#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fh3 s ARG 2 N 0.00 1.17 -0.06 7.34 3.03 -1.11 -4.88 118.95 124.44 1fh3 s ARG 2 Ca 0.00 -1.42 0.03 0.00 2.03 0.00 0.00 55.73 56.37 1fh3 s ARG 2 Cb 0.00 0.31 0.01 0.00 -1.03 0.00 0.00 34.95 34.24 1fh3 s ARG 2 CO 0.00 -0.40 -0.14 -0.51 -1.13 0.00 0.00 175.30 173.12 1fh3 s ASP 3 N -3.07 1.87 0.31 -2.89 1.01 -1.26 -2.24 116.67 110.40 1fh3 s ASP 3 Ca 0.28 -0.31 -0.15 0.00 0.71 0.00 0.00 52.55 53.08 1fh3 s ASP 3 Cb 0.05 -0.74 0.06 0.00 1.01 0.00 0.00 42.92 43.30 1fh3 s ASP 3 CO 0.06 0.07 0.75 0.61 0.21 0.00 0.00 175.17 176.88 1fh3 n GLY 4 N 3.56 1.00 3.73 0.21 0.00 -1.03 -4.98 105.19 107.68 1fh3 n GLY 4 Ca -0.21 -1.21 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1fh3 n GLY 4 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fh3 s TYR 5 N -2.85 3.56 0.19 1.61 1.51 -1.26 -2.39 117.35 117.72 1fh3 s TYR 5 Ca 0.15 1.54 -0.10 0.00 -1.01 0.00 0.00 57.07 57.65 1fh3 s TYR 5 Cb -0.04 -3.30 -0.07 0.00 -0.11 0.00 0.00 41.96 38.44 1fh3 s TYR 5 CO 0.09 -0.73 0.52 -1.50 -1.11 0.00 0.00 175.55 172.83 1fh3 s ILE 6 N 0.13 4.95 0.27 2.71 2.07 0.07 -3.52 121.20 127.87 1fh3 s ILE 6 Ca 0.52 0.51 -0.10 0.00 -1.41 0.00 0.00 60.65 60.16 1fh3 s ILE 6 Cb -0.29 -3.64 0.04 0.00 0.13 0.00 0.00 42.46 38.70 1fh3 s ILE 6 CO 0.33 0.03 0.56 0.00 -1.91 0.00 0.00 174.94 173.95 1fh3 n ALA 7 N 0.17 -1.26 -2.21 1.50 0.00 -1.26 -2.95 120.51 114.50 1fh3 n ALA 7 Ca -0.02 -0.88 -0.19 0.00 0.00 0.00 0.00 53.44 52.36 1fh3 n ALA 7 Cb 0.52 0.69 -0.00 0.00 0.00 0.00 0.00 19.45 20.66 1fh3 n ALA 7 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fh3 s GLN 8 N -2.06 2.84 0.20 0.00 -0.21 0.12 -4.47 119.66 116.09 1fh3 s GLN 8 Ca 0.11 -1.24 -0.32 0.00 0.02 0.00 0.00 55.36 53.94 1fh3 s GLN 8 Cb -0.03 -2.68 -0.11 0.00 1.00 0.00 0.00 33.01 31.18 1fh3 s GLN 8 CO 0.08 -0.14 1.67 -2.14 -2.12 0.00 0.00 175.29 172.65 1fh3 s PRO 9 N -4.23 4.15 -0.14 2.91 0.02 -1.20 -2.30 135.00 134.21 1fh3 s PRO 9 Ca 0.50 2.54 -0.00 0.00 0.02 0.00 0.00 61.00 64.06 1fh3 s PRO 9 Cb -0.08 -3.09 0.03 0.00 0.02 0.00 0.00 34.50 31.38 1fh3 s PRO 9 CO 0.31 -0.71 -0.08 -1.21 -0.33 0.00 0.00 177.00 174.99 1fh3 s GLU 10 N 1.06 1.61 -0.97 5.54 2.02 -0.28 -4.55 118.70 123.14 1fh3 s GLU 10 Ca 0.73 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 55.30 1fh3 s GLU 10 Cb -0.48 -1.85 0.00 0.00 0.10 0.00 0.00 34.13 31.90 1fh3 s GLU 10 CO 0.33 -0.33 0.00 -1.71 0.02 0.00 0.00 175.26 173.57 1fh3 n ASN 11 N 4.88 -4.16 -4.26 -0.19 2.85 0.39 -0.71 115.26 114.07 1fh3 n ASN 11 Ca -0.13 0.23 -0.44 0.00 -0.11 0.00 0.00 54.58 54.13 1fh3 n ASN 11 Cb 0.49 -2.46 -0.05 0.00 1.24 0.00 0.00 39.78 39.00 1fh3 n ASN 11 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1fh3 n VAL 13 N 4.03 2.49 -3.33 0.00 0.24 -1.26 0.15 118.33 120.65 1fh3 n VAL 13 Ca 0.08 -0.26 -0.21 0.00 -2.04 0.00 0.00 64.34 61.91 1fh3 n VAL 13 Cb 0.44 -1.22 0.02 0.00 -1.47 0.00 0.00 33.84 31.61 1fh3 n VAL 13 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1fh3 s TYR 14 N -1.99 1.93 0.05 6.34 2.02 -1.26 -4.59 117.35 119.85 1fh3 s TYR 14 Ca 0.74 -0.66 0.02 0.00 -0.37 0.00 0.00 57.07 56.81 1fh3 s TYR 14 Cb -0.31 -2.16 -0.03 0.00 -0.40 0.00 0.00 41.96 39.06 1fh3 s TYR 14 CO 0.50 -0.69 -0.07 -1.01 -1.57 0.00 0.00 175.55 172.71 1fh3 s HIS 15 N -2.60 0.69 0.56 2.71 3.76 -1.26 -3.89 115.29 115.25 1fh3 s HIS 15 Ca 0.52 -0.62 0.07 0.00 -0.15 0.00 0.00 55.06 54.87 1fh3 s HIS 15 Cb -0.05 -0.41 0.07 0.00 1.11 0.00 0.00 32.58 33.29 1fh3 s HIS 15 CO 0.32 -0.12 0.77 0.00 -0.85 0.00 0.00 174.74 174.86 1fh3 s PHE 17 N -2.68 2.84 -0.47 0.00 0.40 -1.26 -4.96 117.98 111.84 1fh3 s PHE 17 Ca 0.61 -1.54 -0.26 0.00 -0.60 0.00 0.00 56.93 55.13 1fh3 s PHE 17 Cb -0.07 -1.96 -0.06 0.00 0.51 0.00 0.00 43.02 41.44 1fh3 s PHE 17 CO 0.38 -0.76 2.31 -2.14 0.70 0.00 0.00 175.22 175.72 1fh3 s PRO 18 N 1.32 2.29 0.00 0.24 0.02 -1.26 -0.95 135.00 136.65 1fh3 s PRO 18 Ca 0.04 1.38 0.00 0.00 0.02 0.00 0.00 61.00 62.44 1fh3 s PRO 18 Cb -0.14 -4.53 0.00 0.00 0.02 0.00 0.00 34.50 29.85 1fh3 s PRO 18 CO -0.11 -3.07 0.00 0.41 -0.33 0.00 0.00 177.00 173.90 1fh3 n GLY 19 N 5.93 2.05 0.00 0.52 0.00 -1.26 -4.97 105.19 107.46 1fh3 n GLY 19 Ca 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1fh3 n GLY 19 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1fh3 n SER 20 N 0.00 0.00 -0.34 1.61 7.64 -0.13 -4.93 113.62 117.48 1fh3 n SER 20 Ca 0.00 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.06 1fh3 n SER 20 Cb 0.00 0.00 0.35 0.00 -1.01 0.00 0.00 64.21 63.55 1fh3 n SER 20 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1fh3 n SER 21 N 0.00 -0.03 -0.04 6.43 7.64 -1.26 -0.05 113.62 126.31 1fh3 n SER 21 Ca 0.00 1.69 -0.16 0.00 1.01 0.00 0.00 58.87 61.41 1fh3 n SER 21 Cb 0.00 -0.65 -0.07 0.00 -1.01 0.00 0.00 64.21 62.48 1fh3 n SER 21 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1fh3 h GLY 22 N 0.00 0.77 1.71 0.23 0.00 -1.96 -0.84 103.07 102.98 1fh3 h GLY 22 Ca 0.65 -1.03 -0.13 0.00 0.00 0.00 0.00 47.33 46.82 1fh3 h GLY 22 CO -0.91 0.92 -0.81 0.00 0.00 0.00 0.00 176.54 175.73 1fh3 h ASP 24 N 0.00 0.00 -0.22 0.00 3.58 -0.44 0.37 116.42 119.71 1fh3 h ASP 24 Ca -0.05 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.28 1fh3 h ASP 24 Cb 1.48 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.53 1fh3 h ASP 24 CO 0.07 0.31 -0.31 0.74 -2.88 0.00 0.00 179.24 177.17 1fh3 h THR 25 N 0.00 1.32 -0.83 2.25 2.02 -0.90 -2.36 112.91 114.41 1fh3 h THR 25 Ca -0.00 -1.50 -0.04 0.00 0.77 0.00 0.00 66.41 65.64 1fh3 h THR 25 Cb 0.58 1.76 -0.04 0.00 -1.74 0.00 0.00 68.15 68.71 1fh3 h THR 25 CO 0.04 0.47 0.37 -0.07 0.37 0.00 0.00 175.52 176.70 1fh3 h LEU 26 N 0.30 1.11 -0.60 2.58 3.38 -1.04 -2.20 115.31 118.83 1fh3 h LEU 26 Ca 0.03 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.93 1fh3 h LEU 26 Cb 0.88 -0.29 -0.07 0.00 0.09 0.00 0.00 40.66 41.28 1fh3 h LEU 26 CO 0.07 0.95 0.23 0.00 0.09 0.00 0.00 178.44 179.79 1fh3 h LYS 28 N 0.42 0.13 0.00 0.00 1.57 -0.85 0.42 116.57 118.26 1fh3 h LYS 28 Ca 0.30 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1fh3 h LYS 28 Cb 0.36 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1fh3 h LYS 28 CO -0.29 0.17 0.00 1.05 -0.57 0.00 0.00 179.45 179.81 1fh3 h GLU 29 N 0.05 0.00 0.00 3.15 4.11 -1.21 -2.27 114.58 118.41 1fh3 h GLU 29 Ca 0.03 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.39 1fh3 h GLU 29 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1fh3 h GLU 29 CO -0.01 0.00 -0.96 0.87 0.07 0.00 0.00 179.01 178.99 1fh3 h LYS 30 N 0.00 0.00 0.00 1.06 6.56 -1.09 -3.48 116.57 119.62 1fh3 h LYS 30 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1fh3 h LYS 30 Cb 0.72 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.38 1fh3 h LYS 30 CO 0.00 0.17 0.00 0.41 -2.06 0.00 0.00 179.45 177.97 1fh3 n GLY 31 N 1.25 1.93 3.63 3.86 0.00 -0.20 -4.57 105.19 111.09 1fh3 n GLY 31 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1fh3 n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fh3 s GLY 32 N -2.00 1.95 0.00 -0.02 0.00 0.13 -4.22 107.32 103.16 1fh3 s GLY 32 Ca 0.00 -0.79 0.25 0.00 0.00 0.00 0.00 44.72 44.18 1fh3 s GLY 32 CO 0.00 0.82 1.54 -1.30 0.00 0.00 0.00 173.10 174.16 1fh3 n THR 33 N 4.81 0.11 -3.45 0.90 -2.24 -1.26 -3.62 114.28 109.52 1fh3 n THR 33 Ca -0.10 -0.39 -0.12 0.00 -2.27 0.00 0.00 64.05 61.17 1fh3 n THR 33 Cb 0.51 0.78 -0.02 0.00 -2.10 0.00 0.00 70.33 69.50 1fh3 n THR 33 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1fh3 s SER 34 N -1.84 -0.54 0.02 3.42 0.01 -1.26 -5.03 113.70 108.48 1fh3 s SER 34 Ca 0.34 -0.04 -0.27 0.00 1.31 0.00 0.00 55.95 57.29 1fh3 s SER 34 Cb 0.20 0.60 0.09 0.00 0.21 0.00 0.00 66.02 67.13 1fh3 s SER 34 CO 0.31 -0.99 1.23 -0.83 0.41 0.00 0.00 173.24 173.38 1fh3 s GLY 35 N -2.76 -0.10 0.23 3.44 0.00 -1.26 -1.25 107.32 105.62 1fh3 s GLY 35 Ca 0.02 0.01 -0.20 0.00 0.00 0.00 0.00 44.72 44.55 1fh3 s GLY 35 CO -0.12 4.49 0.99 0.30 0.00 0.00 0.00 173.10 178.77 1fh3 s HIS 36 N -2.09 0.11 0.61 1.90 3.76 -0.98 -4.94 115.29 113.66 1fh3 s HIS 36 Ca 0.27 -0.58 0.02 0.00 -0.15 0.00 0.00 55.06 54.62 1fh3 s HIS 36 Cb -0.00 0.74 0.07 0.00 1.11 0.00 0.00 32.58 34.50 1fh3 s HIS 36 CO 0.00 -1.08 0.85 0.00 -0.85 0.00 0.00 174.74 173.66 1fh3 n GLY 38 N -2.49 1.48 3.23 0.00 0.00 -1.18 -4.61 105.19 101.62 1fh3 n GLY 38 Ca 0.11 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.88 1fh3 n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fh3 s PHE 39 N -6.29 1.52 -0.31 1.61 5.36 -1.26 -3.85 117.98 114.76 1fh3 s PHE 39 Ca 0.05 -0.42 0.01 0.00 -0.96 0.00 0.00 56.93 55.61 1fh3 s PHE 39 Cb -0.01 -0.85 0.10 0.00 -0.34 0.00 0.00 43.02 41.91 1fh3 s PHE 39 CO 0.03 0.12 0.06 0.21 -1.46 0.00 0.00 175.22 174.18 1fh3 s LYS 40 N -1.72 1.10 -0.09 10.12 2.47 0.83 -4.91 119.74 127.55 1fh3 s LYS 40 Ca 0.03 -1.37 -0.30 0.00 -1.56 0.00 0.00 55.97 52.78 1fh3 s LYS 40 Cb -0.10 -2.52 -0.04 0.00 -1.46 0.00 0.00 37.83 33.71 1fh3 s LYS 40 CO 0.03 -0.92 1.54 0.08 0.16 0.00 0.00 175.35 176.23 1fh3 s VAL 41 N 1.32 3.79 0.00 4.02 1.01 -1.26 -1.00 120.40 128.28 1fh3 s VAL 41 Ca 0.08 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.02 1fh3 s VAL 41 Cb -0.18 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1fh3 s VAL 41 CO -0.16 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1fh3 n GLY 42 N 3.97 4.30 0.93 4.51 0.00 -1.26 -4.90 105.19 112.74 1fh3 n GLY 42 Ca 0.16 -0.84 -0.00 0.00 0.00 0.00 0.00 46.02 45.34 1fh3 n GLY 42 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fh3 n HIS 43 N 0.00 0.00 0.00 1.61 8.25 -0.62 -5.15 115.22 119.31 1fh3 n HIS 43 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1fh3 n HIS 43 Cb 0.00 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.08 1fh3 n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fh3 n GLY 44 N 3.30 -0.27 3.73 -1.41 0.00 -0.17 -5.03 105.19 105.34 1fh3 n GLY 44 Ca -0.01 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 1fh3 n GLY 44 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fh3 s LEU 45 N 0.00 4.45 0.19 0.99 2.96 -1.26 -0.12 118.68 125.89 1fh3 s LEU 45 Ca 0.00 1.67 -0.21 0.00 -0.22 0.00 0.00 54.13 55.37 1fh3 s LEU 45 Cb 0.00 -3.49 0.05 0.00 0.50 0.00 0.00 46.19 43.25 1fh3 s LEU 45 CO 0.00 -0.09 0.60 0.00 -1.32 0.00 0.00 176.35 175.53 1fh3 s ALA 46 N 0.24 -1.36 0.36 5.97 0.00 -1.25 -4.22 121.76 121.50 1fh3 s ALA 46 Ca 0.46 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.61 1fh3 s ALA 46 Cb -0.22 0.86 0.02 0.00 0.00 0.00 0.00 23.12 23.78 1fh3 s ALA 46 CO 0.28 -0.82 0.19 0.00 0.00 0.00 0.00 175.76 175.40 1fh3 s TRP 48 N -1.95 1.63 -0.02 0.00 -0.11 -0.20 -0.75 118.94 117.54 1fh3 s TRP 48 Ca 0.14 -0.40 -0.02 0.00 1.22 0.00 0.00 56.10 57.04 1fh3 s TRP 48 Cb -0.01 -0.93 0.00 0.00 -1.50 0.00 0.00 33.47 31.03 1fh3 s TRP 48 CO 0.09 0.13 0.06 0.00 -4.62 0.00 0.00 176.95 172.61 1fh3 n ASN 50 N 2.72 4.05 -3.59 0.00 5.15 -0.38 -2.48 115.26 120.72 1fh3 n ASN 50 Ca -0.15 -3.17 -0.06 0.00 -0.60 0.00 0.00 54.58 50.60 1fh3 n ASN 50 Cb 0.59 -0.62 -0.04 0.00 -0.53 0.00 0.00 39.78 39.18 1fh3 n ASN 50 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fh3 s ALA 51 N -2.93 -2.01 0.03 5.20 0.00 -1.23 -4.73 121.76 116.10 1fh3 s ALA 51 Ca 0.47 1.61 -0.14 0.00 0.00 0.00 0.00 51.96 53.89 1fh3 s ALA 51 Cb 0.38 -0.64 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1fh3 s ALA 51 CO 0.09 -0.41 0.32 -0.51 0.00 0.00 0.00 175.76 175.25 1fh3 s LEU 52 N -1.52 0.83 0.88 0.00 2.01 -0.95 -3.83 118.68 116.10 1fh3 s LEU 52 Ca 0.05 -0.13 -0.12 0.00 0.01 0.00 0.00 54.13 53.94 1fh3 s LEU 52 Cb -0.01 1.38 0.12 0.00 0.01 0.00 0.00 46.19 47.69 1fh3 s LEU 52 CO -0.04 -0.60 1.10 -2.16 1.01 0.00 0.00 176.35 175.67 1fh3 s PRO 53 N -2.36 1.37 0.05 1.29 0.04 -1.26 -2.76 135.00 131.37 1fh3 s PRO 53 Ca -0.06 0.65 0.13 0.00 0.04 0.00 0.00 61.00 61.76 1fh3 s PRO 53 Cb -0.01 -1.84 0.58 0.00 0.04 0.00 0.00 34.50 33.27 1fh3 s PRO 53 CO -0.02 -2.12 1.42 -0.25 0.04 0.00 0.00 177.00 176.07 1fh3 n ASP 54 N -3.77 0.13 -0.25 6.66 8.00 -1.26 -2.24 116.55 123.81 1fh3 n ASP 54 Ca 0.07 0.54 0.15 0.00 0.71 0.00 0.00 54.79 56.25 1fh3 n ASP 54 Cb 0.56 -0.56 0.65 0.00 -0.02 0.00 0.00 41.12 41.75 1fh3 n ASP 54 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1fh3 n ASN 55 N -1.65 0.83 -4.88 -2.24 6.94 -1.26 -4.75 115.26 108.25 1fh3 n ASN 55 Ca 0.02 -1.12 -0.35 0.00 -0.02 0.00 0.00 54.58 53.11 1fh3 n ASN 55 Cb 0.14 -0.01 -0.06 0.00 -2.36 0.00 0.00 39.78 37.50 1fh3 n ASN 55 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1fh3 s VAL 56 N -2.13 5.43 -0.00 3.53 1.01 -0.95 -5.09 120.40 122.20 1fh3 s VAL 56 Ca 0.38 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.47 1fh3 s VAL 56 Cb 0.21 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 1fh3 s VAL 56 CO 0.39 0.50 -0.21 -0.83 0.00 0.00 0.00 175.10 174.95 1fh3 s GLY 57 N -1.40 1.05 0.00 4.51 0.00 -1.26 -4.95 107.32 105.27 1fh3 s GLY 57 Ca 0.20 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.98 1fh3 s GLY 57 CO 0.10 -0.81 0.00 0.29 0.00 0.00 0.00 173.10 172.68 1fh3 n ILE 58 N 2.40 0.00 -2.30 0.90 -5.35 -1.26 -3.22 119.36 110.53 1fh3 n ILE 58 Ca -0.16 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 61.90 1fh3 n ILE 58 Cb 0.53 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.41 1fh3 n ILE 58 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1fh3 s ILE 59 N 3.97 4.04 -0.20 7.28 -1.09 -1.23 -0.46 121.20 133.51 1fh3 s ILE 59 Ca 0.00 1.24 -0.00 0.00 -2.23 0.00 0.00 60.65 59.66 1fh3 s ILE 59 Cb 0.00 -3.87 0.05 0.00 -1.58 0.00 0.00 42.46 37.06 1fh3 s ILE 59 CO 0.00 -0.18 -0.04 -0.69 -1.23 0.00 0.00 174.94 172.80 1fh3 s VAL 60 N 3.93 1.21 0.09 2.92 1.01 -1.26 -4.80 120.40 123.50 1fh3 s VAL 60 Ca 0.61 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.71 1fh3 s VAL 60 Cb -0.24 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.67 1fh3 s VAL 60 CO 0.21 -0.02 0.00 1.21 0.00 0.00 0.00 175.10 176.50 1fh3 n GLU 61 N 4.81 -0.80 -3.53 2.72 4.07 -1.26 -4.41 120.64 122.24 1fh3 n GLU 61 Ca -0.12 0.53 -0.38 0.00 -0.06 0.00 0.00 57.16 57.13 1fh3 n GLU 61 Cb 0.46 -0.98 -0.05 0.00 -0.06 0.00 0.00 31.44 30.82 1fh3 n GLU 61 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1fh3 n GLY 62 N -1.72 4.23 0.00 8.31 0.00 -1.26 -4.87 105.19 109.87 1fh3 n GLY 62 Ca 0.00 -2.60 0.00 0.00 0.00 0.00 0.00 46.02 43.42 1fh3 n GLY 62 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1fh3 n GLU 63 N 2.27 0.00 -2.50 1.61 2.13 -1.26 -5.18 120.64 117.70 1fh3 n GLU 63 Ca 0.23 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 58.00 1fh3 n GLU 63 Cb 0.37 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.09 1fh3 n GLU 63 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1fh3 n LYS 64 N 0.00 0.52 -1.90 5.31 0.00 -1.26 -5.11 118.16 115.72 1fh3 n LYS 64 Ca 0.00 -1.20 -0.42 0.00 0.00 0.00 0.00 58.31 56.69 1fh3 n LYS 64 Cb 0.00 1.40 -0.03 0.00 0.00 0.00 0.00 35.03 36.40 1fh3 n LYS 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1fh3 s HIS 66 N 3.17 1.47 0.00 0.00 -3.43 0.11 -4.96 115.29 111.65 1fh3 s HIS 66 Ca 0.76 -1.52 0.00 0.00 -0.80 0.00 0.00 55.06 53.50 1fh3 s HIS 66 Cb -0.39 -0.41 0.00 0.00 -1.43 0.00 0.00 32.58 30.35 1fh3 s HIS 66 CO 0.33 -1.03 0.00 0.43 -2.00 0.00 0.00 174.74 172.47