#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 4.84 0.46 -5.08 -4.23 -1.26 -4.79 115.64 105.58 1nf5 s THR 132 Ca 0.00 -1.05 -0.25 0.00 -1.18 0.00 0.00 61.69 59.21 1nf5 s THR 132 Cb 0.00 -3.55 -0.08 0.00 1.34 0.00 0.00 72.50 70.21 1nf5 s THR 132 CO 0.00 -0.22 1.37 0.00 -0.54 0.00 0.00 174.62 175.23 1nf5 n ALA 133 N -0.84 1.74 -1.77 3.99 0.00 -1.26 -1.03 120.51 121.33 1nf5 n ALA 133 Ca -0.08 0.23 -0.37 0.00 0.00 0.00 0.00 53.44 53.22 1nf5 n ALA 133 Cb 0.56 -2.35 -0.00 0.00 0.00 0.00 0.00 19.45 17.66 1nf5 n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nf5 s PRO 135 N -2.80 2.61 0.34 0.00 0.04 -1.26 -4.85 135.00 129.08 1nf5 s PRO 135 Ca 0.66 2.05 0.12 0.00 0.04 0.00 0.00 61.00 63.87 1nf5 s PRO 135 Cb -0.29 -1.86 0.97 0.00 0.04 0.00 0.00 34.50 33.35 1nf5 s PRO 135 CO 0.35 -1.55 1.72 1.49 0.04 0.00 0.00 177.00 179.06 1nf5 h GLU 136 N 0.61 0.48 -5.96 4.56 4.22 -2.02 -3.36 114.58 113.11 1nf5 h GLU 136 Ca -0.51 -0.03 -0.64 0.00 0.08 0.00 0.00 59.36 58.27 1nf5 h GLU 136 Cb 1.33 -0.11 -0.31 0.00 0.50 0.00 0.00 28.75 30.17 1nf5 h GLU 136 CO 0.53 0.32 -0.87 -2.00 -2.18 0.00 0.00 179.01 174.82 1nf5 s GLU 137 N -5.69 2.02 0.33 1.92 2.12 -1.26 -5.12 118.70 113.02 1nf5 s GLU 137 Ca -0.10 -0.79 -0.27 0.00 0.36 0.00 0.00 54.97 54.17 1nf5 s GLU 137 Cb 0.27 -1.83 -0.09 0.00 0.26 0.00 0.00 34.13 32.74 1nf5 s GLU 137 CO 0.80 0.40 1.10 0.45 -0.54 0.00 0.00 175.26 177.47 1nf5 s SER 138 N -0.30 7.00 0.01 -1.70 0.15 -1.26 -4.93 113.70 112.66 1nf5 s SER 138 Ca 0.02 2.22 0.29 0.00 0.70 0.00 0.00 55.95 59.18 1nf5 s SER 138 Cb -0.11 -2.61 1.18 0.00 -1.71 0.00 0.00 66.02 62.77 1nf5 s SER 138 CO 0.01 -0.33 1.89 -0.81 1.20 0.00 0.00 173.24 175.20 1nf5 n PRO 139 N 0.64 0.01 0.19 5.44 -0.04 -1.26 -3.60 135.00 136.38 1nf5 n PRO 139 Ca 0.02 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 1nf5 n PRO 139 Cb 0.46 -1.51 0.22 0.00 -0.04 0.00 0.00 33.50 32.63 1nf5 n PRO 139 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1nf5 h LEU 140 N 0.00 0.00 -9.53 1.53 3.38 -1.92 -3.47 115.31 105.31 1nf5 h LEU 140 Ca 0.00 -0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 1nf5 h LEU 140 Cb 0.51 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.38 1nf5 h LEU 140 CO 0.00 0.00 0.09 0.18 0.09 0.00 0.00 178.44 178.80 1nf5 n LEU 141 N -2.91 1.93 -0.00 1.67 4.32 -1.24 -4.93 117.00 115.85 1nf5 n LEU 141 Ca 0.04 1.10 0.05 0.00 -0.02 0.00 0.00 56.01 57.18 1nf5 n LEU 141 Cb 0.51 -1.30 -0.07 0.00 -1.62 0.00 0.00 43.42 40.94 1nf5 n LEU 141 CO 0.33 -1.57 -0.28 0.52 -1.22 0.00 0.00 177.39 175.17 1nf5 n VAL 142 N -0.15 0.00 -3.62 4.08 0.31 -1.26 -5.11 118.33 112.58 1nf5 n VAL 142 Ca 0.10 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1nf5 n VAL 142 Cb 0.35 0.68 0.00 0.00 -0.91 0.00 0.00 33.84 33.97 1nf5 n VAL 142 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nf5 n GLY 143 N 1.52 0.30 3.74 2.92 0.00 -1.26 -4.90 105.19 107.51 1nf5 n GLY 143 Ca 0.00 -1.03 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 1nf5 n GLY 143 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nf5 n PRO 144 N 9.40 2.12 -4.16 1.61 -0.04 -1.26 -2.25 135.00 140.43 1nf5 n PRO 144 Ca 0.00 0.76 -0.16 0.00 -0.04 0.00 0.00 63.50 64.06 1nf5 n PRO 144 Cb 0.00 -2.54 -0.11 0.00 -0.04 0.00 0.00 33.50 30.80 1nf5 n PRO 144 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1nf5 s MET 145 N -2.38 0.80 -0.25 0.54 -1.94 0.36 -4.94 119.30 111.49 1nf5 s MET 145 Ca 0.61 -1.03 -0.21 0.00 -1.71 0.00 0.00 55.69 53.35 1nf5 s MET 145 Cb -0.47 -0.61 -0.02 0.00 2.01 0.00 0.00 34.83 35.74 1nf5 s MET 145 CO 0.57 0.11 0.68 -1.17 -0.01 0.00 0.00 175.02 175.21 1nf5 s LEU 146 N -2.08 4.07 -0.28 -0.03 0.20 -1.26 -4.85 118.68 114.46 1nf5 s LEU 146 Ca 0.01 0.79 -0.04 0.00 0.69 0.00 0.00 54.13 55.58 1nf5 s LEU 146 Cb -0.06 -2.93 0.02 0.00 -0.43 0.00 0.00 46.19 42.79 1nf5 s LEU 146 CO 0.01 -0.40 0.00 -0.63 -0.29 0.00 0.00 176.35 175.04 1nf5 s ILE 147 N 2.57 3.28 0.03 6.68 -1.09 -1.26 -5.09 121.20 126.32 1nf5 s ILE 147 Ca 0.28 -0.98 0.04 0.00 -2.23 0.00 0.00 60.65 57.77 1nf5 s ILE 147 Cb -0.15 -2.72 -0.02 0.00 -1.58 0.00 0.00 42.46 37.99 1nf5 s ILE 147 CO 0.08 0.10 -0.12 -1.83 -1.23 0.00 0.00 174.94 171.94 1nf5 s GLU 148 N 1.37 0.83 -0.64 2.79 -1.05 -1.26 -5.06 118.70 115.68 1nf5 s GLU 148 Ca 0.00 -0.70 0.04 0.00 -0.15 0.00 0.00 54.97 54.16 1nf5 s GLU 148 Cb -0.17 -0.80 0.35 0.00 -0.44 0.00 0.00 34.13 33.07 1nf5 s GLU 148 CO -0.01 0.20 1.19 1.19 0.95 0.00 0.00 175.26 178.78 1nf5 n PHE 149 N 1.96 3.65 0.00 4.83 3.01 -1.26 -4.80 117.46 124.85 1nf5 n PHE 149 Ca -0.18 -3.47 0.00 0.00 1.01 0.00 0.00 57.45 54.81 1nf5 n PHE 149 Cb 0.55 -0.56 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 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 -0.29 0.00 -4.42 4.37 3.02 -1.26 -4.96 115.26 111.72 1nf5 n ASN 150 Ca 0.37 0.00 -0.48 0.00 -0.03 0.00 0.00 54.58 54.44 1nf5 n ASN 150 Cb 0.42 -0.06 -0.12 0.00 -0.61 0.00 0.00 39.78 39.40 1nf5 n ASN 150 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1nf5 n ILE 151 N -1.64 0.01 -1.15 2.41 -0.00 -1.26 -4.84 119.36 112.89 1nf5 n ILE 151 Ca 0.00 -0.10 -0.35 0.00 -0.00 0.00 0.00 62.75 62.30 1nf5 n ILE 151 Cb 0.00 -0.83 0.08 0.00 -0.00 0.00 0.00 39.64 38.89 1nf5 n ILE 151 CO 0.00 0.00 0.00 -2.65 -0.00 0.00 0.00 176.55 173.90 1nf5 n PRO 152 N 8.20 0.16 -4.31 0.38 -0.02 -1.26 -4.97 135.00 133.17 1nf5 n PRO 152 Ca 0.57 0.10 -0.27 0.00 -2.02 0.00 0.00 63.50 61.88 1nf5 n PRO 152 Cb 0.08 -1.80 -0.10 0.00 -0.02 0.00 0.00 33.50 31.65 1nf5 n PRO 152 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1nf5 s VAL 153 N -2.02 3.01 -0.29 -1.45 0.11 -1.26 -5.10 120.40 113.40 1nf5 s VAL 153 Ca 0.63 -1.70 0.02 0.00 -2.93 0.00 0.00 61.98 58.00 1nf5 s VAL 153 Cb -0.32 -2.47 0.07 0.00 -1.53 0.00 0.00 36.38 32.13 1nf5 s VAL 153 CO 0.61 -0.09 -0.05 -0.62 -3.33 0.00 0.00 175.10 171.62 1nf5 s ASP 154 N -2.72 4.60 0.46 3.54 -1.08 -1.26 -4.98 116.67 115.22 1nf5 s ASP 154 Ca 0.23 -1.53 0.28 0.00 -0.52 0.00 0.00 52.55 51.01 1nf5 s ASP 154 Cb -0.09 -1.60 1.33 0.00 -1.46 0.00 0.00 42.92 41.11 1nf5 s ASP 154 CO 0.14 -0.25 1.74 -0.07 0.52 0.00 0.00 175.17 177.25 1nf5 h LEU 155 N 7.79 0.25 -0.74 -1.34 3.38 -1.99 1.18 115.31 123.86 1nf5 h LEU 155 Ca -0.17 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1nf5 h LEU 155 Cb 1.04 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 1nf5 h LEU 155 CO 0.49 -0.00 0.41 0.11 0.09 0.00 0.00 178.44 179.54 1nf5 h LYS 156 N 0.19 1.02 -0.38 1.13 1.79 -1.99 -0.14 116.57 118.20 1nf5 h LYS 156 Ca 0.66 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.97 1nf5 h LYS 156 Cb 2.08 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 32.51 1nf5 h LYS 156 CO -0.23 0.75 0.07 -0.07 -1.08 0.00 0.00 179.45 178.89 1nf5 h LEU 157 N 1.01 0.59 -1.25 2.94 -0.00 0.96 -0.52 115.31 119.03 1nf5 h LEU 157 Ca 0.26 -0.25 0.11 0.00 -0.00 0.00 0.00 57.88 58.00 1nf5 h LEU 157 Cb 0.02 -0.16 -0.06 0.00 -0.00 0.00 0.00 40.66 40.46 1nf5 h LEU 157 CO -0.04 0.69 0.56 0.58 -0.00 0.00 0.00 178.44 180.23 1nf5 h VAL 158 N 0.46 0.93 -0.33 1.22 2.07 -0.59 0.48 116.25 120.50 1nf5 h VAL 158 Ca 0.11 -0.28 -0.16 0.00 0.82 0.00 0.00 66.70 67.20 1nf5 h VAL 158 Cb 0.35 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1nf5 h VAL 158 CO 0.01 0.15 -0.43 -0.33 0.02 0.00 0.00 177.57 176.99 1nf5 h GLU 159 N 0.80 0.87 -0.06 1.57 5.08 -0.70 -1.25 114.58 120.89 1nf5 h GLU 159 Ca 0.41 -0.49 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1nf5 h GLU 159 Cb 0.49 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1nf5 h GLU 159 CO -0.18 1.14 -0.14 0.37 -1.00 0.00 0.00 179.01 179.20 1nf5 h GLN 160 N 0.66 -0.20 0.00 2.33 4.15 0.96 -1.97 115.11 121.04 1nf5 h GLN 160 Ca 0.04 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1nf5 h GLN 160 Cb 1.02 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.76 1nf5 h GLN 160 CO 0.10 -0.13 0.00 1.04 -1.93 0.00 0.00 178.83 177.91 1nf5 n GLN 161 N -5.28 0.20 -2.90 1.69 6.02 0.14 -3.86 117.38 113.39 1nf5 n GLN 161 Ca -0.04 0.39 -0.25 0.00 -0.01 0.00 0.00 57.00 57.08 1nf5 n GLN 161 Cb 0.19 -1.86 -0.03 0.00 1.02 0.00 0.00 30.24 29.56 1nf5 n GLN 161 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1nf5 n ASN 162 N -2.24 3.94 0.33 1.08 3.02 -0.49 -4.90 115.26 116.00 1nf5 n ASN 162 Ca 0.03 -3.57 0.20 0.00 -0.03 0.00 0.00 54.58 51.21 1nf5 n ASN 162 Cb 0.26 -0.55 1.09 0.00 -0.61 0.00 0.00 39.78 39.96 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 2.93 0.00 0.00 3.52 0.13 -1.65 -2.06 132.00 134.87 1nf5 h PRO 163 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1nf5 h PRO 163 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 1nf5 h PRO 163 CO 0.77 0.00 0.00 0.87 -0.23 0.00 0.00 178.00 179.41 1nf5 h LYS 164 N 0.00 0.00 -6.18 0.86 1.79 -1.90 -3.44 116.57 107.69 1nf5 h LYS 164 Ca 0.01 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.91 1nf5 h LYS 164 Cb 0.18 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.79 1nf5 h LYS 164 CO -0.00 0.00 0.69 0.08 -1.08 0.00 0.00 179.45 179.14 1nf5 s VAL 165 N -3.14 4.68 0.44 0.50 1.01 -0.78 -4.76 120.40 118.35 1nf5 s VAL 165 Ca 0.09 1.98 -0.02 0.00 0.00 0.00 0.00 61.98 64.03 1nf5 s VAL 165 Cb 0.10 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 1nf5 s VAL 165 CO 0.62 -0.08 0.69 -0.54 0.00 0.00 0.00 175.10 175.79 1nf5 s LYS 166 N 2.61 3.34 -0.05 2.72 1.02 0.51 -4.88 119.74 125.01 1nf5 s LYS 166 Ca 0.47 -0.17 -0.41 0.00 0.02 0.00 0.00 55.97 55.89 1nf5 s LYS 166 Cb -0.17 -2.51 -0.20 0.00 -0.52 0.00 0.00 37.83 34.43 1nf5 s LYS 166 CO 0.13 -0.15 1.14 -0.11 -0.92 0.00 0.00 175.35 175.44 1nf5 n LEU 167 N -2.09 0.19 0.00 3.17 -0.00 -1.26 -0.75 117.00 116.26 1nf5 n LEU 167 Ca -0.01 1.16 0.00 0.00 -0.00 0.00 0.00 56.01 57.16 1nf5 n LEU 167 Cb 0.56 -0.93 0.00 0.00 -0.00 0.00 0.00 43.42 43.06 1nf5 n LEU 167 CO 0.50 -1.76 0.00 0.61 -0.00 0.00 0.00 177.39 176.74 1nf5 n GLY 168 N 1.80 0.73 2.08 -3.96 0.00 0.30 -4.35 105.19 101.79 1nf5 n GLY 168 Ca 0.21 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.14 0.28 3.57 -0.02 0.00 0.07 -2.75 105.19 104.20 1nf5 n GLY 169 Ca 0.00 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 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 -5.00 2.52 -0.10 1.61 1.81 -0.81 -1.67 118.95 117.31 1nf5 s ARG 170 Ca 0.11 -0.72 -0.09 0.00 -1.72 0.00 0.00 55.73 53.31 1nf5 s ARG 170 Cb -0.05 -2.47 0.03 0.00 -0.45 0.00 0.00 34.95 32.01 1nf5 s ARG 170 CO 0.27 0.61 0.25 -0.47 -0.68 0.00 0.00 175.30 175.28 1nf5 s TYR 171 N -0.94 -0.28 -0.01 -0.53 5.04 -0.22 -0.37 117.35 120.04 1nf5 s TYR 171 Ca 0.16 0.69 -0.00 0.00 -2.44 0.00 0.00 57.07 55.47 1nf5 s TYR 171 Cb -0.11 0.09 0.02 0.00 0.35 0.00 0.00 41.96 42.31 1nf5 s TYR 171 CO 0.06 -0.14 0.02 0.99 -1.34 0.00 0.00 175.55 175.14 1nf5 s THR 172 N 0.17 -0.04 0.54 4.34 2.01 -1.26 -1.26 115.64 120.14 1nf5 s THR 172 Ca -0.00 0.14 -0.22 0.00 0.31 0.00 0.00 61.69 61.92 1nf5 s THR 172 Cb -0.02 -0.06 -0.05 0.00 0.01 0.00 0.00 72.50 72.38 1nf5 s THR 172 CO 0.00 0.06 1.36 -2.84 -0.69 0.00 0.00 174.62 172.51 1nf5 s PRO 173 N 0.70 3.16 -0.10 4.92 0.02 -1.26 -4.92 135.00 137.52 1nf5 s PRO 173 Ca -0.06 2.25 0.19 0.00 0.02 0.00 0.00 61.00 63.40 1nf5 s PRO 173 Cb -0.08 -2.28 -0.25 0.00 0.02 0.00 0.00 34.50 31.91 1nf5 s PRO 173 CO -0.02 -1.18 0.34 -1.33 -0.33 0.00 0.00 177.00 174.49 1nf5 n MET 174 N -0.99 0.67 0.02 5.54 0.00 -1.26 -4.46 117.12 116.64 1nf5 n MET 174 Ca 0.10 -0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.66 1nf5 n MET 174 Cb 0.45 -1.59 -0.03 0.00 0.00 0.00 0.00 33.22 32.05 1nf5 n MET 174 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1nf5 h ASP 175 N 0.00 0.72 -5.43 7.83 3.45 -1.98 -3.48 116.42 117.53 1nf5 h ASP 175 Ca -0.33 -0.49 -0.17 0.00 0.43 0.00 0.00 57.03 56.47 1nf5 h ASP 175 Cb 1.80 -0.21 -0.11 0.00 -0.56 0.00 0.00 39.33 40.25 1nf5 h ASP 175 CO 0.03 1.26 -0.29 0.00 -1.57 0.00 0.00 179.24 178.67 1nf5 s ILE 177 N -3.81 5.14 -0.09 0.00 1.01 -0.20 -4.54 121.20 118.71 1nf5 s ILE 177 Ca 0.30 0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.91 1nf5 s ILE 177 Cb 0.02 -3.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 1nf5 s ILE 177 CO 0.13 0.32 0.36 -0.55 0.00 0.00 0.00 174.94 175.20 1nf5 s SER 178 N 1.32 6.62 0.00 3.58 0.15 -1.26 -1.40 113.70 122.70 1nf5 s SER 178 Ca 0.07 0.73 0.29 0.00 0.70 0.00 0.00 55.95 57.74 1nf5 s SER 178 Cb -0.14 -2.22 1.31 0.00 -1.71 0.00 0.00 66.02 63.26 1nf5 s SER 178 CO 0.06 0.19 1.91 -0.81 1.20 0.00 0.00 173.24 175.79 1nf5 n PRO 179 N 2.82 0.63 -3.29 5.44 -0.04 -1.26 -4.64 135.00 134.65 1nf5 n PRO 179 Ca -0.12 -0.17 -0.46 0.00 -0.04 0.00 0.00 63.50 62.71 1nf5 n PRO 179 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 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 -2.49 3.23 -0.57 0.54 3.76 -1.26 -4.98 115.29 113.52 1nf5 s HIS 180 Ca 0.29 -1.27 -0.14 0.00 -0.15 0.00 0.00 55.06 53.79 1nf5 s HIS 180 Cb 0.20 -3.82 0.14 0.00 1.11 0.00 0.00 32.58 30.21 1nf5 s HIS 180 CO 0.47 -1.05 0.51 0.15 -0.85 0.00 0.00 174.74 173.97 1nf5 s LYS 181 N 1.69 2.97 -0.21 1.40 1.02 -1.26 -1.87 119.74 123.49 1nf5 s LYS 181 Ca 0.04 -1.85 -0.07 0.00 0.02 0.00 0.00 55.97 54.11 1nf5 s LYS 181 Cb -0.29 -4.23 -0.03 0.00 -0.52 0.00 0.00 37.83 32.75 1nf5 s LYS 181 CO 0.03 -1.29 0.04 0.08 -0.92 0.00 0.00 175.35 173.29 1nf5 s VAL 182 N 1.30 4.40 -0.27 3.17 1.01 0.25 -1.30 120.40 128.95 1nf5 s VAL 182 Ca 0.06 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.77 1nf5 s VAL 182 Cb -0.26 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 1nf5 s VAL 182 CO 0.00 0.41 0.17 0.00 0.00 0.00 0.00 175.10 175.69 1nf5 s ALA 183 N 0.90 3.50 -0.33 5.51 0.00 -0.03 -1.56 121.76 129.76 1nf5 s ALA 183 Ca 0.03 -1.07 -0.13 0.00 0.00 0.00 0.00 51.96 50.79 1nf5 s ALA 183 Cb -0.14 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.54 1nf5 s ALA 183 CO 0.02 -0.50 0.24 0.42 0.00 0.00 0.00 175.76 175.94 1nf5 s ILE 184 N 1.66 5.28 -0.26 0.00 1.09 -0.19 -1.16 121.20 127.62 1nf5 s ILE 184 Ca 0.07 -0.13 -0.09 0.00 -1.10 0.00 0.00 60.65 59.41 1nf5 s ILE 184 Cb -0.16 -3.69 -0.03 0.00 -1.06 0.00 0.00 42.46 37.52 1nf5 s ILE 184 CO 0.09 0.03 0.11 -0.63 -0.10 0.00 0.00 174.94 174.45 1nf5 s ILE 185 N 1.75 4.63 -0.27 2.92 -1.09 0.12 -0.60 121.20 128.66 1nf5 s ILE 185 Ca 0.07 -0.09 -0.02 0.00 -2.23 0.00 0.00 60.65 58.38 1nf5 s ILE 185 Cb -0.17 -3.20 0.04 0.00 -1.58 0.00 0.00 42.46 37.55 1nf5 s ILE 185 CO 0.11 0.29 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.45 1nf5 s ILE 186 N 1.66 2.95 0.34 2.92 1.01 0.29 -1.22 121.20 129.15 1nf5 s ILE 186 Ca 0.06 -1.17 -0.27 0.00 0.00 0.00 0.00 60.65 59.27 1nf5 s ILE 186 Cb -0.16 -2.59 -0.09 0.00 0.01 0.00 0.00 42.46 39.63 1nf5 s ILE 186 CO 0.06 0.06 1.19 -2.16 0.00 0.00 0.00 174.94 174.09 1nf5 s PRO 187 N 1.30 4.32 -0.03 2.79 0.04 -1.26 -0.46 135.00 141.69 1nf5 s PRO 187 Ca -0.02 1.94 -0.23 0.00 0.04 0.00 0.00 61.00 62.72 1nf5 s PRO 187 Cb -0.18 -2.94 0.05 0.00 0.04 0.00 0.00 34.50 31.47 1nf5 s PRO 187 CO -0.03 -0.12 0.50 0.12 0.04 0.00 0.00 177.00 177.52 1nf5 s PHE 188 N -1.26 -0.43 -0.30 0.56 5.36 0.48 -4.49 117.98 117.89 1nf5 s PHE 188 Ca 0.51 0.73 -0.06 0.00 -0.96 0.00 0.00 56.93 57.15 1nf5 s PHE 188 Cb -0.34 0.26 0.18 0.00 -0.34 0.00 0.00 43.02 42.79 1nf5 s PHE 188 CO 0.43 -0.50 0.76 0.50 -1.46 0.00 0.00 175.22 174.95 1nf5 s ARG 189 N -1.24 0.43 -1.29 10.12 3.52 -1.26 -0.13 118.95 129.10 1nf5 s ARG 189 Ca -0.12 0.77 -0.14 0.00 -0.13 0.00 0.00 55.73 56.11 1nf5 s ARG 189 Cb -0.02 0.43 0.01 0.00 -1.56 0.00 0.00 34.95 33.80 1nf5 s ARG 189 CO 0.07 -0.46 0.56 -1.71 -0.81 0.00 0.00 175.30 172.95 1nf5 n ASN 190 N 5.44 -2.72 -2.75 -2.12 5.15 -1.26 -4.90 115.26 112.10 1nf5 n ASN 190 Ca -0.03 -1.10 -0.03 0.00 -0.60 0.00 0.00 54.58 52.82 1nf5 n ASN 190 Cb 0.52 -2.76 0.04 0.00 -0.53 0.00 0.00 39.78 37.06 1nf5 n ASN 190 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1nf5 n ARG 191 N -4.48 1.82 -0.07 1.20 5.12 -1.26 -4.91 116.66 114.09 1nf5 n ARG 191 Ca -0.20 -3.54 0.15 0.00 -1.93 0.00 0.00 57.85 52.33 1nf5 n ARG 191 Cb 0.63 -1.62 0.55 0.00 -1.16 0.00 0.00 32.46 30.86 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 2.63 0.29 -0.55 5.56 5.75 -1.99 -0.93 115.11 125.87 1nf5 h GLN 192 Ca -0.09 -0.02 -0.10 0.00 -0.15 0.00 0.00 58.65 58.29 1nf5 h GLN 192 Cb 1.27 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.74 1nf5 h GLN 192 CO 0.28 0.19 -0.07 0.93 -2.65 0.00 0.00 178.83 177.51 1nf5 h GLU 193 N 0.30 1.00 -0.45 1.69 4.39 -2.01 -1.95 114.58 117.56 1nf5 h GLU 193 Ca 0.29 -0.34 -0.13 0.00 0.34 0.00 0.00 59.36 59.52 1nf5 h GLU 193 Cb 0.71 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 1nf5 h GLU 193 CO -0.07 1.02 -0.22 0.45 -1.16 0.00 0.00 179.01 179.04 1nf5 h HIS 194 N 0.90 1.04 -0.98 4.33 3.86 -1.57 -3.10 115.15 119.62 1nf5 h HIS 194 Ca 0.15 -0.24 0.01 0.00 -1.16 0.00 0.00 60.37 59.12 1nf5 h HIS 194 Cb 0.62 -0.24 -0.05 0.00 1.06 0.00 0.00 27.41 28.79 1nf5 h HIS 194 CO 0.04 1.03 0.65 1.25 0.86 0.00 0.00 177.93 181.76 1nf5 h LEU 195 N 0.79 1.14 -0.63 2.43 6.46 -0.92 -1.06 115.31 123.52 1nf5 h LEU 195 Ca 0.10 -0.03 0.03 0.00 -0.12 0.00 0.00 57.88 57.86 1nf5 h LEU 195 Cb 0.77 -0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 40.38 1nf5 h LEU 195 CO 0.06 0.83 0.39 0.11 -0.62 0.00 0.00 178.44 179.21 1nf5 h LYS 196 N 1.34 0.74 -0.45 1.25 1.57 -1.29 0.11 116.57 119.84 1nf5 h LYS 196 Ca 0.36 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.96 1nf5 h LYS 196 Cb -0.14 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 31.99 1nf5 h LYS 196 CO -0.08 0.49 -0.24 1.88 -0.57 0.00 0.00 179.45 180.93 1nf5 h TYR 197 N 0.76 1.08 -0.07 -1.35 -1.99 -1.45 0.46 116.97 114.41 1nf5 h TYR 197 Ca 0.25 -0.27 0.02 0.00 2.00 0.00 0.00 58.73 60.73 1nf5 h TYR 197 Cb 0.01 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 38.48 1nf5 h TYR 197 CO -0.05 1.07 -0.02 2.35 -0.00 0.00 0.00 178.16 181.51 1nf5 h TRP 198 N 0.80 -0.04 -0.35 4.88 7.01 -0.61 -0.44 115.95 127.19 1nf5 h TRP 198 Ca 0.10 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.08 1nf5 h TRP 198 Cb 0.81 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.88 1nf5 h TRP 198 CO 0.05 -0.04 0.13 -0.07 -2.79 0.00 0.00 178.44 175.72 1nf5 h LEU 199 N -0.00 0.50 -0.61 0.65 3.38 -0.69 0.22 115.31 118.75 1nf5 h LEU 199 Ca 0.04 -0.18 0.08 0.00 0.09 0.00 0.00 57.88 57.91 1nf5 h LEU 199 Cb 0.06 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 1nf5 h LEU 199 CO -0.08 0.55 0.26 0.22 0.09 0.00 0.00 178.44 179.48 1nf5 h TYR 200 N 0.42 0.46 0.12 1.13 3.20 -0.63 -2.63 116.97 119.04 1nf5 h TYR 200 Ca 0.12 0.03 -0.27 0.00 3.14 0.00 0.00 58.73 61.75 1nf5 h TYR 200 Cb 0.21 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 1nf5 h TYR 200 CO 0.00 0.15 -1.35 1.88 -1.64 0.00 0.00 178.16 177.21 1nf5 h TYR 201 N 0.47 0.45 -0.27 -3.82 -1.99 -0.87 -3.41 116.97 107.53 1nf5 h TYR 201 Ca 0.30 -0.33 -0.15 0.00 2.00 0.00 0.00 58.73 60.55 1nf5 h TYR 201 Cb 0.33 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 1nf5 h TYR 201 CO -0.14 1.53 -0.43 -0.07 -0.00 0.00 0.00 178.16 179.04 1nf5 h LEU 202 N -0.31 0.72 -0.43 3.88 -0.00 -0.59 -3.18 115.31 115.39 1nf5 h LEU 202 Ca -0.29 -0.33 0.07 0.00 -0.00 0.00 0.00 57.88 57.33 1nf5 h LEU 202 Cb 1.75 -0.20 -0.06 0.00 -0.00 0.00 0.00 40.66 42.15 1nf5 h LEU 202 CO 0.07 1.05 0.10 0.45 -0.00 0.00 0.00 178.44 180.10 1nf5 h HIS 203 N 0.54 0.16 -0.42 1.13 3.86 -1.67 0.19 115.15 118.94 1nf5 h HIS 203 Ca 0.04 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.20 1nf5 h HIS 203 Cb 0.97 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 29.41 1nf5 h HIS 203 CO 0.05 0.02 -0.05 -1.35 0.86 0.00 0.00 177.93 177.46 1nf5 h PRO 204 N 0.23 0.71 0.01 2.45 0.11 -1.80 -2.14 132.00 131.58 1nf5 h PRO 204 Ca 0.21 -0.20 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1nf5 h PRO 204 Cb 0.25 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.28 1nf5 h PRO 204 CO -0.26 0.76 -0.01 0.82 -0.21 0.00 0.00 178.00 179.11 1nf5 h ILE 205 N 0.66 1.12 -0.58 4.15 2.04 -1.28 -1.57 117.51 122.05 1nf5 h ILE 205 Ca 0.12 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1nf5 h ILE 205 Cb 0.49 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 1nf5 h ILE 205 CO 0.03 0.10 0.28 -0.07 0.00 0.00 0.00 178.15 178.49 1nf5 h LEU 206 N -0.18 0.73 -0.40 1.44 3.38 -0.58 0.01 115.31 119.71 1nf5 h LEU 206 Ca -0.00 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1nf5 h LEU 206 Cb 0.18 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1nf5 h LEU 206 CO 0.00 0.62 -0.17 1.56 0.09 0.00 0.00 178.44 180.55 1nf5 h GLN 207 N 0.82 0.82 -0.96 1.13 4.20 -1.27 -2.68 115.11 117.16 1nf5 h GLN 207 Ca 0.20 -0.35 0.04 0.00 0.06 0.00 0.00 58.65 58.60 1nf5 h GLN 207 Cb 0.08 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 27.78 1nf5 h GLN 207 CO -0.03 0.98 0.62 0.00 -0.67 0.00 0.00 178.83 179.73 1nf5 h ARG 208 N 0.63 1.17 0.00 1.46 3.08 -0.58 0.18 114.38 120.32 1nf5 h ARG 208 Ca 0.09 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1nf5 h ARG 208 Cb 0.72 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1nf5 h ARG 208 CO 0.05 0.77 0.00 1.04 -1.07 0.00 0.00 179.97 180.76 1nf5 n GLN 209 N -4.48 0.61 -3.71 0.04 6.02 -0.07 -4.48 117.38 111.30 1nf5 n GLN 209 Ca 0.13 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.88 1nf5 n GLN 209 Cb 0.10 -1.43 0.05 0.00 1.02 0.00 0.00 30.24 29.98 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 -0.93 -5.76 -3.93 -1.09 6.02 0.64 -4.84 117.38 107.49 1nf5 n GLN 210 Ca 0.13 0.67 -0.31 0.00 -0.01 0.00 0.00 57.00 57.48 1nf5 n GLN 210 Cb 0.06 -5.46 -0.04 0.00 1.02 0.00 0.00 30.24 25.81 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 -6.90 4.31 -0.68 1.08 1.43 -1.15 -4.70 118.68 112.07 1nf5 s LEU 211 Ca 0.28 0.26 -0.17 0.00 -1.03 0.00 0.00 54.13 53.46 1nf5 s LEU 211 Cb -0.14 -2.88 0.14 0.00 0.03 0.00 0.00 46.19 43.34 1nf5 s LEU 211 CO 0.79 0.18 0.74 -0.62 0.23 0.00 0.00 176.35 177.68 1nf5 s ASP 212 N -2.43 6.36 0.21 2.29 2.15 -0.78 -4.46 116.67 120.02 1nf5 s ASP 212 Ca 0.34 -1.83 0.02 0.00 0.43 0.00 0.00 52.55 51.51 1nf5 s ASP 212 Cb -0.13 -2.28 -0.05 0.00 -0.30 0.00 0.00 42.92 40.16 1nf5 s ASP 212 CO 0.26 -0.96 0.03 -0.72 -0.17 0.00 0.00 175.17 173.62 1nf5 s TYR 213 N 1.99 1.40 -0.01 -5.34 -0.85 -0.39 -0.58 117.35 113.57 1nf5 s TYR 213 Ca 0.14 -1.04 -0.01 0.00 -0.52 0.00 0.00 57.07 55.64 1nf5 s TYR 213 Cb -0.20 -0.81 -0.00 0.00 0.38 0.00 0.00 41.96 41.34 1nf5 s TYR 213 CO 0.01 -0.21 0.02 0.20 -1.52 0.00 0.00 175.55 174.05 1nf5 s GLY 214 N -3.25 0.02 -0.23 5.49 0.00 -0.60 -1.06 107.32 107.69 1nf5 s GLY 214 Ca 0.29 -0.02 -0.10 0.00 0.00 0.00 0.00 44.72 44.89 1nf5 s GLY 214 CO 0.08 -0.04 0.15 -0.42 0.00 0.00 0.00 173.10 172.87 1nf5 s ILE 215 N -0.22 5.36 -0.15 0.90 -1.09 -0.67 -1.02 121.20 124.31 1nf5 s ILE 215 Ca -0.02 0.18 0.00 0.00 -2.23 0.00 0.00 60.65 58.57 1nf5 s ILE 215 Cb -0.02 -3.49 0.03 0.00 -1.58 0.00 0.00 42.46 37.40 1nf5 s ILE 215 CO -0.00 0.36 -0.11 -0.31 -1.23 0.00 0.00 174.94 173.65 1nf5 s TYR 216 N 0.93 2.01 -0.31 3.97 1.51 0.23 -1.21 117.35 124.49 1nf5 s TYR 216 Ca 0.08 -1.17 -0.11 0.00 -1.01 0.00 0.00 57.07 54.86 1nf5 s TYR 216 Cb -0.13 -1.49 -0.02 0.00 -0.11 0.00 0.00 41.96 40.20 1nf5 s TYR 216 CO 0.03 -0.64 0.18 0.08 -1.11 0.00 0.00 175.55 174.09 1nf5 s VAL 217 N 1.54 5.00 -0.54 0.71 1.01 0.83 -0.55 120.40 128.41 1nf5 s VAL 217 Ca 0.03 -0.16 -0.16 0.00 0.00 0.00 0.00 61.98 61.69 1nf5 s VAL 217 Cb -0.14 -3.49 0.11 0.00 0.00 0.00 0.00 36.38 32.87 1nf5 s VAL 217 CO -0.09 0.12 0.52 -0.63 0.00 0.00 0.00 175.10 175.02 1nf5 s ILE 218 N 1.69 5.14 -0.30 2.22 -1.09 0.39 -0.74 121.20 128.51 1nf5 s ILE 218 Ca 0.06 -1.30 -0.25 0.00 -2.23 0.00 0.00 60.65 56.93 1nf5 s ILE 218 Cb -0.17 -4.32 0.00 0.00 -1.58 0.00 0.00 42.46 36.39 1nf5 s ILE 218 CO 0.09 -0.86 0.86 0.21 -1.23 0.00 0.00 174.94 174.01 1nf5 s ASN 219 N 3.39 6.76 -0.44 3.58 2.47 -0.50 -0.39 114.94 129.81 1nf5 s ASN 219 Ca 0.05 0.81 -0.27 0.00 0.42 0.00 0.00 52.86 53.88 1nf5 s ASN 219 Cb -0.28 -2.44 0.02 0.00 -1.45 0.00 0.00 41.25 37.10 1nf5 s ASN 219 CO 0.05 -0.66 0.99 -1.58 -3.72 0.00 0.00 177.10 172.18 1nf5 s GLN 220 N 3.09 3.69 0.77 0.43 0.74 0.82 -1.04 119.66 128.16 1nf5 s GLN 220 Ca 0.36 0.43 -0.11 0.00 0.05 0.00 0.00 55.36 56.09 1nf5 s GLN 220 Cb -0.14 -3.88 0.06 0.00 1.10 0.00 0.00 33.01 30.15 1nf5 s GLN 220 CO 0.12 -1.18 1.09 0.00 -0.55 0.00 0.00 175.29 174.76 1nf5 s ALA 221 N 3.88 2.25 0.00 1.58 0.00 -0.19 -4.84 121.76 124.44 1nf5 s ALA 221 Ca 0.41 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1nf5 s ALA 221 Cb -0.10 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1nf5 s ALA 221 CO 0.25 -1.74 0.00 0.41 0.00 0.00 0.00 175.76 174.68 1nf5 n GLY 222 N -1.36 -2.53 0.02 0.00 0.00 -1.26 -4.73 105.19 95.34 1nf5 n GLY 222 Ca 0.09 -1.68 0.02 0.00 0.00 0.00 0.00 46.02 44.44 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 -0.39 2.63 -0.95 1.61 -0.58 -1.26 -5.05 120.64 116.65 1nf5 n GLU 223 Ca 0.00 -1.74 -0.28 0.00 -0.42 0.00 0.00 57.16 54.72 1nf5 n GLU 223 Cb 0.00 -1.11 0.21 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 -1.40 1.87 0.54 1.62 0.01 -1.26 -4.95 113.70 110.12 1nf5 s SER 224 Ca 0.07 1.24 -0.22 0.00 1.31 0.00 0.00 55.95 58.35 1nf5 s SER 224 Cb 0.06 -1.93 -0.05 0.00 0.21 0.00 0.00 66.02 64.31 1nf5 s SER 224 CO 0.01 -3.61 1.30 -0.04 0.41 0.00 0.00 173.24 171.31 1nf5 s MET 225 N -4.81 3.23 0.28 12.44 -1.94 -1.26 -4.90 119.30 122.33 1nf5 s MET 225 Ca 0.67 2.10 -0.30 0.00 -1.71 0.00 0.00 55.69 56.45 1nf5 s MET 225 Cb -0.20 -2.24 -0.11 0.00 2.01 0.00 0.00 34.83 34.28 1nf5 s MET 225 CO 0.60 -1.08 1.61 0.12 -0.01 0.00 0.00 175.02 176.26 1nf5 s PHE 226 N -1.38 2.77 -0.69 -0.03 5.36 0.65 -4.42 117.98 120.24 1nf5 s PHE 226 Ca 0.71 0.72 0.05 0.00 -0.96 0.00 0.00 56.93 57.45 1nf5 s PHE 226 Cb -0.37 -4.08 0.18 0.00 -0.34 0.00 0.00 43.02 38.41 1nf5 s PHE 226 CO 0.44 -3.69 0.52 -1.71 -1.46 0.00 0.00 175.22 169.32 1nf5 n ASN 227 N 2.41 3.00 0.01 6.13 2.85 -1.26 -0.45 115.26 127.95 1nf5 n ASN 227 Ca 0.09 -3.21 -0.13 0.00 -0.11 0.00 0.00 54.58 51.22 1nf5 n ASN 227 Cb 0.37 -0.74 -0.07 0.00 1.24 0.00 0.00 39.78 40.58 1nf5 n ASN 227 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 1nf5 h ARG 228 N 5.25 -0.50 -0.83 1.20 2.43 -1.90 -2.02 114.38 118.02 1nf5 h ARG 228 Ca 0.16 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.38 1nf5 h ARG 228 Cb 0.75 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.37 1nf5 h ARG 228 CO 0.72 -0.33 0.55 0.00 -1.51 0.00 0.00 179.97 179.40 1nf5 h ALA 229 N 0.05 1.45 -0.29 2.80 0.00 -1.86 -1.37 119.26 120.04 1nf5 h ALA 229 Ca 0.07 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1nf5 h ALA 229 Cb 0.64 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1nf5 h ALA 229 CO -0.39 0.49 -0.38 -0.22 0.00 0.00 0.00 179.25 178.75 1nf5 h LYS 230 N 1.07 0.68 -0.47 0.00 3.64 -1.55 -1.46 116.57 118.47 1nf5 h LYS 230 Ca 0.32 -0.34 -0.06 0.00 -1.27 0.00 0.00 60.65 59.29 1nf5 h LYS 230 Cb -0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1nf5 h LYS 230 CO -0.08 0.95 0.03 -0.07 -2.27 0.00 0.00 179.45 178.01 1nf5 h LEU 231 N 0.56 0.72 -0.72 5.20 3.38 -0.59 -1.67 115.31 122.19 1nf5 h LEU 231 Ca 0.05 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1nf5 h LEU 231 Cb 0.91 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1nf5 h LEU 231 CO 0.08 0.77 0.06 -0.07 0.09 0.00 0.00 178.44 179.36 1nf5 h LEU 232 N 0.72 1.00 -0.80 1.67 3.38 -0.94 -0.71 115.31 119.63 1nf5 h LEU 232 Ca 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1nf5 h LEU 232 Cb 0.39 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1nf5 h LEU 232 CO 0.01 1.03 0.47 0.78 0.09 0.00 0.00 178.44 180.82 1nf5 h ASN 233 N 0.97 0.98 -0.62 -0.43 2.35 -0.60 -2.02 115.58 116.20 1nf5 h ASN 233 Ca 0.18 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1nf5 h ASN 233 Cb 0.48 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 1nf5 h ASN 233 CO 0.02 0.77 0.33 0.58 -1.65 0.00 0.00 177.43 177.47 1nf5 h VAL 234 N 1.10 1.20 -0.78 2.81 2.07 -0.83 -2.37 116.25 119.46 1nf5 h VAL 234 Ca 0.29 -0.53 0.05 0.00 0.82 0.00 0.00 66.70 67.32 1nf5 h VAL 234 Cb -0.02 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 1nf5 h VAL 234 CO -0.05 0.22 0.48 1.23 0.02 0.00 0.00 177.57 179.47 1nf5 h GLY 235 N 0.84 1.14 0.88 2.17 0.00 -0.59 0.71 103.07 108.22 1nf5 h GLY 235 Ca 0.22 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1nf5 h GLY 235 CO -0.03 0.26 -0.29 -2.75 0.00 0.00 0.00 176.54 173.73 1nf5 h PHE 236 N 0.90 -0.76 -0.45 5.60 3.57 -1.10 0.04 116.94 124.73 1nf5 h PHE 236 Ca 0.33 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.81 1nf5 h PHE 236 Cb 0.11 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 1nf5 h PHE 236 CO -0.04 -0.45 0.24 0.87 -2.23 0.00 0.00 178.31 176.70 1nf5 h LYS 237 N -0.73 0.64 -0.49 1.11 1.79 -1.15 -2.51 116.57 115.24 1nf5 h LYS 237 Ca -0.05 -0.08 -0.09 0.00 -2.18 0.00 0.00 60.65 58.24 1nf5 h LYS 237 Cb 0.60 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 1nf5 h LYS 237 CO 0.06 0.52 -0.06 0.93 -1.08 0.00 0.00 179.45 179.82 1nf5 h GLU 238 N 0.59 0.90 -0.71 3.15 4.39 -0.83 -3.10 114.58 118.97 1nf5 h GLU 238 Ca 0.16 -0.32 -0.02 0.00 0.34 0.00 0.00 59.36 59.52 1nf5 h GLU 238 Cb 0.08 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1nf5 h GLU 238 CO -0.02 0.97 0.38 0.00 -1.16 0.00 0.00 179.01 179.17 1nf5 h ALA 239 N 0.91 0.91 -0.03 3.43 0.00 -0.91 -1.97 119.26 121.60 1nf5 h ALA 239 Ca 0.13 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1nf5 h ALA 239 Cb 0.60 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1nf5 h ALA 239 CO 0.04 0.44 0.11 -0.07 0.00 0.00 0.00 179.25 179.76 1nf5 h LEU 240 N 0.98 0.00 -0.93 0.00 4.07 -1.37 0.27 115.31 118.32 1nf5 h LEU 240 Ca 0.25 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.16 1nf5 h LEU 240 Cb 0.05 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.79 1nf5 h LEU 240 CO -0.04 0.00 -0.24 0.11 -1.08 0.00 0.00 178.44 177.19 1nf5 h LYS 241 N 0.00 0.00 0.18 1.13 1.57 -1.36 -3.32 116.57 114.76 1nf5 h LYS 241 Ca 0.01 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.45 1nf5 h LYS 241 Cb 0.23 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.55 1nf5 h LYS 241 CO -0.00 0.24 -1.75 -0.44 -0.57 0.00 0.00 179.45 176.93 1nf5 h ASP 242 N 0.00 0.58 -5.01 0.86 3.32 -1.03 -3.50 116.42 111.64 1nf5 h ASP 242 Ca -0.00 -0.90 -0.02 0.00 0.02 0.00 0.00 57.03 56.13 1nf5 h ASP 242 Cb 0.83 -0.19 -0.12 0.00 0.22 0.00 0.00 39.33 40.07 1nf5 h ASP 242 CO 0.03 1.76 0.17 -0.47 -1.72 0.00 0.00 179.24 179.01 1nf5 s TYR 243 N -2.58 -0.47 -1.41 4.55 5.04 -1.19 -5.06 117.35 116.23 1nf5 s TYR 243 Ca -0.16 0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.60 1nf5 s TYR 243 Cb 0.06 0.52 0.07 0.00 0.35 0.00 0.00 41.96 42.96 1nf5 s TYR 243 CO 0.85 -0.84 2.26 -0.40 -1.34 0.00 0.00 175.55 176.08 1nf5 n ASP 244 N -0.36 5.71 -4.75 4.32 5.75 -1.26 -4.47 116.55 121.49 1nf5 n ASP 244 Ca -0.16 -2.93 -0.38 0.00 -0.01 0.00 0.00 54.79 51.31 1nf5 n ASP 244 Cb 0.65 -1.54 0.04 0.00 -1.03 0.00 0.00 41.12 39.24 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 1.47 2.29 0.00 2.11 1.51 -1.26 -4.92 117.35 118.55 1nf5 s TYR 245 Ca 0.49 1.41 0.00 0.00 -1.01 0.00 0.00 57.07 57.96 1nf5 s TYR 245 Cb 0.14 -3.74 0.00 0.00 -0.11 0.00 0.00 41.96 38.25 1nf5 s TYR 245 CO -0.05 -2.78 0.58 0.27 -1.11 0.00 0.00 175.55 172.45 1nf5 n ASN 246 N -1.17 1.14 -3.77 2.29 0.23 -0.42 -4.88 115.26 108.68 1nf5 n ASN 246 Ca 0.11 -1.19 -0.13 0.00 -0.53 0.00 0.00 54.58 52.85 1nf5 n ASN 246 Cb 0.46 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.03 1nf5 n ASN 246 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1nf5 s PHE 248 N 0.56 2.10 -0.21 0.00 0.08 -0.25 -0.85 117.98 119.42 1nf5 s PHE 248 Ca -0.04 -1.11 -0.08 0.00 0.12 0.00 0.00 56.93 55.83 1nf5 s PHE 248 Cb -0.05 -1.53 -0.04 0.00 -0.57 0.00 0.00 43.02 40.83 1nf5 s PHE 248 CO -0.03 -0.60 0.07 0.08 -0.10 0.00 0.00 175.22 174.65 1nf5 s VAL 249 N 1.30 4.71 -0.28 -0.44 1.01 -0.31 -0.39 120.40 126.00 1nf5 s VAL 249 Ca 0.01 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 1nf5 s VAL 249 Cb -0.14 -3.15 -0.00 0.00 0.00 0.00 0.00 36.38 33.09 1nf5 s VAL 249 CO -0.07 0.41 0.07 -0.36 0.00 0.00 0.00 175.10 175.15 1nf5 s PHE 250 N 0.78 3.12 -0.04 5.22 0.40 0.15 0.14 117.98 127.75 1nf5 s PHE 250 Ca 0.04 -0.80 0.01 0.00 -0.60 0.00 0.00 56.93 55.59 1nf5 s PHE 250 Cb -0.13 -2.24 0.02 0.00 0.51 0.00 0.00 43.02 41.17 1nf5 s PHE 250 CO 0.02 -0.51 -0.06 0.45 0.70 0.00 0.00 175.22 175.82 1nf5 s SER 251 N 1.54 1.07 0.63 1.36 0.15 -0.36 -0.63 113.70 117.47 1nf5 s SER 251 Ca 0.04 -0.16 -0.17 0.00 0.70 0.00 0.00 55.95 56.36 1nf5 s SER 251 Cb -0.16 -0.48 -0.01 0.00 -1.71 0.00 0.00 66.02 63.66 1nf5 s SER 251 CO 0.02 -0.02 1.15 -1.81 1.20 0.00 0.00 173.24 173.78 1nf5 s ASP 252 N 0.73 5.10 0.52 5.45 1.01 -0.67 -4.05 116.67 124.77 1nf5 s ASP 252 Ca -0.11 2.17 0.31 0.00 0.71 0.00 0.00 52.55 55.63 1nf5 s ASP 252 Cb -0.14 -2.57 1.34 0.00 1.01 0.00 0.00 42.92 42.56 1nf5 s ASP 252 CO 0.01 -1.65 1.99 -0.37 0.21 0.00 0.00 175.17 175.36 1nf5 h VAL 253 N 0.39 0.25 -0.50 -1.27 -1.51 -1.93 -3.25 116.25 108.43 1nf5 h VAL 253 Ca -0.48 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.34 1nf5 h VAL 253 Cb 1.27 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.94 1nf5 h VAL 253 CO 0.54 0.08 0.00 -0.90 -1.23 0.00 0.00 177.57 176.06 1nf5 n ASP 254 N -3.26 4.94 -4.16 4.19 5.68 -1.26 -4.55 116.55 118.12 1nf5 n ASP 254 Ca -0.00 -2.75 -0.30 0.00 -0.50 0.00 0.00 54.79 51.24 1nf5 n ASP 254 Cb 0.31 -0.65 -0.17 0.00 -1.14 0.00 0.00 41.12 39.48 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 -2.26 1.97 -0.09 -2.12 1.43 -1.23 -0.78 118.68 115.60 1nf5 s LEU 255 Ca 0.46 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 53.09 1nf5 s LEU 255 Cb 0.35 -1.27 0.01 0.00 0.03 0.00 0.00 46.19 45.30 1nf5 s LEU 255 CO 0.14 0.11 -0.19 -0.63 0.23 0.00 0.00 176.35 176.01 1nf5 s ILE 256 N 0.55 1.71 0.29 -0.59 -1.09 -0.21 -4.93 121.20 116.93 1nf5 s ILE 256 Ca -0.15 -0.81 -0.29 0.00 -2.23 0.00 0.00 60.65 57.17 1nf5 s ILE 256 Cb -0.17 -1.50 -0.09 0.00 -1.58 0.00 0.00 42.46 39.12 1nf5 s ILE 256 CO 0.05 0.48 1.06 -2.16 -1.23 0.00 0.00 174.94 173.14 1nf5 s PRO 257 N 0.50 4.62 0.00 2.79 0.04 -1.26 -0.81 135.00 140.89 1nf5 s PRO 257 Ca -0.16 1.70 0.24 0.00 0.04 0.00 0.00 61.00 62.81 1nf5 s PRO 257 Cb -0.17 -3.12 0.58 0.00 0.04 0.00 0.00 34.50 31.82 1nf5 s PRO 257 CO 0.06 0.23 1.47 -1.33 0.04 0.00 0.00 177.00 177.48 1nf5 n MET 258 N 1.08 2.09 -3.58 4.56 2.81 0.36 -4.81 117.12 119.63 1nf5 n MET 258 Ca -0.01 -1.61 -0.15 0.00 -1.81 0.00 0.00 57.70 54.12 1nf5 n MET 258 Cb 0.46 -1.46 -0.13 0.00 -0.71 0.00 0.00 33.22 31.38 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 -1.76 0.69 0.00 7.83 3.84 -1.26 -0.48 114.94 123.80 1nf5 s ASN 259 Ca 0.34 0.28 0.07 0.00 0.21 0.00 0.00 52.86 53.76 1nf5 s ASN 259 Cb 0.20 0.62 0.39 0.00 -0.55 0.00 0.00 41.25 41.91 1nf5 s ASN 259 CO 0.30 -0.27 0.81 -0.90 -2.79 0.00 0.00 177.10 174.25 1nf5 n ASP 260 N 5.34 0.00 -0.01 -4.21 3.85 -0.95 -1.05 116.55 119.51 1nf5 n ASP 260 Ca -0.06 -0.61 0.13 0.00 -0.71 0.00 0.00 54.79 53.55 1nf5 n ASP 260 Cb 0.50 0.00 0.47 0.00 -1.35 0.00 0.00 41.12 40.74 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 -0.75 0.00 -2.75 2.11 8.25 -1.26 -4.35 115.22 116.47 1nf5 n HIS 261 Ca 0.05 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.08 1nf5 n HIS 261 Cb 0.02 -0.36 -0.01 0.00 1.12 0.00 0.00 29.99 30.76 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 -2.94 6.83 0.17 0.41 3.84 -0.22 -4.97 114.94 118.06 1nf5 s ASN 262 Ca 0.15 -2.40 -0.32 0.00 0.21 0.00 0.00 52.86 50.50 1nf5 s ASN 262 Cb 0.19 -2.49 -0.10 0.00 -0.55 0.00 0.00 41.25 38.29 1nf5 s ASN 262 CO 0.59 -1.07 1.58 -0.89 -2.79 0.00 0.00 177.10 174.52 1nf5 s THR 263 N 3.26 2.55 -1.42 -5.21 2.01 -1.26 -4.90 115.64 110.67 1nf5 s THR 263 Ca 0.46 0.40 -0.09 0.00 0.31 0.00 0.00 61.69 62.77 1nf5 s THR 263 Cb -0.00 -3.25 0.06 0.00 0.01 0.00 0.00 72.50 69.31 1nf5 s THR 263 CO -0.00 0.03 2.44 -1.22 -0.69 0.00 0.00 174.62 175.18 1nf5 n TYR 264 N 3.92 2.72 -4.13 4.92 4.02 -1.26 -4.87 117.16 122.49 1nf5 n TYR 264 Ca 0.14 -2.91 -0.14 0.00 -0.01 0.00 0.00 57.90 54.97 1nf5 n TYR 264 Cb 0.38 -2.14 -0.05 0.00 -0.02 0.00 0.00 39.34 37.52 1nf5 n TYR 264 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 1nf5 n ARG 265 N 3.20 0.42 -3.53 -0.72 -4.01 -1.26 -4.94 116.66 105.82 1nf5 n ARG 265 Ca 0.62 -2.54 -0.28 0.00 -1.04 0.00 0.00 57.85 54.61 1nf5 n ARG 265 Cb 0.28 2.21 -0.03 0.00 -3.04 0.00 0.00 32.46 31.88 1nf5 n ARG 265 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1nf5 n PHE 267 N -0.76 0.60 0.32 0.00 3.01 -1.26 -5.03 117.46 114.34 1nf5 n PHE 267 Ca -0.03 -2.55 0.21 0.00 1.01 0.00 0.00 57.45 56.08 1nf5 n PHE 267 Cb 0.54 -0.15 1.02 0.00 -0.01 0.00 0.00 39.48 40.88 1nf5 n PHE 267 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1nf5 h SER 268 N 1.44 0.00 -4.04 4.37 0.02 -2.00 -3.42 113.55 109.91 1nf5 h SER 268 Ca -0.36 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.26 1nf5 h SER 268 Cb 1.23 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.62 1nf5 h SER 268 CO 0.59 0.00 -0.72 -1.10 -1.14 0.00 0.00 176.83 174.46 1nf5 s GLN 269 N -3.97 1.02 0.30 3.45 -1.52 -1.26 -5.08 119.66 112.61 1nf5 s GLN 269 Ca -0.03 -1.40 -0.28 0.00 -1.95 0.00 0.00 55.36 51.70 1nf5 s GLN 269 Cb 0.11 -0.61 -0.13 0.00 -0.22 0.00 0.00 33.01 32.16 1nf5 s GLN 269 CO 0.46 0.08 1.12 -2.30 -0.25 0.00 0.00 175.29 174.39 1nf5 n PRO 270 N -0.06 1.62 -4.23 2.91 -0.02 -1.24 -4.60 135.00 129.39 1nf5 n PRO 270 Ca -0.11 0.57 -0.34 0.00 -2.02 0.00 0.00 63.50 61.60 1nf5 n PRO 270 Cb 0.60 -2.02 -0.14 0.00 -0.02 0.00 0.00 33.50 31.92 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 -1.61 3.31 -0.30 -0.52 6.06 -0.29 0.03 118.95 125.63 1nf5 s ARG 271 Ca 0.58 -0.68 -0.13 0.00 -2.50 0.00 0.00 55.73 53.00 1nf5 s ARG 271 Cb -0.66 -2.81 -0.03 0.00 0.06 0.00 0.00 34.95 31.51 1nf5 s ARG 271 CO 0.60 -0.06 0.29 -1.58 -2.50 0.00 0.00 175.30 172.04 1nf5 s HIS 272 N 1.07 3.23 -0.18 5.12 5.65 -0.06 -0.41 115.29 129.71 1nf5 s HIS 272 Ca 0.00 0.12 -0.11 0.00 0.25 0.00 0.00 55.06 55.33 1nf5 s HIS 272 Cb -0.15 -2.51 -0.21 0.00 -1.18 0.00 0.00 32.58 28.53 1nf5 s HIS 272 CO -0.02 -0.27 0.17 -0.89 -0.65 0.00 0.00 174.74 173.08 1nf5 n ILE 273 N 5.12 1.64 -2.49 0.89 5.41 -0.06 -4.33 119.36 125.55 1nf5 n ILE 273 Ca -0.11 -0.43 -0.43 0.00 1.00 0.00 0.00 62.75 62.78 1nf5 n ILE 273 Cb 0.51 -1.80 0.00 0.00 -0.71 0.00 0.00 39.64 37.64 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 -3.82 4.93 0.11 4.38 3.41 -1.11 -4.73 113.62 116.79 1nf5 n SER 274 Ca -0.36 -3.00 -0.17 0.00 -0.26 0.00 0.00 58.87 55.08 1nf5 n SER 274 Cb 0.91 -1.58 -0.14 0.00 -0.26 0.00 0.00 64.21 63.14 1nf5 n SER 274 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1nf5 h VAL 275 N 4.36 1.46 -2.89 -3.33 -1.51 -1.80 -3.42 116.25 109.12 1nf5 h VAL 275 Ca 0.40 -2.99 -0.61 0.00 -1.23 0.00 0.00 66.70 62.27 1nf5 h VAL 275 Cb 0.75 2.96 -0.40 0.00 -2.13 0.00 0.00 31.29 32.46 1nf5 h VAL 275 CO 1.51 0.88 -0.74 0.00 -1.23 0.00 0.00 177.57 177.98 1nf5 s ALA 276 N -2.66 2.43 0.21 5.19 0.00 -1.03 -2.81 121.76 123.10 1nf5 s ALA 276 Ca -0.05 -2.88 -0.09 0.00 0.00 0.00 0.00 51.96 48.94 1nf5 s ALA 276 Cb 0.07 -1.90 -0.07 0.00 0.00 0.00 0.00 23.12 21.21 1nf5 s ALA 276 CO 0.90 -2.05 0.53 -1.64 0.00 0.00 0.00 175.76 173.49 1nf5 s MET 277 N -0.16 3.79 0.21 0.00 1.00 -1.26 -0.88 119.30 121.99 1nf5 s MET 277 Ca 0.22 0.24 -0.09 0.00 0.00 0.00 0.00 55.69 56.07 1nf5 s MET 277 Cb -0.14 -2.69 0.15 0.00 0.00 0.00 0.00 34.83 32.16 1nf5 s MET 277 CO -0.08 0.34 1.80 0.38 0.00 0.00 0.00 175.02 177.46 1nf5 h ASP 278 N 2.63 1.02 -0.39 3.03 3.04 -1.85 0.29 116.42 124.19 1nf5 h ASP 278 Ca -0.47 -0.14 0.11 0.00 -3.24 0.00 0.00 57.03 53.30 1nf5 h ASP 278 Cb 1.17 -0.26 -0.02 0.00 -1.04 0.00 0.00 39.33 39.18 1nf5 h ASP 278 CO 0.69 0.87 0.80 0.50 -2.04 0.00 0.00 179.24 180.07 1nf5 h LYS 279 N 1.10 0.00 0.00 4.15 3.64 -1.94 0.99 116.57 124.51 1nf5 h LYS 279 Ca 0.27 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1nf5 h LYS 279 Cb 0.12 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1nf5 h LYS 279 CO -0.03 0.00 -0.36 1.19 -2.27 0.00 0.00 179.45 177.98 1nf5 n PHE 280 N -3.05 0.00 -3.27 1.91 0.99 -0.86 -4.96 117.46 108.22 1nf5 n PHE 280 Ca 0.08 -1.33 -0.17 0.00 -0.00 0.00 0.00 57.45 56.03 1nf5 n PHE 280 Cb 0.94 -0.22 0.06 0.00 -1.00 0.00 0.00 39.48 39.26 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 -1.18 -0.15 4.04 1.37 0.00 0.34 -3.04 105.19 106.55 1nf5 n GLY 281 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -4.18 -1.88 -3.93 1.61 3.01 0.96 -4.96 117.46 108.08 1nf5 n PHE 282 Ca -0.03 0.82 -0.08 0.00 1.01 0.00 0.00 57.45 59.17 1nf5 n PHE 282 Cb 0.56 -3.53 -0.08 0.00 -0.01 0.00 0.00 39.48 36.42 1nf5 n PHE 282 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1nf5 s SER 283 N -3.65 0.24 -0.04 4.37 1.04 -1.17 -4.71 113.70 109.78 1nf5 s SER 283 Ca 0.48 -0.77 -0.30 0.00 0.48 0.00 0.00 55.95 55.84 1nf5 s SER 283 Cb -0.25 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.12 1nf5 s SER 283 CO 0.88 -0.69 1.20 -0.22 0.98 0.00 0.00 173.24 175.40 1nf5 s LEU 284 N -2.88 4.29 0.33 2.42 2.96 -1.12 -4.29 118.68 120.38 1nf5 s LEU 284 Ca 0.06 1.84 0.03 0.00 -0.22 0.00 0.00 54.13 55.84 1nf5 s LEU 284 Cb 0.06 -3.56 0.58 0.00 0.50 0.00 0.00 46.19 43.77 1nf5 s LEU 284 CO -0.11 -0.58 1.88 1.55 -1.32 0.00 0.00 176.35 177.78 1nf5 h PRO 285 N 7.42 0.59 -2.01 0.98 0.13 -1.89 -3.45 132.00 133.77 1nf5 h PRO 285 Ca -0.35 -0.11 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 1nf5 h PRO 285 Cb 1.17 -0.09 -0.19 0.00 0.13 0.00 0.00 31.00 32.01 1nf5 h PRO 285 CO 0.87 0.57 0.25 1.52 -0.23 0.00 0.00 178.00 180.99 1nf5 s TYR 286 N -5.07 -0.61 0.53 1.56 -0.85 -1.26 -5.06 117.35 106.59 1nf5 s TYR 286 Ca -0.08 0.99 0.18 0.00 -0.52 0.00 0.00 57.07 57.65 1nf5 s TYR 286 Cb 0.16 0.43 1.37 0.00 0.38 0.00 0.00 41.96 44.29 1nf5 s TYR 286 CO 0.77 -0.59 2.17 -0.24 -1.52 0.00 0.00 175.55 176.14 1nf5 h VAL 287 N 2.86 0.92 -0.25 -3.49 3.04 -2.04 -2.07 116.25 115.22 1nf5 h VAL 287 Ca -0.26 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.43 1nf5 h VAL 287 Cb 1.16 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.43 1nf5 h VAL 287 CO 0.38 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.94 1nf5 n GLN 288 N -4.42 1.67 -2.44 4.17 3.00 -1.26 -4.90 117.38 113.20 1nf5 n GLN 288 Ca -0.03 -0.94 -0.42 0.00 -0.01 0.00 0.00 57.00 55.60 1nf5 n GLN 288 Cb 0.09 -1.26 -0.03 0.00 0.00 0.00 0.00 30.24 29.05 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 -1.65 3.10 -0.07 1.08 5.04 -0.78 -4.87 117.35 119.20 1nf5 s TYR 289 Ca 0.17 1.15 0.21 0.00 -2.44 0.00 0.00 57.07 56.16 1nf5 s TYR 289 Cb 0.09 -3.45 0.43 0.00 0.35 0.00 0.00 41.96 39.38 1nf5 s TYR 289 CO 0.11 -1.46 1.18 0.34 -1.34 0.00 0.00 175.55 174.39 1nf5 n PHE 290 N 5.48 0.08 -2.72 4.97 7.35 -1.26 -5.02 117.46 126.33 1nf5 n PHE 290 Ca 0.12 -0.87 -0.22 0.00 -0.76 0.00 0.00 57.45 55.71 1nf5 n PHE 290 Cb 0.46 -0.18 0.10 0.00 0.35 0.00 0.00 39.48 40.20 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 -2.45 1.75 0.00 7.13 0.00 -1.26 -4.81 107.32 107.67 1nf5 s GLY 291 Ca 0.35 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 43.19 1nf5 s GLY 291 CO -0.13 -1.33 0.00 0.61 0.00 0.00 0.00 173.10 172.24 1nf5 n GLY 292 N -2.68 1.82 2.92 0.20 0.00 -1.26 -4.69 105.19 101.51 1nf5 n GLY 292 Ca 0.16 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 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 0.69 0.17 1.61 1.01 -1.26 -1.66 120.40 120.97 1nf5 s VAL 293 Ca 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 1nf5 s VAL 293 Cb 0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1nf5 s VAL 293 CO 0.00 0.26 0.28 -0.94 0.00 0.00 0.00 175.10 174.70 1nf5 s SER 294 N 0.87 0.05 -0.02 3.32 1.04 0.20 -0.88 113.70 118.28 1nf5 s SER 294 Ca -0.12 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1nf5 s SER 294 Cb -0.15 0.44 0.02 0.00 0.10 0.00 0.00 66.02 66.44 1nf5 s SER 294 CO 0.01 -0.91 0.01 0.00 0.98 0.00 0.00 173.24 173.34 1nf5 s ALA 295 N -3.99 0.14 -0.03 5.32 0.00 0.45 0.35 121.76 123.99 1nf5 s ALA 295 Ca 0.20 0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.40 1nf5 s ALA 295 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 1nf5 s ALA 295 CO 0.02 -0.07 -0.17 -0.51 0.00 0.00 0.00 175.76 175.03 1nf5 s LEU 296 N 0.82 1.94 0.86 0.00 1.02 0.47 -1.14 118.68 122.65 1nf5 s LEU 296 Ca -0.07 -0.34 -0.11 0.00 0.02 0.00 0.00 54.13 53.63 1nf5 s LEU 296 Cb -0.10 -0.93 0.11 0.00 0.02 0.00 0.00 46.19 45.28 1nf5 s LEU 296 CO -0.02 0.16 1.10 -0.94 0.02 0.00 0.00 176.35 176.67 1nf5 s SER 297 N -0.07 3.69 0.29 2.29 1.04 -1.26 -1.09 113.70 118.59 1nf5 s SER 297 Ca -0.01 1.71 0.00 0.00 0.48 0.00 0.00 55.95 58.13 1nf5 s SER 297 Cb -0.10 -2.37 0.51 0.00 0.10 0.00 0.00 66.02 64.16 1nf5 s SER 297 CO 0.01 -2.53 1.89 0.50 0.98 0.00 0.00 173.24 174.09 1nf5 h LYS 298 N -1.48 1.03 -0.41 4.02 3.64 -1.61 -1.65 116.57 120.11 1nf5 h LYS 298 Ca -0.47 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 58.74 1nf5 h LYS 298 Cb 1.26 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 1nf5 h LYS 298 CO 0.51 0.68 -0.16 0.37 -2.27 0.00 0.00 179.45 178.59 1nf5 h GLN 299 N 1.06 0.83 -0.65 1.90 -0.00 -1.90 -1.35 115.11 114.99 1nf5 h GLN 299 Ca 0.42 -0.34 -0.05 0.00 -0.00 0.00 0.00 58.65 58.67 1nf5 h GLN 299 Cb 0.25 -0.03 -0.03 0.00 0.00 0.00 0.00 27.48 27.66 1nf5 h GLN 299 CO -0.17 0.97 0.20 1.96 0.00 0.00 0.00 178.83 181.79 1nf5 h GLN 300 N 0.64 0.99 0.06 1.69 4.20 -1.74 -0.59 115.11 120.36 1nf5 h GLN 300 Ca 0.10 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1nf5 h GLN 300 Cb 0.70 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1nf5 h GLN 300 CO 0.05 0.85 -0.03 0.35 -0.67 0.00 0.00 178.83 179.38 1nf5 h PHE 301 N 0.96 -0.07 -0.92 2.96 3.57 -1.21 -3.04 116.94 119.18 1nf5 h PHE 301 Ca 0.21 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1nf5 h PHE 301 Cb 0.27 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.99 1nf5 h PHE 301 CO 0.02 0.19 0.59 -0.07 -2.23 0.00 0.00 178.31 176.81 1nf5 h LEU 302 N -0.34 1.07 -1.36 0.59 4.07 -1.09 -0.95 115.31 117.31 1nf5 h LEU 302 Ca -0.01 -0.04 0.13 0.00 0.08 0.00 0.00 57.88 58.05 1nf5 h LEU 302 Cb 0.30 -0.27 -0.06 0.00 1.08 0.00 0.00 40.66 41.70 1nf5 h LEU 302 CO 0.01 0.79 0.55 -1.28 -1.08 0.00 0.00 178.44 177.44 1nf5 h SER 303 N 1.26 0.60 -0.56 -0.43 0.87 -0.99 -0.50 113.55 113.79 1nf5 h SER 303 Ca 0.34 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.93 1nf5 h SER 303 Cb -0.11 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 61.76 1nf5 h SER 303 CO -0.07 0.32 0.00 2.30 -0.53 0.00 0.00 176.83 178.85 1nf5 n ILE 304 N -4.53 1.59 -3.51 2.23 -5.35 -1.01 -4.90 119.36 103.88 1nf5 n ILE 304 Ca 0.16 -1.02 -0.24 0.00 -0.27 0.00 0.00 62.75 61.38 1nf5 n ILE 304 Cb 0.45 0.06 0.07 0.00 -1.74 0.00 0.00 39.64 38.49 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 0.95 -6.33 0.00 7.28 4.05 -0.20 -4.71 115.26 116.31 1nf5 n ASN 305 Ca 0.22 -0.50 0.00 0.00 0.45 0.00 0.00 54.58 54.75 1nf5 n ASN 305 Cb 0.79 -5.00 0.00 0.00 1.23 0.00 0.00 39.78 36.80 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 -1.93 0.64 3.81 8.20 0.00 -0.39 -0.92 105.19 114.59 1nf5 n GLY 306 Ca -0.01 -0.77 -0.22 0.00 0.00 0.00 0.00 46.02 45.02 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 2.85 0.70 1.61 0.08 -1.26 -4.78 117.98 117.17 1nf5 s PHE 307 Ca 0.00 -0.31 -0.15 0.00 0.12 0.00 0.00 56.93 56.59 1nf5 s PHE 307 Cb 0.00 -1.70 0.02 0.00 -0.57 0.00 0.00 43.02 40.77 1nf5 s PHE 307 CO 0.00 0.27 1.16 -1.25 -0.10 0.00 0.00 175.22 175.30 1nf5 s PRO 308 N -3.93 2.45 -0.01 0.24 0.04 -1.26 -4.08 135.00 128.46 1nf5 s PRO 308 Ca 0.39 1.58 0.11 0.00 0.04 0.00 0.00 61.00 63.12 1nf5 s PRO 308 Cb -0.05 -1.89 -0.14 0.00 0.04 0.00 0.00 34.50 32.46 1nf5 s PRO 308 CO 0.25 -1.55 0.37 0.09 0.04 0.00 0.00 177.00 176.20 1nf5 n ASN 309 N -2.57 1.30 -1.10 6.66 3.02 -1.26 -3.52 115.26 117.79 1nf5 n ASN 309 Ca 0.12 -0.45 0.05 0.00 -0.03 0.00 0.00 54.58 54.27 1nf5 n ASN 309 Cb 0.51 1.21 0.21 0.00 -0.61 0.00 0.00 39.78 41.10 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 -1.51 3.14 -4.34 6.41 5.03 -1.26 -4.79 115.26 117.95 1nf5 n ASN 310 Ca 0.00 -2.33 -0.40 0.00 0.87 0.00 0.00 54.58 52.72 1nf5 n ASN 310 Cb 0.22 -0.49 -0.11 0.00 -1.02 0.00 0.00 39.78 38.38 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 -1.79 3.26 -0.10 3.10 1.51 -1.26 -5.06 117.35 117.01 1nf5 s TYR 311 Ca 0.30 -1.16 -0.01 0.00 -1.01 0.00 0.00 57.07 55.19 1nf5 s TYR 311 Cb 0.20 -2.53 -0.03 0.00 -0.11 0.00 0.00 41.96 39.49 1nf5 s TYR 311 CO 0.13 -0.71 -0.05 -1.58 -1.11 0.00 0.00 175.55 172.23 1nf5 s TRP 312 N 1.50 2.99 0.00 2.71 0.52 -1.26 -4.58 118.94 120.82 1nf5 s TRP 312 Ca 0.01 -0.09 0.00 0.00 0.02 0.00 0.00 56.10 56.04 1nf5 s TRP 312 Cb -0.20 -1.81 0.00 0.00 -1.15 0.00 0.00 33.47 30.31 1nf5 s TRP 312 CO 0.05 0.20 0.00 0.41 0.02 0.00 0.00 176.95 177.63 1nf5 n GLY 313 N 2.71 -0.67 3.77 0.98 0.00 0.40 -4.56 105.19 107.81 1nf5 n GLY 313 Ca -0.18 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.74 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 -1.72 3.04 0.00 1.61 -0.00 -0.85 -4.68 118.94 116.34 1nf5 s TRP 314 Ca 0.00 1.51 0.00 0.00 -0.00 0.00 0.00 56.10 57.61 1nf5 s TRP 314 Cb 0.00 -3.49 0.00 0.00 -0.00 0.00 0.00 33.47 29.98 1nf5 s TRP 314 CO 0.00 -1.53 0.00 0.41 -0.00 0.00 0.00 176.95 175.83 1nf5 n GLY 315 N 0.71 -0.66 3.15 5.86 0.00 -1.26 -0.96 105.19 112.03 1nf5 n GLY 315 Ca 0.03 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.62 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 0.15 2.57 0.28 -0.02 0.00 -1.26 -4.81 105.19 102.11 1nf5 n GLY 316 Ca 0.00 -0.01 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 0.00 0.49 0.00 1.61 9.09 -1.93 0.71 114.58 124.54 1nf5 h GLU 317 Ca 0.00 -0.07 -0.11 0.00 0.05 0.00 0.00 59.36 59.24 1nf5 h GLU 317 Cb 0.00 -0.09 -0.02 0.00 -1.65 0.00 0.00 28.75 26.99 1nf5 h GLU 317 CO 0.00 0.43 -0.50 0.38 0.05 0.00 0.00 179.01 179.37 1nf5 h ASP 318 N 0.48 0.00 0.35 3.06 2.03 -1.91 -1.74 116.42 118.69 1nf5 h ASP 318 Ca 0.12 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.22 1nf5 h ASP 318 Cb 0.15 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.65 1nf5 h ASP 318 CO -0.01 0.50 -0.81 0.44 -1.03 0.00 0.00 179.24 178.34 1nf5 h ASP 319 N 0.00 0.44 -0.05 4.15 3.32 -1.39 -1.27 116.42 121.62 1nf5 h ASP 319 Ca -0.01 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 1nf5 h ASP 319 Cb 1.07 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.48 1nf5 h ASP 319 CO 0.07 1.08 0.03 -0.78 -1.72 0.00 0.00 179.24 177.92 1nf5 h ASP 320 N 0.23 0.06 -0.31 6.45 3.58 -0.73 0.66 116.42 126.36 1nf5 h ASP 320 Ca -0.05 -0.05 0.04 0.00 0.42 0.00 0.00 57.03 57.39 1nf5 h ASP 320 Cb 1.41 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 42.41 1nf5 h ASP 320 CO 0.14 0.09 0.10 0.40 -2.88 0.00 0.00 179.24 177.09 1nf5 h ILE 321 N 0.03 0.90 -0.66 2.25 2.04 -1.21 0.21 117.51 121.07 1nf5 h ILE 321 Ca 0.02 -0.08 0.10 0.00 1.00 0.00 0.00 64.86 65.90 1nf5 h ILE 321 Cb 0.04 0.65 -0.07 0.00 -0.74 0.00 0.00 36.82 36.70 1nf5 h ILE 321 CO -0.00 0.04 0.28 0.22 0.00 0.00 0.00 178.15 178.69 1nf5 h TYR 322 N 0.23 0.49 -0.32 1.37 3.20 -0.98 -0.93 116.97 120.03 1nf5 h TYR 322 Ca 0.14 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.06 1nf5 h TYR 322 Cb 0.12 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 1nf5 h TYR 322 CO -0.14 0.14 0.15 -0.91 -1.64 0.00 0.00 178.16 175.76 1nf5 h ASN 323 N 0.48 0.22 -0.57 -2.11 2.35 0.92 -2.03 115.58 114.84 1nf5 h ASN 323 Ca 0.33 0.02 0.04 0.00 -0.55 0.00 0.00 56.30 56.14 1nf5 h ASN 323 Cb 0.40 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 1nf5 h ASN 323 CO -0.30 0.17 0.32 0.03 -1.65 0.00 0.00 177.43 175.99 1nf5 h ARG 324 N 0.32 0.59 -0.08 0.81 3.08 0.28 -1.06 114.38 118.32 1nf5 h ARG 324 Ca 0.13 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1nf5 h ARG 324 Cb 0.05 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 1nf5 h ARG 324 CO -0.10 0.39 0.05 -0.07 -1.07 0.00 0.00 179.97 179.18 1nf5 h LEU 325 N 0.61 0.09 -1.10 3.04 3.38 -0.97 -1.82 115.31 118.54 1nf5 h LEU 325 Ca 0.25 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.24 1nf5 h LEU 325 Cb 0.11 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1nf5 h LEU 325 CO -0.14 0.07 0.61 0.00 0.09 0.00 0.00 178.44 179.06 1nf5 h ALA 326 N 1.03 1.39 0.00 1.53 0.00 -1.08 -0.63 119.26 121.50 1nf5 h ALA 326 Ca 0.03 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1nf5 h ALA 326 Cb -0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1nf5 h ALA 326 CO -0.01 0.54 -0.32 0.74 0.00 0.00 0.00 179.25 180.20 1nf5 h PHE 327 N 1.19 0.00 -0.28 0.00 0.05 -0.83 -1.87 116.94 115.21 1nf5 h PHE 327 Ca 0.36 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.15 1nf5 h PHE 327 Cb -0.04 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.91 1nf5 h PHE 327 CO -0.00 0.32 0.00 0.54 -0.18 0.00 0.00 178.31 178.99 1nf5 n ARG 328 N -4.09 2.60 -1.65 1.51 5.12 -0.61 -4.89 116.66 114.65 1nf5 n ARG 328 Ca -0.02 -1.41 -0.11 0.00 -1.93 0.00 0.00 57.85 54.38 1nf5 n ARG 328 Cb 0.37 -1.73 -0.03 0.00 -1.16 0.00 0.00 32.46 29.90 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 0.45 0.75 3.88 -0.13 0.00 -0.70 -5.03 105.19 104.41 1nf5 n GLY 329 Ca 0.13 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.53 3.19 0.38 1.61 -1.94 -0.34 -5.00 119.30 113.66 1nf5 s MET 330 Ca 0.00 -0.77 0.08 0.00 -1.71 0.00 0.00 55.69 53.29 1nf5 s MET 330 Cb 0.00 -2.80 -0.05 0.00 2.01 0.00 0.00 34.83 33.99 1nf5 s MET 330 CO 0.00 0.48 0.15 -1.54 -0.01 0.00 0.00 175.02 174.10 1nf5 s SER 331 N -3.34 4.46 -0.23 3.03 1.04 -1.26 -4.03 113.70 113.36 1nf5 s SER 331 Ca 0.33 -0.98 -0.10 0.00 0.48 0.00 0.00 55.95 55.68 1nf5 s SER 331 Cb -0.10 -0.55 -0.05 0.00 0.10 0.00 0.00 66.02 65.42 1nf5 s SER 331 CO 0.26 -0.44 0.14 -0.69 0.98 0.00 0.00 173.24 173.49 1nf5 s VAL 332 N -2.54 5.21 0.03 5.02 1.01 -1.26 -3.73 120.40 124.14 1nf5 s VAL 332 Ca 0.39 0.13 -0.14 0.00 0.00 0.00 0.00 61.98 62.36 1nf5 s VAL 332 Cb 0.02 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.91 1nf5 s VAL 332 CO 0.22 0.36 0.43 -0.55 0.00 0.00 0.00 175.10 175.56 1nf5 s SER 333 N 1.00 6.80 0.00 3.32 0.15 0.10 -4.94 113.70 120.14 1nf5 s SER 333 Ca 0.07 0.96 -0.13 0.00 0.70 0.00 0.00 55.95 57.54 1nf5 s SER 333 Cb -0.13 -2.25 0.02 0.00 -1.71 0.00 0.00 66.02 61.95 1nf5 s SER 333 CO 0.04 0.28 0.28 -0.13 1.20 0.00 0.00 173.24 174.90 1nf5 s ARG 334 N -1.31 0.68 0.66 5.44 0.52 -1.26 -0.88 118.95 122.79 1nf5 s ARG 334 Ca 0.27 -0.31 -0.07 0.00 -0.52 0.00 0.00 55.73 55.10 1nf5 s ARG 334 Cb -0.16 0.30 0.04 0.00 0.52 0.00 0.00 34.95 35.64 1nf5 s ARG 334 CO 0.15 -0.19 0.97 -1.25 0.02 0.00 0.00 175.30 175.00 1nf5 s PRO 335 N -1.69 2.54 0.94 3.54 0.04 -1.26 -5.04 135.00 134.07 1nf5 s PRO 335 Ca -0.11 -0.10 -0.12 0.00 0.04 0.00 0.00 61.00 60.71 1nf5 s PRO 335 Cb -0.04 -2.20 0.16 0.00 0.04 0.00 0.00 34.50 32.45 1nf5 s PRO 335 CO 0.02 -1.01 1.09 0.54 0.04 0.00 0.00 177.00 177.69 1nf5 s ASN 336 N -4.42 3.10 0.64 6.66 6.03 -1.26 -4.68 114.94 121.01 1nf5 s ASN 336 Ca 0.57 1.33 0.43 0.00 -1.03 0.00 0.00 52.86 54.16 1nf5 s ASN 336 Cb -0.11 -2.00 2.33 0.00 -3.03 0.00 0.00 41.25 38.44 1nf5 s ASN 336 CO 0.45 -2.85 2.31 0.00 -2.03 0.00 0.00 177.10 174.99 1nf5 h ALA 337 N -1.70 1.00 0.00 3.54 0.00 -1.94 0.49 119.26 120.64 1nf5 h ALA 337 Ca -0.52 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.33 1nf5 h ALA 337 Cb 1.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1nf5 h ALA 337 CO 0.56 0.00 -0.36 0.28 0.00 0.00 0.00 179.25 179.73 1nf5 h VAL 338 N 0.00 1.54 0.00 0.00 2.07 -1.94 -3.28 116.25 114.63 1nf5 h VAL 338 Ca 0.00 -2.30 -0.10 0.00 0.82 0.00 0.00 66.70 65.13 1nf5 h VAL 338 Cb 0.01 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 1nf5 h VAL 338 CO 0.00 0.52 -0.46 0.40 0.02 0.00 0.00 177.57 178.05 1nf5 h ILE 339 N -1.00 1.15 -0.33 4.57 2.04 -1.87 -3.17 117.51 118.90 1nf5 h ILE 339 Ca -0.10 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.08 1nf5 h ILE 339 Cb 1.08 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 39.12 1nf5 h ILE 339 CO -0.06 0.45 0.00 0.61 0.00 0.00 0.00 178.15 179.15 1nf5 n GLY 340 N 0.09 1.72 3.76 5.37 0.00 0.14 -4.33 105.19 111.95 1nf5 n GLY 340 Ca -0.01 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.75 4.39 0.06 1.61 1.02 -1.20 -2.46 119.74 121.41 1nf5 s LYS 341 Ca 0.27 2.15 0.02 0.00 0.02 0.00 0.00 55.97 58.43 1nf5 s LYS 341 Cb 0.18 -3.10 -0.03 0.00 -0.52 0.00 0.00 37.83 34.37 1nf5 s LYS 341 CO 0.12 -0.15 -0.07 0.00 -0.92 0.00 0.00 175.35 174.33 1nf5 s ARG 343 N -2.43 2.81 -0.12 0.00 3.52 0.01 -2.41 118.95 120.33 1nf5 s ARG 343 Ca -0.02 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.90 1nf5 s ARG 343 Cb -0.04 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.79 1nf5 s ARG 343 CO -0.02 0.54 0.05 1.41 -0.81 0.00 0.00 175.30 176.47 1nf5 s MET 344 N -0.48 3.38 -0.27 5.12 -2.45 -1.26 -1.04 119.30 122.30 1nf5 s MET 344 Ca 0.07 -0.33 -0.27 0.00 -1.25 0.00 0.00 55.69 53.91 1nf5 s MET 344 Cb -0.12 -3.00 0.01 0.00 1.25 0.00 0.00 34.83 32.97 1nf5 s MET 344 CO 0.02 0.59 0.94 0.42 1.05 0.00 0.00 175.02 178.03 1nf5 s ILE 345 N -0.53 4.70 0.86 10.11 1.01 0.04 -5.00 121.20 132.40 1nf5 s ILE 345 Ca 0.10 1.66 -0.10 0.00 0.00 0.00 0.00 60.65 62.31 1nf5 s ILE 345 Cb -0.12 -4.25 0.11 0.00 0.01 0.00 0.00 42.46 38.21 1nf5 s ILE 345 CO 0.02 -0.24 1.12 -0.13 0.00 0.00 0.00 174.94 175.71 1nf5 s ARG 346 N 3.17 1.49 0.04 2.79 1.81 -1.26 -4.91 118.95 122.07 1nf5 s ARG 346 Ca 0.39 1.35 -0.28 0.00 -1.72 0.00 0.00 55.73 55.48 1nf5 s ARG 346 Cb -0.14 -1.80 0.09 0.00 -0.45 0.00 0.00 34.95 32.66 1nf5 s ARG 346 CO 0.10 -2.24 0.88 -3.38 -0.68 0.00 0.00 175.30 169.98 1nf5 s HIS 347 N -2.76 -0.32 0.30 -0.53 -3.43 -1.26 -5.13 115.29 102.16 1nf5 s HIS 347 Ca 0.64 0.15 -0.02 0.00 -0.80 0.00 0.00 55.06 55.03 1nf5 s HIS 347 Cb -0.20 0.56 -0.04 0.00 -1.43 0.00 0.00 32.58 31.46 1nf5 s HIS 347 CO 0.57 -0.62 0.53 -1.12 -2.00 0.00 0.00 174.74 172.10 1nf5 s SER 348 N -2.58 6.38 0.12 7.38 0.01 -1.26 -5.01 113.70 118.73 1nf5 s SER 348 Ca 0.06 0.56 -0.31 0.00 1.31 0.00 0.00 55.95 57.57 1nf5 s SER 348 Cb -0.01 -2.08 -0.17 0.00 0.21 0.00 0.00 66.02 63.97 1nf5 s SER 348 CO -0.07 -0.21 0.69 -1.14 0.41 0.00 0.00 173.24 172.92 1nf5 n ARG 349 N -1.21 0.00 -3.47 12.44 3.00 -1.26 -4.89 116.66 121.26 1nf5 n ARG 349 Ca -0.03 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.39 1nf5 n ARG 349 Cb 0.55 -1.13 -0.10 0.00 0.00 0.00 0.00 32.46 31.78 1nf5 n ARG 349 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1nf5 s ASP 350 N -0.59 6.07 0.58 6.15 2.15 -1.26 -4.95 116.67 124.82 1nf5 s ASP 350 Ca 0.70 -0.96 0.28 0.00 0.43 0.00 0.00 52.55 53.01 1nf5 s ASP 350 Cb -1.00 -2.15 1.63 0.00 -0.30 0.00 0.00 42.92 41.10 1nf5 s ASP 350 CO 0.54 -0.46 2.09 0.11 -0.17 0.00 0.00 175.17 177.27 1nf5 h LYS 351 N 8.62 0.00 -0.05 4.34 1.79 -2.02 0.11 116.57 129.36 1nf5 h LYS 351 Ca -0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 1nf5 h LYS 351 Cb 1.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.77 1nf5 h LYS 351 CO 0.74 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 180.74 1nf5 n LYS 352 N -3.84 1.38 -3.11 3.15 5.02 -1.26 -4.13 118.16 115.37 1nf5 n LYS 352 Ca 0.02 -0.57 -0.17 0.00 -2.02 0.00 0.00 58.31 55.57 1nf5 n LYS 352 Cb 0.34 -1.41 -0.01 0.00 -0.02 0.00 0.00 35.03 33.93 1nf5 n LYS 352 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1nf5 n ASN 353 N -0.26 0.15 -4.79 4.39 5.15 0.39 -0.25 115.26 120.03 1nf5 n ASN 353 Ca 0.18 -3.09 -0.36 0.00 -0.60 0.00 0.00 54.58 50.71 1nf5 n ASN 353 Cb 0.23 -0.15 -0.06 0.00 -0.53 0.00 0.00 39.78 39.27 1nf5 n ASN 353 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1nf5 s GLU 354 N -1.78 4.33 0.05 1.20 2.56 -1.23 -3.79 118.70 120.04 1nf5 s GLU 354 Ca 0.36 1.32 -0.38 0.00 0.00 0.00 0.00 54.97 56.27 1nf5 s GLU 354 Cb 0.32 -2.52 -0.18 0.00 2.00 0.00 0.00 34.13 33.74 1nf5 s GLU 354 CO -0.08 0.04 1.17 -2.30 -0.56 0.00 0.00 175.26 173.53 1nf5 n PRO 355 N -0.02 0.50 -2.66 4.30 -0.02 -1.26 -2.00 135.00 133.83 1nf5 n PRO 355 Ca 0.05 0.18 -0.43 0.00 -2.02 0.00 0.00 63.50 61.28 1nf5 n PRO 355 Cb 0.51 -1.73 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 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 0.17 6.81 0.47 2.55 2.47 -0.13 -4.78 114.94 122.49 1nf5 s ASN 356 Ca 0.87 0.82 0.14 0.00 0.42 0.00 0.00 52.86 55.10 1nf5 s ASN 356 Cb -1.12 -2.53 1.11 0.00 -1.45 0.00 0.00 41.25 37.26 1nf5 s ASN 356 CO 0.53 -0.97 2.07 -0.65 -3.72 0.00 0.00 177.10 174.36 1nf5 h PRO 357 N 8.44 0.25 -0.09 0.43 0.11 -1.90 -2.02 132.00 137.23 1nf5 h PRO 357 Ca -0.22 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1nf5 h PRO 357 Cb 1.06 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1nf5 h PRO 357 CO 1.05 0.16 0.00 1.04 -0.21 0.00 0.00 178.00 180.04 1nf5 n GLN 358 N -4.49 1.75 -0.27 1.05 6.02 -1.26 -4.43 117.38 115.75 1nf5 n GLN 358 Ca 0.03 -1.10 0.01 0.00 -0.01 0.00 0.00 57.00 55.93 1nf5 n GLN 358 Cb 0.19 -1.45 0.14 0.00 1.02 0.00 0.00 30.24 30.14 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 2.46 0.71 -0.66 -1.09 0.11 -1.69 -1.42 114.38 112.80 1nf5 h ARG 359 Ca 0.00 -0.04 -0.08 0.00 0.10 0.00 0.00 59.98 59.96 1nf5 h ARG 359 Cb 0.53 -0.16 -0.03 0.00 1.11 0.00 0.00 29.97 31.42 1nf5 h ARG 359 CO 0.00 0.47 0.11 0.74 0.10 0.00 0.00 179.97 181.38 1nf5 h PHE 360 N 0.73 1.16 -0.63 4.08 0.05 -1.82 -0.55 116.94 119.96 1nf5 h PHE 360 Ca 0.36 -0.16 -0.08 0.00 3.82 0.00 0.00 57.97 61.91 1nf5 h PHE 360 Cb 0.31 -0.32 -0.02 0.00 2.00 0.00 0.00 35.95 37.92 1nf5 h PHE 360 CO -0.08 0.97 0.10 0.22 -0.18 0.00 0.00 178.31 179.35 1nf5 h ASP 361 N 1.01 1.01 -0.25 2.17 3.58 -1.75 -1.99 116.42 120.19 1nf5 h ASP 361 Ca 0.20 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1nf5 h ASP 361 Cb 0.44 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.21 1nf5 h ASP 361 CO 0.01 1.01 0.16 0.03 -2.88 0.00 0.00 179.24 177.57 1nf5 h ARG 362 N 0.96 0.33 -0.74 0.28 3.08 -0.82 -2.39 114.38 115.08 1nf5 h ARG 362 Ca 0.19 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.24 1nf5 h ARG 362 Cb 0.44 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1nf5 h ARG 362 CO 0.01 0.24 0.49 0.82 -1.07 0.00 0.00 179.97 180.46 1nf5 h ILE 363 N 0.33 1.15 0.00 2.04 2.04 -0.99 -1.44 117.51 120.64 1nf5 h ILE 363 Ca 0.09 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1nf5 h ILE 363 Cb -0.01 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.18 1nf5 h ILE 363 CO -0.02 0.17 0.00 0.00 0.00 0.00 0.00 178.15 178.30 1nf5 h ALA 364 N 1.55 1.00 -0.20 1.87 0.00 -0.86 -3.16 119.26 119.47 1nf5 h ALA 364 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1nf5 h ALA 364 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1nf5 h ALA 364 CO -0.07 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.90 1nf5 n HIS 365 N -2.77 0.41 -0.29 0.00 8.25 -0.56 -4.77 115.22 115.49 1nf5 n HIS 365 Ca 0.01 -0.66 0.10 0.00 -0.26 0.00 0.00 57.72 56.90 1nf5 n HIS 365 Cb 0.25 -0.12 0.23 0.00 1.12 0.00 0.00 29.99 31.47 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 1.21 0.30 -1.03 1.59 2.02 -1.48 -1.00 112.91 114.52 1nf5 h THR 366 Ca 0.00 -0.05 0.28 0.00 0.77 0.00 0.00 66.41 67.41 1nf5 h THR 366 Cb 0.89 0.14 -0.13 0.00 -1.74 0.00 0.00 68.15 67.31 1nf5 h THR 366 CO 0.06 0.03 0.61 0.50 0.37 0.00 0.00 175.52 177.09 1nf5 h LYS 367 N 0.15 0.45 0.12 6.66 1.63 -1.88 -0.34 116.57 123.36 1nf5 h LYS 367 Ca 0.50 -0.03 -0.36 0.00 -0.85 0.00 0.00 60.65 59.91 1nf5 h LYS 367 Cb 0.96 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.47 1nf5 h LYS 367 CO -0.68 0.30 -1.94 1.05 -3.45 0.00 0.00 179.45 174.72 1nf5 h GLU 368 N 0.46 0.26 0.00 1.90 4.11 -1.58 -3.39 114.58 116.35 1nf5 h GLU 368 Ca 0.67 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 59.65 1nf5 h GLU 368 Cb 1.45 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.87 1nf5 h GLU 368 CO -0.47 1.21 0.00 1.79 0.07 0.00 0.00 179.01 181.61 1nf5 h THR 369 N 0.02 0.00 0.00 -1.06 1.35 -1.04 -3.28 112.91 108.91 1nf5 h THR 369 Ca -0.42 -0.42 -0.04 0.00 -0.55 0.00 0.00 66.41 64.98 1nf5 h THR 369 Cb 2.00 1.32 -0.01 0.00 -1.73 0.00 0.00 68.15 69.74 1nf5 h THR 369 CO 0.08 0.00 -0.21 0.00 -0.25 0.00 0.00 175.52 175.14 1nf5 h MET 370 N 0.00 0.00 0.00 4.72 -0.00 -1.27 -0.41 114.93 117.97 1nf5 h MET 370 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.66 1nf5 h MET 370 Cb 0.60 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.20 1nf5 h MET 370 CO 0.00 0.21 -0.20 -0.07 -0.00 0.00 0.00 176.91 176.85 1nf5 h LEU 371 N 0.00 0.00 0.00 -0.10 3.38 -1.82 -3.35 115.31 113.42 1nf5 h LEU 371 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1nf5 h LEU 371 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1nf5 h LEU 371 CO 0.03 0.20 -0.60 -1.54 0.09 0.00 0.00 178.44 176.62 1nf5 n SER 372 N -3.18 0.77 -3.91 -0.43 3.41 -0.95 -4.90 113.62 104.43 1nf5 n SER 372 Ca 0.03 -0.63 -0.30 0.00 -0.26 0.00 0.00 58.87 57.70 1nf5 n SER 372 Cb 0.57 1.06 -0.15 0.00 -0.26 0.00 0.00 64.21 65.43 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 -2.09 3.96 0.00 4.04 2.15 -0.20 -4.66 116.67 119.87 1nf5 s ASP 373 Ca 0.03 -1.35 0.00 0.00 0.43 0.00 0.00 52.55 51.65 1nf5 s ASP 373 Cb 0.07 -1.17 0.00 0.00 -0.30 0.00 0.00 42.92 41.52 1nf5 s ASP 373 CO 0.40 -0.28 0.00 0.61 -0.17 0.00 0.00 175.17 175.73 1nf5 n GLY 374 N 4.66 -0.71 0.17 2.66 0.00 -1.26 -4.38 105.19 106.33 1nf5 n GLY 374 Ca -0.08 -0.36 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 1nf5 n GLY 374 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1nf5 h LEU 375 N 0.00 -0.36 -0.95 0.99 6.46 -1.21 -0.80 115.31 119.44 1nf5 h LEU 375 Ca 0.00 0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.88 1nf5 h LEU 375 Cb 0.00 0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 1nf5 h LEU 375 CO 0.00 -0.13 0.00 -0.46 -0.62 0.00 0.00 178.44 177.23 1nf5 n ASN 376 N -5.30 0.38 -0.09 1.25 6.94 -1.26 -2.25 115.26 114.94 1nf5 n ASN 376 Ca 0.03 0.68 0.04 0.00 -0.02 0.00 0.00 54.58 55.31 1nf5 n ASN 376 Cb 0.23 -0.73 0.06 0.00 -2.36 0.00 0.00 39.78 36.98 1nf5 n ASN 376 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1nf5 n SER 377 N -2.01 1.75 -4.70 0.53 3.41 -0.37 -5.05 113.62 107.18 1nf5 n SER 377 Ca -0.01 -2.39 -0.42 0.00 -0.26 0.00 0.00 58.87 55.79 1nf5 n SER 377 Cb 0.03 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.74 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 -1.62 4.34 0.01 1.04 2.96 -0.84 -4.83 118.68 119.75 1nf5 s LEU 378 Ca 0.14 1.90 0.00 0.00 -0.22 0.00 0.00 54.13 55.95 1nf5 s LEU 378 Cb 0.12 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.23 1nf5 s LEU 378 CO 0.01 -0.48 -0.02 0.42 -1.32 0.00 0.00 176.35 174.96 1nf5 s THR 379 N 1.45 0.08 0.03 3.68 -4.23 -1.26 -5.08 115.64 110.31 1nf5 s THR 379 Ca 0.57 -0.57 -0.29 0.00 -1.18 0.00 0.00 61.69 60.22 1nf5 s THR 379 Cb -0.27 -0.17 0.10 0.00 1.34 0.00 0.00 72.50 73.50 1nf5 s THR 379 CO 0.26 -0.31 1.10 -0.72 -0.54 0.00 0.00 174.62 174.41 1nf5 s TYR 380 N -0.91 -0.13 -0.10 3.99 -0.85 -1.26 -4.85 117.35 113.24 1nf5 s TYR 380 Ca -0.10 -0.05 0.02 0.00 -0.52 0.00 0.00 57.07 56.42 1nf5 s TYR 380 Cb -0.06 0.58 0.01 0.00 0.38 0.00 0.00 41.96 42.87 1nf5 s TYR 380 CO -0.01 -0.52 -0.16 -1.64 -1.52 0.00 0.00 175.55 171.71 1nf5 s MET 381 N -2.85 2.25 -0.15 -3.49 -1.94 0.16 -4.96 119.30 108.32 1nf5 s MET 381 Ca 0.12 -0.58 -0.29 0.00 -1.71 0.00 0.00 55.69 53.22 1nf5 s MET 381 Cb 0.01 -1.87 -0.01 0.00 2.01 0.00 0.00 34.83 34.97 1nf5 s MET 381 CO -0.02 -0.02 1.09 0.08 -0.01 0.00 0.00 175.02 176.14 1nf5 s VAL 382 N 0.85 4.59 -0.12 -6.03 1.01 -1.26 -0.07 120.40 119.37 1nf5 s VAL 382 Ca -0.10 1.90 0.21 0.00 0.00 0.00 0.00 61.98 64.00 1nf5 s VAL 382 Cb -0.15 -4.22 -0.20 0.00 0.00 0.00 0.00 36.38 31.80 1nf5 s VAL 382 CO 0.01 -0.09 0.68 0.18 0.00 0.00 0.00 175.10 175.88 1nf5 n LEU 383 N 5.76 0.37 -3.64 3.92 4.77 0.97 -4.95 117.00 124.19 1nf5 n LEU 383 Ca 0.11 0.14 -0.05 0.00 -0.03 0.00 0.00 56.01 56.18 1nf5 n LEU 383 Cb 0.47 0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1nf5 n LEU 383 CO 0.53 -0.02 0.99 -0.70 -1.33 0.00 0.00 177.39 176.86 1nf5 s GLU 384 N -3.35 0.25 -0.20 3.23 2.12 -1.12 -4.96 118.70 114.66 1nf5 s GLU 384 Ca -0.05 0.23 -0.01 0.00 0.36 0.00 0.00 54.97 55.51 1nf5 s GLU 384 Cb 0.12 0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.64 1nf5 s GLU 384 CO 0.86 -0.04 -0.14 0.08 -0.54 0.00 0.00 175.26 175.48 1nf5 s VAL 385 N -0.16 2.53 -0.16 3.70 1.01 -1.26 -0.15 120.40 125.90 1nf5 s VAL 385 Ca 0.05 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 1nf5 s VAL 385 Cb -0.04 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 1nf5 s VAL 385 CO -0.10 0.45 -0.10 -1.10 0.00 0.00 0.00 175.10 174.24 1nf5 s GLN 386 N 1.34 3.37 -0.40 2.72 -0.21 0.17 -4.98 119.66 121.67 1nf5 s GLN 386 Ca 0.04 -0.67 -0.09 0.00 0.02 0.00 0.00 55.36 54.66 1nf5 s GLN 386 Cb -0.14 -2.76 0.07 0.00 1.00 0.00 0.00 33.01 31.18 1nf5 s GLN 386 CO -0.09 0.06 0.24 1.03 -2.12 0.00 0.00 175.29 174.41 1nf5 s ARG 387 N 0.76 2.64 0.42 2.91 1.81 -1.26 -0.41 118.95 125.82 1nf5 s ARG 387 Ca -0.04 -1.37 0.06 0.00 -1.72 0.00 0.00 55.73 52.66 1nf5 s ARG 387 Cb -0.15 -3.74 0.01 0.00 -0.45 0.00 0.00 34.95 30.61 1nf5 s ARG 387 CO 0.01 -0.88 0.59 0.71 -0.68 0.00 0.00 175.30 175.05 1nf5 s TYR 388 N 1.45 2.93 0.36 -0.53 1.51 -0.07 -4.67 117.35 118.33 1nf5 s TYR 388 Ca 0.02 -0.23 0.20 0.00 -1.01 0.00 0.00 57.07 56.05 1nf5 s TYR 388 Cb -0.22 -2.34 1.04 0.00 -0.11 0.00 0.00 41.96 40.34 1nf5 s TYR 388 CO 0.03 -0.39 1.93 -1.00 -1.11 0.00 0.00 175.55 175.01 1nf5 h PRO 389 N 0.59 0.00 -0.01 -1.71 0.13 -1.93 0.86 132.00 129.92 1nf5 h PRO 389 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1nf5 h PRO 389 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1nf5 h PRO 389 CO 0.49 0.24 -0.49 1.28 -0.23 0.00 0.00 178.00 179.30 1nf5 n LEU 390 N -3.84 1.99 -3.60 1.56 4.77 -1.26 -2.77 117.00 113.85 1nf5 n LEU 390 Ca -0.02 -0.75 -0.00 0.00 -0.03 0.00 0.00 56.01 55.21 1nf5 n LEU 390 Cb 0.33 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1nf5 n LEU 390 CO 0.35 0.37 1.10 -0.72 -1.33 0.00 0.00 177.39 177.16 1nf5 s TYR 391 N -2.46 -0.05 -0.21 -1.77 -0.85 -1.20 -4.17 117.35 106.64 1nf5 s TYR 391 Ca 0.18 -0.00 -0.05 0.00 -0.52 0.00 0.00 57.07 56.67 1nf5 s TYR 391 Cb 0.18 0.52 -0.02 0.00 0.38 0.00 0.00 41.96 43.02 1nf5 s TYR 391 CO 0.57 -0.16 0.01 0.99 -1.52 0.00 0.00 175.55 175.45 1nf5 s THR 392 N -2.27 3.99 -0.22 -3.49 2.01 -0.35 -0.89 115.64 114.42 1nf5 s THR 392 Ca 0.13 -0.30 -0.05 0.00 0.31 0.00 0.00 61.69 61.79 1nf5 s THR 392 Cb 0.03 -2.81 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 1nf5 s THR 392 CO -0.04 0.41 -0.02 -0.75 -0.69 0.00 0.00 174.62 173.53 1nf5 s LYS 393 N 1.12 3.45 -0.29 4.92 2.20 0.45 -0.12 119.74 131.47 1nf5 s LYS 393 Ca 0.03 -0.59 -0.05 0.00 -0.36 0.00 0.00 55.97 55.00 1nf5 s LYS 393 Cb -0.14 -3.08 0.02 0.00 -1.51 0.00 0.00 37.83 33.12 1nf5 s LYS 393 CO 0.02 -0.17 0.04 0.42 -0.36 0.00 0.00 175.35 175.29 1nf5 s ILE 394 N 1.46 3.54 -0.11 5.43 1.01 0.08 0.43 121.20 133.03 1nf5 s ILE 394 Ca 0.05 -0.93 -0.18 0.00 0.00 0.00 0.00 60.65 59.60 1nf5 s ILE 394 Cb -0.14 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1nf5 s ILE 394 CO -0.01 0.05 0.46 -0.89 0.00 0.00 0.00 174.94 174.55 1nf5 s THR 395 N 1.41 5.18 0.10 2.92 2.01 0.78 -1.41 115.64 126.63 1nf5 s THR 395 Ca 0.00 0.92 0.04 0.00 0.31 0.00 0.00 61.69 62.96 1nf5 s THR 395 Cb -0.18 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 1nf5 s THR 395 CO 0.00 0.35 -0.10 0.68 -0.69 0.00 0.00 174.62 174.87 1nf5 s VAL 396 N 0.46 0.93 -0.41 3.82 -7.23 -0.21 -0.02 120.40 117.73 1nf5 s VAL 396 Ca 0.25 -1.67 -0.10 0.00 -1.81 0.00 0.00 61.98 58.65 1nf5 s VAL 396 Cb -0.15 -1.40 0.07 0.00 0.56 0.00 0.00 36.38 35.47 1nf5 s VAL 396 CO 0.10 -0.59 0.26 -0.62 -0.31 0.00 0.00 175.10 173.94 1nf5 s ASP 397 N -2.51 5.66 -0.14 4.85 -1.08 0.90 -1.02 116.67 123.32 1nf5 s ASP 397 Ca 0.06 -1.44 0.16 0.00 -0.52 0.00 0.00 52.55 50.81 1nf5 s ASP 397 Cb -0.02 -2.00 0.71 0.00 -1.46 0.00 0.00 42.92 40.16 1nf5 s ASP 397 CO -0.00 -0.52 1.61 2.30 0.52 0.00 0.00 175.17 179.07 1nf5 n ILE 398 N 4.93 1.96 -4.09 4.11 -5.35 -1.26 -0.66 119.36 119.00 1nf5 n ILE 398 Ca -0.10 -1.17 0.00 0.00 -0.27 0.00 0.00 62.75 61.21 1nf5 n ILE 398 Cb 0.43 -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 0.97 -0.82 3.18 3.28 0.00 -1.26 -4.95 105.19 105.60 1nf5 n GLY 399 Ca 0.25 -1.18 -0.11 0.00 0.00 0.00 0.00 46.02 44.98 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 0.00 0.06 0.44 2.61 -4.23 -1.26 -4.91 115.64 108.35 1nf5 s THR 400 Ca 0.00 -1.96 -0.26 0.00 -1.18 0.00 0.00 61.69 58.29 1nf5 s THR 400 Cb 0.00 -2.32 -0.09 0.00 1.34 0.00 0.00 72.50 71.43 1nf5 s THR 400 CO 0.00 -0.19 1.44 -2.84 -0.54 0.00 0.00 174.62 172.49 1nf5 s PRO 401 N -4.11 3.76 0.00 3.99 0.02 -1.26 -5.18 135.00 132.23 1nf5 s PRO 401 Ca 0.33 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.80 1nf5 s PRO 401 Cb 0.07 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.88 1nf5 s PRO 401 CO 0.08 -0.77 0.00 -1.13 -0.33 0.00 0.00 177.00 174.85