#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f09 n GLN 2 N 0.00 0.00 -1.69 3.17 6.02 -1.26 -5.08 117.38 118.54 2f09 n GLN 2 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.54 2f09 n GLN 2 Cb 0.00 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.22 2f09 n GLN 2 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2f09 n THR 3 N 0.00 0.18 -2.54 5.09 -1.04 -1.26 -4.82 114.28 109.90 2f09 n THR 3 Ca 0.00 -0.03 -0.41 0.00 -2.04 0.00 0.00 64.05 61.57 2f09 n THR 3 Cb 0.00 -1.82 -0.04 0.00 -1.82 0.00 0.00 70.33 66.65 2f09 n THR 3 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2f09 s ASP 4 N 1.89 7.28 -0.02 8.00 2.15 0.46 -4.79 116.67 131.64 2f09 s ASP 4 Ca 0.81 2.04 0.04 0.00 0.43 0.00 0.00 52.55 55.87 2f09 s ASP 4 Cb -0.60 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 39.42 2f09 s ASP 4 CO 0.39 -0.22 -0.14 -0.89 -0.17 0.00 0.00 175.17 174.14 2f09 s THR 5 N -0.08 1.10 0.13 1.71 2.01 -0.49 0.33 115.64 120.36 2f09 s THR 5 Ca 0.50 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.90 2f09 s THR 5 Cb -0.28 -0.93 0.03 0.00 0.01 0.00 0.00 72.50 71.33 2f09 s THR 5 CO 0.34 0.32 0.13 0.18 -0.69 0.00 0.00 174.62 174.89 2f09 n LEU 6 N 2.86 0.00 0.20 4.42 4.77 -1.21 -4.09 117.00 123.95 2f09 n LEU 6 Ca -0.15 -0.14 0.06 0.00 -0.03 0.00 0.00 56.01 55.75 2f09 n LEU 6 Cb 0.55 -0.11 0.43 0.00 -2.33 0.00 0.00 43.42 41.95 2f09 n LEU 6 CO 0.24 -1.03 0.75 -0.08 -1.33 0.00 0.00 177.39 175.95 2f09 h GLU 7 N 0.00 0.00 -0.99 3.23 4.57 -1.87 -3.45 114.58 116.07 2f09 h GLU 7 Ca -0.05 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.01 2f09 h GLU 7 Cb 0.14 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.68 2f09 h GLU 7 CO 0.03 0.32 -0.11 2.48 -1.18 0.00 0.00 179.01 180.55 2f09 n TYR 8 N -3.71 -0.36 -3.60 0.92 0.18 -1.01 -4.83 117.16 104.76 2f09 n TYR 8 Ca -0.01 0.00 -0.28 0.00 1.88 0.00 0.00 57.90 59.49 2f09 n TYR 8 Cb 0.42 -1.76 -0.12 0.00 -0.38 0.00 0.00 39.34 37.51 2f09 n TYR 8 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 2f09 s GLN 9 N -2.09 1.25 0.42 -3.48 -0.21 -1.26 -3.28 119.66 111.01 2f09 s GLN 9 Ca 0.00 -2.18 0.07 0.00 0.02 0.00 0.00 55.36 53.27 2f09 s GLN 9 Cb 0.00 -2.05 -0.06 0.00 1.00 0.00 0.00 33.01 31.89 2f09 s GLN 9 CO 0.00 -1.27 0.08 0.00 -2.12 0.00 0.00 175.29 171.98 2f09 h ASP 11 N 1.61 0.84 0.00 0.00 3.58 -1.93 -3.34 116.42 117.19 2f09 h ASP 11 Ca -0.43 -0.27 -0.34 0.00 0.42 0.00 0.00 57.03 56.41 2f09 h ASP 11 Cb 1.25 -0.23 -0.06 0.00 1.72 0.00 0.00 39.33 42.01 2f09 h ASP 11 CO 0.76 0.98 -2.29 -0.62 -2.88 0.00 0.00 179.24 175.19 2f09 n GLU 12 N -4.15 0.79 -3.93 0.28 1.02 -1.26 -5.04 120.64 108.36 2f09 n GLU 12 Ca 0.01 0.07 -0.09 0.00 -0.02 0.00 0.00 57.16 57.12 2f09 n GLU 12 Cb 0.39 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.28 2f09 n GLU 12 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2f09 s LYS 13 N -2.46 1.31 0.19 3.49 1.02 -1.25 -5.11 119.74 116.93 2f09 s LYS 13 Ca -0.21 -1.14 -0.30 0.00 0.02 0.00 0.00 55.97 54.35 2f09 s LYS 13 Cb 0.07 0.43 -0.08 0.00 -0.52 0.00 0.00 37.83 37.73 2f09 s LYS 13 CO 0.64 -0.52 0.98 -1.25 -0.92 0.00 0.00 175.35 174.29 2f09 s PRO 14 N -3.97 4.75 -0.52 -1.68 0.04 -1.26 -2.58 135.00 129.78 2f09 s PRO 14 Ca 0.17 1.53 0.04 0.00 0.04 0.00 0.00 61.00 62.78 2f09 s PRO 14 Cb 0.01 -3.31 0.15 0.00 0.04 0.00 0.00 34.50 31.40 2f09 s PRO 14 CO 0.02 0.32 0.35 -1.17 0.04 0.00 0.00 177.00 176.56 2f09 s LEU 15 N -0.66 3.20 -0.23 -3.56 2.96 -1.21 -4.85 118.68 114.33 2f09 s LEU 15 Ca 0.45 -3.15 -0.20 0.00 -0.22 0.00 0.00 54.13 51.00 2f09 s LEU 15 Cb -0.26 -1.13 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 2f09 s LEU 15 CO 0.32 -0.18 0.63 -0.89 -1.32 0.00 0.00 176.35 174.91 2f09 s THR 16 N -0.34 5.00 -0.03 3.68 2.01 -1.26 -2.39 115.64 122.30 2f09 s THR 16 Ca 0.23 1.15 0.06 0.00 0.31 0.00 0.00 61.69 63.45 2f09 s THR 16 Cb -0.12 -3.94 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 2f09 s THR 16 CO -0.10 0.06 -0.23 -0.69 -0.69 0.00 0.00 174.62 172.98 2f09 s VAL 17 N 2.25 1.86 -0.86 3.82 1.01 -1.26 -2.33 120.40 124.90 2f09 s VAL 17 Ca 0.27 -0.99 -0.13 0.00 0.00 0.00 0.00 61.98 61.13 2f09 s VAL 17 Cb -0.16 -1.56 0.22 0.00 0.00 0.00 0.00 36.38 34.89 2f09 s VAL 17 CO 0.09 0.52 0.80 -0.54 0.00 0.00 0.00 175.10 175.98 2f09 s LYS 18 N -0.34 3.65 -0.50 2.72 3.01 0.11 -3.30 119.74 125.09 2f09 s LYS 18 Ca 0.03 -2.55 -0.28 0.00 -1.01 0.00 0.00 55.97 52.16 2f09 s LYS 18 Cb -0.11 -4.43 0.00 0.00 -1.01 0.00 0.00 37.83 32.28 2f09 s LYS 18 CO 0.01 -1.28 1.54 -0.51 0.51 0.00 0.00 175.35 175.62 2f09 s LEU 19 N -0.00 3.44 0.47 3.17 1.43 0.15 -2.11 118.68 125.24 2f09 s LEU 19 Ca 0.19 0.57 -0.22 0.00 -1.03 0.00 0.00 54.13 53.65 2f09 s LEU 19 Cb -0.10 -3.16 -0.08 0.00 0.03 0.00 0.00 46.19 42.89 2f09 s LEU 19 CO -0.09 -1.75 1.11 0.21 0.23 0.00 0.00 176.35 176.06 2f09 s ASN 20 N 5.13 6.21 0.25 2.29 3.84 -0.63 -0.40 114.94 131.63 2f09 s ASN 20 Ca 0.61 2.14 -0.04 0.00 0.21 0.00 0.00 52.86 55.78 2f09 s ASN 20 Cb -0.14 -2.58 0.46 0.00 -0.55 0.00 0.00 41.25 38.44 2f09 s ASN 20 CO 0.27 -0.88 1.74 0.78 -2.79 0.00 0.00 177.10 176.23 2f09 h ASN 21 N 1.83 0.35 0.62 -4.21 4.21 -1.90 0.31 115.58 116.79 2f09 h ASN 21 Ca -0.49 0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.12 2f09 h ASN 21 Cb 1.24 0.06 0.00 0.00 -1.12 0.00 0.00 38.32 38.50 2f09 h ASN 21 CO 0.60 0.15 0.00 -2.65 -1.29 0.00 0.00 177.43 174.23 2f09 n PRO 22 N -4.96 0.19 -3.49 0.81 -0.02 -1.26 -4.91 135.00 121.36 2f09 n PRO 22 Ca 0.14 0.46 -0.21 0.00 -2.02 0.00 0.00 63.50 61.87 2f09 n PRO 22 Cb 0.40 -1.89 0.06 0.00 -0.02 0.00 0.00 33.50 32.05 2f09 n PRO 22 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2f09 n ARG 23 N -2.25 -3.36 0.00 -0.52 1.74 0.11 -4.91 116.66 107.46 2f09 n ARG 23 Ca 0.02 0.71 0.02 0.00 -0.77 0.00 0.00 57.85 57.83 2f09 n ARG 23 Cb 0.20 -5.29 -0.02 0.00 -1.02 0.00 0.00 32.46 26.33 2f09 n ARG 23 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2f09 n GLN 24 N -3.85 5.08 -3.88 5.56 1.13 -1.26 -4.86 117.38 115.30 2f09 n GLN 24 Ca -0.17 -0.05 -0.11 0.00 -1.94 0.00 0.00 57.00 54.73 2f09 n GLN 24 Cb 0.64 -0.75 -0.10 0.00 0.11 0.00 0.00 30.24 30.13 2f09 n GLN 24 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2f09 s GLU 25 N -1.38 0.41 -0.04 -1.09 8.01 -1.26 -0.17 118.70 123.18 2f09 s GLU 25 Ca 0.02 -0.36 0.05 0.00 0.01 0.00 0.00 54.97 54.69 2f09 s GLU 25 Cb 0.04 0.17 -0.01 0.00 -4.31 0.00 0.00 34.13 30.02 2f09 s GLU 25 CO 0.19 -0.09 -0.17 0.14 0.01 0.00 0.00 175.26 175.33 2f09 s VAL 26 N -1.20 1.44 -0.26 2.63 -7.23 0.18 -1.60 120.40 114.35 2f09 s VAL 26 Ca -0.13 -0.73 -0.03 0.00 -1.81 0.00 0.00 61.98 59.28 2f09 s VAL 26 Cb -0.07 -1.22 0.02 0.00 0.56 0.00 0.00 36.38 35.67 2f09 s VAL 26 CO 0.01 0.41 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.74 2f09 s SER 27 N -0.06 4.49 0.24 4.85 0.01 -0.89 -0.39 113.70 121.94 2f09 s SER 27 Ca -0.01 -0.84 0.11 0.00 1.31 0.00 0.00 55.95 56.51 2f09 s SER 27 Cb -0.11 -1.71 -0.05 0.00 0.21 0.00 0.00 66.02 64.37 2f09 s SER 27 CO 0.02 -0.14 -0.19 0.72 0.41 0.00 0.00 173.24 174.05 2f09 s PHE 28 N 1.36 2.13 -0.40 2.43 -0.71 0.35 0.09 117.98 123.24 2f09 s PHE 28 Ca 0.01 -0.40 -0.20 0.00 -1.04 0.00 0.00 56.93 55.30 2f09 s PHE 28 Cb -0.17 -0.97 0.01 0.00 -1.21 0.00 0.00 43.02 40.69 2f09 s PHE 28 CO -0.03 0.58 0.61 0.54 -1.34 0.00 0.00 175.22 175.58 2f09 s VAL 29 N -2.42 4.88 0.07 -2.49 0.11 -0.99 -0.58 120.40 118.99 2f09 s VAL 29 Ca 0.26 0.27 -0.31 0.00 -2.93 0.00 0.00 61.98 59.26 2f09 s VAL 29 Cb -0.05 -4.13 -0.16 0.00 -1.53 0.00 0.00 36.38 30.52 2f09 s VAL 29 CO 0.12 -0.45 1.48 0.22 -3.33 0.00 0.00 175.10 173.14 2f09 h TYR 30 N 8.69 -1.18 0.00 1.54 5.03 -1.36 -3.45 116.97 126.24 2f09 h TYR 30 Ca -0.26 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.05 2f09 h TYR 30 Cb 1.10 0.44 0.00 0.00 1.55 0.00 0.00 36.73 39.82 2f09 h TYR 30 CO 0.73 -0.61 0.00 -3.47 -1.32 0.00 0.00 178.16 173.49 2f09 n ASP 31 N -5.11 0.00 -0.29 -2.11 2.03 -1.26 -4.95 116.55 104.87 2f09 n ASP 31 Ca -0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.19 2f09 n ASP 31 Cb 0.42 0.23 0.00 0.00 -0.72 0.00 0.00 41.12 41.05 2f09 n ASP 31 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2f09 n ASN 32 N -2.03 0.00 -3.75 1.67 4.05 -1.26 -5.03 115.26 108.91 2f09 n ASN 32 Ca 0.00 -1.55 -0.11 0.00 0.45 0.00 0.00 54.58 53.37 2f09 n ASN 32 Cb 0.00 -0.11 -0.07 0.00 1.23 0.00 0.00 39.78 40.83 2f09 n ASN 32 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2f09 s GLN 33 N 0.00 0.85 -0.14 1.20 0.00 -1.26 -5.14 119.66 115.17 2f09 s GLN 33 Ca 0.00 -0.58 -0.02 0.00 -0.00 0.00 0.00 55.36 54.76 2f09 s GLN 33 Cb 0.00 0.37 -0.02 0.00 0.00 0.00 0.00 33.01 33.35 2f09 s GLN 33 CO 0.00 -0.28 -0.08 -0.51 0.00 0.00 0.00 175.29 174.42 2f09 s LEU 34 N -2.25 3.02 0.39 2.60 2.01 -1.26 -0.87 118.68 122.32 2f09 s LEU 34 Ca -0.03 -0.21 0.08 0.00 0.01 0.00 0.00 54.13 53.98 2f09 s LEU 34 Cb 0.00 -1.70 -0.06 0.00 0.01 0.00 0.00 46.19 44.44 2f09 s LEU 34 CO -0.05 0.18 0.10 -0.76 1.01 0.00 0.00 176.35 176.82 2f09 s LEU 35 N 0.29 3.03 -0.02 1.79 2.01 0.26 -4.90 118.68 121.14 2f09 s LEU 35 Ca -0.06 -1.10 0.03 0.00 0.01 0.00 0.00 54.13 53.00 2f09 s LEU 35 Cb -0.15 -1.31 0.00 0.00 0.01 0.00 0.00 46.19 44.74 2f09 s LEU 35 CO 0.04 -0.43 -0.09 -1.38 1.01 0.00 0.00 176.35 175.50 2f09 s HIS 36 N -2.59 0.93 0.07 0.29 -3.43 -1.26 -0.49 115.29 108.80 2f09 s HIS 36 Ca 0.38 -0.22 0.04 0.00 -0.80 0.00 0.00 55.06 54.46 2f09 s HIS 36 Cb 0.04 -0.65 -0.03 0.00 -1.43 0.00 0.00 32.58 30.51 2f09 s HIS 36 CO 0.21 -0.08 -0.12 -0.51 -2.00 0.00 0.00 174.74 172.24 2f09 s LEU 37 N 0.09 2.31 0.18 5.38 1.02 0.47 -4.75 118.68 123.39 2f09 s LEU 37 Ca -0.01 -0.65 0.10 0.00 0.02 0.00 0.00 54.13 53.59 2f09 s LEU 37 Cb -0.07 -0.38 -0.04 0.00 0.02 0.00 0.00 46.19 45.71 2f09 s LEU 37 CO 0.00 -0.15 -0.18 -1.59 0.02 0.00 0.00 176.35 174.45 2f09 s LYS 38 N -1.97 1.74 -0.60 1.70 -2.85 -1.19 -0.65 119.74 115.92 2f09 s LYS 38 Ca -0.02 -1.40 -0.28 0.00 -1.00 0.00 0.00 55.97 53.27 2f09 s LYS 38 Cb -0.08 -1.98 0.03 0.00 -2.06 0.00 0.00 37.83 33.73 2f09 s LYS 38 CO 0.01 0.42 1.23 -1.14 0.10 0.00 0.00 175.35 175.97 2f09 s GLN 39 N -2.69 3.45 -0.02 1.78 0.74 0.76 0.15 119.66 123.82 2f09 s GLN 39 Ca 0.22 0.20 -0.28 0.00 0.05 0.00 0.00 55.36 55.55 2f09 s GLN 39 Cb -0.08 -4.05 0.09 0.00 1.10 0.00 0.00 33.01 30.07 2f09 s GLN 39 CO 0.12 -1.78 0.79 0.20 -0.55 0.00 0.00 175.29 174.07 2f09 s GLY 40 N 3.23 -0.48 -1.50 2.59 0.00 -0.90 -4.89 107.32 105.37 2f09 s GLY 40 Ca 0.43 1.23 0.00 0.00 0.00 0.00 0.00 44.72 46.38 2f09 s GLY 40 CO 0.24 0.64 0.00 1.39 0.00 0.00 0.00 173.10 175.37 2f09 n ILE 41 N 0.29 -0.33 -3.32 0.90 -0.00 -1.26 -4.51 119.36 111.13 2f09 n ILE 41 Ca -0.14 0.00 -0.46 0.00 -0.00 0.00 0.00 62.75 62.15 2f09 n ILE 41 Cb 0.60 -1.93 -0.04 0.00 -0.00 0.00 0.00 39.64 38.27 2f09 n ILE 41 CO 0.00 0.00 0.00 -0.94 -0.00 0.00 0.00 176.55 175.61 2f09 s SER 42 N -2.60 6.40 -0.10 4.38 1.04 -1.26 -4.88 113.70 116.68 2f09 s SER 42 Ca 0.00 -2.12 0.00 0.00 0.48 0.00 0.00 55.95 54.31 2f09 s SER 42 Cb 0.00 -2.21 -0.03 0.00 0.10 0.00 0.00 66.02 63.89 2f09 s SER 42 CO 0.00 -0.75 -0.09 0.00 0.98 0.00 0.00 173.24 173.38 2f09 s ALA 43 N 1.07 2.86 -0.37 5.32 0.00 -1.26 -4.80 121.76 124.58 2f09 s ALA 43 Ca 0.09 -0.89 -0.10 0.00 0.00 0.00 0.00 51.96 51.05 2f09 s ALA 43 Cb -0.23 -1.25 0.01 0.00 0.00 0.00 0.00 23.12 21.66 2f09 s ALA 43 CO -0.01 0.43 0.35 0.43 0.00 0.00 0.00 175.76 176.95 2f09 n SER 44 N 2.77 -7.85 0.00 0.00 7.64 -1.26 -4.79 113.62 110.13 2f09 n SER 44 Ca -0.18 0.86 0.00 0.00 1.01 0.00 0.00 58.87 60.56 2f09 n SER 44 Cb 0.53 -5.10 0.00 0.00 -1.01 0.00 0.00 64.21 58.63 2f09 n SER 44 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2f09 n GLY 45 N 0.15 0.16 2.91 0.23 0.00 -1.26 -4.90 105.19 102.48 2f09 n GLY 45 Ca 0.06 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 2f09 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f09 s ALA 46 N -2.00 -0.96 -0.34 4.61 0.00 0.03 -4.98 121.76 118.11 2f09 s ALA 46 Ca 0.00 0.85 -0.06 0.00 0.00 0.00 0.00 51.96 52.75 2f09 s ALA 46 Cb 0.00 -1.58 0.04 0.00 0.00 0.00 0.00 23.12 21.58 2f09 s ALA 46 CO 0.00 -1.20 0.11 1.03 0.00 0.00 0.00 175.76 175.69 2f09 s ARG 47 N 2.51 2.59 -0.33 0.00 0.52 -1.26 -0.37 118.95 122.61 2f09 s ARG 47 Ca 0.11 -1.21 -0.15 0.00 -0.52 0.00 0.00 55.73 53.95 2f09 s ARG 47 Cb -0.15 -3.46 -0.01 0.00 0.52 0.00 0.00 34.95 31.85 2f09 s ARG 47 CO -0.15 -0.68 0.37 0.71 0.02 0.00 0.00 175.30 175.57 2f09 s TYR 48 N 1.39 3.21 -0.10 -0.53 1.51 0.12 -2.11 117.35 120.83 2f09 s TYR 48 Ca -0.01 0.04 -0.11 0.00 -1.01 0.00 0.00 57.07 55.98 2f09 s TYR 48 Cb -0.20 -2.68 0.03 0.00 -0.11 0.00 0.00 41.96 39.00 2f09 s TYR 48 CO 0.02 -0.42 0.29 0.99 -1.11 0.00 0.00 175.55 175.33 2f09 s THR 49 N 2.05 0.01 0.00 -0.71 2.01 0.12 -0.17 115.64 118.96 2f09 s THR 49 Ca 0.13 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.05 2f09 s THR 49 Cb -0.16 -0.44 0.00 0.00 0.01 0.00 0.00 72.50 71.90 2f09 s THR 49 CO 0.12 -0.04 0.00 -0.67 -0.69 0.00 0.00 174.62 173.33 2f09 n ASP 50 N 2.69 4.68 0.00 3.53 2.03 -1.23 -3.20 116.55 125.05 2f09 n ASP 50 Ca -0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 2f09 n ASP 50 Cb 0.58 0.81 0.00 0.00 -0.72 0.00 0.00 41.12 41.79 2f09 n ASP 50 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2f09 n GLY 51 N 2.47 1.78 0.10 0.27 0.00 -1.26 -4.95 105.19 103.60 2f09 n GLY 51 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2f09 n GLY 51 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2f09 h ILE 52 N 0.00 1.05 -3.68 -0.61 2.04 -1.96 -3.46 117.51 110.89 2f09 h ILE 52 Ca 0.00 -0.62 -0.10 0.00 1.00 0.00 0.00 64.86 65.14 2f09 h ILE 52 Cb 0.00 1.44 -0.08 0.00 -0.74 0.00 0.00 36.82 37.44 2f09 h ILE 52 CO 0.00 0.15 -0.09 -0.31 0.00 0.00 0.00 178.15 177.90 2f09 s TYR 53 N -5.00 0.48 -0.33 1.37 2.02 -1.26 -4.85 117.35 109.78 2f09 s TYR 53 Ca -0.15 -0.84 -0.02 0.00 -0.37 0.00 0.00 57.07 55.69 2f09 s TYR 53 Cb 0.03 0.20 0.06 0.00 -0.40 0.00 0.00 41.96 41.85 2f09 s TYR 53 CO 0.63 -1.08 0.05 0.08 -1.57 0.00 0.00 175.55 173.66 2f09 s VAL 54 N -3.66 3.13 -0.38 0.71 1.01 -1.24 -3.53 120.40 116.45 2f09 s VAL 54 Ca 0.23 -1.49 -0.18 0.00 0.00 0.00 0.00 61.98 60.54 2f09 s VAL 54 Cb -0.01 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.51 2f09 s VAL 54 CO 0.12 -0.23 0.50 0.12 0.00 0.00 0.00 175.10 175.61 2f09 s PHE 55 N 1.24 3.16 -0.22 5.22 2.19 0.76 -1.25 117.98 129.09 2f09 s PHE 55 Ca -0.02 0.02 -0.04 0.00 0.33 0.00 0.00 56.93 57.21 2f09 s PHE 55 Cb -0.20 -2.96 -0.01 0.00 -1.31 0.00 0.00 43.02 38.54 2f09 s PHE 55 CO -0.01 -0.61 -0.03 -0.46 1.83 0.00 0.00 175.22 175.94 2f09 s TRP 56 N 2.37 2.98 -0.19 10.12 -0.00 0.12 0.11 118.94 134.45 2f09 s TRP 56 Ca 0.17 -0.80 -0.02 0.00 -0.00 0.00 0.00 56.10 55.45 2f09 s TRP 56 Cb -0.16 -2.11 -0.01 0.00 -0.00 0.00 0.00 33.47 31.20 2f09 s TRP 56 CO 0.14 -0.47 -0.08 0.45 -0.00 0.00 0.00 176.95 176.98 2f09 s SER 57 N 1.39 4.12 0.00 5.86 0.15 0.50 -0.46 113.70 125.26 2f09 s SER 57 Ca 0.05 -0.39 0.18 0.00 0.70 0.00 0.00 55.95 56.49 2f09 s SER 57 Cb -0.14 -1.68 0.43 0.00 -1.71 0.00 0.00 66.02 62.92 2f09 s SER 57 CO -0.01 0.04 1.35 0.29 1.20 0.00 0.00 173.24 176.11 2f09 n LYS 58 N 4.37 2.52 0.00 5.44 5.02 0.65 -0.79 118.16 135.37 2f09 n LYS 58 Ca -0.18 -2.24 0.00 0.00 -2.02 0.00 0.00 58.31 53.86 2f09 n LYS 58 Cb 0.51 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 2f09 n LYS 58 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f09 n GLY 59 N 1.17 2.04 0.50 0.72 0.00 -1.26 -4.54 105.19 103.82 2f09 n GLY 59 Ca 0.18 -0.67 0.11 0.00 0.00 0.00 0.00 46.02 45.63 2f09 n GLY 59 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f09 n ASP 60 N 2.50 2.01 -3.93 1.61 9.92 -1.26 -4.83 116.55 122.56 2f09 n ASP 60 Ca 0.00 -1.50 -0.10 0.00 -0.53 0.00 0.00 54.79 52.66 2f09 n ASP 60 Cb 0.00 0.42 -0.12 0.00 -0.64 0.00 0.00 41.12 40.78 2f09 n ASP 60 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2f09 s GLU 61 N -2.45 0.18 0.01 -1.24 -1.05 -1.26 0.15 118.70 113.03 2f09 s GLU 61 Ca 0.20 -0.35 0.02 0.00 -0.15 0.00 0.00 54.97 54.69 2f09 s GLU 61 Cb 0.18 0.06 -0.01 0.00 -0.44 0.00 0.00 34.13 33.92 2f09 s GLU 61 CO 0.55 -0.03 -0.07 0.00 0.95 0.00 0.00 175.26 176.66 2f09 s ALA 62 N -0.84 0.59 0.07 -0.84 0.00 0.28 -0.25 121.76 120.77 2f09 s ALA 62 Ca -0.09 -0.44 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 2f09 s ALA 62 Cb -0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 2f09 s ALA 62 CO -0.01 0.10 0.07 -0.08 0.00 0.00 0.00 175.76 175.84 2f09 s THR 63 N -0.52 0.18 -0.24 0.00 -1.32 0.39 -2.49 115.64 111.63 2f09 s THR 63 Ca -0.01 -1.56 -0.04 0.00 -1.21 0.00 0.00 61.69 58.87 2f09 s THR 63 Cb -0.05 -1.49 0.09 0.00 -1.51 0.00 0.00 72.50 69.54 2f09 s THR 63 CO 0.00 -0.81 0.15 -0.69 -2.21 0.00 0.00 174.62 171.05 2f09 s VAL 64 N -3.91 -0.14 -0.29 5.08 1.01 0.15 0.12 120.40 122.43 2f09 s VAL 64 Ca 0.08 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2f09 s VAL 64 Cb 0.07 -0.82 0.08 0.00 0.00 0.00 0.00 36.38 35.70 2f09 s VAL 64 CO -0.09 -0.51 0.01 -0.31 0.00 0.00 0.00 175.10 174.20 2f09 s TYR 65 N 2.17 2.80 0.49 5.22 2.02 -0.38 -1.23 117.35 128.44 2f09 s TYR 65 Ca 0.07 -2.24 -0.02 0.00 -0.37 0.00 0.00 57.07 54.50 2f09 s TYR 65 Cb -0.16 -2.11 -0.00 0.00 -0.40 0.00 0.00 41.96 39.29 2f09 s TYR 65 CO -0.25 -0.87 0.75 0.21 -1.57 0.00 0.00 175.55 173.82 2f09 s LYS 66 N 1.24 3.08 0.33 -0.62 2.20 0.58 -3.60 119.74 122.95 2f09 s LYS 66 Ca 0.03 -0.26 0.15 0.00 -0.36 0.00 0.00 55.97 55.53 2f09 s LYS 66 Cb -0.19 -2.45 0.53 0.00 -1.51 0.00 0.00 37.83 34.21 2f09 s LYS 66 CO -0.11 -0.38 1.68 0.00 -0.36 0.00 0.00 175.35 176.18 2f09 h ARG 67 N 0.21 0.00 0.00 4.03 3.08 -1.96 -2.60 114.38 117.14 2f09 h ARG 67 Ca -0.46 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.40 2f09 h ARG 67 Cb 1.25 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.27 2f09 h ARG 67 CO 0.59 0.49 -1.03 -0.44 -1.07 0.00 0.00 179.97 178.50 2f09 h ASP 68 N 0.00 0.00 -2.51 7.04 3.32 -1.96 -3.46 116.42 118.85 2f09 h ASP 68 Ca -0.00 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.14 2f09 h ASP 68 Cb 0.98 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.27 2f09 h ASP 68 CO 0.06 0.83 0.30 -0.60 -1.72 0.00 0.00 179.24 178.11 2f09 s ARG 69 N -2.78 0.44 -0.01 3.56 3.52 -0.98 -5.12 118.95 117.58 2f09 s ARG 69 Ca 0.00 0.78 -0.20 0.00 -0.13 0.00 0.00 55.73 56.19 2f09 s ARG 69 Cb 0.09 0.13 -0.05 0.00 -1.56 0.00 0.00 34.95 33.55 2f09 s ARG 69 CO 0.80 -0.10 0.57 0.42 -0.81 0.00 0.00 175.30 176.18 2f09 s ILE 70 N 1.50 4.93 -0.13 4.11 1.01 -1.23 -0.31 121.20 131.07 2f09 s ILE 70 Ca -0.09 1.19 0.10 0.00 0.00 0.00 0.00 60.65 61.86 2f09 s ILE 70 Cb -0.04 -3.90 -0.15 0.00 0.01 0.00 0.00 42.46 38.37 2f09 s ILE 70 CO -0.16 0.43 0.28 1.33 0.00 0.00 0.00 174.94 176.82 2f09 n VAL 71 N 2.66 0.00 -3.64 2.92 0.24 -0.36 -4.95 118.33 115.20 2f09 n VAL 71 Ca -0.08 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.34 61.89 2f09 n VAL 71 Cb 0.51 0.44 -0.07 0.00 -1.47 0.00 0.00 33.84 33.25 2f09 n VAL 71 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2f09 s LEU 72 N -3.43 -0.81 -0.00 1.34 1.98 -1.20 -4.81 118.68 111.74 2f09 s LEU 72 Ca -0.02 1.39 0.00 0.00 -2.89 0.00 0.00 54.13 52.62 2f09 s LEU 72 Cb 0.07 2.33 0.01 0.00 0.66 0.00 0.00 46.19 49.25 2f09 s LEU 72 CO 0.43 -0.23 0.65 -0.46 -1.89 0.00 0.00 176.35 174.85 2f09 n ASN 73 N 3.60 0.37 -3.19 3.68 0.23 -1.26 0.33 115.26 119.02 2f09 n ASN 73 Ca -0.17 -1.31 -0.23 0.00 -0.53 0.00 0.00 54.58 52.33 2f09 n ASN 73 Cb 0.57 -0.03 -0.07 0.00 -2.08 0.00 0.00 39.78 38.18 2f09 n ASN 73 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2f09 n ASN 74 N -0.11 -0.15 -4.11 0.53 3.02 -1.26 -4.86 115.26 108.32 2f09 n ASN 74 Ca 0.00 -2.68 -0.27 0.00 -0.03 0.00 0.00 54.58 51.60 2f09 n ASN 74 Cb 0.49 -0.45 -0.17 0.00 -0.61 0.00 0.00 39.78 39.04 2f09 n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2f09 s GLN 76 N 0.44 0.03 0.11 0.00 -0.21 -1.26 -0.56 119.66 118.22 2f09 s GLN 76 Ca -0.14 0.24 -0.19 0.00 0.02 0.00 0.00 55.36 55.29 2f09 s GLN 76 Cb -0.16 -0.42 -0.07 0.00 1.00 0.00 0.00 33.01 33.36 2f09 s GLN 76 CO 0.05 -0.23 0.60 -1.17 -2.12 0.00 0.00 175.29 172.42 2f09 s LEU 77 N 1.52 4.48 -0.17 2.90 2.96 0.12 -4.79 118.68 125.71 2f09 s LEU 77 Ca -0.03 1.29 -0.04 0.00 -0.22 0.00 0.00 54.13 55.12 2f09 s LEU 77 Cb -0.13 -3.09 -0.09 0.00 0.50 0.00 0.00 46.19 43.39 2f09 s LEU 77 CO -0.03 0.21 -0.18 0.00 -1.32 0.00 0.00 176.35 175.02 2f09 n GLN 78 N 1.41 0.38 -3.15 1.98 6.02 -1.26 -4.92 117.38 117.84 2f09 n GLN 78 Ca -0.08 0.13 0.04 0.00 -0.01 0.00 0.00 57.00 57.08 2f09 n GLN 78 Cb 0.51 -1.20 -0.01 0.00 1.02 0.00 0.00 30.24 30.56 2f09 n GLN 78 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2f09 s ASN 79 N -6.08 -1.18 0.00 1.08 2.47 -1.26 -5.03 114.94 104.93 2f09 s ASN 79 Ca -0.23 0.37 0.10 0.00 0.42 0.00 0.00 52.86 53.52 2f09 s ASN 79 Cb 0.08 1.84 0.59 0.00 -1.45 0.00 0.00 41.25 42.30 2f09 s ASN 79 CO 0.33 -0.22 1.28 -0.81 -3.72 0.00 0.00 177.10 173.97 2f09 n PRO 80 N 5.37 0.88 -0.07 0.43 -0.04 -1.26 -3.13 135.00 137.19 2f09 n PRO 80 Ca 0.02 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.34 2f09 n PRO 80 Cb 0.54 -1.17 -0.14 0.00 -0.04 0.00 0.00 33.50 32.68 2f09 n PRO 80 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2f09 n GLN 81 N -0.67 0.68 0.00 0.54 6.02 -1.26 -1.39 117.38 121.29 2f09 n GLN 81 Ca 0.07 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 2f09 n GLN 81 Cb 0.03 -1.61 0.00 0.00 1.02 0.00 0.00 30.24 29.68 2f09 n GLN 81 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59