#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 1.02 -4.84 1.61 2.03 -1.26 -5.10 116.55 110.01 1hhv n ASP 2 Ca 0.00 -2.38 -0.36 0.00 0.52 0.00 0.00 54.79 52.57 1hhv n ASP 2 Cb 0.00 -0.30 -0.06 0.00 -0.72 0.00 0.00 41.12 40.04 1hhv n ASP 2 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1hhv s THR 3 N -2.91 4.87 0.36 5.18 -4.23 -1.26 -5.05 115.64 112.62 1hhv s THR 3 Ca 0.25 0.87 -0.27 0.00 -1.18 0.00 0.00 61.69 61.37 1hhv s THR 3 Cb 0.40 -3.76 -0.09 0.00 1.34 0.00 0.00 72.50 70.39 1hhv s THR 3 CO -0.01 0.34 1.21 -0.76 -0.54 0.00 0.00 174.62 174.86 1hhv s LEU 4 N -1.69 4.31 -0.63 4.79 2.01 -1.26 -4.98 118.68 121.22 1hhv s LEU 4 Ca 0.34 2.45 -0.11 0.00 0.01 0.00 0.00 54.13 56.82 1hhv s LEU 4 Cb -0.16 -3.86 0.16 0.00 0.01 0.00 0.00 46.19 42.35 1hhv s LEU 4 CO 0.18 -0.57 0.53 -0.83 1.01 0.00 0.00 176.35 176.67 1hhv s GLY 5 N -0.89 2.35 -0.32 -3.19 0.00 -1.26 -4.79 107.32 99.22 1hhv s GLY 5 Ca 0.53 -2.95 -0.14 0.00 0.00 0.00 0.00 44.72 42.16 1hhv s GLY 5 CO 0.44 1.17 0.33 0.00 0.00 0.00 0.00 173.10 175.04 1hhv n ALA 6 N 4.37 -2.77 -0.21 3.20 0.00 -1.26 -4.94 120.51 118.90 1hhv n ALA 6 Ca 0.01 0.57 0.00 0.00 0.00 0.00 0.00 53.44 54.02 1hhv n ALA 6 Cb 0.42 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 0.32 1.06 -0.72 0.00 2.88 -1.26 -5.06 113.62 110.84 1hhv n SER 7 Ca 0.02 -1.27 0.00 0.00 -1.33 0.00 0.00 58.87 56.29 1hhv n SER 7 Cb 0.40 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 1hhv n SER 7 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1hhv n TRP 8 N -0.13 0.00 -3.65 0.66 7.02 -1.26 -5.17 117.44 114.91 1hhv n TRP 8 Ca 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.46 1hhv n TRP 8 Cb 0.14 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 28.96 1hhv n TRP 8 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 1hhv s HIS 9 N -0.35 -0.08 -0.04 -5.99 2.46 -1.26 -5.16 115.29 104.87 1hhv s HIS 9 Ca 0.00 0.19 0.04 0.00 0.47 0.00 0.00 55.06 55.76 1hhv s HIS 9 Cb 0.00 0.39 0.00 0.00 -0.13 0.00 0.00 32.58 32.84 1hhv s HIS 9 CO 0.00 -0.04 -0.14 1.03 -2.47 0.00 0.00 174.74 173.12 1hhv s ARG 10 N 0.24 1.52 -0.22 2.88 1.81 -1.26 -5.10 118.95 118.83 1hhv s ARG 10 Ca 0.04 -0.50 -0.29 0.00 -1.72 0.00 0.00 55.73 53.26 1hhv s ARG 10 Cb -0.04 -1.34 -0.01 0.00 -0.45 0.00 0.00 34.95 33.11 1hhv s ARG 10 CO -0.14 0.18 1.37 -1.25 -0.68 0.00 0.00 175.30 174.78 1hhv s PRO 11 N 0.15 4.02 -0.06 3.54 0.04 -1.26 -4.88 135.00 136.55 1hhv s PRO 11 Ca -0.05 1.54 0.15 0.00 0.04 0.00 0.00 61.00 62.68 1hhv s PRO 11 Cb -0.11 -3.88 0.50 0.00 0.04 0.00 0.00 34.50 31.05 1hhv s PRO 11 CO 0.02 -0.99 1.42 -0.40 0.04 0.00 0.00 177.00 177.08 1hhv n ASP 12 N 7.40 3.69 -4.34 6.66 5.68 -1.26 -5.02 116.55 129.36 1hhv n ASP 12 Ca 0.15 -2.28 -0.39 0.00 -0.50 0.00 0.00 54.79 51.78 1hhv n ASP 12 Cb 0.45 -0.41 0.02 0.00 -1.14 0.00 0.00 41.12 40.05 1hhv n ASP 12 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1hhv n LYS 13 N 0.66 0.21 -0.05 0.11 2.85 -1.26 -4.91 118.16 115.77 1hhv n LYS 13 Ca 0.19 0.08 -0.04 0.00 -1.05 0.00 0.00 58.31 57.48 1hhv n LYS 13 Cb 0.65 -1.29 -0.09 0.00 -0.65 0.00 0.00 35.03 33.64 1hhv n LYS 13 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1hhv n LEU 16 N -0.55 1.39 0.00 0.00 4.32 -1.26 -4.94 117.00 115.95 1hhv n LEU 16 Ca -0.06 -0.69 0.00 0.00 -0.02 0.00 0.00 56.01 55.24 1hhv n LEU 16 Cb 0.61 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.94 1hhv n LEU 16 CO 0.14 0.29 0.00 0.61 -1.22 0.00 0.00 177.39 177.21 1hhv n GLY 17 N 0.15 4.12 2.97 -0.72 0.00 -1.26 -4.30 105.19 106.15 1hhv n GLY 17 Ca 0.00 0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 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 1.67 -0.03 1.61 2.02 -1.18 -3.92 117.35 117.51 1hhv s TYR 18 Ca 0.00 -0.81 -0.39 0.00 -0.37 0.00 0.00 57.07 55.50 1hhv s TYR 18 Cb 0.00 -1.29 -0.17 0.00 -0.40 0.00 0.00 41.96 40.09 1hhv s TYR 18 CO 0.00 -0.49 1.37 0.94 -1.57 0.00 0.00 175.55 175.80 1hhv n GLN 19 N 4.58 0.81 -0.03 -0.62 -0.06 0.75 -4.87 117.38 117.95 1hhv n GLN 19 Ca -0.16 0.29 -0.22 0.00 -2.00 0.00 0.00 57.00 54.92 1hhv n GLN 19 Cb 0.51 -1.90 -0.13 0.00 -4.06 0.00 0.00 30.24 24.65 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 2.87 0.70 -2.04 3.69 4.81 -1.26 -4.89 118.16 122.04 1hhv n LYS 20 Ca 0.21 0.33 -0.30 0.00 -0.87 0.00 0.00 58.31 57.68 1hhv n LYS 20 Cb 0.14 -1.70 0.02 0.00 0.02 0.00 0.00 35.03 33.51 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 -2.51 3.41 0.25 1.64 0.52 -1.26 -5.01 118.95 115.99 1hhv s ARG 21 Ca -0.25 0.55 -0.30 0.00 -0.52 0.00 0.00 55.73 55.21 1hhv s ARG 21 Cb 0.07 -2.13 -0.09 0.00 0.52 0.00 0.00 34.95 33.31 1hhv s ARG 21 CO 0.71 -0.60 1.21 -1.25 0.02 0.00 0.00 175.30 175.39 1hhv s PRO 22 N -5.12 4.49 -0.07 3.54 0.04 -1.26 -5.03 135.00 131.59 1hhv s PRO 22 Ca 0.54 1.95 0.03 0.00 0.04 0.00 0.00 61.00 63.56 1hhv s PRO 22 Cb -0.11 -3.18 0.01 0.00 0.04 0.00 0.00 34.50 31.26 1hhv s PRO 22 CO 0.51 -0.05 -0.15 -0.51 0.04 0.00 0.00 177.00 176.85 1hhv s LEU 23 N -0.89 1.75 1.09 -3.56 1.43 -1.26 -5.14 118.68 112.11 1hhv s LEU 23 Ca 0.50 -0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 53.06 1hhv s LEU 23 Cb -0.35 -0.96 0.26 0.00 0.03 0.00 0.00 46.19 45.18 1hhv s LEU 23 CO 0.41 0.07 1.26 -2.16 0.23 0.00 0.00 176.35 176.17 1hhv s PRO 24 N 0.57 -0.41 -0.01 1.29 0.04 -1.26 -4.85 135.00 130.36 1hhv s PRO 24 Ca -0.15 -0.41 0.01 0.00 0.04 0.00 0.00 61.00 60.49 1hhv s PRO 24 Cb -0.16 -1.72 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 1hhv s PRO 24 CO 0.05 -3.12 -0.00 0.94 0.04 0.00 0.00 177.00 174.91 1hhv n GLN 25 N -4.26 2.80 0.00 4.56 0.00 -1.26 -4.52 117.38 114.70 1hhv n GLN 25 Ca 0.16 0.00 0.05 0.00 -0.00 0.00 0.00 57.00 57.22 1hhv n GLN 25 Cb 0.59 -1.03 0.25 0.00 0.00 0.00 0.00 30.24 30.06 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 -2.18 0.87 -0.03 1.69 0.31 -1.26 -1.90 118.33 115.82 1hhv n VAL 26 Ca -0.02 0.22 0.05 0.00 -0.01 0.00 0.00 64.34 64.58 1hhv n VAL 26 Cb 0.53 -1.04 -0.15 0.00 -0.91 0.00 0.00 33.84 32.27 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 -1.33 0.00 -4.99 7.52 -0.00 -1.26 -4.98 117.00 111.97 1hhv n LEU 27 Ca 0.04 0.00 -0.19 0.00 -0.00 0.00 0.00 56.01 55.86 1hhv n LEU 27 Cb 0.09 0.11 0.00 0.00 -0.00 0.00 0.00 43.42 43.63 1hhv n LEU 27 CO 0.08 0.11 0.12 -0.76 -0.00 0.00 0.00 177.39 176.94 1hhv s LEU 28 N -4.61 3.85 0.00 -1.96 1.43 -0.80 -4.02 118.68 112.57 1hhv s LEU 28 Ca -0.08 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 1hhv s LEU 28 Cb 0.11 -2.81 0.00 0.00 0.03 0.00 0.00 46.19 43.52 1hhv s LEU 28 CO 0.80 -0.55 0.00 -1.54 0.23 0.00 0.00 176.35 175.29 1hhv n SER 29 N -1.76 0.00 0.00 2.29 3.41 0.40 -4.70 113.62 113.25 1hhv n SER 29 Ca 0.02 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1hhv n SER 29 Cb 0.58 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1hhv n SER 29 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1hhv n SER 30 N -2.33 0.00 -2.46 4.04 3.41 -0.86 -4.56 113.62 110.86 1hhv n SER 30 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 1hhv n SER 30 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1hhv n SER 30 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1hhv n TRP 31 N 0.00 -1.92 -3.64 7.33 4.27 -1.08 0.29 117.44 122.68 1hhv n TRP 31 Ca 0.00 -1.58 -0.07 0.00 -3.89 0.00 0.00 57.50 51.96 1hhv n TRP 31 Cb 0.00 0.68 -0.07 0.00 -1.36 0.00 0.00 31.31 30.56 1hhv n TRP 31 CO 0.00 0.00 0.00 1.52 -2.29 0.00 0.00 177.69 176.92 1hhv s TYR 32 N -3.50 -0.44 0.71 -2.67 -0.85 0.16 0.37 117.35 111.12 1hhv s TYR 32 Ca 0.15 1.03 -0.14 0.00 -0.52 0.00 0.00 57.07 57.59 1hhv s TYR 32 Cb -0.03 0.37 0.03 0.00 0.38 0.00 0.00 41.96 42.70 1hhv s TYR 32 CO 0.11 -0.21 1.14 -1.25 -1.52 0.00 0.00 175.55 173.81 1hhv s PRO 33 N 0.42 2.45 0.00 -3.49 0.04 -1.26 -1.89 135.00 131.27 1hhv s PRO 33 Ca 0.01 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.53 1hhv s PRO 33 Cb -0.05 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1hhv s PRO 33 CO -0.09 -1.53 0.00 0.25 0.04 0.00 0.00 177.00 175.67 1hhv n THR 34 N -2.73 0.00 -4.27 1.26 -2.24 -0.48 -4.87 114.28 100.94 1hhv n THR 34 Ca 0.11 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.74 1hhv n THR 34 Cb 0.52 -0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 68.12 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 -0.87 1.76 0.34 3.42 0.15 -1.26 -4.63 113.70 112.61 1hhv s SER 35 Ca 0.00 -1.09 0.26 0.00 0.70 0.00 0.00 55.95 55.82 1hhv s SER 35 Cb 0.00 0.00 1.15 0.00 -1.71 0.00 0.00 66.02 65.47 1hhv s SER 35 CO 0.00 -0.40 1.78 1.56 1.20 0.00 0.00 173.24 177.38 1hhv h GLN 36 N 2.68 0.00 -1.40 5.44 4.20 -1.95 -3.12 115.11 120.97 1hhv h GLN 36 Ca -0.37 0.00 0.41 0.00 0.06 0.00 0.00 58.65 58.74 1hhv h GLN 36 Cb 1.20 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.93 1hhv h GLN 36 CO 0.64 0.00 1.16 1.25 -0.67 0.00 0.00 178.83 181.21 1hhv h LEU 37 N 0.00 0.00 0.00 1.46 5.85 -1.98 -3.39 115.31 117.25 1hhv h LEU 37 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1hhv h LEU 37 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1hhv h LEU 37 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 1hhv h SER 39 N 0.00 -0.65 -3.58 0.00 0.87 -1.88 -3.44 113.55 104.86 1hhv h SER 39 Ca 0.00 0.03 -0.32 0.00 -1.23 0.00 0.00 61.79 60.27 1hhv h SER 39 Cb 0.00 0.18 -0.32 0.00 -0.44 0.00 0.00 62.40 61.81 1hhv h SER 39 CO 0.00 -0.44 -0.74 -0.75 -0.53 0.00 0.00 176.83 174.37 1hhv s LYS 40 N -4.61 0.23 1.22 2.24 2.47 -1.26 -5.01 119.74 115.01 1hhv s LYS 40 Ca -0.11 0.05 -0.20 0.00 -1.56 0.00 0.00 55.97 54.15 1hhv s LYS 40 Cb 0.01 -0.37 0.30 0.00 -1.46 0.00 0.00 37.83 36.31 1hhv s LYS 40 CO 0.33 -0.09 1.13 -1.25 0.16 0.00 0.00 175.35 175.63 1hhv s PRO 41 N 0.74 -1.36 0.00 4.03 0.04 -1.26 -4.94 135.00 132.25 1hhv s PRO 41 Ca -0.07 -0.21 0.00 0.00 0.04 0.00 0.00 61.00 60.76 1hhv s PRO 41 Cb -0.10 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.84 1hhv s PRO 41 CO -0.01 -3.78 0.00 0.41 0.04 0.00 0.00 177.00 173.66 1hhv n GLY 42 N -1.19 -0.32 3.22 0.56 0.00 -1.26 -4.99 105.19 101.21 1hhv n GLY 42 Ca 0.15 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 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 -3.60 1.90 -0.06 1.61 1.01 -0.95 -1.38 120.40 118.92 1hhv s VAL 43 Ca 0.00 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.04 1hhv s VAL 43 Cb 0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 1hhv s VAL 43 CO 0.00 0.53 -0.13 -0.51 0.00 0.00 0.00 175.10 174.99 1hhv s ILE 44 N 0.03 3.17 -0.08 2.22 -1.16 -0.79 0.14 121.20 124.72 1hhv s ILE 44 Ca -0.08 -0.67 -0.01 0.00 -0.51 0.00 0.00 60.65 59.38 1hhv s ILE 44 Cb -0.14 -2.26 -0.03 0.00 0.61 0.00 0.00 42.46 40.63 1hhv s ILE 44 CO 0.05 0.58 -0.04 -0.36 -2.81 0.00 0.00 174.94 172.36 1hhv s PHE 45 N -0.59 3.02 -0.18 3.50 0.08 0.32 -0.66 117.98 123.47 1hhv s PHE 45 Ca 0.09 0.05 -0.04 0.00 0.12 0.00 0.00 56.93 57.14 1hhv s PHE 45 Cb -0.11 -1.76 -0.02 0.00 -0.57 0.00 0.00 43.02 40.55 1hhv s PHE 45 CO 0.01 0.34 -0.03 -0.51 -0.10 0.00 0.00 175.22 174.94 1hhv s LEU 46 N -0.71 3.20 0.00 -0.37 2.01 0.14 0.12 118.68 123.07 1hhv s LEU 46 Ca 0.11 -0.20 0.00 0.00 0.01 0.00 0.00 54.13 54.05 1hhv s LEU 46 Cb -0.11 -1.79 0.00 0.00 0.01 0.00 0.00 46.19 44.30 1hhv s LEU 46 CO 0.02 0.10 0.00 0.35 1.01 0.00 0.00 176.35 177.83 1hhv n THR 47 N 3.97 0.00 -0.63 5.49 -2.24 0.25 -0.45 114.28 120.66 1hhv n THR 47 Ca -0.17 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 1hhv n THR 47 Cb 0.52 -0.07 0.20 0.00 -2.10 0.00 0.00 70.33 68.88 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 2.81 0.00 -0.78 5.02 -1.26 -1.88 118.16 122.07 1hhv n LYS 48 Ca 0.00 -2.45 0.00 0.00 -2.02 0.00 0.00 58.31 53.84 1hhv n LYS 48 Cb 0.00 -1.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 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 -0.19 0.00 -0.55 1.97 1.74 -1.26 -5.01 116.66 113.37 1hhv n ARG 49 Ca 0.16 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.23 1hhv n ARG 49 Cb 0.66 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 32.09 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 2.36 0.83 3.66 -0.13 0.00 -1.26 -5.11 105.19 105.53 1hhv n GLY 50 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1hhv n GLY 50 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hhv s ARG 51 N 0.00 3.98 0.17 1.61 3.00 -1.26 -4.98 118.95 121.47 1hhv s ARG 51 Ca 0.00 -0.32 0.07 0.00 0.00 0.00 0.00 55.73 55.48 1hhv s ARG 51 Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 34.95 31.67 1hhv s ARG 51 CO 0.00 0.30 0.04 -0.65 0.00 0.00 0.00 175.30 174.99 1hhv s GLN 52 N 0.30 2.54 0.13 3.54 -0.21 -1.26 -0.58 119.66 124.12 1hhv s GLN 52 Ca 0.04 -1.04 0.01 0.00 0.02 0.00 0.00 55.36 54.39 1hhv s GLN 52 Cb -0.12 -2.44 -0.04 0.00 1.00 0.00 0.00 33.01 31.41 1hhv s GLN 52 CO -0.00 0.46 -0.01 0.08 -2.12 0.00 0.00 175.29 173.70 1hhv s VAL 53 N -1.74 0.49 -0.07 1.09 1.01 0.33 -4.91 120.40 116.60 1hhv s VAL 53 Ca 0.28 -1.93 -0.03 0.00 0.00 0.00 0.00 61.98 60.31 1hhv s VAL 53 Cb -0.09 -1.91 0.04 0.00 0.00 0.00 0.00 36.38 34.41 1hhv s VAL 53 CO 0.20 -0.65 0.08 0.00 0.00 0.00 0.00 175.10 174.73 1hhv s ALA 55 N 2.18 1.07 -0.04 0.00 0.00 0.12 0.27 121.76 125.36 1hhv s ALA 55 Ca 0.04 -1.49 -0.27 0.00 0.00 0.00 0.00 51.96 50.24 1hhv s ALA 55 Cb -0.13 0.60 -0.03 0.00 0.00 0.00 0.00 23.12 23.56 1hhv s ALA 55 CO -0.05 -0.37 0.84 0.34 0.00 0.00 0.00 175.76 176.52 1hhv s ASP 56 N -3.09 7.17 0.26 0.00 2.15 -1.26 -2.23 116.67 119.66 1hhv s ASP 56 Ca 0.21 1.41 0.16 0.00 0.43 0.00 0.00 52.55 54.76 1hhv s ASP 56 Cb 0.07 -2.49 0.85 0.00 -0.30 0.00 0.00 42.92 41.05 1hhv s ASP 56 CO 0.01 -0.20 1.45 0.29 -0.17 0.00 0.00 175.17 176.55 1hhv n LYS 57 N 3.91 0.10 -0.02 4.34 5.02 -1.26 -1.39 118.16 128.86 1hhv n LYS 57 Ca 0.02 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 1hhv n LYS 57 Cb 0.51 -1.91 0.01 0.00 -0.02 0.00 0.00 35.03 33.62 1hhv n LYS 57 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1hhv n SER 58 N -2.06 1.02 -4.40 4.39 3.41 -1.26 -4.19 113.62 110.54 1hhv n SER 58 Ca -0.01 -2.02 -0.36 0.00 -0.26 0.00 0.00 58.87 56.21 1hhv n SER 58 Cb 0.10 -0.46 -0.13 0.00 -0.26 0.00 0.00 64.21 63.46 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 -1.13 3.47 0.16 4.33 -0.14 -0.49 -5.00 119.74 120.94 1hhv s LYS 59 Ca 0.01 -0.60 -0.29 0.00 -1.36 0.00 0.00 55.97 53.74 1hhv s LYS 59 Cb 0.01 -3.28 -0.04 0.00 -1.68 0.00 0.00 37.83 32.84 1hhv s LYS 59 CO 0.00 -0.25 1.49 -0.25 -0.76 0.00 0.00 175.35 175.58 1hhv n ASP 60 N 4.89 -0.99 -0.32 2.83 8.00 -1.26 0.36 116.55 130.05 1hhv n ASP 60 Ca -0.16 1.72 0.04 0.00 0.71 0.00 0.00 54.79 57.10 1hhv n ASP 60 Cb 0.50 -0.23 0.18 0.00 -0.02 0.00 0.00 41.12 41.55 1hhv n ASP 60 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 1hhv h TRP 61 N 0.00 0.96 0.30 1.24 5.08 -1.95 -2.40 115.95 119.17 1hhv h TRP 61 Ca 0.17 0.03 -0.01 0.00 1.08 0.00 0.00 58.89 60.15 1hhv h TRP 61 Cb 0.41 -0.30 0.00 0.00 -3.00 0.00 0.00 29.16 26.28 1hhv h TRP 61 CO -0.98 0.40 -0.14 0.28 -1.28 0.00 0.00 178.44 176.71 1hhv h VAL 62 N 0.88 0.74 -0.82 0.12 2.07 -0.42 -2.56 116.25 116.26 1hhv h VAL 62 Ca 0.42 -0.43 0.16 0.00 0.82 0.00 0.00 66.70 67.68 1hhv h VAL 62 Cb 0.37 0.97 -0.15 0.00 -1.52 0.00 0.00 31.29 30.96 1hhv h VAL 62 CO -0.24 0.09 -0.23 0.50 0.02 0.00 0.00 177.57 177.70 1hhv h LYS 63 N -0.63 -0.02 -0.92 1.57 3.64 0.03 1.38 116.57 121.61 1hhv h LYS 63 Ca -0.04 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.43 1hhv h LYS 63 Cb 0.45 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1hhv h LYS 63 CO 0.07 -0.01 0.60 -0.22 -2.27 0.00 0.00 179.45 177.61 1hhv h LYS 64 N -0.02 0.93 -0.98 1.90 3.64 -1.33 -0.90 116.57 119.82 1hhv h LYS 64 Ca 0.38 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 1hhv h LYS 64 Cb 0.60 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1hhv h LYS 64 CO -0.84 0.61 0.00 1.28 -2.27 0.00 0.00 179.45 178.23 1hhv n LEU 65 N -4.53 0.14 0.00 5.20 4.77 0.47 -1.78 117.00 121.26 1hhv n LEU 65 Ca 0.16 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1hhv n LEU 65 Cb 0.29 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1hhv n LEU 65 CO 0.31 0.03 0.00 0.00 -1.33 0.00 0.00 177.39 176.39 1hhv n GLN 67 N 0.71 0.00 0.02 3.23 1.13 -0.34 0.44 117.38 122.56 1hhv n GLN 67 Ca 0.00 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 55.03 1hhv n GLN 67 Cb 0.03 0.00 -0.10 0.00 0.11 0.00 0.00 30.24 30.28 1hhv n GLN 67 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 1hhv h GLN 68 N 0.00 0.00 -6.44 -1.09 1.08 -1.62 -3.46 115.11 103.57 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 0.35 -0.08 -0.51 -0.95 0.00 0.00 178.83 177.64 1hhv s LEU 69 N -5.89 4.19 -0.10 1.46 1.43 0.17 -5.05 118.68 114.90 1hhv s LEU 69 Ca -0.03 1.00 -0.25 0.00 -1.03 0.00 0.00 54.13 53.81 1hhv s LEU 69 Cb 0.08 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 1hhv s LEU 69 CO 0.81 -0.05 0.80 -2.16 0.23 0.00 0.00 176.35 175.99 1hhv s PRO 70 N -2.64 4.40 -1.06 1.29 0.04 -1.26 -4.83 135.00 130.93 1hhv s PRO 70 Ca 0.46 1.02 -0.25 0.00 0.04 0.00 0.00 61.00 62.27 1hhv s PRO 70 Cb -0.12 -3.50 -0.16 0.00 0.04 0.00 0.00 34.50 30.75 1hhv s PRO 70 CO 0.20 -0.12 2.09 0.54 0.04 0.00 0.00 177.00 179.75 1hhv s VAL 71 N 1.40 3.21 0.71 -0.36 0.11 -1.26 -2.64 120.40 121.57 1hhv s VAL 71 Ca 0.40 -0.32 -0.13 0.00 -2.93 0.00 0.00 61.98 59.00 1hhv s VAL 71 Cb -0.18 -4.04 -0.12 0.00 -1.53 0.00 0.00 36.38 30.52 1hhv s VAL 71 CO 0.17 -0.39 -0.53 0.41 -3.33 0.00 0.00 175.10 171.44 1hhv n THR 72 N 8.58 0.00 -3.66 5.04 -1.04 1.16 -4.82 114.28 119.54 1hhv n THR 72 Ca 0.43 -0.39 -0.20 0.00 -2.04 0.00 0.00 64.05 61.85 1hhv n THR 72 Cb 0.46 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.96 1hhv n THR 72 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hhv s ALA 73 N -1.55 4.12 0.00 2.41 0.00 -1.26 -4.62 121.76 120.86 1hhv s ALA 73 Ca 0.33 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1hhv s ALA 73 Cb -0.18 -1.69 0.00 0.00 0.00 0.00 0.00 23.12 21.25 1hhv s ALA 73 CO 0.62 0.07 0.00 -2.13 0.00 0.00 0.00 175.76 174.32