#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hhv n ASP 2 N 0.00 0.00 -4.03 1.61 9.92 -1.26 -4.74 116.55 118.05 1hhv n ASP 2 Ca 0.00 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 53.98 1hhv n ASP 2 Cb 0.00 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 40.41 1hhv n ASP 2 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1hhv n THR 3 N 0.00 -1.02 -3.64 -3.53 5.66 -1.26 -4.90 114.28 105.60 1hhv n THR 3 Ca 0.00 -0.43 -0.24 0.00 -3.05 0.00 0.00 64.05 60.33 1hhv n THR 3 Cb 0.00 -0.97 -0.17 0.00 -1.55 0.00 0.00 70.33 67.63 1hhv n THR 3 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1hhv s LEU 4 N -6.74 0.33 0.60 1.09 2.96 -1.26 -5.13 118.68 110.51 1hhv s LEU 4 Ca 0.06 -0.40 -0.16 0.00 -0.22 0.00 0.00 54.13 53.41 1hhv s LEU 4 Cb -0.03 -0.23 -0.03 0.00 0.50 0.00 0.00 46.19 46.39 1hhv s LEU 4 CO 0.84 -0.31 1.06 -0.83 -1.32 0.00 0.00 176.35 175.78 1hhv s GLY 5 N 2.13 2.12 0.36 7.98 0.00 -1.26 -4.95 107.32 113.70 1hhv s GLY 5 Ca 0.03 0.39 0.23 0.00 0.00 0.00 0.00 44.72 45.37 1hhv s GLY 5 CO -0.07 0.71 1.52 0.00 0.00 0.00 0.00 173.10 175.26 1hhv h ALA 6 N 0.41 0.90 0.00 3.20 0.00 -2.04 -3.44 119.26 118.30 1hhv h ALA 6 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1hhv h ALA 6 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1hhv h ALA 6 CO 0.57 0.00 0.00 0.45 0.00 0.00 0.00 179.25 180.27 1hhv n SER 7 N -2.89 -0.80 -4.70 0.00 2.88 -1.26 -5.12 113.62 101.73 1hhv n SER 7 Ca 0.03 0.31 -0.24 0.00 -1.33 0.00 0.00 58.87 57.64 1hhv n SER 7 Cb 0.52 0.91 -0.07 0.00 -0.75 0.00 0.00 64.21 64.82 1hhv n SER 7 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1hhv s TRP 8 N -2.00 2.87 0.08 0.66 -2.14 -1.26 -5.13 118.94 112.01 1hhv s TRP 8 Ca 0.00 -0.15 -0.22 0.00 2.66 0.00 0.00 56.10 58.39 1hhv s TRP 8 Cb 0.00 -1.33 0.05 0.00 -3.10 0.00 0.00 33.47 29.09 1hhv s TRP 8 CO 0.00 0.55 0.52 -3.38 -2.66 0.00 0.00 176.95 171.98 1hhv s HIS 9 N -2.00 -0.41 -0.21 1.66 -3.43 -1.26 -4.39 115.29 105.24 1hhv s HIS 9 Ca 0.30 0.36 -0.07 0.00 -0.80 0.00 0.00 55.06 54.86 1hhv s HIS 9 Cb -0.08 0.37 0.01 0.00 -1.43 0.00 0.00 32.58 31.45 1hhv s HIS 9 CO 0.21 -0.69 0.15 0.54 -2.00 0.00 0.00 174.74 172.94 1hhv n ARG 10 N 0.17 -1.89 -1.41 -0.38 5.12 -1.26 -4.94 116.66 112.08 1hhv n ARG 10 Ca -0.18 1.74 -0.30 0.00 -1.93 0.00 0.00 57.85 57.19 1hhv n ARG 10 Cb 0.62 -3.23 0.11 0.00 -1.16 0.00 0.00 32.46 28.80 1hhv n ARG 10 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1hhv s PRO 11 N -1.59 1.70 -0.17 5.56 0.04 -1.26 -4.91 135.00 134.37 1hhv s PRO 11 Ca 0.08 0.70 -0.02 0.00 0.04 0.00 0.00 61.00 61.80 1hhv s PRO 11 Cb -0.01 -1.87 0.04 0.00 0.04 0.00 0.00 34.50 32.69 1hhv s PRO 11 CO 0.48 -1.90 2.38 -0.25 0.04 0.00 0.00 177.00 177.75 1hhv n ASP 12 N -3.63 5.86 -2.19 6.66 8.00 -1.26 -4.34 116.55 125.66 1hhv n ASP 12 Ca 0.07 -2.75 -0.27 0.00 0.71 0.00 0.00 54.79 52.55 1hhv n ASP 12 Cb 0.56 -1.17 0.03 0.00 -0.02 0.00 0.00 41.12 40.52 1hhv n ASP 12 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1hhv n LYS 13 N 1.19 3.41 0.00 -1.24 0.00 -1.26 -4.85 118.16 115.41 1hhv n LYS 13 Ca 0.24 -4.07 0.00 0.00 0.00 0.00 0.00 58.31 54.48 1hhv n LYS 13 Cb 0.60 -2.28 0.00 0.00 0.00 0.00 0.00 35.03 33.36 1hhv n LYS 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1hhv n LEU 16 N 0.00 1.68 0.00 0.00 0.00 -1.26 -4.87 117.00 112.54 1hhv n LEU 16 Ca 0.01 -0.85 0.00 0.00 0.00 0.00 0.00 56.01 55.17 1hhv n LEU 16 Cb 0.36 -0.44 0.00 0.00 0.00 0.00 0.00 43.42 43.34 1hhv n LEU 16 CO 0.11 0.30 0.00 0.61 0.00 0.00 0.00 177.39 178.41 1hhv n GLY 17 N 0.26 1.50 0.00 -3.96 0.00 -1.26 -4.58 105.19 97.15 1hhv n GLY 17 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1hhv n GLY 17 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1hhv n TYR 18 N 0.00 0.00 -1.65 1.61 4.02 -1.25 -4.83 117.16 115.06 1hhv n TYR 18 Ca 0.00 0.00 -0.60 0.00 -0.01 0.00 0.00 57.90 57.29 1hhv n TYR 18 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.24 1hhv n TYR 18 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1hhv n GLN 19 N 0.00 0.55 -0.02 -0.72 -0.06 0.91 -4.84 117.38 113.20 1hhv n GLN 19 Ca 0.00 0.20 -0.21 0.00 -2.00 0.00 0.00 57.00 54.99 1hhv n GLN 19 Cb 0.00 -1.78 -0.13 0.00 -4.06 0.00 0.00 30.24 24.27 1hhv n GLN 19 CO 0.00 0.00 0.00 1.57 -0.20 0.00 0.00 177.06 178.43 1hhv h LYS 20 N 5.11 0.16 -7.30 3.69 2.10 -1.91 -3.47 116.57 114.96 1hhv h LYS 20 Ca -0.47 -0.28 -0.50 0.00 -2.00 0.00 0.00 60.65 57.40 1hhv h LYS 20 Cb 1.36 0.10 0.06 0.00 -0.90 0.00 0.00 32.23 32.86 1hhv h LYS 20 CO 0.86 1.13 0.34 1.03 -2.00 0.00 0.00 179.45 180.82 1hhv s ARG 21 N -2.42 3.30 0.24 0.07 0.52 -1.26 -5.02 118.95 114.38 1hhv s ARG 21 Ca -0.22 0.50 -0.30 0.00 -0.52 0.00 0.00 55.73 55.19 1hhv s ARG 21 Cb 0.04 -2.13 -0.09 0.00 0.52 0.00 0.00 34.95 33.29 1hhv s ARG 21 CO 0.72 -0.66 1.17 -1.25 0.02 0.00 0.00 175.30 175.30 1hhv s PRO 22 N -5.14 4.53 -0.08 3.54 0.04 -1.26 -5.03 135.00 131.59 1hhv s PRO 22 Ca 0.55 1.89 0.04 0.00 0.04 0.00 0.00 61.00 63.51 1hhv s PRO 22 Cb -0.11 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.23 1hhv s PRO 22 CO 0.51 0.01 -0.20 -0.51 0.04 0.00 0.00 177.00 176.85 1hhv s LEU 23 N -0.84 1.95 0.00 -3.56 1.43 -1.26 -5.13 118.68 111.26 1hhv s LEU 23 Ca 0.49 -0.46 -0.08 0.00 -1.03 0.00 0.00 54.13 53.05 1hhv s LEU 23 Cb -0.33 -1.21 0.11 0.00 0.03 0.00 0.00 46.19 44.80 1hhv s LEU 23 CO 0.40 0.13 0.49 -0.81 0.23 0.00 0.00 176.35 176.80 1hhv n PRO 24 N 3.51 -1.34 0.00 1.29 -0.04 -1.26 -4.88 135.00 132.28 1hhv n PRO 24 Ca -0.20 -0.78 0.00 0.00 -0.04 0.00 0.00 63.50 62.48 1hhv n PRO 24 Cb 0.53 -0.63 0.00 0.00 -0.04 0.00 0.00 33.50 33.35 1hhv n PRO 24 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1hhv n GLN 25 N -2.60 0.00 0.00 0.54 0.00 -1.26 -4.61 117.38 109.45 1hhv n GLN 25 Ca 0.07 0.00 0.02 0.00 -0.00 0.00 0.00 57.00 57.09 1hhv n GLN 25 Cb 0.24 -0.73 0.09 0.00 0.00 0.00 0.00 30.24 29.84 1hhv n GLN 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1hhv n VAL 26 N -2.27 1.64 -0.05 1.69 0.31 -1.26 -1.61 118.33 116.78 1hhv n VAL 26 Ca 0.00 0.41 -0.03 0.00 -0.01 0.00 0.00 64.34 64.71 1hhv n VAL 26 Cb 0.33 -1.34 -0.15 0.00 -0.91 0.00 0.00 33.84 31.77 1hhv n VAL 26 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1hhv n LEU 27 N -1.48 0.23 -4.96 7.52 -0.00 -1.26 -4.96 117.00 112.09 1hhv n LEU 27 Ca 0.01 0.10 -0.22 0.00 -0.00 0.00 0.00 56.01 55.90 1hhv n LEU 27 Cb 0.05 0.27 0.05 0.00 -0.00 0.00 0.00 43.42 43.79 1hhv n LEU 27 CO 0.04 0.30 0.43 -0.76 -0.00 0.00 0.00 177.39 177.40 1hhv s LEU 28 N -5.36 3.15 0.00 -1.96 1.43 -0.64 -3.91 118.68 111.40 1hhv s LEU 28 Ca -0.08 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.09 1hhv s LEU 28 Cb 0.09 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.45 1hhv s LEU 28 CO 0.84 -1.29 0.00 -0.24 0.23 0.00 0.00 176.35 175.89 1hhv n SER 29 N -2.50 0.00 0.00 2.29 2.88 0.60 -4.63 113.62 112.25 1hhv n SER 29 Ca 0.08 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 1hhv n SER 29 Cb 0.60 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 1hhv n SER 29 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1hhv n SER 30 N -2.17 0.07 -3.55 -3.46 3.41 -0.84 -4.54 113.62 102.54 1hhv n SER 30 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 1hhv n SER 30 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1hhv n SER 30 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1hhv s TRP 31 N -0.89 -0.39 -0.11 7.33 1.48 -1.05 0.12 118.94 125.42 1hhv s TRP 31 Ca 0.00 0.11 -0.09 0.00 -1.06 0.00 0.00 56.10 55.06 1hhv s TRP 31 Cb 0.00 0.52 0.03 0.00 -1.16 0.00 0.00 33.47 32.86 1hhv s TRP 31 CO 0.00 -0.90 0.28 1.52 -4.06 0.00 0.00 176.95 173.79 1hhv s TYR 32 N -3.80 -0.32 0.83 1.66 -0.85 -0.36 0.33 117.35 114.84 1hhv s TYR 32 Ca 0.04 0.77 -0.11 0.00 -0.52 0.00 0.00 57.07 57.25 1hhv s TYR 32 Cb -0.01 0.10 0.09 0.00 0.38 0.00 0.00 41.96 42.52 1hhv s TYR 32 CO -0.09 -0.16 1.13 -1.25 -1.52 0.00 0.00 175.55 173.66 1hhv s PRO 33 N 0.29 1.71 0.29 -3.49 0.04 -1.26 -2.39 135.00 130.19 1hhv s PRO 33 Ca -0.01 1.41 0.03 0.00 0.04 0.00 0.00 61.00 62.46 1hhv s PRO 33 Cb -0.03 -1.82 0.03 0.00 0.04 0.00 0.00 34.50 32.72 1hhv s PRO 33 CO -0.01 -2.09 0.23 0.25 0.04 0.00 0.00 177.00 175.42 1hhv n THR 34 N -3.72 0.00 -4.19 1.26 -2.24 -0.77 -4.86 114.28 99.76 1hhv n THR 34 Ca 0.11 -1.15 -0.27 0.00 -2.27 0.00 0.00 64.05 60.47 1hhv n THR 34 Cb 0.52 -0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.42 1hhv n THR 34 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1hhv s SER 35 N -2.72 4.43 0.00 3.42 0.15 -1.26 -4.72 113.70 113.01 1hhv s SER 35 Ca 0.17 -1.28 0.27 0.00 0.70 0.00 0.00 55.95 55.82 1hhv s SER 35 Cb -0.01 0.08 0.91 0.00 -1.71 0.00 0.00 66.02 65.29 1hhv s SER 35 CO 0.11 -0.82 1.67 0.00 1.20 0.00 0.00 173.24 175.40 1hhv n GLN 36 N -1.43 0.41 -0.33 5.44 6.02 -1.26 -4.09 117.38 122.14 1hhv n GLN 36 Ca -0.06 -0.18 0.23 0.00 -0.01 0.00 0.00 57.00 56.98 1hhv n GLN 36 Cb 0.65 -1.50 0.46 0.00 1.02 0.00 0.00 30.24 30.87 1hhv n GLN 36 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1hhv h LEU 37 N 0.45 0.30 0.00 1.08 6.46 -2.00 -3.39 115.31 118.21 1hhv h LEU 37 Ca 0.00 0.22 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 1hhv h LEU 37 Cb 0.45 0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.60 1hhv h LEU 37 CO 0.00 -0.23 0.00 0.00 -0.62 0.00 0.00 178.44 177.59 1hhv n SER 39 N 0.00 2.83 -3.02 0.00 2.88 -1.26 -4.83 113.62 110.21 1hhv n SER 39 Ca 0.00 -1.83 0.02 0.00 -1.33 0.00 0.00 58.87 55.73 1hhv n SER 39 Cb 0.00 -0.15 -0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1hhv n SER 39 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1hhv s LYS 40 N -1.24 0.46 0.57 -1.46 -2.85 -1.26 -5.15 119.74 108.80 1hhv s LYS 40 Ca 0.26 -0.05 -0.18 0.00 -1.00 0.00 0.00 55.97 55.01 1hhv s LYS 40 Cb 0.16 0.08 -0.05 0.00 -2.06 0.00 0.00 37.83 35.96 1hhv s LYS 40 CO 0.22 -0.69 1.09 -1.25 0.10 0.00 0.00 175.35 174.82 1hhv s PRO 41 N 2.13 3.33 0.00 1.78 0.04 -1.26 -4.99 135.00 136.03 1hhv s PRO 41 Ca 0.16 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.60 1hhv s PRO 41 Cb -0.02 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1hhv s PRO 41 CO -0.14 -0.83 0.00 0.41 0.04 0.00 0.00 177.00 176.48 1hhv n GLY 42 N -0.38 2.38 3.08 0.56 0.00 -1.26 -5.00 105.19 104.56 1hhv n GLY 42 Ca 0.10 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1hhv n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hhv s VAL 43 N 0.08 1.40 -0.05 1.61 1.01 -0.96 -1.86 120.40 121.63 1hhv s VAL 43 Ca 0.00 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1hhv s VAL 43 Cb 0.00 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 1hhv s VAL 43 CO 0.00 0.41 -0.04 0.27 0.00 0.00 0.00 175.10 175.74 1hhv s ILE 44 N 0.60 3.88 -0.04 2.22 -5.25 -1.01 -0.13 121.20 121.47 1hhv s ILE 44 Ca -0.15 -0.51 0.01 0.00 -0.99 0.00 0.00 60.65 59.01 1hhv s ILE 44 Cb -0.16 -2.64 -0.03 0.00 2.95 0.00 0.00 42.46 42.58 1hhv s ILE 44 CO 0.05 0.53 -0.04 -0.36 -1.79 0.00 0.00 174.94 173.33 1hhv s PHE 45 N -0.90 3.00 -0.20 1.37 0.08 0.41 -1.22 117.98 120.51 1hhv s PHE 45 Ca 0.14 0.05 -0.05 0.00 0.12 0.00 0.00 56.93 57.20 1hhv s PHE 45 Cb -0.11 -1.70 -0.02 0.00 -0.57 0.00 0.00 43.02 40.62 1hhv s PHE 45 CO 0.04 0.39 -0.02 -0.51 -0.10 0.00 0.00 175.22 175.03 1hhv s LEU 46 N -1.10 3.14 0.00 -0.37 2.01 0.12 0.19 118.68 122.67 1hhv s LEU 46 Ca 0.15 -0.26 0.00 0.00 0.01 0.00 0.00 54.13 54.03 1hhv s LEU 46 Cb -0.11 -1.79 0.00 0.00 0.01 0.00 0.00 46.19 44.29 1hhv s LEU 46 CO 0.05 0.04 0.00 0.35 1.01 0.00 0.00 176.35 177.80 1hhv n THR 47 N 4.39 0.00 0.19 5.49 -2.24 -0.18 -0.29 114.28 121.63 1hhv n THR 47 Ca -0.17 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.64 1hhv n THR 47 Cb 0.52 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.80 1hhv n THR 47 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hhv n LYS 48 N 0.00 0.83 0.00 -0.78 5.02 -1.25 -1.54 118.16 120.44 1hhv n LYS 48 Ca 0.00 -1.20 0.00 0.00 -2.02 0.00 0.00 58.31 55.09 1hhv n LYS 48 Cb 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1hhv n LYS 48 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1hhv n ARG 49 N 0.34 0.00 -0.62 1.97 1.74 -1.26 -4.99 116.66 113.84 1hhv n ARG 49 Ca 0.05 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.11 1hhv n ARG 49 Cb 0.23 -0.11 -0.02 0.00 -1.02 0.00 0.00 32.46 31.55 1hhv n ARG 49 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hhv n GLY 50 N 2.89 -0.12 3.49 -0.13 0.00 -1.26 -5.14 105.19 104.92 1hhv n GLY 50 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1hhv n GLY 50 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1hhv s ARG 51 N 0.00 2.18 0.26 1.61 3.52 -1.26 -5.00 118.95 120.26 1hhv s ARG 51 Ca 0.00 -0.93 0.09 0.00 -0.13 0.00 0.00 55.73 54.76 1hhv s ARG 51 Cb 0.00 -2.26 -0.04 0.00 -1.56 0.00 0.00 34.95 31.09 1hhv s ARG 51 CO 0.00 0.55 0.06 -0.65 -0.81 0.00 0.00 175.30 174.45 1hhv s GLN 52 N -1.44 2.50 0.05 5.12 1.11 -1.26 -1.01 119.66 124.73 1hhv s GLN 52 Ca 0.15 -1.30 0.00 0.00 0.01 0.00 0.00 55.36 54.22 1hhv s GLN 52 Cb -0.11 -2.29 -0.03 0.00 -1.01 0.00 0.00 33.01 29.57 1hhv s GLN 52 CO 0.06 0.37 -0.04 0.08 0.01 0.00 0.00 175.29 175.77 1hhv s VAL 53 N -2.27 0.31 -0.13 1.09 1.01 0.51 -4.90 120.40 116.03 1hhv s VAL 53 Ca 0.32 -1.51 -0.02 0.00 0.00 0.00 0.00 61.98 60.77 1hhv s VAL 53 Cb -0.07 -1.11 0.04 0.00 0.00 0.00 0.00 36.38 35.24 1hhv s VAL 53 CO 0.22 -0.78 -0.01 0.00 0.00 0.00 0.00 175.10 174.53 1hhv s ALA 55 N 1.85 0.60 0.14 0.00 0.00 0.82 0.31 121.76 125.47 1hhv s ALA 55 Ca 0.02 -1.23 -0.30 0.00 0.00 0.00 0.00 51.96 50.45 1hhv s ALA 55 Cb -0.14 0.25 -0.07 0.00 0.00 0.00 0.00 23.12 23.16 1hhv s ALA 55 CO -0.07 -0.34 1.09 0.34 0.00 0.00 0.00 175.76 176.79 1hhv s ASP 56 N -2.92 7.27 0.20 0.00 -1.08 -1.26 -2.27 116.67 116.60 1hhv s ASP 56 Ca 0.08 2.01 0.18 0.00 -0.52 0.00 0.00 52.55 54.30 1hhv s ASP 56 Cb 0.07 -2.60 0.84 0.00 -1.46 0.00 0.00 42.92 39.77 1hhv s ASP 56 CO -0.09 -0.25 1.55 1.17 0.52 0.00 0.00 175.17 178.07 1hhv n LYS 57 N 2.79 0.12 0.00 4.34 0.00 -1.26 -1.41 118.16 122.74 1hhv n LYS 57 Ca 0.04 0.48 0.15 0.00 0.00 0.00 0.00 58.31 58.98 1hhv n LYS 57 Cb 0.47 -1.79 0.84 0.00 0.00 0.00 0.00 35.03 34.55 1hhv n LYS 57 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1hhv n SER 58 N -2.02 0.20 -4.66 3.14 3.41 -1.26 -4.10 113.62 108.33 1hhv n SER 58 Ca 0.01 -0.86 -0.42 0.00 -0.26 0.00 0.00 58.87 57.34 1hhv n SER 58 Cb 0.12 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1hhv n SER 58 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1hhv s LYS 59 N -2.15 4.27 0.16 4.33 3.01 -0.50 -4.92 119.74 123.93 1hhv s LYS 59 Ca 0.42 1.23 -0.29 0.00 -1.01 0.00 0.00 55.97 56.31 1hhv s LYS 59 Cb 0.21 -3.62 -0.02 0.00 -1.01 0.00 0.00 37.83 33.39 1hhv s LYS 59 CO 0.39 -0.52 1.55 -0.44 0.51 0.00 0.00 175.35 176.84 1hhv h ASP 60 N 7.44 -1.82 -0.99 2.83 5.19 -1.89 0.44 116.42 127.61 1hhv h ASP 60 Ca -0.23 0.28 0.11 0.00 -0.62 0.00 0.00 57.03 56.57 1hhv h ASP 60 Cb 1.09 0.80 -0.08 0.00 0.18 0.00 0.00 39.33 41.32 1hhv h ASP 60 CO 0.92 -0.32 0.62 4.11 -3.12 0.00 0.00 179.24 181.45 1hhv h TRP 61 N -0.19 1.13 0.26 4.55 5.08 -1.95 -2.26 115.95 122.56 1hhv h TRP 61 Ca 0.16 0.03 -0.01 0.00 1.08 0.00 0.00 58.89 60.15 1hhv h TRP 61 Cb 0.53 -0.36 0.00 0.00 -3.00 0.00 0.00 29.16 26.33 1hhv h TRP 61 CO -0.83 0.48 -0.12 0.28 -1.28 0.00 0.00 178.44 176.96 1hhv h VAL 62 N 1.01 0.80 -0.83 0.12 2.07 -0.72 -2.60 116.25 116.10 1hhv h VAL 62 Ca 0.48 -0.45 0.15 0.00 0.82 0.00 0.00 66.70 67.70 1hhv h VAL 62 Cb 0.41 1.05 -0.15 0.00 -1.52 0.00 0.00 31.29 31.08 1hhv h VAL 62 CO -0.25 0.10 -0.28 0.50 0.02 0.00 0.00 177.57 177.66 1hhv h LYS 63 N -0.58 -0.03 -0.94 1.57 3.11 0.22 1.43 116.57 121.35 1hhv h LYS 63 Ca -0.04 0.00 0.11 0.00 -2.81 0.00 0.00 60.65 57.91 1hhv h LYS 63 Cb 0.42 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 31.59 1hhv h LYS 63 CO 0.06 -0.02 0.60 -0.22 -2.81 0.00 0.00 179.45 177.06 1hhv h LYS 64 N -0.04 0.90 -1.07 1.90 3.64 -1.35 -0.45 116.57 120.11 1hhv h LYS 64 Ca 0.36 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1hhv h LYS 64 Cb 0.60 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1hhv h LYS 64 CO -0.86 0.60 0.00 1.28 -2.27 0.00 0.00 179.45 178.20 1hhv n LEU 65 N -4.56 0.22 0.00 5.20 4.77 0.49 -1.43 117.00 121.69 1hhv n LEU 65 Ca 0.17 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1hhv n LEU 65 Cb 0.33 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1hhv n LEU 65 CO 0.30 0.04 0.00 1.67 -1.33 0.00 0.00 177.39 178.07 1hhv n GLN 67 N 0.72 0.00 0.06 3.23 7.27 -0.18 0.36 117.38 128.83 1hhv n GLN 67 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 1hhv n GLN 67 Cb 0.04 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 32.63 1hhv n GLN 67 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1hhv h GLN 68 N 0.00 0.00 -6.42 3.69 1.08 -1.51 -3.46 115.11 108.49 1hhv h GLN 68 Ca 0.00 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.66 1hhv h GLN 68 Cb 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.40 1hhv h GLN 68 CO 0.00 0.44 -0.07 -0.51 -0.95 0.00 0.00 178.83 177.74 1hhv s LEU 69 N -6.09 4.25 -0.13 1.46 1.43 0.16 -5.04 118.68 114.71 1hhv s LEU 69 Ca -0.01 1.06 -0.27 0.00 -1.03 0.00 0.00 54.13 53.88 1hhv s LEU 69 Cb 0.08 -3.52 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 1hhv s LEU 69 CO 0.80 0.00 0.89 -2.16 0.23 0.00 0.00 176.35 176.11 1hhv s PRO 70 N -2.38 4.36 -1.00 1.29 0.04 -1.26 -4.79 135.00 131.26 1hhv s PRO 70 Ca 0.43 1.15 -0.26 0.00 0.04 0.00 0.00 61.00 62.36 1hhv s PRO 70 Cb -0.13 -3.55 -0.18 0.00 0.04 0.00 0.00 34.50 30.68 1hhv s PRO 70 CO 0.20 -0.28 2.17 0.54 0.04 0.00 0.00 177.00 179.67 1hhv s VAL 71 N 1.95 3.10 0.40 -0.36 0.11 -1.24 -2.54 120.40 121.83 1hhv s VAL 71 Ca 0.42 -0.15 -0.13 0.00 -2.93 0.00 0.00 61.98 59.20 1hhv s VAL 71 Cb -0.17 -3.78 -0.11 0.00 -1.53 0.00 0.00 36.38 30.79 1hhv s VAL 71 CO 0.15 -0.20 -0.15 0.41 -3.33 0.00 0.00 175.10 171.99 1hhv n THR 72 N 8.78 0.00 -4.85 5.04 -1.04 0.99 -4.45 114.28 118.75 1hhv n THR 72 Ca 0.43 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1hhv n THR 72 Cb 0.46 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.97 1hhv n THR 72 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hhv n ALA 73 N -1.16 0.00 0.28 2.41 0.00 -1.26 -4.60 120.51 116.19 1hhv n ALA 73 Ca 0.05 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.52 1hhv n ALA 73 Cb 0.34 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.82 1hhv n ALA 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04