#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 -0.18 -2.74 0.03 6.02 -1.26 -5.02 117.38 114.23 2f09 n GLN 2 Ca 0.00 -2.50 -0.42 0.00 -0.01 0.00 0.00 57.00 54.06 2f09 n GLN 2 Cb 0.00 -0.69 -0.03 0.00 1.02 0.00 0.00 30.24 30.54 2f09 n GLN 2 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2f09 s THR 3 N -2.98 4.78 0.47 5.09 2.01 -1.26 -4.97 115.64 118.78 2f09 s THR 3 Ca 0.63 1.92 -0.23 0.00 0.31 0.00 0.00 61.69 64.32 2f09 s THR 3 Cb -0.03 -4.26 -0.09 0.00 0.01 0.00 0.00 72.50 68.13 2f09 s THR 3 CO 0.42 -0.05 1.13 -0.67 -0.69 0.00 0.00 174.62 174.76 2f09 n ASP 4 N 5.47 1.76 -3.81 3.53 2.03 -1.03 -4.58 116.55 119.92 2f09 n ASP 4 Ca 0.08 1.01 -0.10 0.00 0.52 0.00 0.00 54.79 56.30 2f09 n ASP 4 Cb 0.48 -1.44 -0.08 0.00 -0.72 0.00 0.00 41.12 39.37 2f09 n ASP 4 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2f09 s THR 5 N -1.30 0.11 0.00 5.18 -1.32 -1.05 -0.38 115.64 116.88 2f09 s THR 5 Ca 0.66 -0.90 0.00 0.00 -1.21 0.00 0.00 61.69 60.24 2f09 s THR 5 Cb -0.50 -1.04 0.00 0.00 -1.51 0.00 0.00 72.50 69.45 2f09 s THR 5 CO 0.54 -0.49 0.00 0.18 -2.21 0.00 0.00 174.62 172.64 2f09 n LEU 6 N 0.42 0.00 0.23 9.08 4.77 -1.26 -4.17 117.00 126.06 2f09 n LEU 6 Ca -0.18 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.91 2f09 n LEU 6 Cb 0.60 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 42.16 2f09 n LEU 6 CO 0.22 -0.01 0.82 -0.08 -1.33 0.00 0.00 177.39 177.01 2f09 h GLU 7 N 0.00 0.00 -1.37 3.23 4.57 -1.85 -3.45 114.58 115.71 2f09 h GLU 7 Ca 0.00 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 2f09 h GLU 7 Cb 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.53 2f09 h GLU 7 CO 0.00 0.18 -0.13 2.48 -1.18 0.00 0.00 179.01 180.37 2f09 n TYR 8 N -3.31 -0.52 -2.74 0.92 0.18 -0.96 -4.72 117.16 106.00 2f09 n TYR 8 Ca 0.01 0.00 -0.04 0.00 1.88 0.00 0.00 57.90 59.75 2f09 n TYR 8 Cb 0.43 -1.82 0.07 0.00 -0.38 0.00 0.00 39.34 37.64 2f09 n TYR 8 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2f09 n GLN 9 N -1.24 1.43 -1.31 -3.48 10.64 -1.26 -3.81 117.38 118.35 2f09 n GLN 9 Ca -0.07 -2.67 -0.30 0.00 -1.83 0.00 0.00 57.00 52.13 2f09 n GLN 9 Cb 0.25 -0.82 0.10 0.00 -0.86 0.00 0.00 30.24 28.92 2f09 n GLN 9 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2f09 h ASP 11 N -1.20 0.00 0.00 0.00 3.32 -1.98 -3.27 116.42 113.28 2f09 h ASP 11 Ca -0.46 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.45 2f09 h ASP 11 Cb 1.25 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 2f09 h ASP 11 CO 0.54 0.00 -1.55 1.21 -1.72 0.00 0.00 179.24 177.72 2f09 n GLU 12 N -2.44 0.68 -3.86 3.56 2.13 -1.26 -5.06 120.64 114.39 2f09 n GLU 12 Ca 0.03 0.05 -0.13 0.00 0.66 0.00 0.00 57.16 57.77 2f09 n GLU 12 Cb 0.32 -1.19 -0.14 0.00 0.27 0.00 0.00 31.44 30.69 2f09 n GLU 12 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2f09 s LYS 13 N -2.19 0.01 -0.49 5.31 -0.14 -1.23 -5.09 119.74 115.92 2f09 s LYS 13 Ca -0.11 0.02 -0.29 0.00 -1.36 0.00 0.00 55.97 54.23 2f09 s LYS 13 Cb 0.03 -0.04 0.02 0.00 -1.68 0.00 0.00 37.83 36.16 2f09 s LYS 13 CO 0.24 -0.02 1.25 -2.14 -0.76 0.00 0.00 175.35 173.91 2f09 s PRO 14 N 0.14 3.61 -0.67 -1.68 0.02 -1.26 -2.67 135.00 132.48 2f09 s PRO 14 Ca -0.01 0.59 -0.07 0.00 0.02 0.00 0.00 61.00 61.53 2f09 s PRO 14 Cb -0.02 -3.98 0.18 0.00 0.02 0.00 0.00 34.50 30.70 2f09 s PRO 14 CO -0.00 -1.54 0.53 -1.17 -0.33 0.00 0.00 177.00 174.48 2f09 s LEU 15 N 4.96 5.72 -0.16 -5.54 2.96 -1.25 -4.83 118.68 120.54 2f09 s LEU 15 Ca 0.51 -2.74 -0.13 0.00 -0.22 0.00 0.00 54.13 51.55 2f09 s LEU 15 Cb -0.09 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.58 2f09 s LEU 15 CO 0.30 -0.45 0.25 -0.89 -1.32 0.00 0.00 176.35 174.25 2f09 s THR 16 N 0.11 5.33 0.01 3.68 2.01 -1.26 -2.27 115.64 123.23 2f09 s THR 16 Ca 0.16 0.47 0.05 0.00 0.31 0.00 0.00 61.69 62.68 2f09 s THR 16 Cb -0.18 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2f09 s THR 16 CO -0.05 0.42 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.47 2f09 s VAL 17 N 0.28 3.04 -0.97 3.82 1.01 -1.26 -3.37 120.40 122.94 2f09 s VAL 17 Ca 0.15 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 2f09 s VAL 17 Cb -0.13 -2.26 0.24 0.00 0.00 0.00 0.00 36.38 34.24 2f09 s VAL 17 CO 0.03 0.43 0.91 -0.54 0.00 0.00 0.00 175.10 175.93 2f09 s LYS 18 N -1.22 3.71 -0.98 2.72 3.01 0.98 -3.99 119.74 123.98 2f09 s LYS 18 Ca 0.14 -3.10 -0.19 0.00 -1.01 0.00 0.00 55.97 51.82 2f09 s LYS 18 Cb -0.11 -4.29 0.12 0.00 -1.01 0.00 0.00 37.83 32.55 2f09 s LYS 18 CO 0.04 -1.25 1.22 -1.17 0.51 0.00 0.00 175.35 174.70 2f09 s LEU 19 N -1.03 4.80 -0.64 3.17 2.96 0.49 -1.83 118.68 126.61 2f09 s LEU 19 Ca 0.27 -2.06 -0.18 0.00 -0.22 0.00 0.00 54.13 51.94 2f09 s LEU 19 Cb -0.10 -2.43 0.12 0.00 0.50 0.00 0.00 46.19 44.28 2f09 s LEU 19 CO -0.09 -1.10 0.73 0.21 -1.32 0.00 0.00 176.35 174.78 2f09 s ASN 20 N 3.76 6.27 0.21 3.68 2.47 -0.79 -2.48 114.94 128.06 2f09 s ASN 20 Ca 0.36 -1.61 -0.10 0.00 0.42 0.00 0.00 52.86 51.93 2f09 s ASN 20 Cb -0.04 -2.30 0.28 0.00 -1.45 0.00 0.00 41.25 37.75 2f09 s ASN 20 CO -0.08 -1.05 1.72 0.78 -3.72 0.00 0.00 177.10 174.75 2f09 h ASN 21 N 9.03 0.11 0.00 -4.21 4.21 -1.92 0.22 115.58 123.01 2f09 h ASN 21 Ca -0.23 0.09 0.00 0.00 1.21 0.00 0.00 56.30 57.38 2f09 h ASN 21 Cb 1.08 0.11 0.00 0.00 -1.12 0.00 0.00 38.32 38.38 2f09 h ASN 21 CO 1.07 0.07 0.10 -0.65 -1.29 0.00 0.00 177.43 176.73 2f09 h PRO 22 N 0.32 0.00 0.00 0.81 0.11 -1.97 -1.86 132.00 129.41 2f09 h PRO 22 Ca 0.31 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.19 2f09 h PRO 22 Cb 0.42 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.48 2f09 h PRO 22 CO -0.35 0.00 -2.02 0.54 -0.21 0.00 0.00 178.00 175.96 2f09 n ARG 23 N -2.87 1.21 -2.12 1.05 5.12 -0.39 -4.98 116.66 113.68 2f09 n ARG 23 Ca -0.02 -0.04 -0.17 0.00 -1.93 0.00 0.00 57.85 55.68 2f09 n ARG 23 Cb 0.16 -1.41 -0.03 0.00 -1.16 0.00 0.00 32.46 30.02 2f09 n ARG 23 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2f09 n GLN 24 N -2.48 -1.34 -4.91 5.56 1.13 0.62 -4.86 117.38 111.10 2f09 n GLN 24 Ca -0.21 0.91 -0.33 0.00 -1.94 0.00 0.00 57.00 55.43 2f09 n GLN 24 Cb 0.89 -5.31 -0.14 0.00 0.11 0.00 0.00 30.24 25.79 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 -4.51 2.59 -0.17 -1.09 2.02 -1.20 -0.83 118.70 115.52 2f09 s GLU 25 Ca 0.00 -0.72 -0.01 0.00 0.02 0.00 0.00 54.97 54.27 2f09 s GLU 25 Cb 0.00 -2.38 -0.00 0.00 0.10 0.00 0.00 34.13 31.84 2f09 s GLU 25 CO 0.00 0.56 -0.12 0.14 0.02 0.00 0.00 175.26 175.86 2f09 s VAL 26 N -0.57 2.89 -0.30 2.63 -7.23 0.57 -1.88 120.40 116.51 2f09 s VAL 26 Ca 0.08 -0.69 -0.09 0.00 -1.81 0.00 0.00 61.98 59.47 2f09 s VAL 26 Cb -0.11 -2.25 -0.01 0.00 0.56 0.00 0.00 36.38 34.57 2f09 s VAL 26 CO 0.01 0.50 0.14 -0.44 -0.31 0.00 0.00 175.10 175.00 2f09 s SER 27 N 0.92 5.48 0.30 4.85 0.01 -0.76 -0.36 113.70 124.14 2f09 s SER 27 Ca -0.03 -0.52 0.11 0.00 1.31 0.00 0.00 55.95 56.82 2f09 s SER 27 Cb -0.15 -1.98 -0.05 0.00 0.21 0.00 0.00 66.02 64.04 2f09 s SER 27 CO -0.01 -0.18 -0.16 0.72 0.41 0.00 0.00 173.24 174.01 2f09 s PHE 28 N 1.60 2.32 -0.34 2.43 -0.71 0.13 -0.01 117.98 123.41 2f09 s PHE 28 Ca 0.04 -0.39 -0.13 0.00 -1.04 0.00 0.00 56.93 55.41 2f09 s PHE 28 Cb -0.17 -1.12 -0.02 0.00 -1.21 0.00 0.00 43.02 40.50 2f09 s PHE 28 CO 0.06 0.67 0.26 0.54 -1.34 0.00 0.00 175.22 175.41 2f09 s VAL 29 N -2.55 5.27 0.17 -2.49 0.11 -1.22 -0.54 120.40 119.15 2f09 s VAL 29 Ca 0.31 -0.14 -0.10 0.00 -2.93 0.00 0.00 61.98 59.12 2f09 s VAL 29 Cb -0.02 -3.72 0.04 0.00 -1.53 0.00 0.00 36.38 31.14 2f09 s VAL 29 CO 0.15 -0.01 1.60 0.22 -3.33 0.00 0.00 175.10 173.74 2f09 h TYR 30 N 8.47 1.15 0.00 1.54 3.20 -1.39 -3.45 116.97 126.49 2f09 h TYR 30 Ca -0.31 -0.23 0.00 0.00 3.14 0.00 0.00 58.73 61.33 2f09 h TYR 30 Cb 1.16 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.14 2f09 h TYR 30 CO 0.67 1.05 0.00 -3.47 -1.64 0.00 0.00 178.16 174.78 2f09 n ASP 31 N -4.17 0.00 -0.17 -2.11 2.03 -1.26 -4.94 116.55 105.93 2f09 n ASP 31 Ca 0.02 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.35 2f09 n ASP 31 Cb 0.39 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.82 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 0.00 0.94 -3.65 1.67 2.85 -1.26 -5.04 115.26 110.77 2f09 n ASN 32 Ca 0.00 -2.00 -0.13 0.00 -0.11 0.00 0.00 54.58 52.34 2f09 n ASN 32 Cb 0.00 -0.16 -0.06 0.00 1.24 0.00 0.00 39.78 40.79 2f09 n ASN 32 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2f09 s GLN 33 N -0.87 0.94 -0.11 1.20 -2.07 -1.26 -5.14 119.66 112.34 2f09 s GLN 33 Ca 0.08 -0.31 -0.01 0.00 -1.82 0.00 0.00 55.36 53.29 2f09 s GLN 33 Cb 0.07 0.42 -0.03 0.00 -1.09 0.00 0.00 33.01 32.38 2f09 s GLN 33 CO 0.01 -0.32 -0.07 -0.51 -1.32 0.00 0.00 175.29 173.08 2f09 s LEU 34 N -1.95 3.14 0.43 2.60 2.01 -1.26 -0.91 118.68 122.74 2f09 s LEU 34 Ca -0.06 -0.11 0.07 0.00 0.01 0.00 0.00 54.13 54.04 2f09 s LEU 34 Cb -0.01 -1.72 -0.04 0.00 0.01 0.00 0.00 46.19 44.44 2f09 s LEU 34 CO -0.02 0.26 0.21 -0.76 1.01 0.00 0.00 176.35 177.05 2f09 s LEU 35 N -0.16 3.05 -0.01 1.79 2.01 0.30 -4.91 118.68 120.74 2f09 s LEU 35 Ca 0.02 -1.10 0.01 0.00 0.01 0.00 0.00 54.13 53.07 2f09 s LEU 35 Cb -0.13 -1.42 0.00 0.00 0.01 0.00 0.00 46.19 44.65 2f09 s LEU 35 CO 0.03 -0.63 -0.04 -1.38 1.01 0.00 0.00 176.35 175.34 2f09 s HIS 36 N -2.62 0.43 0.23 0.29 -3.43 -1.26 -0.69 115.29 108.23 2f09 s HIS 36 Ca 0.39 -0.08 0.04 0.00 -0.80 0.00 0.00 55.06 54.61 2f09 s HIS 36 Cb 0.03 -0.32 -0.05 0.00 -1.43 0.00 0.00 32.58 30.80 2f09 s HIS 36 CO 0.22 -0.04 -0.01 -0.51 -2.00 0.00 0.00 174.74 172.40 2f09 s LEU 37 N 0.17 2.21 0.01 5.38 2.01 0.52 -4.56 118.68 124.42 2f09 s LEU 37 Ca -0.02 -1.21 -0.04 0.00 0.01 0.00 0.00 54.13 52.87 2f09 s LEU 37 Cb -0.05 -0.28 -0.01 0.00 0.01 0.00 0.00 46.19 45.86 2f09 s LEU 37 CO -0.00 -0.50 0.06 -1.59 1.01 0.00 0.00 176.35 175.32 2f09 s LYS 38 N -3.86 0.39 -0.47 1.70 -2.85 -1.25 -0.31 119.74 113.09 2f09 s LYS 38 Ca 0.28 -0.47 -0.23 0.00 -1.00 0.00 0.00 55.97 54.56 2f09 s LYS 38 Cb 0.06 0.15 0.03 0.00 -2.06 0.00 0.00 37.83 36.01 2f09 s LYS 38 CO 0.09 -0.08 0.79 -1.14 0.10 0.00 0.00 175.35 175.11 2f09 s GLN 39 N -1.34 3.37 0.00 1.78 -0.44 -0.01 0.11 119.66 123.13 2f09 s GLN 39 Ca -0.15 -0.18 0.00 0.00 -2.50 0.00 0.00 55.36 52.53 2f09 s GLN 39 Cb -0.08 -3.96 0.00 0.00 -1.64 0.00 0.00 33.01 27.32 2f09 s GLN 39 CO 0.00 -1.17 0.33 0.41 0.50 0.00 0.00 175.29 175.36 2f09 n GLY 40 N 5.02 0.91 3.32 2.59 0.00 -1.24 -4.97 105.19 110.82 2f09 n GLY 40 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2f09 n GLY 40 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f09 s ILE 41 N 0.00 -0.01 0.15 -0.61 1.01 -1.25 -5.10 121.20 115.40 2f09 s ILE 41 Ca 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.62 2f09 s ILE 41 Cb 0.00 -0.62 -0.02 0.00 0.01 0.00 0.00 42.46 41.83 2f09 s ILE 41 CO 0.00 0.01 0.19 -0.44 0.00 0.00 0.00 174.94 174.70 2f09 s SER 42 N 0.59 0.16 0.00 3.58 0.01 -1.26 -1.77 113.70 115.00 2f09 s SER 42 Ca -0.03 -1.00 0.00 0.00 1.31 0.00 0.00 55.95 56.23 2f09 s SER 42 Cb -0.05 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.56 2f09 s SER 42 CO -0.04 -0.82 0.00 0.00 0.41 0.00 0.00 173.24 172.80 2f09 n ALA 43 N -0.16 0.07 -1.39 1.44 0.00 -1.26 -4.94 120.51 114.27 2f09 n ALA 43 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.10 2f09 n ALA 43 Cb 0.63 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.20 2f09 n ALA 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2f09 n SER 44 N -0.34 5.76 0.00 0.00 7.64 -1.26 -4.92 113.62 120.50 2f09 n SER 44 Ca 0.00 -3.74 0.00 0.00 1.01 0.00 0.00 58.87 56.14 2f09 n SER 44 Cb 0.00 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 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 -0.98 -0.58 3.10 0.23 0.00 -1.26 -4.75 105.19 100.95 2f09 n GLY 45 Ca 0.57 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.00 1.86 -0.30 4.61 0.00 0.28 -4.71 121.76 122.50 2f09 s ALA 46 Ca 0.00 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2f09 s ALA 46 Cb 0.00 -0.86 0.07 0.00 0.00 0.00 0.00 23.12 22.33 2f09 s ALA 46 CO 0.00 -0.02 -0.02 1.03 0.00 0.00 0.00 175.76 176.75 2f09 s ARG 47 N 0.86 2.15 -0.59 0.00 0.52 -0.73 -0.69 118.95 120.48 2f09 s ARG 47 Ca -0.08 -1.45 -0.22 0.00 -0.52 0.00 0.00 55.73 53.45 2f09 s ARG 47 Cb -0.15 -3.09 0.06 0.00 0.52 0.00 0.00 34.95 32.29 2f09 s ARG 47 CO -0.00 -0.69 0.88 0.71 0.02 0.00 0.00 175.30 176.22 2f09 s TYR 48 N 1.12 2.80 -0.13 -0.53 1.51 0.11 -3.59 117.35 118.62 2f09 s TYR 48 Ca -0.03 -0.39 -0.08 0.00 -1.01 0.00 0.00 57.07 55.57 2f09 s TYR 48 Cb -0.20 -4.07 0.05 0.00 -0.11 0.00 0.00 41.96 37.63 2f09 s TYR 48 CO -0.04 -1.42 0.32 0.99 -1.11 0.00 0.00 175.55 174.29 2f09 s THR 49 N 3.70 -0.03 -0.09 -0.71 2.01 0.12 0.11 115.64 120.75 2f09 s THR 49 Ca 0.23 0.11 0.12 0.00 0.31 0.00 0.00 61.69 62.46 2f09 s THR 49 Cb -0.16 -0.49 -0.17 0.00 0.01 0.00 0.00 72.50 71.69 2f09 s THR 49 CO 0.13 0.04 0.12 -0.67 -0.69 0.00 0.00 174.62 173.56 2f09 n ASP 50 N 4.11 1.96 0.00 3.53 2.03 -1.23 -3.88 116.55 123.06 2f09 n ASP 50 Ca -0.23 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.08 2f09 n ASP 50 Cb 0.54 1.06 0.00 0.00 -0.72 0.00 0.00 41.12 42.01 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 2.08 1.64 0.12 0.27 0.00 -1.26 -4.96 105.19 103.08 2f09 n GLY 51 Ca -0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 0.96 -4.14 -0.61 2.04 -1.94 -3.46 117.51 110.36 2f09 h ILE 52 Ca 0.00 -1.11 -0.27 0.00 1.00 0.00 0.00 64.86 64.48 2f09 h ILE 52 Cb 0.00 1.58 -0.15 0.00 -0.74 0.00 0.00 36.82 37.51 2f09 h ILE 52 CO 0.00 0.24 -0.63 -0.31 0.00 0.00 0.00 178.15 177.44 2f09 s TYR 53 N -3.68 1.22 -0.31 1.37 2.02 -1.26 -4.79 117.35 111.91 2f09 s TYR 53 Ca -0.14 -1.21 -0.02 0.00 -0.37 0.00 0.00 57.07 55.33 2f09 s TYR 53 Cb 0.01 -0.67 0.06 0.00 -0.40 0.00 0.00 41.96 40.95 2f09 s TYR 53 CO 0.53 -0.43 0.02 0.08 -1.57 0.00 0.00 175.55 174.18 2f09 s VAL 54 N -3.91 2.97 -0.66 0.71 1.01 -1.25 -3.56 120.40 115.71 2f09 s VAL 54 Ca 0.32 -1.50 -0.17 0.00 0.00 0.00 0.00 61.98 60.63 2f09 s VAL 54 Cb 0.07 -2.77 0.15 0.00 0.00 0.00 0.00 36.38 33.83 2f09 s VAL 54 CO 0.09 -0.19 0.68 0.12 0.00 0.00 0.00 175.10 175.80 2f09 s PHE 55 N 1.22 3.30 -0.26 5.22 2.19 0.12 -1.21 117.98 128.55 2f09 s PHE 55 Ca -0.03 -1.38 -0.10 0.00 0.33 0.00 0.00 56.93 55.75 2f09 s PHE 55 Cb -0.20 -3.91 -0.04 0.00 -1.31 0.00 0.00 43.02 37.56 2f09 s PHE 55 CO -0.02 -1.13 0.15 -0.46 1.83 0.00 0.00 175.22 175.59 2f09 s TRP 56 N 1.64 3.20 -0.30 10.12 -0.00 0.13 0.04 118.94 133.76 2f09 s TRP 56 Ca 0.12 -0.00 -0.08 0.00 -0.00 0.00 0.00 56.10 56.13 2f09 s TRP 56 Cb -0.21 -2.32 0.00 0.00 -0.00 0.00 0.00 33.47 30.95 2f09 s TRP 56 CO -0.00 -0.17 0.11 0.45 -0.00 0.00 0.00 176.95 177.34 2f09 s SER 57 N 1.58 5.29 -0.58 5.86 0.15 0.14 -0.41 113.70 125.73 2f09 s SER 57 Ca 0.07 -0.67 0.06 0.00 0.70 0.00 0.00 55.95 56.11 2f09 s SER 57 Cb -0.15 -1.93 0.29 0.00 -1.71 0.00 0.00 66.02 62.52 2f09 s SER 57 CO 0.08 -0.20 0.79 2.29 1.20 0.00 0.00 173.24 177.40 2f09 n LYS 58 N 4.91 2.48 0.00 5.44 2.85 -0.41 -0.56 118.16 132.88 2f09 n LYS 58 Ca -0.14 -4.51 0.00 0.00 -1.05 0.00 0.00 58.31 52.61 2f09 n LYS 58 Cb 0.48 -2.11 0.00 0.00 -0.65 0.00 0.00 35.03 32.75 2f09 n LYS 58 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2f09 n GLY 59 N 0.51 1.00 1.33 2.58 0.00 -1.26 -3.92 105.19 105.44 2f09 n GLY 59 Ca 0.29 -1.03 0.10 0.00 0.00 0.00 0.00 46.02 45.38 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 0.72 4.17 -4.10 1.61 9.92 -1.26 -4.88 116.55 122.73 2f09 n ASP 60 Ca 0.00 -2.25 -0.23 0.00 -0.53 0.00 0.00 54.79 51.78 2f09 n ASP 60 Cb 0.00 -0.50 -0.15 0.00 -0.64 0.00 0.00 41.12 39.83 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 -1.46 1.34 -0.04 -1.24 -1.05 -1.25 0.40 118.70 115.40 2f09 s GLU 61 Ca 0.46 -0.51 0.05 0.00 -0.15 0.00 0.00 54.97 54.82 2f09 s GLU 61 Cb 0.27 -1.24 -0.01 0.00 -0.44 0.00 0.00 34.13 32.72 2f09 s GLU 61 CO 0.26 0.25 -0.20 0.00 0.95 0.00 0.00 175.26 176.53 2f09 s ALA 62 N -0.11 1.70 -0.02 -0.84 0.00 0.10 -1.28 121.76 121.31 2f09 s ALA 62 Ca 0.01 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.20 2f09 s ALA 62 Cb -0.08 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 2f09 s ALA 62 CO 0.00 0.33 -0.14 0.99 0.00 0.00 0.00 175.76 176.95 2f09 s THR 63 N -0.11 1.13 -0.35 0.00 2.01 0.46 -3.42 115.64 115.36 2f09 s THR 63 Ca -0.02 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2f09 s THR 63 Cb -0.11 -0.95 0.10 0.00 0.01 0.00 0.00 72.50 71.55 2f09 s THR 63 CO 0.02 0.32 0.08 -0.69 -0.69 0.00 0.00 174.62 173.66 2f09 s VAL 64 N -0.18 1.98 -0.25 3.82 1.01 0.16 0.18 120.40 127.12 2f09 s VAL 64 Ca 0.02 -2.20 -0.03 0.00 0.00 0.00 0.00 61.98 59.77 2f09 s VAL 64 Cb -0.07 -2.46 0.09 0.00 0.00 0.00 0.00 36.38 33.93 2f09 s VAL 64 CO 0.00 -0.63 0.10 -0.47 0.00 0.00 0.00 175.10 174.10 2f09 s TYR 65 N 0.98 0.66 0.03 5.22 6.14 -0.35 -1.02 117.35 129.01 2f09 s TYR 65 Ca 0.11 -0.92 -0.03 0.00 0.64 0.00 0.00 57.07 56.87 2f09 s TYR 65 Cb -0.19 -1.03 -0.04 0.00 0.42 0.00 0.00 41.96 41.12 2f09 s TYR 65 CO -0.11 -0.74 0.24 0.21 0.64 0.00 0.00 175.55 175.79 2f09 s LYS 66 N 1.98 3.51 0.55 4.97 2.47 0.24 -3.84 119.74 129.62 2f09 s LYS 66 Ca 0.06 -0.24 0.37 0.00 -1.56 0.00 0.00 55.97 54.60 2f09 s LYS 66 Cb -0.16 -3.04 1.54 0.00 -1.46 0.00 0.00 37.83 34.71 2f09 s LYS 66 CO -0.25 0.62 1.77 -0.09 0.16 0.00 0.00 175.35 177.57 2f09 h ARG 67 N 3.55 0.00 0.00 4.03 2.43 -1.97 0.84 114.38 123.26 2f09 h ARG 67 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2f09 h ARG 67 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2f09 h ARG 67 CO 0.70 0.00 -1.32 -0.25 -1.51 0.00 0.00 179.97 177.60 2f09 n ASP 68 N -4.09 0.78 -3.19 -3.80 8.00 -1.26 -4.92 116.55 108.07 2f09 n ASP 68 Ca 0.26 -0.51 0.04 0.00 0.71 0.00 0.00 54.79 55.29 2f09 n ASP 68 Cb 1.28 1.39 -0.02 0.00 -0.02 0.00 0.00 41.12 43.76 2f09 n ASP 68 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2f09 s ARG 69 N -2.99 0.33 -0.06 -1.24 6.06 0.29 -5.11 118.95 116.22 2f09 s ARG 69 Ca 0.01 0.62 -0.15 0.00 -2.50 0.00 0.00 55.73 53.70 2f09 s ARG 69 Cb 0.13 0.35 -0.05 0.00 0.06 0.00 0.00 34.95 35.44 2f09 s ARG 69 CO 0.77 -0.32 0.39 0.42 -2.50 0.00 0.00 175.30 174.06 2f09 s ILE 70 N 2.86 5.13 0.00 4.11 1.09 -1.22 -0.59 121.20 132.59 2f09 s ILE 70 Ca 0.05 0.79 0.00 0.00 -1.10 0.00 0.00 60.65 60.39 2f09 s ILE 70 Cb -0.11 -3.71 0.00 0.00 -1.06 0.00 0.00 42.46 37.58 2f09 s ILE 70 CO -0.15 0.49 0.00 0.55 -0.10 0.00 0.00 174.94 175.73 2f09 n VAL 71 N 2.58 0.00 -3.71 2.92 3.14 -0.19 -4.97 118.33 118.10 2f09 n VAL 71 Ca -0.12 -0.11 -0.13 0.00 -2.96 0.00 0.00 64.34 61.02 2f09 n VAL 71 Cb 0.52 0.63 -0.13 0.00 -1.06 0.00 0.00 33.84 33.80 2f09 n VAL 71 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2f09 s LEU 72 N -1.02 0.27 0.00 6.55 1.02 -0.98 -4.93 118.68 119.60 2f09 s LEU 72 Ca 0.00 0.51 0.08 0.00 0.02 0.00 0.00 54.13 54.74 2f09 s LEU 72 Cb 0.00 0.67 0.13 0.00 0.02 0.00 0.00 46.19 47.01 2f09 s LEU 72 CO 0.00 -0.18 1.03 -0.46 0.02 0.00 0.00 176.35 176.76 2f09 n ASN 73 N 4.51 0.29 -3.20 2.29 6.94 -1.26 0.40 115.26 125.22 2f09 n ASN 73 Ca -0.21 -1.96 -0.10 0.00 -0.02 0.00 0.00 54.58 52.29 2f09 n ASN 73 Cb 0.52 -0.21 -0.04 0.00 -2.36 0.00 0.00 39.78 37.68 2f09 n ASN 73 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2f09 s ASN 74 N -1.27 -0.16 -0.17 0.53 3.84 -1.26 -4.97 114.94 111.48 2f09 s ASN 74 Ca 0.10 -1.52 -0.07 0.00 0.21 0.00 0.00 52.86 51.58 2f09 s ASN 74 Cb 0.12 1.16 0.08 0.00 -0.55 0.00 0.00 41.25 42.06 2f09 s ASN 74 CO -0.05 -0.18 0.37 0.00 -2.79 0.00 0.00 177.10 174.45 2f09 s GLN 76 N 2.36 0.87 0.26 0.00 -0.21 -1.26 -0.72 119.66 120.97 2f09 s GLN 76 Ca -0.02 -0.92 -0.30 0.00 0.02 0.00 0.00 55.36 54.14 2f09 s GLN 76 Cb -0.11 -2.16 -0.09 0.00 1.00 0.00 0.00 33.01 31.64 2f09 s GLN 76 CO -0.11 -0.83 1.05 -1.17 -2.12 0.00 0.00 175.29 172.10 2f09 s LEU 77 N 1.62 4.58 -0.25 2.90 1.98 0.16 -4.89 118.68 124.78 2f09 s LEU 77 Ca 0.05 2.16 -0.05 0.00 -2.89 0.00 0.00 54.13 53.40 2f09 s LEU 77 Cb -0.18 -3.62 -0.14 0.00 0.66 0.00 0.00 46.19 42.91 2f09 s LEU 77 CO -0.17 -0.05 -0.27 0.00 -1.89 0.00 0.00 176.35 173.97 2f09 n GLN 78 N 1.34 0.59 -3.38 1.98 1.13 -1.26 -4.88 117.38 112.90 2f09 n GLN 78 Ca -0.01 0.19 0.02 0.00 -1.94 0.00 0.00 57.00 55.25 2f09 n GLN 78 Cb 0.46 -1.47 -0.04 0.00 0.11 0.00 0.00 30.24 29.30 2f09 n GLN 78 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2f09 s ASN 79 N -6.80 -0.55 0.00 1.08 3.84 -1.26 -5.06 114.94 106.19 2f09 s ASN 79 Ca -0.35 0.74 0.24 0.00 0.21 0.00 0.00 52.86 53.70 2f09 s ASN 79 Cb 0.11 1.62 1.03 0.00 -0.55 0.00 0.00 41.25 43.46 2f09 s ASN 79 CO 0.52 -0.10 1.71 -0.81 -2.79 0.00 0.00 177.10 175.63 2f09 n PRO 80 N 4.96 1.49 0.20 0.43 -0.04 -1.26 -4.22 135.00 136.57 2f09 n PRO 80 Ca -0.09 -0.73 0.13 0.00 -0.04 0.00 0.00 63.50 62.77 2f09 n PRO 80 Cb 0.53 -1.41 0.26 0.00 -0.04 0.00 0.00 33.50 32.84 2f09 n PRO 80 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2f09 h GLN 81 N 1.58 0.00 0.00 0.54 4.15 -1.93 -2.79 115.11 116.66 2f09 h GLN 81 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2f09 h GLN 81 Cb 0.34 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.03 2f09 h GLN 81 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 178.83 177.44