#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f08 n GLN 2 N 0.00 1.92 -4.37 -1.24 7.27 -1.26 -3.38 117.38 116.32 2f08 n GLN 2 Ca 0.00 0.68 -0.25 0.00 0.07 0.00 0.00 57.00 57.51 2f08 n GLN 2 Cb 0.00 -2.38 -0.12 0.00 2.41 0.00 0.00 30.24 30.16 2f08 n GLN 2 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2f08 s VAL 3 N -1.20 2.05 -0.17 1.69 -7.23 -0.55 -1.17 120.40 113.82 2f08 s VAL 3 Ca 0.61 -1.90 -0.29 0.00 -1.81 0.00 0.00 61.98 58.58 2f08 s VAL 3 Cb -0.51 -1.93 -0.01 0.00 0.56 0.00 0.00 36.38 34.50 2f08 s VAL 3 CO 0.58 -0.17 1.13 -1.81 -0.31 0.00 0.00 175.10 174.52 2f08 s ASP 4 N -2.52 7.06 0.15 4.85 1.11 0.28 -4.67 116.67 122.93 2f08 s ASP 4 Ca 0.16 1.56 0.07 0.00 0.18 0.00 0.00 52.55 54.52 2f08 s ASP 4 Cb -0.07 -2.54 -0.04 0.00 1.07 0.00 0.00 42.92 41.33 2f08 s ASP 4 CO 0.08 -0.67 -0.15 0.68 1.18 0.00 0.00 175.17 176.29 2f08 s VAL 5 N 3.06 1.52 -0.19 -1.27 -7.23 -1.26 -4.57 120.40 110.45 2f08 s VAL 5 Ca 0.50 -1.92 -0.08 0.00 -1.81 0.00 0.00 61.98 58.66 2f08 s VAL 5 Cb -0.19 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 2f08 s VAL 5 CO 0.12 -0.48 0.09 -0.54 -0.31 0.00 0.00 175.10 173.98 2f08 s LYS 6 N -3.06 4.04 0.19 4.82 3.01 0.25 -4.89 119.74 124.09 2f08 s LYS 6 Ca 0.15 -0.31 -0.30 0.00 -1.01 0.00 0.00 55.97 54.50 2f08 s LYS 6 Cb -0.03 -3.30 -0.08 0.00 -1.01 0.00 0.00 37.83 33.42 2f08 s LYS 6 CO 0.04 0.26 1.00 0.34 0.51 0.00 0.00 175.35 177.50 2f08 s ASP 7 N 0.44 7.49 -0.15 2.83 -1.08 -1.26 -0.31 116.67 124.63 2f08 s ASP 7 Ca 0.05 1.96 0.15 0.00 -0.52 0.00 0.00 52.55 54.19 2f08 s ASP 7 Cb -0.12 -2.60 0.33 0.00 -1.46 0.00 0.00 42.92 39.06 2f08 s ASP 7 CO -0.00 -0.02 1.17 0.00 0.52 0.00 0.00 175.17 176.84 2f08 n ALA 9 N -1.18 0.00 -2.66 0.00 0.00 -1.25 -4.82 120.51 110.59 2f08 n ALA 9 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.50 2f08 n ALA 9 Cb 0.68 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.16 2f08 n ALA 9 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2f08 n ASN 10 N 0.00 1.72 -2.63 0.00 5.15 -1.26 -4.98 115.26 113.26 2f08 n ASN 10 Ca 0.00 -2.74 -0.18 0.00 -0.60 0.00 0.00 54.58 51.06 2f08 n ASN 10 Cb 0.00 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 38.73 2f08 n ASN 10 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2f08 n ASN 11 N -0.14 -5.02 0.15 1.20 3.02 -1.26 -4.87 115.26 108.33 2f08 n ASN 11 Ca 0.11 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.64 2f08 n ASN 11 Cb 0.81 -4.18 0.27 0.00 -0.61 0.00 0.00 39.78 36.07 2f08 n ASN 11 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2f08 h GLU 12 N -0.35 0.07 -6.28 3.52 3.07 -1.88 -3.43 114.58 109.30 2f08 h GLU 12 Ca -0.42 -0.04 -0.55 0.00 -0.50 0.00 0.00 59.36 57.85 2f08 h GLU 12 Cb 1.31 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.20 2f08 h GLU 12 CO 0.49 0.51 0.88 0.42 -1.40 0.00 0.00 179.01 179.91 2f08 s ILE 13 N -4.01 3.94 -0.13 3.13 -1.09 -1.26 -2.18 121.20 119.59 2f08 s ILE 13 Ca -0.03 1.24 -0.19 0.00 -2.23 0.00 0.00 60.65 59.43 2f08 s ILE 13 Cb 0.14 -3.80 -0.25 0.00 -1.58 0.00 0.00 42.46 36.97 2f08 s ILE 13 CO 0.75 -0.05 0.51 0.11 -1.23 0.00 0.00 174.94 175.03 2f08 h LYS 14 N 8.17 0.15 -2.59 2.79 1.79 -0.84 -3.49 116.57 122.54 2f08 h LYS 14 Ca -0.34 -0.25 0.03 0.00 -2.18 0.00 0.00 60.65 57.91 2f08 h LYS 14 Cb 1.15 0.09 -0.14 0.00 -1.58 0.00 0.00 32.23 31.76 2f08 h LYS 14 CO 0.93 1.12 0.34 -1.59 -1.08 0.00 0.00 179.45 179.16 2f08 s LYS 15 N -2.41 1.05 -0.03 3.15 -2.85 -1.15 -5.01 119.74 112.48 2f08 s LYS 15 Ca -0.22 -0.33 -0.02 0.00 -1.00 0.00 0.00 55.97 54.40 2f08 s LYS 15 Cb 0.04 0.49 0.02 0.00 -2.06 0.00 0.00 37.83 36.31 2f08 s LYS 15 CO 0.71 -0.45 0.08 0.54 0.10 0.00 0.00 175.35 176.33 2f08 s VAL 16 N -3.24 -0.03 0.03 1.79 0.11 -1.26 -1.25 120.40 116.56 2f08 s VAL 16 Ca 0.02 0.09 0.05 0.00 -2.93 0.00 0.00 61.98 59.21 2f08 s VAL 16 Cb -0.01 -0.13 -0.02 0.00 -1.53 0.00 0.00 36.38 34.69 2f08 s VAL 16 CO -0.09 0.04 -0.14 0.00 -3.33 0.00 0.00 175.10 171.58 2f08 s MET 17 N 0.54 0.95 0.00 1.54 0.23 -0.22 -1.48 119.30 120.86 2f08 s MET 17 Ca -0.04 -0.69 0.03 0.00 -1.03 0.00 0.00 55.69 53.96 2f08 s MET 17 Cb -0.06 -0.95 -0.01 0.00 -1.53 0.00 0.00 34.83 32.29 2f08 s MET 17 CO -0.02 0.24 -0.11 0.14 -2.03 0.00 0.00 175.02 173.24 2f08 s VAL 18 N -0.74 0.85 0.13 5.16 -7.23 -1.22 -0.06 120.40 117.29 2f08 s VAL 18 Ca 0.02 -0.56 -0.31 0.00 -1.81 0.00 0.00 61.98 59.32 2f08 s VAL 18 Cb -0.07 -0.73 -0.11 0.00 0.56 0.00 0.00 36.38 36.03 2f08 s VAL 18 CO 0.01 0.17 1.84 -0.67 -0.31 0.00 0.00 175.10 176.13 2f08 n ASP 19 N 2.62 4.06 0.00 4.85 2.03 -0.55 -2.27 116.55 127.29 2f08 n ASP 19 Ca -0.15 0.99 0.00 0.00 0.52 0.00 0.00 54.79 56.15 2f08 n ASP 19 Cb 0.56 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.41 2f08 n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2f08 n GLY 20 N 4.23 0.68 3.45 0.27 0.00 -1.26 -4.82 105.19 107.73 2f08 n GLY 20 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 2f08 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f08 s HIS 22 N -2.86 -0.87 0.00 0.00 2.46 -1.26 -4.52 115.29 108.23 2f08 s HIS 22 Ca 0.30 1.81 0.00 0.00 0.47 0.00 0.00 55.06 57.64 2f08 s HIS 22 Cb 0.02 0.46 0.00 0.00 -0.13 0.00 0.00 32.58 32.94 2f08 s HIS 22 CO 0.13 -0.44 0.00 0.41 -2.47 0.00 0.00 174.74 172.37 2f08 n GLY 23 N 4.04 2.59 1.11 1.59 0.00 -0.32 -1.41 105.19 112.80 2f08 n GLY 23 Ca -0.20 0.18 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2f08 n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2f08 n SER 24 N 2.60 3.95 -4.76 1.61 3.41 -1.26 -0.55 113.62 118.62 2f08 n SER 24 Ca 0.00 -2.42 -0.30 0.00 -0.26 0.00 0.00 58.87 55.88 2f08 n SER 24 Cb 0.00 -0.46 0.10 0.00 -0.26 0.00 0.00 64.21 63.60 2f08 n SER 24 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2f08 s ASP 25 N -1.19 4.23 0.25 4.04 1.01 -0.50 -4.92 116.67 119.59 2f08 s ASP 25 Ca 0.40 1.59 -0.31 0.00 0.71 0.00 0.00 52.55 54.94 2f08 s ASP 25 Cb 0.26 -2.31 -0.12 0.00 1.01 0.00 0.00 42.92 41.76 2f08 s ASP 25 CO 0.18 -2.18 1.65 -2.65 0.21 0.00 0.00 175.17 172.38 2f08 n PRO 26 N -3.59 2.69 -3.55 8.23 -0.02 -1.26 -4.73 135.00 132.76 2f08 n PRO 26 Ca 0.08 0.96 -0.41 0.00 -2.02 0.00 0.00 63.50 62.11 2f08 n PRO 26 Cb 0.54 -2.77 -0.09 0.00 -0.02 0.00 0.00 33.50 31.16 2f08 n PRO 26 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2f08 s ILE 28 N 1.45 4.84 -0.22 0.00 -1.09 -1.26 -1.93 121.20 122.99 2f08 s ILE 28 Ca 0.04 1.82 -0.09 0.00 -2.23 0.00 0.00 60.65 60.19 2f08 s ILE 28 Cb -0.24 -4.22 -0.05 0.00 -1.58 0.00 0.00 42.46 36.37 2f08 s ILE 28 CO 0.02 0.03 0.12 -0.63 -1.23 0.00 0.00 174.94 173.25 2f08 s ILE 29 N 1.99 5.11 -0.37 2.92 1.01 0.20 -4.95 121.20 127.11 2f08 s ILE 29 Ca 0.43 0.09 -0.13 0.00 0.00 0.00 0.00 60.65 61.04 2f08 s ILE 29 Cb -0.17 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 38.95 2f08 s ILE 29 CO 0.15 0.40 0.26 -1.00 0.00 0.00 0.00 174.94 174.75 2f08 s HIS 30 N 0.77 3.23 0.28 3.97 3.76 -1.26 -1.30 115.29 124.74 2f08 s HIS 30 Ca 0.06 -0.44 -0.27 0.00 -0.15 0.00 0.00 55.06 54.26 2f08 s HIS 30 Cb -0.13 -2.51 -0.15 0.00 1.11 0.00 0.00 32.58 30.90 2f08 s HIS 30 CO 0.02 -0.48 0.75 0.54 -0.85 0.00 0.00 174.74 174.72 2f08 n ARG 31 N 5.11 0.72 -0.59 1.40 1.74 -0.23 -0.02 116.66 124.79 2f08 n ARG 31 Ca -0.12 0.25 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2f08 n ARG 31 Cb 0.48 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 2f08 n ARG 31 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f08 n GLY 32 N 1.60 0.75 3.56 -0.13 0.00 0.20 -4.77 105.19 106.40 2f08 n GLY 32 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2f08 n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f08 s LYS 33 N -0.37 2.27 0.15 1.61 3.01 0.98 -4.94 119.74 122.44 2f08 s LYS 33 Ca 0.00 -0.91 -0.31 0.00 -1.01 0.00 0.00 55.97 53.74 2f08 s LYS 33 Cb 0.00 -2.35 -0.10 0.00 -1.01 0.00 0.00 37.83 34.37 2f08 s LYS 33 CO 0.00 0.55 1.54 -1.25 0.51 0.00 0.00 175.35 176.70 2f08 s PRO 34 N -1.78 4.23 -0.37 -1.68 0.04 -1.26 -4.04 135.00 130.15 2f08 s PRO 34 Ca 0.19 2.31 -0.08 0.00 0.04 0.00 0.00 61.00 63.45 2f08 s PRO 34 Cb -0.11 -3.20 0.05 0.00 0.04 0.00 0.00 34.50 31.28 2f08 s PRO 34 CO 0.10 -0.58 0.17 0.12 0.04 0.00 0.00 177.00 176.85 2f08 s PHE 35 N 1.22 3.29 -0.25 0.56 5.36 0.62 -4.94 117.98 123.84 2f08 s PHE 35 Ca 0.69 -1.39 -0.09 0.00 -0.96 0.00 0.00 56.93 55.18 2f08 s PHE 35 Cb -0.42 -2.53 -0.04 0.00 -0.34 0.00 0.00 43.02 39.69 2f08 s PHE 35 CO 0.31 -0.75 0.12 0.99 -1.46 0.00 0.00 175.22 174.43 2f08 s THR 36 N 1.43 4.89 0.19 0.12 2.01 -1.26 0.89 115.64 123.91 2f08 s THR 36 Ca 0.01 0.02 0.08 0.00 0.31 0.00 0.00 61.69 62.10 2f08 s THR 36 Cb -0.20 -3.29 -0.05 0.00 0.01 0.00 0.00 72.50 68.97 2f08 s THR 36 CO 0.03 0.33 -0.15 -1.48 -0.69 0.00 0.00 174.62 172.67 2f08 s LEU 37 N 1.34 2.53 -0.02 4.42 0.05 0.26 -1.49 118.68 125.78 2f08 s LEU 37 Ca 0.06 -0.98 0.01 0.00 0.05 0.00 0.00 54.13 53.27 2f08 s LEU 37 Cb -0.15 -0.69 0.01 0.00 -2.05 0.00 0.00 46.19 43.32 2f08 s LEU 37 CO 0.06 -0.15 -0.03 -0.70 -0.55 0.00 0.00 176.35 174.98 2f08 s GLU 38 N -3.43 0.42 -0.04 1.48 2.12 0.92 0.20 118.70 120.37 2f08 s GLU 38 Ca 0.20 -0.08 0.02 0.00 0.36 0.00 0.00 54.97 55.48 2f08 s GLU 38 Cb -0.02 -0.47 0.01 0.00 0.26 0.00 0.00 34.13 33.91 2f08 s GLU 38 CO 0.06 -0.01 -0.09 0.00 -0.54 0.00 0.00 175.26 174.68 2f08 s ALA 39 N 0.42 0.98 -0.19 6.30 0.00 0.49 -1.05 121.76 128.70 2f08 s ALA 39 Ca -0.04 -0.32 -0.05 0.00 0.00 0.00 0.00 51.96 51.55 2f08 s ALA 39 Cb -0.08 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 2f08 s ALA 39 CO -0.01 0.11 0.00 -1.17 0.00 0.00 0.00 175.76 174.70 2f08 s LEU 40 N 0.46 3.33 0.18 0.00 2.96 -0.38 -0.30 118.68 124.94 2f08 s LEU 40 Ca -0.08 -0.15 -0.10 0.00 -0.22 0.00 0.00 54.13 53.57 2f08 s LEU 40 Cb -0.12 -1.84 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 2f08 s LEU 40 CO 0.01 0.09 0.34 0.72 -1.32 0.00 0.00 176.35 176.20 2f08 s PHE 41 N 0.83 0.37 -0.19 5.38 -0.71 0.12 -0.19 117.98 123.59 2f08 s PHE 41 Ca 0.01 -0.72 -0.05 0.00 -1.04 0.00 0.00 56.93 55.13 2f08 s PHE 41 Cb -0.14 0.01 -0.03 0.00 -1.21 0.00 0.00 43.02 41.66 2f08 s PHE 41 CO 0.02 -0.79 -0.01 -0.51 -1.34 0.00 0.00 175.22 172.59 2f08 s ASP 42 N -2.98 4.84 0.24 1.98 -0.00 -0.93 0.18 116.67 120.01 2f08 s ASP 42 Ca 0.18 -0.18 -0.31 0.00 -0.00 0.00 0.00 52.55 52.24 2f08 s ASP 42 Cb 0.02 -1.82 -0.12 0.00 -0.00 0.00 0.00 42.92 41.01 2f08 s ASP 42 CO 0.02 0.09 1.67 0.00 -0.00 0.00 0.00 175.17 176.94 2f08 n ALA 43 N 4.07 2.67 -0.74 5.23 0.00 0.45 -4.84 120.51 127.34 2f08 n ALA 43 Ca -0.17 0.39 0.08 0.00 0.00 0.00 0.00 53.44 53.74 2f08 n ALA 43 Cb 0.52 -2.49 0.36 0.00 0.00 0.00 0.00 19.45 17.83 2f08 n ALA 43 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2f08 n ASN 44 N 3.20 4.93 -3.64 0.00 6.94 -1.26 -0.54 115.26 124.88 2f08 n ASN 44 Ca 0.13 -2.65 0.01 0.00 -0.02 0.00 0.00 54.58 52.04 2f08 n ASN 44 Cb 0.35 -0.60 -0.00 0.00 -2.36 0.00 0.00 39.78 37.17 2f08 n ASN 44 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2f08 s GLN 45 N -2.23 0.54 -0.19 -3.83 -2.07 -1.26 -4.93 119.66 105.69 2f08 s GLN 45 Ca 0.50 -0.30 -0.10 0.00 -1.82 0.00 0.00 55.36 53.64 2f08 s GLN 45 Cb 0.35 0.18 -0.05 0.00 -1.09 0.00 0.00 33.01 32.41 2f08 s GLN 45 CO 0.20 -0.25 0.12 -0.80 -1.32 0.00 0.00 175.29 173.24 2f08 s ASN 46 N -3.01 6.16 -0.13 12.60 -0.87 -1.26 -2.56 114.94 125.87 2f08 s ASN 46 Ca 0.15 0.23 -0.15 0.00 -1.57 0.00 0.00 52.86 51.52 2f08 s ASN 46 Cb 0.04 -2.08 0.04 0.00 -0.02 0.00 0.00 41.25 39.23 2f08 s ASN 46 CO -0.03 0.19 0.40 0.28 -2.57 0.00 0.00 177.10 175.37 2f08 s THR 47 N 0.30 0.01 -0.19 1.60 -1.32 -0.87 -4.79 115.64 110.38 2f08 s THR 47 Ca 0.08 -0.08 0.18 0.00 -1.21 0.00 0.00 61.69 60.66 2f08 s THR 47 Cb -0.11 -0.58 0.01 0.00 -1.51 0.00 0.00 72.50 70.31 2f08 s THR 47 CO -0.02 -0.04 1.18 0.11 -2.21 0.00 0.00 174.62 173.65 2f08 h LYS 48 N 5.17 0.00 -5.89 7.08 1.57 -1.94 0.11 116.57 122.66 2f08 h LYS 48 Ca -0.27 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.98 2f08 h LYS 48 Cb 1.18 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.34 2f08 h LYS 48 CO 0.28 0.30 -0.76 0.95 -0.57 0.00 0.00 179.45 179.65 2f08 s THR 49 N -3.04 2.01 -0.19 -0.16 -4.23 -1.26 -4.54 115.64 104.23 2f08 s THR 49 Ca 0.01 -2.20 -0.10 0.00 -1.18 0.00 0.00 61.69 58.22 2f08 s THR 49 Cb 0.08 -2.08 0.06 0.00 1.34 0.00 0.00 72.50 71.90 2f08 s THR 49 CO 0.77 -0.45 0.46 0.00 -0.54 0.00 0.00 174.62 174.86 2f08 s ALA 50 N -2.57 -1.20 -0.04 3.99 0.00 -1.26 -3.80 121.76 116.89 2f08 s ALA 50 Ca 0.23 1.69 0.07 0.00 0.00 0.00 0.00 51.96 53.95 2f08 s ALA 50 Cb -0.03 -1.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.05 2f08 s ALA 50 CO 0.09 -0.29 -0.25 0.21 0.00 0.00 0.00 175.76 175.53 2f08 s LYS 51 N 1.45 2.34 -0.20 0.00 2.20 0.93 -0.65 119.74 125.81 2f08 s LYS 51 Ca -0.10 -0.89 -0.03 0.00 -0.36 0.00 0.00 55.97 54.60 2f08 s LYS 51 Cb -0.08 -2.06 -0.01 0.00 -1.51 0.00 0.00 37.83 34.17 2f08 s LYS 51 CO -0.14 0.42 -0.06 -1.50 -0.36 0.00 0.00 175.35 173.72 2f08 s ILE 52 N -0.29 3.39 -0.15 5.43 2.07 -0.03 -0.24 121.20 131.38 2f08 s ILE 52 Ca 0.01 -0.50 0.01 0.00 -1.41 0.00 0.00 60.65 58.75 2f08 s ILE 52 Cb -0.12 -2.51 0.00 0.00 0.13 0.00 0.00 42.46 39.96 2f08 s ILE 52 CO 0.02 0.45 -0.18 -1.61 -1.91 0.00 0.00 174.94 171.71 2f08 s GLU 53 N 1.13 3.14 -0.10 3.50 2.02 0.45 -4.68 118.70 124.15 2f08 s GLU 53 Ca 0.01 -0.79 0.03 0.00 0.02 0.00 0.00 54.97 54.24 2f08 s GLU 53 Cb -0.15 -2.56 -0.01 0.00 0.10 0.00 0.00 34.13 31.51 2f08 s GLU 53 CO -0.01 -0.01 -0.18 0.42 0.02 0.00 0.00 175.26 175.50 2f08 s ILE 54 N 0.84 2.63 0.03 -1.63 1.01 -1.26 -0.95 121.20 121.87 2f08 s ILE 54 Ca -0.05 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.76 2f08 s ILE 54 Cb -0.15 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.24 2f08 s ILE 54 CO -0.01 0.55 -0.02 -0.54 0.00 0.00 0.00 174.94 174.92 2f08 s LYS 55 N 0.10 0.43 0.02 2.79 1.02 -0.79 -4.63 119.74 118.68 2f08 s LYS 55 Ca -0.08 -0.80 0.06 0.00 0.02 0.00 0.00 55.97 55.16 2f08 s LYS 55 Cb -0.15 0.15 -0.02 0.00 -0.52 0.00 0.00 37.83 37.29 2f08 s LYS 55 CO 0.05 -0.08 -0.18 0.00 -0.92 0.00 0.00 175.35 174.23 2f08 s ALA 56 N -2.30 1.51 -0.09 5.17 0.00 -0.66 -0.93 121.76 124.47 2f08 s ALA 56 Ca -0.08 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.01 2f08 s ALA 56 Cb -0.04 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2f08 s ALA 56 CO -0.04 0.34 -0.14 0.45 0.00 0.00 0.00 175.76 176.37 2f08 s SER 57 N -0.90 2.14 -0.12 0.00 0.15 0.20 -0.60 113.70 114.58 2f08 s SER 57 Ca 0.06 -0.37 -0.06 0.00 0.70 0.00 0.00 55.95 56.28 2f08 s SER 57 Cb -0.08 -0.97 0.05 0.00 -1.71 0.00 0.00 66.02 63.31 2f08 s SER 57 CO 0.01 0.03 0.27 -1.48 1.20 0.00 0.00 173.24 173.27 2f08 s LEU 58 N 0.80 0.26 -1.43 3.45 2.34 -0.30 -0.55 118.68 123.25 2f08 s LEU 58 Ca -0.11 0.59 -0.09 0.00 0.06 0.00 0.00 54.13 54.58 2f08 s LEU 58 Cb -0.16 0.83 0.01 0.00 -0.56 0.00 0.00 46.19 46.31 2f08 s LEU 58 CO 0.02 -0.18 0.26 0.47 -1.06 0.00 0.00 176.35 175.86 2f08 n ASP 59 N 4.34 -0.70 -0.03 1.48 10.43 -1.26 -1.54 116.55 129.26 2f08 n ASP 59 Ca -0.23 -1.23 -0.00 0.00 2.57 0.00 0.00 54.79 55.89 2f08 n ASP 59 Cb 0.53 -1.93 -0.00 0.00 1.84 0.00 0.00 41.12 41.56 2f08 n ASP 59 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2f08 n GLY 60 N -2.34 0.47 3.09 0.44 0.00 -1.26 -5.03 105.19 100.57 2f08 n GLY 60 Ca -0.27 -0.22 -0.19 0.00 0.00 0.00 0.00 46.02 45.34 2f08 n GLY 60 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2f08 s LEU 61 N -0.10 2.11 -0.06 0.99 2.96 -0.59 -5.14 118.68 118.85 2f08 s LEU 61 Ca 0.00 -0.35 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 2f08 s LEU 61 Cb 0.00 -0.52 -0.02 0.00 0.50 0.00 0.00 46.19 46.15 2f08 s LEU 61 CO 0.00 0.05 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.19 2f08 s GLU 62 N -0.80 2.55 0.08 1.98 2.12 -1.26 -1.15 118.70 122.23 2f08 s GLU 62 Ca 0.01 -0.79 0.04 0.00 0.36 0.00 0.00 54.97 54.59 2f08 s GLU 62 Cb -0.06 -2.29 -0.03 0.00 0.26 0.00 0.00 34.13 32.00 2f08 s GLU 62 CO 0.00 0.50 -0.12 0.96 -0.54 0.00 0.00 175.26 176.06 2f08 s ILE 63 N -0.42 1.00 0.20 -3.70 -4.36 0.23 -4.99 121.20 109.16 2f08 s ILE 63 Ca 0.04 -1.45 -0.11 0.00 -0.26 0.00 0.00 60.65 58.87 2f08 s ILE 63 Cb -0.12 -1.18 -0.00 0.00 1.25 0.00 0.00 42.46 42.41 2f08 s ILE 63 CO 0.02 -0.39 0.38 1.51 0.24 0.00 0.00 174.94 176.70 2f08 s ASP 64 N -2.07 -0.05 -0.36 4.36 -4.77 -1.26 -1.65 116.67 110.87 2f08 s ASP 64 Ca 0.01 -0.85 -0.05 0.00 -3.30 0.00 0.00 52.55 48.36 2f08 s ASP 64 Cb -0.07 0.51 0.06 0.00 -1.09 0.00 0.00 42.92 42.33 2f08 s ASP 64 CO 0.01 -1.00 0.13 -0.69 0.70 0.00 0.00 175.17 174.32 2f08 s VAL 65 N -3.98 3.61 0.59 2.11 1.01 -1.26 -5.09 120.40 117.39 2f08 s VAL 65 Ca 0.19 -1.41 -0.14 0.00 0.00 0.00 0.00 61.98 60.61 2f08 s VAL 65 Cb 0.01 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 2f08 s VAL 65 CO 0.03 -0.32 1.03 -2.16 0.00 0.00 0.00 175.10 173.68 2f08 s PRO 66 N 1.33 3.53 0.00 2.72 0.04 -1.26 -3.95 135.00 137.41 2f08 s PRO 66 Ca 0.00 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.04 2f08 s PRO 66 Cb -0.21 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2f08 s PRO 66 CO 0.01 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.83 2f08 n GLY 67 N -1.68 1.07 3.95 0.56 0.00 -1.26 -5.06 105.19 102.77 2f08 n GLY 67 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2f08 n GLY 67 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2f08 s ILE 68 N -2.57 4.92 -0.19 -0.61 -4.36 -1.25 -5.04 121.20 112.10 2f08 s ILE 68 Ca 0.00 -0.49 -0.29 0.00 -0.26 0.00 0.00 60.65 59.61 2f08 s ILE 68 Cb 0.00 -3.80 -0.02 0.00 1.25 0.00 0.00 42.46 39.89 2f08 s ILE 68 CO 0.00 -0.52 1.42 -0.62 0.24 0.00 0.00 174.94 175.47 2f08 s ASP 69 N -4.07 6.70 0.00 4.36 3.68 -1.26 -4.87 116.67 121.22 2f08 s ASP 69 Ca 0.41 1.66 0.13 0.00 2.13 0.00 0.00 52.55 56.89 2f08 s ASP 69 Cb -0.10 -2.54 0.34 0.00 -1.45 0.00 0.00 42.92 39.18 2f08 s ASP 69 CO 0.36 -0.98 1.27 0.35 0.13 0.00 0.00 175.17 176.30 2f08 n THR 70 N 5.82 0.89 -2.82 1.71 -2.24 -1.26 -4.88 114.28 111.50 2f08 n THR 70 Ca 0.16 -0.94 -0.43 0.00 -2.27 0.00 0.00 64.05 60.57 2f08 n THR 70 Cb 0.45 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 2f08 n THR 70 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2f08 s ASN 71 N -1.02 6.29 0.57 3.42 3.04 -1.26 -0.85 114.94 125.13 2f08 s ASN 71 Ca 0.27 -1.19 0.27 0.00 0.04 0.00 0.00 52.86 52.25 2f08 s ASN 71 Cb 0.14 -2.44 1.58 0.00 -1.54 0.00 0.00 41.25 39.00 2f08 s ASN 71 CO 0.19 -1.41 2.11 0.00 -3.04 0.00 0.00 177.10 174.95 2f08 h ALA 72 N 9.48 1.91 0.00 1.71 0.00 -1.20 -1.81 119.26 129.34 2f08 h ALA 72 Ca -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2f08 h ALA 72 Cb 1.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2f08 h ALA 72 CO 1.19 -0.28 0.00 0.00 0.00 0.00 0.00 179.25 180.16 2f08 n HIS 74 N -1.31 0.00 0.03 0.00 8.25 -0.68 -4.09 115.22 117.41 2f08 n HIS 74 Ca 0.02 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.50 2f08 n HIS 74 Cb 0.05 -0.20 -0.02 0.00 1.12 0.00 0.00 29.99 30.93 2f08 n HIS 74 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2f08 n PHE 75 N -1.18 0.00 -4.11 4.41 3.72 0.16 -5.05 117.46 115.43 2f08 n PHE 75 Ca 0.08 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.40 2f08 n PHE 75 Cb 0.34 -0.06 -0.10 0.00 -0.94 0.00 0.00 39.48 38.72 2f08 n PHE 75 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2f08 s VAL 76 N -2.02 0.35 -0.44 -4.37 -7.23 -0.71 -4.79 120.40 101.18 2f08 s VAL 76 Ca -0.01 -1.79 -0.28 0.00 -1.81 0.00 0.00 61.98 58.09 2f08 s VAL 76 Cb 0.02 -1.49 -0.00 0.00 0.56 0.00 0.00 36.38 35.47 2f08 s VAL 76 CO 0.13 -0.93 1.61 -0.54 -0.31 0.00 0.00 175.10 175.06 2f08 s LYS 77 N -3.75 3.30 0.20 4.82 -0.14 -1.26 -4.50 119.74 118.42 2f08 s LYS 77 Ca 0.07 0.97 0.05 0.00 -1.36 0.00 0.00 55.97 55.70 2f08 s LYS 77 Cb 0.06 -4.16 -0.04 0.00 -1.68 0.00 0.00 37.83 32.02 2f08 s LYS 77 CO -0.08 -1.91 0.20 0.00 -0.76 0.00 0.00 175.35 172.81 2f08 s PRO 79 N -3.48 2.65 0.20 0.00 0.04 -1.26 -5.12 135.00 128.03 2f08 s PRO 79 Ca 0.32 1.24 -0.25 0.00 0.04 0.00 0.00 61.00 62.36 2f08 s PRO 79 Cb -0.09 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 2f08 s PRO 79 CO 0.25 -1.35 0.79 -0.51 0.04 0.00 0.00 177.00 176.23 2f08 s LEU 80 N -5.32 4.52 -0.23 -3.56 1.43 0.37 -4.91 118.68 110.97 2f08 s LEU 80 Ca 0.63 1.64 -0.08 0.00 -1.03 0.00 0.00 54.13 55.29 2f08 s LEU 80 Cb -0.18 -3.44 -0.03 0.00 0.03 0.00 0.00 46.19 42.56 2f08 s LEU 80 CO 0.48 0.14 0.08 -0.69 0.23 0.00 0.00 176.35 176.60 2f08 s VAL 81 N -1.27 4.57 0.38 -1.59 1.01 -1.26 -2.06 120.40 120.18 2f08 s VAL 81 Ca 0.39 -0.09 -0.24 0.00 0.00 0.00 0.00 61.98 62.04 2f08 s VAL 81 Cb -0.22 -3.12 -0.13 0.00 0.00 0.00 0.00 36.38 32.91 2f08 s VAL 81 CO 0.25 0.36 0.61 1.17 0.00 0.00 0.00 175.10 177.50 2f08 n LYS 82 N 4.53 0.64 0.00 2.72 4.81 -1.06 -1.47 118.16 128.33 2f08 n LYS 82 Ca -0.16 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2f08 n LYS 82 Cb 0.52 -1.51 0.00 0.00 0.02 0.00 0.00 35.03 34.06 2f08 n LYS 82 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2f08 n GLY 83 N 1.72 2.24 3.76 3.14 0.00 0.29 -4.93 105.19 111.41 2f08 n GLY 83 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2f08 n GLY 83 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2f08 s GLN 84 N 0.00 3.62 -0.05 1.61 0.74 -0.54 -4.58 119.66 120.45 2f08 s GLN 84 Ca 0.00 1.96 -0.15 0.00 0.05 0.00 0.00 55.36 57.23 2f08 s GLN 84 Cb 0.00 -2.42 -0.05 0.00 1.10 0.00 0.00 33.01 31.64 2f08 s GLN 84 CO 0.00 -0.72 0.38 -1.14 -0.55 0.00 0.00 175.29 173.26 2f08 s GLN 85 N -2.68 4.00 0.13 1.67 0.74 -1.26 -0.41 119.66 121.85 2f08 s GLN 85 Ca 0.65 0.32 0.07 0.00 0.05 0.00 0.00 55.36 56.45 2f08 s GLN 85 Cb -0.33 -3.29 -0.04 0.00 1.10 0.00 0.00 33.01 30.45 2f08 s GLN 85 CO 0.41 0.54 -0.16 0.71 -0.55 0.00 0.00 175.29 176.23 2f08 s TYR 86 N -0.55 1.55 -0.20 1.67 1.51 0.48 -4.96 117.35 116.84 2f08 s TYR 86 Ca 0.22 -0.51 0.00 0.00 -1.01 0.00 0.00 57.07 55.78 2f08 s TYR 86 Cb -0.15 -0.81 0.05 0.00 -0.11 0.00 0.00 41.96 40.94 2f08 s TYR 86 CO 0.11 0.19 -0.06 0.34 -1.11 0.00 0.00 175.55 175.02 2f08 s ASP 87 N -2.37 3.41 -0.20 2.29 2.15 -1.26 0.15 116.67 120.83 2f08 s ASP 87 Ca 0.09 -0.95 -0.03 0.00 0.43 0.00 0.00 52.55 52.10 2f08 s ASP 87 Cb -0.06 -1.10 -0.01 0.00 -0.30 0.00 0.00 42.92 41.45 2f08 s ASP 87 CO 0.04 -0.20 -0.07 -0.51 -0.17 0.00 0.00 175.17 174.26 2f08 s ILE 88 N 1.48 3.25 -0.23 4.11 2.07 0.59 -4.87 121.20 127.60 2f08 s ILE 88 Ca -0.03 -0.54 -0.07 0.00 -1.41 0.00 0.00 60.65 58.60 2f08 s ILE 88 Cb -0.17 -2.46 -0.03 0.00 0.13 0.00 0.00 42.46 39.93 2f08 s ILE 88 CO -0.07 0.45 0.07 -0.54 -1.91 0.00 0.00 174.94 172.93 2f08 s LYS 89 N 1.27 3.76 -0.00 3.50 1.02 -1.26 -0.38 119.74 127.65 2f08 s LYS 89 Ca 0.03 -0.44 0.02 0.00 0.02 0.00 0.00 55.97 55.61 2f08 s LYS 89 Cb -0.14 -3.29 -0.01 0.00 -0.52 0.00 0.00 37.83 33.87 2f08 s LYS 89 CO -0.03 -0.04 -0.07 -0.47 -0.92 0.00 0.00 175.35 173.83 2f08 s TYR 90 N 1.22 0.60 -0.28 3.18 6.14 0.13 -4.99 117.35 123.35 2f08 s TYR 90 Ca 0.05 -0.13 -0.07 0.00 0.64 0.00 0.00 57.07 57.55 2f08 s TYR 90 Cb -0.14 -0.39 -0.01 0.00 0.42 0.00 0.00 41.96 41.84 2f08 s TYR 90 CO 0.03 -0.01 0.08 0.99 0.64 0.00 0.00 175.55 177.28 2f08 s THR 91 N -0.21 4.16 -0.29 4.34 2.01 -1.26 -0.57 115.64 123.81 2f08 s THR 91 Ca 0.02 -0.46 -0.10 0.00 0.31 0.00 0.00 61.69 61.46 2f08 s THR 91 Cb -0.03 -3.06 -0.03 0.00 0.01 0.00 0.00 72.50 69.39 2f08 s THR 91 CO -0.00 0.19 0.16 0.86 -0.69 0.00 0.00 174.62 175.14 2f08 s TRP 92 N 1.56 3.18 -0.56 4.92 -0.00 0.26 -4.89 118.94 123.41 2f08 s TRP 92 Ca 0.04 -0.19 -0.17 0.00 -0.00 0.00 0.00 56.10 55.79 2f08 s TRP 92 Cb -0.16 -2.36 0.12 0.00 -0.00 0.00 0.00 33.47 31.06 2f08 s TRP 92 CO 0.03 -0.29 0.58 -0.80 -0.00 0.00 0.00 176.95 176.47 2f08 s ASN 93 N 1.69 6.19 -0.19 5.86 0.01 -1.26 -0.28 114.94 126.96 2f08 s ASN 93 Ca 0.06 -1.61 -0.26 0.00 -0.71 0.00 0.00 52.86 50.34 2f08 s ASN 93 Cb -0.16 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.24 2f08 s ASN 93 CO 0.08 -0.95 0.89 -0.69 -1.51 0.00 0.00 177.10 174.92 2f08 s VAL 94 N 2.05 4.82 0.77 1.60 1.01 -1.26 -4.96 120.40 124.45 2f08 s VAL 94 Ca 0.07 1.73 -0.13 0.00 0.00 0.00 0.00 61.98 63.65 2f08 s VAL 94 Cb -0.27 -4.18 0.06 0.00 0.00 0.00 0.00 36.38 31.99 2f08 s VAL 94 CO 0.05 -0.04 1.16 -2.16 0.00 0.00 0.00 175.10 174.11 2f08 s PRO 95 N 2.52 1.95 0.59 2.72 0.04 -1.26 0.58 135.00 142.14 2f08 s PRO 95 Ca 0.39 1.58 0.35 0.00 0.04 0.00 0.00 61.00 63.36 2f08 s PRO 95 Cb -0.16 -1.83 1.87 0.00 0.04 0.00 0.00 34.50 34.42 2f08 s PRO 95 CO 0.10 -1.94 2.21 0.87 0.04 0.00 0.00 177.00 178.28 2f08 h LYS 96 N -0.77 0.00 0.00 4.56 6.56 -1.92 -2.29 116.57 122.71 2f08 h LYS 96 Ca -0.46 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.13 2f08 h LYS 96 Cb 1.27 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.93 2f08 h LYS 96 CO 0.48 0.04 0.00 1.51 -2.06 0.00 0.00 179.45 179.42 2f08 n ILE 97 N -3.43 0.74 -1.69 1.86 0.13 -1.26 -4.81 119.36 110.90 2f08 n ILE 97 Ca -0.02 0.07 -0.44 0.00 -1.10 0.00 0.00 62.75 61.25 2f08 n ILE 97 Cb 0.15 -0.96 -0.03 0.00 -0.84 0.00 0.00 39.64 37.96 2f08 n ILE 97 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2f08 n ALA 98 N -1.76 1.85 -1.46 1.51 0.00 -0.86 -4.91 120.51 114.88 2f08 n ALA 98 Ca 0.03 0.41 -0.34 0.00 0.00 0.00 0.00 53.44 53.55 2f08 n ALA 98 Cb 0.29 -2.39 0.07 0.00 0.00 0.00 0.00 19.45 17.42 2f08 n ALA 98 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2f08 s PRO 99 N 0.37 2.49 0.19 0.00 0.04 -1.26 -5.00 135.00 131.83 2f08 s PRO 99 Ca 0.73 1.62 -0.15 0.00 0.04 0.00 0.00 61.00 63.24 2f08 s PRO 99 Cb -0.60 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 31.98 2f08 s PRO 99 CO 0.42 -1.54 0.59 0.15 0.04 0.00 0.00 177.00 176.66 2f08 s LYS 100 N -3.91 4.00 -0.08 4.56 1.02 -1.26 -4.84 119.74 119.23 2f08 s LYS 100 Ca 0.72 0.54 -0.30 0.00 0.02 0.00 0.00 55.97 56.95 2f08 s LYS 100 Cb -0.26 -2.84 0.07 0.00 -0.52 0.00 0.00 37.83 34.28 2f08 s LYS 100 CO 0.42 0.41 0.67 0.45 -0.92 0.00 0.00 175.35 176.39 2f08 s SER 101 N -1.85 -0.66 0.00 2.83 0.15 -0.72 -4.97 113.70 108.49 2f08 s SER 101 Ca 0.41 0.79 0.25 0.00 0.70 0.00 0.00 55.95 58.10 2f08 s SER 101 Cb -0.14 0.65 0.46 0.00 -1.71 0.00 0.00 66.02 65.27 2f08 s SER 101 CO 0.20 -0.56 1.41 -0.62 1.20 0.00 0.00 173.24 174.87 2f08 n GLU 102 N 1.15 2.17 -3.45 5.44 -0.58 -1.26 -0.99 120.64 123.13 2f08 n GLU 102 Ca -0.18 -1.72 -0.28 0.00 -0.42 0.00 0.00 57.16 54.55 2f08 n GLU 102 Cb 0.57 -1.47 -0.12 0.00 -0.57 0.00 0.00 31.44 29.85 2f08 n GLU 102 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2f08 s ASN 103 N -1.89 2.82 -0.01 1.62 0.01 -1.26 -4.75 114.94 111.48 2f08 s ASN 103 Ca 0.32 -2.20 0.04 0.00 -0.71 0.00 0.00 52.86 50.31 2f08 s ASN 103 Cb 0.21 -0.36 -0.01 0.00 0.41 0.00 0.00 41.25 41.50 2f08 s ASN 103 CO 0.31 -0.30 -0.13 0.54 -1.51 0.00 0.00 177.10 176.01 2f08 s VAL 104 N 1.04 1.03 -0.21 1.60 0.11 -0.94 -4.32 120.40 118.71 2f08 s VAL 104 Ca 0.19 -0.55 -0.07 0.00 -2.93 0.00 0.00 61.98 58.62 2f08 s VAL 104 Cb -0.21 -0.87 -0.03 0.00 -1.53 0.00 0.00 36.38 33.73 2f08 s VAL 104 CO -0.00 0.30 0.05 -0.69 -3.33 0.00 0.00 175.10 171.42 2f08 s VAL 105 N -0.23 4.45 -0.18 2.04 1.01 0.29 -1.94 120.40 125.83 2f08 s VAL 105 Ca 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 2f08 s VAL 105 Cb -0.06 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.28 2f08 s VAL 105 CO -0.00 0.41 -0.06 -0.69 0.00 0.00 0.00 175.10 174.76 2f08 s VAL 106 N 0.88 3.45 -0.12 2.92 1.01 -0.52 0.58 120.40 128.60 2f08 s VAL 106 Ca 0.03 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2f08 s VAL 106 Cb -0.14 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 2f08 s VAL 106 CO 0.02 0.46 -0.14 0.42 0.00 0.00 0.00 175.10 175.87 2f08 s THR 107 N 0.95 3.02 -0.16 3.92 -4.23 -0.10 -0.48 115.64 118.56 2f08 s THR 107 Ca -0.00 -0.68 -0.02 0.00 -1.18 0.00 0.00 61.69 59.81 2f08 s THR 107 Cb -0.15 -2.25 -0.01 0.00 1.34 0.00 0.00 72.50 71.43 2f08 s THR 107 CO 0.01 0.53 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.83 2f08 s VAL 108 N 0.23 3.21 0.02 2.29 1.01 0.45 -1.88 120.40 125.73 2f08 s VAL 108 Ca -0.09 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.34 2f08 s VAL 108 Cb -0.15 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2f08 s VAL 108 CO 0.05 0.50 -0.12 -0.75 0.00 0.00 0.00 175.10 174.78 2f08 s LYS 109 N 0.67 0.85 -0.10 2.72 2.20 -0.13 -1.14 119.74 124.81 2f08 s LYS 109 Ca -0.05 -0.60 0.03 0.00 -0.36 0.00 0.00 55.97 54.99 2f08 s LYS 109 Cb -0.15 -0.82 0.01 0.00 -1.51 0.00 0.00 37.83 35.36 2f08 s LYS 109 CO 0.02 0.21 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.51 2f08 s LEU 110 N -0.83 1.96 -0.07 5.43 2.01 0.01 -0.41 118.68 126.78 2f08 s LEU 110 Ca 0.01 -0.50 0.05 0.00 0.01 0.00 0.00 54.13 53.71 2f08 s LEU 110 Cb -0.06 -1.26 -0.01 0.00 0.01 0.00 0.00 46.19 44.87 2f08 s LEU 110 CO 0.01 0.11 -0.24 -0.63 1.01 0.00 0.00 176.35 176.60 2f08 s ILE 111 N 0.54 1.98 0.34 -0.59 1.09 0.67 0.70 121.20 125.92 2f08 s ILE 111 Ca -0.15 -1.01 0.00 0.00 -1.10 0.00 0.00 60.65 58.39 2f08 s ILE 111 Cb -0.17 -1.69 -0.00 0.00 -1.06 0.00 0.00 42.46 39.55 2f08 s ILE 111 CO 0.05 0.55 0.01 0.61 -0.10 0.00 0.00 174.94 176.06 2f08 n GLY 112 N 3.13 3.76 0.26 6.18 0.00 -0.31 -0.05 105.19 118.17 2f08 n GLY 112 Ca -0.18 -2.30 0.03 0.00 0.00 0.00 0.00 46.02 43.57 2f08 n GLY 112 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2f08 h ASP 113 N 0.83 -0.34 -0.92 1.61 3.45 -1.89 -2.49 116.42 116.67 2f08 h ASP 113 Ca -0.28 0.18 -0.42 0.00 0.43 0.00 0.00 57.03 56.94 2f08 h ASP 113 Cb 0.85 0.32 -0.25 0.00 -0.56 0.00 0.00 39.33 39.69 2f08 h ASP 113 CO 0.46 -0.15 0.54 0.59 -1.57 0.00 0.00 179.24 179.10 2f08 n ASN 114 N -5.33 4.11 0.00 6.45 4.13 -1.26 -5.05 115.26 118.32 2f08 n ASN 114 Ca 0.11 -3.48 0.00 0.00 1.68 0.00 0.00 54.58 52.89 2f08 n ASN 114 Cb 0.41 -0.81 0.00 0.00 -1.54 0.00 0.00 39.78 37.84 2f08 n ASN 114 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2f08 n GLY 115 N -0.82 -0.25 3.67 7.41 0.00 -0.94 -5.03 105.19 109.23 2f08 n GLY 115 Ca 0.54 -2.24 -0.46 0.00 0.00 0.00 0.00 46.02 43.86 2f08 n GLY 115 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2f08 n VAL 116 N 0.00 0.04 -0.08 1.61 0.31 -1.26 -1.16 118.33 117.80 2f08 n VAL 116 Ca 0.00 -0.01 -0.23 0.00 -0.01 0.00 0.00 64.34 64.10 2f08 n VAL 116 Cb 0.00 -1.61 -0.12 0.00 -0.91 0.00 0.00 33.84 31.20 2f08 n VAL 116 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2f08 n LEU 117 N 3.71 2.14 -3.48 7.52 7.94 0.22 -4.84 117.00 130.21 2f08 n LEU 117 Ca 0.17 0.33 -0.15 0.00 -1.11 0.00 0.00 56.01 55.24 2f08 n LEU 117 Cb 0.30 -0.99 -0.04 0.00 0.53 0.00 0.00 43.42 43.21 2f08 n LEU 117 CO 0.64 0.51 0.42 0.00 -1.11 0.00 0.00 177.39 177.84 2f08 s ALA 118 N -2.44 -1.69 -0.18 1.96 0.00 -1.03 -4.62 121.76 113.75 2f08 s ALA 118 Ca -0.29 0.96 -0.07 0.00 0.00 0.00 0.00 51.96 52.57 2f08 s ALA 118 Cb 0.07 0.37 0.08 0.00 0.00 0.00 0.00 23.12 23.64 2f08 s ALA 118 CO 0.63 -0.54 0.40 0.00 0.00 0.00 0.00 175.76 176.25 2f08 s ALA 120 N 2.27 0.43 -0.14 0.00 0.00 -0.30 -0.70 121.76 123.32 2f08 s ALA 120 Ca -0.03 -0.36 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2f08 s ALA 120 Cb -0.11 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 22.97 2f08 s ALA 120 CO -0.12 0.06 -0.21 0.42 0.00 0.00 0.00 175.76 175.91 2f08 s ILE 121 N -0.48 1.98 -0.40 0.00 1.01 0.58 -0.41 121.20 123.48 2f08 s ILE 121 Ca -0.02 -0.93 -0.13 0.00 0.00 0.00 0.00 60.65 59.58 2f08 s ILE 121 Cb -0.04 -1.76 0.03 0.00 0.01 0.00 0.00 42.46 40.70 2f08 s ILE 121 CO -0.00 0.53 0.26 0.00 0.00 0.00 0.00 174.94 175.73 2f08 s ALA 122 N 0.90 3.38 -2.45 9.38 0.00 0.37 -0.59 121.76 132.76 2f08 s ALA 122 Ca -0.06 -1.74 0.24 0.00 0.00 0.00 0.00 51.96 50.40 2f08 s ALA 122 Cb -0.15 -2.75 0.73 0.00 0.00 0.00 0.00 23.12 20.94 2f08 s ALA 122 CO -0.03 -1.44 1.55 0.25 0.00 0.00 0.00 175.76 176.09 2f08 n THR 123 N 5.08 0.17 -1.55 0.00 -2.24 -1.26 -1.44 114.28 113.03 2f08 n THR 123 Ca -0.11 -0.39 -0.18 0.00 -2.27 0.00 0.00 64.05 61.09 2f08 n THR 123 Cb 0.46 0.62 0.13 0.00 -2.10 0.00 0.00 70.33 69.44 2f08 n THR 123 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2f08 n HIS 124 N 0.56 2.16 -2.03 4.78 8.25 -1.26 -4.78 115.22 122.90 2f08 n HIS 124 Ca 0.17 -2.10 -0.30 0.00 -0.26 0.00 0.00 57.72 55.23 2f08 n HIS 124 Cb 0.41 -0.71 0.01 0.00 1.12 0.00 0.00 29.99 30.81 2f08 n HIS 124 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2f08 s GLY 125 N -2.53 1.62 -0.18 -1.41 0.00 -0.82 0.13 107.32 104.13 2f08 s GLY 125 Ca 0.52 -0.20 -0.15 0.00 0.00 0.00 0.00 44.72 44.89 2f08 s GLY 125 CO 0.02 0.06 0.48 0.54 0.00 0.00 0.00 173.10 174.20 2f08 s LYS 126 N -5.10 0.54 -0.21 2.90 1.02 -0.81 -2.22 119.74 115.86 2f08 s LYS 126 Ca 0.54 0.72 -0.03 0.00 0.02 0.00 0.00 55.97 57.22 2f08 s LYS 126 Cb -0.11 0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 2f08 s LYS 126 CO 0.52 -0.09 -0.07 0.42 -0.92 0.00 0.00 175.35 175.22 2f08 s ILE 127 N 0.53 3.22 0.26 2.17 1.01 -0.16 0.61 121.20 128.83 2f08 s ILE 127 Ca -0.02 -0.55 0.04 0.00 0.00 0.00 0.00 60.65 60.12 2f08 s ILE 127 Cb -0.04 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 2f08 s ILE 127 CO -0.03 0.44 0.26 0.54 0.00 0.00 0.00 174.94 176.15 2f08 n ARG 128 N 4.66 0.37 0.00 2.79 1.74 -0.42 -1.76 116.66 124.05 2f08 n ARG 128 Ca -0.18 -2.48 0.14 0.00 -0.77 0.00 0.00 57.85 54.56 2f08 n ARG 128 Cb 0.51 2.11 0.84 0.00 -1.02 0.00 0.00 32.46 34.90 2f08 n ARG 128 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86