#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f08 s GLN 2 N 0.00 1.56 0.11 -0.67 0.74 -1.26 -4.02 119.66 116.13 2f08 s GLN 2 Ca 0.00 1.23 0.06 0.00 0.05 0.00 0.00 55.36 56.69 2f08 s GLN 2 Cb 0.00 -1.81 -0.04 0.00 1.10 0.00 0.00 33.01 32.26 2f08 s GLN 2 CO 0.00 -2.15 -0.14 0.14 -0.55 0.00 0.00 175.29 172.59 2f08 s VAL 3 N -2.81 1.28 -0.42 1.34 -7.23 -0.56 -1.24 120.40 110.77 2f08 s VAL 3 Ca 0.64 -1.62 -0.29 0.00 -1.81 0.00 0.00 61.98 58.89 2f08 s VAL 3 Cb -0.19 -1.43 0.02 0.00 0.56 0.00 0.00 36.38 35.34 2f08 s VAL 3 CO 0.57 -0.37 1.15 -1.81 -0.31 0.00 0.00 175.10 174.34 2f08 s ASP 4 N -2.29 6.69 0.27 4.85 1.11 -0.47 -4.65 116.67 122.19 2f08 s ASP 4 Ca 0.06 0.69 0.11 0.00 0.18 0.00 0.00 52.55 53.59 2f08 s ASP 4 Cb -0.06 -2.55 -0.05 0.00 1.07 0.00 0.00 42.92 41.33 2f08 s ASP 4 CO 0.03 -1.16 -0.17 0.68 1.18 0.00 0.00 175.17 175.73 2f08 s VAL 5 N 4.32 2.26 -0.09 -1.27 -7.23 -1.26 -4.47 120.40 112.66 2f08 s VAL 5 Ca 0.49 -2.33 -0.02 0.00 -1.81 0.00 0.00 61.98 58.31 2f08 s VAL 5 Cb -0.09 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 2f08 s VAL 5 CO 0.27 -0.41 0.01 -0.54 -0.31 0.00 0.00 175.10 174.13 2f08 s LYS 6 N -3.56 3.01 -0.05 4.82 3.01 0.42 -4.87 119.74 122.51 2f08 s LYS 6 Ca 0.29 -0.39 -0.23 0.00 -1.01 0.00 0.00 55.97 54.63 2f08 s LYS 6 Cb -0.03 -2.82 -0.04 0.00 -1.01 0.00 0.00 37.83 33.94 2f08 s LYS 6 CO 0.13 0.71 0.69 0.34 0.51 0.00 0.00 175.35 177.73 2f08 s ASP 7 N -0.91 7.00 -0.27 2.83 -1.08 -1.26 0.81 116.67 123.79 2f08 s ASP 7 Ca 0.14 1.20 0.09 0.00 -0.52 0.00 0.00 52.55 53.46 2f08 s ASP 7 Cb -0.11 -2.41 0.47 0.00 -1.46 0.00 0.00 42.92 39.41 2f08 s ASP 7 CO 0.03 -0.08 1.36 0.00 0.52 0.00 0.00 175.17 177.00 2f08 n ALA 9 N -1.09 0.00 -2.80 0.00 0.00 -1.25 -4.77 120.51 110.59 2f08 n ALA 9 Ca 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.71 2f08 n ALA 9 Cb 0.89 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.39 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 1.37 -1.99 0.00 5.15 -1.26 -5.01 115.26 113.52 2f08 n ASN 10 Ca 0.00 -2.16 -0.18 0.00 -0.60 0.00 0.00 54.58 51.63 2f08 n ASN 10 Cb 0.00 -0.42 -0.02 0.00 -0.53 0.00 0.00 39.78 38.81 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 -0.54 -5.30 0.21 1.20 3.02 -1.26 -4.89 115.26 107.70 2f08 n ASN 11 Ca 0.06 0.05 0.11 0.00 -0.03 0.00 0.00 54.58 54.77 2f08 n ASN 11 Cb 0.81 -4.37 0.27 0.00 -0.61 0.00 0.00 39.78 35.88 2f08 n ASN 11 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 2f08 h GLU 12 N 0.00 0.00 -6.42 3.52 9.09 -1.87 -3.43 114.58 115.47 2f08 h GLU 12 Ca -0.43 0.00 -0.54 0.00 0.05 0.00 0.00 59.36 58.44 2f08 h GLU 12 Cb 1.30 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.40 2f08 h GLU 12 CO 0.52 0.14 0.62 0.42 0.05 0.00 0.00 179.01 180.76 2f08 s ILE 13 N -3.30 4.10 -0.21 -1.06 -1.09 -1.26 -1.34 121.20 117.04 2f08 s ILE 13 Ca 0.04 1.49 -0.05 0.00 -2.23 0.00 0.00 60.65 59.91 2f08 s ILE 13 Cb 0.07 -3.96 -0.20 0.00 -1.58 0.00 0.00 42.46 36.79 2f08 s ILE 13 CO 0.66 0.07 0.01 0.29 -1.23 0.00 0.00 174.94 174.74 2f08 n LYS 14 N 4.42 0.68 -3.53 2.79 4.76 0.15 -4.97 118.16 122.46 2f08 n LYS 14 Ca 0.10 0.23 -0.13 0.00 -2.87 0.00 0.00 58.31 55.64 2f08 n LYS 14 Cb 0.46 -1.60 -0.05 0.00 -1.84 0.00 0.00 35.03 32.00 2f08 n LYS 14 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 2f08 s LYS 15 N -2.52 0.86 -0.03 1.97 -2.85 -1.12 -5.01 119.74 111.04 2f08 s LYS 15 Ca -0.30 0.06 -0.01 0.00 -1.00 0.00 0.00 55.97 54.72 2f08 s LYS 15 Cb 0.08 0.40 0.03 0.00 -2.06 0.00 0.00 37.83 36.28 2f08 s LYS 15 CO 0.65 -0.30 0.05 0.54 0.10 0.00 0.00 175.35 176.40 2f08 s VAL 16 N -1.69 -0.05 0.06 1.79 0.11 -1.26 -0.75 120.40 118.62 2f08 s VAL 16 Ca -0.04 0.17 0.06 0.00 -2.93 0.00 0.00 61.98 59.24 2f08 s VAL 16 Cb -0.00 -0.11 -0.03 0.00 -1.53 0.00 0.00 36.38 34.71 2f08 s VAL 16 CO 0.02 0.07 -0.18 0.00 -3.33 0.00 0.00 175.10 171.68 2f08 s MET 17 N 0.88 1.11 -0.02 1.54 0.23 0.32 -1.49 119.30 121.86 2f08 s MET 17 Ca -0.07 -0.92 0.03 0.00 -1.03 0.00 0.00 55.69 53.70 2f08 s MET 17 Cb -0.10 -1.20 -0.00 0.00 -1.53 0.00 0.00 34.83 32.00 2f08 s MET 17 CO -0.03 0.29 -0.10 0.14 -2.03 0.00 0.00 175.02 173.29 2f08 s VAL 18 N -0.94 0.85 -0.26 5.16 -7.23 -1.26 0.33 120.40 117.05 2f08 s VAL 18 Ca 0.04 -0.42 -0.38 0.00 -1.81 0.00 0.00 61.98 59.41 2f08 s VAL 18 Cb -0.09 -0.74 -0.14 0.00 0.56 0.00 0.00 36.38 35.98 2f08 s VAL 18 CO 0.02 0.26 1.90 -0.67 -0.31 0.00 0.00 175.10 176.29 2f08 n ASP 19 N 3.12 2.53 0.00 4.85 2.03 0.47 -1.85 116.55 127.69 2f08 n ASP 19 Ca -0.17 0.88 0.00 0.00 0.52 0.00 0.00 54.79 56.02 2f08 n ASP 19 Cb 0.55 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 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 4.91 0.50 3.46 0.27 0.00 -1.26 -4.81 105.19 108.25 2f08 n GLY 20 Ca 0.30 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.98 -0.79 0.00 0.00 2.46 -1.26 -4.66 115.29 108.06 2f08 s HIS 22 Ca 0.31 1.88 0.00 0.00 0.47 0.00 0.00 55.06 57.72 2f08 s HIS 22 Cb 0.05 0.32 0.00 0.00 -0.13 0.00 0.00 32.58 32.82 2f08 s HIS 22 CO 0.13 -0.38 0.00 0.41 -2.47 0.00 0.00 174.74 172.43 2f08 n GLY 23 N 2.84 2.72 1.31 1.59 0.00 -0.37 -2.05 105.19 111.23 2f08 n GLY 23 Ca -0.15 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 1.67 4.46 -4.84 1.61 3.41 -1.26 -1.37 113.62 117.31 2f08 n SER 24 Ca 0.00 -2.66 -0.31 0.00 -0.26 0.00 0.00 58.87 55.64 2f08 n SER 24 Cb 0.00 -0.54 0.03 0.00 -0.26 0.00 0.00 64.21 63.44 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 -1.21 5.76 0.01 4.04 1.01 -0.87 -4.91 116.67 120.49 2f08 s ASP 25 Ca 0.45 1.56 -0.35 0.00 0.71 0.00 0.00 52.55 54.92 2f08 s ASP 25 Cb 0.32 -2.49 -0.14 0.00 1.01 0.00 0.00 42.92 41.62 2f08 s ASP 25 CO 0.17 -1.19 1.65 -2.65 0.21 0.00 0.00 175.17 173.37 2f08 n PRO 26 N -2.84 1.85 -3.44 8.23 -0.02 -1.26 -4.72 135.00 132.80 2f08 n PRO 26 Ca 0.07 0.67 -0.41 0.00 -2.02 0.00 0.00 63.50 61.81 2f08 n PRO 26 Cb 0.54 -2.43 -0.10 0.00 -0.02 0.00 0.00 33.50 31.49 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 1.92 5.10 -0.27 0.00 -1.09 -1.26 -0.97 121.20 124.63 2f08 s ILE 28 Ca 0.10 0.91 -0.10 0.00 -2.23 0.00 0.00 60.65 59.33 2f08 s ILE 28 Cb -0.17 -3.83 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 2f08 s ILE 28 CO 0.11 0.15 0.16 -0.63 -1.23 0.00 0.00 174.94 173.50 2f08 s ILE 29 N 1.88 5.04 -0.38 2.92 1.01 0.23 -4.95 121.20 126.95 2f08 s ILE 29 Ca 0.23 0.08 -0.16 0.00 0.00 0.00 0.00 60.65 60.79 2f08 s ILE 29 Cb -0.15 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 38.93 2f08 s ILE 29 CO 0.09 0.28 0.41 -1.00 0.00 0.00 0.00 174.94 174.72 2f08 s HIS 30 N 1.70 3.19 0.34 3.97 3.76 -1.26 -0.80 115.29 126.19 2f08 s HIS 30 Ca 0.07 -0.15 -0.27 0.00 -0.15 0.00 0.00 55.06 54.56 2f08 s HIS 30 Cb -0.16 -2.79 -0.13 0.00 1.11 0.00 0.00 32.58 30.62 2f08 s HIS 30 CO 0.09 -0.56 1.06 0.54 -0.85 0.00 0.00 174.74 175.02 2f08 n ARG 31 N 5.51 1.50 0.00 1.40 1.74 -0.43 -0.67 116.66 125.72 2f08 n ARG 31 Ca -0.08 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 2f08 n ARG 31 Cb 0.48 -1.99 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 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 1.13 2.95 3.71 -0.13 0.00 0.15 -4.74 105.19 108.26 2f08 n GLY 32 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 2.87 0.39 1.61 3.01 0.16 -4.94 119.74 122.85 2f08 s LYS 33 Ca 0.00 -0.56 -0.26 0.00 -1.01 0.00 0.00 55.97 54.13 2f08 s LYS 33 Cb 0.00 -2.73 -0.09 0.00 -1.01 0.00 0.00 37.83 34.00 2f08 s LYS 33 CO 0.00 0.64 1.30 -1.25 0.51 0.00 0.00 175.35 176.55 2f08 s PRO 34 N -1.56 4.03 -0.31 -1.68 0.04 -1.26 -4.01 135.00 130.25 2f08 s PRO 34 Ca 0.20 2.17 -0.03 0.00 0.04 0.00 0.00 61.00 63.38 2f08 s PRO 34 Cb -0.12 -2.80 0.05 0.00 0.04 0.00 0.00 34.50 31.67 2f08 s PRO 34 CO 0.11 -0.45 0.02 0.12 0.04 0.00 0.00 177.00 176.84 2f08 s PHE 35 N -1.24 3.26 -0.24 0.56 5.36 0.48 -4.93 117.98 121.22 2f08 s PHE 35 Ca 0.56 -1.80 -0.11 0.00 -0.96 0.00 0.00 56.93 54.62 2f08 s PHE 35 Cb -0.38 -2.15 -0.05 0.00 -0.34 0.00 0.00 43.02 40.10 2f08 s PHE 35 CO 0.50 -0.79 0.17 0.99 -1.46 0.00 0.00 175.22 174.62 2f08 s THR 36 N 1.28 5.35 0.20 0.12 2.01 -1.26 0.14 115.64 123.48 2f08 s THR 36 Ca -0.04 0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.20 2f08 s THR 36 Cb -0.20 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 2f08 s THR 36 CO -0.00 0.33 -0.08 -1.48 -0.69 0.00 0.00 174.62 172.70 2f08 s LEU 37 N 1.16 2.43 -0.08 4.42 0.05 -0.62 -0.40 118.68 125.64 2f08 s LEU 37 Ca 0.08 -1.10 -0.04 0.00 0.05 0.00 0.00 54.13 53.12 2f08 s LEU 37 Cb -0.14 -0.43 0.04 0.00 -2.05 0.00 0.00 46.19 43.61 2f08 s LEU 37 CO 0.05 -0.35 0.19 -0.70 -0.55 0.00 0.00 176.35 174.99 2f08 s GLU 38 N -3.76 0.15 -0.05 1.48 2.12 0.15 -1.40 118.70 117.40 2f08 s GLU 38 Ca 0.23 0.40 0.03 0.00 0.36 0.00 0.00 54.97 55.99 2f08 s GLU 38 Cb 0.03 -0.10 0.01 0.00 0.26 0.00 0.00 34.13 34.32 2f08 s GLU 38 CO 0.06 -0.14 -0.14 0.00 -0.54 0.00 0.00 175.26 174.50 2f08 s ALA 39 N 0.98 1.31 -0.23 6.30 0.00 -0.08 -0.52 121.76 129.51 2f08 s ALA 39 Ca -0.07 -0.50 -0.07 0.00 0.00 0.00 0.00 51.96 51.31 2f08 s ALA 39 Cb -0.09 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 2f08 s ALA 39 CO -0.06 0.17 0.07 -1.17 0.00 0.00 0.00 175.76 174.78 2f08 s LEU 40 N 0.40 3.55 0.12 0.00 2.96 0.08 -1.12 118.68 124.66 2f08 s LEU 40 Ca -0.10 -0.13 -0.09 0.00 -0.22 0.00 0.00 54.13 53.60 2f08 s LEU 40 Cb -0.14 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 2f08 s LEU 40 CO 0.03 0.02 0.22 0.72 -1.32 0.00 0.00 176.35 176.02 2f08 s PHE 41 N 1.29 0.25 -0.15 5.38 -0.71 0.25 0.33 117.98 124.61 2f08 s PHE 41 Ca 0.05 -0.65 -0.04 0.00 -1.04 0.00 0.00 56.93 55.25 2f08 s PHE 41 Cb -0.15 -0.06 -0.03 0.00 -1.21 0.00 0.00 43.02 41.57 2f08 s PHE 41 CO 0.04 -0.61 -0.02 -0.51 -1.34 0.00 0.00 175.22 172.78 2f08 s ASP 42 N -2.90 4.97 0.19 1.98 -0.00 -0.45 0.94 116.67 121.40 2f08 s ASP 42 Ca 0.10 -0.07 -0.31 0.00 -0.00 0.00 0.00 52.55 52.26 2f08 s ASP 42 Cb 0.04 -1.79 -0.10 0.00 -0.00 0.00 0.00 42.92 41.08 2f08 s ASP 42 CO -0.07 0.19 1.50 0.00 -0.00 0.00 0.00 175.17 176.79 2f08 s ALA 43 N 0.26 3.71 -0.29 5.23 0.00 -0.07 -4.81 121.76 125.79 2f08 s ALA 43 Ca -0.02 1.33 0.11 0.00 0.00 0.00 0.00 51.96 53.38 2f08 s ALA 43 Cb -0.14 -3.59 0.69 0.00 0.00 0.00 0.00 23.12 20.09 2f08 s ALA 43 CO 0.02 -0.75 1.71 0.27 0.00 0.00 0.00 175.76 177.01 2f08 n ASN 44 N 3.43 4.50 -3.61 0.00 0.23 -1.26 0.22 115.26 118.77 2f08 n ASN 44 Ca 0.11 -3.23 -0.00 0.00 -0.53 0.00 0.00 54.58 50.93 2f08 n ASN 44 Cb 0.40 -0.70 -0.01 0.00 -2.08 0.00 0.00 39.78 37.38 2f08 n ASN 44 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2f08 s GLN 45 N -2.98 0.08 -0.21 -3.83 -2.07 -1.26 -4.94 119.66 104.45 2f08 s GLN 45 Ca 0.52 -0.04 -0.12 0.00 -1.82 0.00 0.00 55.36 53.90 2f08 s GLN 45 Cb 0.42 0.03 -0.05 0.00 -1.09 0.00 0.00 33.01 32.33 2f08 s GLN 45 CO 0.11 -0.04 0.23 -0.80 -1.32 0.00 0.00 175.29 173.48 2f08 s ASN 46 N -2.42 6.26 -0.02 12.60 -0.87 -1.26 -2.84 114.94 126.40 2f08 s ASN 46 Ca 0.13 0.30 -0.07 0.00 -1.57 0.00 0.00 52.86 51.64 2f08 s ASN 46 Cb 0.02 -2.14 0.01 0.00 -0.02 0.00 0.00 41.25 39.12 2f08 s ASN 46 CO -0.04 0.07 0.16 0.28 -2.57 0.00 0.00 177.10 175.00 2f08 s THR 47 N 0.84 0.05 -0.04 1.60 -1.32 -0.95 -4.79 115.64 111.03 2f08 s THR 47 Ca 0.12 -0.43 -0.04 0.00 -1.21 0.00 0.00 61.69 60.13 2f08 s THR 47 Cb -0.13 -0.38 -0.27 0.00 -1.51 0.00 0.00 72.50 70.20 2f08 s THR 47 CO 0.04 -0.23 0.70 0.11 -2.21 0.00 0.00 174.62 173.02 2f08 h LYS 48 N 4.83 0.25 -6.19 7.08 1.57 -1.94 0.52 116.57 122.70 2f08 h LYS 48 Ca -0.29 -0.43 -0.53 0.00 -1.87 0.00 0.00 60.65 57.53 2f08 h LYS 48 Cb 1.19 0.16 -0.07 0.00 0.08 0.00 0.00 32.23 33.59 2f08 h LYS 48 CO 0.40 1.10 -0.58 0.95 -0.57 0.00 0.00 179.45 180.76 2f08 s THR 49 N -2.60 3.81 -0.17 -0.16 -4.23 -1.26 -4.45 115.64 106.58 2f08 s THR 49 Ca -0.13 -1.66 -0.10 0.00 -1.18 0.00 0.00 61.69 58.63 2f08 s THR 49 Cb 0.07 -3.10 0.06 0.00 1.34 0.00 0.00 72.50 70.87 2f08 s THR 49 CO 0.83 -0.34 0.42 0.00 -0.54 0.00 0.00 174.62 174.99 2f08 s ALA 50 N -2.26 -1.07 -0.05 3.99 0.00 -1.26 -3.97 121.76 117.14 2f08 s ALA 50 Ca 0.33 1.54 0.05 0.00 0.00 0.00 0.00 51.96 53.88 2f08 s ALA 50 Cb -0.07 -0.93 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 2f08 s ALA 50 CO 0.22 -0.27 -0.21 0.21 0.00 0.00 0.00 175.76 175.72 2f08 s LYS 51 N 1.37 2.12 -0.14 0.00 2.20 0.20 -0.85 119.74 124.63 2f08 s LYS 51 Ca -0.09 -0.75 0.01 0.00 -0.36 0.00 0.00 55.97 54.77 2f08 s LYS 51 Cb -0.08 -1.83 -0.01 0.00 -1.51 0.00 0.00 37.83 34.40 2f08 s LYS 51 CO -0.12 0.32 -0.16 -1.50 -0.36 0.00 0.00 175.35 173.53 2f08 s ILE 52 N -0.10 2.71 -0.03 5.43 2.07 -0.30 0.14 121.20 131.13 2f08 s ILE 52 Ca -0.03 -0.77 0.07 0.00 -1.41 0.00 0.00 60.65 58.51 2f08 s ILE 52 Cb -0.12 -2.13 -0.01 0.00 0.13 0.00 0.00 42.46 40.32 2f08 s ILE 52 CO 0.03 0.52 -0.23 -1.61 -1.91 0.00 0.00 174.94 171.74 2f08 s GLU 53 N 0.62 2.01 -0.06 3.50 2.02 0.17 -4.64 118.70 122.32 2f08 s GLU 53 Ca -0.09 -0.82 0.01 0.00 0.02 0.00 0.00 54.97 54.09 2f08 s GLU 53 Cb -0.16 -1.86 0.02 0.00 0.10 0.00 0.00 34.13 32.23 2f08 s GLU 53 CO 0.03 0.45 -0.08 0.42 0.02 0.00 0.00 175.26 176.10 2f08 s ILE 54 N -0.41 0.87 0.16 -1.63 1.01 -1.26 -1.14 121.20 118.80 2f08 s ILE 54 Ca 0.05 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.45 2f08 s ILE 54 Cb -0.10 -0.84 -0.05 0.00 0.01 0.00 0.00 42.46 41.48 2f08 s ILE 54 CO 0.00 0.31 -0.09 -0.54 0.00 0.00 0.00 174.94 174.62 2f08 s LYS 55 N 0.96 1.10 -0.03 2.79 1.02 -0.93 -4.62 119.74 120.02 2f08 s LYS 55 Ca -0.10 -1.48 0.03 0.00 0.02 0.00 0.00 55.97 54.45 2f08 s LYS 55 Cb -0.15 -0.63 -0.00 0.00 -0.52 0.00 0.00 37.83 36.54 2f08 s LYS 55 CO 0.00 0.06 -0.13 0.00 -0.92 0.00 0.00 175.35 174.36 2f08 s ALA 56 N -3.33 1.17 -0.07 5.17 0.00 -0.69 -1.41 121.76 122.59 2f08 s ALA 56 Ca 0.18 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 51.67 2f08 s ALA 56 Cb 0.03 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.73 2f08 s ALA 56 CO 0.02 0.21 -0.16 0.45 0.00 0.00 0.00 175.76 176.27 2f08 s SER 57 N 0.10 3.86 -0.29 0.00 0.15 0.24 -1.08 113.70 116.68 2f08 s SER 57 Ca -0.03 -0.28 -0.10 0.00 0.70 0.00 0.00 55.95 56.24 2f08 s SER 57 Cb -0.10 -1.01 0.12 0.00 -1.71 0.00 0.00 66.02 63.32 2f08 s SER 57 CO 0.01 0.29 0.62 -1.48 1.20 0.00 0.00 173.24 173.88 2f08 s LEU 58 N -0.39 -1.09 -1.16 3.45 2.34 0.24 -1.07 118.68 121.02 2f08 s LEU 58 Ca 0.04 1.51 -0.27 0.00 0.06 0.00 0.00 54.13 55.47 2f08 s LEU 58 Cb -0.12 2.20 0.02 0.00 -0.56 0.00 0.00 46.19 47.73 2f08 s LEU 58 CO 0.02 -0.22 0.72 0.47 -1.06 0.00 0.00 176.35 176.28 2f08 n ASP 59 N 5.42 -4.70 0.00 1.48 10.43 -1.26 -1.54 116.55 126.38 2f08 n ASP 59 Ca -0.12 -1.16 0.00 0.00 2.57 0.00 0.00 54.79 56.08 2f08 n ASP 59 Cb 0.49 -2.36 0.00 0.00 1.84 0.00 0.00 41.12 41.09 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 -1.91 0.38 3.09 0.44 0.00 -1.26 -5.00 105.19 100.93 2f08 n GLY 60 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 2.00 -0.11 0.99 2.96 -0.59 -5.13 118.68 118.80 2f08 s LEU 61 Ca 0.00 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.69 2f08 s LEU 61 Cb 0.00 -0.70 -0.01 0.00 0.50 0.00 0.00 46.19 45.98 2f08 s LEU 61 CO 0.00 0.16 -0.21 -0.70 -1.32 0.00 0.00 176.35 174.28 2f08 s GLU 62 N -0.26 3.12 0.14 1.98 2.12 -1.26 -0.59 118.70 123.95 2f08 s GLU 62 Ca 0.04 -0.82 0.09 0.00 0.36 0.00 0.00 54.97 54.64 2f08 s GLU 62 Cb -0.06 -2.40 -0.04 0.00 0.26 0.00 0.00 34.13 31.90 2f08 s GLU 62 CO -0.00 0.21 -0.20 0.96 -0.54 0.00 0.00 175.26 175.68 2f08 s ILE 63 N 0.30 1.85 0.19 -3.70 -4.36 -0.24 -4.98 121.20 110.26 2f08 s ILE 63 Ca -0.15 -1.77 -0.09 0.00 -0.26 0.00 0.00 60.65 58.38 2f08 s ILE 63 Cb -0.17 -1.76 -0.01 0.00 1.25 0.00 0.00 42.46 41.76 2f08 s ILE 63 CO 0.08 -0.17 0.31 1.51 0.24 0.00 0.00 174.94 176.91 2f08 s ASP 64 N -2.33 0.02 -0.25 4.36 -4.77 -1.26 -1.71 116.67 110.74 2f08 s ASP 64 Ca 0.12 -0.97 -0.04 0.00 -3.30 0.00 0.00 52.55 48.36 2f08 s ASP 64 Cb -0.08 0.47 0.01 0.00 -1.09 0.00 0.00 42.92 42.23 2f08 s ASP 64 CO 0.06 -0.95 -0.02 -0.69 0.70 0.00 0.00 175.17 174.27 2f08 s VAL 65 N -4.01 3.33 0.48 2.11 1.01 -1.26 -5.07 120.40 116.98 2f08 s VAL 65 Ca 0.22 -0.75 -0.19 0.00 0.00 0.00 0.00 61.98 61.26 2f08 s VAL 65 Cb 0.03 -2.63 -0.09 0.00 0.00 0.00 0.00 36.38 33.69 2f08 s VAL 65 CO 0.04 0.25 1.00 -2.16 0.00 0.00 0.00 175.10 174.24 2f08 s PRO 66 N 1.43 3.93 0.00 2.72 0.04 -1.26 -3.90 135.00 137.95 2f08 s PRO 66 Ca 0.03 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.24 2f08 s PRO 66 Cb -0.16 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2f08 s PRO 66 CO -0.02 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.13 2f08 n GLY 67 N -0.73 0.75 3.93 0.56 0.00 -1.26 -5.05 105.19 103.39 2f08 n GLY 67 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.68 5.08 -0.37 -0.61 -4.36 -1.25 -5.03 121.20 111.98 2f08 s ILE 68 Ca 0.00 -0.30 -0.29 0.00 -0.26 0.00 0.00 60.65 59.80 2f08 s ILE 68 Cb 0.00 -3.83 0.01 0.00 1.25 0.00 0.00 42.46 39.89 2f08 s ILE 68 CO 0.00 -0.51 1.27 -0.62 0.24 0.00 0.00 174.94 175.32 2f08 s ASP 69 N -3.80 6.60 -0.02 4.36 3.68 -1.26 -4.87 116.67 121.35 2f08 s ASP 69 Ca 0.41 0.92 0.17 0.00 2.13 0.00 0.00 52.55 56.18 2f08 s ASP 69 Cb -0.10 -2.54 0.53 0.00 -1.45 0.00 0.00 42.92 39.36 2f08 s ASP 69 CO 0.35 -1.19 1.44 0.35 0.13 0.00 0.00 175.17 176.25 2f08 n THR 70 N 6.55 1.17 -2.83 1.71 -2.24 -1.26 -4.86 114.28 112.52 2f08 n THR 70 Ca 0.14 -1.07 -0.43 0.00 -2.27 0.00 0.00 64.05 60.43 2f08 n THR 70 Cb 0.48 0.42 -0.04 0.00 -2.10 0.00 0.00 70.33 69.08 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 -1.03 6.20 0.57 3.42 3.04 -1.26 -1.14 114.94 124.74 2f08 s ASN 71 Ca 0.40 -0.83 0.32 0.00 0.04 0.00 0.00 52.86 52.78 2f08 s ASN 71 Cb 0.22 -2.43 1.74 0.00 -1.54 0.00 0.00 41.25 39.23 2f08 s ASN 71 CO 0.25 -1.43 2.17 0.00 -3.04 0.00 0.00 177.10 175.04 2f08 h ALA 72 N 9.56 1.26 0.00 1.71 0.00 -1.31 -2.00 119.26 128.47 2f08 h ALA 72 Ca -0.28 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2f08 h ALA 72 Cb 1.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2f08 h ALA 72 CO 1.17 0.07 0.00 0.00 0.00 0.00 0.00 179.25 180.49 2f08 n HIS 74 N -0.99 0.00 0.00 0.00 8.25 -0.75 -4.33 115.22 117.39 2f08 n HIS 74 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2f08 n HIS 74 Cb 0.03 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.11 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 -0.33 0.00 -4.12 4.41 3.72 0.75 -5.06 117.46 116.83 2f08 n PHE 75 Ca 0.09 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.40 2f08 n PHE 75 Cb 0.43 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.86 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 -1.99 0.51 -0.45 -4.37 -7.23 -0.78 -4.78 120.40 101.32 2f08 s VAL 76 Ca 0.00 -1.72 -0.28 0.00 -1.81 0.00 0.00 61.98 58.17 2f08 s VAL 76 Cb 0.00 -1.41 -0.01 0.00 0.56 0.00 0.00 36.38 35.53 2f08 s VAL 76 CO 0.00 -0.82 1.65 -0.54 -0.31 0.00 0.00 175.10 175.08 2f08 s LYS 77 N -3.41 3.24 0.21 4.82 -0.14 -1.26 -4.49 119.74 118.72 2f08 s LYS 77 Ca 0.06 0.97 0.04 0.00 -1.36 0.00 0.00 55.97 55.68 2f08 s LYS 77 Cb 0.03 -4.18 -0.03 0.00 -1.68 0.00 0.00 37.83 31.97 2f08 s LYS 77 CO -0.05 -1.98 0.30 0.00 -0.76 0.00 0.00 175.35 172.86 2f08 s PRO 79 N -3.68 2.11 0.10 0.00 0.04 -1.26 -5.12 135.00 127.20 2f08 s PRO 79 Ca 0.34 1.07 -0.19 0.00 0.04 0.00 0.00 61.00 62.26 2f08 s PRO 79 Cb -0.10 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 2f08 s PRO 79 CO 0.28 -1.71 0.58 -0.51 0.04 0.00 0.00 177.00 175.68 2f08 s LEU 80 N -5.95 4.48 -0.27 -3.56 1.43 0.18 -4.92 118.68 110.08 2f08 s LEU 80 Ca 0.61 1.25 -0.09 0.00 -1.03 0.00 0.00 54.13 54.87 2f08 s LEU 80 Cb -0.17 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.98 2f08 s LEU 80 CO 0.56 0.22 0.13 -0.69 0.23 0.00 0.00 176.35 176.80 2f08 s VAL 81 N -1.21 4.82 0.19 -1.59 1.01 -1.26 -2.23 120.40 120.12 2f08 s VAL 81 Ca 0.32 -0.00 -0.32 0.00 0.00 0.00 0.00 61.98 61.98 2f08 s VAL 81 Cb -0.19 -3.28 -0.15 0.00 0.00 0.00 0.00 36.38 32.76 2f08 s VAL 81 CO 0.19 0.29 1.19 1.17 0.00 0.00 0.00 175.10 177.95 2f08 n LYS 82 N 4.99 1.33 0.00 2.72 4.81 -1.13 -1.53 118.16 129.35 2f08 n LYS 82 Ca -0.15 0.47 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 2f08 n LYS 82 Cb 0.52 -1.99 0.00 0.00 0.02 0.00 0.00 35.03 33.58 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 1.99 2.94 3.80 3.14 0.00 0.13 -4.93 105.19 112.27 2f08 n GLY 83 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.18 3.75 -0.07 1.61 0.74 -0.58 -4.67 119.66 120.25 2f08 s GLN 84 Ca 0.00 1.27 -0.10 0.00 0.05 0.00 0.00 55.36 56.58 2f08 s GLN 84 Cb 0.00 -2.09 -0.05 0.00 1.10 0.00 0.00 33.01 31.97 2f08 s GLN 84 CO 0.00 -0.46 0.26 -1.14 -0.55 0.00 0.00 175.29 173.40 2f08 s GLN 85 N -3.47 3.66 0.07 1.67 0.74 -1.26 -0.89 119.66 120.19 2f08 s GLN 85 Ca 0.65 0.10 0.06 0.00 0.05 0.00 0.00 55.36 56.23 2f08 s GLN 85 Cb -0.15 -3.21 -0.03 0.00 1.10 0.00 0.00 33.01 30.72 2f08 s GLN 85 CO 0.24 0.73 -0.17 0.71 -0.55 0.00 0.00 175.29 176.24 2f08 s TYR 86 N -1.01 1.51 -0.22 1.67 1.51 0.27 -4.97 117.35 116.10 2f08 s TYR 86 Ca 0.19 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.85 2f08 s TYR 86 Cb -0.14 -0.85 0.04 0.00 -0.11 0.00 0.00 41.96 40.90 2f08 s TYR 86 CO 0.08 0.11 -0.13 0.34 -1.11 0.00 0.00 175.55 174.84 2f08 s ASP 87 N -1.61 3.83 -0.16 2.29 2.15 -1.26 -0.59 116.67 121.32 2f08 s ASP 87 Ca 0.03 -1.07 -0.01 0.00 0.43 0.00 0.00 52.55 51.93 2f08 s ASP 87 Cb -0.09 -1.46 -0.01 0.00 -0.30 0.00 0.00 42.92 41.06 2f08 s ASP 87 CO 0.03 -0.13 -0.12 -0.51 -0.17 0.00 0.00 175.17 174.27 2f08 s ILE 88 N 1.22 2.90 -0.26 4.11 2.07 -0.27 -4.85 121.20 126.12 2f08 s ILE 88 Ca -0.03 -0.69 -0.06 0.00 -1.41 0.00 0.00 60.65 58.46 2f08 s ILE 88 Cb -0.17 -2.24 -0.00 0.00 0.13 0.00 0.00 42.46 40.17 2f08 s ILE 88 CO -0.08 0.50 0.03 -0.54 -1.91 0.00 0.00 174.94 172.94 2f08 s LYS 89 N 0.85 3.29 -0.04 3.50 1.02 -1.26 -0.91 119.74 126.19 2f08 s LYS 89 Ca -0.04 -0.71 0.02 0.00 0.02 0.00 0.00 55.97 55.26 2f08 s LYS 89 Cb -0.15 -3.22 0.01 0.00 -0.52 0.00 0.00 37.83 33.95 2f08 s LYS 89 CO -0.00 -0.31 -0.08 -0.47 -0.92 0.00 0.00 175.35 173.58 2f08 s TYR 90 N 1.51 0.97 -0.29 3.18 6.14 -0.49 -5.01 117.35 123.36 2f08 s TYR 90 Ca 0.04 -0.29 -0.11 0.00 0.64 0.00 0.00 57.07 57.35 2f08 s TYR 90 Cb -0.16 -0.76 -0.04 0.00 0.42 0.00 0.00 41.96 41.42 2f08 s TYR 90 CO 0.00 -0.18 0.19 0.99 0.64 0.00 0.00 175.55 177.19 2f08 s THR 91 N 0.62 5.18 -0.21 4.34 2.01 -1.26 -1.59 115.64 124.73 2f08 s THR 91 Ca -0.10 0.04 -0.09 0.00 0.31 0.00 0.00 61.69 61.85 2f08 s THR 91 Cb -0.13 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 2f08 s THR 91 CO 0.01 0.20 0.10 0.86 -0.69 0.00 0.00 174.62 175.10 2f08 s TRP 92 N 1.73 3.25 -0.72 4.92 -0.00 0.37 -4.87 118.94 123.63 2f08 s TRP 92 Ca 0.07 0.06 -0.10 0.00 -0.00 0.00 0.00 56.10 56.13 2f08 s TRP 92 Cb -0.16 -2.18 0.19 0.00 -0.00 0.00 0.00 33.47 31.32 2f08 s TRP 92 CO 0.10 0.05 0.61 -0.80 -0.00 0.00 0.00 176.95 176.91 2f08 s ASN 93 N 0.81 6.11 0.01 5.86 0.01 -1.26 0.18 114.94 126.67 2f08 s ASN 93 Ca 0.05 -2.67 -0.30 0.00 -0.71 0.00 0.00 52.86 49.23 2f08 s ASN 93 Cb -0.13 -2.07 -0.06 0.00 0.41 0.00 0.00 41.25 39.40 2f08 s ASN 93 CO 0.02 -0.52 1.45 -0.69 -1.51 0.00 0.00 177.10 175.86 2f08 s VAL 94 N 0.21 3.59 0.64 1.60 1.01 -1.26 -4.95 120.40 121.25 2f08 s VAL 94 Ca 0.16 0.98 -0.15 0.00 0.00 0.00 0.00 61.98 62.96 2f08 s VAL 94 Cb -0.16 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 2f08 s VAL 94 CO -0.06 -0.00 1.10 -2.16 0.00 0.00 0.00 175.10 173.98 2f08 s PRO 95 N 2.48 2.92 0.53 2.72 0.04 -1.26 0.34 135.00 142.77 2f08 s PRO 95 Ca 0.66 1.38 0.23 0.00 0.04 0.00 0.00 61.00 63.31 2f08 s PRO 95 Cb -0.33 -1.97 1.45 0.00 0.04 0.00 0.00 34.50 33.69 2f08 s PRO 95 CO 0.27 -1.15 2.14 0.87 0.04 0.00 0.00 177.00 179.17 2f08 h LYS 96 N 0.18 0.00 0.00 4.56 1.57 -1.92 -1.98 116.57 118.99 2f08 h LYS 96 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2f08 h LYS 96 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2f08 h LYS 96 CO 0.55 0.07 0.00 1.51 -0.57 0.00 0.00 179.45 181.00 2f08 n ILE 97 N -4.05 0.85 -1.72 1.86 0.13 -1.26 -4.73 119.36 110.43 2f08 n ILE 97 Ca -0.03 0.20 -0.42 0.00 -1.10 0.00 0.00 62.75 61.40 2f08 n ILE 97 Cb 0.15 -1.06 -0.03 0.00 -0.84 0.00 0.00 39.64 37.87 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 -1.68 2.79 -1.66 1.51 0.00 -0.74 -4.93 120.51 115.80 2f08 n ALA 98 Ca 0.03 0.40 -0.35 0.00 0.00 0.00 0.00 53.44 53.52 2f08 n ALA 98 Cb 0.22 -2.51 0.04 0.00 0.00 0.00 0.00 19.45 17.20 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 0.96 2.90 0.37 0.00 0.04 -1.26 -5.00 135.00 133.02 2f08 s PRO 99 Ca 0.74 1.71 -0.19 0.00 0.04 0.00 0.00 61.00 63.30 2f08 s PRO 99 Cb -0.51 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.00 2f08 s PRO 99 CO 0.34 -1.23 0.85 0.15 0.04 0.00 0.00 177.00 177.15 2f08 s LYS 100 N -3.52 4.15 -0.18 4.56 1.02 -1.26 -4.88 119.74 119.62 2f08 s LYS 100 Ca 0.74 0.92 -0.28 0.00 0.02 0.00 0.00 55.97 57.38 2f08 s LYS 100 Cb -0.27 -2.34 0.10 0.00 -0.52 0.00 0.00 37.83 34.80 2f08 s LYS 100 CO 0.35 0.08 0.87 0.45 -0.92 0.00 0.00 175.35 176.18 2f08 s SER 101 N -2.18 -0.54 0.00 2.83 0.15 -0.71 -4.96 113.70 108.29 2f08 s SER 101 Ca 0.57 0.80 0.24 0.00 0.70 0.00 0.00 55.95 58.27 2f08 s SER 101 Cb -0.10 0.73 0.23 0.00 -1.71 0.00 0.00 66.02 65.17 2f08 s SER 101 CO 0.16 -0.34 1.27 -0.62 1.20 0.00 0.00 173.24 174.91 2f08 n GLU 102 N 1.53 2.04 -3.57 5.44 -0.58 -1.26 -0.37 120.64 123.87 2f08 n GLU 102 Ca -0.14 -1.65 -0.27 0.00 -0.42 0.00 0.00 57.16 54.68 2f08 n GLU 102 Cb 0.57 -1.47 -0.11 0.00 -0.57 0.00 0.00 31.44 29.86 2f08 n GLU 102 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2f08 n ASN 103 N 0.96 0.95 -4.08 1.62 3.02 -1.26 -4.74 115.26 111.73 2f08 n ASN 103 Ca 0.13 -2.72 -0.26 0.00 -0.03 0.00 0.00 54.58 51.70 2f08 n ASN 103 Cb 0.55 -0.63 -0.17 0.00 -0.61 0.00 0.00 39.78 38.92 2f08 n ASN 103 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2f08 s VAL 104 N -0.63 1.37 -0.21 2.41 0.11 -0.85 -4.31 120.40 118.28 2f08 s VAL 104 Ca 0.30 -0.62 -0.11 0.00 -2.93 0.00 0.00 61.98 58.62 2f08 s VAL 104 Cb 0.02 -1.22 -0.05 0.00 -1.53 0.00 0.00 36.38 33.60 2f08 s VAL 104 CO -0.18 0.41 0.17 -0.69 -3.33 0.00 0.00 175.10 171.47 2f08 s VAL 105 N 0.54 5.37 -0.11 2.04 1.01 -0.23 -1.83 120.40 127.19 2f08 s VAL 105 Ca -0.15 0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 2f08 s VAL 105 Cb -0.16 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 2f08 s VAL 105 CO 0.05 0.39 -0.01 -0.69 0.00 0.00 0.00 175.10 174.84 2f08 s VAL 106 N 0.72 4.22 -0.07 2.92 1.01 -0.43 0.80 120.40 129.56 2f08 s VAL 106 Ca 0.09 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.84 2f08 s VAL 106 Cb -0.12 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.46 2f08 s VAL 106 CO 0.02 0.56 -0.19 0.42 0.00 0.00 0.00 175.10 175.91 2f08 s THR 107 N -0.42 1.61 -0.16 3.92 -4.23 -0.50 -0.11 115.64 115.76 2f08 s THR 107 Ca 0.08 -0.78 -0.01 0.00 -1.18 0.00 0.00 61.69 59.79 2f08 s THR 107 Cb -0.12 -1.41 -0.01 0.00 1.34 0.00 0.00 72.50 72.30 2f08 s THR 107 CO 0.02 0.46 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.76 2f08 s VAL 108 N 0.32 3.08 -0.03 2.29 1.01 -0.34 -2.18 120.40 124.55 2f08 s VAL 108 Ca -0.12 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.24 2f08 s VAL 108 Cb -0.15 -2.33 0.01 0.00 0.00 0.00 0.00 36.38 33.91 2f08 s VAL 108 CO 0.05 0.50 -0.05 -0.75 0.00 0.00 0.00 175.10 174.85 2f08 s LYS 109 N 0.75 0.67 -0.12 2.72 2.20 -0.29 -1.47 119.74 124.21 2f08 s LYS 109 Ca -0.05 -0.13 -0.00 0.00 -0.36 0.00 0.00 55.97 55.43 2f08 s LYS 109 Cb -0.15 -0.68 -0.02 0.00 -1.51 0.00 0.00 37.83 35.46 2f08 s LYS 109 CO 0.01 -0.01 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.38 2f08 s LEU 110 N 0.54 2.87 0.00 5.43 2.01 -0.32 -0.66 118.68 128.56 2f08 s LEU 110 Ca -0.07 -0.24 0.08 0.00 0.01 0.00 0.00 54.13 53.92 2f08 s LEU 110 Cb -0.10 -1.65 -0.02 0.00 0.01 0.00 0.00 46.19 44.43 2f08 s LEU 110 CO -0.00 0.21 -0.25 -0.63 1.01 0.00 0.00 176.35 176.69 2f08 s ILE 111 N 0.08 2.01 0.31 -0.59 1.09 0.12 0.32 121.20 124.54 2f08 s ILE 111 Ca -0.04 -1.17 0.01 0.00 -1.10 0.00 0.00 60.65 58.35 2f08 s ILE 111 Cb -0.14 -1.68 -0.00 0.00 -1.06 0.00 0.00 42.46 39.57 2f08 s ILE 111 CO 0.04 0.48 0.03 0.61 -0.10 0.00 0.00 174.94 176.00 2f08 n GLY 112 N 2.23 3.72 0.22 6.18 0.00 0.18 -0.63 105.19 117.08 2f08 n GLY 112 Ca -0.16 -2.23 -0.00 0.00 0.00 0.00 0.00 46.02 43.62 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 0.86 -0.13 -0.65 1.61 3.45 -1.89 -2.33 116.42 117.33 2f08 h ASP 113 Ca -0.25 0.12 -0.17 0.00 0.43 0.00 0.00 57.03 57.16 2f08 h ASP 113 Cb 0.81 0.20 -0.10 0.00 -0.56 0.00 0.00 39.33 39.67 2f08 h ASP 113 CO 0.41 -0.05 0.22 0.59 -1.57 0.00 0.00 179.24 178.84 2f08 n ASN 114 N -5.20 4.62 0.00 6.45 4.13 -1.26 -5.05 115.26 118.96 2f08 n ASN 114 Ca 0.08 -3.05 0.00 0.00 1.68 0.00 0.00 54.58 53.28 2f08 n ASN 114 Cb 0.31 -0.72 0.00 0.00 -1.54 0.00 0.00 39.78 37.83 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 -0.02 0.36 3.72 7.41 0.00 -0.88 -5.05 105.19 110.74 2f08 n GLY 115 Ca 0.35 -2.29 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 2f08 n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f08 s VAL 116 N -0.10 2.18 -0.18 1.61 1.01 -1.26 0.47 120.40 124.13 2f08 s VAL 116 Ca 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.95 2f08 s VAL 116 Cb 0.00 -3.09 -0.22 0.00 0.00 0.00 0.00 36.38 33.08 2f08 s VAL 116 CO 0.00 0.01 0.28 0.25 0.00 0.00 0.00 175.10 175.64 2f08 h LEU 117 N 6.47 0.14 -7.03 3.92 5.85 -0.44 -3.45 115.31 120.77 2f08 h LEU 117 Ca -0.44 -0.65 -0.03 0.00 0.84 0.00 0.00 57.88 57.60 2f08 h LEU 117 Cb 1.20 -0.05 -0.14 0.00 0.37 0.00 0.00 40.66 42.05 2f08 h LEU 117 CO 0.92 1.61 0.18 0.00 -0.34 0.00 0.00 178.44 180.81 2f08 s ALA 118 N -2.43 -1.59 -0.22 1.25 0.00 -1.02 -4.64 121.76 113.11 2f08 s ALA 118 Ca -0.27 0.65 -0.09 0.00 0.00 0.00 0.00 51.96 52.25 2f08 s ALA 118 Cb 0.06 0.66 0.09 0.00 0.00 0.00 0.00 23.12 23.92 2f08 s ALA 118 CO 0.65 -0.66 0.49 0.00 0.00 0.00 0.00 175.76 176.24 2f08 s ALA 120 N 2.17 0.01 -0.17 0.00 0.00 -0.54 -0.51 121.76 122.72 2f08 s ALA 120 Ca -0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2f08 s ALA 120 Cb -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 2f08 s ALA 120 CO -0.15 -0.00 -0.11 0.42 0.00 0.00 0.00 175.76 175.92 2f08 s ILE 121 N -0.03 2.96 -0.47 0.00 1.01 0.24 -1.19 121.20 123.71 2f08 s ILE 121 Ca -0.00 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 59.83 2f08 s ILE 121 Cb -0.00 -2.28 0.07 0.00 0.01 0.00 0.00 42.46 40.25 2f08 s ILE 121 CO -0.00 0.49 0.39 0.00 0.00 0.00 0.00 174.94 175.82 2f08 s ALA 122 N 0.98 3.55 -1.35 9.38 0.00 0.85 -0.44 121.76 134.73 2f08 s ALA 122 Ca -0.01 -2.07 0.27 0.00 0.00 0.00 0.00 51.96 50.14 2f08 s ALA 122 Cb -0.15 -3.06 0.95 0.00 0.00 0.00 0.00 23.12 20.86 2f08 s ALA 122 CO -0.01 -1.71 1.70 0.25 0.00 0.00 0.00 175.76 175.99 2f08 n THR 123 N 5.21 0.00 -1.75 0.00 -2.24 -1.26 -1.32 114.28 112.91 2f08 n THR 123 Ca -0.12 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.28 2f08 n THR 123 Cb 0.44 -0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.17 3.10 -3.21 4.78 8.25 -1.26 -4.71 115.22 120.99 2f08 n HIS 124 Ca 0.10 -2.70 -0.29 0.00 -0.26 0.00 0.00 57.72 54.57 2f08 n HIS 124 Cb 0.32 -1.01 -0.03 0.00 1.12 0.00 0.00 29.99 30.38 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 -2.16 1.83 -0.12 -1.41 0.00 -0.76 0.93 107.32 105.62 2f08 s GLY 125 Ca 0.57 -0.50 -0.08 0.00 0.00 0.00 0.00 44.72 44.70 2f08 s GLY 125 CO -0.13 -0.38 0.31 0.54 0.00 0.00 0.00 173.10 173.44 2f08 s LYS 126 N -3.69 0.31 -0.21 2.90 1.02 -0.14 -2.01 119.74 117.91 2f08 s LYS 126 Ca 0.45 0.55 -0.06 0.00 0.02 0.00 0.00 55.97 56.93 2f08 s LYS 126 Cb -0.11 0.01 -0.03 0.00 -0.52 0.00 0.00 37.83 37.19 2f08 s LYS 126 CO 0.31 -0.12 0.04 0.42 -0.92 0.00 0.00 175.35 175.08 2f08 s ILE 127 N 0.88 4.27 0.32 2.17 1.01 0.50 0.74 121.20 131.10 2f08 s ILE 127 Ca -0.06 -0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.40 2f08 s ILE 127 Cb -0.07 -2.95 -0.00 0.00 0.01 0.00 0.00 42.46 39.45 2f08 s ILE 127 CO -0.06 0.41 0.40 0.54 0.00 0.00 0.00 174.94 176.23 2f08 n ARG 128 N 4.26 0.58 0.00 2.79 1.74 0.02 -1.74 116.66 124.31 2f08 n ARG 128 Ca -0.17 -2.73 0.14 0.00 -0.77 0.00 0.00 57.85 54.32 2f08 n ARG 128 Cb 0.52 2.51 0.82 0.00 -1.02 0.00 0.00 32.46 35.29 2f08 n ARG 128 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86