.23 1e1u s HIS 140 N -1.98 3.10 0.36 3.97 3.76 -1.26 -4.90 115.29 118.35 1e1u s HIS 140 Ca 0.64 -0.12 0.06 0.00 -0.15 0.00 0.00 55.06 55.49 1e1u s HIS 140 Cb -0.15 -3.22 0.70 0.00 1.11 0.00 0.00 32.58 31.02 1e1u s HIS 140 CO 0.19 -0.81 1.91 0.74 -0.85 0.00 0.00 174.74 175.92 1e1u h PHE 141 N 8.82 0.44 0.00 1.40 0.04 -1.97 -3.47 116.94 122.19 1e1u h PHE 141 Ca -0.26 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.48 1e1u h PHE 141 Cb 1.10 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 39.12 1e1u h PHE 141 CO 0.70 0.45 0.00 0.41 -0.60 0.00 0.00 178.31 179.27 1e1u n GLY 142 N -0.96 1.94 3.00 -1.45 0.00 -1.26 -5.14 105.19 101.32 1e1u n GLY 142 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 1e1u n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1e1u s SER 143 N -2.00 0.63 0.32 1.61 0.01 -1.26 -5.06 113.70 107.95 1e1u s SER 143 Ca 0.00 -0.33 0.01 0.00 1.31 0.00 0.00 55.95 56.94 1e1u s SER 143 Cb 0.00 0.00 0.53 0.00 0.21 0.00 0.00 66.02 66.76 1e1u s SER 143 CO 0.00 -0.10 1.93 0.44 0.41 0.00 0.00 173.24 175.92 1e1u h ASP 144 N 5.22 0.75 1.19 2.44 5.19 -2.01 -1.22 116.42 127.98 1e1u h ASP 144 Ca -0.31 -0.07 -0.15 0.00 -0.62 0.00 0.00 57.03 55.87 1e1u h ASP 144 Cb 1.20 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 40.50 1e1u h ASP 144 CO 0.45 0.63 -0.83 0.10 -3.12 0.00 0.00 179.24 176.47 1e1u h TYR 145 N 0.84 0.00 0.00 4.55 -0.00 -2.00 -3.30 116.97 117.06 1e1u h TYR 145 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.94 1e1u h TYR 145 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.80 1e1u h TYR 145 CO 0.01 0.68 0.00 0.39 -0.00 0.00 0.00 178.16 179.23 1e1u n GLU 146 N -3.20 0.34 0.10 0.10 1.02 -0.49 -0.18 120.64 118.33 1e1u n GLU 146 Ca -0.01 0.01 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 1e1u n GLU 146 Cb 0.82 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.72 1e1u n GLU 146 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1e1u h ASP 147 N 0.00 -0.23 -0.63 1.62 1.82 -1.55 -3.35 116.42 114.10 1e1u h ASP 147 Ca 0.00 0.01 -0.07 0.00 -0.39 0.00 0.00 57.03 56.58 1e1u h ASP 147 Cb 0.32 0.06 -0.02 0.00 0.68 0.00 0.00 39.33 40.36 1e1u h ASP 147 CO 0.00 -0.13 0.11 0.03 -1.61 0.00 0.00 179.24 177.64 1e1u h ARG 148 N -0.33 1.03 -0.27 0.28 -0.00 -1.50 -0.08 114.38 113.51 1e1u h ARG 148 Ca -0.03 -0.27 0.04 0.00 -0.50 0.00 0.00 59.98 59.22 1e1u h ARG 148 Cb 0.20 -0.12 -0.04 0.00 0.00 0.00 0.00 29.97 30.01 1e1u h ARG 148 CO 0.04 0.95 0.03 -0.92 0.00 0.00 0.00 179.97 180.08 1e1u h TYR 149 N 0.94 0.05 0.68 3.04 5.03 -0.77 0.20 116.97 126.14 1e1u h TYR 149 Ca 0.19 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.49 1e1u h TYR 149 Cb 0.41 0.02 0.01 0.00 1.55 0.00 0.00 36.73 38.72 1e1u h TYR 149 CO 0.03 -0.00 -0.33 -0.92 -1.32 0.00 0.00 178.16 175.62 1e1u h TYR 150 N 0.13 -0.85 -0.98 -3.82 3.20 -1.67 -3.21 116.97 109.76 1e1u h TYR 150 Ca 0.13 -0.02 0.23 0.00 3.14 0.00 0.00 58.73 62.20 1e1u h TYR 150 Cb 0.14 0.28 -0.12 0.00 1.54 0.00 0.00 36.73 38.57 1e1u h TYR 150 CO -0.18 -0.52 0.56 0.00 -1.64 0.00 0.00 178.16 176.38 1e1u h ARG 151 N -1.22 0.57 0.01 1.82 2.47 -0.28 0.42 114.38 118.17 1e1u h ARG 151 Ca -0.09 -0.03 -0.25 0.00 -1.26 0.00 0.00 59.98 58.34 1e1u h ARG 151 Cb 0.71 -0.13 0.01 0.00 -1.65 0.00 0.00 29.97 28.92 1e1u h ARG 151 CO 0.15 0.38 -1.01 0.93 0.56 0.00 0.00 179.97 180.98 1e1u h GLU 152 N 0.59 0.54 -0.01 0.04 5.08 -0.78 -3.28 114.58 116.76 1e1u h GLU 152 Ca 0.61 -0.60 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1e1u h GLU 152 Cb 1.12 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1e1u h GLU 152 CO -0.46 1.22 -0.17 0.09 -1.00 0.00 0.00 179.01 178.68 1e1u n ASN 153 N -3.79 0.81 0.04 1.42 3.02 -0.19 -4.73 115.26 111.84 1e1u n ASN 153 Ca -0.09 -0.80 0.19 0.00 -0.03 0.00 0.00 54.58 53.85 1e1u n ASN 153 Cb 0.87 0.03 0.69 0.00 -0.61 0.00 0.00 39.78 40.77 1e1u n ASN 153 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1e1u h MET 154 N 1.00 0.00 0.00 3.52 -0.00 -0.31 0.92 114.93 120.06 1e1u h MET 154 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.65 1e1u h MET 154 Cb 0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.03 1e1u h MET 154 CO 0.00 0.00 -0.22 1.25 -0.00 0.00 0.00 176.91 177.94 1e1u h HIS 155 N 0.00 0.00 0.00 -0.10 -0.00 -1.86 -3.20 115.15 109.99 1e1u h HIS 155 Ca 0.22 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.55 1e1u h HIS 155 Cb 0.89 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.30 1e1u h HIS 155 CO 0.00 0.22 -0.19 0.07 -0.00 0.00 0.00 177.93 178.03 1e1u h ARG 156 N 0.00 0.00 -7.45 5.26 -0.00 -1.19 -3.43 114.38 107.57 1e1u h ARG 156 Ca -0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 59.98 59.49 1e1u h ARG 156 Cb 0.76 0.00 0.11 0.00 -0.00 0.00 0.00 29.97 30.83 1e1u h ARG 156 CO 0.03 0.19 0.36 0.71 -0.00 0.00 0.00 179.97 181.25 1e1u s TYR 157 N -3.30 2.92 0.80 4.08 2.02 -1.21 -5.03 117.35 117.61 1e1u s TYR 157 Ca 0.04 1.06 -0.14 0.00 -0.37 0.00 0.00 57.07 57.66 1e1u s TYR 157 Cb 0.07 -3.17 0.06 0.00 -0.40 0.00 0.00 41.96 38.52 1e1u s TYR 157 CO 0.67 -1.70 1.09 -0.35 -1.57 0.00 0.00 175.55 173.68 1e1u n PRO 158 N -3.36 0.23 0.00 -1.71 -0.04 -1.26 -4.95 135.00 123.91 1e1u n PRO 158 Ca 0.07 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 1e1u n PRO 158 Cb 0.57 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 1e1u n PRO 158 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1e1u n ASN 159 N -2.73 0.30 -4.17 3.54 6.94 -1.26 -4.98 115.26 112.89 1e1u n ASN 159 Ca 0.13 -0.63 -0.12 0.00 -0.02 0.00 0.00 54.58 53.94 1e1u n ASN 159 Cb 0.50 0.51 -0.10 0.00 -2.36 0.00 0.00 39.78 38.33 1e1u n ASN 159 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1e1u s GLN 160 N -0.51 0.83 0.09 -3.83 -0.21 -1.26 -2.03 119.66 112.74 1e1u s GLN 160 Ca 0.00 -1.24 0.09 0.00 0.02 0.00 0.00 55.36 54.23 1e1u s GLN 160 Cb 0.00 -0.36 -0.03 0.00 1.00 0.00 0.00 33.01 33.62 1e1u s GLN 160 CO 0.00 0.03 -0.23 0.14 -2.12 0.00 0.00 175.29 173.11 1e1u s VAL 161 N -3.00 1.85 0.62 1.09 -7.23 -1.26 -5.01 120.40 107.46 1e1u s VAL 161 Ca 0.08 -1.50 -0.10 0.00 -1.81 0.00 0.00 61.98 58.66 1e1u s VAL 161 Cb 0.01 -1.65 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 1e1u s VAL 161 CO -0.02 0.06 1.00 -0.31 -0.31 0.00 0.00 175.10 175.53 1e1u s TYR 162 N -1.03 3.49 0.20 2.82 2.02 -1.26 -1.39 117.35 122.20 1e1u s TYR 162 Ca 0.09 1.09 -0.23 0.00 -0.37 0.00 0.00 57.07 57.65 1e1u s TYR 162 Cb -0.10 -2.77 0.06 0.00 -0.40 0.00 0.00 41.96 38.76 1e1u s TYR 162 CO 0.04 -0.79 0.94 1.52 -1.57 0.00 0.00 175.55 175.69 1e1u s TYR 163 N -3.16 -0.06 -0.06 2.71 1.13 -0.01 -4.73 117.35 113.18 1e1u s TYR 163 Ca 0.55 -0.32 -0.19 0.00 -1.41 0.00 0.00 57.07 55.69 1e1u s TYR 163 Cb -0.11 0.68 -0.05 0.00 -1.10 0.00 0.00 41.96 41.39 1e1u s TYR 163 CO 0.51 -0.96 0.53 1.03 -2.51 0.00 0.00 175.55 174.15 1e1u s ARG 164 N -2.96 4.30 -0.28 -3.49 0.52 -1.26 -0.68 118.95 115.09 1e1u s ARG 164 Ca 0.15 0.58 -0.29 0.00 -0.52 0.00 0.00 55.73 55.66 1e1u s ARG 164 Cb -0.02 -3.38 -0.03 0.00 0.52 0.00 0.00 34.95 32.04 1e1u s ARG 164 CO 0.04 0.28 1.82 -1.25 0.02 0.00 0.00 175.30 176.21 1e1u s PRO 165 N 0.17 3.43 -0.15 3.54 0.04 -1.26 -4.26 135.00 136.51 1e1u s PRO 165 Ca 0.28 1.59 -0.04 0.00 0.04 0.00 0.00 61.00 62.87 1e1u s PRO 165 Cb -0.17 -4.18 0.01 0.00 0.04 0.00 0.00 34.50 30.20 1e1u s PRO 165 CO 0.14 -1.74 0.14 -1.33 0.04 0.00 0.00 177.00 174.25 1e1u n MET 166 N 8.29 -0.39 0.00 4.56 2.81 -1.26 -4.92 117.12 126.21 1e1u n MET 166 Ca 0.23 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.36 1e1u n MET 166 Cb 0.46 -0.48 0.00 0.00 -0.71 0.00 0.00 33.22 32.49 1e1u n MET 166 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1e1u n ASP 167 N 0.21 0.00 0.25 7.83 2.03 -1.26 -4.99 116.55 120.61 1e1u n ASP 167 Ca -0.05 0.46 0.00 0.00 0.52 0.00 0.00 54.79 55.72 1e1u n ASP 167 Cb 0.16 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 1e1u n ASP 167 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1e1u n GLU 168 N -0.51 0.00 0.16 -0.67 0.00 -1.26 -5.01 120.64 113.35 1e1u n GLU 168 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.19 1e1u n GLU 168 Cb 0.00 0.00 0.19 0.00 0.00 0.00 0.00 31.44 31.63 1e1u n GLU 168 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.13 177.23 1e1u h TYR 169 N 0.00 0.00 0.00 4.31 -0.00 -2.03 -3.47 116.97 115.78 1e1u h TYR 169 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1e1u h TYR 169 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1e1u h TYR 169 CO 0.00 0.50 0.00 0.43 -0.00 0.00 0.00 178.16 179.09 1e1u n SER 170 N -3.47 -0.30 -4.68 0.10 7.64 -1.26 -4.92 113.62 106.73 1e1u n SER 170 Ca 0.00 0.00 -0.45 0.00 1.01 0.00 0.00 58.87 59.43 1e1u n SER 170 Cb 0.62 -1.45 -0.04 0.00 -1.01 0.00 0.00 64.21 62.33 1e1u n SER 170 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1e1u n ASN 171 N 0.07 3.16 0.18 6.43 2.85 -1.26 -4.79 115.26 121.90 1e1u n ASN 171 Ca 0.00 1.09 0.17 0.00 -0.11 0.00 0.00 54.58 55.73 1e1u n ASN 171 Cb 0.02 -1.45 0.79 0.00 1.24 0.00 0.00 39.78 40.39 1e1u n ASN 171 CO 0.00 0.00 0.00 0.06 -2.11 0.00 0.00 177.26 175.21 1e1u h GLN 172 N 5.70 0.00 0.00 1.20 -0.00 -2.00 0.69 115.11 120.71 1e1u h GLN 172 Ca -0.45 0.00 -0.31 0.00 -0.00 0.00 0.00 58.65 57.89 1e1u h GLN 172 Cb 1.25 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 28.67 1e1u h GLN 172 CO 0.87 0.00 -2.16 0.09 -0.00 0.00 0.00 178.83 177.63 1e1u n ASN 173 N -3.96 1.89 -0.05 0.06 4.13 -1.26 -4.27 115.26 111.80 1e1u n ASN 173 Ca 0.02 -0.07 -0.15 0.00 1.68 0.00 0.00 54.58 56.06 1e1u n ASN 173 Cb 0.34 0.10 -0.07 0.00 -1.54 0.00 0.00 39.78 38.60 1e1u n ASN 173 CO 0.00 0.00 0.00 -1.13 0.28 0.00 0.00 177.26 176.41 1e1u h ASN 174 N 0.00 0.60 -0.26 6.41 -1.24 -1.76 0.53 115.58 119.86 1e1u h ASN 174 Ca -0.46 -0.59 0.05 0.00 0.71 0.00 0.00 56.30 56.02 1e1u h ASN 174 Cb 1.82 -0.18 -0.05 0.00 0.73 0.00 0.00 38.32 40.65 1e1u h ASN 174 CO -0.04 1.08 -0.03 0.15 -1.29 0.00 0.00 177.43 177.30 1e1u h PHE 175 N 0.16 -0.07 0.48 0.67 3.57 -1.16 -0.77 116.94 119.83 1e1u h PHE 175 Ca -0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1e1u h PHE 175 Cb 1.01 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.80 1e1u h PHE 175 CO 0.10 -0.07 -0.49 0.28 -2.23 0.00 0.00 178.31 175.90 1e1u h VAL 176 N 0.04 0.00 0.00 1.41 2.07 -1.73 -1.15 116.25 116.90 1e1u h VAL 176 Ca 0.13 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 1e1u h VAL 176 Cb 0.18 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1e1u h VAL 176 CO -0.24 0.00 -0.07 0.45 0.02 0.00 0.00 177.57 177.74 1e1u h HIS 177 N -0.97 0.00 0.36 1.57 3.86 -0.41 0.26 115.15 119.82 1e1u h HIS 177 Ca -0.06 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 1e1u h HIS 177 Cb 0.84 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.31 1e1u h HIS 177 CO -0.25 0.07 -0.17 0.22 0.86 0.00 0.00 177.93 178.65 1e1u h ASP 178 N 0.00 -0.41 -0.17 2.45 1.82 -1.06 -2.47 116.42 116.57 1e1u h ASP 178 Ca -0.00 -0.10 -0.06 0.00 -0.39 0.00 0.00 57.03 56.48 1e1u h ASP 178 Cb 0.12 0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.22 1e1u h ASP 178 CO 0.01 0.04 -0.05 0.00 -1.61 0.00 0.00 179.24 177.63 1e1u h VAL 180 N 0.46 0.00 -0.93 0.00 2.07 -0.64 -0.96 116.25 116.24 1e1u h VAL 180 Ca 0.09 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.65 1e1u h VAL 180 Cb 0.38 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 1e1u h VAL 180 CO 0.02 0.00 0.61 -1.13 0.02 0.00 0.00 177.57 177.09 1e1u h ASN 181 N -0.66 1.01 -0.34 0.57 -1.24 -0.82 0.21 115.58 114.31 1e1u h ASN 181 Ca -0.05 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.95 1e1u h ASN 181 Cb 0.55 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 39.35 1e1u h ASN 181 CO 0.02 0.69 0.22 0.40 -1.29 0.00 0.00 177.43 177.47 1e1u h ILE 182 N 1.17 1.09 -0.23 2.57 1.08 -1.22 -1.65 117.51 120.31 1e1u h ILE 182 Ca 0.37 -0.16 -0.12 0.00 -0.39 0.00 0.00 64.86 64.56 1e1u h ILE 182 Cb 0.03 0.59 -0.00 0.00 -3.07 0.00 0.00 36.82 34.37 1e1u h ILE 182 CO -0.12 0.09 -0.34 0.74 -0.69 0.00 0.00 178.15 177.83 1e1u h THR 183 N 0.46 1.32 -0.07 -0.27 2.02 0.74 0.15 112.91 117.26 1e1u h THR 183 Ca 0.12 -1.54 0.03 0.00 0.77 0.00 0.00 66.41 65.79 1e1u h THR 183 Cb -0.05 1.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 1e1u h THR 183 CO -0.03 0.48 -0.14 0.40 0.37 0.00 0.00 175.52 176.60 1e1u h ILE 184 N 0.33 0.63 -0.64 3.11 1.08 -0.91 -0.98 117.51 120.12 1e1u h ILE 184 Ca 0.02 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1e1u h ILE 184 Cb 0.92 0.63 -0.03 0.00 -3.07 0.00 0.00 36.82 35.28 1e1u h ILE 184 CO 0.08 0.00 0.39 0.50 -0.69 0.00 0.00 178.15 178.43 1e1u h LYS 185 N -0.20 0.87 -0.02 2.37 3.64 -1.08 -2.10 116.57 120.05 1e1u h LYS 185 Ca 0.07 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1e1u h LYS 185 Cb 0.30 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1e1u h LYS 185 CO -0.19 0.62 -0.42 1.96 -2.27 0.00 0.00 179.45 179.14 1e1u h GLN 186 N 0.87 0.03 0.23 1.90 7.50 -0.24 0.34 115.11 125.75 1e1u h GLN 186 Ca 0.23 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.36 1e1u h GLN 186 Cb -0.04 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.50 1e1u h GLN 186 CO -0.04 0.45 -0.11 1.25 -1.50 0.00 0.00 178.83 178.88 1e1u h HIS 187 N 0.03 -0.28 -1.06 2.96 2.76 -1.00 -1.81 115.15 116.75 1e1u h HIS 187 Ca -0.00 -0.01 0.31 0.00 -2.20 0.00 0.00 60.37 58.47 1e1u h HIS 187 Cb 0.76 0.09 -0.12 0.00 1.55 0.00 0.00 27.41 29.69 1e1u h HIS 187 CO 0.00 0.02 0.65 1.15 -1.30 0.00 0.00 177.93 178.45 1e1u h THR 188 N -0.58 0.39 -0.12 6.26 2.02 -0.64 0.16 112.91 120.41 1e1u h THR 188 Ca -0.03 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 1e1u h THR 188 Cb 0.42 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1e1u h THR 188 CO 0.05 0.07 -0.15 0.58 0.37 0.00 0.00 175.52 176.43 1e1u h VAL 189 N 0.37 1.36 0.00 3.16 2.07 -0.27 -2.28 116.25 120.67 1e1u h VAL 189 Ca 0.69 -1.35 -0.12 0.00 0.82 0.00 0.00 66.70 66.73 1e1u h VAL 189 Cb 1.66 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 33.38 1e1u h VAL 189 CO -0.46 0.39 -0.59 0.74 0.02 0.00 0.00 177.57 177.67 1e1u h THR 190 N -0.08 1.31 -0.08 2.57 2.02 -0.11 -1.16 112.91 117.38 1e1u h THR 190 Ca 0.02 -2.11 -0.22 0.00 0.77 0.00 0.00 66.41 64.86 1e1u h THR 190 Cb 0.70 2.18 0.01 0.00 -1.74 0.00 0.00 68.15 69.30 1e1u h THR 190 CO 0.04 0.58 -0.80 0.71 0.37 0.00 0.00 175.52 176.42 1e1u h THR 191 N 0.00 1.31 -0.23 3.16 1.35 -0.84 -1.72 112.91 115.94 1e1u h THR 191 Ca -0.01 -2.05 -0.05 0.00 -0.55 0.00 0.00 66.41 63.75 1e1u h THR 191 Cb 1.13 2.22 -0.01 0.00 -1.73 0.00 0.00 68.15 69.76 1e1u h THR 191 CO 0.08 0.63 -0.08 0.00 -0.25 0.00 0.00 175.52 175.90 1e1u h THR 192 N 0.35 1.19 -0.10 6.82 1.03 -1.22 0.72 112.91 121.70 1e1u h THR 192 Ca -0.08 -0.80 -0.02 0.00 -0.01 0.00 0.00 66.41 65.50 1e1u h THR 192 Cb 1.45 1.11 -0.01 0.00 -1.07 0.00 0.00 68.15 69.63 1e1u h THR 192 CO 0.16 0.26 -0.04 0.74 -0.01 0.00 0.00 175.52 176.63 1e1u h THR 193 N 0.34 1.09 -0.01 0.00 2.02 -1.09 -1.09 112.91 114.17 1e1u h THR 193 Ca 0.07 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1e1u h THR 193 Cb 0.36 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1e1u h THR 193 CO 0.02 0.12 -0.06 0.29 0.37 0.00 0.00 175.52 176.26 1e1u n LYS 194 N -4.41 1.37 -2.10 6.66 5.02 -0.11 -4.98 118.16 119.61 1e1u n LYS 194 Ca -0.01 -0.73 -0.04 0.00 -2.02 0.00 0.00 58.31 55.51 1e1u n LYS 194 Cb 0.17 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 33.71 1e1u n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1e1u n GLY 195 N 1.20 0.01 3.26 0.72 0.00 0.06 -5.05 105.19 105.38 1e1u n GLY 195 Ca 0.18 0.03 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1e1u n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1e1u s GLU 196 N -3.39 0.88 -0.10 1.61 2.12 -0.13 -4.96 118.70 114.74 1e1u s GLU 196 Ca 0.13 -0.63 0.04 0.00 0.36 0.00 0.00 54.97 54.86 1e1u s GLU 196 Cb -0.02 0.38 0.00 0.00 0.26 0.00 0.00 34.13 34.75 1e1u s GLU 196 CO 0.26 -0.30 -0.22 1.21 -0.54 0.00 0.00 175.26 175.67 1e1u s ASN 197 N -2.39 2.91 0.62 -1.70 2.47 -1.26 -2.76 114.94 112.83 1e1u s ASN 197 Ca -0.01 -0.53 -0.15 0.00 0.42 0.00 0.00 52.86 52.59 1e1u s ASN 197 Cb 0.01 -1.33 -0.02 0.00 -1.45 0.00 0.00 41.25 38.45 1e1u s ASN 197 CO -0.07 0.13 1.08 -0.36 -3.72 0.00 0.00 177.10 174.16 1e1u s PHE 198 N 0.44 2.87 0.68 0.43 0.08 -1.26 -5.06 117.98 116.16 1e1u s PHE 198 Ca -0.17 1.52 -0.13 0.00 0.12 0.00 0.00 56.93 58.27 1e1u s PHE 198 Cb -0.17 -3.06 0.01 0.00 -0.57 0.00 0.00 43.02 39.22 1e1u s PHE 198 CO 0.07 -1.31 1.09 0.95 -0.10 0.00 0.00 175.22 175.92 1e1u s THR 199 N -2.43 3.52 0.48 0.64 -4.23 -1.26 -4.92 115.64 107.44 1e1u s THR 199 Ca 0.65 0.62 0.16 0.00 -1.18 0.00 0.00 61.69 61.93 1e1u s THR 199 Cb -0.17 -3.16 0.31 0.00 1.34 0.00 0.00 72.50 70.81 1e1u s THR 199 CO 0.39 -0.52 2.06 1.05 -0.54 0.00 0.00 174.62 177.05 1e1u h GLU 200 N -0.29 0.19 0.15 3.99 4.11 -1.99 -1.92 114.58 118.82 1e1u h GLU 200 Ca -0.45 -0.01 -0.29 0.00 0.07 0.00 0.00 59.36 58.67 1e1u h GLU 200 Cb 1.23 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 30.46 1e1u h GLU 200 CO 0.55 0.13 -1.28 1.15 0.07 0.00 0.00 179.01 179.63 1e1u h THR 201 N 0.20 1.37 -0.70 -1.06 2.02 -1.98 -1.18 112.91 111.59 1e1u h THR 201 Ca 0.15 -2.74 -0.01 0.00 0.77 0.00 0.00 66.41 64.58 1e1u h THR 201 Cb 0.35 2.85 -0.03 0.00 -1.74 0.00 0.00 68.15 69.58 1e1u h THR 201 CO -0.03 0.82 0.39 0.44 0.37 0.00 0.00 175.52 177.51 1e1u h ASP 202 N 0.16 0.86 -0.03 4.18 5.19 -1.85 0.51 116.42 125.45 1e1u h ASP 202 Ca -0.18 -0.09 0.03 0.00 -0.62 0.00 0.00 57.03 56.18 1e1u h ASP 202 Cb 1.97 -0.22 -0.04 0.00 0.18 0.00 0.00 39.33 41.21 1e1u h ASP 202 CO 0.23 0.70 -0.23 0.58 -3.12 0.00 0.00 179.24 177.40 1e1u h VAL 203 N 0.96 0.47 -0.45 -1.35 2.07 -1.34 0.25 116.25 116.86 1e1u h VAL 203 Ca 0.25 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.71 1e1u h VAL 203 Cb 0.02 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1e1u h VAL 203 CO -0.04 0.00 0.05 0.11 0.02 0.00 0.00 177.57 177.70 1e1u h LYS 204 N -0.34 0.71 0.00 1.57 1.57 -0.90 -1.34 116.57 117.83 1e1u h LYS 204 Ca 0.07 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 1e1u h LYS 204 Cb 0.44 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1e1u h LYS 204 CO -0.23 0.69 -0.23 0.52 -0.57 0.00 0.00 179.45 179.63 1e1u h MET 205 N 0.68 0.00 -0.23 3.15 2.86 -0.37 -2.08 114.93 118.93 1e1u h MET 205 Ca 0.14 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.68 1e1u h MET 205 Cb 0.35 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.01 1e1u h MET 205 CO 0.01 0.23 -0.25 0.52 1.06 0.00 0.00 176.91 178.48 1e1u h MET 206 N 0.00 0.59 0.08 1.72 2.86 0.08 -3.28 114.93 116.98 1e1u h MET 206 Ca -0.00 -0.32 0.02 0.00 -2.06 0.00 0.00 59.70 57.34 1e1u h MET 206 Cb 0.48 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.11 1e1u h MET 206 CO 0.03 0.91 -0.37 0.93 1.06 0.00 0.00 176.91 179.48 1e1u h GLU 207 N 0.28 -0.55 -0.91 1.72 4.39 -0.56 0.28 114.58 119.23 1e1u h GLU 207 Ca 0.03 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 1e1u h GLU 207 Cb 0.82 0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 29.55 1e1u h GLU 207 CO 0.06 -0.37 0.51 0.00 -1.16 0.00 0.00 179.01 178.05 1e1u h ARG 208 N -0.58 1.25 0.69 2.33 2.47 -1.71 -0.55 114.38 118.29 1e1u h ARG 208 Ca 0.04 -0.14 -0.03 0.00 -1.26 0.00 0.00 59.98 58.58 1e1u h ARG 208 Cb 0.62 -0.25 0.01 0.00 -1.65 0.00 0.00 29.97 28.70 1e1u h ARG 208 CO -0.24 0.91 -0.33 0.28 0.56 0.00 0.00 179.97 181.14 1e1u h VAL 209 N 1.26 0.00 -0.80 2.04 2.07 -1.39 -2.53 116.25 116.90 1e1u h VAL 209 Ca 0.32 -0.19 0.14 0.00 0.82 0.00 0.00 66.70 67.80 1e1u h VAL 209 Cb 0.01 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.72 1e1u h VAL 209 CO -0.05 0.00 0.53 0.58 0.02 0.00 0.00 177.57 178.65 1e1u h VAL 210 N -1.12 0.82 0.51 2.57 2.07 -0.41 -0.37 116.25 120.32 1e1u h VAL 210 Ca -0.10 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1e1u h VAL 210 Cb 0.71 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1e1u h VAL 210 CO 0.16 0.10 -0.44 -0.08 0.02 0.00 0.00 177.57 177.32 1e1u h GLU 211 N 0.53 -0.90 -0.41 1.57 4.81 -1.05 0.21 114.58 119.34 1e1u h GLU 211 Ca 0.40 0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.72 1e1u h GLU 211 Cb 0.78 0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1e1u h GLU 211 CO -0.15 -0.60 0.28 1.96 -0.73 0.00 0.00 179.01 179.77 1e1u h GLN 212 N -0.93 0.40 -0.08 1.92 1.08 -0.77 -0.08 115.11 116.65 1e1u h GLN 212 Ca -0.07 -0.02 -0.11 0.00 -1.45 0.00 0.00 58.65 57.00 1e1u h GLN 212 Cb 0.79 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.13 1e1u h GLN 212 CO -0.01 0.27 -0.38 0.52 -0.95 0.00 0.00 178.83 178.28 1e1u h MET 213 N 0.42 0.40 -0.81 1.46 2.86 -0.93 -0.56 114.93 117.78 1e1u h MET 213 Ca 0.17 -0.32 0.03 0.00 -2.06 0.00 0.00 59.70 57.51 1e1u h MET 213 Cb 0.16 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 1e1u h MET 213 CO -0.04 0.96 0.52 0.00 1.06 0.00 0.00 176.91 179.41 1e1u h ILE 215 N 1.03 1.17 -0.55 0.00 2.04 -1.00 -1.27 117.51 118.94 1e1u h ILE 215 Ca 0.32 -0.44 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1e1u h ILE 215 Cb -0.03 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1e1u h ILE 215 CO -0.10 0.19 0.33 0.74 0.00 0.00 0.00 178.15 179.30 1e1u h THR 216 N 0.67 1.16 -0.28 -0.27 2.02 -0.44 -0.52 112.91 115.26 1e1u h THR 216 Ca 0.18 -0.36 -0.15 0.00 0.77 0.00 0.00 66.41 66.84 1e1u h THR 216 Cb 0.05 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1e1u h THR 216 CO -0.03 0.17 -0.45 -0.61 0.37 0.00 0.00 175.52 174.97 1e1u h GLN 217 N 0.76 0.71 0.31 6.66 -0.00 -0.59 -3.08 115.11 119.88 1e1u h GLN 217 Ca 0.20 -0.40 -0.02 0.00 -0.00 0.00 0.00 58.65 58.44 1e1u h GLN 217 Cb -0.02 0.02 0.00 0.00 0.00 0.00 0.00 27.48 27.49 1e1u h GLN 217 CO -0.04 1.01 -0.15 -0.92 0.00 0.00 0.00 178.83 178.74 1e1u h TYR 218 N 0.57 -0.39 0.00 3.99 3.20 -0.74 -3.04 116.97 120.57 1e1u h TYR 218 Ca 0.04 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1e1u h TYR 218 Cb 1.00 0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.40 1e1u h TYR 218 CO 0.05 -0.22 0.00 0.39 -1.64 0.00 0.00 178.16 176.75 1e1u n GLU 219 N -5.25 0.30 0.00 1.82 -0.58 -0.25 -1.40 120.64 115.28 1e1u n GLU 219 Ca -0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 1e1u n GLU 219 Cb 0.20 -1.11 0.00 0.00 -0.57 0.00 0.00 31.44 29.95 1e1u n GLU 219 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1e1u n LYS 220 N 0.15 2.59 0.07 3.49 2.85 -1.16 -4.94 118.16 121.21 1e1u n LYS 220 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1e1u n LYS 220 Cb 0.06 -0.22 0.00 0.00 -0.65 0.00 0.00 35.03 34.22 1e1u n LYS 220 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1e1u n GLU 221 N -0.37 0.00 0.25 -1.58 -0.58 -0.54 -4.67 120.64 113.15 1e1u n GLU 221 Ca 0.00 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 56.83 1e1u n GLU 221 Cb 0.00 -0.32 0.66 0.00 -0.57 0.00 0.00 31.44 31.20 1e1u n GLU 221 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 1e1u h SER 222 N 0.00 0.00 0.17 1.62 0.02 -1.46 -0.63 113.55 113.28 1e1u h SER 222 Ca 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1e1u h SER 222 Cb 0.09 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 1e1u h SER 222 CO 0.00 0.00 -0.26 1.56 -1.14 0.00 0.00 176.83 176.99 1e1u h GLN 223 N 0.00 -0.48 -0.28 3.45 4.20 -1.87 -2.60 115.11 117.54 1e1u h GLN 223 Ca 0.01 0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.79 1e1u h GLN 223 Cb 0.06 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1e1u h GLN 223 CO -0.00 -0.32 0.19 0.00 -0.67 0.00 0.00 178.83 178.03 1e1u h ALA 224 N 0.20 1.99 0.00 3.87 0.00 -1.40 -1.11 119.26 122.82 1e1u h ALA 224 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1e1u h ALA 224 Cb 0.50 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1e1u h ALA 224 CO -0.11 -0.04 -0.06 -0.92 0.00 0.00 0.00 179.25 178.11 1e1u h TYR 225 N 0.21 0.00 -0.90 0.00 5.03 -1.02 -3.14 116.97 117.16 1e1u h TYR 225 Ca 0.12 0.00 -0.42 0.00 2.58 0.00 0.00 58.73 61.01 1e1u h TYR 225 Cb 0.21 0.00 -0.41 0.00 1.55 0.00 0.00 36.73 38.08 1e1u h TYR 225 CO -0.00 0.06 -0.99 0.66 -1.32 0.00 0.00 178.16 176.58 1e1u n TYR 226 N -4.13 2.05 -1.61 -3.82 4.01 -0.47 -4.87 117.16 108.32 1e1u n TYR 226 Ca -0.03 -2.55 -0.35 0.00 -0.16 0.00 0.00 57.90 54.82 1e1u n TYR 226 Cb 0.15 -0.26 0.06 0.00 -0.31 0.00 0.00 39.34 38.98 1e1u n TYR 226 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1e1u n GLN 227 N -0.45 2.83 0.00 -0.72 -0.06 -0.89 -4.98 117.38 113.10 1e1u n GLN 227 Ca 0.23 -3.49 0.15 0.00 -2.00 0.00 0.00 57.00 51.89 1e1u n GLN 227 Cb 0.81 -2.28 0.71 0.00 -4.06 0.00 0.00 30.24 25.43 1e1u n GLN 227 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40