#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nf5 s THR 132 N 0.00 2.99 0.19 -5.08 -4.23 -1.26 -4.78 115.64 103.46 1nf5 s THR 132 Ca 0.00 -1.00 -0.30 0.00 -1.18 0.00 0.00 61.69 59.21 1nf5 s THR 132 Cb 0.00 -2.99 -0.08 0.00 1.34 0.00 0.00 72.50 70.77 1nf5 s THR 132 CO 0.00 0.00 1.19 0.00 -0.54 0.00 0.00 174.62 175.27 1nf5 s ALA 133 N -2.35 3.43 0.75 3.99 0.00 -1.26 0.53 121.76 126.85 1nf5 s ALA 133 Ca 0.55 0.94 -0.15 0.00 0.00 0.00 0.00 51.96 53.30 1nf5 s ALA 133 Cb -0.10 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.65 1nf5 s ALA 133 CO 0.33 -0.36 1.12 0.00 0.00 0.00 0.00 175.76 176.85 1nf5 s PRO 135 N -3.69 1.92 0.19 0.00 0.04 -1.26 -4.93 135.00 127.27 1nf5 s PRO 135 Ca 0.75 1.50 -0.13 0.00 0.04 0.00 0.00 61.00 63.16 1nf5 s PRO 135 Cb -0.33 -1.83 0.21 0.00 0.04 0.00 0.00 34.50 32.59 1nf5 s PRO 135 CO 0.49 -1.95 1.69 1.49 0.04 0.00 0.00 177.00 178.76 1nf5 h GLU 136 N -0.93 0.14 -6.58 4.56 4.57 -2.02 -3.40 114.58 110.92 1nf5 h GLU 136 Ca -0.45 -0.01 -0.69 0.00 -1.18 0.00 0.00 59.36 57.03 1nf5 h GLU 136 Cb 1.26 -0.03 -0.25 0.00 -0.16 0.00 0.00 28.75 29.57 1nf5 h GLU 136 CO 0.48 0.09 -0.84 -2.00 -1.18 0.00 0.00 179.01 175.57 1nf5 s GLU 137 N -6.16 2.09 0.35 1.92 2.12 -1.26 -5.12 118.70 112.64 1nf5 s GLU 137 Ca -0.13 -0.95 -0.27 0.00 0.36 0.00 0.00 54.97 53.98 1nf5 s GLU 137 Cb 0.16 -2.14 -0.09 0.00 0.26 0.00 0.00 34.13 32.33 1nf5 s GLU 137 CO 0.73 0.55 1.13 0.45 -0.54 0.00 0.00 175.26 177.58 1nf5 s SER 138 N -1.08 6.89 0.00 -1.70 0.15 -1.26 -4.93 113.70 111.76 1nf5 s SER 138 Ca 0.12 2.28 0.27 0.00 0.70 0.00 0.00 55.95 59.32 1nf5 s SER 138 Cb -0.10 -2.62 0.86 0.00 -1.71 0.00 0.00 66.02 62.45 1nf5 s SER 138 CO 0.02 -0.42 1.65 -0.81 1.20 0.00 0.00 173.24 174.89 1nf5 n PRO 139 N 0.54 0.28 0.02 5.44 -0.04 -1.26 -3.86 135.00 136.13 1nf5 n PRO 139 Ca 0.02 -0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.48 1nf5 n PRO 139 Cb 0.46 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.82 1nf5 n PRO 139 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1nf5 n LEU 140 N -1.25 0.39 -4.74 1.53 4.77 -1.26 -4.96 117.00 111.48 1nf5 n LEU 140 Ca 0.09 0.30 -0.42 0.00 -0.03 0.00 0.00 56.01 55.95 1nf5 n LEU 140 Cb 0.32 -0.34 -0.01 0.00 -2.33 0.00 0.00 43.42 41.06 1nf5 n LEU 140 CO 0.29 0.01 1.15 0.18 -1.33 0.00 0.00 177.39 177.69 1nf5 n LEU 141 N -1.70 4.20 -0.00 2.23 4.32 -1.25 -4.95 117.00 119.84 1nf5 n LEU 141 Ca 0.06 1.17 0.06 0.00 -0.02 0.00 0.00 56.01 57.28 1nf5 n LEU 141 Cb 0.37 -1.57 -0.09 0.00 -1.62 0.00 0.00 43.42 40.52 1nf5 n LEU 141 CO 0.32 -0.00 -0.28 1.33 -1.22 0.00 0.00 177.39 177.54 1nf5 n VAL 142 N 1.54 0.00 -0.17 4.08 0.24 -1.26 -5.09 118.33 117.66 1nf5 n VAL 142 Ca 0.07 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 1nf5 n VAL 142 Cb 0.36 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.42 1nf5 n VAL 142 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1nf5 n GLY 143 N 1.47 0.58 3.73 7.63 0.00 -1.26 -4.92 105.19 112.42 1nf5 n GLY 143 Ca 0.01 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 1nf5 n GLY 143 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nf5 s PRO 144 N 0.00 4.25 0.15 1.61 0.04 -1.26 -1.68 135.00 138.11 1nf5 s PRO 144 Ca 0.00 2.28 0.07 0.00 0.04 0.00 0.00 61.00 63.39 1nf5 s PRO 144 Cb 0.00 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 1nf5 s PRO 144 CO 0.00 -0.51 -0.15 -1.64 0.04 0.00 0.00 177.00 174.74 1nf5 s MET 145 N 0.67 1.13 -0.30 4.56 -1.94 0.01 -4.99 119.30 118.44 1nf5 s MET 145 Ca 0.66 -1.34 -0.23 0.00 -1.71 0.00 0.00 55.69 53.07 1nf5 s MET 145 Cb -0.42 -1.04 -0.00 0.00 2.01 0.00 0.00 34.83 35.38 1nf5 s MET 145 CO 0.35 0.20 0.75 -1.17 -0.01 0.00 0.00 175.02 175.13 1nf5 s LEU 146 N -2.66 4.10 -0.27 -0.03 2.96 -1.26 -4.87 118.68 116.65 1nf5 s LEU 146 Ca 0.13 0.64 -0.05 0.00 -0.22 0.00 0.00 54.13 54.63 1nf5 s LEU 146 Cb -0.04 -3.01 0.01 0.00 0.50 0.00 0.00 46.19 43.64 1nf5 s LEU 146 CO 0.04 -0.56 0.03 -0.63 -1.32 0.00 0.00 176.35 173.91 1nf5 s ILE 147 N 2.84 3.66 0.04 6.68 -1.09 -1.26 -5.09 121.20 126.99 1nf5 s ILE 147 Ca 0.31 -0.67 0.01 0.00 -2.23 0.00 0.00 60.65 58.07 1nf5 s ILE 147 Cb -0.14 -2.83 -0.02 0.00 -1.58 0.00 0.00 42.46 37.88 1nf5 s ILE 147 CO 0.12 0.19 -0.06 -1.61 -1.23 0.00 0.00 174.94 172.35 1nf5 s GLU 148 N 1.47 0.48 -0.30 2.79 2.02 -1.26 -5.05 118.70 118.84 1nf5 s GLU 148 Ca 0.03 -0.76 0.07 0.00 0.02 0.00 0.00 54.97 54.33 1nf5 s GLU 148 Cb -0.16 -0.14 0.46 0.00 0.10 0.00 0.00 34.13 34.38 1nf5 s GLU 148 CO 0.00 0.01 1.29 1.19 0.02 0.00 0.00 175.26 177.77 1nf5 n PHE 149 N 1.37 2.03 0.00 1.61 3.01 -1.26 -4.84 117.46 119.38 1nf5 n PHE 149 Ca -0.22 -2.07 0.00 0.00 1.01 0.00 0.00 57.45 56.17 1nf5 n PHE 149 Cb 0.55 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1nf5 n PHE 149 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1nf5 n ASN 150 N -0.86 0.00 -2.32 4.37 3.02 -1.26 -4.95 115.26 113.26 1nf5 n ASN 150 Ca 0.39 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.62 1nf5 n ASN 150 Cb 0.89 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 40.02 1nf5 n ASN 150 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1nf5 n ILE 151 N -0.10 0.00 -1.55 2.41 -5.35 -1.26 -4.84 119.36 108.68 1nf5 n ILE 151 Ca 0.00 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.14 1nf5 n ILE 151 Cb 0.00 -0.11 0.08 0.00 -1.74 0.00 0.00 39.64 37.87 1nf5 n ILE 151 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 1nf5 s PRO 152 N 0.67 2.34 -0.03 6.28 0.02 -1.26 -4.99 135.00 138.02 1nf5 s PRO 152 Ca 0.49 1.69 0.07 0.00 0.02 0.00 0.00 61.00 63.27 1nf5 s PRO 152 Cb -0.69 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 31.94 1nf5 s PRO 152 CO 0.34 -1.67 -0.23 0.14 -0.33 0.00 0.00 177.00 175.26 1nf5 s VAL 153 N -2.02 2.31 -0.24 3.83 -7.23 -1.26 -5.10 120.40 110.69 1nf5 s VAL 153 Ca 0.73 -1.00 -0.05 0.00 -1.81 0.00 0.00 61.98 59.84 1nf5 s VAL 153 Cb -0.28 -1.83 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 1nf5 s VAL 153 CO 0.43 0.58 0.01 -0.62 -0.31 0.00 0.00 175.10 175.19 1nf5 s ASP 154 N -0.55 4.65 0.53 4.85 -1.08 -1.26 -4.98 116.67 118.83 1nf5 s ASP 154 Ca 0.08 -0.39 0.18 0.00 -0.52 0.00 0.00 52.55 51.89 1nf5 s ASP 154 Cb -0.11 -1.81 1.31 0.00 -1.46 0.00 0.00 42.92 40.86 1nf5 s ASP 154 CO 0.00 -0.05 2.13 -0.07 0.52 0.00 0.00 175.17 177.70 1nf5 h LEU 155 N 8.16 0.00 -0.81 -1.34 3.38 -1.98 0.27 115.31 122.99 1nf5 h LEU 155 Ca -0.39 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 1nf5 h LEU 155 Cb 1.16 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 1nf5 h LEU 155 CO 0.59 0.00 0.18 0.50 0.09 0.00 0.00 178.44 179.81 1nf5 h LYS 156 N 0.00 1.07 -0.39 1.13 3.11 -1.99 0.11 116.57 119.62 1nf5 h LYS 156 Ca 0.04 -0.24 -0.01 0.00 -2.81 0.00 0.00 60.65 57.63 1nf5 h LYS 156 Cb 0.16 -0.15 -0.02 0.00 -1.00 0.00 0.00 32.23 31.22 1nf5 h LYS 156 CO -0.00 0.93 0.20 1.25 -2.81 0.00 0.00 179.45 179.02 1nf5 h LEU 157 N 1.02 0.50 -0.96 5.20 7.12 -0.95 -0.84 115.31 126.41 1nf5 h LEU 157 Ca 0.22 -0.11 -0.04 0.00 0.13 0.00 0.00 57.88 58.08 1nf5 h LEU 157 Cb 0.33 -0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 40.31 1nf5 h LEU 157 CO -0.00 0.47 0.24 0.58 -0.13 0.00 0.00 178.44 179.59 1nf5 h VAL 158 N 0.50 1.24 -0.57 1.05 2.07 -0.55 -1.64 116.25 118.33 1nf5 h VAL 158 Ca 0.14 -0.78 -0.10 0.00 0.82 0.00 0.00 66.70 66.77 1nf5 h VAL 158 Cb 0.09 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1nf5 h VAL 158 CO -0.02 0.31 -0.04 -0.33 0.02 0.00 0.00 177.57 177.51 1nf5 h GLU 159 N 0.97 1.04 -0.68 1.57 5.08 -0.48 -2.04 114.58 120.04 1nf5 h GLU 159 Ca 0.22 -0.35 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1nf5 h GLU 159 Cb 0.23 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1nf5 h GLU 159 CO -0.01 1.04 0.25 1.96 -1.00 0.00 0.00 179.01 181.25 1nf5 h GLN 160 N 0.93 1.02 0.00 2.33 4.20 -0.73 -2.56 115.11 120.29 1nf5 h GLN 160 Ca 0.16 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1nf5 h GLN 160 Cb 0.60 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1nf5 h GLN 160 CO 0.04 0.84 0.00 1.96 -0.67 0.00 0.00 178.83 181.00 1nf5 h GLN 161 N 0.99 0.00 -2.15 1.46 4.20 -1.03 -3.33 115.11 115.25 1nf5 h GLN 161 Ca 0.23 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.38 1nf5 h GLN 161 Cb 0.22 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 27.59 1nf5 h GLN 161 CO -0.02 0.00 -0.85 0.09 -0.67 0.00 0.00 178.83 177.39 1nf5 n ASN 162 N -2.68 2.73 0.28 1.46 3.02 -0.79 -4.93 115.26 114.35 1nf5 n ASN 162 Ca 0.03 -3.31 0.18 0.00 -0.03 0.00 0.00 54.58 51.44 1nf5 n ASN 162 Cb 0.35 -0.61 0.96 0.00 -0.61 0.00 0.00 39.78 39.86 1nf5 n ASN 162 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1nf5 h PRO 163 N 3.40 0.00 0.00 3.52 0.13 -1.66 -2.19 132.00 135.19 1nf5 h PRO 163 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1nf5 h PRO 163 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1nf5 h PRO 163 CO 0.69 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.09 1nf5 n LYS 164 N -3.57 0.23 -2.58 0.86 4.01 -1.26 -4.77 118.16 111.08 1nf5 n LYS 164 Ca -0.01 0.27 -0.43 0.00 -0.51 0.00 0.00 58.31 57.63 1nf5 n LYS 164 Cb 0.18 -1.81 -0.02 0.00 -0.51 0.00 0.00 35.03 32.87 1nf5 n LYS 164 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1nf5 s VAL 165 N -3.16 4.53 0.61 -0.18 1.01 -0.83 -4.79 120.40 117.60 1nf5 s VAL 165 Ca 0.09 1.85 -0.07 0.00 0.00 0.00 0.00 61.98 63.84 1nf5 s VAL 165 Cb 0.12 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.29 1nf5 s VAL 165 CO 0.52 -0.19 0.94 -0.54 0.00 0.00 0.00 175.10 175.83 1nf5 s LYS 166 N 3.34 2.93 -0.09 2.72 1.02 0.18 -4.86 119.74 124.98 1nf5 s LYS 166 Ca 0.48 0.09 -0.38 0.00 0.02 0.00 0.00 55.97 56.18 1nf5 s LYS 166 Cb -0.17 -2.22 -0.16 0.00 -0.52 0.00 0.00 37.83 34.76 1nf5 s LYS 166 CO 0.10 -0.75 1.55 -0.11 -0.92 0.00 0.00 175.35 175.22 1nf5 n LEU 167 N -2.66 2.07 0.00 3.17 -0.00 -1.26 -1.17 117.00 117.15 1nf5 n LEU 167 Ca 0.05 1.09 0.00 0.00 -0.00 0.00 0.00 56.01 57.15 1nf5 n LEU 167 Cb 0.57 -1.17 0.00 0.00 -0.00 0.00 0.00 43.42 42.82 1nf5 n LEU 167 CO 0.54 -0.71 0.00 0.61 -0.00 0.00 0.00 177.39 177.82 1nf5 n GLY 168 N 3.39 0.92 3.17 -3.96 0.00 0.36 -4.34 105.19 104.74 1nf5 n GLY 168 Ca 0.22 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 1nf5 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nf5 n GLY 169 N -2.15 -0.28 3.63 -0.02 0.00 -0.32 -3.45 105.19 102.60 1nf5 n GLY 169 Ca 0.00 0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1nf5 n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nf5 s ARG 170 N -5.72 3.23 -0.08 1.61 1.81 -0.78 -2.12 118.95 116.90 1nf5 s ARG 170 Ca 0.30 -0.44 -0.07 0.00 -1.72 0.00 0.00 55.73 53.79 1nf5 s ARG 170 Cb -0.13 -2.85 0.02 0.00 -0.45 0.00 0.00 34.95 31.54 1nf5 s ARG 170 CO 0.61 0.54 0.22 -0.47 -0.68 0.00 0.00 175.30 175.52 1nf5 s TYR 171 N -0.45 -0.24 -0.03 -0.53 5.04 -0.21 0.51 117.35 121.44 1nf5 s TYR 171 Ca 0.08 0.59 -0.01 0.00 -2.44 0.00 0.00 57.07 55.29 1nf5 s TYR 171 Cb -0.12 0.08 0.03 0.00 0.35 0.00 0.00 41.96 42.30 1nf5 s TYR 171 CO 0.02 -0.12 0.06 0.99 -1.34 0.00 0.00 175.55 175.16 1nf5 s THR 172 N 0.22 -0.06 0.49 4.34 2.01 -1.26 -0.83 115.64 120.55 1nf5 s THR 172 Ca -0.01 0.22 -0.24 0.00 0.31 0.00 0.00 61.69 61.97 1nf5 s THR 172 Cb -0.02 -0.12 -0.07 0.00 0.01 0.00 0.00 72.50 72.30 1nf5 s THR 172 CO -0.00 0.09 1.38 -2.84 -0.69 0.00 0.00 174.62 172.55 1nf5 s PRO 173 N 1.13 3.45 0.00 4.92 0.02 -1.26 -4.91 135.00 138.34 1nf5 s PRO 173 Ca -0.09 2.29 0.11 0.00 0.02 0.00 0.00 61.00 63.33 1nf5 s PRO 173 Cb -0.13 -2.46 0.23 0.00 0.02 0.00 0.00 34.50 32.16 1nf5 s PRO 173 CO -0.04 -0.96 1.11 0.00 -0.33 0.00 0.00 177.00 176.78 1nf5 n MET 174 N -0.58 2.02 -0.01 5.54 0.00 -1.26 -4.47 117.12 118.36 1nf5 n MET 174 Ca 0.08 -1.73 0.10 0.00 0.00 0.00 0.00 57.70 56.15 1nf5 n MET 174 Cb 0.44 -1.25 -0.14 0.00 0.00 0.00 0.00 33.22 32.27 1nf5 n MET 174 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1nf5 n ASP 175 N 0.56 0.56 -3.71 3.17 10.43 -1.26 -5.03 116.55 121.26 1nf5 n ASP 175 Ca 0.10 -0.35 -0.03 0.00 2.57 0.00 0.00 54.79 57.07 1nf5 n ASP 175 Cb 0.37 1.59 -0.01 0.00 1.84 0.00 0.00 41.12 44.91 1nf5 n ASP 175 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1nf5 s ILE 177 N -3.13 5.34 -0.11 0.00 1.09 0.19 -4.64 121.20 119.94 1nf5 s ILE 177 Ca 0.12 0.22 -0.19 0.00 -1.10 0.00 0.00 60.65 59.70 1nf5 s ILE 177 Cb -0.00 -3.52 -0.04 0.00 -1.06 0.00 0.00 42.46 37.83 1nf5 s ILE 177 CO 0.00 0.33 0.50 -0.55 -0.10 0.00 0.00 174.94 175.12 1nf5 s SER 178 N 1.13 6.72 0.04 3.58 0.15 -1.26 -0.89 113.70 123.16 1nf5 s SER 178 Ca 0.08 0.85 0.28 0.00 0.70 0.00 0.00 55.95 57.87 1nf5 s SER 178 Cb -0.14 -2.30 1.04 0.00 -1.71 0.00 0.00 66.02 62.91 1nf5 s SER 178 CO 0.05 -0.00 1.81 -0.81 1.20 0.00 0.00 173.24 175.49 1nf5 n PRO 179 N 3.65 0.05 -3.20 5.44 -0.04 -1.26 -4.60 135.00 135.03 1nf5 n PRO 179 Ca -0.07 0.04 -0.45 0.00 -0.04 0.00 0.00 63.50 62.98 1nf5 n PRO 179 Cb 0.52 -1.56 -0.04 0.00 -0.04 0.00 0.00 33.50 32.38 1nf5 n PRO 179 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1nf5 s HIS 180 N -3.02 3.16 -0.65 0.54 3.76 -1.26 -4.97 115.29 112.85 1nf5 s HIS 180 Ca 0.13 -1.18 -0.18 0.00 -0.15 0.00 0.00 55.06 53.67 1nf5 s HIS 180 Cb 0.18 -3.92 0.12 0.00 1.11 0.00 0.00 32.58 30.07 1nf5 s HIS 180 CO 0.57 -1.17 0.72 0.15 -0.85 0.00 0.00 174.74 174.17 1nf5 s LYS 181 N 2.06 3.16 -0.16 1.40 1.02 -1.26 -2.19 119.74 123.76 1nf5 s LYS 181 Ca 0.09 -1.56 -0.04 0.00 0.02 0.00 0.00 55.97 54.48 1nf5 s LYS 181 Cb -0.25 -4.35 -0.03 0.00 -0.52 0.00 0.00 37.83 32.68 1nf5 s LYS 181 CO 0.03 -1.50 -0.03 0.08 -0.92 0.00 0.00 175.35 173.01 1nf5 s VAL 182 N 2.22 3.95 -0.26 3.17 1.01 -0.14 -0.81 120.40 129.53 1nf5 s VAL 182 Ca 0.13 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.68 1nf5 s VAL 182 Cb -0.21 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1nf5 s VAL 182 CO 0.02 0.48 0.15 0.00 0.00 0.00 0.00 175.10 175.76 1nf5 s ALA 183 N 0.43 3.44 -0.38 5.51 0.00 -0.11 -2.01 121.76 128.64 1nf5 s ALA 183 Ca -0.03 -1.05 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 1nf5 s ALA 183 Cb -0.14 -2.33 0.02 0.00 0.00 0.00 0.00 23.12 20.67 1nf5 s ALA 183 CO 0.03 -0.45 0.24 0.42 0.00 0.00 0.00 175.76 176.00 1nf5 s ILE 184 N 1.56 4.84 -0.27 0.00 1.01 -0.36 -0.88 121.20 127.09 1nf5 s ILE 184 Ca 0.07 -0.76 -0.11 0.00 0.00 0.00 0.00 60.65 59.85 1nf5 s ILE 184 Cb -0.15 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.58 1nf5 s ILE 184 CO 0.08 -0.25 0.20 -0.63 0.00 0.00 0.00 174.94 174.34 1nf5 s ILE 185 N 1.61 5.31 -0.29 2.92 -1.09 0.51 -0.33 121.20 129.83 1nf5 s ILE 185 Ca 0.03 0.20 0.00 0.00 -2.23 0.00 0.00 60.65 58.66 1nf5 s ILE 185 Cb -0.19 -3.54 0.06 0.00 -1.58 0.00 0.00 42.46 37.21 1nf5 s ILE 185 CO 0.08 0.26 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.39 1nf5 s ILE 186 N 1.67 2.63 0.39 2.92 1.01 0.98 -0.90 121.20 129.89 1nf5 s ILE 186 Ca 0.08 -1.58 -0.26 0.00 0.00 0.00 0.00 60.65 58.88 1nf5 s ILE 186 Cb -0.16 -2.56 -0.09 0.00 0.01 0.00 0.00 42.46 39.66 1nf5 s ILE 186 CO 0.10 -0.13 1.27 -2.16 0.00 0.00 0.00 174.94 174.02 1nf5 s PRO 187 N 1.16 4.08 -0.13 2.79 0.04 -1.26 -0.98 135.00 140.70 1nf5 s PRO 187 Ca -0.05 2.10 -0.18 0.00 0.04 0.00 0.00 61.00 62.91 1nf5 s PRO 187 Cb -0.20 -2.82 0.05 0.00 0.04 0.00 0.00 34.50 31.57 1nf5 s PRO 187 CO -0.03 -0.38 0.48 0.12 0.04 0.00 0.00 177.00 177.23 1nf5 s PHE 188 N -1.26 -0.48 -0.30 0.56 5.36 0.19 -4.47 117.98 117.57 1nf5 s PHE 188 Ca 0.55 1.08 -0.02 0.00 -0.96 0.00 0.00 56.93 57.59 1nf5 s PHE 188 Cb -0.37 0.20 0.18 0.00 -0.34 0.00 0.00 43.02 42.69 1nf5 s PHE 188 CO 0.48 -0.33 0.59 0.50 -1.46 0.00 0.00 175.22 175.00 1nf5 s ARG 189 N -0.24 0.56 -1.45 10.12 3.52 -1.26 -0.87 118.95 129.33 1nf5 s ARG 189 Ca -0.04 1.01 -0.03 0.00 -0.13 0.00 0.00 55.73 56.53 1nf5 s ARG 189 Cb -0.03 0.52 0.03 0.00 -1.56 0.00 0.00 34.95 33.90 1nf5 s ARG 189 CO 0.03 -0.60 0.50 -1.71 -0.81 0.00 0.00 175.30 172.71 1nf5 n ASN 190 N 5.43 -0.94 -2.66 -2.12 2.85 -1.26 -4.93 115.26 111.63 1nf5 n ASN 190 Ca -0.02 -0.99 -0.17 0.00 -0.11 0.00 0.00 54.58 53.30 1nf5 n ASN 190 Cb 0.51 -3.10 0.01 0.00 1.24 0.00 0.00 39.78 38.44 1nf5 n ASN 190 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1nf5 n ARG 191 N -4.41 1.99 -0.26 1.20 5.12 -1.26 -4.92 116.66 114.12 1nf5 n ARG 191 Ca -0.24 -3.76 -0.03 0.00 -1.93 0.00 0.00 57.85 51.89 1nf5 n ARG 191 Cb 0.65 -1.66 0.08 0.00 -1.16 0.00 0.00 32.46 30.37 1nf5 n ARG 191 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 1nf5 h GLN 192 N 2.86 0.87 -0.24 5.56 5.75 -1.99 -1.76 115.11 126.16 1nf5 h GLN 192 Ca 0.06 -0.05 0.02 0.00 -0.15 0.00 0.00 58.65 58.53 1nf5 h GLN 192 Cb 1.04 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.37 1nf5 h GLN 192 CO 0.63 0.58 0.09 0.93 -2.65 0.00 0.00 178.83 178.41 1nf5 h GLU 193 N 0.90 0.21 -0.25 1.69 4.39 -2.00 -0.52 114.58 119.00 1nf5 h GLU 193 Ca 0.29 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 60.03 1nf5 h GLU 193 Cb 0.01 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.56 1nf5 h GLU 193 CO -0.11 0.14 -0.07 0.45 -1.16 0.00 0.00 179.01 178.26 1nf5 h HIS 194 N 0.21 -0.15 -0.94 4.33 3.86 -1.79 -1.62 115.15 119.06 1nf5 h HIS 194 Ca 0.10 0.02 0.13 0.00 -1.16 0.00 0.00 60.37 59.47 1nf5 h HIS 194 Cb 0.06 0.10 -0.08 0.00 1.06 0.00 0.00 27.41 28.56 1nf5 h HIS 194 CO -0.12 -0.12 0.60 1.25 0.86 0.00 0.00 177.93 180.40 1nf5 h LEU 195 N -0.01 0.77 -0.29 2.43 6.46 -0.94 -0.09 115.31 123.65 1nf5 h LEU 195 Ca 0.12 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.92 1nf5 h LEU 195 Cb 0.19 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 1nf5 h LEU 195 CO -0.26 0.40 0.16 0.11 -0.62 0.00 0.00 178.44 178.22 1nf5 h LYS 196 N 0.82 0.41 -0.65 1.25 1.57 -0.12 -0.05 116.57 119.80 1nf5 h LYS 196 Ca 0.47 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 59.13 1nf5 h LYS 196 Cb 0.62 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1nf5 h LYS 196 CO -0.23 0.36 0.11 1.88 -0.57 0.00 0.00 179.45 181.00 1nf5 h TYR 197 N 0.35 1.11 -0.05 -1.35 -1.99 -1.01 -1.11 116.97 112.92 1nf5 h TYR 197 Ca 0.10 -0.14 0.02 0.00 2.00 0.00 0.00 58.73 60.71 1nf5 h TYR 197 Cb 0.07 -0.31 -0.02 0.00 2.00 0.00 0.00 36.73 38.47 1nf5 h TYR 197 CO -0.03 0.93 -0.08 2.35 -0.00 0.00 0.00 178.16 181.33 1nf5 h TRP 198 N 0.99 -0.19 -0.59 4.88 7.01 -0.49 -0.80 115.95 126.76 1nf5 h TRP 198 Ca 0.20 0.01 -0.08 0.00 2.11 0.00 0.00 58.89 61.13 1nf5 h TRP 198 Cb 0.41 0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.54 1nf5 h TRP 198 CO 0.03 -0.12 0.06 -0.07 -2.79 0.00 0.00 178.44 175.55 1nf5 h LEU 199 N -0.11 0.97 -0.99 0.65 3.38 -0.90 0.21 115.31 118.52 1nf5 h LEU 199 Ca 0.05 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 57.81 1nf5 h LEU 199 Cb 0.18 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.60 1nf5 h LEU 199 CO -0.12 1.01 0.64 0.22 0.09 0.00 0.00 178.44 180.28 1nf5 h TYR 200 N 0.90 1.18 0.10 1.13 3.20 -0.84 -2.73 116.97 119.91 1nf5 h TYR 200 Ca 0.17 0.03 -0.34 0.00 3.14 0.00 0.00 58.73 61.73 1nf5 h TYR 200 Cb 0.48 -0.38 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 1nf5 h TYR 200 CO 0.03 0.60 -1.87 0.66 -1.64 0.00 0.00 178.16 175.95 1nf5 n TYR 201 N -4.52 1.22 -0.06 -3.82 4.02 -0.34 -4.58 117.16 109.07 1nf5 n TYR 201 Ca 0.15 0.30 -0.15 0.00 -0.01 0.00 0.00 57.90 58.20 1nf5 n TYR 201 Cb 0.20 -1.15 -0.04 0.00 -0.02 0.00 0.00 39.34 38.33 1nf5 n TYR 201 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1nf5 h LEU 202 N -0.13 0.93 -0.49 7.72 -0.00 -0.60 -3.25 115.31 119.48 1nf5 h LEU 202 Ca -0.41 -0.52 0.07 0.00 -0.00 0.00 0.00 57.88 57.01 1nf5 h LEU 202 Cb 1.90 -0.27 -0.06 0.00 -0.00 0.00 0.00 40.66 42.23 1nf5 h LEU 202 CO 0.03 1.31 0.17 0.45 -0.00 0.00 0.00 178.44 180.41 1nf5 h HIS 203 N 0.62 0.30 -0.64 1.13 3.86 -1.69 0.53 115.15 119.26 1nf5 h HIS 203 Ca 0.00 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.18 1nf5 h HIS 203 Cb 1.20 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 29.58 1nf5 h HIS 203 CO 0.07 0.09 0.19 -1.35 0.86 0.00 0.00 177.93 177.79 1nf5 h PRO 204 N 0.34 0.98 -0.10 2.45 0.11 -1.81 -2.12 132.00 131.85 1nf5 h PRO 204 Ca 0.24 -0.20 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 1nf5 h PRO 204 Cb 0.26 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.21 1nf5 h PRO 204 CO -0.25 0.85 0.02 0.82 -0.21 0.00 0.00 178.00 179.23 1nf5 h ILE 205 N 0.94 1.22 -0.71 4.15 2.04 -1.22 -2.02 117.51 121.91 1nf5 h ILE 205 Ca 0.21 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1nf5 h ILE 205 Cb 0.29 1.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 1nf5 h ILE 205 CO -0.01 0.20 0.46 -0.07 0.00 0.00 0.00 178.15 178.73 1nf5 h LEU 206 N -0.06 0.82 -0.38 1.44 3.38 0.12 -0.75 115.31 119.88 1nf5 h LEU 206 Ca 0.03 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1nf5 h LEU 206 Cb 0.29 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1nf5 h LEU 206 CO 0.00 0.60 -0.29 1.56 0.09 0.00 0.00 178.44 180.41 1nf5 h GLN 207 N 0.96 0.86 0.00 1.13 4.20 -1.27 -2.41 115.11 118.58 1nf5 h GLN 207 Ca 0.26 -0.42 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 1nf5 h GLN 207 Cb -0.10 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.68 1nf5 h GLN 207 CO -0.05 1.06 -0.12 0.00 -0.67 0.00 0.00 178.83 179.05 1nf5 h ARG 208 N 0.66 0.00 -0.01 1.46 3.08 -0.63 -1.38 114.38 117.56 1nf5 h ARG 208 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1nf5 h ARG 208 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1nf5 h ARG 208 CO 0.08 0.12 0.00 1.04 -1.07 0.00 0.00 179.97 180.14 1nf5 n GLN 209 N -4.00 1.07 -3.71 0.04 6.02 -0.36 -4.51 117.38 111.94 1nf5 n GLN 209 Ca -0.02 -0.11 -0.25 0.00 -0.01 0.00 0.00 57.00 56.61 1nf5 n GLN 209 Cb 0.21 -1.40 0.05 0.00 1.02 0.00 0.00 30.24 30.12 1nf5 n GLN 209 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1nf5 n GLN 210 N -0.77 -6.41 -3.77 -1.09 6.02 -0.52 -4.84 117.38 106.00 1nf5 n GLN 210 Ca 0.19 0.71 -0.33 0.00 -0.01 0.00 0.00 57.00 57.56 1nf5 n GLN 210 Cb 0.11 -5.62 -0.05 0.00 1.02 0.00 0.00 30.24 25.70 1nf5 n GLN 210 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1nf5 s LEU 211 N -7.09 4.33 -0.69 1.08 1.43 -1.23 -4.67 118.68 111.85 1nf5 s LEU 211 Ca 0.45 0.50 -0.12 0.00 -1.03 0.00 0.00 54.13 53.93 1nf5 s LEU 211 Cb -0.21 -2.98 0.18 0.00 0.03 0.00 0.00 46.19 43.21 1nf5 s LEU 211 CO 0.78 0.16 0.61 -0.62 0.23 0.00 0.00 176.35 177.51 1nf5 s ASP 212 N -2.16 6.29 0.35 2.29 2.15 -0.93 -4.35 116.67 120.30 1nf5 s ASP 212 Ca 0.34 -2.41 0.04 0.00 0.43 0.00 0.00 52.55 50.96 1nf5 s ASP 212 Cb -0.13 -2.14 -0.06 0.00 -0.30 0.00 0.00 42.92 40.30 1nf5 s ASP 212 CO 0.22 -0.63 0.06 -0.72 -0.17 0.00 0.00 175.17 173.93 1nf5 s TYR 213 N 0.62 2.03 -0.05 -5.34 -0.85 -0.01 -0.97 117.35 112.78 1nf5 s TYR 213 Ca 0.13 -0.95 -0.07 0.00 -0.52 0.00 0.00 57.07 55.66 1nf5 s TYR 213 Cb -0.18 -1.36 0.01 0.00 0.38 0.00 0.00 41.96 40.81 1nf5 s TYR 213 CO -0.04 0.05 0.18 0.20 -1.52 0.00 0.00 175.55 174.42 1nf5 s GLY 214 N -3.55 -0.09 -0.19 5.49 0.00 -0.85 -1.05 107.32 107.08 1nf5 s GLY 214 Ca 0.34 0.35 -0.07 0.00 0.00 0.00 0.00 44.72 45.33 1nf5 s GLY 214 CO 0.15 0.25 0.06 -0.42 0.00 0.00 0.00 173.10 173.15 1nf5 s ILE 215 N -0.34 4.70 -0.15 0.90 -1.09 -0.90 -1.23 121.20 123.09 1nf5 s ILE 215 Ca -0.04 -0.06 -0.00 0.00 -2.23 0.00 0.00 60.65 58.31 1nf5 s ILE 215 Cb -0.03 -3.13 0.03 0.00 -1.58 0.00 0.00 42.46 37.75 1nf5 s ILE 215 CO 0.01 0.44 -0.09 -0.31 -1.23 0.00 0.00 174.94 173.76 1nf5 s TYR 216 N 0.54 1.87 -0.33 3.97 1.51 0.55 -1.49 117.35 123.96 1nf5 s TYR 216 Ca 0.03 -1.08 -0.11 0.00 -1.01 0.00 0.00 57.07 54.90 1nf5 s TYR 216 Cb -0.13 -1.42 -0.00 0.00 -0.11 0.00 0.00 41.96 40.30 1nf5 s TYR 216 CO 0.01 -0.62 0.19 0.08 -1.11 0.00 0.00 175.55 174.11 1nf5 s VAL 217 N 1.58 4.79 -0.55 0.71 1.01 0.11 -0.02 120.40 128.05 1nf5 s VAL 217 Ca 0.03 -0.47 -0.17 0.00 0.00 0.00 0.00 61.98 61.38 1nf5 s VAL 217 Cb -0.14 -3.50 0.12 0.00 0.00 0.00 0.00 36.38 32.86 1nf5 s VAL 217 CO -0.09 -0.03 0.54 -0.63 0.00 0.00 0.00 175.10 174.90 1nf5 s ILE 218 N 1.63 5.11 -0.33 2.22 -1.09 -0.16 -1.11 121.20 127.47 1nf5 s ILE 218 Ca 0.04 -1.31 -0.25 0.00 -2.23 0.00 0.00 60.65 56.91 1nf5 s ILE 218 Cb -0.18 -4.36 0.01 0.00 -1.58 0.00 0.00 42.46 36.35 1nf5 s ILE 218 CO 0.08 -0.91 0.86 0.21 -1.23 0.00 0.00 174.94 173.95 1nf5 s ASN 219 N 3.50 6.70 -0.58 3.58 2.47 -0.67 -0.64 114.94 129.30 1nf5 s ASN 219 Ca 0.05 0.67 -0.28 0.00 0.42 0.00 0.00 52.86 53.73 1nf5 s ASN 219 Cb -0.28 -2.44 0.03 0.00 -1.45 0.00 0.00 41.25 37.11 1nf5 s ASN 219 CO 0.04 -0.72 1.25 -1.58 -3.72 0.00 0.00 177.10 172.38 1nf5 s GLN 220 N 3.18 3.46 0.84 0.43 0.74 -0.05 -1.34 119.66 126.92 1nf5 s GLN 220 Ca 0.35 0.29 -0.11 0.00 0.05 0.00 0.00 55.36 55.94 1nf5 s GLN 220 Cb -0.13 -4.05 0.09 0.00 1.10 0.00 0.00 33.01 30.03 1nf5 s GLN 220 CO 0.15 -1.76 1.09 0.00 -0.55 0.00 0.00 175.29 174.22 1nf5 s ALA 221 N 5.24 1.90 0.00 1.58 0.00 -0.22 -4.87 121.76 125.39 1nf5 s ALA 221 Ca 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1nf5 s ALA 221 Cb -0.08 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1nf5 s ALA 221 CO 0.25 -2.04 0.00 0.41 0.00 0.00 0.00 175.76 174.38 1nf5 n GLY 222 N -1.37 -3.02 0.08 0.00 0.00 -1.26 -4.76 105.19 94.87 1nf5 n GLY 222 Ca 0.07 -1.87 0.01 0.00 0.00 0.00 0.00 46.02 44.24 1nf5 n GLY 222 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nf5 n GLU 223 N -0.27 2.87 -1.40 1.61 -0.58 -1.26 -5.05 120.64 116.56 1nf5 n GLU 223 Ca 0.00 -1.65 -0.29 0.00 -0.42 0.00 0.00 57.16 54.80 1nf5 n GLU 223 Cb 0.00 -1.07 0.17 0.00 -0.57 0.00 0.00 31.44 29.97 1nf5 n GLU 223 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1nf5 s SER 224 N -1.14 2.66 0.54 1.62 0.01 -1.26 -4.97 113.70 111.16 1nf5 s SER 224 Ca 0.05 0.85 -0.21 0.00 1.31 0.00 0.00 55.95 57.95 1nf5 s SER 224 Cb 0.04 -1.31 -0.05 0.00 0.21 0.00 0.00 66.02 64.91 1nf5 s SER 224 CO 0.02 -3.07 1.26 -0.04 0.41 0.00 0.00 173.24 171.82 1nf5 s MET 225 N -5.31 3.26 0.34 12.44 -1.94 -1.25 -4.90 119.30 121.94 1nf5 s MET 225 Ca 0.67 1.98 -0.29 0.00 -1.71 0.00 0.00 55.69 56.34 1nf5 s MET 225 Cb -0.13 -2.19 -0.11 0.00 2.01 0.00 0.00 34.83 34.40 1nf5 s MET 225 CO 0.55 -1.02 1.52 0.12 -0.01 0.00 0.00 175.02 176.18 1nf5 s PHE 226 N -1.46 2.66 -0.58 -0.03 5.36 0.18 -4.44 117.98 119.66 1nf5 s PHE 226 Ca 0.71 1.03 0.05 0.00 -0.96 0.00 0.00 56.93 57.76 1nf5 s PHE 226 Cb -0.34 -4.03 0.17 0.00 -0.34 0.00 0.00 43.02 38.48 1nf5 s PHE 226 CO 0.39 -3.20 0.43 1.21 -1.46 0.00 0.00 175.22 172.60 1nf5 s ASN 227 N 0.09 3.48 0.17 6.13 3.84 -1.26 -0.58 114.94 126.81 1nf5 s ASN 227 Ca 0.57 -3.52 -0.22 0.00 0.21 0.00 0.00 52.86 49.89 1nf5 s ASN 227 Cb -0.47 -1.16 0.07 0.00 -0.55 0.00 0.00 41.25 39.15 1nf5 s ASN 227 CO 0.57 -0.12 1.60 -0.09 -2.79 0.00 0.00 177.10 176.27 1nf5 h ARG 228 N 5.52 -0.22 -0.45 0.43 2.43 -1.90 -2.25 114.38 117.94 1nf5 h ARG 228 Ca 0.19 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.32 1nf5 h ARG 228 Cb 0.82 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.40 1nf5 h ARG 228 CO 0.58 -0.15 0.06 0.00 -1.51 0.00 0.00 179.97 178.95 1nf5 h ALA 229 N 0.83 1.26 -0.51 2.80 0.00 -1.86 -1.43 119.26 120.35 1nf5 h ALA 229 Ca 0.18 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1nf5 h ALA 229 Cb 0.53 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1nf5 h ALA 229 CO -0.54 0.50 -0.16 -0.22 0.00 0.00 0.00 179.25 178.83 1nf5 h LYS 230 N 0.67 1.01 -0.59 0.00 3.64 -1.53 -1.34 116.57 118.43 1nf5 h LYS 230 Ca 0.14 -0.40 -0.06 0.00 -1.27 0.00 0.00 60.65 59.07 1nf5 h LYS 230 Cb 0.33 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1nf5 h LYS 230 CO 0.01 1.08 0.14 -0.07 -2.27 0.00 0.00 179.45 178.33 1nf5 h LEU 231 N 0.88 0.86 -0.85 5.20 3.38 -0.97 -0.76 115.31 123.06 1nf5 h LEU 231 Ca 0.13 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1nf5 h LEU 231 Cb 0.73 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1nf5 h LEU 231 CO 0.06 0.84 0.21 -0.07 0.09 0.00 0.00 178.44 179.57 1nf5 h LEU 232 N 0.88 0.99 -0.32 1.67 3.38 -0.90 0.15 115.31 121.16 1nf5 h LEU 232 Ca 0.19 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1nf5 h LEU 232 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1nf5 h LEU 232 CO 0.00 0.93 0.12 0.78 0.09 0.00 0.00 178.44 180.36 1nf5 h ASN 233 N 1.02 0.45 -0.60 -0.43 2.35 -0.52 -1.83 115.58 116.02 1nf5 h ASN 233 Ca 0.22 -0.18 0.06 0.00 -0.55 0.00 0.00 56.30 55.86 1nf5 h ASN 233 Cb 0.30 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.50 1nf5 h ASN 233 CO -0.01 0.51 0.29 0.58 -1.65 0.00 0.00 177.43 177.16 1nf5 h VAL 234 N 0.37 0.91 -0.64 2.81 2.07 -0.67 -1.89 116.25 119.21 1nf5 h VAL 234 Ca 0.11 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1nf5 h VAL 234 Cb 0.21 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1nf5 h VAL 234 CO -0.01 0.10 0.28 1.23 0.02 0.00 0.00 177.57 179.20 1nf5 h GLY 235 N 0.55 0.98 0.89 2.17 0.00 -0.73 0.73 103.07 107.65 1nf5 h GLY 235 Ca 0.28 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1nf5 h GLY 235 CO -0.21 0.45 -0.02 -2.75 0.00 0.00 0.00 176.54 174.02 1nf5 h PHE 236 N 0.90 -0.05 0.10 5.60 3.57 -0.66 -0.07 116.94 126.33 1nf5 h PHE 236 Ca 0.22 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.71 1nf5 h PHE 236 Cb 0.13 0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1nf5 h PHE 236 CO 0.01 0.07 -0.05 0.87 -2.23 0.00 0.00 178.31 176.99 1nf5 h LYS 237 N -0.16 -0.13 -0.79 1.11 1.79 -0.98 -2.85 116.57 114.57 1nf5 h LYS 237 Ca -0.01 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1nf5 h LYS 237 Cb 0.15 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.79 1nf5 h LYS 237 CO 0.01 -0.04 0.34 0.93 -1.08 0.00 0.00 179.45 179.61 1nf5 h GLU 238 N -0.18 1.15 -0.39 3.15 4.39 -0.85 -2.87 114.58 118.99 1nf5 h GLU 238 Ca -0.01 -0.19 0.03 0.00 0.34 0.00 0.00 59.36 59.53 1nf5 h GLU 238 Cb 0.15 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 1nf5 h GLU 238 CO 0.02 0.92 0.19 0.00 -1.16 0.00 0.00 179.01 178.98 1nf5 h ALA 239 N 1.23 0.48 0.00 3.43 0.00 -0.98 -2.06 119.26 121.36 1nf5 h ALA 239 Ca 0.27 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1nf5 h ALA 239 Cb 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1nf5 h ALA 239 CO -0.03 -0.17 0.00 -0.07 0.00 0.00 0.00 179.25 178.99 1nf5 h LEU 240 N 0.39 0.00 -0.01 0.00 3.38 -1.27 0.13 115.31 117.93 1nf5 h LEU 240 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1nf5 h LEU 240 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1nf5 h LEU 240 CO -0.12 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.70 1nf5 n LYS 241 N -2.89 0.05 -0.06 1.13 5.02 -0.77 -3.79 118.16 116.85 1nf5 n LYS 241 Ca -0.03 0.06 -0.19 0.00 -2.02 0.00 0.00 58.31 56.14 1nf5 n LYS 241 Cb 0.07 -1.56 -0.13 0.00 -0.02 0.00 0.00 35.03 33.38 1nf5 n LYS 241 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1nf5 n ASP 242 N -1.65 1.95 -3.59 4.39 9.92 0.45 -5.06 116.55 122.97 1nf5 n ASP 242 Ca 0.06 0.06 -0.08 0.00 -0.53 0.00 0.00 54.79 54.31 1nf5 n ASP 242 Cb 0.34 -0.58 -0.02 0.00 -0.64 0.00 0.00 41.12 40.22 1nf5 n ASP 242 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1nf5 s TYR 243 N -2.54 -0.33 -1.49 1.24 5.04 -1.17 -5.05 117.35 113.04 1nf5 s TYR 243 Ca -0.27 0.09 -0.08 0.00 -2.44 0.00 0.00 57.07 54.37 1nf5 s TYR 243 Cb 0.08 0.59 0.00 0.00 0.35 0.00 0.00 41.96 42.98 1nf5 s TYR 243 CO 0.70 -0.79 2.67 -0.40 -1.34 0.00 0.00 175.55 176.39 1nf5 n ASP 244 N -0.36 8.13 -4.76 4.32 5.75 -1.26 -4.42 116.55 123.95 1nf5 n ASP 244 Ca -0.10 -2.82 -0.39 0.00 -0.01 0.00 0.00 54.79 51.47 1nf5 n ASP 244 Cb 0.62 -1.49 0.03 0.00 -1.03 0.00 0.00 41.12 39.25 1nf5 n ASP 244 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1nf5 s TYR 245 N 0.91 2.37 -0.01 2.11 1.51 -1.26 -4.92 117.35 118.05 1nf5 s TYR 245 Ca 0.62 1.34 0.00 0.00 -1.01 0.00 0.00 57.07 58.01 1nf5 s TYR 245 Cb 0.18 -3.83 0.00 0.00 -0.11 0.00 0.00 41.96 38.19 1nf5 s TYR 245 CO -0.07 -2.88 0.36 0.27 -1.11 0.00 0.00 175.55 172.13 1nf5 n ASN 246 N -0.69 0.73 -3.94 2.29 6.94 0.01 -4.89 115.26 115.71 1nf5 n ASN 246 Ca 0.08 -0.86 -0.15 0.00 -0.02 0.00 0.00 54.58 53.63 1nf5 n ASN 246 Cb 0.44 0.28 -0.14 0.00 -2.36 0.00 0.00 39.78 38.00 1nf5 n ASN 246 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1nf5 s PHE 248 N -0.16 1.67 -0.21 0.00 0.08 0.40 -0.93 117.98 118.84 1nf5 s PHE 248 Ca 0.01 -0.77 -0.06 0.00 0.12 0.00 0.00 56.93 56.23 1nf5 s PHE 248 Cb -0.02 -1.26 -0.03 0.00 -0.57 0.00 0.00 43.02 41.14 1nf5 s PHE 248 CO -0.00 -0.44 0.03 0.08 -0.10 0.00 0.00 175.22 174.79 1nf5 s VAL 249 N 1.14 4.15 -0.30 -0.44 1.01 -0.06 -0.60 120.40 125.31 1nf5 s VAL 249 Ca -0.05 -0.24 -0.10 0.00 0.00 0.00 0.00 61.98 61.59 1nf5 s VAL 249 Cb -0.14 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1nf5 s VAL 249 CO -0.03 0.41 0.17 -0.36 0.00 0.00 0.00 175.10 175.29 1nf5 s PHE 250 N 1.06 3.18 -0.04 5.22 0.40 0.45 -0.36 117.98 127.90 1nf5 s PHE 250 Ca 0.03 -0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.10 1nf5 s PHE 250 Cb -0.14 -2.36 0.02 0.00 0.51 0.00 0.00 43.02 41.04 1nf5 s PHE 250 CO 0.02 -0.33 -0.05 0.45 0.70 0.00 0.00 175.22 176.01 1nf5 s SER 251 N 1.68 0.92 0.61 1.36 0.15 -0.08 -1.33 113.70 117.01 1nf5 s SER 251 Ca 0.06 -0.13 -0.18 0.00 0.70 0.00 0.00 55.95 56.40 1nf5 s SER 251 Cb -0.16 -0.41 -0.03 0.00 -1.71 0.00 0.00 66.02 63.71 1nf5 s SER 251 CO 0.08 -0.03 1.16 -1.81 1.20 0.00 0.00 173.24 173.83 1nf5 s ASP 252 N 0.74 5.24 0.00 5.45 1.01 -0.51 -4.00 116.67 124.60 1nf5 s ASP 252 Ca -0.10 2.21 0.23 0.00 0.71 0.00 0.00 52.55 55.60 1nf5 s ASP 252 Cb -0.13 -2.58 1.02 0.00 1.01 0.00 0.00 42.92 42.24 1nf5 s ASP 252 CO 0.00 -1.55 1.73 0.55 0.21 0.00 0.00 175.17 176.12 1nf5 n VAL 253 N -1.82 0.40 -0.76 -1.27 3.14 -1.26 -3.34 118.33 113.43 1nf5 n VAL 253 Ca 0.12 0.10 0.08 0.00 -2.96 0.00 0.00 64.34 61.68 1nf5 n VAL 253 Cb 0.51 -0.72 0.26 0.00 -1.06 0.00 0.00 33.84 32.83 1nf5 n VAL 253 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 1nf5 n ASP 254 N -1.44 3.92 -4.23 6.55 5.68 -1.26 -4.44 116.55 121.34 1nf5 n ASP 254 Ca 0.07 -2.72 -0.33 0.00 -0.50 0.00 0.00 54.79 51.31 1nf5 n ASP 254 Cb 0.24 -0.49 -0.15 0.00 -1.14 0.00 0.00 41.12 39.58 1nf5 n ASP 254 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1nf5 s LEU 255 N -2.30 2.38 -0.08 -2.12 1.43 -1.21 -0.48 118.68 116.31 1nf5 s LEU 255 Ca 0.40 -0.52 0.05 0.00 -1.03 0.00 0.00 54.13 53.02 1nf5 s LEU 255 Cb 0.30 -1.54 -0.00 0.00 0.03 0.00 0.00 46.19 44.97 1nf5 s LEU 255 CO 0.13 0.06 -0.23 -0.63 0.23 0.00 0.00 176.35 175.91 1nf5 s ILE 256 N 0.96 1.94 0.39 -0.59 -1.09 -0.38 -4.91 121.20 117.52 1nf5 s ILE 256 Ca -0.03 -0.97 -0.23 0.00 -2.23 0.00 0.00 60.65 57.19 1nf5 s ILE 256 Cb -0.15 -1.67 -0.10 0.00 -1.58 0.00 0.00 42.46 38.97 1nf5 s ILE 256 CO -0.03 0.54 0.98 -2.16 -1.23 0.00 0.00 174.94 173.04 1nf5 s PRO 257 N 0.15 4.29 0.00 2.79 0.04 -1.26 -0.53 135.00 140.48 1nf5 s PRO 257 Ca -0.12 1.31 0.23 0.00 0.04 0.00 0.00 61.00 62.47 1nf5 s PRO 257 Cb -0.16 -2.47 0.15 0.00 0.04 0.00 0.00 34.50 32.06 1nf5 s PRO 257 CO 0.06 0.00 1.20 -1.33 0.04 0.00 0.00 177.00 176.97 1nf5 n MET 258 N -0.13 1.47 -3.67 4.56 2.81 0.48 -4.86 117.12 117.78 1nf5 n MET 258 Ca 0.05 -1.19 -0.20 0.00 -1.81 0.00 0.00 57.70 54.56 1nf5 n MET 258 Cb 0.51 -1.48 -0.18 0.00 -0.71 0.00 0.00 33.22 31.37 1nf5 n MET 258 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1nf5 s ASN 259 N -2.34 1.09 0.00 7.83 3.84 -1.26 -0.81 114.94 123.28 1nf5 s ASN 259 Ca 0.22 0.10 0.12 0.00 0.21 0.00 0.00 52.86 53.51 1nf5 s ASN 259 Cb 0.19 -0.10 0.72 0.00 -0.55 0.00 0.00 41.25 41.50 1nf5 s ASN 259 CO 0.49 -0.25 1.14 -0.90 -2.79 0.00 0.00 177.10 174.79 1nf5 n ASP 260 N 5.28 0.00 0.05 -4.21 3.85 -0.68 -1.45 116.55 119.39 1nf5 n ASP 260 Ca -0.04 -0.53 0.13 0.00 -0.71 0.00 0.00 54.79 53.64 1nf5 n ASP 260 Cb 0.50 0.00 0.42 0.00 -1.35 0.00 0.00 41.12 40.69 1nf5 n ASP 260 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 1nf5 n HIS 261 N -0.91 0.48 -2.67 2.11 8.25 -1.26 -4.43 115.22 116.78 1nf5 n HIS 261 Ca 0.09 0.14 -0.42 0.00 -0.26 0.00 0.00 57.72 57.27 1nf5 n HIS 261 Cb 0.04 -0.69 -0.03 0.00 1.12 0.00 0.00 29.99 30.44 1nf5 n HIS 261 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1nf5 s ASN 262 N -3.84 6.53 0.09 0.41 3.84 -0.53 -4.96 114.94 116.48 1nf5 s ASN 262 Ca 0.11 -1.62 -0.31 0.00 0.21 0.00 0.00 52.86 51.26 1nf5 s ASN 262 Cb 0.15 -2.52 -0.07 0.00 -0.55 0.00 0.00 41.25 38.26 1nf5 s ASN 262 CO 0.61 -1.38 1.42 -0.89 -2.79 0.00 0.00 177.10 174.06 1nf5 s THR 263 N 4.30 3.36 -1.47 -5.21 2.01 -1.26 -4.93 115.64 112.45 1nf5 s THR 263 Ca 0.42 0.93 -0.12 0.00 0.31 0.00 0.00 61.69 63.23 1nf5 s THR 263 Cb -0.02 -3.59 0.03 0.00 0.01 0.00 0.00 72.50 68.93 1nf5 s THR 263 CO -0.10 0.05 2.38 -1.22 -0.69 0.00 0.00 174.62 175.04 1nf5 n TYR 264 N 4.40 3.13 -3.91 4.92 4.02 -1.26 -4.85 117.16 123.61 1nf5 n TYR 264 Ca 0.12 -2.98 -0.11 0.00 -0.01 0.00 0.00 57.90 54.93 1nf5 n TYR 264 Cb 0.42 -2.43 -0.00 0.00 -0.02 0.00 0.00 39.34 37.32 1nf5 n TYR 264 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 1nf5 s ARG 265 N 2.35 2.11 0.39 -0.72 1.04 -1.26 -4.95 118.95 117.92 1nf5 s ARG 265 Ca 0.52 -1.54 -0.10 0.00 -1.04 0.00 0.00 55.73 53.57 1nf5 s ARG 265 Cb 0.15 0.56 -0.06 0.00 -2.04 0.00 0.00 34.95 33.56 1nf5 s ARG 265 CO -0.07 -0.95 0.76 0.00 -0.04 0.00 0.00 175.30 174.99 1nf5 s PHE 267 N -2.34 1.77 0.59 0.00 0.40 -1.26 -5.02 117.98 112.12 1nf5 s PHE 267 Ca 0.51 -1.30 0.30 0.00 -0.60 0.00 0.00 56.93 55.84 1nf5 s PHE 267 Cb -0.10 -1.10 1.81 0.00 0.51 0.00 0.00 43.02 44.14 1nf5 s PHE 267 CO 0.31 -0.34 2.24 0.66 0.70 0.00 0.00 175.22 178.78 1nf5 h SER 268 N 1.88 0.00 -3.74 1.36 4.64 -2.02 -3.41 113.55 112.26 1nf5 h SER 268 Ca -0.35 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.48 1nf5 h SER 268 Cb 1.27 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.17 1nf5 h SER 268 CO 0.56 0.00 -0.78 -1.10 -0.87 0.00 0.00 176.83 174.64 1nf5 s GLN 269 N -4.62 1.19 0.17 4.77 -1.52 -1.26 -5.06 119.66 113.33 1nf5 s GLN 269 Ca -0.05 -1.34 -0.32 0.00 -1.95 0.00 0.00 55.36 51.69 1nf5 s GLN 269 Cb 0.15 -1.20 -0.16 0.00 -0.22 0.00 0.00 33.01 31.58 1nf5 s GLN 269 CO 0.54 0.24 1.00 -2.30 -0.25 0.00 0.00 175.29 174.52 1nf5 n PRO 270 N 0.40 0.79 -4.00 2.91 -0.02 -1.24 -4.50 135.00 129.34 1nf5 n PRO 270 Ca -0.14 0.28 -0.35 0.00 -2.02 0.00 0.00 63.50 61.27 1nf5 n PRO 270 Cb 0.57 -1.66 -0.11 0.00 -0.02 0.00 0.00 33.50 32.27 1nf5 n PRO 270 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1nf5 s ARG 271 N -0.61 3.79 -0.31 -0.52 6.06 -0.11 -0.32 118.95 126.93 1nf5 s ARG 271 Ca 0.72 -0.43 -0.11 0.00 -2.50 0.00 0.00 55.73 53.41 1nf5 s ARG 271 Cb -0.90 -3.19 -0.02 0.00 0.06 0.00 0.00 34.95 30.89 1nf5 s ARG 271 CO 0.55 0.09 0.19 -1.58 -2.50 0.00 0.00 175.30 172.05 1nf5 s HIS 272 N 0.84 3.20 -0.16 5.12 5.65 0.04 0.36 115.29 130.33 1nf5 s HIS 272 Ca 0.03 -0.28 -0.13 0.00 0.25 0.00 0.00 55.06 54.93 1nf5 s HIS 272 Cb -0.14 -2.40 -0.23 0.00 -1.18 0.00 0.00 32.58 28.64 1nf5 s HIS 272 CO 0.02 -0.35 0.28 -0.89 -0.65 0.00 0.00 174.74 173.15 1nf5 n ILE 273 N 5.04 1.67 -2.11 0.89 5.41 0.10 -4.33 119.36 126.03 1nf5 n ILE 273 Ca -0.14 -0.37 -0.42 0.00 1.00 0.00 0.00 62.75 62.82 1nf5 n ILE 273 Cb 0.50 -1.87 0.00 0.00 -0.71 0.00 0.00 39.64 37.56 1nf5 n ILE 273 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1nf5 n SER 274 N -3.91 5.32 0.04 4.38 3.41 -1.09 -4.71 113.62 117.05 1nf5 n SER 274 Ca -0.33 -3.03 -0.17 0.00 -0.26 0.00 0.00 58.87 55.09 1nf5 n SER 274 Cb 0.88 -1.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.25 1nf5 n SER 274 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1nf5 h VAL 275 N 3.63 1.32 -2.31 -3.33 2.07 -1.81 -3.40 116.25 112.42 1nf5 h VAL 275 Ca 0.49 -2.25 -0.59 0.00 0.82 0.00 0.00 66.70 65.17 1nf5 h VAL 275 Cb 0.58 2.30 -0.41 0.00 -1.52 0.00 0.00 31.29 32.24 1nf5 h VAL 275 CO 1.68 0.69 -0.74 0.00 0.02 0.00 0.00 177.57 179.22 1nf5 n ALA 276 N -2.60 3.47 -1.76 1.67 0.00 -0.99 -2.70 120.51 117.60 1nf5 n ALA 276 Ca -0.09 -4.27 -0.40 0.00 0.00 0.00 0.00 53.44 48.68 1nf5 n ALA 276 Cb 0.83 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 19.35 1nf5 n ALA 276 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1nf5 s MET 277 N -1.80 4.62 0.40 0.00 -1.94 -1.26 -1.80 119.30 117.52 1nf5 s MET 277 Ca 0.36 1.77 0.13 0.00 -1.71 0.00 0.00 55.69 56.24 1nf5 s MET 277 Cb 0.11 -3.15 0.95 0.00 2.01 0.00 0.00 34.83 34.75 1nf5 s MET 277 CO -0.08 0.20 1.90 0.38 -0.01 0.00 0.00 175.02 177.41 1nf5 h ASP 278 N 3.75 0.50 -0.14 3.03 2.03 -1.38 0.24 116.42 124.45 1nf5 h ASP 278 Ca -0.47 0.03 0.04 0.00 -0.73 0.00 0.00 57.03 55.90 1nf5 h ASP 278 Cb 1.21 -0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 39.64 1nf5 h ASP 278 CO 0.67 0.26 0.15 0.50 -1.03 0.00 0.00 179.24 179.79 1nf5 h LYS 279 N 0.53 0.00 -0.46 4.15 3.64 -1.91 -0.68 116.57 121.84 1nf5 h LYS 279 Ca 0.40 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.59 1nf5 h LYS 279 Cb 0.80 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.50 1nf5 h LYS 279 CO -0.15 0.00 0.07 1.19 -2.27 0.00 0.00 179.45 178.29 1nf5 n PHE 280 N -3.85 1.46 -2.74 1.91 0.99 0.71 -4.93 117.46 111.01 1nf5 n PHE 280 Ca 0.01 -1.47 -0.18 0.00 -0.00 0.00 0.00 57.45 55.81 1nf5 n PHE 280 Cb 0.27 -0.54 0.02 0.00 -1.00 0.00 0.00 39.48 38.23 1nf5 n PHE 280 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1nf5 n GLY 281 N -0.94 -0.30 3.87 1.37 0.00 -0.26 -2.81 105.19 106.12 1nf5 n GLY 281 Ca 0.35 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 1nf5 n GLY 281 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nf5 n PHE 282 N -4.22 -2.29 -4.04 1.61 0.99 -0.38 -4.97 117.46 104.17 1nf5 n PHE 282 Ca -0.12 0.88 -0.08 0.00 -0.00 0.00 0.00 57.45 58.13 1nf5 n PHE 282 Cb 0.61 -3.95 -0.09 0.00 -1.00 0.00 0.00 39.48 35.05 1nf5 n PHE 282 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1nf5 s SER 283 N -3.26 0.33 0.13 4.37 0.15 -1.12 -4.74 113.70 109.56 1nf5 s SER 283 Ca 0.65 -0.95 -0.30 0.00 0.70 0.00 0.00 55.95 56.05 1nf5 s SER 283 Cb -0.33 0.27 -0.07 0.00 -1.71 0.00 0.00 66.02 64.18 1nf5 s SER 283 CO 0.81 -0.68 1.26 -0.22 1.20 0.00 0.00 173.24 175.60 1nf5 s LEU 284 N -2.94 4.40 0.33 3.45 2.96 -1.10 -4.14 118.68 121.64 1nf5 s LEU 284 Ca 0.11 2.21 0.06 0.00 -0.22 0.00 0.00 54.13 56.29 1nf5 s LEU 284 Cb 0.07 -3.59 0.57 0.00 0.50 0.00 0.00 46.19 43.73 1nf5 s LEU 284 CO -0.07 -0.49 1.81 1.55 -1.32 0.00 0.00 176.35 177.83 1nf5 h PRO 285 N 6.13 0.38 -1.79 0.98 0.13 -1.88 -3.45 132.00 132.50 1nf5 h PRO 285 Ca -0.43 -0.12 0.01 0.00 -0.87 0.00 0.00 66.00 64.59 1nf5 h PRO 285 Cb 1.21 -0.04 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 1nf5 h PRO 285 CO 0.80 0.56 0.35 1.52 -0.23 0.00 0.00 178.00 180.99 1nf5 s TYR 286 N -4.60 -0.54 -0.19 1.56 -0.85 -1.26 -5.06 117.35 106.41 1nf5 s TYR 286 Ca -0.06 1.01 0.27 0.00 -0.52 0.00 0.00 57.07 57.77 1nf5 s TYR 286 Cb 0.15 0.41 1.25 0.00 0.38 0.00 0.00 41.96 44.14 1nf5 s TYR 286 CO 0.76 -0.45 1.81 -0.39 -1.52 0.00 0.00 175.55 175.77 1nf5 h VAL 287 N 2.98 0.00 -0.30 -3.49 -1.51 -2.03 -1.99 116.25 109.91 1nf5 h VAL 287 Ca -0.24 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1nf5 h VAL 287 Cb 1.15 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.25 1nf5 h VAL 287 CO 0.30 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.64 1nf5 n GLN 288 N -2.48 2.08 -2.83 5.19 3.00 -1.26 -4.90 117.38 116.18 1nf5 n GLN 288 Ca 0.00 -1.24 -0.42 0.00 -0.01 0.00 0.00 57.00 55.33 1nf5 n GLN 288 Cb 0.18 -1.45 -0.04 0.00 0.00 0.00 0.00 30.24 28.93 1nf5 n GLN 288 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.06 176.59 1nf5 s TYR 289 N -1.63 3.44 -0.10 1.08 5.04 -0.75 -4.88 117.35 119.55 1nf5 s TYR 289 Ca 0.23 1.36 0.14 0.00 -2.44 0.00 0.00 57.07 56.35 1nf5 s TYR 289 Cb 0.14 -3.07 0.27 0.00 0.35 0.00 0.00 41.96 39.65 1nf5 s TYR 289 CO 0.12 -0.25 1.13 0.34 -1.34 0.00 0.00 175.55 175.56 1nf5 n PHE 290 N 5.23 0.00 -2.69 4.97 7.35 -1.26 -5.01 117.46 126.05 1nf5 n PHE 290 Ca 0.06 -0.79 -0.23 0.00 -0.76 0.00 0.00 57.45 55.73 1nf5 n PHE 290 Cb 0.49 -0.15 0.09 0.00 0.35 0.00 0.00 39.48 40.26 1nf5 n PHE 290 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1nf5 s GLY 291 N -2.36 1.76 0.00 7.13 0.00 -1.26 -4.78 107.32 107.81 1nf5 s GLY 291 Ca 0.26 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.19 1nf5 s GLY 291 CO -0.03 -1.27 0.00 0.61 0.00 0.00 0.00 173.10 172.41 1nf5 n GLY 292 N -2.67 1.66 2.81 0.20 0.00 -1.26 -4.66 105.19 101.27 1nf5 n GLY 292 Ca 0.15 -0.31 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 1nf5 n GLY 292 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nf5 s VAL 293 N 0.00 0.29 0.14 1.61 1.01 -1.26 -1.42 120.40 120.77 1nf5 s VAL 293 Ca 0.00 0.07 -0.07 0.00 0.00 0.00 0.00 61.98 61.98 1nf5 s VAL 293 Cb 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 35.97 1nf5 s VAL 293 CO 0.00 0.20 0.21 -0.94 0.00 0.00 0.00 175.10 174.57 1nf5 s SER 294 N 1.32 0.12 0.01 3.32 1.04 -0.44 -0.72 113.70 118.35 1nf5 s SER 294 Ca -0.05 -0.91 0.01 0.00 0.48 0.00 0.00 55.95 55.48 1nf5 s SER 294 Cb -0.13 0.38 -0.01 0.00 0.10 0.00 0.00 66.02 66.36 1nf5 s SER 294 CO -0.02 -0.82 -0.05 0.00 0.98 0.00 0.00 173.24 173.32 1nf5 s ALA 295 N -3.97 0.38 0.00 5.32 0.00 0.16 -0.41 121.76 123.24 1nf5 s ALA 295 Ca 0.16 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1nf5 s ALA 295 Cb 0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.15 1nf5 s ALA 295 CO -0.02 0.02 -0.02 -0.51 0.00 0.00 0.00 175.76 175.23 1nf5 s LEU 296 N -0.75 2.02 0.70 0.00 1.02 0.23 -0.94 118.68 120.97 1nf5 s LEU 296 Ca -0.04 -0.07 -0.11 0.00 0.02 0.00 0.00 54.13 53.93 1nf5 s LEU 296 Cb -0.05 -0.07 0.01 0.00 0.02 0.00 0.00 46.19 46.10 1nf5 s LEU 296 CO -0.00 -0.00 1.07 -0.94 0.02 0.00 0.00 176.35 176.49 1nf5 s SER 297 N -0.15 5.20 0.23 2.29 1.04 -1.26 -0.45 113.70 120.60 1nf5 s SER 297 Ca -0.01 1.70 -0.06 0.00 0.48 0.00 0.00 55.95 58.07 1nf5 s SER 297 Cb -0.01 -2.51 0.40 0.00 0.10 0.00 0.00 66.02 64.00 1nf5 s SER 297 CO -0.00 -1.56 1.72 0.50 0.98 0.00 0.00 173.24 174.88 1nf5 h LYS 298 N -0.67 0.37 -0.39 4.02 3.64 -1.53 0.52 116.57 122.53 1nf5 h LYS 298 Ca -0.44 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.87 1nf5 h LYS 298 Cb 1.22 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 1nf5 h LYS 298 CO 0.55 0.25 0.05 1.96 -2.27 0.00 0.00 179.45 179.99 1nf5 h GLN 299 N 0.38 0.66 -0.29 1.90 1.08 -1.91 -1.14 115.11 115.78 1nf5 h GLN 299 Ca 0.38 -0.18 0.02 0.00 -1.45 0.00 0.00 58.65 57.41 1nf5 h GLN 299 Cb 0.57 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1nf5 h GLN 299 CO -0.40 0.72 0.15 1.96 -0.95 0.00 0.00 178.83 180.31 1nf5 h GLN 300 N 0.50 0.31 -0.29 1.46 4.20 -1.74 -0.89 115.11 118.66 1nf5 h GLN 300 Ca 0.12 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.83 1nf5 h GLN 300 Cb 0.39 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1nf5 h GLN 300 CO 0.01 0.20 0.13 0.35 -0.67 0.00 0.00 178.83 178.86 1nf5 h PHE 301 N 0.32 0.25 -0.31 2.96 3.57 -0.74 -2.46 116.94 120.51 1nf5 h PHE 301 Ca 0.12 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.56 1nf5 h PHE 301 Cb 0.03 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1nf5 h PHE 301 CO -0.09 0.13 -0.11 -0.07 -2.23 0.00 0.00 178.31 175.94 1nf5 h LEU 302 N 0.29 0.51 -0.30 0.59 4.07 -1.04 -1.30 115.31 118.11 1nf5 h LEU 302 Ca 0.12 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1nf5 h LEU 302 Cb 0.06 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.66 1nf5 h LEU 302 CO -0.10 0.66 0.00 -1.54 -1.08 0.00 0.00 178.44 176.38 1nf5 n SER 303 N -4.21 0.18 -0.39 -0.43 3.41 -0.35 -1.51 113.62 110.33 1nf5 n SER 303 Ca 0.01 0.56 0.07 0.00 -0.26 0.00 0.00 58.87 59.25 1nf5 n SER 303 Cb 0.32 -0.59 0.15 0.00 -0.26 0.00 0.00 64.21 63.83 1nf5 n SER 303 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1nf5 n ILE 304 N -1.72 1.70 -3.20 -1.33 -5.35 -1.07 -4.93 119.36 103.46 1nf5 n ILE 304 Ca 0.01 -1.72 -0.23 0.00 -0.27 0.00 0.00 62.75 60.55 1nf5 n ILE 304 Cb 0.11 0.01 0.05 0.00 -1.74 0.00 0.00 39.64 38.06 1nf5 n ILE 304 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1nf5 n ASN 305 N -0.69 -6.13 0.00 7.28 4.05 -0.57 -4.69 115.26 114.52 1nf5 n ASN 305 Ca 0.14 -0.37 0.00 0.00 0.45 0.00 0.00 54.58 54.80 1nf5 n ASN 305 Cb 0.61 -4.92 0.00 0.00 1.23 0.00 0.00 39.78 36.70 1nf5 n ASN 305 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1nf5 n GLY 306 N -1.65 0.70 3.89 8.20 0.00 -0.52 -0.45 105.19 115.36 1nf5 n GLY 306 Ca -0.08 -0.74 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 1nf5 n GLY 306 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nf5 s PHE 307 N 0.00 3.13 0.63 1.61 0.08 -1.26 -4.81 117.98 117.36 1nf5 s PHE 307 Ca 0.00 -0.16 -0.17 0.00 0.12 0.00 0.00 56.93 56.72 1nf5 s PHE 307 Cb 0.00 -1.64 -0.01 0.00 -0.57 0.00 0.00 43.02 40.80 1nf5 s PHE 307 CO 0.00 0.33 1.16 -1.25 -0.10 0.00 0.00 175.22 175.35 1nf5 s PRO 308 N -3.97 2.82 0.00 0.24 0.04 -1.26 -4.12 135.00 128.75 1nf5 s PRO 308 Ca 0.37 1.61 0.09 0.00 0.04 0.00 0.00 61.00 63.11 1nf5 s PRO 308 Cb -0.08 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 1nf5 s PRO 308 CO 0.27 -1.28 0.40 0.09 0.04 0.00 0.00 177.00 176.52 1nf5 n ASN 309 N -2.06 0.53 -0.80 6.66 3.02 -1.26 -3.63 115.26 117.72 1nf5 n ASN 309 Ca 0.12 -0.76 0.06 0.00 -0.03 0.00 0.00 54.58 53.96 1nf5 n ASN 309 Cb 0.51 0.91 0.17 0.00 -0.61 0.00 0.00 39.78 40.76 1nf5 n ASN 309 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1nf5 n ASN 310 N -1.04 2.29 -4.43 6.41 5.03 -1.26 -4.79 115.26 117.47 1nf5 n ASN 310 Ca 0.02 -2.10 -0.41 0.00 0.87 0.00 0.00 54.58 52.96 1nf5 n ASN 310 Cb 0.14 -0.32 -0.11 0.00 -1.02 0.00 0.00 39.78 38.47 1nf5 n ASN 310 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1nf5 s TYR 311 N -1.58 3.24 -0.06 3.10 1.51 -1.26 -4.99 117.35 117.30 1nf5 s TYR 311 Ca 0.26 -0.70 0.04 0.00 -1.01 0.00 0.00 57.07 55.65 1nf5 s TYR 311 Cb 0.15 -2.50 -0.02 0.00 -0.11 0.00 0.00 41.96 39.48 1nf5 s TYR 311 CO 0.15 -0.58 -0.18 -1.58 -1.11 0.00 0.00 175.55 172.25 1nf5 s TRP 312 N 1.63 2.61 0.00 2.71 0.52 -1.26 -4.57 118.94 120.58 1nf5 s TRP 312 Ca 0.04 -0.43 0.00 0.00 0.02 0.00 0.00 56.10 55.73 1nf5 s TRP 312 Cb -0.19 -1.65 0.00 0.00 -1.15 0.00 0.00 33.47 30.49 1nf5 s TRP 312 CO 0.08 -0.02 0.00 0.41 0.02 0.00 0.00 176.95 177.45 1nf5 n GLY 313 N 2.71 -0.66 3.77 0.98 0.00 0.26 -4.49 105.19 107.75 1nf5 n GLY 313 Ca -0.17 -1.68 -0.39 0.00 0.00 0.00 0.00 46.02 43.78 1nf5 n GLY 313 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1nf5 s TRP 314 N -2.30 3.01 0.00 1.61 -0.00 -0.68 -4.50 118.94 116.07 1nf5 s TRP 314 Ca 0.00 1.50 0.00 0.00 -0.00 0.00 0.00 56.10 57.60 1nf5 s TRP 314 Cb 0.00 -3.51 0.00 0.00 -0.00 0.00 0.00 33.47 29.96 1nf5 s TRP 314 CO 0.00 -1.59 0.00 0.41 -0.00 0.00 0.00 176.95 175.77 1nf5 n GLY 315 N 0.70 0.10 3.16 5.86 0.00 -1.26 -0.40 105.19 113.35 1nf5 n GLY 315 Ca 0.03 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1nf5 n GLY 315 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nf5 n GLY 316 N 0.65 2.64 0.29 -0.02 0.00 -1.26 -4.77 105.19 102.72 1nf5 n GLY 316 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1nf5 n GLY 316 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1nf5 h GLU 317 N 0.09 0.52 0.00 1.61 9.09 -1.93 -0.55 114.58 123.41 1nf5 h GLU 317 Ca 0.00 -0.07 -0.07 0.00 0.05 0.00 0.00 59.36 59.27 1nf5 h GLU 317 Cb 0.00 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 26.99 1nf5 h GLU 317 CO 0.00 0.45 -0.33 0.38 0.05 0.00 0.00 179.01 179.57 1nf5 h ASP 318 N 0.52 0.00 0.23 3.06 2.03 -1.91 -1.12 116.42 119.23 1nf5 h ASP 318 Ca 0.13 0.00 -0.24 0.00 -0.73 0.00 0.00 57.03 56.19 1nf5 h ASP 318 Cb 0.14 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.65 1nf5 h ASP 318 CO -0.01 0.33 -0.98 0.44 -1.03 0.00 0.00 179.24 177.99 1nf5 h ASP 319 N 0.00 0.66 -0.44 4.15 3.32 -1.54 -1.53 116.42 121.03 1nf5 h ASP 319 Ca -0.00 -0.53 -0.02 0.00 0.02 0.00 0.00 57.03 56.50 1nf5 h ASP 319 Cb 0.88 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 1nf5 h ASP 319 CO 0.04 1.33 0.21 -0.78 -1.72 0.00 0.00 179.24 178.32 1nf5 h ASP 320 N 0.28 0.59 -0.59 6.45 3.58 -0.89 -0.99 116.42 124.86 1nf5 h ASP 320 Ca -0.10 -0.14 0.01 0.00 0.42 0.00 0.00 57.03 57.23 1nf5 h ASP 320 Cb 1.62 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 42.49 1nf5 h ASP 320 CO 0.18 0.56 0.38 0.40 -2.88 0.00 0.00 179.24 177.88 1nf5 h ILE 321 N 0.58 1.13 -0.73 2.25 2.04 -1.16 -0.25 117.51 121.38 1nf5 h ILE 321 Ca 0.15 -0.27 0.08 0.00 1.00 0.00 0.00 64.86 65.83 1nf5 h ILE 321 Cb 0.14 0.29 -0.07 0.00 -0.74 0.00 0.00 36.82 36.44 1nf5 h ILE 321 CO -0.02 0.14 0.39 0.22 0.00 0.00 0.00 178.15 178.89 1nf5 h TYR 322 N 0.78 0.71 -0.58 1.37 3.20 -0.66 -1.77 116.97 120.01 1nf5 h TYR 322 Ca 0.22 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 1nf5 h TYR 322 Cb -0.07 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 37.96 1nf5 h TYR 322 CO -0.04 0.30 0.23 -0.91 -1.64 0.00 0.00 178.16 176.10 1nf5 h ASN 323 N 0.69 0.81 -0.71 -2.11 2.35 -0.35 -2.60 115.58 113.66 1nf5 h ASN 323 Ca 0.34 -0.17 0.06 0.00 -0.55 0.00 0.00 56.30 55.98 1nf5 h ASN 323 Cb 0.30 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.40 1nf5 h ASN 323 CO -0.23 0.76 0.41 0.03 -1.65 0.00 0.00 177.43 176.75 1nf5 h ARG 324 N 0.81 0.74 -0.56 0.81 3.08 -0.24 0.16 114.38 119.16 1nf5 h ARG 324 Ca 0.19 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 1nf5 h ARG 324 Cb 0.20 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1nf5 h ARG 324 CO -0.02 0.49 0.33 -0.07 -1.07 0.00 0.00 179.97 179.64 1nf5 h LEU 325 N 0.76 0.68 -0.66 3.04 3.38 -1.14 -1.44 115.31 119.93 1nf5 h LEU 325 Ca 0.31 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 1nf5 h LEU 325 Cb 0.16 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1nf5 h LEU 325 CO -0.17 0.54 0.28 0.00 0.09 0.00 0.00 178.44 179.18 1nf5 h ALA 326 N 1.16 0.85 0.00 1.53 0.00 -1.02 0.11 119.26 121.89 1nf5 h ALA 326 Ca 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1nf5 h ALA 326 Cb -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1nf5 h ALA 326 CO -0.04 0.45 0.00 0.74 0.00 0.00 0.00 179.25 180.40 1nf5 h PHE 327 N 0.92 0.00 -0.50 0.00 0.05 -0.54 -1.96 116.94 114.92 1nf5 h PHE 327 Ca 0.22 0.00 -0.26 0.00 3.82 0.00 0.00 57.97 61.75 1nf5 h PHE 327 Cb 0.18 0.00 -0.15 0.00 2.00 0.00 0.00 35.95 37.97 1nf5 h PHE 327 CO 0.01 0.00 0.07 0.54 -0.18 0.00 0.00 178.31 178.75 1nf5 n ARG 328 N -2.59 1.92 -1.96 1.51 5.12 -0.58 -4.97 116.66 115.12 1nf5 n ARG 328 Ca 0.01 -3.16 -0.20 0.00 -1.93 0.00 0.00 57.85 52.57 1nf5 n ARG 328 Cb 0.22 -1.90 -0.05 0.00 -1.16 0.00 0.00 32.46 29.57 1nf5 n ARG 328 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1nf5 n GLY 329 N -1.13 0.77 3.81 -0.13 0.00 -0.74 -5.00 105.19 102.77 1nf5 n GLY 329 Ca 0.39 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.15 1nf5 n GLY 329 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nf5 s MET 330 N -4.30 2.95 0.45 1.61 -1.94 0.33 -5.01 119.30 113.39 1nf5 s MET 330 Ca 0.00 -0.85 0.03 0.00 -1.71 0.00 0.00 55.69 53.15 1nf5 s MET 330 Cb 0.00 -2.67 0.03 0.00 2.01 0.00 0.00 34.83 34.19 1nf5 s MET 330 CO 0.00 0.48 0.22 -1.13 -0.01 0.00 0.00 175.02 174.59 1nf5 n SER 331 N -0.40 2.75 -4.46 3.03 3.41 -1.26 -3.87 113.62 112.81 1nf5 n SER 331 Ca -0.08 -2.71 -0.34 0.00 -0.26 0.00 0.00 58.87 55.47 1nf5 n SER 331 Cb 0.55 0.09 -0.12 0.00 -0.26 0.00 0.00 64.21 64.46 1nf5 n SER 331 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1nf5 s VAL 332 N -2.40 3.87 -0.05 -3.33 1.01 -1.26 -3.69 120.40 114.54 1nf5 s VAL 332 Ca 0.17 -0.35 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1nf5 s VAL 332 Cb -0.01 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1nf5 s VAL 332 CO 0.11 0.46 0.20 -0.55 0.00 0.00 0.00 175.10 175.32 1nf5 s SER 333 N 0.75 6.45 -0.00 3.32 0.15 0.57 -4.96 113.70 119.97 1nf5 s SER 333 Ca -0.01 0.50 -0.10 0.00 0.70 0.00 0.00 55.95 57.05 1nf5 s SER 333 Cb -0.14 -2.07 0.01 0.00 -1.71 0.00 0.00 66.02 62.10 1nf5 s SER 333 CO 0.02 0.33 0.20 -0.13 1.20 0.00 0.00 173.24 174.86 1nf5 s ARG 334 N -1.41 0.55 0.72 5.44 0.52 -1.26 -0.78 118.95 122.72 1nf5 s ARG 334 Ca 0.21 -0.35 -0.11 0.00 -0.52 0.00 0.00 55.73 54.97 1nf5 s ARG 334 Cb -0.13 0.24 0.02 0.00 0.52 0.00 0.00 34.95 35.60 1nf5 s ARG 334 CO 0.11 -0.14 1.09 -1.25 0.02 0.00 0.00 175.30 175.13 1nf5 s PRO 335 N -1.42 2.77 0.66 3.54 0.04 -1.26 -5.00 135.00 134.33 1nf5 s PRO 335 Ca -0.14 0.54 -0.15 0.00 0.04 0.00 0.00 61.00 61.29 1nf5 s PRO 335 Cb -0.07 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1nf5 s PRO 335 CO 0.02 -1.11 1.12 0.54 0.04 0.00 0.00 177.00 177.60 1nf5 s ASN 336 N -4.24 5.06 0.56 6.66 4.22 -1.26 -4.69 114.94 121.25 1nf5 s ASN 336 Ca 0.58 2.02 0.28 0.00 -2.14 0.00 0.00 52.86 53.60 1nf5 s ASN 336 Cb -0.12 -2.55 1.48 0.00 1.28 0.00 0.00 41.25 41.33 1nf5 s ASN 336 CO 0.53 -1.66 1.95 0.00 -2.04 0.00 0.00 177.10 175.88 1nf5 h ALA 337 N 0.02 2.34 -0.01 3.54 0.00 -1.94 0.25 119.26 123.45 1nf5 h ALA 337 Ca -0.47 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1nf5 h ALA 337 Cb 1.25 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1nf5 h ALA 337 CO 0.54 -0.70 -0.02 0.28 0.00 0.00 0.00 179.25 179.35 1nf5 h VAL 338 N 0.00 1.43 0.00 0.00 2.07 -1.93 -3.19 116.25 114.63 1nf5 h VAL 338 Ca 0.24 -1.29 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1nf5 h VAL 338 Cb 1.11 2.28 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1nf5 h VAL 338 CO -0.00 0.34 -0.22 2.30 0.02 0.00 0.00 177.57 180.01 1nf5 n ILE 339 N -4.80 0.19 1.34 4.57 -5.35 -0.69 -3.51 119.36 111.11 1nf5 n ILE 339 Ca -0.08 -0.11 0.05 0.00 -0.27 0.00 0.00 62.75 62.34 1nf5 n ILE 339 Cb 0.29 -0.29 0.19 0.00 -1.74 0.00 0.00 39.64 38.09 1nf5 n ILE 339 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nf5 n GLY 340 N 1.43 -0.00 3.76 3.28 0.00 0.78 -4.28 105.19 110.16 1nf5 n GLY 340 Ca 0.06 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1nf5 n GLY 340 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nf5 s LYS 341 N -1.74 4.19 0.07 1.61 1.02 -1.21 -2.36 119.74 121.32 1nf5 s LYS 341 Ca 0.20 2.45 -0.01 0.00 0.02 0.00 0.00 55.97 58.63 1nf5 s LYS 341 Cb 0.10 -3.03 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 1nf5 s LYS 341 CO 0.14 -0.47 -0.01 0.00 -0.92 0.00 0.00 175.35 174.09 1nf5 s ARG 343 N -3.94 2.29 -0.16 0.00 0.52 0.32 -0.88 118.95 117.09 1nf5 s ARG 343 Ca 0.11 -0.86 -0.05 0.00 -0.52 0.00 0.00 55.73 54.41 1nf5 s ARG 343 Cb 0.08 -2.15 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 1nf5 s ARG 343 CO -0.07 0.55 0.00 1.41 0.02 0.00 0.00 175.30 177.21 1nf5 s MET 344 N -0.57 3.77 -0.08 3.54 -2.45 -1.26 -1.25 119.30 121.00 1nf5 s MET 344 Ca 0.08 -0.45 -0.30 0.00 -1.25 0.00 0.00 55.69 53.78 1nf5 s MET 344 Cb -0.11 -3.02 -0.04 0.00 1.25 0.00 0.00 34.83 32.91 1nf5 s MET 344 CO 0.00 0.27 1.42 0.42 1.05 0.00 0.00 175.02 178.18 1nf5 s ILE 345 N 0.32 3.92 0.25 10.11 1.01 0.37 -4.96 121.20 132.21 1nf5 s ILE 345 Ca -0.01 1.17 -0.30 0.00 0.00 0.00 0.00 60.65 61.51 1nf5 s ILE 345 Cb -0.13 -3.75 -0.09 0.00 0.01 0.00 0.00 42.46 38.49 1nf5 s ILE 345 CO 0.02 -0.07 1.20 -0.13 0.00 0.00 0.00 174.94 175.95 1nf5 s ARG 346 N 3.35 4.51 0.00 2.79 1.81 -1.26 -4.95 118.95 125.20 1nf5 s ARG 346 Ca 0.63 1.93 -0.19 0.00 -1.72 0.00 0.00 55.73 56.39 1nf5 s ARG 346 Cb -0.28 -3.19 0.04 0.00 -0.45 0.00 0.00 34.95 31.07 1nf5 s ARG 346 CO 0.23 -0.02 0.41 -3.38 -0.68 0.00 0.00 175.30 171.86 1nf5 s HIS 347 N -0.63 -0.29 0.65 -0.53 -3.43 -1.26 -5.15 115.29 104.64 1nf5 s HIS 347 Ca 0.50 0.40 -0.16 0.00 -0.80 0.00 0.00 55.06 54.99 1nf5 s HIS 347 Cb -0.34 0.20 -0.01 0.00 -1.43 0.00 0.00 32.58 31.00 1nf5 s HIS 347 CO 0.41 -0.50 1.14 -1.54 -2.00 0.00 0.00 174.74 172.26 1nf5 s SER 348 N -1.56 5.05 0.32 7.38 1.04 -1.26 -4.93 113.70 119.75 1nf5 s SER 348 Ca -0.10 2.13 -0.29 0.00 0.48 0.00 0.00 55.95 58.17 1nf5 s SER 348 Cb -0.03 -2.57 -0.11 0.00 0.10 0.00 0.00 66.02 63.42 1nf5 s SER 348 CO 0.03 -1.67 1.43 -0.60 0.98 0.00 0.00 173.24 173.40 1nf5 s ARG 349 N -3.86 4.23 0.13 4.02 3.00 -1.26 -4.96 118.95 120.25 1nf5 s ARG 349 Ca 0.70 2.39 -0.22 0.00 -1.00 0.00 0.00 55.73 57.60 1nf5 s ARG 349 Cb -0.23 -3.04 -0.07 0.00 0.00 0.00 0.00 34.95 31.60 1nf5 s ARG 349 CO 0.39 -0.40 0.67 0.34 0.00 0.00 0.00 175.30 176.30 1nf5 s ASP 350 N -0.09 7.21 0.57 -2.12 2.15 -1.26 -4.97 116.67 118.16 1nf5 s ASP 350 Ca 0.54 1.44 0.26 0.00 0.43 0.00 0.00 52.55 55.22 1nf5 s ASP 350 Cb -0.43 -2.42 1.63 0.00 -0.30 0.00 0.00 42.92 41.39 1nf5 s ASP 350 CO 0.54 0.23 2.19 0.11 -0.17 0.00 0.00 175.17 178.07 1nf5 h LYS 351 N 4.34 0.00 -0.59 4.34 1.57 -2.02 -1.07 116.57 123.14 1nf5 h LYS 351 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1nf5 h LYS 351 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1nf5 h LYS 351 CO 0.65 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 181.16 1nf5 n LYS 352 N -4.05 2.58 -2.74 3.15 4.01 -1.26 -4.38 118.16 115.46 1nf5 n LYS 352 Ca -0.02 -2.14 -0.10 0.00 -0.51 0.00 0.00 58.31 55.54 1nf5 n LYS 352 Cb 0.15 -1.54 0.03 0.00 -0.51 0.00 0.00 35.03 33.15 1nf5 n LYS 352 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1nf5 n ASN 353 N 1.10 1.10 -4.78 4.39 5.15 -0.40 0.52 115.26 122.34 1nf5 n ASN 353 Ca 0.20 -2.75 -0.36 0.00 -0.60 0.00 0.00 54.58 51.07 1nf5 n ASN 353 Cb 0.56 -0.42 -0.03 0.00 -0.53 0.00 0.00 39.78 39.35 1nf5 n ASN 353 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1nf5 s GLU 354 N -2.78 3.92 0.15 1.20 0.41 -1.25 -3.77 118.70 116.58 1nf5 s GLU 354 Ca 0.29 1.51 -0.33 0.00 -0.41 0.00 0.00 54.97 56.03 1nf5 s GLU 354 Cb 0.44 -2.34 -0.16 0.00 -1.78 0.00 0.00 34.13 30.29 1nf5 s GLU 354 CO 0.01 -0.35 1.10 -2.30 -0.49 0.00 0.00 175.26 173.23 1nf5 n PRO 355 N -0.52 0.91 -2.54 0.39 -0.02 -1.26 -1.68 135.00 130.29 1nf5 n PRO 355 Ca 0.07 0.33 -0.43 0.00 -2.02 0.00 0.00 63.50 61.45 1nf5 n PRO 355 Cb 0.50 -1.78 -0.02 0.00 -0.02 0.00 0.00 33.50 32.18 1nf5 n PRO 355 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1nf5 s ASN 356 N -0.08 6.56 0.38 2.55 2.47 0.47 -4.72 114.94 122.57 1nf5 s ASN 356 Ca 0.75 0.57 0.12 0.00 0.42 0.00 0.00 52.86 54.72 1nf5 s ASN 356 Cb -0.91 -2.55 0.92 0.00 -1.45 0.00 0.00 41.25 37.26 1nf5 s ASN 356 CO 0.53 -1.30 1.86 -0.65 -3.72 0.00 0.00 177.10 173.83 1nf5 h PRO 357 N 9.59 0.56 -0.01 0.43 0.11 -1.89 -1.08 132.00 139.71 1nf5 h PRO 357 Ca -0.24 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1nf5 h PRO 357 Cb 1.07 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1nf5 h PRO 357 CO 1.12 0.37 -0.03 1.04 -0.21 0.00 0.00 178.00 180.28 1nf5 n GLN 358 N -4.56 1.19 -0.31 1.05 6.02 -1.26 -4.45 117.38 115.06 1nf5 n GLN 358 Ca 0.18 -0.46 0.06 0.00 -0.01 0.00 0.00 57.00 56.77 1nf5 n GLN 358 Cb 0.56 -1.49 0.21 0.00 1.02 0.00 0.00 30.24 30.54 1nf5 n GLN 358 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1nf5 h ARG 359 N 1.13 0.77 -0.19 -1.09 0.11 -1.51 -1.76 114.38 111.83 1nf5 h ARG 359 Ca 0.00 -0.05 -0.11 0.00 0.10 0.00 0.00 59.98 59.93 1nf5 h ARG 359 Cb 0.30 -0.17 -0.01 0.00 1.11 0.00 0.00 29.97 31.20 1nf5 h ARG 359 CO 0.00 0.51 -0.34 0.74 0.10 0.00 0.00 179.97 180.98 1nf5 h PHE 360 N 0.79 0.46 -0.27 4.08 -1.00 -1.82 -1.33 116.94 117.86 1nf5 h PHE 360 Ca 0.45 -0.11 -0.06 0.00 2.81 0.00 0.00 57.97 61.06 1nf5 h PHE 360 Cb 0.52 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 1nf5 h PHE 360 CO -0.05 0.70 -0.06 0.22 -1.61 0.00 0.00 178.31 177.50 1nf5 h ASP 361 N 0.34 0.53 -0.83 2.17 -0.00 -1.71 -2.95 116.42 113.97 1nf5 h ASP 361 Ca 0.04 -0.36 -0.04 0.00 -0.00 0.00 0.00 57.03 56.67 1nf5 h ASP 361 Cb 0.77 -0.14 -0.04 0.00 -0.00 0.00 0.00 39.33 39.92 1nf5 h ASP 361 CO 0.06 0.77 0.38 0.03 -0.00 0.00 0.00 179.24 180.48 1nf5 h ARG 362 N 0.28 1.21 -0.28 0.28 3.08 -1.05 -2.31 114.38 115.59 1nf5 h ARG 362 Ca 0.07 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 1nf5 h ARG 362 Cb 0.53 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1nf5 h ARG 362 CO 0.03 0.94 0.07 0.82 -1.07 0.00 0.00 179.97 180.76 1nf5 h ILE 363 N 1.19 1.14 0.00 2.04 2.04 -1.23 -1.96 117.51 120.73 1nf5 h ILE 363 Ca 0.28 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1nf5 h ILE 363 Cb 0.15 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1nf5 h ILE 363 CO -0.03 0.17 0.00 0.00 0.00 0.00 0.00 178.15 178.29 1nf5 h ALA 364 N 1.68 1.00 -0.05 1.87 0.00 -1.23 -3.22 119.26 119.30 1nf5 h ALA 364 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1nf5 h ALA 364 Cb 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1nf5 h ALA 364 CO -0.00 0.00 -0.16 0.72 0.00 0.00 0.00 179.25 179.81 1nf5 n HIS 365 N -2.36 0.17 -0.29 0.00 8.25 -0.74 -4.83 115.22 115.42 1nf5 n HIS 365 Ca 0.02 -1.19 -0.00 0.00 -0.26 0.00 0.00 57.72 56.29 1nf5 n HIS 365 Cb 0.23 -0.22 0.13 0.00 1.12 0.00 0.00 29.99 31.25 1nf5 n HIS 365 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1nf5 h THR 366 N 0.55 1.03 -0.69 1.59 2.02 -1.58 -2.07 112.91 113.77 1nf5 h THR 366 Ca 0.02 -0.31 0.15 0.00 0.77 0.00 0.00 66.41 67.04 1nf5 h THR 366 Cb 1.09 0.05 -0.11 0.00 -1.74 0.00 0.00 68.15 67.44 1nf5 h THR 366 CO 0.05 0.16 0.08 0.50 0.37 0.00 0.00 175.52 176.69 1nf5 h LYS 367 N 0.90 0.18 0.04 6.66 3.64 -1.89 -0.00 116.57 126.10 1nf5 h LYS 367 Ca 0.35 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1nf5 h LYS 367 Cb 0.16 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1nf5 h LYS 367 CO -0.17 0.12 -0.02 1.49 -2.27 0.00 0.00 179.45 178.60 1nf5 h GLU 368 N 0.18 -0.05 0.00 1.90 4.81 -1.87 -3.35 114.58 116.20 1nf5 h GLU 368 Ca 0.38 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.59 1nf5 h GLU 368 Cb 0.64 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 1nf5 h GLU 368 CO -0.54 0.61 -0.11 1.79 -0.73 0.00 0.00 179.01 180.04 1nf5 h THR 369 N -0.85 0.32 0.00 0.32 1.35 -1.23 -2.74 112.91 110.07 1nf5 h THR 369 Ca -0.01 -0.71 -0.02 0.00 -0.55 0.00 0.00 66.41 65.13 1nf5 h THR 369 Cb 0.69 1.54 -0.00 0.00 -1.73 0.00 0.00 68.15 68.64 1nf5 h THR 369 CO 0.01 0.11 -0.10 0.00 -0.25 0.00 0.00 175.52 175.29 1nf5 h MET 370 N 0.00 0.00 -0.24 4.72 -0.00 -1.13 0.37 114.93 118.64 1nf5 h MET 370 Ca -0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.61 1nf5 h MET 370 Cb 0.53 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.11 1nf5 h MET 370 CO 0.01 0.10 -0.24 -0.07 -0.00 0.00 0.00 176.91 176.71 1nf5 h LEU 371 N 0.00 0.46 -0.41 -0.10 3.38 -1.66 -3.31 115.31 113.66 1nf5 h LEU 371 Ca -0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1nf5 h LEU 371 Cb 0.23 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1nf5 h LEU 371 CO 0.01 0.69 -0.26 -1.54 0.09 0.00 0.00 178.44 177.44 1nf5 n SER 372 N -4.13 0.80 -3.96 -0.43 3.41 -0.69 -4.92 113.62 103.69 1nf5 n SER 372 Ca -0.00 -0.90 -0.30 0.00 -0.26 0.00 0.00 58.87 57.41 1nf5 n SER 372 Cb 0.39 0.69 -0.16 0.00 -0.26 0.00 0.00 64.21 64.88 1nf5 n SER 372 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1nf5 s ASP 373 N -1.44 3.64 0.00 4.04 2.15 0.12 -4.65 116.67 120.54 1nf5 s ASP 373 Ca 0.05 -1.05 0.00 0.00 0.43 0.00 0.00 52.55 51.98 1nf5 s ASP 373 Cb 0.06 -1.19 0.00 0.00 -0.30 0.00 0.00 42.92 41.49 1nf5 s ASP 373 CO 0.26 -0.20 0.00 0.61 -0.17 0.00 0.00 175.17 175.67 1nf5 n GLY 374 N 4.68 -0.60 0.26 2.66 0.00 -1.26 -4.39 105.19 106.53 1nf5 n GLY 374 Ca -0.13 -0.55 0.04 0.00 0.00 0.00 0.00 46.02 45.38 1nf5 n GLY 374 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1nf5 h LEU 375 N 0.00 0.06 -1.30 0.99 3.38 -0.94 0.02 115.31 117.52 1nf5 h LEU 375 Ca 0.00 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1nf5 h LEU 375 Cb 0.00 0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1nf5 h LEU 375 CO 0.00 0.01 0.00 -0.55 0.09 0.00 0.00 178.44 177.99 1nf5 h ASN 376 N 0.30 0.00 -0.07 -0.43 7.08 -1.93 -2.40 115.58 118.12 1nf5 h ASN 376 Ca 0.37 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.59 1nf5 h ASN 376 Cb 0.59 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.83 1nf5 h ASN 376 CO -0.45 0.00 0.00 -1.54 -2.08 0.00 0.00 177.43 173.36 1nf5 n SER 377 N -2.37 2.36 -4.73 6.14 3.41 -0.09 -5.04 113.62 113.31 1nf5 n SER 377 Ca -0.00 -2.35 -0.42 0.00 -0.26 0.00 0.00 58.87 55.84 1nf5 n SER 377 Cb 0.12 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 1nf5 n SER 377 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1nf5 s LEU 378 N -1.61 4.41 -0.04 1.04 2.96 -0.72 -4.85 118.68 119.87 1nf5 s LEU 378 Ca 0.15 2.18 -0.07 0.00 -0.22 0.00 0.00 54.13 56.16 1nf5 s LEU 378 Cb 0.11 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 43.22 1nf5 s LEU 378 CO 0.04 -0.45 0.18 0.42 -1.32 0.00 0.00 176.35 175.22 1nf5 s THR 379 N 0.49 0.03 -0.10 3.68 -4.23 -1.26 -5.08 115.64 109.17 1nf5 s THR 379 Ca 0.57 -0.28 -0.33 0.00 -1.18 0.00 0.00 61.69 60.47 1nf5 s THR 379 Cb -0.32 -0.35 0.13 0.00 1.34 0.00 0.00 72.50 73.29 1nf5 s THR 379 CO 0.33 -0.15 1.22 -0.72 -0.54 0.00 0.00 174.62 174.76 1nf5 s TYR 380 N -0.52 -0.10 -0.07 3.99 -0.85 -1.26 -4.82 117.35 113.71 1nf5 s TYR 380 Ca -0.06 0.01 0.03 0.00 -0.52 0.00 0.00 57.07 56.53 1nf5 s TYR 380 Cb -0.04 0.53 0.01 0.00 0.38 0.00 0.00 41.96 42.85 1nf5 s TYR 380 CO 0.01 -0.27 -0.15 1.41 -1.52 0.00 0.00 175.55 175.03 1nf5 s MET 381 N -2.48 1.96 -0.22 -3.49 1.75 -0.71 -4.98 119.30 111.13 1nf5 s MET 381 Ca 0.11 -0.51 -0.28 0.00 -1.25 0.00 0.00 55.69 53.76 1nf5 s MET 381 Cb 0.01 -1.58 0.00 0.00 2.84 0.00 0.00 34.83 36.11 1nf5 s MET 381 CO -0.04 0.07 0.99 0.08 -0.65 0.00 0.00 175.02 175.47 1nf5 s VAL 382 N 0.57 4.73 -0.11 10.11 1.01 -1.26 -1.30 120.40 134.14 1nf5 s VAL 382 Ca -0.15 1.93 0.21 0.00 0.00 0.00 0.00 61.98 63.97 1nf5 s VAL 382 Cb -0.16 -4.27 -0.22 0.00 0.00 0.00 0.00 36.38 31.73 1nf5 s VAL 382 CO 0.05 -0.14 0.61 0.18 0.00 0.00 0.00 175.10 175.80 1nf5 n LEU 383 N 6.11 0.33 -3.63 3.92 4.77 -0.00 -4.99 117.00 123.51 1nf5 n LEU 383 Ca 0.10 0.13 -0.09 0.00 -0.03 0.00 0.00 56.01 56.13 1nf5 n LEU 383 Cb 0.47 0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.56 1nf5 n LEU 383 CO 0.51 0.05 0.80 -0.70 -1.33 0.00 0.00 177.39 176.72 1nf5 s GLU 384 N -3.25 0.46 -0.12 3.23 2.12 -1.12 -5.00 118.70 115.01 1nf5 s GLU 384 Ca -0.06 0.44 0.01 0.00 0.36 0.00 0.00 54.97 55.72 1nf5 s GLU 384 Cb 0.11 0.22 0.02 0.00 0.26 0.00 0.00 34.13 34.74 1nf5 s GLU 384 CO 0.86 -0.08 -0.14 0.08 -0.54 0.00 0.00 175.26 175.44 1nf5 s VAL 385 N -0.08 1.48 -0.16 3.70 1.01 -1.26 -0.35 120.40 124.74 1nf5 s VAL 385 Ca 0.03 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1nf5 s VAL 385 Cb -0.04 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1nf5 s VAL 385 CO -0.06 0.44 -0.20 -1.10 0.00 0.00 0.00 175.10 174.18 1nf5 s GLN 386 N 1.23 3.04 -0.36 2.72 -0.21 0.56 -5.00 119.66 121.64 1nf5 s GLN 386 Ca -0.01 -0.83 -0.13 0.00 0.02 0.00 0.00 55.36 54.41 1nf5 s GLN 386 Cb -0.14 -2.52 0.00 0.00 1.00 0.00 0.00 33.01 31.35 1nf5 s GLN 386 CO -0.05 -0.08 0.24 1.03 -2.12 0.00 0.00 175.29 174.31 1nf5 s ARG 387 N 0.99 3.21 0.41 2.91 1.81 -1.26 -0.10 118.95 126.92 1nf5 s ARG 387 Ca -0.02 -0.84 0.08 0.00 -1.72 0.00 0.00 55.73 53.22 1nf5 s ARG 387 Cb -0.15 -3.82 -0.02 0.00 -0.45 0.00 0.00 34.95 30.51 1nf5 s ARG 387 CO -0.05 -0.58 0.41 0.71 -0.68 0.00 0.00 175.30 175.11 1nf5 s TYR 388 N 1.67 2.74 0.25 -0.53 1.51 0.58 -4.80 117.35 118.77 1nf5 s TYR 388 Ca 0.05 -0.46 -0.03 0.00 -1.01 0.00 0.00 57.07 55.62 1nf5 s TYR 388 Cb -0.18 -2.19 0.31 0.00 -0.11 0.00 0.00 41.96 39.79 1nf5 s TYR 388 CO 0.09 -0.16 1.77 -1.00 -1.11 0.00 0.00 175.55 175.15 1nf5 h PRO 389 N 0.97 0.88 0.00 -1.71 0.13 -1.94 1.05 132.00 131.38 1nf5 h PRO 389 Ca -0.41 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1nf5 h PRO 389 Cb 1.27 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1nf5 h PRO 389 CO 0.55 0.83 -0.99 1.28 -0.23 0.00 0.00 178.00 179.44 1nf5 n LEU 390 N -4.24 0.63 -3.74 1.56 4.77 -1.26 -1.95 117.00 112.77 1nf5 n LEU 390 Ca 0.04 -0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 55.87 1nf5 n LEU 390 Cb 0.27 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1nf5 n LEU 390 CO 0.41 0.07 0.48 -0.72 -1.33 0.00 0.00 177.39 176.30 1nf5 s TYR 391 N -3.16 -0.27 -0.18 -1.77 -0.85 -1.23 -3.54 117.35 106.35 1nf5 s TYR 391 Ca 0.05 -0.11 -0.04 0.00 -0.52 0.00 0.00 57.07 56.45 1nf5 s TYR 391 Cb 0.15 0.66 -0.02 0.00 0.38 0.00 0.00 41.96 43.13 1nf5 s TYR 391 CO 0.80 -1.09 -0.04 0.99 -1.52 0.00 0.00 175.55 174.69 1nf5 s THR 392 N -3.80 3.73 -0.24 -3.49 2.01 -0.55 -0.31 115.64 112.98 1nf5 s THR 392 Ca 0.09 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 1nf5 s THR 392 Cb -0.04 -2.65 0.03 0.00 0.01 0.00 0.00 72.50 69.84 1nf5 s THR 392 CO 0.01 0.47 -0.09 -0.75 -0.69 0.00 0.00 174.62 173.58 1nf5 s LYS 393 N 0.72 2.79 -0.35 4.92 2.20 0.85 -0.71 119.74 130.16 1nf5 s LYS 393 Ca -0.02 -1.00 -0.08 0.00 -0.36 0.00 0.00 55.97 54.51 1nf5 s LYS 393 Cb -0.14 -2.92 0.03 0.00 -1.51 0.00 0.00 37.83 33.29 1nf5 s LYS 393 CO 0.02 -0.39 0.13 0.42 -0.36 0.00 0.00 175.35 175.17 1nf5 s ILE 394 N 1.29 4.04 -0.16 5.43 1.01 -0.27 -0.32 121.20 132.21 1nf5 s ILE 394 Ca -0.00 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 59.41 1nf5 s ILE 394 Cb -0.17 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 1nf5 s ILE 394 CO -0.06 -0.18 0.64 -0.89 0.00 0.00 0.00 174.94 174.45 1nf5 s THR 395 N 1.45 5.03 0.11 2.92 2.01 0.53 -1.67 115.64 126.03 1nf5 s THR 395 Ca -0.00 1.24 0.06 0.00 0.31 0.00 0.00 61.69 63.29 1nf5 s THR 395 Cb -0.19 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.32 1nf5 s THR 395 CO 0.04 0.15 -0.15 0.68 -0.69 0.00 0.00 174.62 174.65 1nf5 s VAL 396 N 1.59 1.33 -0.41 3.82 -7.23 -0.45 -0.82 120.40 118.22 1nf5 s VAL 396 Ca 0.31 -1.59 -0.10 0.00 -1.81 0.00 0.00 61.98 58.79 1nf5 s VAL 396 Cb -0.16 -1.42 0.07 0.00 0.56 0.00 0.00 36.38 35.43 1nf5 s VAL 396 CO 0.12 -0.31 0.26 -0.62 -0.31 0.00 0.00 175.10 174.24 1nf5 s ASP 397 N -2.19 5.72 -0.15 4.85 -1.08 -0.42 -1.06 116.67 122.34 1nf5 s ASP 397 Ca 0.06 -1.36 0.17 0.00 -0.52 0.00 0.00 52.55 50.89 1nf5 s ASP 397 Cb -0.07 -2.02 0.74 0.00 -1.46 0.00 0.00 42.92 40.12 1nf5 s ASP 397 CO 0.03 -0.51 1.66 2.30 0.52 0.00 0.00 175.17 179.16 1nf5 n ILE 398 N 4.97 2.15 -3.93 4.11 -5.35 -1.26 -1.73 119.36 118.31 1nf5 n ILE 398 Ca -0.11 -1.30 0.00 0.00 -0.27 0.00 0.00 62.75 61.07 1nf5 n ILE 398 Cb 0.44 -0.01 -0.00 0.00 -1.74 0.00 0.00 39.64 38.33 1nf5 n ILE 398 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nf5 n GLY 399 N 0.89 -2.10 3.62 3.28 0.00 -1.26 -4.93 105.19 104.69 1nf5 n GLY 399 Ca 0.26 -1.43 -0.26 0.00 0.00 0.00 0.00 46.02 44.60 1nf5 n GLY 399 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nf5 s THR 400 N -0.02 2.38 0.53 2.61 -4.23 -1.26 -4.92 115.64 110.72 1nf5 s THR 400 Ca 0.00 -1.99 -0.23 0.00 -1.18 0.00 0.00 61.69 58.29 1nf5 s THR 400 Cb 0.00 -2.83 -0.06 0.00 1.34 0.00 0.00 72.50 70.96 1nf5 s THR 400 CO 0.00 -0.14 1.39 -2.84 -0.54 0.00 0.00 174.62 172.49 1nf5 s PRO 401 N -3.72 3.25 0.00 3.99 0.02 -1.26 -5.17 135.00 132.11 1nf5 s PRO 401 Ca 0.35 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.68 1nf5 s PRO 401 Cb 0.03 -2.35 0.00 0.00 0.02 0.00 0.00 34.50 32.20 1nf5 s PRO 401 CO 0.19 -1.13 0.00 -1.13 -0.33 0.00 0.00 177.00 174.60