#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fh3 n ARG 2 N 0.00 0.39 -4.25 7.34 0.00 0.33 -4.92 116.66 115.54 1fh3 n ARG 2 Ca 0.00 -2.39 -0.17 0.00 -0.00 0.00 0.00 57.85 55.29 1fh3 n ARG 2 Cb 0.00 1.79 -0.14 0.00 -0.00 0.00 0.00 32.46 34.11 1fh3 n ARG 2 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1fh3 s ASP 3 N -2.68 1.06 0.33 2.89 1.01 -1.26 -0.86 116.67 117.16 1fh3 s ASP 3 Ca 0.25 -0.30 -0.18 0.00 0.71 0.00 0.00 52.55 53.03 1fh3 s ASP 3 Cb 0.01 -0.07 0.05 0.00 1.01 0.00 0.00 42.92 43.93 1fh3 s ASP 3 CO 0.18 0.01 0.83 -0.83 0.21 0.00 0.00 175.17 175.57 1fh3 s GLY 4 N -0.71 0.25 -0.04 0.21 0.00 -0.75 -4.99 107.32 101.30 1fh3 s GLY 4 Ca -0.00 -0.60 -0.30 0.00 0.00 0.00 0.00 44.72 43.82 1fh3 s GLY 4 CO 0.00 0.18 1.02 -0.19 0.00 0.00 0.00 173.10 174.11 1fh3 s TYR 5 N -2.51 3.56 -0.01 1.90 2.02 -1.26 -1.27 117.35 119.77 1fh3 s TYR 5 Ca 0.16 1.60 -0.20 0.00 -0.37 0.00 0.00 57.07 58.26 1fh3 s TYR 5 Cb -0.05 -3.19 -0.05 0.00 -0.40 0.00 0.00 41.96 38.27 1fh3 s TYR 5 CO 0.10 -0.27 0.56 -1.50 -1.57 0.00 0.00 175.55 172.86 1fh3 s ILE 6 N 1.48 4.94 0.00 2.71 2.07 0.21 -3.10 121.20 129.51 1fh3 s ILE 6 Ca 0.51 1.17 0.00 0.00 -1.41 0.00 0.00 60.65 60.92 1fh3 s ILE 6 Cb -0.21 -3.89 0.00 0.00 0.13 0.00 0.00 42.46 38.49 1fh3 s ILE 6 CO 0.24 0.43 0.00 0.00 -1.91 0.00 0.00 174.94 173.70 1fh3 n ALA 7 N 2.70 0.00 -2.95 1.50 0.00 -1.22 -2.13 120.51 118.40 1fh3 n ALA 7 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 1fh3 n ALA 7 Cb 0.51 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.90 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 3.28 1.37 0.62 0.00 -0.21 -1.26 -3.77 119.66 119.70 1fh3 s GLN 8 Ca 0.00 -1.21 -0.18 0.00 0.02 0.00 0.00 55.36 53.99 1fh3 s GLN 8 Cb 0.00 0.43 -0.02 0.00 1.00 0.00 0.00 33.01 34.42 1fh3 s GLN 8 CO 0.00 -0.54 1.20 -2.14 -2.12 0.00 0.00 175.29 171.69 1fh3 s PRO 9 N -4.00 2.80 -0.15 2.91 0.02 -1.26 -3.37 135.00 131.95 1fh3 s PRO 9 Ca 0.20 1.79 -0.25 0.00 0.02 0.00 0.00 61.00 62.77 1fh3 s PRO 9 Cb 0.01 -1.91 -0.22 0.00 0.02 0.00 0.00 34.50 32.40 1fh3 s PRO 9 CO 0.05 -1.33 0.59 0.93 -0.33 0.00 0.00 177.00 176.90 1fh3 h GLU 10 N 0.60 0.00 -3.38 5.54 4.39 -1.39 -3.40 114.58 116.95 1fh3 h GLU 10 Ca -0.50 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.06 1fh3 h GLU 10 Cb 1.29 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 29.73 1fh3 h GLU 10 CO 0.54 0.89 -0.46 1.21 -1.16 0.00 0.00 179.01 180.03 1fh3 s ASN 11 N -6.26 -0.06 0.00 1.42 2.47 -1.24 -5.02 114.94 106.25 1fh3 s ASN 11 Ca -0.19 -0.02 0.00 0.00 0.42 0.00 0.00 52.86 53.07 1fh3 s ASN 11 Cb -0.01 0.27 0.00 0.00 -1.45 0.00 0.00 41.25 40.06 1fh3 s ASN 11 CO 0.60 -0.31 0.00 0.00 -3.72 0.00 0.00 177.10 173.67 1fh3 s VAL 13 N -2.33 1.76 0.00 0.00 -7.23 -1.26 -4.35 120.40 106.99 1fh3 s VAL 13 Ca 0.00 -2.20 0.00 0.00 -1.81 0.00 0.00 61.98 57.97 1fh3 s VAL 13 Cb 0.00 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.73 1fh3 s VAL 13 CO 0.00 -0.47 0.00 0.00 -0.31 0.00 0.00 175.10 174.32 1fh3 n TYR 14 N -0.47 0.00 -4.29 2.82 4.19 -0.90 -4.23 117.16 114.28 1fh3 n TYR 14 Ca -0.07 0.00 -0.19 0.00 3.31 0.00 0.00 57.90 60.96 1fh3 n TYR 14 Cb 0.61 0.00 -0.08 0.00 0.49 0.00 0.00 39.34 40.36 1fh3 n TYR 14 CO 0.00 0.00 0.00 -1.01 0.91 0.00 0.00 176.86 176.76 1fh3 s HIS 15 N 0.00 1.67 0.11 2.98 3.76 -1.26 -4.22 115.29 118.33 1fh3 s HIS 15 Ca 0.00 -1.60 0.00 0.00 -0.15 0.00 0.00 55.06 53.31 1fh3 s HIS 15 Cb 0.00 -0.72 -0.04 0.00 1.11 0.00 0.00 32.58 32.93 1fh3 s HIS 15 CO 0.00 -0.80 -0.01 0.00 -0.85 0.00 0.00 174.74 173.09 1fh3 s PHE 17 N -3.85 3.16 0.00 0.00 0.40 -1.26 -4.98 117.98 111.45 1fh3 s PHE 17 Ca 0.16 -1.81 -0.03 0.00 -0.60 0.00 0.00 56.93 54.65 1fh3 s PHE 17 Cb 0.07 -2.05 -0.13 0.00 0.51 0.00 0.00 43.02 41.42 1fh3 s PHE 17 CO -0.03 -0.79 2.08 -2.30 0.70 0.00 0.00 175.22 174.89 1fh3 n PRO 18 N 4.61 1.02 -0.14 0.24 -0.02 -1.26 -2.34 135.00 137.11 1fh3 n PRO 18 Ca -0.15 -0.50 0.05 0.00 -2.02 0.00 0.00 63.50 60.88 1fh3 n PRO 18 Cb 0.45 -1.74 0.06 0.00 -0.02 0.00 0.00 33.50 32.26 1fh3 n PRO 18 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fh3 n GLY 19 N 2.69 2.73 5.00 -1.23 0.00 -1.26 -5.02 105.19 108.10 1fh3 n GLY 19 Ca 0.21 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.78 0.00 -0.32 1.61 7.64 -0.99 -4.65 113.62 116.13 1fh3 n SER 20 Ca 0.07 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.06 1fh3 n SER 20 Cb 0.55 0.00 0.28 0.00 -1.01 0.00 0.00 64.21 64.03 1fh3 n SER 20 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1fh3 h SER 21 N 0.00 0.60 0.51 6.43 0.02 -1.96 0.18 113.55 119.33 1fh3 h SER 21 Ca 0.00 0.11 -0.15 0.00 -0.84 0.00 0.00 61.79 60.90 1fh3 h SER 21 Cb 0.00 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1fh3 h SER 21 CO 0.00 0.20 -0.68 1.23 -1.14 0.00 0.00 176.83 176.44 1fh3 h GLY 22 N 0.64 0.16 0.42 -3.77 0.00 -1.83 0.20 103.07 98.90 1fh3 h GLY 22 Ca 0.53 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.57 1fh3 h GLY 22 CO -0.40 0.20 -0.22 0.00 0.00 0.00 0.00 176.54 176.12 1fh3 h ASP 24 N -0.53 0.64 -0.34 0.00 3.58 -0.60 0.28 116.42 119.45 1fh3 h ASP 24 Ca -0.03 0.03 0.04 0.00 0.42 0.00 0.00 57.03 57.49 1fh3 h ASP 24 Cb 0.98 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.89 1fh3 h ASP 24 CO 0.04 0.40 0.12 0.74 -2.88 0.00 0.00 179.24 177.67 1fh3 h THR 25 N 0.77 0.91 -0.47 2.25 2.02 -0.62 0.28 112.91 118.05 1fh3 h THR 25 Ca 0.33 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 67.36 1fh3 h THR 25 Cb 0.21 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1fh3 h THR 25 CO -0.19 0.05 0.06 -0.07 0.37 0.00 0.00 175.52 175.74 1fh3 h LEU 26 N 0.27 0.75 -0.48 2.58 3.38 -1.06 -1.32 115.31 119.42 1fh3 h LEU 26 Ca 0.15 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1fh3 h LEU 26 Cb 0.12 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1fh3 h LEU 26 CO -0.15 0.83 0.24 0.00 0.09 0.00 0.00 178.44 179.45 1fh3 h LYS 28 N 0.48 0.60 -0.01 0.00 1.79 -0.15 0.29 116.57 119.57 1fh3 h LYS 28 Ca 0.21 -0.21 -0.12 0.00 -2.18 0.00 0.00 60.65 58.34 1fh3 h LYS 28 Cb 0.12 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.71 1fh3 h LYS 28 CO -0.15 0.76 -0.56 1.05 -1.08 0.00 0.00 179.45 179.47 1fh3 h GLU 29 N 0.39 0.05 0.04 3.15 4.11 -1.08 -2.81 114.58 118.42 1fh3 h GLU 29 Ca 0.09 -0.03 -0.23 0.00 0.07 0.00 0.00 59.36 59.26 1fh3 h GLU 29 Cb 0.52 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1fh3 h GLU 29 CO 0.03 0.60 -1.01 0.87 0.07 0.00 0.00 179.01 179.56 1fh3 h LYS 30 N 0.03 0.22 0.00 1.06 1.79 -1.05 -3.48 116.57 115.15 1fh3 h LYS 30 Ca -0.00 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.17 1fh3 h LYS 30 Cb 1.01 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1fh3 h LYS 30 CO 0.08 1.06 0.00 0.41 -1.08 0.00 0.00 179.45 179.92 1fh3 n GLY 31 N 1.15 0.99 3.87 3.86 0.00 0.51 -4.96 105.19 110.60 1fh3 n GLY 31 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.38 2.15 0.00 -0.02 0.00 0.73 -4.43 107.32 104.37 1fh3 s GLY 32 Ca 0.00 -0.65 0.25 0.00 0.00 0.00 0.00 44.72 44.32 1fh3 s GLY 32 CO 0.00 -0.39 1.38 -1.30 0.00 0.00 0.00 173.10 172.79 1fh3 n THR 33 N 2.00 0.00 -3.78 0.90 -2.24 -0.63 -3.87 114.28 106.66 1fh3 n THR 33 Ca -0.20 -0.33 -0.08 0.00 -2.27 0.00 0.00 64.05 61.17 1fh3 n THR 33 Cb 0.55 1.05 -0.02 0.00 -2.10 0.00 0.00 70.33 69.81 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 -2.18 -0.31 0.23 3.42 0.01 -1.21 -5.00 113.70 108.65 1fh3 s SER 34 Ca 0.28 -0.49 -0.14 0.00 1.31 0.00 0.00 55.95 56.90 1fh3 s SER 34 Cb 0.20 0.69 0.05 0.00 0.21 0.00 0.00 66.02 67.18 1fh3 s SER 34 CO 0.40 -1.26 0.73 0.61 0.41 0.00 0.00 173.24 174.13 1fh3 n GLY 35 N -0.44 0.96 2.56 3.44 0.00 -1.26 -0.69 105.19 109.75 1fh3 n GLY 35 Ca -0.06 -1.15 -0.06 0.00 0.00 0.00 0.00 46.02 44.74 1fh3 n GLY 35 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fh3 n HIS 36 N -0.50 -1.87 -3.99 1.61 8.25 -0.93 -4.88 115.22 112.91 1fh3 n HIS 36 Ca -0.04 -1.31 -0.09 0.00 -0.26 0.00 0.00 57.72 56.02 1fh3 n HIS 36 Cb 0.47 0.62 -0.11 0.00 1.12 0.00 0.00 29.99 32.08 1fh3 n HIS 36 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fh3 n GLY 38 N 1.55 0.28 3.37 0.00 0.00 -1.25 -4.88 105.19 104.27 1fh3 n GLY 38 Ca -0.24 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.23 2.44 -0.12 1.61 5.36 -1.26 -2.74 117.98 121.05 1fh3 s PHE 39 Ca 0.22 -0.35 0.16 0.00 -0.96 0.00 0.00 56.93 56.00 1fh3 s PHE 39 Cb -0.00 -1.50 -0.23 0.00 -0.34 0.00 0.00 43.02 40.94 1fh3 s PHE 39 CO -0.01 0.08 0.42 1.17 -1.46 0.00 0.00 175.22 175.42 1fh3 n LYS 40 N 2.17 0.66 0.00 10.12 0.00 -0.23 -4.92 118.16 125.95 1fh3 n LYS 40 Ca -0.16 0.13 0.00 0.00 0.00 0.00 0.00 58.31 58.28 1fh3 n LYS 40 Cb 0.52 -1.67 0.00 0.00 0.00 0.00 0.00 35.03 33.88 1fh3 n LYS 40 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1fh3 n VAL 41 N -2.86 0.00 0.00 3.15 0.31 -1.12 -4.90 118.33 112.91 1fh3 n VAL 41 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1fh3 n VAL 41 Cb 1.05 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.98 1fh3 n VAL 41 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fh3 n GLY 42 N 0.00 1.65 0.10 2.92 0.00 -1.26 -2.59 105.19 106.01 1fh3 n GLY 42 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 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 0.03 0.00 1.61 8.25 -1.26 -5.12 115.22 118.73 1fh3 n HIS 43 Ca 0.00 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1fh3 n HIS 43 Cb 0.00 -0.64 0.00 0.00 1.12 0.00 0.00 29.99 30.47 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 1.41 -0.58 3.78 -1.41 0.00 -1.07 -5.08 105.19 102.25 1fh3 n GLY 44 Ca -0.25 -0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 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 4.34 0.00 0.99 2.96 -1.26 -1.07 118.68 124.64 1fh3 s LEU 45 Ca 0.00 1.78 -0.02 0.00 -0.22 0.00 0.00 54.13 55.67 1fh3 s LEU 45 Cb 0.00 -3.96 0.01 0.00 0.50 0.00 0.00 46.19 42.74 1fh3 s LEU 45 CO 0.00 -0.05 0.52 0.00 -1.32 0.00 0.00 176.35 175.49 1fh3 n ALA 46 N 0.59 -0.42 -2.53 5.97 0.00 -1.11 -4.35 120.51 118.67 1fh3 n ALA 46 Ca 0.01 -1.65 -0.25 0.00 0.00 0.00 0.00 53.44 51.55 1fh3 n ALA 46 Cb 0.50 1.33 -0.08 0.00 0.00 0.00 0.00 19.45 21.20 1fh3 n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fh3 s TRP 48 N -2.53 1.33 0.01 0.00 -0.11 -0.64 0.65 118.94 117.64 1fh3 s TRP 48 Ca 0.35 -0.47 -0.04 0.00 1.22 0.00 0.00 56.10 57.16 1fh3 s TRP 48 Cb 0.01 -0.73 -0.01 0.00 -1.50 0.00 0.00 33.47 31.23 1fh3 s TRP 48 CO 0.20 0.09 0.06 0.00 -4.62 0.00 0.00 176.95 172.68 1fh3 s ASN 50 N -1.36 3.51 -0.72 0.00 -0.87 0.13 -1.80 114.94 113.83 1fh3 s ASN 50 Ca -0.15 -0.35 -0.01 0.00 -1.57 0.00 0.00 52.86 50.78 1fh3 s ASN 50 Cb -0.08 -0.67 -0.01 0.00 -0.02 0.00 0.00 41.25 40.46 1fh3 s ASN 50 CO 0.00 0.32 0.67 0.00 -2.57 0.00 0.00 177.10 175.52 1fh3 n ALA 51 N 2.49 -2.36 -2.76 0.60 0.00 -0.86 -1.61 120.51 116.01 1fh3 n ALA 51 Ca -0.17 0.03 -0.37 0.00 0.00 0.00 0.00 53.44 52.93 1fh3 n ALA 51 Cb 0.52 -2.25 -0.06 0.00 0.00 0.00 0.00 19.45 17.65 1fh3 n ALA 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fh3 s LEU 52 N -4.10 4.41 0.82 0.00 1.43 -0.03 -4.00 118.68 117.21 1fh3 s LEU 52 Ca 0.10 0.62 -0.11 0.00 -1.03 0.00 0.00 54.13 53.70 1fh3 s LEU 52 Cb -0.01 -2.23 0.09 0.00 0.03 0.00 0.00 46.19 44.06 1fh3 s LEU 52 CO 0.67 0.37 1.09 -2.16 0.23 0.00 0.00 176.35 176.55 1fh3 s PRO 53 N -0.99 1.86 0.33 1.29 0.04 -1.26 -0.51 135.00 135.76 1fh3 s PRO 53 Ca 0.18 0.98 0.04 0.00 0.04 0.00 0.00 61.00 62.23 1fh3 s PRO 53 Cb -0.13 -1.87 0.64 0.00 0.04 0.00 0.00 34.50 33.18 1fh3 s PRO 53 CO 0.07 -1.87 1.93 -0.44 0.04 0.00 0.00 177.00 176.73 1fh3 h ASP 54 N -1.28 0.79 0.48 6.66 5.19 -1.97 -1.89 116.42 124.39 1fh3 h ASP 54 Ca -0.46 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1fh3 h ASP 54 Cb 1.25 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.61 1fh3 h ASP 54 CO 0.53 0.50 -0.11 -0.46 -3.12 0.00 0.00 179.24 176.58 1fh3 n ASN 55 N -4.49 0.33 -4.42 6.45 6.94 -1.26 -4.48 115.26 114.33 1fh3 n ASN 55 Ca 0.13 -0.35 -0.44 0.00 -0.02 0.00 0.00 54.58 53.90 1fh3 n ASN 55 Cb 0.23 -0.13 -0.04 0.00 -2.36 0.00 0.00 39.78 37.48 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 -2.59 4.52 0.67 3.53 1.01 -0.71 -4.99 120.40 121.84 1fh3 s VAL 56 Ca 0.26 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 1fh3 s VAL 56 Cb 0.20 -4.62 0.03 0.00 0.00 0.00 0.00 36.38 31.99 1fh3 s VAL 56 CO 0.49 -1.34 1.01 -0.83 0.00 0.00 0.00 175.10 174.43 1fh3 s GLY 57 N 3.66 1.63 0.31 4.51 0.00 -1.26 -4.82 107.32 111.35 1fh3 s GLY 57 Ca 0.19 -0.63 -0.00 0.00 0.00 0.00 0.00 44.72 44.28 1fh3 s GLY 57 CO 0.08 -0.27 0.41 0.29 0.00 0.00 0.00 173.10 173.61 1fh3 n ILE 58 N -2.86 0.00 -2.03 0.90 -5.35 -1.26 -3.46 119.36 105.29 1fh3 n ILE 58 Ca 0.06 -1.69 -0.40 0.00 -0.27 0.00 0.00 62.75 60.45 1fh3 n ILE 58 Cb 0.58 1.01 -0.03 0.00 -1.74 0.00 0.00 39.64 39.46 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 -2.84 3.42 0.59 7.28 -1.09 -1.18 -4.69 121.20 122.69 1fh3 s ILE 59 Ca 0.28 0.34 -0.00 0.00 -2.23 0.00 0.00 60.65 59.03 1fh3 s ILE 59 Cb -0.00 -3.84 0.05 0.00 -1.58 0.00 0.00 42.46 37.09 1fh3 s ILE 59 CO 0.20 -0.71 0.83 -0.69 -1.23 0.00 0.00 174.94 173.34 1fh3 s VAL 60 N 8.20 2.55 0.18 2.92 1.01 -1.26 -5.02 120.40 128.98 1fh3 s VAL 60 Ca 0.72 -0.60 -0.17 0.00 0.00 0.00 0.00 61.98 61.92 1fh3 s VAL 60 Cb -0.16 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.31 1fh3 s VAL 60 CO 0.26 0.00 0.50 -0.70 0.00 0.00 0.00 175.10 175.15 1fh3 s GLU 61 N -4.87 1.31 0.00 2.72 2.12 -1.26 -4.81 118.70 113.91 1fh3 s GLU 61 Ca 0.59 -0.83 0.00 0.00 0.36 0.00 0.00 54.97 55.09 1fh3 s GLU 61 Cb -0.10 0.51 0.00 0.00 0.26 0.00 0.00 34.13 34.80 1fh3 s GLU 61 CO 0.40 -0.55 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 1fh3 n GLY 62 N -0.32 1.44 0.00 -1.50 0.00 -1.26 -4.97 105.19 98.59 1fh3 n GLY 62 Ca -0.11 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 0.00 0.00 1.61 2.13 -1.26 -5.17 120.64 117.95 1fh3 n GLU 63 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1fh3 n GLU 63 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 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 0.00 -4.50 5.31 4.81 -1.26 -5.13 118.16 117.39 1fh3 n LYS 64 Ca 0.00 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.12 1fh3 n LYS 64 Cb 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 34.89 1fh3 n LYS 64 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fh3 s HIS 66 N 0.96 -0.19 0.00 0.00 -3.43 -0.79 -4.96 115.29 106.89 1fh3 s HIS 66 Ca -0.04 0.27 0.00 0.00 -0.80 0.00 0.00 55.06 54.49 1fh3 s HIS 66 Cb -0.15 0.10 0.00 0.00 -1.43 0.00 0.00 32.58 31.11 1fh3 s HIS 66 CO -0.05 -0.40 0.00 0.45 -2.00 0.00 0.00 174.74 172.74