#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfg n GLY 2 N 0.00 -1.68 3.31 -3.96 0.00 -1.26 -4.50 105.19 97.10 1hfg n GLY 2 Ca 0.00 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 1hfg n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfg n ALA 3 N -0.26 -1.16 0.18 4.61 0.00 -1.26 -4.85 120.51 117.77 1hfg n ALA 3 Ca 0.00 0.34 0.18 0.00 0.00 0.00 0.00 53.44 53.96 1hfg n ALA 3 Cb 0.02 -4.75 0.81 0.00 0.00 0.00 0.00 19.45 15.52 1hfg n ALA 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1hfg h SER 4 N -2.32 0.00 -0.28 0.00 0.87 -1.97 0.86 113.55 110.71 1hfg h SER 4 Ca -0.49 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.15 1hfg h SER 4 Cb 1.32 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.27 1hfg h SER 4 CO 0.48 0.00 0.26 4.11 -0.53 0.00 0.00 176.83 181.16 1hfg h TRP 5 N 0.00 0.00 0.00 2.24 5.08 -1.98 0.27 115.95 121.56 1hfg h TRP 5 Ca 0.11 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.08 1hfg h TRP 5 Cb 0.65 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.81 1hfg h TRP 5 CO 0.00 0.00 0.01 0.45 -1.28 0.00 0.00 178.44 177.62 1hfg h HIS 6 N 0.00 0.00 -3.32 0.12 3.86 -1.18 -3.36 115.15 111.27 1hfg h HIS 6 Ca 0.13 0.00 -0.73 0.00 -1.16 0.00 0.00 60.37 58.61 1hfg h HIS 6 Cb 0.66 0.00 -0.25 0.00 1.06 0.00 0.00 27.41 28.88 1hfg h HIS 6 CO 0.00 0.00 -0.36 0.50 0.86 0.00 0.00 177.93 178.93 1hfg s ARG 7 N -3.63 2.85 -1.15 2.45 3.52 0.95 -5.02 118.95 118.92 1hfg s ARG 7 Ca -0.03 -1.45 -0.20 0.00 -0.13 0.00 0.00 55.73 53.92 1hfg s ARG 7 Cb 0.07 -4.04 0.07 0.00 -1.56 0.00 0.00 34.95 29.49 1hfg s ARG 7 CO 0.23 -1.06 1.56 -1.25 -0.81 0.00 0.00 175.30 173.97 1hfg s PRO 8 N 1.56 3.80 -0.52 5.12 0.04 -1.26 -4.88 135.00 138.85 1hfg s PRO 8 Ca 0.04 -1.63 -0.06 0.00 0.04 0.00 0.00 61.00 59.39 1hfg s PRO 8 Cb -0.25 -5.40 -0.06 0.00 0.04 0.00 0.00 34.50 28.84 1hfg s PRO 8 CO 0.04 -2.18 1.66 -3.47 0.04 0.00 0.00 177.00 173.09 1hfg n ASP 9 N 8.35 2.73 0.00 6.66 2.03 -1.26 -4.38 116.55 130.68 1hfg n ASP 9 Ca 0.40 -2.24 0.13 0.00 0.52 0.00 0.00 54.79 53.60 1hfg n ASP 9 Cb 0.48 -0.85 0.60 0.00 -0.72 0.00 0.00 41.12 40.63 1hfg n ASP 9 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1hfg n LYS 10 N 4.93 0.03 -0.94 -0.67 5.02 -1.26 -4.21 118.16 121.05 1hfg n LYS 10 Ca 0.29 0.02 -0.25 0.00 -2.02 0.00 0.00 58.31 56.35 1hfg n LYS 10 Cb 0.12 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.58 1hfg n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hfg h LEU 13 N 4.39 0.78 -9.40 0.00 3.38 -1.91 -3.44 115.31 109.12 1hfg h LEU 13 Ca -0.40 -0.12 -0.59 0.00 0.09 0.00 0.00 57.88 56.86 1hfg h LEU 13 Cb 1.24 -0.20 -0.12 0.00 0.09 0.00 0.00 40.66 41.67 1hfg h LEU 13 CO 0.86 0.73 -0.69 -0.83 0.09 0.00 0.00 178.44 178.60 1hfg s GLY 14 N -3.60 1.84 0.36 0.83 0.00 -1.26 -5.02 107.32 100.47 1hfg s GLY 14 Ca -0.10 -1.81 0.09 0.00 0.00 0.00 0.00 44.72 42.89 1hfg s GLY 14 CO 0.80 -1.87 -0.01 -0.19 0.00 0.00 0.00 173.10 171.82 1hfg s TYR 15 N -2.45 2.49 0.20 1.90 2.02 -1.26 -4.83 117.35 115.42 1hfg s TYR 15 Ca 0.31 -0.52 -0.13 0.00 -0.37 0.00 0.00 57.07 56.35 1hfg s TYR 15 Cb -0.05 -1.56 0.23 0.00 -0.40 0.00 0.00 41.96 40.18 1hfg s TYR 15 CO 0.17 0.49 1.29 0.94 -1.57 0.00 0.00 175.55 176.87 1hfg n GLN 16 N -0.92 -0.18 0.00 -0.62 -0.06 0.22 -4.76 117.38 111.06 1hfg n GLN 16 Ca -0.04 1.28 0.00 0.00 -2.00 0.00 0.00 57.00 56.24 1hfg n GLN 16 Cb 0.64 -1.90 0.00 0.00 -4.06 0.00 0.00 30.24 24.92 1hfg n GLN 16 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1hfg n LYS 17 N -5.24 0.00 -4.36 3.69 4.81 -1.26 -4.99 118.16 110.81 1hfg n LYS 17 Ca 0.09 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.31 1hfg n LYS 17 Cb 0.34 -0.74 -0.13 0.00 0.02 0.00 0.00 35.03 34.53 1hfg n LYS 17 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1hfg s ARG 18 N -0.37 1.05 -0.32 1.64 0.52 -1.26 -5.12 118.95 115.09 1hfg s ARG 18 Ca 0.00 -0.94 -0.27 0.00 -0.52 0.00 0.00 55.73 54.00 1hfg s ARG 18 Cb 0.00 -1.15 0.01 0.00 0.52 0.00 0.00 34.95 34.34 1hfg s ARG 18 CO 0.00 0.28 0.98 -1.25 0.02 0.00 0.00 175.30 175.33 1hfg s PRO 19 N -1.48 4.00 0.30 3.54 0.04 -1.26 -5.04 135.00 135.10 1hfg s PRO 19 Ca 0.03 0.88 -0.05 0.00 0.04 0.00 0.00 61.00 61.90 1hfg s PRO 19 Cb -0.09 -3.75 -0.05 0.00 0.04 0.00 0.00 34.50 30.65 1hfg s PRO 19 CO 0.02 -0.86 0.56 -0.51 0.04 0.00 0.00 177.00 176.26 1hfg s LEU 20 N 3.46 4.04 0.06 -3.56 1.43 -1.26 -5.07 118.68 117.79 1hfg s LEU 20 Ca 0.41 0.73 -0.28 0.00 -1.03 0.00 0.00 54.13 53.97 1hfg s LEU 20 Cb -0.13 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.49 1hfg s LEU 20 CO 0.15 -0.21 0.87 -2.16 0.23 0.00 0.00 176.35 175.23 1hfg s PRO 21 N -3.58 4.59 0.00 1.29 0.04 -1.26 -4.93 135.00 131.14 1hfg s PRO 21 Ca 0.44 1.26 0.23 0.00 0.04 0.00 0.00 61.00 62.98 1hfg s PRO 21 Cb -0.11 -3.38 1.35 0.00 0.04 0.00 0.00 34.50 32.40 1hfg s PRO 21 CO 0.30 0.21 1.77 0.94 0.04 0.00 0.00 177.00 180.26 1hfg n GLN 22 N 2.95 0.64 0.29 4.56 0.00 -1.26 -3.22 117.38 121.33 1hfg n GLN 22 Ca 0.01 0.02 0.14 0.00 -0.00 0.00 0.00 57.00 57.17 1hfg n GLN 22 Cb 0.50 -1.50 0.85 0.00 0.00 0.00 0.00 30.24 30.09 1hfg n GLN 22 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1hfg h VAL 23 N 0.00 0.55 0.00 1.69 3.04 -2.04 -2.71 116.25 116.78 1hfg h VAL 23 Ca 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 1hfg h VAL 23 Cb 0.05 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.45 1hfg h VAL 23 CO 0.00 0.04 0.00 0.00 -1.01 0.00 0.00 177.57 176.60 1hfg n LEU 24 N -3.79 0.88 -4.88 3.16 -0.00 -1.20 -5.06 117.00 106.12 1hfg n LEU 24 Ca -0.03 -0.88 -0.30 0.00 -0.00 0.00 0.00 56.01 54.80 1hfg n LEU 24 Cb 0.13 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.57 1hfg n LEU 24 CO 0.28 0.22 0.68 -0.22 -0.00 0.00 0.00 177.39 178.36 1hfg s LEU 25 N -0.07 3.25 0.00 1.47 2.96 -1.03 -0.76 118.68 124.50 1hfg s LEU 25 Ca 0.00 1.31 0.00 0.00 -0.22 0.00 0.00 54.13 55.22 1hfg s LEU 25 Cb 0.00 -4.32 0.00 0.00 0.50 0.00 0.00 46.19 42.37 1hfg s LEU 25 CO 0.00 -0.88 0.00 -0.24 -1.32 0.00 0.00 176.35 173.91 1hfg n SER 26 N -2.71 0.00 0.00 3.68 2.88 -1.19 -4.31 113.62 111.97 1hfg n SER 26 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1hfg n SER 26 Cb 0.55 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1hfg n SER 26 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1hfg n SER 27 N -2.25 0.00 -3.65 -3.46 7.64 -1.20 -4.74 113.62 105.96 1hfg n SER 27 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 1hfg n SER 27 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.12 1hfg n SER 27 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1hfg s TRP 28 N -1.55 -0.73 -0.02 1.43 1.48 -1.26 -2.29 118.94 116.00 1hfg s TRP 28 Ca 0.00 1.77 0.08 0.00 -1.06 0.00 0.00 56.10 56.89 1hfg s TRP 28 Cb 0.00 0.25 -0.02 0.00 -1.16 0.00 0.00 33.47 32.54 1hfg s TRP 28 CO 0.00 -0.35 -0.25 1.52 -4.06 0.00 0.00 176.95 173.81 1hfg s TYR 29 N 0.35 2.30 0.36 1.66 -0.85 -0.17 -2.24 117.35 118.76 1hfg s TYR 29 Ca -0.00 -0.47 -0.22 0.00 -0.52 0.00 0.00 57.07 55.87 1hfg s TYR 29 Cb -0.05 -1.48 -0.10 0.00 0.38 0.00 0.00 41.96 40.71 1hfg s TYR 29 CO 0.01 -0.06 0.90 -1.25 -1.52 0.00 0.00 175.55 173.63 1hfg s PRO 30 N -0.54 4.31 0.62 -3.49 0.04 -1.26 -1.61 135.00 133.07 1hfg s PRO 30 Ca 0.08 1.10 -0.04 0.00 0.04 0.00 0.00 61.00 62.18 1hfg s PRO 30 Cb -0.10 -2.48 0.13 0.00 0.04 0.00 0.00 34.50 32.09 1hfg s PRO 30 CO -0.00 0.13 0.85 -2.37 0.04 0.00 0.00 177.00 175.65 1hfg n THR 31 N -0.09 0.00 -1.23 1.26 5.66 -1.13 -4.94 114.28 113.81 1hfg n THR 31 Ca 0.04 -1.09 -0.29 0.00 -3.05 0.00 0.00 64.05 59.67 1hfg n THR 31 Cb 0.52 -1.18 0.16 0.00 -1.55 0.00 0.00 70.33 68.29 1hfg n THR 31 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1hfg s SER 32 N -4.32 2.90 -0.00 1.09 0.01 -1.26 -4.94 113.70 107.18 1hfg s SER 32 Ca 0.53 1.21 0.20 0.00 1.31 0.00 0.00 55.95 59.21 1hfg s SER 32 Cb -0.03 -1.87 -0.23 0.00 0.21 0.00 0.00 66.02 64.11 1hfg s SER 32 CO 0.36 -2.96 0.84 1.67 0.41 0.00 0.00 173.24 173.56 1hfg n GLN 33 N -4.06 0.30 -1.19 12.44 7.27 -1.26 -4.45 117.38 126.43 1hfg n GLN 33 Ca 0.06 -0.01 -0.20 0.00 0.07 0.00 0.00 57.00 56.91 1hfg n GLN 33 Cb 0.57 -1.46 -0.05 0.00 2.41 0.00 0.00 30.24 31.71 1hfg n GLN 33 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1hfg n LEU 34 N -1.53 6.22 -4.35 1.69 7.99 -1.26 -4.88 117.00 120.88 1hfg n LEU 34 Ca 0.03 -3.62 -0.20 0.00 -0.01 0.00 0.00 56.01 52.22 1hfg n LEU 34 Cb 0.33 -1.21 -0.10 0.00 -0.11 0.00 0.00 43.42 42.33 1hfg n LEU 34 CO 0.41 1.55 -0.46 0.00 -1.51 0.00 0.00 177.39 177.38 1hfg h SER 36 N 2.74 0.00 -0.10 0.00 0.87 -1.91 -3.38 113.55 111.77 1hfg h SER 36 Ca -0.39 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.05 1hfg h SER 36 Cb 1.22 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 63.04 1hfg h SER 36 CO 0.58 0.16 -0.23 2.29 -0.53 0.00 0.00 176.83 179.10 1hfg n LYS 37 N -3.67 0.36 -2.85 2.24 2.85 -1.26 -5.16 118.16 110.68 1hfg n LYS 37 Ca -0.02 -1.14 -0.39 0.00 -1.05 0.00 0.00 58.31 55.71 1hfg n LYS 37 Cb 0.28 -0.68 -0.06 0.00 -0.65 0.00 0.00 35.03 33.92 1hfg n LYS 37 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1hfg s PRO 38 N 0.47 4.70 0.00 -1.58 0.04 -1.26 -4.68 135.00 132.68 1hfg s PRO 38 Ca 0.28 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1hfg s PRO 38 Cb 0.19 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.53 1hfg s PRO 38 CO -0.14 0.50 0.00 0.41 0.04 0.00 0.00 177.00 177.82 1hfg n GLY 39 N 1.38 2.58 3.43 0.56 0.00 -1.26 -4.98 105.19 106.90 1hfg n GLY 39 Ca -0.03 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 1hfg n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfg s VAL 40 N 2.92 -0.01 -0.04 1.61 1.01 0.24 -2.86 120.40 123.28 1hfg s VAL 40 Ca 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 1hfg s VAL 40 Cb 0.00 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1hfg s VAL 40 CO 0.00 0.01 0.19 -0.63 0.00 0.00 0.00 175.10 174.67 1hfg s ILE 41 N 0.74 5.42 -0.20 2.22 1.09 -0.63 0.11 121.20 129.95 1hfg s ILE 41 Ca -0.04 0.04 -0.05 0.00 -1.10 0.00 0.00 60.65 59.51 1hfg s ILE 41 Cb -0.05 -3.51 -0.03 0.00 -1.06 0.00 0.00 42.46 37.82 1hfg s ILE 41 CO -0.05 0.43 0.00 -0.36 -0.10 0.00 0.00 174.94 174.86 1hfg s PHE 42 N -1.22 3.05 -0.65 3.97 0.40 0.29 -1.00 117.98 122.81 1hfg s PHE 42 Ca 0.23 -0.42 -0.15 0.00 -0.60 0.00 0.00 56.93 55.99 1hfg s PHE 42 Cb -0.13 -2.07 0.16 0.00 0.51 0.00 0.00 43.02 41.49 1hfg s PHE 42 CO 0.13 -0.20 0.62 -0.51 0.70 0.00 0.00 175.22 175.96 1hfg s LEU 43 N 0.91 6.34 0.97 -0.37 1.02 -0.97 -0.01 118.68 126.57 1hfg s LEU 43 Ca 0.01 -2.10 -0.13 0.00 0.02 0.00 0.00 54.13 51.93 1hfg s LEU 43 Cb -0.14 -2.22 0.04 0.00 0.02 0.00 0.00 46.19 43.89 1hfg s LEU 43 CO 0.02 -0.77 0.34 0.35 0.02 0.00 0.00 176.35 176.31 1hfg n THR 44 N 4.81 0.00 0.10 5.49 -2.24 -0.60 -3.17 114.28 118.67 1hfg n THR 44 Ca -0.03 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.42 1hfg n THR 44 Cb 0.43 -0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 68.00 1hfg n THR 44 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1hfg h LYS 45 N -1.61 -0.46 0.00 -0.78 1.57 -1.14 -3.36 116.57 110.79 1hfg h LYS 45 Ca -0.45 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1hfg h LYS 45 Cb 1.29 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1hfg h LYS 45 CO 0.34 -0.30 0.00 -2.13 -0.57 0.00 0.00 179.45 176.79 1hfg n ARG 46 N -5.39 -0.26 0.00 3.15 0.63 -1.26 -4.98 116.66 108.55 1hfg n ARG 46 Ca -0.06 -0.22 0.00 0.00 -0.92 0.00 0.00 57.85 56.65 1hfg n ARG 46 Cb 0.30 -0.67 0.00 0.00 0.45 0.00 0.00 32.46 32.54 1hfg n ARG 46 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1hfg n GLY 47 N -0.01 1.44 0.55 5.14 0.00 -1.26 -5.12 105.19 105.94 1hfg n GLY 47 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1hfg n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hfg n ARG 48 N 0.00 0.13 -3.23 1.61 1.74 -1.26 -4.90 116.66 110.76 1hfg n ARG 48 Ca 0.00 -0.43 -0.33 0.00 -0.77 0.00 0.00 57.85 56.33 1hfg n ARG 48 Cb 0.00 0.44 -0.06 0.00 -1.02 0.00 0.00 32.46 31.82 1hfg n ARG 48 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1hfg s GLN 49 N -2.10 3.96 -0.10 5.56 -0.21 -1.25 -1.55 119.66 123.96 1hfg s GLN 49 Ca 0.04 0.56 -0.03 0.00 0.02 0.00 0.00 55.36 55.95 1hfg s GLN 49 Cb -0.00 -2.54 0.05 0.00 1.00 0.00 0.00 33.01 31.51 1hfg s GLN 49 CO 0.03 0.23 0.09 0.08 -2.12 0.00 0.00 175.29 173.60 1hfg s VAL 50 N -1.89 -0.13 0.03 1.09 1.01 0.98 -4.87 120.40 116.62 1hfg s VAL 50 Ca 0.51 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 62.35 1hfg s VAL 50 Cb -0.11 -0.35 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 1hfg s VAL 50 CO 0.19 -0.02 1.18 0.00 0.00 0.00 0.00 175.10 176.45 1hfg s ALA 52 N 1.28 -0.03 -0.23 0.00 0.00 0.30 0.70 121.76 123.78 1hfg s ALA 52 Ca 0.58 -0.80 -0.02 0.00 0.00 0.00 0.00 51.96 51.71 1hfg s ALA 52 Cb -0.28 0.64 0.01 0.00 0.00 0.00 0.00 23.12 23.49 1hfg s ALA 52 CO 0.28 -0.55 -0.06 -0.51 0.00 0.00 0.00 175.76 174.91 1hfg s ASP 53 N -2.91 4.20 0.58 0.00 1.01 -1.26 0.81 116.67 119.10 1hfg s ASP 53 Ca 0.11 -0.66 0.34 0.00 0.71 0.00 0.00 52.55 53.04 1hfg s ASP 53 Cb 0.05 -1.68 1.32 0.00 1.01 0.00 0.00 42.92 43.62 1hfg s ASP 53 CO -0.06 -0.08 1.58 0.07 0.21 0.00 0.00 175.17 176.89 1hfg h LYS 54 N 8.05 0.00 -0.79 8.23 2.10 -1.91 1.10 116.57 133.35 1hfg h LYS 54 Ca -0.37 0.00 0.10 0.00 -2.00 0.00 0.00 60.65 58.38 1hfg h LYS 54 Cb 1.13 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.41 1hfg h LYS 54 CO 0.60 0.00 0.52 0.77 -2.00 0.00 0.00 179.45 179.33 1hfg h SER 55 N 0.00 0.63 -0.57 7.07 0.02 -1.94 -3.35 113.55 115.41 1hfg h SER 55 Ca 0.53 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 1hfg h SER 55 Cb 2.60 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 65.03 1hfg h SER 55 CO -0.01 0.37 0.00 0.29 -1.14 0.00 0.00 176.83 176.34 1hfg n LYS 56 N -4.51 -0.31 -0.08 3.45 4.76 0.38 -4.93 118.16 116.92 1hfg n LYS 56 Ca 0.14 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.42 1hfg n LYS 56 Cb 0.35 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.49 1hfg n LYS 56 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1hfg n ASP 57 N -1.72 1.48 0.20 4.39 9.92 -1.26 -4.14 116.55 125.43 1hfg n ASP 57 Ca 0.00 0.25 0.06 0.00 -0.53 0.00 0.00 54.79 54.57 1hfg n ASP 57 Cb 0.00 -0.59 0.43 0.00 -0.64 0.00 0.00 41.12 40.32 1hfg n ASP 57 CO 0.00 0.00 0.00 4.11 0.13 0.00 0.00 177.20 181.44 1hfg h TRP 58 N -0.70 0.00 0.00 1.24 5.08 -1.94 -2.02 115.95 117.61 1hfg h TRP 58 Ca -0.32 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 59.56 1hfg h TRP 58 Cb 1.17 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.32 1hfg h TRP 58 CO -0.15 0.32 -0.44 0.28 -1.28 0.00 0.00 178.44 177.17 1hfg h VAL 59 N 0.00 1.01 -0.02 0.12 2.07 -1.85 -2.56 116.25 115.02 1hfg h VAL 59 Ca -0.00 -1.70 -0.11 0.00 0.82 0.00 0.00 66.70 65.71 1hfg h VAL 59 Cb 0.67 2.01 0.01 0.00 -1.52 0.00 0.00 31.29 32.46 1hfg h VAL 59 CO 0.04 0.43 -0.41 0.50 0.02 0.00 0.00 177.57 178.15 1hfg h LYS 60 N 0.00 0.31 -0.57 1.57 3.64 -1.52 -2.89 116.57 117.11 1hfg h LYS 60 Ca -0.00 -0.31 0.04 0.00 -1.27 0.00 0.00 60.65 59.11 1hfg h LYS 60 Cb 0.97 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 1hfg h LYS 60 CO 0.06 1.00 0.32 -0.22 -2.27 0.00 0.00 179.45 178.33 1hfg h LYS 61 N -0.26 0.60 -0.49 1.90 3.64 -1.40 -2.06 116.57 118.50 1hfg h LYS 61 Ca -0.05 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1hfg h LYS 61 Cb 1.13 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.76 1hfg h LYS 61 CO 0.08 0.40 0.22 -0.07 -2.27 0.00 0.00 179.45 177.80 1hfg h LEU 62 N 0.62 0.28 -0.97 5.20 3.38 -1.52 0.56 115.31 122.86 1hfg h LEU 62 Ca 0.24 0.04 0.21 0.00 0.09 0.00 0.00 57.88 58.46 1hfg h LEU 62 Cb 0.09 -0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.73 1hfg h LEU 62 CO -0.14 0.19 0.55 0.24 0.09 0.00 0.00 178.44 179.38 1hfg h MET 63 N 0.42 0.61 0.00 1.13 2.86 -1.15 1.86 114.93 120.65 1hfg h MET 63 Ca 0.23 -0.04 -0.21 0.00 -2.06 0.00 0.00 59.70 57.62 1hfg h MET 63 Cb 0.18 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.68 1hfg h MET 63 CO -0.19 0.40 -1.08 1.96 1.06 0.00 0.00 176.91 179.06 1hfg h GLN 64 N 0.62 0.00 -0.02 1.72 4.20 -0.92 -3.29 115.11 117.43 1hfg h GLN 64 Ca 0.59 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 59.11 1hfg h GLN 64 Cb 1.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 1hfg h GLN 64 CO -0.44 0.83 -0.81 1.96 -0.67 0.00 0.00 178.83 179.70 1hfg h GLN 65 N 0.00 0.25 -6.30 1.46 1.08 0.37 -3.45 115.11 108.51 1hfg h GLN 65 Ca -0.06 -0.24 -0.60 0.00 -1.45 0.00 0.00 58.65 56.29 1hfg h GLN 65 Cb 1.76 0.06 -0.13 0.00 -0.05 0.00 0.00 27.48 29.12 1hfg h GLN 65 CO 0.11 0.93 -0.73 -0.51 -0.95 0.00 0.00 178.83 177.68 1hfg s LEU 66 N -7.62 2.80 0.00 1.46 1.43 0.60 -5.05 118.68 112.30 1hfg s LEU 66 Ca -0.04 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 1hfg s LEU 66 Cb 0.10 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.95 1hfg s LEU 66 CO 0.83 0.05 0.00 -0.81 0.23 0.00 0.00 176.35 176.65 1hfg n PRO 67 N -0.47 0.00 0.00 1.29 -0.04 -1.26 -4.58 135.00 129.94 1hfg n PRO 67 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 1hfg n PRO 67 Cb 0.58 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 1hfg n PRO 67 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1hfg n VAL 68 N 0.00 0.00 -2.11 0.52 3.14 -1.26 -4.77 118.33 113.84 1hfg n VAL 68 Ca 0.00 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.98 1hfg n VAL 68 Cb 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 32.75 1hfg n VAL 68 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1hfg s THR 69 N -1.43 3.49 -0.28 1.55 -4.23 -0.95 -4.86 115.64 108.92 1hfg s THR 69 Ca 0.00 0.38 0.02 0.00 -1.18 0.00 0.00 61.69 60.91 1hfg s THR 69 Cb 0.00 -3.98 0.08 0.00 1.34 0.00 0.00 72.50 69.94 1hfg s THR 69 CO 0.00 -0.84 0.00 0.00 -0.54 0.00 0.00 174.62 173.24 1hfg s ALA 70 N 7.84 2.19 0.00 3.99 0.00 -1.26 -4.87 121.76 129.64 1hfg s ALA 70 Ca 0.67 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1hfg s ALA 70 Cb -0.15 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.34 1hfg s ALA 70 CO 0.25 -1.44 0.00 -2.13 0.00 0.00 0.00 175.76 172.44