#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j50 s ALA 129 N 0.00 0.12 0.39 5.87 0.00 -1.26 -4.92 121.76 121.96 2j50 s ALA 129 Ca 0.00 -1.16 0.12 0.00 0.00 0.00 0.00 51.96 50.92 2j50 s ALA 129 Cb 0.00 1.00 0.80 0.00 0.00 0.00 0.00 23.12 24.92 2j50 s ALA 129 CO 0.00 -0.86 1.89 1.25 0.00 0.00 0.00 175.76 178.04 2j50 h LEU 130 N 2.11 0.07 -2.30 0.00 5.85 -1.97 -3.04 115.31 116.03 2j50 h LEU 130 Ca -0.29 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 2j50 h LEU 130 Cb 1.24 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 2j50 h LEU 130 CO 0.38 0.34 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.45 2j50 h GLU 131 N 0.07 0.00 -0.29 1.25 3.07 -2.03 -2.71 114.58 113.93 2j50 h GLU 131 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2j50 h GLU 131 Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2j50 h GLU 131 CO 0.04 0.04 0.00 -0.25 -1.40 0.00 0.00 179.01 177.44 2j50 n ASP 132 N -3.43 0.87 -4.08 1.42 8.00 -1.15 -4.81 116.55 113.37 2j50 n ASP 132 Ca -0.02 -2.03 -0.18 0.00 0.71 0.00 0.00 54.79 53.26 2j50 n ASP 132 Cb 0.16 -0.18 -0.14 0.00 -0.02 0.00 0.00 41.12 40.95 2j50 n ASP 132 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2j50 s PHE 133 N -1.72 0.96 -0.22 1.24 0.40 -1.02 -1.63 117.98 115.99 2j50 s PHE 133 Ca 0.08 -0.28 -0.08 0.00 -0.60 0.00 0.00 56.93 56.06 2j50 s PHE 133 Cb 0.05 -0.59 -0.04 0.00 0.51 0.00 0.00 43.02 42.95 2j50 s PHE 133 CO 0.05 -0.00 0.08 -2.00 0.70 0.00 0.00 175.22 174.04 2j50 s GLU 134 N -0.74 3.85 0.05 0.44 2.12 0.34 -4.88 118.70 119.89 2j50 s GLU 134 Ca 0.01 -0.39 -0.21 0.00 0.36 0.00 0.00 54.97 54.74 2j50 s GLU 134 Cb -0.06 -3.30 -0.06 0.00 0.26 0.00 0.00 34.13 30.97 2j50 s GLU 134 CO 0.00 0.06 0.63 0.42 -0.54 0.00 0.00 175.26 175.83 2j50 s ILE 135 N 0.97 4.75 0.00 -3.70 -1.09 -1.26 0.25 121.20 121.12 2j50 s ILE 135 Ca 0.04 1.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.81 2j50 s ILE 135 Cb -0.14 -3.97 0.00 0.00 -1.58 0.00 0.00 42.46 36.77 2j50 s ILE 135 CO 0.03 0.47 0.00 0.61 -1.23 0.00 0.00 174.94 174.82 2j50 n GLY 136 N 2.07 3.16 3.81 6.18 0.00 0.19 -4.97 105.19 115.63 2j50 n GLY 136 Ca -0.07 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 43.88 2j50 n GLY 136 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2j50 s ARG 137 N 4.62 4.33 0.38 1.61 1.70 -1.26 -4.74 118.95 125.60 2j50 s ARG 137 Ca 0.00 1.17 -0.27 0.00 -0.47 0.00 0.00 55.73 56.17 2j50 s ARG 137 Cb 0.00 -2.36 -0.09 0.00 -0.57 0.00 0.00 34.95 31.93 2j50 s ARG 137 CO 0.00 0.06 1.28 -2.14 -1.08 0.00 0.00 175.30 173.43 2j50 s PRO 138 N -2.85 4.09 -0.16 3.89 0.02 -1.26 -2.23 135.00 136.50 2j50 s PRO 138 Ca 0.58 2.12 0.19 0.00 0.02 0.00 0.00 61.00 63.92 2j50 s PRO 138 Cb -0.12 -2.83 -0.27 0.00 0.02 0.00 0.00 34.50 31.30 2j50 s PRO 138 CO 0.16 -0.38 0.18 1.28 -0.33 0.00 0.00 177.00 177.91 2j50 n LEU 139 N 0.30 0.01 0.00 -5.54 4.77 0.18 -4.86 117.00 111.86 2j50 n LEU 139 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2j50 n LEU 139 Cb 0.43 0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 2j50 n LEU 139 CO 0.56 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 2j50 n GLY 140 N 1.63 1.54 3.89 -0.72 0.00 -1.13 -5.01 105.19 105.38 2j50 n GLY 140 Ca -0.26 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 44.58 2j50 n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j50 s LYS 141 N -2.00 3.16 0.14 1.61 1.02 -1.26 -1.71 119.74 120.70 2j50 s LYS 141 Ca 0.00 -0.88 0.01 0.00 0.02 0.00 0.00 55.97 55.12 2j50 s LYS 141 Cb 0.00 -2.73 -0.00 0.00 -0.52 0.00 0.00 37.83 34.57 2j50 s LYS 141 CO 0.00 0.43 0.03 0.41 -0.92 0.00 0.00 175.35 175.31 2j50 n GLY 142 N -1.11 3.87 0.18 -3.33 0.00 0.42 -4.93 105.19 100.29 2j50 n GLY 142 Ca -0.08 -2.07 0.03 0.00 0.00 0.00 0.00 46.02 43.90 2j50 n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j50 h LYS 143 N 0.00 0.00 0.00 1.61 1.79 -2.00 -3.30 116.57 114.67 2j50 h LYS 143 Ca -0.12 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.27 2j50 h LYS 143 Cb 0.41 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 30.88 2j50 h LYS 143 CO 0.19 0.42 -0.70 1.19 -1.08 0.00 0.00 179.45 179.47 2j50 n PHE 144 N -3.84 0.00 0.00 -1.35 3.01 -1.26 -4.98 117.46 109.04 2j50 n PHE 144 Ca -0.01 -0.71 0.00 0.00 1.01 0.00 0.00 57.45 57.74 2j50 n PHE 144 Cb 0.48 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 2j50 n PHE 144 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2j50 n GLY 145 N -0.20 0.55 3.98 1.37 0.00 -1.24 0.10 105.19 109.76 2j50 n GLY 145 Ca 0.09 -1.46 -0.21 0.00 0.00 0.00 0.00 46.02 44.44 2j50 n GLY 145 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j50 s ASN 146 N 0.00 5.25 -0.05 1.61 -0.87 -1.15 0.16 114.94 119.88 2j50 s ASN 146 Ca 0.00 -0.11 -0.02 0.00 -1.57 0.00 0.00 52.86 51.16 2j50 s ASN 146 Cb 0.00 -0.76 0.04 0.00 -0.02 0.00 0.00 41.25 40.51 2j50 s ASN 146 CO 0.00 -1.16 0.10 0.54 -2.57 0.00 0.00 177.10 174.01 2j50 s VAL 147 N -2.74 -0.12 0.31 1.60 0.11 -0.70 -0.49 120.40 118.37 2j50 s VAL 147 Ca 0.58 0.30 0.10 0.00 -2.93 0.00 0.00 61.98 60.03 2j50 s VAL 147 Cb -0.10 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.51 2j50 s VAL 147 CO 0.38 0.13 -0.09 -0.31 -3.33 0.00 0.00 175.10 171.88 2j50 s TYR 148 N 1.70 2.46 -0.05 1.54 1.51 0.39 0.51 117.35 125.39 2j50 s TYR 148 Ca -0.02 -0.37 -0.24 0.00 -1.01 0.00 0.00 57.07 55.42 2j50 s TYR 148 Cb -0.12 -1.24 -0.04 0.00 -0.11 0.00 0.00 41.96 40.45 2j50 s TYR 148 CO -0.04 0.61 0.74 -1.17 -1.11 0.00 0.00 175.55 174.57 2j50 s LEU 149 N -3.62 4.33 0.23 -1.29 2.96 -0.95 0.10 118.68 120.45 2j50 s LEU 149 Ca 0.32 1.26 0.01 0.00 -0.22 0.00 0.00 54.13 55.49 2j50 s LEU 149 Cb -0.02 -3.15 -0.05 0.00 0.50 0.00 0.00 46.19 43.47 2j50 s LEU 149 CO 0.17 -0.13 0.09 0.00 -1.32 0.00 0.00 176.35 175.17 2j50 s ALA 150 N 0.78 1.50 -0.05 5.97 0.00 0.18 0.55 121.76 130.69 2j50 s ALA 150 Ca 0.39 -1.78 0.03 0.00 0.00 0.00 0.00 51.96 50.60 2j50 s ALA 150 Cb -0.18 1.08 0.01 0.00 0.00 0.00 0.00 23.12 24.03 2j50 s ALA 150 CO 0.20 -0.48 -0.13 0.50 0.00 0.00 0.00 175.76 175.85 2j50 s ARG 151 N -4.06 1.60 -0.49 0.00 6.06 0.14 -0.37 118.95 121.83 2j50 s ARG 151 Ca 0.36 -0.44 -0.29 0.00 -2.50 0.00 0.00 55.73 52.87 2j50 s ARG 151 Cb 0.07 -1.35 0.03 0.00 0.06 0.00 0.00 34.95 33.76 2j50 s ARG 151 CO 0.12 0.08 1.19 -2.00 -2.50 0.00 0.00 175.30 172.19 2j50 s GLU 152 N 0.46 3.66 0.18 5.12 2.12 0.31 0.13 118.70 130.68 2j50 s GLU 152 Ca -0.11 0.55 -0.22 0.00 0.36 0.00 0.00 54.97 55.55 2j50 s GLU 152 Cb -0.14 -3.95 0.09 0.00 0.26 0.00 0.00 34.13 30.40 2j50 s GLU 152 CO 0.03 -1.47 1.59 0.87 -0.54 0.00 0.00 175.26 175.73 2j50 h LYS 153 N 9.50 -0.19 0.00 4.30 1.57 -1.62 0.89 116.57 131.02 2j50 h LYS 153 Ca -0.24 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2j50 h LYS 153 Cb 1.07 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2j50 h LYS 153 CO 1.14 -0.13 0.00 1.96 -0.57 0.00 0.00 179.45 181.85 2j50 h GLN 154 N -0.20 0.00 0.00 3.15 4.20 -1.92 -3.18 115.11 117.17 2j50 h GLN 154 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 2j50 h GLN 154 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2j50 h GLN 154 CO -0.64 0.00 0.00 -1.13 -0.67 0.00 0.00 178.83 176.39 2j50 n SER 155 N -2.58 0.36 -2.06 1.46 3.41 -0.35 -5.00 113.62 108.87 2j50 n SER 155 Ca -0.02 -1.14 -0.14 0.00 -0.26 0.00 0.00 58.87 57.32 2j50 n SER 155 Cb 0.05 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.98 2j50 n SER 155 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2j50 n LYS 156 N -0.07 -1.83 -3.15 4.33 5.02 0.30 -4.92 118.16 117.84 2j50 n LYS 156 Ca 0.00 0.72 -0.39 0.00 -2.02 0.00 0.00 58.31 56.62 2j50 n LYS 156 Cb 0.34 -5.20 -0.05 0.00 -0.02 0.00 0.00 35.03 30.10 2j50 n LYS 156 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2j50 s PHE 157 N -2.50 3.65 0.25 2.13 5.36 -1.12 -4.80 117.98 120.96 2j50 s PHE 157 Ca 0.00 1.22 -0.12 0.00 -0.96 0.00 0.00 56.93 57.07 2j50 s PHE 157 Cb 0.00 -2.68 -0.08 0.00 -0.34 0.00 0.00 43.02 39.92 2j50 s PHE 157 CO 0.00 0.26 0.61 0.96 -1.46 0.00 0.00 175.22 175.60 2j50 s ILE 158 N 0.13 4.84 0.00 3.12 -0.00 -1.26 0.11 121.20 128.14 2j50 s ILE 158 Ca 0.33 0.67 -0.12 0.00 -0.00 0.00 0.00 60.65 61.53 2j50 s ILE 158 Cb -0.18 -3.63 0.04 0.00 -0.00 0.00 0.00 42.46 38.69 2j50 s ILE 158 CO 0.18 -0.08 0.55 0.00 -0.00 0.00 0.00 174.94 175.59 2j50 n LEU 159 N -0.12 0.00 -4.39 0.37 -0.00 0.50 -4.68 117.00 108.69 2j50 n LEU 159 Ca 0.01 -0.24 -0.33 0.00 -0.00 0.00 0.00 56.01 55.45 2j50 n LEU 159 Cb 0.53 0.87 -0.14 0.00 -0.00 0.00 0.00 43.42 44.68 2j50 n LEU 159 CO 0.44 -0.08 -0.46 0.00 -0.00 0.00 0.00 177.39 177.29 2j50 s ALA 160 N -1.44 2.60 -0.32 1.47 0.00 0.54 0.49 121.76 125.11 2j50 s ALA 160 Ca 0.13 -0.92 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 2j50 s ALA 160 Cb -0.00 -1.12 0.01 0.00 0.00 0.00 0.00 23.12 22.00 2j50 s ALA 160 CO 0.00 0.33 0.12 -1.17 0.00 0.00 0.00 175.76 175.04 2j50 s LEU 161 N 0.08 4.10 -0.23 0.00 2.96 0.29 -0.35 118.68 125.53 2j50 s LEU 161 Ca -0.06 -0.72 -0.09 0.00 -0.22 0.00 0.00 54.13 53.04 2j50 s LEU 161 Cb -0.15 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 2j50 s LEU 161 CO 0.05 -0.23 0.12 -0.75 -1.32 0.00 0.00 176.35 174.22 2j50 s LYS 162 N 1.54 3.96 -0.26 1.98 2.20 -1.00 -0.47 119.74 127.70 2j50 s LYS 162 Ca 0.03 -0.33 -0.10 0.00 -0.36 0.00 0.00 55.97 55.21 2j50 s LYS 162 Cb -0.18 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.66 2j50 s LYS 162 CO 0.04 0.04 0.15 0.08 -0.36 0.00 0.00 175.35 175.30 2j50 s VAL 163 N 1.07 5.03 -0.27 4.02 1.01 0.35 -1.59 120.40 130.03 2j50 s VAL 163 Ca 0.06 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.14 2j50 s VAL 163 Cb -0.14 -3.37 0.06 0.00 0.00 0.00 0.00 36.38 32.93 2j50 s VAL 163 CO 0.04 0.31 -0.09 -0.76 0.00 0.00 0.00 175.10 174.59 2j50 s LEU 164 N 1.49 3.51 -0.17 3.92 1.43 0.27 -2.95 118.68 126.18 2j50 s LEU 164 Ca 0.07 -1.37 -0.29 0.00 -1.03 0.00 0.00 54.13 51.50 2j50 s LEU 164 Cb -0.15 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2j50 s LEU 164 CO 0.07 -0.20 1.68 -0.36 0.23 0.00 0.00 176.35 177.77 2j50 s PHE 165 N 1.13 1.98 0.19 0.29 0.40 0.28 0.13 117.98 122.38 2j50 s PHE 165 Ca -0.08 0.42 -0.20 0.00 -0.60 0.00 0.00 56.93 56.47 2j50 s PHE 165 Cb -0.20 -3.97 0.14 0.00 0.51 0.00 0.00 43.02 39.50 2j50 s PHE 165 CO -0.04 -3.34 1.59 0.87 0.70 0.00 0.00 175.22 174.99 2j50 h LYS 166 N 10.72 -0.13 -0.19 0.44 1.57 -1.56 -1.60 116.57 125.81 2j50 h LYS 166 Ca -0.36 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.48 2j50 h LYS 166 Cb 1.17 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 33.44 2j50 h LYS 166 CO 0.98 -0.09 -0.35 0.00 -0.57 0.00 0.00 179.45 179.43 2j50 h ALA 167 N 1.07 -0.39 -0.63 3.86 0.00 -1.92 0.31 119.26 121.56 2j50 h ALA 167 Ca 0.25 0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.36 2j50 h ALA 167 Cb 0.55 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2j50 h ALA 167 CO -0.71 -0.81 0.45 1.96 0.00 0.00 0.00 179.25 180.13 2j50 h GLN 168 N -0.39 0.09 -0.00 0.00 4.20 -1.69 -0.66 115.11 116.66 2j50 h GLN 168 Ca 0.11 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2j50 h GLN 168 Cb 0.56 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.32 2j50 h GLN 168 CO -0.41 0.06 -0.02 -0.07 -0.67 0.00 0.00 178.83 177.73 2j50 h LEU 169 N 0.09 0.02 -2.07 1.46 3.38 -0.01 -3.11 115.31 115.07 2j50 h LEU 169 Ca 0.30 -0.68 0.09 0.00 0.09 0.00 0.00 57.88 57.68 2j50 h LEU 169 Cb 1.07 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2j50 h LEU 169 CO -0.03 0.70 0.35 -0.33 0.09 0.00 0.00 178.44 179.22 2j50 h GLU 170 N -0.65 0.00 0.01 1.13 4.39 0.96 -0.99 114.58 119.42 2j50 h GLU 170 Ca -0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 2j50 h GLU 170 Cb 0.70 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 2j50 h GLU 170 CO 0.00 0.00 -0.90 -0.22 -1.16 0.00 0.00 179.01 176.74 2j50 h LYS 171 N 0.00 0.06 -0.64 2.33 1.63 -1.23 -3.27 116.57 115.45 2j50 h LYS 171 Ca 0.14 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2j50 h LYS 171 Cb 0.84 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.49 2j50 h LYS 171 CO -0.00 0.91 0.00 0.00 -3.45 0.00 0.00 179.45 176.91 2j50 n ALA 172 N -2.40 3.26 -3.69 5.00 0.00 -0.39 -4.94 120.51 117.34 2j50 n ALA 172 Ca -0.02 -1.57 -0.29 0.00 0.00 0.00 0.00 53.44 51.57 2j50 n ALA 172 Cb 0.84 -1.05 0.04 0.00 0.00 0.00 0.00 19.45 19.27 2j50 n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j50 n GLY 173 N 0.98 -0.86 0.00 0.00 0.00 -1.15 -4.87 105.19 99.29 2j50 n GLY 173 Ca 0.25 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.67 2j50 n GLY 173 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2j50 n VAL 174 N -4.17 0.00 -0.28 1.61 0.24 -1.19 -4.83 118.33 109.70 2j50 n VAL 174 Ca -0.13 -0.06 0.34 0.00 -2.04 0.00 0.00 64.34 62.45 2j50 n VAL 174 Cb 0.61 0.67 0.66 0.00 -1.47 0.00 0.00 33.84 34.32 2j50 n VAL 174 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2j50 h GLU 175 N 0.00 0.00 0.00 7.34 -0.00 -1.90 0.27 114.58 120.29 2j50 h GLU 175 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 59.36 58.98 2j50 h GLU 175 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 28.68 2j50 h GLU 175 CO 0.00 0.00 -2.44 -2.39 -0.00 0.00 0.00 179.01 174.18 2j50 n HIS 176 N -3.71 0.00 0.08 2.06 1.44 -1.26 -4.09 115.22 109.74 2j50 n HIS 176 Ca 0.25 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.83 2j50 n HIS 176 Cb 1.37 -1.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.41 2j50 n HIS 176 CO 0.00 0.00 0.00 0.37 -2.81 0.00 0.00 176.34 173.90 2j50 h GLN 177 N 0.00 -0.14 -0.80 -1.40 4.15 -1.45 -2.43 115.11 113.03 2j50 h GLN 177 Ca -0.57 0.01 0.18 0.00 0.77 0.00 0.00 58.65 59.04 2j50 h GLN 177 Cb 2.00 0.03 -0.11 0.00 0.21 0.00 0.00 27.48 29.62 2j50 h GLN 177 CO -0.05 0.01 0.29 1.25 -1.93 0.00 0.00 178.83 178.39 2j50 h LEU 178 N -0.27 0.19 -1.53 -2.39 5.85 -0.76 0.92 115.31 117.33 2j50 h LEU 178 Ca -0.02 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.89 2j50 h LEU 178 Cb 0.22 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 2j50 h LEU 178 CO 0.03 0.01 0.38 -0.09 -0.34 0.00 0.00 178.44 178.43 2j50 h ARG 179 N 0.37 0.57 -0.09 1.25 2.43 -1.62 -1.27 114.38 116.01 2j50 h ARG 179 Ca 0.47 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.57 2j50 h ARG 179 Cb 0.81 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2j50 h ARG 179 CO -0.49 0.38 -0.09 0.00 -1.51 0.00 0.00 179.97 178.26 2j50 h ARG 180 N 0.59 0.22 0.07 0.20 3.08 0.13 -2.78 114.38 115.90 2j50 h ARG 180 Ca 0.24 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 2j50 h ARG 180 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2j50 h ARG 180 CO -0.07 0.64 -0.03 0.93 -1.07 0.00 0.00 179.97 180.37 2j50 h GLU 181 N -0.18 -0.09 -0.82 0.04 5.08 -0.92 -2.38 114.58 115.31 2j50 h GLU 181 Ca 0.02 0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.56 2j50 h GLU 181 Cb 0.59 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.76 2j50 h GLU 181 CO 0.02 0.10 0.34 -0.24 -1.00 0.00 0.00 179.01 178.23 2j50 h VAL 182 N -0.27 0.58 -0.11 3.13 3.04 -1.34 0.25 116.25 121.54 2j50 h VAL 182 Ca -0.01 -0.15 0.04 0.00 -1.01 0.00 0.00 66.70 65.57 2j50 h VAL 182 Cb 0.23 0.11 -0.05 0.00 -2.01 0.00 0.00 31.29 29.57 2j50 h VAL 182 CO 0.02 0.08 -0.21 -0.33 -1.01 0.00 0.00 177.57 176.11 2j50 h GLU 183 N 0.44 -0.27 0.00 4.17 4.39 -1.17 -1.61 114.58 120.53 2j50 h GLU 183 Ca 0.48 0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.19 2j50 h GLU 183 Cb 0.80 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2j50 h GLU 183 CO -0.46 -0.18 0.00 -0.89 -1.16 0.00 0.00 179.01 176.32 2j50 n ILE 184 N -5.35 0.00 0.29 3.13 5.41 0.15 -3.03 119.36 119.96 2j50 n ILE 184 Ca -0.03 1.29 0.02 0.00 1.00 0.00 0.00 62.75 65.03 2j50 n ILE 184 Cb 0.26 -2.28 0.13 0.00 -0.71 0.00 0.00 39.64 37.04 2j50 n ILE 184 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2j50 h GLN 185 N 0.00 0.00 0.00 0.38 4.15 -0.65 0.45 115.11 119.45 2j50 h GLN 185 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2j50 h GLN 185 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2j50 h GLN 185 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 178.83 175.77 2j50 n SER 186 N -2.37 0.00 -0.35 -0.69 3.41 -0.61 -2.73 113.62 110.28 2j50 n SER 186 Ca -0.00 0.45 0.05 0.00 -0.26 0.00 0.00 58.87 59.11 2j50 n SER 186 Cb 0.83 -0.48 0.11 0.00 -0.26 0.00 0.00 64.21 64.41 2j50 n SER 186 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2j50 n HIS 187 N -1.48 0.29 -3.45 7.33 8.25 0.16 -4.92 115.22 121.39 2j50 n HIS 187 Ca 0.07 -0.64 -0.43 0.00 -0.26 0.00 0.00 57.72 56.46 2j50 n HIS 187 Cb 0.32 -0.10 -0.07 0.00 1.12 0.00 0.00 29.99 31.26 2j50 n HIS 187 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2j50 s LEU 188 N -1.58 5.87 -0.35 2.41 1.43 -1.10 -5.03 118.68 120.32 2j50 s LEU 188 Ca 0.19 -1.83 -0.04 0.00 -1.03 0.00 0.00 54.13 51.43 2j50 s LEU 188 Cb 0.14 -2.09 0.07 0.00 0.03 0.00 0.00 46.19 44.33 2j50 s LEU 188 CO 0.07 -0.75 0.10 -0.13 0.23 0.00 0.00 176.35 175.87 2j50 s ARG 189 N 1.47 2.35 -0.25 1.70 0.52 -1.26 -4.69 118.95 118.79 2j50 s ARG 189 Ca 0.04 -1.43 -0.20 0.00 -0.52 0.00 0.00 55.73 53.62 2j50 s ARG 189 Cb -0.28 -3.41 0.07 0.00 0.52 0.00 0.00 34.95 31.85 2j50 s ARG 189 CO 0.01 -0.79 0.65 -1.58 0.02 0.00 0.00 175.30 173.61 2j50 s HIS 190 N 1.26 -0.80 0.61 -0.53 2.46 -1.26 -5.04 115.29 111.98 2j50 s HIS 190 Ca 0.00 1.83 0.28 0.00 0.47 0.00 0.00 55.06 57.65 2j50 s HIS 190 Cb -0.21 0.34 1.47 0.00 -0.13 0.00 0.00 32.58 34.06 2j50 s HIS 190 CO -0.01 -0.39 1.87 -1.00 -2.47 0.00 0.00 174.74 172.74 2j50 h PRO 191 N 5.68 0.00 -0.47 2.88 0.13 -1.97 -1.34 132.00 136.90 2j50 h PRO 191 Ca -0.29 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.78 2j50 h PRO 191 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2j50 h PRO 191 CO 0.12 0.00 0.05 0.09 -0.23 0.00 0.00 178.00 178.03 2j50 n ASN 192 N -3.52 4.68 -3.80 1.44 3.02 -1.26 -4.83 115.26 110.99 2j50 n ASN 192 Ca 0.06 -3.07 -0.21 0.00 -0.03 0.00 0.00 54.58 51.33 2j50 n ASN 192 Cb 0.63 -0.64 -0.17 0.00 -0.61 0.00 0.00 39.78 38.99 2j50 n ASN 192 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2j50 s ILE 193 N -2.87 0.36 -0.33 2.41 1.01 -0.51 -1.80 121.20 119.47 2j50 s ILE 193 Ca 0.49 0.08 -0.39 0.00 0.00 0.00 0.00 60.65 60.83 2j50 s ILE 193 Cb 0.39 -0.48 -0.15 0.00 0.01 0.00 0.00 42.46 42.23 2j50 s ILE 193 CO 0.12 0.23 1.93 -0.11 0.00 0.00 0.00 174.94 177.11 2j50 n LEU 194 N 4.77 2.11 -4.68 2.97 7.94 -0.14 -4.60 117.00 125.37 2j50 n LEU 194 Ca -0.14 0.82 -0.42 0.00 -1.11 0.00 0.00 56.01 55.16 2j50 n LEU 194 Cb 0.50 -1.15 -0.03 0.00 0.53 0.00 0.00 43.42 43.28 2j50 n LEU 194 CO 0.15 -0.56 1.10 -0.60 -1.11 0.00 0.00 177.39 176.37 2j50 s ARG 195 N 4.68 4.27 -0.73 1.96 6.06 -1.26 -4.90 118.95 129.03 2j50 s ARG 195 Ca 1.05 1.83 -0.15 0.00 -2.50 0.00 0.00 55.73 55.95 2j50 s ARG 195 Cb -1.06 -3.68 0.18 0.00 0.06 0.00 0.00 34.95 30.45 2j50 s ARG 195 CO 0.61 -0.62 0.71 -1.17 -2.50 0.00 0.00 175.30 172.33 2j50 s LEU 196 N 2.88 6.38 0.29 -0.88 2.96 -1.26 -0.91 118.68 128.13 2j50 s LEU 196 Ca 0.60 -2.28 -0.01 0.00 -0.22 0.00 0.00 54.13 52.22 2j50 s LEU 196 Cb -0.27 -2.23 0.43 0.00 0.50 0.00 0.00 46.19 44.62 2j50 s LEU 196 CO 0.22 -0.73 1.87 1.88 -1.32 0.00 0.00 176.35 178.27 2j50 h TYR 197 N 8.29 0.88 -1.98 5.38 0.99 -1.29 -3.43 116.97 125.80 2j50 h TYR 197 Ca -0.04 -0.05 0.37 0.00 2.00 0.00 0.00 58.73 61.01 2j50 h TYR 197 Cb 1.06 -0.27 -0.08 0.00 1.00 0.00 0.00 36.73 38.44 2j50 h TYR 197 CO 0.94 0.68 0.95 0.20 -0.00 0.00 0.00 178.16 180.93 2j50 s GLY 198 N -3.56 -0.20 0.16 3.88 0.00 -1.18 -4.99 107.32 101.43 2j50 s GLY 198 Ca -0.10 0.17 -0.19 0.00 0.00 0.00 0.00 44.72 44.59 2j50 s GLY 198 CO 0.79 5.60 0.53 -2.52 0.00 0.00 0.00 173.10 177.50 2j50 s TYR 199 N -2.03 -0.32 -0.13 1.90 -0.85 -1.26 0.24 117.35 114.89 2j50 s TYR 199 Ca 0.29 0.04 -0.30 0.00 -0.52 0.00 0.00 57.07 56.58 2j50 s TYR 199 Cb 0.00 0.43 0.11 0.00 0.38 0.00 0.00 41.96 42.89 2j50 s TYR 199 CO -0.02 -0.84 0.91 -0.59 -1.52 0.00 0.00 175.55 173.50 2j50 s PHE 200 N -3.80 -0.45 0.48 -3.49 -0.12 -0.46 -4.98 117.98 105.16 2j50 s PHE 200 Ca 0.04 0.77 0.05 0.00 -0.05 0.00 0.00 56.93 57.74 2j50 s PHE 200 Cb -0.00 0.44 -0.02 0.00 -0.63 0.00 0.00 43.02 42.81 2j50 s PHE 200 CO -0.09 -0.41 0.19 -3.38 -0.05 0.00 0.00 175.22 171.47 2j50 s HIS 201 N -1.12 2.11 0.00 3.49 -3.43 -1.26 -0.97 115.29 114.11 2j50 s HIS 201 Ca -0.04 -0.77 0.00 0.00 -0.80 0.00 0.00 55.06 53.45 2j50 s HIS 201 Cb -0.00 -1.84 0.00 0.00 -1.43 0.00 0.00 32.58 29.30 2j50 s HIS 201 CO 0.04 0.02 0.00 -0.40 -2.00 0.00 0.00 174.74 172.39 2j50 n ASP 202 N -1.39 0.00 0.00 7.38 3.85 -1.06 -5.00 116.55 120.33 2j50 n ASP 202 Ca -0.06 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.02 2j50 n ASP 202 Cb 0.65 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.42 2j50 n ASP 202 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2j50 n ALA 203 N -3.00 0.00 -0.45 2.12 0.00 -1.26 -4.25 120.51 113.67 2j50 n ALA 203 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2j50 n ALA 203 Cb 0.00 0.15 0.14 0.00 0.00 0.00 0.00 19.45 19.74 2j50 n ALA 203 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2j50 n THR 204 N -0.66 1.43 -3.85 0.00 -2.24 -1.26 -4.98 114.28 102.72 2j50 n THR 204 Ca 0.00 -1.38 -0.09 0.00 -2.27 0.00 0.00 64.05 60.31 2j50 n THR 204 Cb 0.00 0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.38 2j50 n THR 204 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j50 s ARG 205 N -1.69 0.91 -0.02 -0.78 1.70 -1.26 -1.45 118.95 116.36 2j50 s ARG 205 Ca 0.24 -0.96 0.08 0.00 -0.47 0.00 0.00 55.73 54.61 2j50 s ARG 205 Cb 0.17 0.36 -0.02 0.00 -0.57 0.00 0.00 34.95 34.89 2j50 s ARG 205 CO 0.09 -0.31 -0.25 0.08 -1.08 0.00 0.00 175.30 173.83 2j50 s VAL 206 N -3.87 1.96 -0.05 4.99 1.01 0.35 -2.58 120.40 122.20 2j50 s VAL 206 Ca 0.06 -1.06 0.05 0.00 0.00 0.00 0.00 61.98 61.03 2j50 s VAL 206 Cb 0.04 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 2j50 s VAL 206 CO -0.10 0.55 -0.20 -0.31 0.00 0.00 0.00 175.10 175.05 2j50 s TYR 207 N -0.59 2.55 -0.22 5.22 1.51 -0.15 0.93 117.35 126.62 2j50 s TYR 207 Ca 0.10 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.76 2j50 s TYR 207 Cb -0.10 -1.61 0.05 0.00 -0.11 0.00 0.00 41.96 40.19 2j50 s TYR 207 CO -0.01 -0.01 -0.11 -0.51 -1.11 0.00 0.00 175.55 173.81 2j50 s LEU 208 N -0.46 2.57 -0.61 -1.29 1.43 -0.62 -1.35 118.68 118.35 2j50 s LEU 208 Ca 0.05 -1.02 -0.27 0.00 -1.03 0.00 0.00 54.13 51.86 2j50 s LEU 208 Cb -0.12 -1.32 0.01 0.00 0.03 0.00 0.00 46.19 44.79 2j50 s LEU 208 CO 0.01 -0.15 1.53 -0.63 0.23 0.00 0.00 176.35 177.34 2j50 s ILE 209 N 1.32 3.63 0.13 -0.59 -1.09 0.14 -2.37 121.20 122.37 2j50 s ILE 209 Ca -0.03 0.46 0.06 0.00 -2.23 0.00 0.00 60.65 58.91 2j50 s ILE 209 Cb -0.17 -4.36 -0.04 0.00 -1.58 0.00 0.00 42.46 36.31 2j50 s ILE 209 CO -0.08 -1.21 0.01 -0.76 -1.23 0.00 0.00 174.94 171.67 2j50 s LEU 210 N 6.91 3.42 0.62 2.97 1.43 0.52 -0.75 118.68 133.80 2j50 s LEU 210 Ca 0.54 -0.26 -0.18 0.00 -1.03 0.00 0.00 54.13 53.20 2j50 s LEU 210 Cb -0.11 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 2j50 s LEU 210 CO 0.22 0.13 1.17 -0.70 0.23 0.00 0.00 176.35 177.40 2j50 s GLU 211 N -2.62 2.88 -0.27 1.70 2.12 -0.09 -0.34 118.70 122.09 2j50 s GLU 211 Ca 0.27 1.69 -0.09 0.00 0.36 0.00 0.00 54.97 57.20 2j50 s GLU 211 Cb -0.11 -1.93 -0.04 0.00 0.26 0.00 0.00 34.13 32.31 2j50 s GLU 211 CO 0.19 -1.25 0.14 -0.47 -0.54 0.00 0.00 175.26 173.33 2j50 s TYR 212 N -1.83 3.16 -0.38 5.30 5.04 -1.26 -4.35 117.35 123.04 2j50 s TYR 212 Ca 0.74 -0.12 -0.16 0.00 -2.44 0.00 0.00 57.07 55.09 2j50 s TYR 212 Cb -0.27 -2.32 0.00 0.00 0.35 0.00 0.00 41.96 39.72 2j50 s TYR 212 CO 0.35 -0.25 0.40 0.00 -1.34 0.00 0.00 175.55 174.71 2j50 s ALA 213 N 1.70 3.47 0.04 3.97 0.00 -1.26 -4.86 121.76 124.81 2j50 s ALA 213 Ca 0.07 -1.33 0.17 0.00 0.00 0.00 0.00 51.96 50.86 2j50 s ALA 213 Cb -0.16 -2.93 0.38 0.00 0.00 0.00 0.00 23.12 20.42 2j50 s ALA 213 CO 0.08 -1.29 1.59 -1.35 0.00 0.00 0.00 175.76 174.78 2j50 h PRO 214 N 8.57 0.00 -0.01 0.00 0.11 -1.80 -3.33 132.00 135.54 2j50 h PRO 214 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2j50 h PRO 214 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2j50 h PRO 214 CO 0.74 0.47 -0.12 1.28 -0.21 0.00 0.00 178.00 180.15 2j50 n LEU 215 N -3.39 0.96 0.00 2.35 4.77 -0.98 -5.05 117.00 115.65 2j50 n LEU 215 Ca 0.01 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 2j50 n LEU 215 Cb 0.63 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 2j50 n LEU 215 CO 0.39 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 2j50 n GLY 216 N 1.25 -1.04 3.94 -0.72 0.00 -1.25 -4.76 105.19 102.61 2j50 n GLY 216 Ca 0.16 -1.45 -0.24 0.00 0.00 0.00 0.00 46.02 44.49 2j50 n GLY 216 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j50 s THR 217 N 0.00 4.98 0.22 2.61 -4.23 -1.26 0.49 115.64 118.46 2j50 s THR 217 Ca 0.00 -0.49 0.06 0.00 -1.18 0.00 0.00 61.69 60.08 2j50 s THR 217 Cb 0.00 -3.82 -0.07 0.00 1.34 0.00 0.00 72.50 69.95 2j50 s THR 217 CO 0.00 -0.53 1.52 0.58 -0.54 0.00 0.00 174.62 175.65 2j50 h VAL 218 N 0.73 1.45 -0.94 2.29 2.07 0.03 -2.68 116.25 119.21 2j50 h VAL 218 Ca -0.49 -2.28 0.02 0.00 0.82 0.00 0.00 66.70 64.77 2j50 h VAL 218 Cb 1.22 2.22 -0.05 0.00 -1.52 0.00 0.00 31.29 33.16 2j50 h VAL 218 CO 0.61 0.66 0.62 0.22 0.02 0.00 0.00 177.57 179.70 2j50 h TYR 219 N 0.09 1.17 0.62 1.57 -0.00 -1.74 -1.80 116.97 116.88 2j50 h TYR 219 Ca -0.02 0.03 -0.03 0.00 -0.00 0.00 0.00 58.73 58.71 2j50 h TYR 219 Cb 1.24 -0.39 0.01 0.00 -0.00 0.00 0.00 36.73 37.58 2j50 h TYR 219 CO 0.01 0.72 -0.30 -0.09 -0.00 0.00 0.00 178.16 178.51 2j50 h ARG 220 N 1.25 -0.80 -0.15 1.82 9.65 -1.86 0.22 114.38 124.50 2j50 h ARG 220 Ca 0.35 0.05 0.04 0.00 -1.10 0.00 0.00 59.98 59.33 2j50 h ARG 220 Cb -0.11 0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.65 2j50 h ARG 220 CO -0.08 -0.54 0.50 1.49 2.80 0.00 0.00 179.97 184.14 2j50 h GLU 221 N -1.21 0.00 0.05 0.20 4.81 -1.40 0.52 114.58 117.56 2j50 h GLU 221 Ca -0.09 0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 58.81 2j50 h GLU 221 Cb 0.64 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.98 2j50 h GLU 221 CO 0.14 0.00 -1.94 -0.11 -0.73 0.00 0.00 179.01 176.37 2j50 n LEU 222 N -3.04 1.73 0.00 1.64 7.94 -0.68 -1.94 117.00 122.64 2j50 n LEU 222 Ca 0.02 0.26 0.09 0.00 -1.11 0.00 0.00 56.01 55.26 2j50 n LEU 222 Cb 0.59 -0.44 0.43 0.00 0.53 0.00 0.00 43.42 44.53 2j50 n LEU 222 CO 0.15 0.64 0.76 1.67 -1.11 0.00 0.00 177.39 179.50 2j50 n GLN 223 N -3.23 0.22 -0.08 1.96 7.27 0.15 -1.60 117.38 122.08 2j50 n GLN 223 Ca -0.27 0.13 -0.08 0.00 0.07 0.00 0.00 57.00 56.85 2j50 n GLN 223 Cb 1.05 -1.50 -0.03 0.00 2.41 0.00 0.00 30.24 32.18 2j50 n GLN 223 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 2j50 n LYS 224 N -1.31 0.48 -0.12 3.69 4.81 0.60 -4.63 118.16 121.70 2j50 n LYS 224 Ca 0.08 0.23 0.03 0.00 -0.87 0.00 0.00 58.31 57.78 2j50 n LYS 224 Cb 0.15 -1.39 0.09 0.00 0.02 0.00 0.00 35.03 33.90 2j50 n LYS 224 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2j50 n LEU 225 N -4.33 1.20 0.00 3.14 4.77 -0.82 -4.92 117.00 116.04 2j50 n LEU 225 Ca -0.12 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 2j50 n LEU 225 Cb 0.46 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2j50 n LEU 225 CO 0.18 0.27 0.00 -1.54 -1.33 0.00 0.00 177.39 174.98 2j50 n SER 226 N 0.08 0.00 -3.63 -1.43 3.41 -0.62 -4.64 113.62 106.79 2j50 n SER 226 Ca 0.07 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.53 2j50 n SER 226 Cb 0.21 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.09 2j50 n SER 226 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2j50 s LYS 227 N 0.00 0.91 0.22 4.33 -2.85 -1.26 -4.19 119.74 116.89 2j50 s LYS 227 Ca 0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 55.97 54.88 2j50 s LYS 227 Cb 0.00 0.41 -0.05 0.00 -2.06 0.00 0.00 37.83 36.14 2j50 s LYS 227 CO 0.00 -0.29 0.43 -0.06 0.10 0.00 0.00 175.35 175.54 2j50 s PHE 228 N -1.65 3.48 0.47 1.78 2.99 0.76 -5.03 117.98 120.78 2j50 s PHE 228 Ca -0.10 0.43 -0.16 0.00 0.00 0.00 0.00 56.93 57.10 2j50 s PHE 228 Cb -0.02 -1.93 -0.08 0.00 0.00 0.00 0.00 43.02 41.00 2j50 s PHE 228 CO 0.04 0.33 0.92 0.16 -0.00 0.00 0.00 175.22 176.66 2j50 s ASP 229 N -3.13 6.64 0.32 1.36 1.47 -1.26 -4.50 116.67 117.58 2j50 s ASP 229 Ca 0.40 1.46 0.22 0.00 1.18 0.00 0.00 52.55 55.81 2j50 s ASP 229 Cb -0.11 -2.46 1.13 0.00 -0.34 0.00 0.00 42.92 41.14 2j50 s ASP 229 CO 0.29 -0.49 1.24 1.21 0.68 0.00 0.00 175.17 178.10 2j50 n GLU 230 N -1.33 -0.04 0.02 2.11 2.13 -1.26 -1.20 120.64 121.07 2j50 n GLU 230 Ca 0.05 1.03 -0.18 0.00 0.66 0.00 0.00 57.16 58.73 2j50 n GLU 230 Cb 0.54 -1.96 -0.14 0.00 0.27 0.00 0.00 31.44 30.15 2j50 n GLU 230 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2j50 h GLN 231 N 0.00 0.23 -0.88 5.31 7.50 -1.92 -2.10 115.11 123.26 2j50 h GLN 231 Ca 0.69 -0.37 0.01 0.00 0.50 0.00 0.00 58.65 59.47 2j50 h GLN 231 Cb 2.04 0.13 -0.04 0.00 0.05 0.00 0.00 27.48 29.66 2j50 h GLN 231 CO -0.47 1.16 0.58 -0.09 -1.50 0.00 0.00 178.83 178.50 2j50 h ARG 232 N -0.50 1.16 0.59 1.46 2.43 -1.44 -0.83 114.38 117.25 2j50 h ARG 232 Ca -0.10 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 58.97 2j50 h ARG 232 Cb 1.44 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2j50 h ARG 232 CO 0.11 0.77 -0.29 1.15 -1.51 0.00 0.00 179.97 180.19 2j50 h THR 233 N 1.19 0.00 -0.96 0.20 2.02 -1.29 -1.36 112.91 112.71 2j50 h THR 233 Ca 0.32 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.73 2j50 h THR 233 Cb -0.13 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.20 2j50 h THR 233 CO -0.07 0.00 0.63 0.00 0.37 0.00 0.00 175.52 176.45 2j50 h ALA 234 N -1.60 2.20 -0.18 6.16 0.00 -1.18 -0.28 119.26 124.38 2j50 h ALA 234 Ca -0.08 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 2j50 h ALA 234 Cb 0.62 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.41 2j50 h ALA 234 CO 0.13 -0.53 -0.63 1.15 0.00 0.00 0.00 179.25 179.37 2j50 h THR 235 N 0.42 1.30 -0.67 0.00 2.02 -1.04 -2.63 112.91 112.31 2j50 h THR 235 Ca 0.52 -1.84 -0.01 0.00 0.77 0.00 0.00 66.41 65.85 2j50 h THR 235 Cb 1.28 1.92 -0.03 0.00 -1.74 0.00 0.00 68.15 69.58 2j50 h THR 235 CO -0.22 0.58 0.38 1.88 0.37 0.00 0.00 175.52 178.51 2j50 h TYR 236 N 0.47 0.90 -0.62 3.16 0.05 0.09 -1.83 116.97 119.19 2j50 h TYR 236 Ca -0.03 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.69 2j50 h TYR 236 Cb 1.25 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 38.68 2j50 h TYR 236 CO 0.09 0.63 0.18 0.82 -1.05 0.00 0.00 178.16 178.83 2j50 h ILE 237 N 0.91 1.24 0.05 -2.88 1.08 -1.29 -2.07 117.51 114.54 2j50 h ILE 237 Ca 0.24 -0.83 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 2j50 h ILE 237 Cb 0.01 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 34.31 2j50 h ILE 237 CO -0.04 0.32 -0.06 0.74 -0.69 0.00 0.00 178.15 178.42 2j50 h THR 238 N 0.92 0.86 -0.55 -0.27 2.02 -1.03 0.40 112.91 115.25 2j50 h THR 238 Ca 0.20 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.42 2j50 h THR 238 Cb 0.28 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 2j50 h THR 238 CO -0.01 0.00 0.32 -0.33 0.37 0.00 0.00 175.52 175.87 2j50 h GLU 239 N -0.13 0.61 -0.21 6.66 5.08 -1.16 0.42 114.58 125.85 2j50 h GLU 239 Ca 0.01 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2j50 h GLU 239 Cb 0.13 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2j50 h GLU 239 CO -0.03 0.40 0.10 -0.07 -1.00 0.00 0.00 179.01 178.42 2j50 h LEU 240 N 0.63 0.26 -0.95 1.33 3.38 -1.10 -1.35 115.31 117.51 2j50 h LEU 240 Ca 0.23 -0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.14 2j50 h LEU 240 Cb 0.06 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2j50 h LEU 240 CO -0.12 0.30 0.62 0.00 0.09 0.00 0.00 178.44 179.33 2j50 h ALA 241 N 0.98 1.28 0.42 1.53 0.00 0.68 0.33 119.26 124.48 2j50 h ALA 241 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2j50 h ALA 241 Cb 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2j50 h ALA 241 CO -0.01 0.46 -0.20 -0.91 0.00 0.00 0.00 179.25 178.59 2j50 h ASN 242 N 1.17 -0.47 -0.42 0.00 -0.26 0.18 -1.68 115.58 114.10 2j50 h ASN 242 Ca 0.39 -0.08 0.05 0.00 -0.56 0.00 0.00 56.30 56.10 2j50 h ASN 242 Cb 0.06 0.12 -0.05 0.00 -1.06 0.00 0.00 38.32 37.40 2j50 h ASN 242 CO -0.14 -0.19 0.15 0.00 -1.06 0.00 0.00 177.43 176.19 2j50 h ALA 243 N -0.26 0.50 -0.31 -0.83 0.00 -0.98 0.12 119.26 117.50 2j50 h ALA 243 Ca -0.06 0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2j50 h ALA 243 Cb 0.52 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2j50 h ALA 243 CO 0.09 -0.24 0.22 -0.07 0.00 0.00 0.00 179.25 179.25 2j50 h LEU 244 N 0.32 0.14 0.01 0.00 3.38 -0.91 -1.43 115.31 116.82 2j50 h LEU 244 Ca 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2j50 h LEU 244 Cb 0.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2j50 h LEU 244 CO -0.19 0.09 -0.01 -1.28 0.09 0.00 0.00 178.44 177.14 2j50 h SER 245 N 0.16 -0.02 -1.15 -0.43 0.87 0.14 -0.75 113.55 112.38 2j50 h SER 245 Ca 0.14 -0.51 0.33 0.00 -1.23 0.00 0.00 61.79 60.52 2j50 h SER 245 Cb 0.36 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.27 2j50 h SER 245 CO -0.02 0.50 0.82 0.22 -0.53 0.00 0.00 176.83 177.82 2j50 h TYR 246 N -0.54 0.08 0.16 2.24 3.20 0.02 0.15 116.97 122.27 2j50 h TYR 246 Ca -0.00 0.00 -0.35 0.00 3.14 0.00 0.00 58.73 61.52 2j50 h TYR 246 Cb 0.52 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.77 2j50 h TYR 246 CO 0.11 0.00 -1.79 0.00 -1.64 0.00 0.00 178.16 174.84 2j50 h HIS 248 N 0.09 0.21 -0.16 0.00 -0.00 0.64 0.26 115.15 116.20 2j50 h HIS 248 Ca -0.35 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.02 2j50 h HIS 248 Cb 2.08 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 29.42 2j50 h HIS 248 CO 0.09 0.11 0.00 -1.13 -0.00 0.00 0.00 177.93 177.00 2j50 n SER 249 N -4.47 0.89 -0.31 3.26 3.41 0.28 -3.37 113.62 113.30 2j50 n SER 249 Ca 0.04 -1.95 0.03 0.00 -0.26 0.00 0.00 58.87 56.73 2j50 n SER 249 Cb 0.27 -0.11 0.04 0.00 -0.26 0.00 0.00 64.21 64.16 2j50 n SER 249 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2j50 n LYS 250 N -0.04 0.50 -2.48 4.33 5.02 0.65 -4.96 118.16 121.17 2j50 n LYS 250 Ca 0.07 -1.44 -0.15 0.00 -2.02 0.00 0.00 58.31 54.77 2j50 n LYS 250 Cb 0.15 -0.81 0.01 0.00 -0.02 0.00 0.00 35.03 34.35 2j50 n LYS 250 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2j50 n ARG 251 N -0.44 -2.08 -5.13 1.97 3.00 -1.06 -5.00 116.66 107.92 2j50 n ARG 251 Ca 0.05 0.67 -0.30 0.00 -0.01 0.00 0.00 57.85 58.25 2j50 n ARG 251 Cb 0.65 -4.96 -0.17 0.00 0.00 0.00 0.00 32.46 27.99 2j50 n ARG 251 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2j50 s VAL 252 N -2.83 1.89 0.35 1.55 1.01 0.33 -4.25 120.40 118.45 2j50 s VAL 252 Ca 0.09 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.16 2j50 s VAL 252 Cb -0.04 -1.62 -0.07 0.00 0.00 0.00 0.00 36.38 34.66 2j50 s VAL 252 CO 0.11 0.53 0.04 -0.63 0.00 0.00 0.00 175.10 175.14 2j50 s ILE 253 N 0.08 1.47 0.14 2.22 1.01 0.14 -2.96 121.20 123.30 2j50 s ILE 253 Ca -0.09 -2.01 0.09 0.00 0.00 0.00 0.00 60.65 58.64 2j50 s ILE 253 Cb -0.15 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 2j50 s ILE 253 CO 0.05 -0.02 -0.21 -2.28 0.00 0.00 0.00 174.94 172.49 2j50 s HIS 254 N -3.10 1.91 0.00 3.97 2.46 -1.26 -0.74 115.29 118.54 2j50 s HIS 254 Ca 0.36 -0.43 0.00 0.00 0.47 0.00 0.00 55.06 55.46 2j50 s HIS 254 Cb 0.09 -1.00 0.00 0.00 -0.13 0.00 0.00 32.58 31.54 2j50 s HIS 254 CO 0.16 0.31 0.00 0.54 -2.47 0.00 0.00 174.74 173.28 2j50 n ARG 255 N 0.65 3.44 -1.33 2.88 1.74 -1.19 -4.34 116.66 118.51 2j50 n ARG 255 Ca -0.16 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.63 2j50 n ARG 255 Cb 0.55 0.00 0.16 0.00 -1.02 0.00 0.00 32.46 32.15 2j50 n ARG 255 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2j50 s ASP 256 N -1.00 2.97 -0.04 0.55 3.84 -1.26 -4.17 116.67 117.56 2j50 s ASP 256 Ca 0.00 1.07 0.01 0.00 -0.00 0.00 0.00 52.55 53.63 2j50 s ASP 256 Cb 0.00 -1.70 0.02 0.00 -1.38 0.00 0.00 42.92 39.87 2j50 s ASP 256 CO 0.00 -2.90 -0.02 -0.63 -0.00 0.00 0.00 175.17 171.62 2j50 s ILE 257 N -3.11 0.38 0.20 2.11 1.01 -1.26 -5.04 121.20 115.49 2j50 s ILE 257 Ca 0.65 -0.01 0.08 0.00 0.00 0.00 0.00 60.65 61.36 2j50 s ILE 257 Cb -0.17 -0.45 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 2j50 s ILE 257 CO 0.56 0.20 -0.01 -0.54 0.00 0.00 0.00 174.94 175.14 2j50 s LYS 258 N 1.07 2.34 0.31 2.79 1.02 -1.26 -4.90 119.74 121.11 2j50 s LYS 258 Ca -0.09 -1.21 0.02 0.00 0.02 0.00 0.00 55.97 54.71 2j50 s LYS 258 Cb -0.14 -2.28 0.50 0.00 -0.52 0.00 0.00 37.83 35.39 2j50 s LYS 258 CO -0.01 0.43 1.83 -1.35 -0.92 0.00 0.00 175.35 175.33 2j50 h PRO 259 N 2.50 0.62 0.00 -1.68 0.11 -1.97 -2.07 132.00 129.51 2j50 h PRO 259 Ca -0.46 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 65.50 2j50 h PRO 259 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2j50 h PRO 259 CO 0.58 0.64 0.11 0.39 -0.21 0.00 0.00 178.00 179.51 2j50 n GLU 260 N -4.25 0.12 -0.44 1.05 4.71 -1.26 -1.19 120.64 119.37 2j50 n GLU 260 Ca 0.02 0.61 0.08 0.00 -0.01 0.00 0.00 57.16 57.86 2j50 n GLU 260 Cb 0.27 -2.00 0.26 0.00 -1.01 0.00 0.00 31.44 28.95 2j50 n GLU 260 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2j50 n ASN 261 N -2.17 3.91 -4.15 1.62 3.02 -0.78 -4.92 115.26 111.79 2j50 n ASN 261 Ca -0.01 -2.80 -0.33 0.00 -0.03 0.00 0.00 54.58 51.41 2j50 n ASN 261 Cb 0.14 -0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 38.65 2j50 n ASN 261 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2j50 s LEU 262 N -2.44 2.17 0.34 3.41 1.43 -0.34 -1.87 118.68 121.38 2j50 s LEU 262 Ca 0.40 -0.62 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 2j50 s LEU 262 Cb 0.31 -1.48 -0.01 0.00 0.03 0.00 0.00 46.19 45.03 2j50 s LEU 262 CO 0.11 0.03 0.42 -0.76 0.23 0.00 0.00 176.35 176.38 2j50 s LEU 263 N 1.14 3.84 -0.08 1.79 1.43 -0.59 0.60 118.68 126.80 2j50 s LEU 263 Ca 0.01 -0.30 0.05 0.00 -1.03 0.00 0.00 54.13 52.86 2j50 s LEU 263 Cb -0.14 -2.58 -0.00 0.00 0.03 0.00 0.00 46.19 43.50 2j50 s LEU 263 CO -0.09 -0.43 -0.24 -0.76 0.23 0.00 0.00 176.35 175.06 2j50 s LEU 264 N -4.13 2.06 0.00 1.79 1.43 0.18 0.05 118.68 120.07 2j50 s LEU 264 Ca 0.44 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2j50 s LEU 264 Cb -0.08 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.78 2j50 s LEU 264 CO 0.30 0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.68 2j50 n GLY 265 N 3.27 -1.23 0.27 -3.19 0.00 0.45 -2.32 105.19 102.45 2j50 n GLY 265 Ca -0.18 -1.64 -0.09 0.00 0.00 0.00 0.00 46.02 44.11 2j50 n GLY 265 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2j50 h SER 266 N -0.10 0.91 -0.05 1.61 4.64 -1.89 -2.91 113.55 115.75 2j50 h SER 266 Ca 0.00 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2j50 h SER 266 Cb 0.00 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 2j50 h SER 266 CO 0.00 0.95 0.00 0.00 -0.87 0.00 0.00 176.83 176.91 2j50 n ALA 267 N -2.43 2.55 -1.04 5.18 0.00 -1.26 -4.80 120.51 118.71 2j50 n ALA 267 Ca 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 2j50 n ALA 267 Cb 0.28 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 2j50 n ALA 267 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j50 n GLY 268 N 0.30 0.51 3.74 0.00 0.00 -1.10 -5.00 105.19 103.64 2j50 n GLY 268 Ca 0.02 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.14 2j50 n GLY 268 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2j50 s GLU 269 N -1.27 4.62 0.58 1.61 1.03 -1.26 -4.74 118.70 119.28 2j50 s GLU 269 Ca 0.00 1.29 -0.17 0.00 0.03 0.00 0.00 54.97 56.12 2j50 s GLU 269 Cb 0.00 -3.36 -0.04 0.00 -0.80 0.00 0.00 34.13 29.93 2j50 s GLU 269 CO 0.00 0.28 1.07 -1.17 -1.33 0.00 0.00 175.26 174.11 2j50 s LEU 270 N -0.14 3.56 -0.08 1.83 0.20 -1.26 0.17 118.68 122.96 2j50 s LEU 270 Ca 0.43 1.91 -0.03 0.00 0.69 0.00 0.00 54.13 57.12 2j50 s LEU 270 Cb -0.22 -4.55 0.05 0.00 -0.43 0.00 0.00 46.19 41.04 2j50 s LEU 270 CO 0.27 -1.20 0.16 -0.54 -0.29 0.00 0.00 176.35 174.75 2j50 s LYS 271 N -3.86 0.04 -0.32 1.98 3.01 0.11 -4.42 119.74 116.29 2j50 s LYS 271 Ca 0.66 0.53 -0.29 0.00 -1.01 0.00 0.00 55.97 55.85 2j50 s LYS 271 Cb -0.18 -0.25 -0.00 0.00 -1.01 0.00 0.00 37.83 36.39 2j50 s LYS 271 CO 0.34 -0.28 1.41 0.42 0.51 0.00 0.00 175.35 177.75 2j50 s ILE 272 N 2.07 3.97 -0.30 2.17 1.01 -0.74 -1.55 121.20 127.83 2j50 s ILE 272 Ca 0.01 1.06 0.07 0.00 0.00 0.00 0.00 60.65 61.79 2j50 s ILE 272 Cb -0.12 -4.06 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 2j50 s ILE 272 CO -0.06 -0.51 0.28 0.00 0.00 0.00 0.00 174.94 174.65 2j50 n ALA 273 N 8.20 2.84 -0.69 9.38 0.00 -0.78 -0.97 120.51 138.48 2j50 n ALA 273 Ca 0.16 -0.19 -0.29 0.00 0.00 0.00 0.00 53.44 53.12 2j50 n ALA 273 Cb 0.47 -0.25 0.25 0.00 0.00 0.00 0.00 19.45 19.92 2j50 n ALA 273 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2j50 s ASP 274 N -1.75 0.53 -0.27 0.00 1.47 -1.21 -4.91 116.67 110.53 2j50 s ASP 274 Ca 0.02 1.08 0.09 0.00 1.18 0.00 0.00 52.55 54.92 2j50 s ASP 274 Cb 0.05 -1.62 0.48 0.00 -0.34 0.00 0.00 42.92 41.49 2j50 s ASP 274 CO 0.28 -4.41 1.40 0.49 0.68 0.00 0.00 175.17 173.61 2j50 n PHE 275 N -5.01 0.81 -2.13 2.11 0.99 -1.26 -4.89 117.46 108.08 2j50 n PHE 275 Ca 0.08 -1.60 -0.42 0.00 -0.00 0.00 0.00 57.45 55.51 2j50 n PHE 275 Cb 0.58 -0.43 -0.00 0.00 -1.00 0.00 0.00 39.48 38.62 2j50 n PHE 275 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2j50 n GLY 276 N -1.12 4.83 3.79 1.37 0.00 -1.26 -4.84 105.19 107.95 2j50 n GLY 276 Ca 0.30 -2.01 -0.26 0.00 0.00 0.00 0.00 46.02 44.05 2j50 n GLY 276 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j50 s TRP 277 N 0.33 3.12 -0.22 1.61 0.52 -1.26 -3.16 118.94 119.88 2j50 s TRP 277 Ca 0.46 -0.02 -0.17 0.00 0.02 0.00 0.00 56.10 56.38 2j50 s TRP 277 Cb 0.13 -1.51 0.06 0.00 -1.15 0.00 0.00 33.47 31.01 2j50 s TRP 277 CO -0.03 0.52 0.57 0.45 0.02 0.00 0.00 176.95 178.48 2j50 s SER 278 N -3.06 -0.67 -0.07 2.95 0.15 0.08 -4.72 113.70 108.37 2j50 s SER 278 Ca 0.31 1.19 0.13 0.00 0.70 0.00 0.00 55.95 58.28 2j50 s SER 278 Cb -0.10 1.15 0.38 0.00 -1.71 0.00 0.00 66.02 65.74 2j50 s SER 278 CO 0.23 -0.21 1.31 0.55 1.20 0.00 0.00 173.24 176.32 2j50 n VAL 279 N 3.42 1.51 -0.66 4.45 3.14 -1.26 0.24 118.33 129.17 2j50 n VAL 279 Ca -0.17 -1.36 0.00 0.00 -2.96 0.00 0.00 64.34 59.85 2j50 n VAL 279 Cb 0.57 0.20 0.00 0.00 -1.06 0.00 0.00 33.84 33.54 2j50 n VAL 279 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2j50 n THR 288 N 0.07 -1.46 -1.29 1.55 -2.24 -1.26 -4.88 114.28 104.77 2j50 n THR 288 Ca 0.15 0.67 0.00 0.00 -2.27 0.00 0.00 64.05 62.60 2j50 n THR 288 Cb 0.61 -1.07 0.00 0.00 -2.10 0.00 0.00 70.33 67.77 2j50 n THR 288 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2j50 n LEU 289 N -1.81 -4.95 -4.59 3.22 4.77 -1.26 -4.97 117.00 107.41 2j50 n LEU 289 Ca 0.00 2.19 -0.34 0.00 -0.03 0.00 0.00 56.01 57.82 2j50 n LEU 289 Cb 0.17 -1.86 -0.11 0.00 -2.33 0.00 0.00 43.42 39.30 2j50 n LEU 289 CO 0.00 -0.52 -0.28 0.00 -1.33 0.00 0.00 177.39 175.26 2j50 n GLY 291 N 3.61 0.30 0.10 0.00 0.00 -1.26 -4.94 105.19 103.00 2j50 n GLY 291 Ca -0.17 -0.60 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 2j50 n GLY 291 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2j50 n THR 292 N -3.67 1.29 -0.28 2.61 -1.04 -1.26 -4.62 114.28 107.29 2j50 n THR 292 Ca -0.09 -0.64 0.08 0.00 -2.04 0.00 0.00 64.05 61.36 2j50 n THR 292 Cb 0.48 -0.92 0.23 0.00 -1.82 0.00 0.00 70.33 68.31 2j50 n THR 292 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2j50 h LEU 293 N 0.00 0.38 -2.26 -4.42 5.85 -1.92 -1.19 115.31 111.74 2j50 h LEU 293 Ca -0.50 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2j50 h LEU 293 Cb 1.96 0.07 0.00 0.00 0.37 0.00 0.00 40.66 43.06 2j50 h LEU 293 CO -0.03 0.12 0.05 0.44 -0.34 0.00 0.00 178.44 178.68 2j50 h ASP 294 N 0.49 0.00 -0.18 1.25 3.32 -1.94 -2.01 116.42 117.35 2j50 h ASP 294 Ca 0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.52 2j50 h ASP 294 Cb 0.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2j50 h ASP 294 CO -0.42 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 175.88 2j50 n TYR 295 N -2.73 0.24 -3.44 4.55 4.02 -0.46 -4.77 117.16 114.56 2j50 n TYR 295 Ca -0.02 -0.27 -0.34 0.00 -0.01 0.00 0.00 57.90 57.26 2j50 n TYR 295 Cb 0.10 -0.02 -0.05 0.00 -0.02 0.00 0.00 39.34 39.35 2j50 n TYR 295 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2j50 s LEU 296 N -0.94 4.27 0.54 7.72 1.43 -0.76 -4.53 118.68 126.41 2j50 s LEU 296 Ca 0.17 0.93 -0.01 0.00 -1.03 0.00 0.00 54.13 54.19 2j50 s LEU 296 Cb 0.10 -3.38 0.02 0.00 0.03 0.00 0.00 46.19 42.96 2j50 s LEU 296 CO 0.14 0.04 0.79 -2.16 0.23 0.00 0.00 176.35 175.39 2j50 s PRO 297 N -2.34 2.70 0.03 1.29 0.04 -1.26 -5.00 135.00 130.46 2j50 s PRO 297 Ca 0.41 -0.55 -0.07 0.00 0.04 0.00 0.00 61.00 60.83 2j50 s PRO 297 Cb -0.13 -2.45 -0.02 0.00 0.04 0.00 0.00 34.50 31.94 2j50 s PRO 297 CO 0.20 -0.64 1.11 -1.35 0.04 0.00 0.00 177.00 176.37 2j50 h PRO 298 N 0.06 -0.05 -1.25 0.56 0.11 -1.89 -2.32 132.00 127.22 2j50 h PRO 298 Ca -0.44 0.00 0.38 0.00 0.11 0.00 0.00 66.00 66.05 2j50 h PRO 298 Cb 1.28 0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.30 2j50 h PRO 298 CO 0.56 -0.03 0.82 1.05 -0.21 0.00 0.00 178.00 180.18 2j50 h GLU 299 N -0.05 0.17 0.00 1.05 9.09 -1.96 0.25 114.58 123.13 2j50 h GLU 299 Ca 0.02 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.42 2j50 h GLU 299 Cb 0.11 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 2j50 h GLU 299 CO -0.15 0.11 0.00 -1.33 0.05 0.00 0.00 179.01 177.69 2j50 n MET 300 N -4.59 0.78 0.00 1.06 2.81 -0.87 -3.61 117.12 112.70 2j50 n MET 300 Ca 0.32 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.21 2j50 n MET 300 Cb 1.26 -1.16 0.00 0.00 -0.71 0.00 0.00 33.22 32.61 2j50 n MET 300 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 2j50 n ILE 301 N -0.66 0.00 -0.06 2.02 -5.35 0.75 -4.94 119.36 111.13 2j50 n ILE 301 Ca 0.06 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.32 2j50 n ILE 301 Cb 0.03 0.19 -0.13 0.00 -1.74 0.00 0.00 39.64 37.99 2j50 n ILE 301 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2j50 h GLU 302 N 0.00 0.11 -1.42 6.28 5.08 -1.21 -3.52 114.58 119.90 2j50 h GLU 302 Ca 0.00 -0.19 0.15 0.00 -1.00 0.00 0.00 59.36 58.33 2j50 h GLU 302 Cb 0.00 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 2j50 h GLU 302 CO 0.00 1.09 -0.40 -0.40 -1.00 0.00 0.00 179.01 178.30 2j50 n ASP 307 N -4.09 -3.60 -0.76 1.42 3.85 -1.26 -5.08 116.55 107.03 2j50 n ASP 307 Ca -0.31 0.45 0.00 0.00 -0.71 0.00 0.00 54.79 54.22 2j50 n ASP 307 Cb 0.82 -1.97 0.00 0.00 -1.35 0.00 0.00 41.12 38.61 2j50 n ASP 307 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 2j50 n GLU 308 N -3.23 0.00 -0.00 0.11 0.00 -1.26 -2.54 120.64 113.72 2j50 n GLU 308 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.19 2j50 n GLU 308 Cb 0.28 -0.68 -0.07 0.00 0.00 0.00 0.00 31.44 30.97 2j50 n GLU 308 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2j50 n LYS 309 N 0.29 2.08 -0.04 3.44 4.76 -1.26 -4.55 118.16 122.88 2j50 n LYS 309 Ca 0.00 -0.04 -0.11 0.00 -2.87 0.00 0.00 58.31 55.28 2j50 n LYS 309 Cb 0.00 -1.10 -0.06 0.00 -1.84 0.00 0.00 35.03 32.03 2j50 n LYS 309 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2j50 h VAL 310 N 0.00 1.20 -0.75 -0.18 2.07 -1.80 -2.88 116.25 113.91 2j50 h VAL 310 Ca 0.00 -0.62 0.16 0.00 0.82 0.00 0.00 66.70 67.07 2j50 h VAL 310 Cb 0.35 1.34 -0.14 0.00 -1.52 0.00 0.00 31.29 31.32 2j50 h VAL 310 CO 0.00 0.18 -0.08 0.44 0.02 0.00 0.00 177.57 178.13 2j50 h ASP 311 N 0.03 -0.51 -0.03 0.57 5.19 -1.76 0.42 116.42 120.33 2j50 h ASP 311 Ca 0.04 0.21 -0.01 0.00 -0.62 0.00 0.00 57.03 56.66 2j50 h ASP 311 Cb 0.25 0.40 -0.00 0.00 0.18 0.00 0.00 39.33 40.16 2j50 h ASP 311 CO 0.00 -0.21 0.01 -0.07 -3.12 0.00 0.00 179.24 175.84 2j50 h LEU 312 N 0.05 0.07 -0.34 1.55 3.38 -1.76 0.83 115.31 119.09 2j50 h LEU 312 Ca 0.39 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.17 2j50 h LEU 312 Cb 0.65 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2j50 h LEU 312 CO -0.71 0.09 -0.59 -0.25 0.09 0.00 0.00 178.44 177.06 2j50 h TRP 313 N 0.09 0.97 -0.31 1.13 2.91 -0.12 -2.79 115.95 117.83 2j50 h TRP 313 Ca 0.02 -0.36 0.05 0.00 1.13 0.00 0.00 58.89 59.73 2j50 h TRP 313 Cb 0.05 -0.18 -0.05 0.00 -0.51 0.00 0.00 29.16 28.47 2j50 h TRP 313 CO 0.00 1.17 -0.00 0.77 -1.03 0.00 0.00 178.44 179.35 2j50 h SER 314 N 0.57 -0.12 -0.55 2.65 0.02 0.32 -0.06 113.55 116.38 2j50 h SER 314 Ca 0.00 0.07 0.06 0.00 -0.84 0.00 0.00 61.79 61.08 2j50 h SER 314 Cb 1.19 0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.80 2j50 h SER 314 CO 0.12 -0.03 0.26 -0.07 -1.14 0.00 0.00 176.83 175.98 2j50 h LEU 315 N 0.09 0.36 -1.09 5.07 4.07 -1.05 1.58 115.31 124.34 2j50 h LEU 315 Ca 0.15 0.04 0.01 0.00 0.08 0.00 0.00 57.88 58.16 2j50 h LEU 315 Cb 0.20 -0.02 -0.05 0.00 1.08 0.00 0.00 40.66 41.87 2j50 h LEU 315 CO -0.25 0.24 0.62 1.23 -1.08 0.00 0.00 178.44 179.20 2j50 h GLY 316 N 0.50 1.31 0.88 0.83 0.00 -1.07 0.69 103.07 106.22 2j50 h GLY 316 Ca 0.25 -0.48 -0.18 0.00 0.00 0.00 0.00 47.33 46.91 2j50 h GLY 316 CO -0.19 0.46 -0.72 -2.08 0.00 0.00 0.00 176.54 174.01 2j50 h VAL 317 N 1.24 1.40 -0.55 4.60 2.07 0.44 -2.71 116.25 122.74 2j50 h VAL 317 Ca 0.35 -2.15 -0.07 0.00 0.82 0.00 0.00 66.70 65.65 2j50 h VAL 317 Cb -0.12 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 2j50 h VAL 317 CO -0.08 0.63 0.07 -0.07 0.02 0.00 0.00 177.57 178.14 2j50 h LEU 318 N -0.00 0.85 -0.46 2.57 3.38 0.26 -1.74 115.31 120.17 2j50 h LEU 318 Ca -0.09 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 2j50 h LEU 318 Cb 1.43 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 2j50 h LEU 318 CO 0.14 0.87 0.06 0.00 0.09 0.00 0.00 178.44 179.61 2j50 h TYR 320 N 0.63 -0.02 0.26 0.00 3.20 -1.27 -2.37 116.97 117.39 2j50 h TYR 320 Ca 0.14 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.99 2j50 h TYR 320 Cb 0.40 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2j50 h TYR 320 CO 0.03 0.14 -0.12 1.49 -1.64 0.00 0.00 178.16 178.06 2j50 h GLU 321 N -0.19 -0.33 -1.05 1.82 4.81 -1.29 0.78 114.58 119.13 2j50 h GLU 321 Ca -0.00 0.02 0.35 0.00 -0.13 0.00 0.00 59.36 59.60 2j50 h GLU 321 Cb 0.18 0.08 -0.15 0.00 0.63 0.00 0.00 28.75 29.49 2j50 h GLU 321 CO 0.00 -0.22 0.62 0.74 -0.73 0.00 0.00 179.01 179.42 2j50 h PHE 322 N -0.35 0.84 0.14 0.92 0.05 -1.03 0.54 116.94 118.04 2j50 h PHE 322 Ca -0.04 0.03 -0.30 0.00 3.82 0.00 0.00 57.97 61.49 2j50 h PHE 322 Cb 0.27 -0.22 0.00 0.00 2.00 0.00 0.00 35.95 38.00 2j50 h PHE 322 CO -0.06 -0.21 -1.51 -0.07 -0.18 0.00 0.00 178.31 176.28 2j50 h LEU 323 N 0.24 0.47 0.00 1.54 3.38 -0.88 0.22 115.31 120.28 2j50 h LEU 323 Ca 0.76 -0.89 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2j50 h LEU 323 Cb 1.89 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.48 2j50 h LEU 323 CO -0.58 1.67 -0.54 0.58 0.09 0.00 0.00 178.44 179.66 2j50 h VAL 324 N -0.16 0.43 0.00 1.22 2.07 -0.11 -3.41 116.25 116.29 2j50 h VAL 324 Ca -0.31 -1.45 0.00 0.00 0.82 0.00 0.00 66.70 65.76 2j50 h VAL 324 Cb 1.88 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 2j50 h VAL 324 CO 0.11 0.15 0.00 0.61 0.02 0.00 0.00 177.57 178.45 2j50 n GLY 325 N 1.60 1.16 3.11 2.17 0.00 0.18 -4.63 105.19 108.78 2j50 n GLY 325 Ca -0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 2j50 n GLY 325 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j50 s LYS 326 N 0.00 0.66 0.86 1.61 -2.85 -1.26 -4.97 119.74 113.79 2j50 s LYS 326 Ca 0.00 -1.16 -0.11 0.00 -1.00 0.00 0.00 55.97 53.71 2j50 s LYS 326 Cb 0.00 -0.02 0.11 0.00 -2.06 0.00 0.00 37.83 35.87 2j50 s LYS 326 CO 0.00 -0.05 1.11 -2.14 0.10 0.00 0.00 175.35 174.37 2j50 s PRO 327 N -3.40 1.49 0.40 1.78 0.02 -1.26 -3.87 135.00 130.15 2j50 s PRO 327 Ca 0.05 1.23 0.14 0.00 0.02 0.00 0.00 61.00 62.44 2j50 s PRO 327 Cb 0.03 -1.81 0.83 0.00 0.02 0.00 0.00 34.50 33.57 2j50 s PRO 327 CO -0.06 -2.20 1.87 -1.00 -0.33 0.00 0.00 177.00 175.28 2j50 h PRO 328 N -1.54 0.00 -0.18 5.54 0.13 -1.88 -3.29 132.00 130.79 2j50 h PRO 328 Ca -0.45 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 2j50 h PRO 328 Cb 1.26 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2j50 h PRO 328 CO 0.48 0.32 -0.07 1.19 -0.23 0.00 0.00 178.00 179.69 2j50 n PHE 329 N -4.07 0.60 -2.32 1.56 3.01 -1.26 -4.63 117.46 110.35 2j50 n PHE 329 Ca -0.02 -1.14 -0.42 0.00 1.01 0.00 0.00 57.45 56.88 2j50 n PHE 329 Cb 0.37 -0.30 -0.03 0.00 -0.01 0.00 0.00 39.48 39.51 2j50 n PHE 329 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2j50 s GLU 330 N -2.98 4.39 0.00 -1.08 2.12 -1.24 -4.55 118.70 115.35 2j50 s GLU 330 Ca 0.39 1.90 0.00 0.00 0.36 0.00 0.00 54.97 57.62 2j50 s GLU 330 Cb 0.34 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 31.43 2j50 s GLU 330 CO 0.03 -0.32 0.00 0.00 -0.54 0.00 0.00 175.26 174.43 2j50 n ALA 331 N 3.86 0.00 0.01 6.30 0.00 -1.26 -4.98 120.51 124.44 2j50 n ALA 331 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 2j50 n ALA 331 Cb 0.45 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 2j50 n ALA 331 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2j50 n ASN 332 N -0.44 0.74 -4.06 0.00 3.02 -1.26 -4.93 115.26 108.32 2j50 n ASN 332 Ca 0.00 0.33 -0.09 0.00 -0.03 0.00 0.00 54.58 54.79 2j50 n ASN 332 Cb 0.00 0.32 -0.10 0.00 -0.61 0.00 0.00 39.78 39.38 2j50 n ASN 332 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2j50 s THR 333 N -2.89 0.29 0.15 3.41 -4.23 -1.26 -5.08 115.64 106.04 2j50 s THR 333 Ca -0.04 -1.47 -0.22 0.00 -1.18 0.00 0.00 61.69 58.78 2j50 s THR 333 Cb 0.09 -1.06 0.04 0.00 1.34 0.00 0.00 72.50 72.91 2j50 s THR 333 CO 0.82 -0.76 1.62 0.22 -0.54 0.00 0.00 174.62 175.98 2j50 h TYR 334 N 3.73 -0.68 -0.26 3.99 3.20 -2.00 -1.66 116.97 123.30 2j50 h TYR 334 Ca -0.34 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.63 2j50 h TYR 334 Cb 1.17 0.34 -0.05 0.00 1.54 0.00 0.00 36.73 39.73 2j50 h TYR 334 CO 0.59 -0.33 -0.08 1.96 -1.64 0.00 0.00 178.16 178.66 2j50 h GLN 335 N -0.25 -0.03 0.33 1.82 7.50 -1.99 -1.42 115.11 121.06 2j50 h GLN 335 Ca 0.15 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.30 2j50 h GLN 335 Cb 0.47 0.01 -0.03 0.00 0.05 0.00 0.00 27.48 27.98 2j50 h GLN 335 CO -0.42 -0.02 -0.45 1.49 -1.50 0.00 0.00 178.83 177.93 2j50 h GLU 336 N -0.03 -0.80 -0.71 1.46 4.57 -1.90 -1.90 114.58 115.27 2j50 h GLU 336 Ca 0.13 0.05 0.08 0.00 -1.18 0.00 0.00 59.36 58.45 2j50 h GLU 336 Cb 0.23 0.18 -0.11 0.00 -0.16 0.00 0.00 28.75 28.89 2j50 h GLU 336 CO -0.28 -0.53 -0.52 1.15 -1.18 0.00 0.00 179.01 177.65 2j50 h THR 337 N -0.83 0.02 -0.80 0.32 2.02 -0.93 0.22 112.91 112.92 2j50 h THR 337 Ca -0.02 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.32 2j50 h THR 337 Cb 0.77 0.02 -0.15 0.00 -1.74 0.00 0.00 68.15 67.05 2j50 h THR 337 CO -0.14 0.00 -0.19 0.22 0.37 0.00 0.00 175.52 175.79 2j50 h TYR 338 N -0.18 -0.40 -0.02 3.16 3.20 -0.90 0.13 116.97 121.95 2j50 h TYR 338 Ca 0.16 0.07 -0.04 0.00 3.14 0.00 0.00 58.73 62.06 2j50 h TYR 338 Cb 0.53 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 2j50 h TYR 338 CO -0.84 -0.34 -0.16 0.87 -1.64 0.00 0.00 178.16 176.05 2j50 h LYS 339 N 0.00 0.04 -0.03 1.82 1.57 0.20 0.36 116.57 120.54 2j50 h LYS 339 Ca 0.39 -0.01 -0.21 0.00 -1.87 0.00 0.00 60.65 58.95 2j50 h LYS 339 Cb 0.60 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 32.92 2j50 h LYS 339 CO -0.82 0.19 -0.80 0.00 -0.57 0.00 0.00 179.45 177.45 2j50 h ARG 340 N 0.04 0.59 -0.36 3.15 3.08 -0.19 -0.94 114.38 119.75 2j50 h ARG 340 Ca 0.01 -0.60 -0.06 0.00 0.07 0.00 0.00 59.98 59.40 2j50 h ARG 340 Cb 0.30 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2j50 h ARG 340 CO 0.02 1.21 -0.00 0.82 -1.07 0.00 0.00 179.97 180.96 2j50 h ILE 341 N 0.20 1.26 -0.00 2.04 2.04 -1.06 0.16 117.51 122.14 2j50 h ILE 341 Ca -0.09 -0.99 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 2j50 h ILE 341 Cb 1.48 1.18 -0.00 0.00 -0.74 0.00 0.00 36.82 38.74 2j50 h ILE 341 CO 0.16 0.33 0.00 -1.28 0.00 0.00 0.00 178.15 177.36 2j50 h SER 342 N 0.46 0.01 -0.15 1.72 0.87 -0.95 -2.84 113.55 112.66 2j50 h SER 342 Ca 0.10 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2j50 h SER 342 Cb 0.46 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 2j50 h SER 342 CO 0.02 0.15 0.00 0.54 -0.53 0.00 0.00 176.83 177.01 2j50 n ARG 343 N -5.02 1.59 -3.50 2.24 1.74 -0.36 -4.94 116.66 108.41 2j50 n ARG 343 Ca -0.07 -0.89 -0.21 0.00 -0.77 0.00 0.00 57.85 55.92 2j50 n ARG 343 Cb 0.10 -1.35 0.03 0.00 -1.02 0.00 0.00 32.46 30.21 2j50 n ARG 343 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2j50 n VAL 344 N 0.12 -6.78 -3.84 1.55 0.31 0.32 -4.97 118.33 105.05 2j50 n VAL 344 Ca 0.15 -0.62 -0.35 0.00 -0.01 0.00 0.00 64.34 63.51 2j50 n VAL 344 Cb 0.27 -4.93 -0.13 0.00 -0.91 0.00 0.00 33.84 28.14 2j50 n VAL 344 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2j50 s GLU 345 N -4.85 2.11 0.07 5.55 2.02 0.06 -5.04 118.70 118.62 2j50 s GLU 345 Ca 0.25 -1.63 -0.07 0.00 0.02 0.00 0.00 54.97 53.55 2j50 s GLU 345 Cb -0.08 -3.42 -0.01 0.00 0.10 0.00 0.00 34.13 30.72 2j50 s GLU 345 CO 0.83 -0.90 0.13 -0.59 0.02 0.00 0.00 175.26 174.75 2j50 s PHE 346 N 1.16 0.22 0.03 1.61 -0.12 -1.26 -4.79 117.98 114.83 2j50 s PHE 346 Ca 0.04 -0.62 0.02 0.00 -0.05 0.00 0.00 56.93 56.31 2j50 s PHE 346 Cb -0.21 -0.13 -0.02 0.00 -0.63 0.00 0.00 43.02 42.02 2j50 s PHE 346 CO -0.03 -0.47 -0.06 0.95 -0.05 0.00 0.00 175.22 175.56 2j50 s THR 347 N -3.49 0.42 -0.14 -4.49 -4.23 -1.26 -5.14 115.64 97.30 2j50 s THR 347 Ca 0.02 -0.91 -0.20 0.00 -1.18 0.00 0.00 61.69 59.42 2j50 s THR 347 Cb 0.04 -0.49 -0.04 0.00 1.34 0.00 0.00 72.50 73.35 2j50 s THR 347 CO -0.09 -0.34 0.55 -0.36 -0.54 0.00 0.00 174.62 173.85 2j50 s PHE 348 N -1.21 3.47 0.56 3.99 0.40 -1.26 -5.06 117.98 118.88 2j50 s PHE 348 Ca -0.10 0.94 -0.19 0.00 -0.60 0.00 0.00 56.93 56.98 2j50 s PHE 348 Cb -0.09 -2.67 -0.05 0.00 0.51 0.00 0.00 43.02 40.73 2j50 s PHE 348 CO 0.00 0.04 1.17 -2.14 0.70 0.00 0.00 175.22 174.99 2j50 s PRO 349 N 1.09 3.19 0.08 0.24 0.02 -1.26 -4.88 135.00 133.49 2j50 s PRO 349 Ca 0.28 1.73 -0.10 0.00 0.02 0.00 0.00 61.00 62.93 2j50 s PRO 349 Cb -0.16 -1.99 0.04 0.00 0.02 0.00 0.00 34.50 32.42 2j50 s PRO 349 CO 0.12 -1.01 0.65 -0.25 -0.33 0.00 0.00 177.00 176.18 2j50 n ASP 350 N -1.39 -0.35 0.00 2.53 10.43 -1.26 -0.65 116.55 125.86 2j50 n ASP 350 Ca 0.12 0.74 0.05 0.00 2.57 0.00 0.00 54.79 58.27 2j50 n ASP 350 Cb 0.50 -0.14 0.21 0.00 1.84 0.00 0.00 41.12 43.54 2j50 n ASP 350 CO 0.00 0.00 0.00 2.22 -1.07 0.00 0.00 177.20 178.35 2j50 n PHE 351 N -4.58 0.00 -2.03 1.24 1.16 -1.26 -4.74 117.46 107.25 2j50 n PHE 351 Ca 0.03 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.20 2j50 n PHE 351 Cb 0.14 -0.50 -0.03 0.00 -1.61 0.00 0.00 39.48 37.49 2j50 n PHE 351 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2j50 s VAL 352 N -2.99 3.44 0.66 1.97 1.01 0.17 -4.94 120.40 119.72 2j50 s VAL 352 Ca 0.05 0.37 -0.17 0.00 0.00 0.00 0.00 61.98 62.23 2j50 s VAL 352 Cb 0.06 -3.80 -0.12 0.00 0.00 0.00 0.00 36.38 32.53 2j50 s VAL 352 CO 0.18 -0.65 -0.03 1.07 0.00 0.00 0.00 175.10 175.67 2j50 n THR 353 N 7.32 0.66 0.06 3.92 5.66 -1.26 -4.74 114.28 125.90 2j50 n THR 353 Ca 0.22 -0.47 -0.08 0.00 -3.05 0.00 0.00 64.05 60.67 2j50 n THR 353 Cb 0.50 -0.25 0.07 0.00 -1.55 0.00 0.00 70.33 69.09 2j50 n THR 353 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 2j50 h GLU 354 N -0.26 0.33 -0.51 1.09 4.22 -1.96 -2.35 114.58 115.14 2j50 h GLU 354 Ca -0.43 -0.25 -0.06 0.00 0.08 0.00 0.00 59.36 58.70 2j50 h GLU 354 Cb 1.39 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.67 2j50 h GLU 354 CO 0.39 0.88 0.07 0.78 -2.18 0.00 0.00 179.01 178.96 2j50 h GLY 355 N 1.40 0.87 1.61 1.92 0.00 -2.00 -1.25 103.07 105.61 2j50 h GLY 355 Ca -0.02 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 46.71 2j50 h GLY 355 CO 0.11 0.50 -0.14 0.00 0.00 0.00 0.00 176.54 177.01 2j50 h ALA 356 N 1.31 1.25 0.00 3.60 0.00 -1.87 -2.71 119.26 120.84 2j50 h ALA 356 Ca 0.16 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2j50 h ALA 356 Cb 0.36 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2j50 h ALA 356 CO 0.01 0.49 -0.27 0.00 0.00 0.00 0.00 179.25 179.48 2j50 h ARG 357 N 0.44 0.00 -0.12 0.00 3.08 -0.71 -2.80 114.38 114.27 2j50 h ARG 357 Ca 0.08 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.90 2j50 h ARG 357 Cb 0.50 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.56 2j50 h ARG 357 CO 0.03 0.27 -0.84 0.22 -1.07 0.00 0.00 179.97 178.58 2j50 h ASP 358 N 0.00 0.94 -0.07 7.04 1.82 -1.02 -3.12 116.42 122.01 2j50 h ASP 358 Ca -0.00 -0.65 -0.16 0.00 -0.39 0.00 0.00 57.03 55.84 2j50 h ASP 358 Cb 0.80 -0.28 0.01 0.00 0.68 0.00 0.00 39.33 40.53 2j50 h ASP 358 CO 0.03 1.45 -0.56 0.25 -1.61 0.00 0.00 179.24 178.80 2j50 h LEU 359 N 0.51 0.62 -1.58 2.28 5.85 -1.53 -2.39 115.31 119.09 2j50 h LEU 359 Ca -0.07 -0.68 -0.04 0.00 0.84 0.00 0.00 57.88 57.93 2j50 h LEU 359 Cb 1.47 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 2j50 h LEU 359 CO 0.17 1.20 -0.20 0.40 -0.34 0.00 0.00 178.44 179.68 2j50 h ILE 360 N 0.09 1.15 -0.02 4.05 2.04 -1.62 -1.54 117.51 121.66 2j50 h ILE 360 Ca -0.05 -0.71 -0.22 0.00 1.00 0.00 0.00 64.86 64.88 2j50 h ILE 360 Cb 1.22 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 2j50 h ILE 360 CO 0.11 0.20 -0.91 0.28 0.00 0.00 0.00 178.15 177.84 2j50 h SER 361 N 0.02 0.55 1.39 1.72 0.02 -1.54 0.33 113.55 116.04 2j50 h SER 361 Ca 0.00 -0.43 -0.04 0.00 -0.84 0.00 0.00 61.79 60.48 2j50 h SER 361 Cb 0.36 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2j50 h SER 361 CO 0.03 1.22 -0.19 0.03 -1.14 0.00 0.00 176.83 176.78 2j50 h ARG 362 N 0.25 0.00 0.11 3.45 3.08 -1.02 -3.24 114.38 117.02 2j50 h ARG 362 Ca -0.07 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.68 2j50 h ARG 362 Cb 1.54 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.58 2j50 h ARG 362 CO 0.16 0.19 -1.52 -0.07 -1.07 0.00 0.00 179.97 177.65 2j50 h LEU 363 N 0.00 0.38 -4.09 3.04 3.38 -1.25 -3.33 115.31 113.43 2j50 h LEU 363 Ca -0.00 -0.85 -0.17 0.00 0.09 0.00 0.00 57.88 56.94 2j50 h LEU 363 Cb 0.93 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.50 2j50 h LEU 363 CO 0.02 1.66 -0.31 0.18 0.09 0.00 0.00 178.44 180.09 2j50 n LEU 364 N -3.86 4.75 -4.76 1.67 4.77 0.10 -4.44 117.00 115.22 2j50 n LEU 364 Ca -0.27 -2.93 -0.39 0.00 -0.03 0.00 0.00 56.01 52.40 2j50 n LEU 364 Cb 0.92 -1.29 -0.06 0.00 -2.33 0.00 0.00 43.42 40.67 2j50 n LEU 364 CO 0.40 1.49 0.27 -0.54 -1.33 0.00 0.00 177.39 177.69 2j50 s LYS 365 N 1.19 4.30 0.46 3.23 3.01 -1.26 -4.94 119.74 125.73 2j50 s LYS 365 Ca 0.61 0.69 0.21 0.00 -1.01 0.00 0.00 55.97 56.47 2j50 s LYS 365 Cb 0.29 -3.35 1.12 0.00 -1.01 0.00 0.00 37.83 34.88 2j50 s LYS 365 CO 0.00 0.35 1.96 1.25 0.51 0.00 0.00 175.35 179.42 2j50 h HIS 366 N 5.75 0.00 -3.11 3.18 -0.00 -1.96 -3.37 115.15 115.65 2j50 h HIS 366 Ca -0.45 0.00 -0.76 0.00 -0.00 0.00 0.00 60.37 59.16 2j50 h HIS 366 Cb 1.20 0.00 -0.24 0.00 -0.00 0.00 0.00 27.41 28.37 2j50 h HIS 366 CO 0.65 0.21 -0.23 1.21 -0.00 0.00 0.00 177.93 179.78 2j50 s ASN 367 N -6.51 6.17 0.49 3.26 3.04 -1.26 -4.79 114.94 115.34 2j50 s ASN 367 Ca -0.03 -1.77 0.37 0.00 0.04 0.00 0.00 52.86 51.48 2j50 s ASN 367 Cb 0.14 -2.20 1.53 0.00 -1.54 0.00 0.00 41.25 39.18 2j50 s ASN 367 CO 0.65 -0.84 1.64 -0.65 -3.04 0.00 0.00 177.10 174.85 2j50 h PRO 368 N 8.87 0.06 -0.64 0.43 0.11 -1.95 0.33 132.00 139.20 2j50 h PRO 368 Ca -0.30 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.87 2j50 h PRO 368 Cb 1.10 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 2j50 h PRO 368 CO 1.02 0.04 0.42 0.77 -0.21 0.00 0.00 178.00 180.04 2j50 h SER 369 N 0.06 0.58 0.14 -2.05 0.02 -1.93 -1.47 113.55 108.89 2j50 h SER 369 Ca 0.81 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.76 2j50 h SER 369 Cb 2.88 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 65.29 2j50 h SER 369 CO -0.23 0.38 -0.28 0.00 -1.14 0.00 0.00 176.83 175.57 2j50 n GLN 370 N -4.47 1.07 -2.22 3.45 6.02 0.11 -4.85 117.38 116.50 2j50 n GLN 370 Ca 0.09 -0.72 -0.42 0.00 -0.01 0.00 0.00 57.00 55.93 2j50 n GLN 370 Cb 0.21 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 29.96 2j50 n GLN 370 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2j50 s ARG 371 N -2.43 4.27 1.05 -1.09 0.52 -0.56 -4.89 118.95 115.82 2j50 s ARG 371 Ca 0.24 1.96 -0.17 0.00 -0.52 0.00 0.00 55.73 57.24 2j50 s ARG 371 Cb 0.19 -3.63 0.05 0.00 0.52 0.00 0.00 34.95 32.08 2j50 s ARG 371 CO 0.51 -0.61 0.03 -0.35 0.02 0.00 0.00 175.30 174.89 2j50 n PRO 372 N 5.67 -0.97 -2.11 3.54 -0.04 -1.25 -5.01 135.00 134.83 2j50 n PRO 372 Ca 0.14 -0.26 -0.29 0.00 -0.04 0.00 0.00 63.50 63.05 2j50 n PRO 372 Cb 0.44 -1.69 0.04 0.00 -0.04 0.00 0.00 33.50 32.25 2j50 n PRO 372 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2j50 s MET 373 N -3.37 2.92 0.44 0.54 -1.94 -1.26 -4.93 119.30 111.70 2j50 s MET 373 Ca 0.55 0.27 0.21 0.00 -1.71 0.00 0.00 55.69 55.01 2j50 s MET 373 Cb -0.14 -2.13 1.03 0.00 2.01 0.00 0.00 34.83 35.60 2j50 s MET 373 CO 0.67 -0.87 1.91 -0.07 -0.01 0.00 0.00 175.02 176.65 2j50 h LEU 374 N -0.43 0.00 -0.93 -0.03 3.38 -1.95 -2.01 115.31 113.33 2j50 h LEU 374 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2j50 h LEU 374 Cb 1.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 2j50 h LEU 374 CO 0.62 0.25 0.54 0.03 0.09 0.00 0.00 178.44 179.97 2j50 h ARG 375 N 0.00 1.28 0.31 1.13 3.08 -1.95 -0.40 114.38 117.83 2j50 h ARG 375 Ca -0.00 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2j50 h ARG 375 Cb 0.58 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2j50 h ARG 375 CO 0.03 0.91 -0.15 0.93 -1.07 0.00 0.00 179.97 180.62 2j50 h GLU 376 N 1.29 -0.41 -0.34 0.04 5.08 -1.75 -2.26 114.58 116.24 2j50 h GLU 376 Ca 0.33 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.79 2j50 h GLU 376 Cb -0.02 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.23 2j50 h GLU 376 CO -0.06 -0.08 -0.38 0.28 -1.00 0.00 0.00 179.01 177.77 2j50 h VAL 377 N -0.79 0.18 -0.41 3.13 2.07 -1.34 0.20 116.25 119.29 2j50 h VAL 377 Ca -0.04 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.60 2j50 h VAL 377 Cb 0.51 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2j50 h VAL 377 CO 0.07 0.00 0.41 -0.07 0.02 0.00 0.00 177.57 178.00 2j50 h LEU 378 N -0.33 0.00 -2.85 2.57 3.38 -1.04 -0.60 115.31 116.45 2j50 h LEU 378 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2j50 h LEU 378 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2j50 h LEU 378 CO -0.52 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.39 2j50 n GLU 379 N -3.82 2.84 -2.08 1.13 1.02 0.45 -4.60 120.64 115.58 2j50 n GLU 379 Ca 0.07 -2.25 -0.42 0.00 -0.02 0.00 0.00 57.16 54.55 2j50 n GLU 379 Cb 0.59 -1.37 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 2j50 n GLU 379 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2j50 s HIS 380 N -1.02 3.13 0.27 -0.32 2.46 0.21 -4.86 115.29 115.17 2j50 s HIS 380 Ca 0.31 1.00 -0.05 0.00 0.47 0.00 0.00 55.06 56.79 2j50 s HIS 380 Cb 0.16 -3.76 0.51 0.00 -0.13 0.00 0.00 32.58 29.37 2j50 s HIS 380 CO 0.21 -2.54 1.46 -2.30 -2.47 0.00 0.00 174.74 169.11 2j50 n PRO 381 N 2.98 -0.08 0.15 2.88 -0.02 -1.26 -0.74 135.00 138.90 2j50 n PRO 381 Ca 0.09 1.44 0.01 0.00 -2.02 0.00 0.00 63.50 63.02 2j50 n PRO 381 Cb 0.41 -2.20 0.19 0.00 -0.02 0.00 0.00 33.50 31.88 2j50 n PRO 381 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 2j50 h TRP 382 N 0.00 0.00 0.43 6.00 7.01 -1.91 -1.91 115.95 125.58 2j50 h TRP 382 Ca 0.48 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.46 2j50 h TRP 382 Cb 0.82 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.89 2j50 h TRP 382 CO -0.65 0.57 -0.21 0.82 -2.79 0.00 0.00 178.44 176.18 2j50 h ILE 383 N 0.00 0.00 -0.76 2.65 1.08 -1.25 -2.63 117.51 116.60 2j50 h ILE 383 Ca -0.01 -0.57 0.14 0.00 -0.39 0.00 0.00 64.86 64.03 2j50 h ILE 383 Cb 1.11 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.81 2j50 h ILE 383 CO 0.07 0.00 0.50 0.71 -0.69 0.00 0.00 178.15 178.75 2j50 h THR 384 N -1.15 0.83 -0.46 -0.27 1.35 -1.47 0.48 112.91 112.23 2j50 h THR 384 Ca -0.06 -0.17 -0.04 0.00 -0.55 0.00 0.00 66.41 65.59 2j50 h THR 384 Cb 0.45 0.29 -0.02 0.00 -1.73 0.00 0.00 68.15 67.14 2j50 h THR 384 CO 0.10 0.09 0.11 0.00 -0.25 0.00 0.00 175.52 175.57 2j50 h ALA 385 N 1.64 0.60 -0.00 6.62 0.00 -1.34 -3.33 119.26 123.44 2j50 h ALA 385 Ca 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2j50 h ALA 385 Cb 0.74 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2j50 h ALA 385 CO -0.13 0.29 -0.41 0.09 0.00 0.00 0.00 179.25 179.08 2j50 n ASN 386 N -4.50 0.67 -2.69 0.00 4.13 -0.99 -5.02 115.26 106.85 2j50 n ASN 386 Ca 0.01 -0.83 0.00 0.00 1.68 0.00 0.00 54.58 55.43 2j50 n ASN 386 Cb 0.22 0.87 0.00 0.00 -1.54 0.00 0.00 39.78 39.33 2j50 n ASN 386 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2j50 n SER 387 N -0.99 0.00 0.00 6.41 2.88 0.17 -4.41 113.62 117.67 2j50 n SER 387 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2j50 n SER 387 Cb 0.17 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2j50 n SER 387 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2j50 n SER 388 N 0.00 0.00 0.00 -3.46 3.41 -1.26 -4.89 113.62 107.41 2j50 n SER 388 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2j50 n SER 388 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2j50 n SER 388 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17