#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 2.12 -0.02 7.34 3.03 0.89 -4.91 118.95 127.39 1fh3 s ARG 2 Ca 0.00 -2.03 0.01 0.00 2.03 0.00 0.00 55.73 55.75 1fh3 s ARG 2 Cb 0.00 -1.80 0.01 0.00 -1.03 0.00 0.00 34.95 32.14 1fh3 s ARG 2 CO 0.00 -0.14 -0.04 -0.51 -1.13 0.00 0.00 175.30 173.48 1fh3 s ASP 3 N -3.84 0.68 0.26 -2.89 1.01 -1.26 -1.50 116.67 109.12 1fh3 s ASP 3 Ca 0.34 -0.09 -0.12 0.00 0.71 0.00 0.00 52.55 53.39 1fh3 s ASP 3 Cb 0.06 -0.25 0.05 0.00 1.01 0.00 0.00 42.92 43.79 1fh3 s ASP 3 CO 0.18 -0.02 0.62 0.61 0.21 0.00 0.00 175.17 176.77 1fh3 n GLY 4 N 3.64 1.15 3.73 0.21 0.00 -1.17 -5.01 105.19 107.75 1fh3 n GLY 4 Ca -0.21 -1.17 -0.41 0.00 0.00 0.00 0.00 46.02 44.22 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 -3.81 3.47 0.01 1.61 2.02 -1.26 -2.33 117.35 117.06 1fh3 s TYR 5 Ca 0.13 1.43 -0.19 0.00 -0.37 0.00 0.00 57.07 58.07 1fh3 s TYR 5 Cb -0.03 -3.39 -0.06 0.00 -0.40 0.00 0.00 41.96 38.08 1fh3 s TYR 5 CO 0.08 -1.07 0.54 -1.50 -1.57 0.00 0.00 175.55 172.03 1fh3 s ILE 6 N 0.23 4.91 0.00 2.71 2.07 0.18 -3.48 121.20 127.82 1fh3 s ILE 6 Ca 0.54 1.12 0.00 0.00 -1.41 0.00 0.00 60.65 60.90 1fh3 s ILE 6 Cb -0.31 -3.87 0.00 0.00 0.13 0.00 0.00 42.46 38.42 1fh3 s ILE 6 CO 0.34 0.48 0.00 0.00 -1.91 0.00 0.00 174.94 173.85 1fh3 n ALA 7 N 2.35 0.00 -2.77 1.50 0.00 -1.26 -2.63 120.51 117.71 1fh3 n ALA 7 Ca -0.09 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.19 1fh3 n ALA 7 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 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 3.69 0.65 0.44 0.00 -0.21 -1.26 -3.19 119.66 119.78 1fh3 s GLN 8 Ca 0.00 -0.68 -0.24 0.00 0.02 0.00 0.00 55.36 54.46 1fh3 s GLN 8 Cb 0.00 -0.54 -0.08 0.00 1.00 0.00 0.00 33.01 33.39 1fh3 s GLN 8 CO 0.00 0.12 1.20 -2.14 -2.12 0.00 0.00 175.29 172.36 1fh3 s PRO 9 N -1.23 3.82 -0.07 2.91 0.02 -1.26 -3.16 135.00 136.04 1fh3 s PRO 9 Ca -0.04 1.89 -0.20 0.00 0.02 0.00 0.00 61.00 62.68 1fh3 s PRO 9 Cb -0.08 -2.53 -0.29 0.00 0.02 0.00 0.00 34.50 31.62 1fh3 s PRO 9 CO 0.01 -0.53 0.75 0.93 -0.33 0.00 0.00 177.00 177.82 1fh3 h GLU 10 N 2.27 0.27 -2.70 5.54 5.08 -1.95 -3.47 114.58 119.62 1fh3 h GLU 10 Ca -0.49 -0.46 -0.10 0.00 -1.00 0.00 0.00 59.36 57.31 1fh3 h GLU 10 Cb 1.25 0.17 -0.20 0.00 0.50 0.00 0.00 28.75 30.47 1fh3 h GLU 10 CO 0.61 1.22 -0.13 1.21 -1.00 0.00 0.00 179.01 180.92 1fh3 s ASN 11 N -6.99 -0.35 0.00 1.42 2.47 -1.04 -4.33 114.94 106.14 1fh3 s ASN 11 Ca -0.16 0.31 0.00 0.00 0.42 0.00 0.00 52.86 53.43 1fh3 s ASN 11 Cb 0.02 0.41 0.00 0.00 -1.45 0.00 0.00 41.25 40.23 1fh3 s ASN 11 CO 0.80 -0.49 0.00 0.00 -3.72 0.00 0.00 177.10 173.69 1fh3 s VAL 13 N -3.11 2.01 0.00 0.00 -7.23 -1.26 -4.45 120.40 106.36 1fh3 s VAL 13 Ca 0.00 -2.26 0.00 0.00 -1.81 0.00 0.00 61.98 57.91 1fh3 s VAL 13 Cb 0.00 -2.24 0.00 0.00 0.56 0.00 0.00 36.38 34.70 1fh3 s VAL 13 CO 0.00 -0.46 0.00 0.00 -0.31 0.00 0.00 175.10 174.33 1fh3 n TYR 14 N -0.52 -0.90 -4.20 2.82 4.19 -1.08 -4.02 117.16 113.44 1fh3 n TYR 14 Ca -0.06 0.00 -0.12 0.00 3.31 0.00 0.00 57.90 61.03 1fh3 n TYR 14 Cb 0.61 0.00 -0.10 0.00 0.49 0.00 0.00 39.34 40.34 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 0.09 1.10 0.41 2.98 3.76 -1.26 -4.04 115.29 118.32 1fh3 s HIS 15 Ca 0.00 -1.19 0.07 0.00 -0.15 0.00 0.00 55.06 53.79 1fh3 s HIS 15 Cb 0.00 -0.61 -0.08 0.00 1.11 0.00 0.00 32.58 33.00 1fh3 s HIS 15 CO 0.00 -0.43 0.01 0.00 -0.85 0.00 0.00 174.74 173.47 1fh3 s PHE 17 N -2.71 2.70 0.00 0.00 0.40 -1.26 -5.00 117.98 112.12 1fh3 s PHE 17 Ca 0.35 -0.74 0.00 0.00 -0.60 0.00 0.00 56.93 55.94 1fh3 s PHE 17 Cb 0.10 -1.77 0.00 0.00 0.51 0.00 0.00 43.02 41.85 1fh3 s PHE 17 CO 0.18 -0.25 0.80 -2.30 0.70 0.00 0.00 175.22 174.35 1fh3 n PRO 18 N 3.40 0.45 -3.69 0.24 -0.02 -1.26 -4.49 135.00 129.64 1fh3 n PRO 18 Ca -0.18 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.16 1fh3 n PRO 18 Cb 0.53 -1.27 -0.09 0.00 -0.02 0.00 0.00 33.50 32.65 1fh3 n PRO 18 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1fh3 s GLY 19 N 1.76 -0.36 0.20 -1.23 0.00 -1.26 -5.08 107.32 101.35 1fh3 s GLY 19 Ca 0.00 1.22 -0.10 0.00 0.00 0.00 0.00 44.72 45.84 1fh3 s GLY 19 CO 0.00 1.00 1.80 1.76 0.00 0.00 0.00 173.10 177.66 1fh3 h SER 20 N 4.84 0.94 -0.62 1.64 0.02 -2.02 -3.36 113.55 114.99 1fh3 h SER 20 Ca -0.28 -0.12 0.11 0.00 -0.84 0.00 0.00 61.79 60.66 1fh3 h SER 20 Cb 1.17 -0.24 -0.12 0.00 0.14 0.00 0.00 62.40 63.35 1fh3 h SER 20 CO 0.25 0.79 -0.31 0.28 -1.14 0.00 0.00 176.83 176.70 1fh3 h SER 21 N 1.01 -1.08 0.04 3.07 0.02 -1.98 -2.07 113.55 112.57 1fh3 h SER 21 Ca 0.25 0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 61.43 1fh3 h SER 21 Cb 0.09 0.56 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1fh3 h SER 21 CO -0.04 -0.29 -0.02 1.23 -1.14 0.00 0.00 176.83 176.57 1fh3 h GLY 22 N -0.13 -0.06 2.00 -3.77 0.00 -1.90 -2.70 103.07 96.52 1fh3 h GLY 22 Ca 0.25 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1fh3 h GLY 22 CO -0.70 -0.02 0.00 0.00 0.00 0.00 0.00 176.54 175.82 1fh3 h ASP 24 N 0.00 -0.51 -0.71 0.00 3.58 -1.23 0.37 116.42 117.92 1fh3 h ASP 24 Ca 0.00 0.04 -0.05 0.00 0.42 0.00 0.00 57.03 57.44 1fh3 h ASP 24 Cb 0.86 0.16 -0.03 0.00 1.72 0.00 0.00 39.33 42.04 1fh3 h ASP 24 CO 0.00 -0.31 0.24 0.71 -2.88 0.00 0.00 179.24 177.00 1fh3 h THR 25 N -0.47 1.25 -0.48 2.25 1.35 -1.20 -1.96 112.91 113.65 1fh3 h THR 25 Ca -0.02 -0.87 -0.09 0.00 -0.55 0.00 0.00 66.41 64.88 1fh3 h THR 25 Cb 0.41 0.45 -0.02 0.00 -1.73 0.00 0.00 68.15 67.25 1fh3 h THR 25 CO -0.00 0.34 -0.08 -0.07 -0.25 0.00 0.00 175.52 175.46 1fh3 h LEU 26 N 1.06 0.85 -0.27 3.87 3.38 -1.00 -0.74 115.31 122.47 1fh3 h LEU 26 Ca 0.24 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1fh3 h LEU 26 Cb 0.28 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1fh3 h LEU 26 CO -0.01 0.95 0.01 0.00 0.09 0.00 0.00 178.44 179.49 1fh3 h LYS 28 N 0.26 0.98 0.00 0.00 1.57 -1.11 0.22 116.57 118.49 1fh3 h LYS 28 Ca 0.08 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 1fh3 h LYS 28 Cb 0.39 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1fh3 h LYS 28 CO 0.01 0.93 0.00 1.05 -0.57 0.00 0.00 179.45 180.87 1fh3 h GLU 29 N 0.88 0.00 -0.01 3.15 4.11 -1.13 -0.14 114.58 121.45 1fh3 h GLU 29 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 1fh3 h GLU 29 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1fh3 h GLU 29 CO 0.01 0.00 -0.49 1.63 0.07 0.00 0.00 179.01 180.23 1fh3 n LYS 30 N -2.67 0.76 -1.51 1.06 4.76 -1.04 -4.96 118.16 114.56 1fh3 n LYS 30 Ca 0.01 -0.56 0.00 0.00 -2.87 0.00 0.00 58.31 54.89 1fh3 n LYS 30 Cb 0.26 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 1fh3 n LYS 30 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1fh3 n GLY 31 N 1.42 0.88 3.85 0.72 0.00 -0.06 -4.79 105.19 107.20 1fh3 n GLY 31 Ca 0.09 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.71 2.01 -0.06 -0.02 0.00 0.75 -4.31 107.32 102.98 1fh3 s GLY 32 Ca 0.00 -0.98 -0.20 0.00 0.00 0.00 0.00 44.72 43.54 1fh3 s GLY 32 CO 0.00 -0.97 0.80 -0.91 0.00 0.00 0.00 173.10 172.02 1fh3 h THR 33 N 2.23 0.76 -2.67 0.90 1.35 -0.99 -3.24 112.91 111.25 1fh3 h THR 33 Ca -0.46 -1.12 -0.01 0.00 -0.55 0.00 0.00 66.41 64.26 1fh3 h THR 33 Cb 1.17 1.29 0.01 0.00 -1.73 0.00 0.00 68.15 68.88 1fh3 h THR 33 CO 0.69 0.20 0.21 -1.20 -0.25 0.00 0.00 175.52 175.18 1fh3 n SER 34 N -4.92 -1.61 -3.54 5.36 7.64 -1.26 -4.75 113.62 110.54 1fh3 n SER 34 Ca -0.07 -2.10 -0.01 0.00 1.01 0.00 0.00 58.87 57.70 1fh3 n SER 34 Cb 0.25 2.68 0.01 0.00 -1.01 0.00 0.00 64.21 66.14 1fh3 n SER 34 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1fh3 s GLY 35 N -2.51 -0.06 0.34 0.23 0.00 -1.26 -1.60 107.32 102.47 1fh3 s GLY 35 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 44.72 44.77 1fh3 s GLY 35 CO 0.08 2.35 0.43 -2.38 0.00 0.00 0.00 173.10 173.58 1fh3 s HIS 36 N -2.35 1.21 0.77 1.90 -3.43 -1.24 -4.85 115.29 107.30 1fh3 s HIS 36 Ca 0.21 -1.37 -0.09 0.00 -0.80 0.00 0.00 55.06 53.01 1fh3 s HIS 36 Cb -0.01 -0.22 0.09 0.00 -1.43 0.00 0.00 32.58 31.01 1fh3 s HIS 36 CO 0.02 -1.08 1.10 0.00 -2.00 0.00 0.00 174.74 172.79 1fh3 n GLY 38 N -3.14 0.34 3.20 0.00 0.00 -1.19 -4.64 105.19 99.76 1fh3 n GLY 38 Ca 0.10 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.18 -0.04 -0.23 1.61 2.19 -1.26 -1.43 117.98 116.64 1fh3 s PHE 39 Ca 0.26 -0.06 -0.03 0.00 0.33 0.00 0.00 56.93 57.43 1fh3 s PHE 39 Cb -0.01 0.02 0.08 0.00 -1.31 0.00 0.00 43.02 41.80 1fh3 s PHE 39 CO 0.01 -0.41 0.08 0.21 1.83 0.00 0.00 175.22 176.94 1fh3 s LYS 40 N -2.03 0.40 -0.09 10.12 2.36 0.70 -4.75 119.74 126.45 1fh3 s LYS 40 Ca -0.09 -0.46 -0.30 0.00 -2.55 0.00 0.00 55.97 52.57 1fh3 s LYS 40 Cb -0.03 -1.80 -0.03 0.00 -1.05 0.00 0.00 37.83 34.92 1fh3 s LYS 40 CO -0.01 -0.79 1.32 0.08 1.55 0.00 0.00 175.35 177.50 1fh3 s VAL 41 N 1.95 4.08 0.00 4.02 1.01 -1.26 -1.13 120.40 129.07 1fh3 s VAL 41 Ca 0.04 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.39 1fh3 s VAL 41 Cb -0.17 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1fh3 s VAL 41 CO -0.18 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1fh3 n GLY 42 N 3.62 4.64 1.20 4.51 0.00 -1.26 -4.91 105.19 112.99 1fh3 n GLY 42 Ca 0.13 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.12 -2.74 1.61 8.25 -0.55 -5.07 115.22 116.60 1fh3 n HIS 43 Ca 0.00 0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1fh3 n HIS 43 Cb 0.00 0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.21 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 3.12 -0.54 3.76 -1.41 0.00 -0.28 -5.02 105.19 104.82 1fh3 n GLY 44 Ca 0.00 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 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 4.48 0.00 0.99 0.20 -1.26 -0.21 118.68 122.88 1fh3 s LEU 45 Ca 0.00 2.45 0.02 0.00 0.69 0.00 0.00 54.13 57.29 1fh3 s LEU 45 Cb 0.00 -3.63 -0.01 0.00 -0.43 0.00 0.00 46.19 42.12 1fh3 s LEU 45 CO 0.00 -0.36 0.08 0.00 -0.29 0.00 0.00 176.35 175.78 1fh3 n ALA 46 N 1.28 0.23 -2.52 5.97 0.00 -0.51 -4.36 120.51 120.60 1fh3 n ALA 46 Ca 0.00 -0.72 -0.26 0.00 0.00 0.00 0.00 53.44 52.47 1fh3 n ALA 46 Cb 0.43 0.54 -0.08 0.00 0.00 0.00 0.00 19.45 20.34 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 -3.20 2.10 0.01 0.00 -0.11 -0.07 0.51 118.94 118.17 1fh3 s TRP 48 Ca 0.24 -0.43 -0.13 0.00 1.22 0.00 0.00 56.10 57.00 1fh3 s TRP 48 Cb 0.03 -0.96 0.02 0.00 -1.50 0.00 0.00 33.47 31.06 1fh3 s TRP 48 CO 0.14 0.58 0.27 0.00 -4.62 0.00 0.00 176.95 173.32 1fh3 s ASN 50 N -1.61 3.87 -0.28 0.00 2.47 -0.62 -3.03 114.94 115.74 1fh3 s ASN 50 Ca -0.11 -0.36 -0.01 0.00 0.42 0.00 0.00 52.86 52.81 1fh3 s ASN 50 Cb -0.04 -1.58 -0.01 0.00 -1.45 0.00 0.00 41.25 38.17 1fh3 s ASN 50 CO 0.01 0.16 0.26 0.00 -3.72 0.00 0.00 177.10 173.81 1fh3 n ALA 51 N 3.53 -1.63 -2.79 1.71 0.00 -1.07 -0.56 120.51 119.70 1fh3 n ALA 51 Ca -0.18 0.01 -0.36 0.00 0.00 0.00 0.00 53.44 52.91 1fh3 n ALA 51 Cb 0.53 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 18.84 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 -3.02 4.00 0.97 0.00 1.43 -0.56 -4.18 118.68 117.31 1fh3 s LEU 52 Ca 0.05 0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 53.30 1fh3 s LEU 52 Cb -0.01 -1.96 0.17 0.00 0.03 0.00 0.00 46.19 44.42 1fh3 s LEU 52 CO 0.25 0.35 1.13 -2.16 0.23 0.00 0.00 176.35 176.15 1fh3 s PRO 53 N -0.69 0.68 0.00 1.29 0.04 -1.26 -0.08 135.00 134.98 1fh3 s PRO 53 Ca 0.12 0.30 0.21 0.00 0.04 0.00 0.00 61.00 61.67 1fh3 s PRO 53 Cb -0.12 -1.79 1.05 0.00 0.04 0.00 0.00 34.50 33.69 1fh3 s PRO 53 CO 0.03 -2.51 1.66 -0.25 0.04 0.00 0.00 177.00 175.96 1fh3 n ASP 54 N -3.98 0.00 -0.50 6.66 9.92 -1.26 -2.23 116.55 125.16 1fh3 n ASP 54 Ca 0.07 -0.01 0.11 0.00 -0.53 0.00 0.00 54.79 54.42 1fh3 n ASP 54 Cb 0.59 -0.28 0.41 0.00 -0.64 0.00 0.00 41.12 41.20 1fh3 n ASP 54 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1fh3 n ASN 55 N -1.28 1.50 -4.55 -2.24 6.94 -1.26 -4.77 115.26 109.60 1fh3 n ASN 55 Ca 0.10 -1.65 -0.34 0.00 -0.02 0.00 0.00 54.58 52.67 1fh3 n ASN 55 Cb 0.17 -0.08 -0.12 0.00 -2.36 0.00 0.00 39.78 37.39 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 -1.84 3.75 0.16 3.53 1.01 -0.95 -5.11 120.40 120.96 1fh3 s VAL 56 Ca 0.33 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1fh3 s VAL 56 Cb 0.18 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1fh3 s VAL 56 CO 0.27 0.56 0.22 -0.83 0.00 0.00 0.00 175.10 175.32 1fh3 s GLY 57 N -0.36 1.71 0.05 4.51 0.00 -1.26 -4.93 107.32 107.04 1fh3 s GLY 57 Ca 0.05 -1.11 0.01 0.00 0.00 0.00 0.00 44.72 43.68 1fh3 s GLY 57 CO 0.02 -1.11 0.04 0.29 0.00 0.00 0.00 173.10 172.34 1fh3 n ILE 58 N -0.47 0.00 -2.46 0.90 -5.35 -1.26 -4.13 119.36 106.59 1fh3 n ILE 58 Ca -0.08 -0.33 -0.39 0.00 -0.27 0.00 0.00 62.75 61.68 1fh3 n ILE 58 Cb 0.54 0.16 -0.04 0.00 -1.74 0.00 0.00 39.64 38.57 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 -2.18 3.48 0.05 7.28 -1.09 -1.23 -4.68 121.20 122.83 1fh3 s ILE 59 Ca 0.05 1.37 -0.13 0.00 -2.23 0.00 0.00 60.65 59.71 1fh3 s ILE 59 Cb 0.00 -3.82 0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1fh3 s ILE 59 CO 0.04 0.24 0.29 -0.69 -1.23 0.00 0.00 174.94 173.58 1fh3 s VAL 60 N -1.31 0.09 0.03 2.92 1.01 -1.26 -5.00 120.40 116.87 1fh3 s VAL 60 Ca 0.49 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.69 1fh3 s VAL 60 Cb -0.30 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 1fh3 s VAL 60 CO 0.38 -0.40 0.11 -0.70 0.00 0.00 0.00 175.10 174.49 1fh3 s GLU 61 N -2.61 0.55 0.00 2.72 2.12 -1.26 -4.60 118.70 115.61 1fh3 s GLU 61 Ca -0.05 -0.62 0.00 0.00 0.36 0.00 0.00 54.97 54.67 1fh3 s GLU 61 Cb -0.01 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.60 1fh3 s GLU 61 CO -0.04 -0.14 0.00 0.41 -0.54 0.00 0.00 175.26 174.96 1fh3 n GLY 62 N 1.03 3.51 0.00 -1.50 0.00 -1.26 -4.91 105.19 102.06 1fh3 n GLY 62 Ca -0.21 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.78 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 1.84 -0.62 1.61 4.07 -1.26 -5.17 120.64 121.11 1fh3 n GLU 63 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1fh3 n GLU 63 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1fh3 n GLU 63 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1fh3 n LYS 64 N 0.00 0.00 -1.69 5.31 3.00 -1.26 -5.08 118.16 118.44 1fh3 n LYS 64 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.89 1fh3 n LYS 64 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 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 2.76 0.19 0.00 0.00 -3.43 -1.11 -4.94 115.29 108.76 1fh3 s HIS 66 Ca 0.82 -0.47 0.00 0.00 -0.80 0.00 0.00 55.06 54.61 1fh3 s HIS 66 Cb -0.48 -0.14 0.00 0.00 -1.43 0.00 0.00 32.58 30.54 1fh3 s HIS 66 CO 0.37 -0.35 0.00 0.43 -2.00 0.00 0.00 174.74 173.19