#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 1.23 -4.66 1.61 9.92 -1.26 -4.81 116.55 118.58 1hhv n ASP 2 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.84 1hhv n ASP 2 Cb 0.00 0.02 -0.03 0.00 -0.64 0.00 0.00 41.12 40.47 1hhv n ASP 2 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1hhv s THR 3 N -1.30 3.01 -1.52 -3.53 2.01 -1.26 -2.15 115.64 110.90 1hhv s THR 3 Ca 0.00 0.09 -0.16 0.00 0.31 0.00 0.00 61.69 61.93 1hhv s THR 3 Cb 0.00 -3.06 0.14 0.00 0.01 0.00 0.00 72.50 69.59 1hhv s THR 3 CO 0.00 -0.01 0.66 -0.11 -0.69 0.00 0.00 174.62 174.47 1hhv n LEU 4 N 7.29 -1.51 -4.86 4.42 7.94 -1.26 -4.92 117.00 124.10 1hhv n LEU 4 Ca 0.19 -0.78 -0.30 0.00 -1.11 0.00 0.00 56.01 54.01 1hhv n LEU 4 Cb 0.41 -2.01 0.21 0.00 0.53 0.00 0.00 43.42 42.57 1hhv n LEU 4 CO 0.67 0.23 0.83 -0.83 -1.11 0.00 0.00 177.39 177.18 1hhv s GLY 5 N -3.06 1.77 0.38 -3.96 0.00 -0.91 -4.88 107.32 96.65 1hhv s GLY 5 Ca 0.63 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 44.10 1hhv s GLY 5 CO 0.77 -0.40 0.00 0.00 0.00 0.00 0.00 173.10 173.47 1hhv n ALA 6 N -4.08 -2.09 -0.52 3.20 0.00 -1.26 -4.90 120.51 110.86 1hhv n ALA 6 Ca 0.16 0.42 -0.28 0.00 0.00 0.00 0.00 53.44 53.74 1hhv n ALA 6 Cb 0.59 -1.34 0.21 0.00 0.00 0.00 0.00 19.45 18.91 1hhv n ALA 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1hhv n SER 7 N 0.03 -2.67 -3.60 0.00 2.88 -1.26 -4.78 113.62 104.22 1hhv n SER 7 Ca 0.00 -0.32 -0.41 0.00 -1.33 0.00 0.00 58.87 56.81 1hhv n SER 7 Cb 0.00 -1.00 -0.01 0.00 -0.75 0.00 0.00 64.21 62.46 1hhv n SER 7 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 1hhv n TRP 8 N -4.82 2.96 -1.51 0.66 -0.00 -1.26 -4.71 117.44 108.77 1hhv n TRP 8 Ca 0.04 -2.95 -0.34 0.00 -0.00 0.00 0.00 57.50 54.24 1hhv n TRP 8 Cb 0.55 -2.32 0.05 0.00 -0.00 0.00 0.00 31.31 29.59 1hhv n TRP 8 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 177.69 179.27 1hhv n HIS 9 N 4.32 2.82 -3.52 5.87 -0.00 -1.26 -4.72 115.22 118.73 1hhv n HIS 9 Ca 0.59 -2.58 -0.27 0.00 -0.00 0.00 0.00 57.72 55.46 1hhv n HIS 9 Cb 0.32 -1.31 -0.09 0.00 -0.00 0.00 0.00 29.99 28.91 1hhv n HIS 9 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1hhv n ARG 10 N -0.49 2.22 -1.15 1.57 1.74 -1.26 -4.95 116.66 114.33 1hhv n ARG 10 Ca 0.55 -4.52 -0.29 0.00 -0.77 0.00 0.00 57.85 52.82 1hhv n ARG 10 Cb 0.49 -2.20 -0.07 0.00 -1.02 0.00 0.00 32.46 29.66 1hhv n ARG 10 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1hhv n PRO 11 N 1.18 3.00 -0.75 5.56 -0.04 -1.26 -4.34 135.00 138.35 1hhv n PRO 11 Ca 0.27 -1.73 0.04 0.00 -0.04 0.00 0.00 63.50 62.04 1hhv n PRO 11 Cb 0.40 -2.50 0.19 0.00 -0.04 0.00 0.00 33.50 31.55 1hhv n PRO 11 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1hhv n ASP 12 N 3.27 1.80 -4.59 3.54 8.00 -1.26 -5.01 116.55 122.30 1hhv n ASP 12 Ca 0.64 -3.74 -0.43 0.00 0.71 0.00 0.00 54.79 51.97 1hhv n ASP 12 Cb 0.44 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 41.02 1hhv n ASP 12 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1hhv s LYS 13 N -3.00 3.65 0.00 -1.24 2.36 -1.26 -4.73 119.74 115.52 1hhv s LYS 13 Ca 0.38 0.45 0.00 0.00 -2.55 0.00 0.00 55.97 54.26 1hhv s LYS 13 Cb 0.37 -3.94 0.00 0.00 -1.05 0.00 0.00 37.83 33.21 1hhv s LYS 13 CO -0.07 -1.47 0.00 0.00 1.55 0.00 0.00 175.35 175.36 1hhv n LEU 16 N -0.49 1.35 0.00 0.00 0.00 -1.26 -4.94 117.00 111.65 1hhv n LEU 16 Ca -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 56.01 55.30 1hhv n LEU 16 Cb 0.61 -0.48 0.00 0.00 0.00 0.00 0.00 43.42 43.54 1hhv n LEU 16 CO 0.25 0.29 0.00 0.61 0.00 0.00 0.00 177.39 178.54 1hhv n GLY 17 N 0.11 4.09 2.99 -3.96 0.00 -1.26 -4.29 105.19 102.87 1hhv n GLY 17 Ca 0.00 0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1hhv n GLY 17 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hhv s TYR 18 N 0.00 1.78 -0.05 1.61 2.02 -1.19 -3.73 117.35 117.79 1hhv s TYR 18 Ca 0.00 -0.88 -0.38 0.00 -0.37 0.00 0.00 57.07 55.44 1hhv s TYR 18 Cb 0.00 -1.35 -0.17 0.00 -0.40 0.00 0.00 41.96 40.04 1hhv s TYR 18 CO 0.00 -0.51 1.45 0.94 -1.57 0.00 0.00 175.55 175.86 1hhv n GLN 19 N 4.54 1.00 -0.03 -0.62 -0.06 0.85 -4.86 117.38 118.20 1hhv n GLN 19 Ca -0.17 0.36 -0.21 0.00 -2.00 0.00 0.00 57.00 54.98 1hhv n GLN 19 Cb 0.51 -2.00 -0.13 0.00 -4.06 0.00 0.00 30.24 24.55 1hhv n GLN 19 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1hhv n LYS 20 N 3.33 0.71 -2.22 3.69 4.81 -1.26 -4.90 118.16 122.32 1hhv n LYS 20 Ca 0.21 0.30 -0.32 0.00 -0.87 0.00 0.00 58.31 57.64 1hhv n LYS 20 Cb 0.15 -1.69 -0.02 0.00 0.02 0.00 0.00 35.03 33.50 1hhv n LYS 20 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1hhv s ARG 21 N -2.52 3.74 0.24 1.64 0.52 -1.26 -5.00 118.95 116.32 1hhv s ARG 21 Ca -0.25 0.97 -0.30 0.00 -0.52 0.00 0.00 55.73 55.63 1hhv s ARG 21 Cb 0.07 -2.10 -0.09 0.00 0.52 0.00 0.00 34.95 33.34 1hhv s ARG 21 CO 0.71 -0.45 1.30 -1.25 0.02 0.00 0.00 175.30 175.64 1hhv s PRO 22 N -4.28 4.39 -0.08 3.54 0.04 -1.26 -5.02 135.00 132.33 1hhv s PRO 22 Ca 0.59 2.10 0.02 0.00 0.04 0.00 0.00 61.00 63.75 1hhv s PRO 22 Cb -0.11 -3.16 0.01 0.00 0.04 0.00 0.00 34.50 31.28 1hhv s PRO 22 CO 0.37 -0.21 -0.14 -0.51 0.04 0.00 0.00 177.00 176.54 1hhv s LEU 23 N -0.66 1.71 0.74 -3.56 1.43 -1.26 -5.13 118.68 111.95 1hhv s LEU 23 Ca 0.54 -0.35 -0.11 0.00 -1.03 0.00 0.00 54.13 53.18 1hhv s LEU 23 Cb -0.37 -0.95 0.05 0.00 0.03 0.00 0.00 46.19 44.95 1hhv s LEU 23 CO 0.43 0.05 1.11 -2.16 0.23 0.00 0.00 176.35 176.00 1hhv s PRO 24 N 0.67 2.39 -0.21 1.29 0.04 -1.26 -4.86 135.00 133.06 1hhv s PRO 24 Ca -0.14 0.18 -0.04 0.00 0.04 0.00 0.00 61.00 61.04 1hhv s PRO 24 Cb -0.16 -2.03 -0.20 0.00 0.04 0.00 0.00 34.50 32.15 1hhv s PRO 24 CO 0.04 -1.28 -0.03 0.94 0.04 0.00 0.00 177.00 176.71 1hhv n GLN 25 N -3.09 0.67 0.13 4.56 7.27 -1.26 -4.02 117.38 121.64 1hhv n GLN 25 Ca 0.07 0.22 0.08 0.00 0.07 0.00 0.00 57.00 57.44 1hhv n GLN 25 Cb 0.59 -1.59 0.41 0.00 2.41 0.00 0.00 30.24 32.06 1hhv n GLN 25 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1hhv n VAL 26 N -3.50 1.08 0.00 1.69 0.31 -1.26 -0.56 118.33 116.08 1hhv n VAL 26 Ca -0.42 0.69 0.03 0.00 -0.01 0.00 0.00 64.34 64.63 1hhv n VAL 26 Cb 0.98 -1.69 -0.11 0.00 -0.91 0.00 0.00 33.84 32.11 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 -2.04 0.42 -4.97 7.52 7.94 -1.26 -4.95 117.00 119.66 1hhv n LEU 27 Ca -0.01 0.18 -0.18 0.00 -1.11 0.00 0.00 56.01 54.88 1hhv n LEU 27 Cb 0.11 0.12 -0.00 0.00 0.53 0.00 0.00 43.42 44.18 1hhv n LEU 27 CO 0.07 0.13 0.08 -0.76 -1.11 0.00 0.00 177.39 175.80 1hhv s LEU 28 N -5.29 3.74 0.00 -1.96 1.43 0.27 -3.74 118.68 113.14 1hhv s LEU 28 Ca -0.06 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 1hhv s LEU 28 Cb 0.10 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1hhv s LEU 28 CO 0.84 -0.59 0.00 -0.24 0.23 0.00 0.00 176.35 176.59 1hhv n SER 29 N -1.70 0.00 0.00 2.29 2.88 0.17 -4.63 113.62 112.64 1hhv n SER 29 Ca 0.04 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1hhv n SER 29 Cb 0.59 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 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 -2.26 0.00 -3.57 -3.46 3.41 -0.88 -4.64 113.62 102.22 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 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.02 -0.39 -0.16 7.33 1.48 -1.14 0.08 118.94 125.12 1hhv s TRP 31 Ca 0.00 0.10 -0.14 0.00 -1.06 0.00 0.00 56.10 55.00 1hhv s TRP 31 Cb 0.00 0.54 0.05 0.00 -1.16 0.00 0.00 33.47 32.90 1hhv s TRP 31 CO 0.00 -0.93 0.43 1.52 -4.06 0.00 0.00 176.95 173.91 1hhv s TYR 32 N -3.81 -0.51 0.58 1.66 -0.85 0.22 0.27 117.35 114.92 1hhv s TYR 32 Ca 0.04 1.19 -0.19 0.00 -0.52 0.00 0.00 57.07 57.60 1hhv s TYR 32 Cb -0.02 0.19 -0.04 0.00 0.38 0.00 0.00 41.96 42.47 1hhv s TYR 32 CO -0.08 -0.26 1.14 -1.25 -1.52 0.00 0.00 175.55 173.59 1hhv s PRO 33 N 0.52 3.16 0.00 -3.49 0.04 -1.26 -2.15 135.00 131.82 1hhv s PRO 33 Ca -0.02 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.64 1hhv s PRO 33 Cb -0.04 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1hhv s PRO 33 CO -0.03 -1.01 0.00 0.25 0.04 0.00 0.00 177.00 176.25 1hhv n THR 34 N -1.57 0.00 -4.41 1.26 -2.24 -0.86 -4.91 114.28 101.56 1hhv n THR 34 Ca 0.12 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.70 1hhv n THR 34 Cb 0.51 -0.53 -0.10 0.00 -2.10 0.00 0.00 70.33 68.11 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 -0.15 2.17 0.00 3.42 0.15 -1.26 -4.75 113.70 113.29 1hhv s SER 35 Ca 0.00 -1.32 0.21 0.00 0.70 0.00 0.00 55.95 55.53 1hhv s SER 35 Cb 0.00 -0.05 0.95 0.00 -1.71 0.00 0.00 66.02 65.21 1hhv s SER 35 CO 0.00 -0.57 1.66 1.67 1.20 0.00 0.00 173.24 177.20 1hhv n GLN 36 N -0.59 0.14 -0.32 5.44 -0.06 -1.26 -3.62 117.38 117.10 1hhv n GLN 36 Ca -0.03 0.12 0.20 0.00 -2.00 0.00 0.00 57.00 55.30 1hhv n GLN 36 Cb 0.66 -1.50 0.41 0.00 -4.06 0.00 0.00 30.24 25.75 1hhv n GLN 36 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 1hhv h LEU 37 N 0.00 0.27 0.00 1.69 6.46 -2.00 -3.40 115.31 118.33 1hhv h LEU 37 Ca 0.00 0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.96 1hhv h LEU 37 Cb 0.28 0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1hhv h LEU 37 CO 0.00 -0.18 0.00 0.00 -0.62 0.00 0.00 178.44 177.64 1hhv n SER 39 N -0.16 0.28 -3.53 0.00 7.64 -1.26 -4.75 113.62 111.84 1hhv n SER 39 Ca 0.00 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.60 1hhv n SER 39 Cb 0.00 1.89 -0.11 0.00 -1.01 0.00 0.00 64.21 64.98 1hhv n SER 39 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1hhv s LYS 40 N -3.38 1.08 0.75 1.43 1.02 -1.26 -5.12 119.74 114.27 1hhv s LYS 40 Ca -0.08 -2.05 -0.11 0.00 0.02 0.00 0.00 55.97 53.75 1hhv s LYS 40 Cb 0.13 -1.81 0.04 0.00 -0.52 0.00 0.00 37.83 35.67 1hhv s LYS 40 CO 0.85 -1.29 1.08 -1.25 -0.92 0.00 0.00 175.35 173.82 1hhv s PRO 41 N 0.18 2.44 0.00 -1.68 0.04 -1.26 -4.83 135.00 129.88 1hhv s PRO 41 Ca 0.25 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.30 1hhv s PRO 41 Cb -0.09 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1hhv s PRO 41 CO -0.11 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 175.88 1hhv n GLY 42 N -1.61 -0.52 3.26 0.56 0.00 -1.26 -5.03 105.19 100.59 1hhv n GLY 42 Ca 0.08 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.41 1.83 -0.04 1.61 1.01 -0.98 -2.03 120.40 119.39 1hhv s VAL 43 Ca 0.00 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.06 1hhv s VAL 43 Cb 0.00 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1hhv s VAL 43 CO 0.00 0.52 -0.24 -0.51 0.00 0.00 0.00 175.10 174.87 1hhv s ILE 44 N -0.53 2.21 -0.02 2.22 -1.16 -0.91 -0.20 121.20 122.79 1hhv s ILE 44 Ca 0.09 -1.03 0.01 0.00 -0.51 0.00 0.00 60.65 59.20 1hhv s ILE 44 Cb -0.09 -1.79 -0.03 0.00 0.61 0.00 0.00 42.46 41.15 1hhv s ILE 44 CO -0.01 0.58 -0.02 -0.36 -2.81 0.00 0.00 174.94 172.31 1hhv s PHE 45 N -0.44 3.03 -0.21 3.50 0.08 0.39 -0.61 117.98 123.72 1hhv s PHE 45 Ca 0.05 0.07 -0.05 0.00 0.12 0.00 0.00 56.93 57.12 1hhv s PHE 45 Cb -0.12 -1.68 -0.02 0.00 -0.57 0.00 0.00 43.02 40.63 1hhv s PHE 45 CO 0.01 0.43 -0.01 -0.51 -0.10 0.00 0.00 175.22 175.03 1hhv s LEU 46 N -1.31 3.13 0.00 -0.37 2.01 0.11 0.23 118.68 122.49 1hhv s LEU 46 Ca 0.17 -0.27 0.00 0.00 0.01 0.00 0.00 54.13 54.04 1hhv s LEU 46 Cb -0.11 -1.80 0.00 0.00 0.01 0.00 0.00 46.19 44.29 1hhv s LEU 46 CO 0.07 0.03 0.00 0.35 1.01 0.00 0.00 176.35 177.81 1hhv n THR 47 N 4.46 0.00 0.12 5.49 -2.24 0.07 0.46 114.28 122.64 1hhv n THR 47 Ca -0.17 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.64 1hhv n THR 47 Cb 0.51 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.79 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 1.02 0.00 -0.78 4.76 -1.25 -1.50 118.16 120.42 1hhv n LYS 48 Ca 0.00 -1.23 0.00 0.00 -2.87 0.00 0.00 58.31 54.21 1hhv n LYS 48 Cb 0.00 -1.13 0.00 0.00 -1.84 0.00 0.00 35.03 32.06 1hhv n LYS 48 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1hhv n ARG 49 N 0.24 0.00 -0.73 1.97 1.74 -1.26 -5.00 116.66 113.63 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 -0.15 -0.02 0.00 -1.02 0.00 0.00 32.46 31.50 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 2.80 -0.21 3.41 -0.13 0.00 -1.26 -5.15 105.19 104.66 1hhv n GLY 50 Ca 0.00 -0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 1.49 0.34 1.61 3.52 -1.26 -5.01 118.95 119.64 1hhv s ARG 51 Ca 0.00 -1.41 0.08 0.00 -0.13 0.00 0.00 55.73 54.28 1hhv s ARG 51 Cb 0.01 -1.90 -0.05 0.00 -1.56 0.00 0.00 34.95 31.46 1hhv s ARG 51 CO -0.00 0.43 0.10 -0.65 -0.81 0.00 0.00 175.30 174.37 1hhv s GLN 52 N -2.33 2.27 0.08 5.12 -0.21 -1.26 -0.75 119.66 122.58 1hhv s GLN 52 Ca 0.17 -1.63 -0.05 0.00 0.02 0.00 0.00 55.36 53.88 1hhv s GLN 52 Cb -0.09 -2.09 -0.02 0.00 1.00 0.00 0.00 33.01 31.81 1hhv s GLN 52 CO 0.08 0.11 0.10 0.08 -2.12 0.00 0.00 175.29 173.54 1hhv s VAL 53 N -2.46 0.17 -0.06 1.09 1.01 0.64 -4.89 120.40 115.89 1hhv s VAL 53 Ca 0.37 -1.49 -0.02 0.00 0.00 0.00 0.00 61.98 60.83 1hhv s VAL 53 Cb -0.01 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 34.92 1hhv s VAL 53 CO 0.22 -0.77 0.11 0.00 0.00 0.00 0.00 175.10 174.66 1hhv s ALA 55 N 2.07 0.86 -0.33 0.00 0.00 0.72 0.29 121.76 125.38 1hhv s ALA 55 Ca 0.02 -1.51 -0.21 0.00 0.00 0.00 0.00 51.96 50.26 1hhv s ALA 55 Cb -0.12 1.28 -0.00 0.00 0.00 0.00 0.00 23.12 24.27 1hhv s ALA 55 CO -0.04 -0.63 0.68 0.34 0.00 0.00 0.00 175.76 176.11 1hhv s ASP 56 N -3.12 6.50 0.55 0.00 -1.08 -1.26 -2.33 116.67 115.93 1hhv s ASP 56 Ca 0.34 0.35 0.45 0.00 -0.52 0.00 0.00 52.55 53.17 1hhv s ASP 56 Cb 0.06 -2.35 1.53 0.00 -1.46 0.00 0.00 42.92 40.69 1hhv s ASP 56 CO 0.10 -0.58 1.46 0.29 0.52 0.00 0.00 175.17 176.97 1hhv n LYS 57 N 6.07 0.00 -0.30 4.34 5.02 -1.26 0.11 118.16 132.14 1hhv n LYS 57 Ca 0.00 1.04 0.05 0.00 -2.02 0.00 0.00 58.31 57.38 1hhv n LYS 57 Cb 0.49 -2.43 0.26 0.00 -0.02 0.00 0.00 35.03 33.32 1hhv n LYS 57 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1hhv h SER 58 N 0.00 0.87 -1.37 4.39 4.64 -1.97 -3.24 113.55 116.86 1hhv h SER 58 Ca 0.83 0.01 -0.75 0.00 -0.47 0.00 0.00 61.79 61.41 1hhv h SER 58 Cb 3.52 -0.17 0.01 0.00 -0.31 0.00 0.00 62.40 65.45 1hhv h SER 58 CO -0.01 0.54 0.94 0.29 -0.87 0.00 0.00 176.83 177.72 1hhv n LYS 59 N -4.51 0.95 -0.11 4.77 4.76 0.31 -4.74 118.16 119.60 1hhv n LYS 59 Ca 0.14 0.34 -0.08 0.00 -2.87 0.00 0.00 58.31 55.84 1hhv n LYS 59 Cb 0.24 -2.03 -0.02 0.00 -1.84 0.00 0.00 35.03 31.38 1hhv n LYS 59 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 1hhv h ASP 60 N 7.44 -1.14 -0.98 4.39 3.32 -1.88 0.30 116.42 127.87 1hhv h ASP 60 Ca -0.43 0.19 0.10 0.00 0.02 0.00 0.00 57.03 56.91 1hhv h ASP 60 Cb 1.33 0.52 -0.07 0.00 0.22 0.00 0.00 39.33 41.33 1hhv h ASP 60 CO 0.98 -0.33 0.62 4.11 -1.72 0.00 0.00 179.24 182.90 1hhv h TRP 61 N -0.28 1.11 0.16 4.55 5.08 -1.93 -2.06 115.95 122.58 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 0.55 -0.36 0.00 0.00 -3.00 0.00 0.00 29.16 26.35 1hhv h TRP 61 CO -0.54 0.50 -0.08 0.28 -1.28 0.00 0.00 178.44 177.33 1hhv h VAL 62 N 1.03 0.94 -0.80 0.12 2.07 -1.12 -2.62 116.25 115.86 1hhv h VAL 62 Ca 0.46 -0.47 0.15 0.00 0.82 0.00 0.00 66.70 67.65 1hhv h VAL 62 Cb 0.37 1.23 -0.15 0.00 -1.52 0.00 0.00 31.29 31.22 1hhv h VAL 62 CO -0.21 0.11 -0.29 0.50 0.02 0.00 0.00 177.57 177.70 1hhv h LYS 63 N -0.44 -0.05 -0.89 1.57 3.64 0.16 1.56 116.57 122.13 1hhv h LYS 63 Ca -0.02 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.47 1hhv h LYS 63 Cb 0.34 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.11 1hhv h LYS 63 CO 0.04 -0.03 0.57 1.57 -2.27 0.00 0.00 179.45 179.33 1hhv h LYS 64 N -0.05 0.79 -0.40 1.90 2.10 -1.33 0.46 116.57 120.04 1hhv h LYS 64 Ca 0.34 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.94 1hhv h LYS 64 Cb 0.59 -0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 1hhv h LYS 64 CO -0.83 0.52 0.00 1.28 -2.00 0.00 0.00 179.45 178.42 1hhv n LEU 65 N -4.54 0.32 0.00 7.07 4.77 0.53 -1.05 117.00 124.09 1hhv n LEU 65 Ca 0.16 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1hhv n LEU 65 Cb 0.36 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1hhv n LEU 65 CO 0.30 0.07 0.00 1.67 -1.33 0.00 0.00 177.39 178.11 1hhv n GLN 67 N 0.41 0.00 -0.02 3.23 -0.06 0.16 0.67 117.38 121.78 1hhv n GLN 67 Ca 0.00 0.00 -0.11 0.00 -2.00 0.00 0.00 57.00 54.89 1hhv n GLN 67 Cb 0.07 0.00 -0.14 0.00 -4.06 0.00 0.00 30.24 26.11 1hhv n GLN 67 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 1hhv n GLN 68 N 0.00 0.65 -2.36 3.69 3.00 -0.22 -4.91 117.38 117.24 1hhv n GLN 68 Ca 0.00 0.29 -0.32 0.00 -0.01 0.00 0.00 57.00 56.96 1hhv n GLN 68 Cb 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 30.24 28.43 1hhv n GLN 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1hhv s LEU 69 N -6.26 3.60 -0.23 1.08 1.43 0.21 -5.02 118.68 113.50 1hhv s LEU 69 Ca -0.08 1.57 -0.24 0.00 -1.03 0.00 0.00 54.13 54.35 1hhv s LEU 69 Cb 0.08 -4.51 -0.01 0.00 0.03 0.00 0.00 46.19 41.78 1hhv s LEU 69 CO 0.82 -0.62 0.81 -2.16 0.23 0.00 0.00 176.35 175.43 1hhv s PRO 70 N -4.12 4.20 -0.49 1.29 0.04 -1.26 -4.84 135.00 129.82 1hhv s PRO 70 Ca 0.59 0.91 -0.29 0.00 0.04 0.00 0.00 61.00 62.25 1hhv s PRO 70 Cb -0.10 -3.63 -0.31 0.00 0.04 0.00 0.00 34.50 30.50 1hhv s PRO 70 CO 0.32 -0.46 1.82 1.55 0.04 0.00 0.00 177.00 180.27 1hhv n VAL 71 N 5.13 0.00 -0.96 -0.36 3.14 -1.24 -2.90 118.33 121.14 1hhv n VAL 71 Ca 0.05 -0.01 -0.34 0.00 -2.96 0.00 0.00 64.34 61.08 1hhv n VAL 71 Cb 0.48 -1.98 0.03 0.00 -1.06 0.00 0.00 33.84 31.31 1hhv n VAL 71 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1hhv n THR 72 N 7.93 0.00 -4.47 1.55 -1.04 0.78 -4.78 114.28 114.25 1hhv n THR 72 Ca 0.44 -0.46 -0.24 0.00 -2.04 0.00 0.00 64.05 61.75 1hhv n THR 72 Cb 0.44 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.88 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 -2.15 0.55 0.11 2.41 0.00 -1.26 -4.39 120.51 115.77 1hhv n ALA 73 Ca -0.00 -1.97 0.01 0.00 0.00 0.00 0.00 53.44 51.48 1hhv n ALA 73 Cb 0.50 1.33 0.01 0.00 0.00 0.00 0.00 19.45 21.29 1hhv n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37