#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 2.41 -3.94 1.61 5.68 -1.26 -5.07 116.55 115.98 1hhv n ASP 2 Ca 0.00 -3.20 -0.09 0.00 -0.50 0.00 0.00 54.79 51.00 1hhv n ASP 2 Cb 0.00 -0.64 -0.09 0.00 -1.14 0.00 0.00 41.12 39.25 1hhv n ASP 2 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1hhv s THR 3 N -2.41 0.14 -0.05 2.12 2.01 -1.26 -4.99 115.64 111.20 1hhv s THR 3 Ca 0.40 -1.13 -0.03 0.00 0.31 0.00 0.00 61.69 61.23 1hhv s THR 3 Cb 0.20 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.77 1hhv s THR 3 CO -0.07 -0.63 -0.06 -0.11 -0.69 0.00 0.00 174.62 173.06 1hhv n LEU 4 N 0.71 0.62 0.00 4.42 -0.00 -1.26 -4.98 117.00 116.50 1hhv n LEU 4 Ca -0.19 0.37 0.00 0.00 -0.00 0.00 0.00 56.01 56.19 1hhv n LEU 4 Cb 0.59 -0.62 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 1hhv n LEU 4 CO 0.23 -0.49 0.00 0.61 -0.00 0.00 0.00 177.39 177.74 1hhv n GLY 5 N 1.69 0.64 0.00 -3.96 0.00 -1.26 -5.03 105.19 97.27 1hhv n GLY 5 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1hhv n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hhv n ALA 6 N -3.00 1.61 -0.98 4.61 0.00 -1.26 -4.85 120.51 116.64 1hhv n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1hhv n ALA 6 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1hhv n ALA 6 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1hhv n SER 7 N -1.40 0.03 -3.62 0.00 7.64 -1.26 -4.95 113.62 110.06 1hhv n SER 7 Ca 0.00 -1.01 -0.42 0.00 1.01 0.00 0.00 58.87 58.45 1hhv n SER 7 Cb 0.24 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.40 1hhv n SER 7 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 1hhv n TRP 8 N -0.01 2.29 -1.78 1.43 8.01 -1.26 -4.92 117.44 121.20 1hhv n TRP 8 Ca 0.00 -2.14 -0.29 0.00 -1.31 0.00 0.00 57.50 53.76 1hhv n TRP 8 Cb 0.38 -1.94 0.11 0.00 -2.01 0.00 0.00 31.31 27.86 1hhv n TRP 8 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 1hhv s HIS 9 N 4.41 2.70 -0.46 -5.99 2.46 -1.26 -4.46 115.29 112.69 1hhv s HIS 9 Ca 0.54 0.75 -0.19 0.00 0.47 0.00 0.00 55.06 56.63 1hhv s HIS 9 Cb 0.14 -3.50 0.04 0.00 -0.13 0.00 0.00 32.58 29.12 1hhv s HIS 9 CO 0.05 -2.04 0.59 1.03 -2.47 0.00 0.00 174.74 171.90 1hhv s ARG 10 N -5.50 3.17 1.18 2.88 1.81 -1.26 -5.05 118.95 116.17 1hhv s ARG 10 Ca 0.63 -0.67 -0.20 0.00 -1.72 0.00 0.00 55.73 53.77 1hhv s ARG 10 Cb -0.12 -4.01 0.29 0.00 -0.45 0.00 0.00 34.95 30.65 1hhv s ARG 10 CO 0.51 -1.06 1.18 -1.25 -0.68 0.00 0.00 175.30 173.99 1hhv s PRO 11 N 2.58 -1.07 -0.22 3.54 0.04 -1.26 -5.03 135.00 133.58 1hhv s PRO 11 Ca 0.17 -0.28 0.21 0.00 0.04 0.00 0.00 61.00 61.14 1hhv s PRO 11 Cb -0.17 -1.63 0.46 0.00 0.04 0.00 0.00 34.50 33.20 1hhv s PRO 11 CO 0.15 -3.57 1.19 -3.47 0.04 0.00 0.00 177.00 171.33 1hhv n ASP 12 N -4.62 0.86 -4.58 6.66 2.03 -1.26 -5.11 116.55 110.53 1hhv n ASP 12 Ca 0.15 -2.05 -0.49 0.00 0.52 0.00 0.00 54.79 52.93 1hhv n ASP 12 Cb 0.60 -0.22 -0.04 0.00 -0.72 0.00 0.00 41.12 40.74 1hhv n ASP 12 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1hhv n LYS 13 N -0.56 1.18 0.00 -0.67 5.02 -1.26 -4.77 118.16 117.09 1hhv n LYS 13 Ca 0.01 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1hhv n LYS 13 Cb 0.86 -1.91 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 1hhv n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hhv n LEU 16 N 0.00 1.45 0.00 0.00 4.77 -1.26 -4.88 117.00 117.08 1hhv n LEU 16 Ca -0.03 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 1hhv n LEU 16 Cb 0.35 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1hhv n LEU 16 CO 0.17 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1hhv n GLY 17 N 0.25 1.53 0.00 -0.72 0.00 -1.26 -4.56 105.19 100.44 1hhv n GLY 17 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.59 1.61 4.02 -1.24 -4.78 117.16 115.18 1hhv n TYR 18 Ca 0.00 0.00 -0.55 0.00 -0.01 0.00 0.00 57.90 57.34 1hhv n TYR 18 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.25 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 0.77 -0.07 -0.72 -0.06 0.84 -4.86 117.38 113.28 1hhv n GLN 19 Ca 0.00 0.28 -0.20 0.00 -2.00 0.00 0.00 57.00 55.08 1hhv n GLN 19 Cb 0.00 -1.88 -0.13 0.00 -4.06 0.00 0.00 30.24 24.18 1hhv n GLN 19 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1hhv n LYS 20 N 2.63 0.69 -2.28 3.69 5.02 -1.26 -4.92 118.16 121.74 1hhv n LYS 20 Ca 0.20 0.22 -0.31 0.00 -2.02 0.00 0.00 58.31 56.41 1hhv n LYS 20 Cb 0.14 -1.61 -0.01 0.00 -0.02 0.00 0.00 35.03 33.53 1hhv n LYS 20 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1hhv s ARG 21 N -2.53 3.70 0.27 1.97 1.81 -1.26 -5.01 118.95 117.90 1hhv s ARG 21 Ca -0.29 0.67 -0.29 0.00 -1.72 0.00 0.00 55.73 54.09 1hhv s ARG 21 Cb 0.08 -2.19 -0.10 0.00 -0.45 0.00 0.00 34.95 32.30 1hhv s ARG 21 CO 0.67 -0.36 1.26 -1.25 -0.68 0.00 0.00 175.30 174.95 1hhv s PRO 22 N -4.63 4.43 -0.05 3.54 0.04 -1.26 -5.03 135.00 132.04 1hhv s PRO 22 Ca 0.54 2.07 0.02 0.00 0.04 0.00 0.00 61.00 63.67 1hhv s PRO 22 Cb -0.10 -3.14 0.02 0.00 0.04 0.00 0.00 34.50 31.31 1hhv s PRO 22 CO 0.43 -0.12 -0.09 -0.51 0.04 0.00 0.00 177.00 176.75 1hhv s LEU 23 N -1.10 1.54 0.66 -3.56 1.43 -1.26 -5.14 118.68 111.25 1hhv s LEU 23 Ca 0.51 -0.22 -0.05 0.00 -1.03 0.00 0.00 54.13 53.34 1hhv s LEU 23 Cb -0.37 -0.65 0.05 0.00 0.03 0.00 0.00 46.19 45.25 1hhv s LEU 23 CO 0.45 0.00 0.94 -2.16 0.23 0.00 0.00 176.35 175.82 1hhv s PRO 24 N 0.70 2.34 -0.13 1.29 0.04 -1.26 -4.84 135.00 133.14 1hhv s PRO 24 Ca -0.12 -0.37 0.12 0.00 0.04 0.00 0.00 61.00 60.66 1hhv s PRO 24 Cb -0.15 -2.26 -0.24 0.00 0.04 0.00 0.00 34.50 31.90 1hhv s PRO 24 CO 0.02 -1.06 0.32 0.94 0.04 0.00 0.00 177.00 177.26 1hhv n GLN 25 N -2.74 0.67 0.11 4.56 0.00 -1.26 -3.95 117.38 114.76 1hhv n GLN 25 Ca 0.08 0.16 0.08 0.00 -0.00 0.00 0.00 57.00 57.32 1hhv n GLN 25 Cb 0.60 -1.66 0.40 0.00 0.00 0.00 0.00 30.24 29.58 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 -3.00 1.29 0.02 1.69 0.31 -1.26 -1.13 118.33 116.25 1hhv n VAL 26 Ca -0.27 0.60 0.11 0.00 -0.01 0.00 0.00 64.34 64.76 1hhv n VAL 26 Cb 1.09 -1.58 -0.16 0.00 -0.91 0.00 0.00 33.84 32.27 1hhv n VAL 26 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1hhv n LEU 27 N -2.01 0.03 -4.95 7.52 7.99 -1.26 -4.95 117.00 119.38 1hhv n LEU 27 Ca -0.00 -0.02 -0.25 0.00 -0.01 0.00 0.00 56.01 55.73 1hhv n LEU 27 Cb 0.05 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.33 1hhv n LEU 27 CO 0.08 0.01 -0.04 -0.76 -1.51 0.00 0.00 177.39 175.17 1hhv s LEU 28 N -4.43 4.29 -0.04 2.23 1.43 -0.28 -3.48 118.68 118.39 1hhv s LEU 28 Ca -0.07 0.22 -0.02 0.00 -1.03 0.00 0.00 54.13 53.22 1hhv s LEU 28 Cb 0.14 -2.99 -0.01 0.00 0.03 0.00 0.00 46.19 43.36 1hhv s LEU 28 CO 0.89 -0.02 -0.05 -0.24 0.23 0.00 0.00 176.35 177.16 1hhv n SER 29 N -0.87 0.46 0.00 2.29 2.88 0.30 -4.69 113.62 113.99 1hhv n SER 29 Ca -0.07 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1hhv n SER 29 Cb 0.55 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.41 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 -2.86 0.00 -3.59 -3.46 3.41 -0.88 -4.58 113.62 101.67 1hhv n SER 30 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.50 1hhv n SER 30 Cb 0.07 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.00 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 -1.37 -0.36 -0.16 7.33 1.48 -1.12 0.02 118.94 124.76 1hhv s TRP 31 Ca 0.00 0.09 -0.13 0.00 -1.06 0.00 0.00 56.10 55.01 1hhv s TRP 31 Cb 0.00 0.60 0.05 0.00 -1.16 0.00 0.00 33.47 32.96 1hhv s TRP 31 CO 0.00 -0.86 0.42 1.52 -4.06 0.00 0.00 176.95 173.97 1hhv s TYR 32 N -3.57 -0.52 0.66 1.66 -0.85 -0.53 0.25 117.35 114.45 1hhv s TYR 32 Ca 0.06 1.21 -0.15 0.00 -0.52 0.00 0.00 57.07 57.66 1hhv s TYR 32 Cb -0.02 0.20 -0.00 0.00 0.38 0.00 0.00 41.96 42.52 1hhv s TYR 32 CO -0.05 -0.27 1.13 -1.25 -1.52 0.00 0.00 175.55 173.58 1hhv s PRO 33 N 0.68 2.76 0.00 -3.49 0.04 -1.26 -2.58 135.00 131.15 1hhv s PRO 33 Ca -0.04 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1hhv s PRO 33 Cb -0.05 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1hhv s PRO 33 CO -0.05 -1.29 0.00 0.25 0.04 0.00 0.00 177.00 175.95 1hhv n THR 34 N -2.34 0.00 -4.44 1.26 -2.24 -0.76 -4.91 114.28 100.85 1hhv n THR 34 Ca 0.11 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.68 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 -0.65 2.68 0.01 3.42 0.15 -1.26 -4.69 113.70 113.36 1hhv s SER 35 Ca 0.00 -1.24 0.18 0.00 0.70 0.00 0.00 55.95 55.58 1hhv s SER 35 Cb 0.00 -0.15 0.74 0.00 -1.71 0.00 0.00 66.02 64.90 1hhv s SER 35 CO 0.00 -0.42 1.56 1.67 1.20 0.00 0.00 173.24 177.25 1hhv n GLN 36 N -0.62 0.01 -0.32 5.44 7.27 -1.26 -3.59 117.38 124.32 1hhv n GLN 36 Ca -0.05 0.21 0.16 0.00 0.07 0.00 0.00 57.00 57.40 1hhv n GLN 36 Cb 0.64 -1.52 0.33 0.00 2.41 0.00 0.00 30.24 32.11 1hhv n GLN 36 CO 0.00 0.00 0.00 1.25 0.07 0.00 0.00 177.06 178.38 1hhv h LEU 37 N 0.00 -0.15 0.00 1.69 5.85 -2.01 -3.40 115.31 117.30 1hhv h LEU 37 Ca 0.00 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1hhv h LEU 37 Cb 0.30 0.35 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1hhv h LEU 37 CO 0.00 -0.28 0.00 0.00 -0.34 0.00 0.00 178.44 177.82 1hhv n SER 39 N -0.11 0.12 -3.35 0.00 2.88 -1.26 -4.77 113.62 107.12 1hhv n SER 39 Ca 0.00 -0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.32 1hhv n SER 39 Cb 0.00 1.81 -0.09 0.00 -0.75 0.00 0.00 64.21 65.19 1hhv n SER 39 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1hhv s LYS 40 N -3.49 0.70 1.13 -1.46 -0.14 -1.26 -5.13 119.74 110.09 1hhv s LYS 40 Ca -0.07 -1.27 -0.18 0.00 -1.36 0.00 0.00 55.97 53.10 1hhv s LYS 40 Cb 0.14 -0.98 0.26 0.00 -1.68 0.00 0.00 37.83 35.57 1hhv s LYS 40 CO 0.90 -1.25 1.15 -1.25 -0.76 0.00 0.00 175.35 174.13 1hhv s PRO 41 N 1.00 -0.69 0.00 -1.68 0.04 -1.26 -4.85 135.00 127.56 1hhv s PRO 41 Ca 0.21 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.18 1hhv s PRO 41 Cb -0.13 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.75 1hhv s PRO 41 CO -0.05 -3.36 0.00 0.41 0.04 0.00 0.00 177.00 174.04 1hhv n GLY 42 N -1.51 -0.16 3.19 0.56 0.00 -1.26 -5.02 105.19 100.98 1hhv n GLY 42 Ca 0.13 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 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 -4.00 1.95 -0.08 1.61 1.01 -0.99 -1.83 120.40 118.08 1hhv s VAL 43 Ca 0.00 -0.95 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 1hhv s VAL 43 Cb 0.00 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 1hhv s VAL 43 CO 0.00 0.54 -0.05 0.27 0.00 0.00 0.00 175.10 175.85 1hhv s ILE 44 N 0.48 3.82 0.03 2.22 -5.25 -1.06 -0.32 121.20 121.11 1hhv s ILE 44 Ca -0.16 -0.43 0.03 0.00 -0.99 0.00 0.00 60.65 59.10 1hhv s ILE 44 Cb -0.17 -2.58 -0.04 0.00 2.95 0.00 0.00 42.46 42.62 1hhv s ILE 44 CO 0.06 0.59 -0.03 -0.36 -1.79 0.00 0.00 174.94 173.42 1hhv s PHE 45 N -0.72 2.97 -0.21 1.37 0.08 0.32 -1.45 117.98 120.35 1hhv s PHE 45 Ca 0.11 0.00 -0.05 0.00 0.12 0.00 0.00 56.93 57.11 1hhv s PHE 45 Cb -0.11 -1.60 -0.02 0.00 -0.57 0.00 0.00 43.02 40.71 1hhv s PHE 45 CO 0.02 0.44 -0.01 -0.51 -0.10 0.00 0.00 175.22 175.05 1hhv s LEU 46 N -1.75 3.15 0.00 -0.37 1.02 0.10 0.20 118.68 121.04 1hhv s LEU 46 Ca 0.20 -0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.10 1hhv s LEU 46 Cb -0.11 -1.80 0.00 0.00 0.02 0.00 0.00 46.19 44.29 1hhv s LEU 46 CO 0.12 0.04 0.00 0.35 0.02 0.00 0.00 176.35 176.87 1hhv n THR 47 N 4.43 0.00 0.16 5.49 -2.24 0.53 0.11 114.28 122.76 1hhv n THR 47 Ca -0.17 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.65 1hhv n THR 47 Cb 0.52 -0.20 0.08 0.00 -2.10 0.00 0.00 70.33 68.62 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 1.38 -0.02 -0.78 4.76 -1.23 -1.69 118.16 120.58 1hhv n LYS 48 Ca 0.00 -1.43 0.00 0.00 -2.87 0.00 0.00 58.31 54.02 1hhv n LYS 48 Cb 0.00 -1.20 -0.06 0.00 -1.84 0.00 0.00 35.03 31.94 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 0.44 1.46 0.00 1.97 5.12 -1.26 -5.00 116.66 119.39 1hhv n ARG 49 Ca 0.07 -0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.95 1hhv n ARG 49 Cb 0.30 -1.18 0.00 0.00 -1.16 0.00 0.00 32.46 30.42 1hhv n ARG 49 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1hhv n GLY 50 N 2.30 0.13 3.88 -0.13 0.00 -1.26 -5.13 105.19 104.97 1hhv n GLY 50 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 3.79 0.21 1.61 0.52 -1.26 -4.90 118.95 118.93 1hhv s ARG 51 Ca 0.00 0.26 0.08 0.00 -0.52 0.00 0.00 55.73 55.54 1hhv s ARG 51 Cb 0.00 -2.65 -0.04 0.00 0.52 0.00 0.00 34.95 32.78 1hhv s ARG 51 CO 0.00 0.32 0.06 -0.65 0.02 0.00 0.00 175.30 175.05 1hhv s GLN 52 N -2.83 2.56 0.06 3.54 -1.52 -1.26 -0.35 119.66 119.85 1hhv s GLN 52 Ca 0.47 -1.15 0.00 0.00 -1.95 0.00 0.00 55.36 52.74 1hhv s GLN 52 Cb -0.11 -2.39 -0.04 0.00 -0.22 0.00 0.00 33.01 30.25 1hhv s GLN 52 CO 0.22 0.42 -0.04 0.08 -0.25 0.00 0.00 175.29 175.72 1hhv s VAL 53 N -1.98 0.35 -0.05 1.09 1.01 0.53 -4.90 120.40 116.44 1hhv s VAL 53 Ca 0.30 -1.65 -0.02 0.00 0.00 0.00 0.00 61.98 60.61 1hhv s VAL 53 Cb -0.08 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.02 1hhv s VAL 53 CO 0.21 -0.85 0.04 0.00 0.00 0.00 0.00 175.10 174.50 1hhv s ALA 55 N 2.05 0.35 -0.27 0.00 0.00 0.56 0.29 121.76 124.74 1hhv s ALA 55 Ca 0.04 -1.11 -0.26 0.00 0.00 0.00 0.00 51.96 50.63 1hhv s ALA 55 Cb -0.12 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.82 1hhv s ALA 55 CO -0.04 -0.57 0.93 0.34 0.00 0.00 0.00 175.76 176.42 1hhv s ASP 56 N -2.99 6.89 0.63 0.00 -1.08 -1.26 -2.34 116.67 116.51 1hhv s ASP 56 Ca 0.19 1.06 0.24 0.00 -0.52 0.00 0.00 52.55 53.51 1hhv s ASP 56 Cb 0.05 -2.48 1.29 0.00 -1.46 0.00 0.00 42.92 40.32 1hhv s ASP 56 CO -0.00 -0.65 1.71 0.07 0.52 0.00 0.00 175.17 176.82 1hhv h LYS 57 N 7.79 0.00 0.00 4.34 -0.00 -1.93 0.57 116.57 127.34 1hhv h LYS 57 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.43 1hhv h LYS 57 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.31 1hhv h LYS 57 CO 0.94 0.00 0.00 -1.13 -0.00 0.00 0.00 179.45 179.26 1hhv n SER 58 N -2.73 0.00 -4.63 7.07 3.41 -1.26 -3.96 113.62 111.51 1hhv n SER 58 Ca -0.02 -1.09 -0.41 0.00 -0.26 0.00 0.00 58.87 57.10 1hhv n SER 58 Cb 0.46 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.36 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 -2.00 4.15 0.16 4.33 -0.14 0.20 -4.94 119.74 121.49 1hhv s LYS 59 Ca 0.27 0.73 -0.30 0.00 -1.36 0.00 0.00 55.97 55.31 1hhv s LYS 59 Cb 0.12 -3.65 -0.05 0.00 -1.68 0.00 0.00 37.83 32.57 1hhv s LYS 59 CO 0.20 -0.46 1.54 -0.44 -0.76 0.00 0.00 175.35 175.44 1hhv h ASP 60 N 7.79 -2.08 -0.73 2.83 5.19 -1.88 0.47 116.42 128.01 1hhv h ASP 60 Ca -0.25 0.32 0.08 0.00 -0.62 0.00 0.00 57.03 56.56 1hhv h ASP 60 Cb 1.11 0.92 -0.07 0.00 0.18 0.00 0.00 39.33 41.47 1hhv h ASP 60 CO 0.82 -0.26 0.39 4.11 -3.12 0.00 0.00 179.24 181.18 1hhv h TRP 61 N -0.05 0.71 0.23 4.55 5.08 -1.95 -2.27 115.95 122.24 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 0.45 -0.21 0.00 0.00 -3.00 0.00 0.00 29.16 26.40 1hhv h TRP 61 CO -0.98 0.29 -0.11 0.28 -1.28 0.00 0.00 178.44 176.64 1hhv h VAL 62 N 0.68 0.81 -0.93 0.12 2.07 -0.79 -2.44 116.25 115.76 1hhv h VAL 62 Ca 0.35 -0.15 0.25 0.00 0.82 0.00 0.00 66.70 67.97 1hhv h VAL 62 Cb 0.31 0.90 -0.17 0.00 -1.52 0.00 0.00 31.29 30.81 1hhv h VAL 62 CO -0.24 0.03 0.07 0.50 0.02 0.00 0.00 177.57 177.96 1hhv h LYS 63 N -0.38 0.06 -0.88 1.57 3.64 0.30 2.06 116.57 122.94 1hhv h LYS 63 Ca -0.03 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1hhv h LYS 63 Cb 0.29 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.04 1hhv h LYS 63 CO 0.05 0.04 0.55 -0.22 -2.27 0.00 0.00 179.45 177.60 1hhv h LYS 64 N 0.06 0.99 -0.86 1.90 1.63 -1.09 -0.44 116.57 118.76 1hhv h LYS 64 Ca 0.57 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 60.31 1hhv h LYS 64 Cb 1.16 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 32.57 1hhv h LYS 64 CO -0.83 0.66 0.00 1.28 -3.45 0.00 0.00 179.45 177.10 1hhv n LEU 65 N -4.59 0.00 0.00 5.20 4.77 0.70 -1.18 117.00 121.90 1hhv n LEU 65 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1hhv n LEU 65 Cb 0.15 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1hhv n LEU 65 CO 0.32 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 178.05 1hhv n GLN 67 N 0.69 0.00 0.02 3.23 7.27 -0.18 0.38 117.38 128.79 1hhv n GLN 67 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 1hhv n GLN 67 Cb 0.00 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 32.55 1hhv n GLN 67 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 1hhv n GLN 68 N 0.00 0.62 -3.38 3.69 1.13 -0.33 -4.88 117.38 114.23 1hhv n GLN 68 Ca 0.00 0.25 -0.34 0.00 -1.94 0.00 0.00 57.00 54.96 1hhv n GLN 68 Cb 0.00 -1.80 -0.06 0.00 0.11 0.00 0.00 30.24 28.49 1hhv n GLN 68 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1hhv s LEU 69 N -5.87 4.28 -0.17 1.08 1.43 0.16 -5.05 118.68 114.55 1hhv s LEU 69 Ca -0.03 1.02 -0.25 0.00 -1.03 0.00 0.00 54.13 53.84 1hhv s LEU 69 Cb 0.08 -3.41 -0.02 0.00 0.03 0.00 0.00 46.19 42.88 1hhv s LEU 69 CO 0.82 0.04 0.83 -2.16 0.23 0.00 0.00 176.35 176.11 1hhv s PRO 70 N -2.25 4.30 -0.98 1.29 0.04 -1.26 -4.80 135.00 131.34 1hhv s PRO 70 Ca 0.41 1.01 -0.27 0.00 0.04 0.00 0.00 61.00 62.19 1hhv s PRO 70 Cb -0.14 -3.57 -0.20 0.00 0.04 0.00 0.00 34.50 30.63 1hhv s PRO 70 CO 0.20 -0.32 2.23 0.54 0.04 0.00 0.00 177.00 179.69 1hhv s VAL 71 N 2.11 3.01 0.47 -0.36 0.11 -1.24 -2.80 120.40 121.69 1hhv s VAL 71 Ca 0.38 -0.01 -0.15 0.00 -2.93 0.00 0.00 61.98 59.28 1hhv s VAL 71 Cb -0.17 -3.64 -0.12 0.00 -1.53 0.00 0.00 36.38 30.92 1hhv s VAL 71 CO 0.13 -0.01 -0.19 0.41 -3.33 0.00 0.00 175.10 172.10 1hhv n THR 72 N 9.00 0.00 -2.68 5.04 -1.04 0.69 -4.84 114.28 120.46 1hhv n THR 72 Ca 0.43 -0.41 -0.05 0.00 -2.04 0.00 0.00 64.05 61.99 1hhv n THR 72 Cb 0.46 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 69.01 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 -1.36 3.05 -0.42 2.41 0.00 -1.26 -4.63 120.51 118.31 1hhv n ALA 73 Ca 0.05 -2.95 0.00 0.00 0.00 0.00 0.00 53.44 50.54 1hhv n ALA 73 Cb 0.40 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1hhv n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37