#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hra n PRO 2 N 0.00 0.78 -3.64 3.17 -0.02 -1.26 -4.91 135.00 129.11 1hra n PRO 2 Ca 0.00 0.13 -0.29 0.00 -2.02 0.00 0.00 63.50 61.32 1hra n PRO 2 Cb 0.00 -2.48 -0.13 0.00 -0.02 0.00 0.00 33.50 30.87 1hra n PRO 2 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1hra s ARG 3 N 7.49 1.04 0.00 -0.52 0.52 -1.26 -3.15 118.95 123.07 1hra s ARG 3 Ca 1.13 -1.76 0.00 0.00 -0.52 0.00 0.00 55.73 54.58 1hra s ARG 3 Cb -0.78 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 32.67 1hra s ARG 3 CO 0.43 -1.17 0.15 0.28 0.02 0.00 0.00 175.30 175.01 1hra n VAL 4 N 3.76 0.00 -4.92 3.52 0.31 -1.26 -4.89 118.33 114.85 1hra n VAL 4 Ca 0.09 0.49 -0.33 0.00 -0.01 0.00 0.00 64.34 64.58 1hra n VAL 4 Cb 0.36 -1.17 -0.13 0.00 -0.91 0.00 0.00 33.84 31.98 1hra n VAL 4 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1hra s TYR 5 N -0.29 2.67 0.05 3.52 1.13 -1.26 -5.09 117.35 118.07 1hra s TYR 5 Ca 0.00 -0.18 -0.16 0.00 -1.41 0.00 0.00 57.07 55.32 1hra s TYR 5 Cb 0.00 -1.61 -0.07 0.00 -1.10 0.00 0.00 41.96 39.18 1hra s TYR 5 CO 0.00 0.17 1.25 0.87 -2.51 0.00 0.00 175.55 175.33 1hra h LYS 6 N 5.33 -0.34 -2.03 -3.49 1.79 -1.88 -1.72 116.57 114.23 1hra h LYS 6 Ca -0.46 0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.02 1hra h LYS 6 Cb 1.15 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1hra h LYS 6 CO 0.50 -0.22 -0.00 -2.30 -1.08 0.00 0.00 179.45 176.34 1hra n PRO 7 N -3.78 0.63 0.12 3.15 -0.02 -1.25 0.51 135.00 134.35 1hra n PRO 7 Ca -0.04 -0.04 -0.19 0.00 -2.02 0.00 0.00 63.50 61.20 1hra n PRO 7 Cb 0.19 -1.25 -0.15 0.00 -0.02 0.00 0.00 33.50 32.27 1hra n PRO 7 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hra n PHE 9 N -3.59 0.00 0.00 0.00 -0.00 0.47 -2.12 117.46 112.22 1hra n PHE 9 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.33 1hra n PHE 9 Cb 1.06 -0.14 0.00 0.00 -0.00 0.00 0.00 39.48 40.40 1hra n PHE 9 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1hra n VAL 10 N -1.14 0.00 -1.49 -2.13 0.31 -1.26 -4.51 118.33 108.12 1hra n VAL 10 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.52 1hra n VAL 10 Cb 0.17 -0.66 0.20 0.00 -0.91 0.00 0.00 33.84 32.65 1hra n VAL 10 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hra s GLN 12 N -3.23 1.16 0.00 0.00 2.00 -1.26 -4.86 119.66 113.47 1hra s GLN 12 Ca 0.42 -0.25 0.00 0.00 -2.00 0.00 0.00 55.36 53.53 1hra s GLN 12 Cb 0.39 0.53 0.00 0.00 0.80 0.00 0.00 33.01 34.73 1hra s GLN 12 CO -0.02 -0.45 0.00 -0.25 -0.50 0.00 0.00 175.29 174.06 1hra n ASP 13 N 0.14 0.00 -4.74 6.67 9.92 0.18 -4.89 116.55 123.83 1hra n ASP 13 Ca -0.18 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 53.67 1hra n ASP 13 Cb 0.62 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.07 1hra n ASP 13 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1hra s LYS 14 N 0.00 4.39 0.21 -1.24 2.20 -1.26 -3.97 119.74 120.06 1hra s LYS 14 Ca 0.00 2.06 0.03 0.00 -0.36 0.00 0.00 55.97 57.70 1hra s LYS 14 Cb 0.00 -3.19 -0.05 0.00 -1.51 0.00 0.00 37.83 33.08 1hra s LYS 14 CO 0.00 -0.25 0.01 -1.54 -0.36 0.00 0.00 175.35 173.21 1hra s SER 15 N 0.29 1.51 -0.08 1.43 1.04 -1.25 -1.88 113.70 114.75 1hra s SER 15 Ca 0.56 -1.22 -0.30 0.00 0.48 0.00 0.00 55.95 55.47 1hra s SER 15 Cb -0.37 0.07 0.12 0.00 0.10 0.00 0.00 66.02 65.94 1hra s SER 15 CO 0.39 -0.56 0.99 -0.44 0.98 0.00 0.00 173.24 174.60 1hra s SER 16 N -3.25 -0.31 -0.40 7.02 0.01 -0.51 -4.03 113.70 112.22 1hra s SER 16 Ca 0.28 0.08 0.03 0.00 1.31 0.00 0.00 55.95 57.64 1hra s SER 16 Cb 0.06 0.31 0.16 0.00 0.21 0.00 0.00 66.02 66.76 1hra s SER 16 CO 0.07 -0.47 0.35 -0.83 0.41 0.00 0.00 173.24 172.77 1hra s GLY 17 N -2.14 0.75 -0.03 3.44 0.00 -1.26 -3.00 107.32 105.08 1hra s GLY 17 Ca 0.05 -1.95 -0.29 0.00 0.00 0.00 0.00 44.72 42.53 1hra s GLY 17 CO -0.06 2.33 0.87 -0.47 0.00 0.00 0.00 173.10 175.77 1hra s TYR 18 N 0.54 -0.39 0.00 1.90 5.04 -1.26 -5.14 117.35 118.03 1hra s TYR 18 Ca 0.27 0.39 0.00 0.00 -2.44 0.00 0.00 57.07 55.29 1hra s TYR 18 Cb -0.05 0.51 0.00 0.00 0.35 0.00 0.00 41.96 42.77 1hra s TYR 18 CO -0.11 -0.53 0.00 0.72 -1.34 0.00 0.00 175.55 174.29 1hra n HIS 19 N 0.06 0.00 -3.90 4.97 8.25 -1.26 -4.98 115.22 118.35 1hra n HIS 19 Ca -0.11 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.01 1hra n HIS 19 Cb 0.61 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.58 1hra n HIS 19 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1hra s TYR 20 N 0.00 3.38 0.00 4.41 -0.85 -1.26 -4.88 117.35 118.15 1hra s TYR 20 Ca 0.00 -2.12 0.00 0.00 -0.52 0.00 0.00 57.07 54.43 1hra s TYR 20 Cb 0.00 -2.40 0.00 0.00 0.38 0.00 0.00 41.96 39.94 1hra s TYR 20 CO 0.00 -0.86 0.00 0.41 -1.52 0.00 0.00 175.55 173.58 1hra n GLY 21 N 4.57 1.86 0.00 5.49 0.00 -1.26 -3.24 105.19 112.61 1hra n GLY 21 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1hra n GLY 21 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1hra n VAL 22 N 0.00 0.00 -3.92 1.61 3.14 -1.26 -4.84 118.33 113.06 1hra n VAL 22 Ca 0.00 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.09 1hra n VAL 22 Cb 0.00 -0.39 -0.16 0.00 -1.06 0.00 0.00 33.84 32.23 1hra n VAL 22 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1hra s SER 23 N 0.20 3.18 0.21 6.55 0.15 -1.26 -4.80 113.70 117.92 1hra s SER 23 Ca 0.00 -0.83 0.11 0.00 0.70 0.00 0.00 55.95 55.93 1hra s SER 23 Cb 0.00 -1.03 -0.04 0.00 -1.71 0.00 0.00 66.02 63.23 1hra s SER 23 CO 0.00 -0.19 -0.18 0.00 1.20 0.00 0.00 173.24 174.07 1hra s ALA 24 N 1.53 2.71 -1.64 5.45 0.00 -0.96 -0.40 121.76 128.45 1hra s ALA 24 Ca -0.01 -1.63 0.17 0.00 0.00 0.00 0.00 51.96 50.49 1hra s ALA 24 Cb -0.16 -0.45 0.93 0.00 0.00 0.00 0.00 23.12 23.44 1hra s ALA 24 CO -0.08 0.41 1.48 0.00 0.00 0.00 0.00 175.76 177.58 1hra n GLU 26 N -1.18 0.00 -0.14 0.00 -0.58 -1.26 -4.12 120.64 113.37 1hra n GLU 26 Ca 0.10 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.80 1hra n GLU 26 Cb 0.11 -0.17 0.04 0.00 -0.57 0.00 0.00 31.44 30.85 1hra n GLU 26 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1hra h GLY 27 N 0.00 0.57 0.85 0.62 0.00 -1.91 -2.19 103.07 101.01 1hra h GLY 27 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1hra h GLY 27 CO 0.00 0.00 0.05 0.00 0.00 0.00 0.00 176.54 176.59 1hra h LYS 29 N 0.06 1.16 0.02 0.00 2.10 -1.85 0.14 116.57 118.21 1hra h LYS 29 Ca 0.05 -0.07 0.02 0.00 -2.00 0.00 0.00 60.65 58.65 1hra h LYS 29 Cb 0.22 -0.26 -0.03 0.00 -0.90 0.00 0.00 32.23 31.27 1hra h LYS 29 CO -0.00 0.77 -0.14 0.78 -2.00 0.00 0.00 179.45 178.86 1hra h GLY 30 N 1.19 -0.19 0.82 0.07 0.00 -1.13 -1.78 103.07 102.06 1hra h GLY 30 Ca 0.39 0.16 0.12 0.00 0.00 0.00 0.00 47.33 48.00 1hra h GLY 30 CO -0.14 -0.14 0.48 -2.75 0.00 0.00 0.00 176.54 174.00 1hra h PHE 31 N -0.24 0.59 0.05 5.60 3.04 -0.26 -0.68 116.94 125.03 1hra h PHE 31 Ca 0.04 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.00 1hra h PHE 31 Cb 0.29 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.61 1hra h PHE 31 CO -0.18 0.25 -0.02 0.35 -2.02 0.00 0.00 178.31 176.69 1hra h PHE 32 N 0.53 -0.06 -0.85 0.41 3.57 0.12 -1.19 116.94 119.47 1hra h PHE 32 Ca 0.35 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.82 1hra h PHE 32 Cb 0.63 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 1hra h PHE 32 CO -0.00 0.58 0.43 0.07 -2.23 0.00 0.00 178.31 177.15 1hra h ARG 33 N -0.80 1.21 -0.72 1.11 0.11 -1.42 0.86 114.38 114.72 1hra h ARG 33 Ca -0.01 -0.16 0.07 0.00 0.10 0.00 0.00 59.98 59.98 1hra h ARG 33 Cb 0.66 -0.22 -0.06 0.00 1.11 0.00 0.00 29.97 31.46 1hra h ARG 33 CO 0.01 0.91 0.41 -0.09 0.10 0.00 0.00 179.97 181.31 1hra h ARG 34 N 1.20 0.72 0.00 0.08 1.12 -0.48 0.62 114.38 117.64 1hra h ARG 34 Ca 0.29 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 59.12 1hra h ARG 34 Cb 0.09 -0.16 0.00 0.00 -0.01 0.00 0.00 29.97 29.88 1hra h ARG 34 CO -0.04 0.47 0.00 0.43 -3.11 0.00 0.00 179.97 177.72 1hra n SER 35 N -4.76 0.00 -0.01 -3.80 7.64 -0.51 -3.22 113.62 108.96 1hra n SER 35 Ca 0.10 0.53 -0.10 0.00 1.01 0.00 0.00 58.87 60.41 1hra n SER 35 Cb 0.20 -0.33 -0.05 0.00 -1.01 0.00 0.00 64.21 63.02 1hra n SER 35 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1hra h ILE 36 N 0.00 0.99 -0.73 0.44 2.04 -0.49 0.38 117.51 120.15 1hra h ILE 36 Ca 0.00 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1hra h ILE 36 Cb 0.00 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1hra h ILE 36 CO 0.00 0.02 0.49 -0.61 0.00 0.00 0.00 178.15 178.05 1hra h GLN 37 N 0.12 0.96 0.00 2.37 4.15 -0.84 -3.39 115.11 118.47 1hra h GLN 37 Ca 0.05 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1hra h GLN 37 Cb 0.01 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.49 1hra h GLN 37 CO -0.04 0.63 0.00 0.36 -1.93 0.00 0.00 178.83 177.85 1hra n LYS 38 N -4.43 0.00 -2.96 1.69 2.85 -1.04 -4.11 118.16 110.16 1hra n LYS 38 Ca 0.08 0.00 -0.25 0.00 -1.05 0.00 0.00 58.31 57.09 1hra n LYS 38 Cb 0.04 -0.26 -0.04 0.00 -0.65 0.00 0.00 35.03 34.13 1hra n LYS 38 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1hra n ASN 39 N -3.40 3.74 -4.15 -5.58 0.23 0.13 -4.94 115.26 101.30 1hra n ASN 39 Ca 0.00 -3.54 -0.40 0.00 -0.53 0.00 0.00 54.58 50.11 1hra n ASN 39 Cb 0.00 -0.57 -0.03 0.00 -2.08 0.00 0.00 39.78 37.10 1hra n ASN 39 CO 0.00 0.00 0.00 1.15 -0.93 0.00 0.00 177.26 177.48 1hra n MET 40 N -0.15 3.16 -3.96 -3.83 0.00 -0.71 -4.53 117.12 107.10 1hra n MET 40 Ca 0.30 -4.49 -0.31 0.00 0.00 0.00 0.00 57.70 53.20 1hra n MET 40 Cb 0.46 -2.47 -0.14 0.00 0.00 0.00 0.00 33.22 31.08 1hra n MET 40 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1hra s ILE 41 N -1.55 2.56 -0.21 3.17 1.01 -1.26 -5.00 121.20 119.91 1hra s ILE 41 Ca 0.30 -3.01 -0.09 0.00 0.00 0.00 0.00 60.65 57.85 1hra s ILE 41 Cb -0.06 -2.80 0.08 0.00 0.01 0.00 0.00 42.46 39.70 1hra s ILE 41 CO -0.08 -0.74 0.48 -0.72 0.00 0.00 0.00 174.94 173.87 1hra s TYR 42 N 0.08 -0.84 -0.41 3.97 -0.85 -1.26 -4.90 117.35 113.14 1hra s TYR 42 Ca 0.15 1.63 0.06 0.00 -0.52 0.00 0.00 57.07 58.39 1hra s TYR 42 Cb -0.24 0.40 0.17 0.00 0.38 0.00 0.00 41.96 42.68 1hra s TYR 42 CO -0.03 -0.47 0.56 0.99 -1.52 0.00 0.00 175.55 175.09 1hra s THR 43 N 2.15 -0.77 -0.11 -3.49 2.01 -1.26 -4.90 115.64 109.27 1hra s THR 43 Ca -0.06 -0.50 0.12 0.00 0.31 0.00 0.00 61.69 61.56 1hra s THR 43 Cb -0.10 -0.23 -0.16 0.00 0.01 0.00 0.00 72.50 72.02 1hra s THR 43 CO -0.14 -0.21 0.08 0.00 -0.69 0.00 0.00 174.62 173.66 1hra n HIS 45 N -2.40 3.50 0.00 0.00 -0.00 -1.26 -0.95 115.22 114.11 1hra n HIS 45 Ca -0.18 -4.20 0.00 0.00 0.46 0.00 0.00 57.72 53.80 1hra n HIS 45 Cb 0.83 -0.72 0.00 0.00 -0.12 0.00 0.00 29.99 29.99 1hra n HIS 45 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1hra n ARG 46 N 1.73 0.00 -4.27 1.57 1.74 -1.26 -4.92 116.66 111.25 1hra n ARG 46 Ca 0.23 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 57.16 1hra n ARG 46 Cb 0.37 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.70 1hra n ARG 46 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1hra s ASP 47 N 0.00 1.33 -0.37 0.55 1.47 -1.26 -5.06 116.67 113.32 1hra s ASP 47 Ca 0.00 -1.22 0.03 0.00 1.18 0.00 0.00 52.55 52.54 1hra s ASP 47 Cb 0.00 0.11 0.53 0.00 -0.34 0.00 0.00 42.92 43.22 1hra s ASP 47 CO 0.00 -0.59 1.76 2.29 0.68 0.00 0.00 175.17 179.31 1hra n LYS 48 N -0.32 2.03 0.00 2.11 2.85 -1.26 -2.34 118.16 121.22 1hra n LYS 48 Ca -0.05 -2.44 0.00 0.00 -1.05 0.00 0.00 58.31 54.77 1hra n LYS 48 Cb 0.64 -1.96 0.00 0.00 -0.65 0.00 0.00 35.03 33.06 1hra n LYS 48 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1hra n ASN 49 N -0.81 0.73 -4.62 -5.58 6.94 -1.26 -5.02 115.26 105.65 1hra n ASN 49 Ca 0.48 -0.87 -0.52 0.00 -0.02 0.00 0.00 54.58 53.65 1hra n ASN 49 Cb 1.40 0.25 -0.06 0.00 -2.36 0.00 0.00 39.78 39.01 1hra n ASN 49 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1hra s VAL 51 N 5.03 2.94 -0.23 0.00 1.01 0.17 -4.54 120.40 124.77 1hra s VAL 51 Ca 1.00 -0.73 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 1hra s VAL 51 Cb -0.85 -2.19 0.11 0.00 0.00 0.00 0.00 36.38 33.44 1hra s VAL 51 CO 0.55 0.55 0.23 0.27 0.00 0.00 0.00 175.10 176.71 1hra s ILE 52 N -0.08 -0.32 0.00 2.22 -0.00 -1.26 -0.39 121.20 121.36 1hra s ILE 52 Ca -0.03 -0.27 0.00 0.00 -0.00 0.00 0.00 60.65 60.36 1hra s ILE 52 Cb -0.14 -0.78 0.00 0.00 -0.00 0.00 0.00 42.46 41.54 1hra s ILE 52 CO 0.04 -0.32 0.00 -0.46 -0.00 0.00 0.00 174.94 174.20 1hra n ASN 53 N 5.31 0.00 -3.41 4.36 6.94 -1.22 -4.34 115.26 122.89 1hra n ASN 53 Ca -0.05 0.00 -0.26 0.00 -0.02 0.00 0.00 54.58 54.25 1hra n ASN 53 Cb 0.48 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 37.81 1hra n ASN 53 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1hra n LYS 54 N 0.00 1.16 0.00 -3.83 2.85 -1.19 -4.13 118.16 113.03 1hra n LYS 54 Ca 0.00 -3.74 0.00 0.00 -1.05 0.00 0.00 58.31 53.52 1hra n LYS 54 Cb 0.00 -1.75 0.00 0.00 -0.65 0.00 0.00 35.03 32.63 1hra n LYS 54 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1hra n VAL 55 N 1.76 0.00 0.00 0.58 0.31 -1.26 -4.31 118.33 115.41 1hra n VAL 55 Ca 0.25 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1hra n VAL 55 Cb 0.46 0.68 0.00 0.00 -0.91 0.00 0.00 33.84 34.07 1hra n VAL 55 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1hra n THR 56 N -1.05 0.00 -2.86 2.52 -2.24 -1.26 -5.12 114.28 104.27 1hra n THR 56 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1hra n THR 56 Cb 0.00 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 1hra n THR 56 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1hra n ARG 57 N 0.00 -2.63 -3.50 -0.78 1.85 0.48 -4.96 116.66 107.11 1hra n ARG 57 Ca 0.00 2.23 -0.20 0.00 -1.00 0.00 0.00 57.85 58.89 1hra n ARG 57 Cb 0.00 -3.81 0.09 0.00 -1.05 0.00 0.00 32.46 27.69 1hra n ARG 57 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1hra n ASN 58 N 1.16 -3.73 -4.44 2.89 3.02 -1.26 -5.04 115.26 107.85 1hra n ASN 58 Ca -0.06 -0.59 -0.31 0.00 -0.03 0.00 0.00 54.58 53.58 1hra n ASN 58 Cb 0.23 -5.09 -0.13 0.00 -0.61 0.00 0.00 39.78 34.19 1hra n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hra s ARG 59 N -5.74 2.23 0.00 3.52 3.03 -1.26 -0.66 118.95 120.07 1hra s ARG 59 Ca 0.23 -0.87 0.00 0.00 2.03 0.00 0.00 55.73 57.12 1hra s ARG 59 Cb -0.10 -2.23 0.00 0.00 -1.03 0.00 0.00 34.95 31.59 1hra s ARG 59 CO 0.73 0.57 0.00 0.00 -1.13 0.00 0.00 175.30 175.47 1hra n GLN 61 N 0.00 0.00 -0.28 0.00 6.02 -1.26 -4.31 117.38 117.56 1hra n GLN 61 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.03 1hra n GLN 61 Cb 0.00 -0.15 0.18 0.00 1.02 0.00 0.00 30.24 31.29 1hra n GLN 61 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 1hra h TYR 62 N 0.00 0.74 -0.93 1.08 5.03 -1.42 0.29 116.97 121.77 1hra h TYR 62 Ca 0.00 0.03 0.17 0.00 2.58 0.00 0.00 58.73 61.51 1hra h TYR 62 Cb 0.00 -0.21 -0.17 0.00 1.55 0.00 0.00 36.73 37.90 1hra h TYR 62 CO 0.00 0.24 -0.31 0.00 -1.32 0.00 0.00 178.16 176.77 1hra n ARG 64 N -5.53 1.08 0.13 0.00 5.12 0.01 -1.59 116.66 115.87 1hra n ARG 64 Ca 0.12 -1.21 -0.14 0.00 -1.93 0.00 0.00 57.85 54.69 1hra n ARG 64 Cb 0.43 -1.11 -0.08 0.00 -1.16 0.00 0.00 32.46 30.54 1hra n ARG 64 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1hra h LEU 65 N 0.98 -0.22 0.07 0.55 -0.00 0.07 -2.73 115.31 114.04 1hra h LEU 65 Ca 0.00 -0.06 -0.28 0.00 -0.00 0.00 0.00 57.88 57.54 1hra h LEU 65 Cb 0.38 0.06 0.02 0.00 -0.00 0.00 0.00 40.66 41.11 1hra h LEU 65 CO 0.00 -0.08 -1.21 1.56 -0.00 0.00 0.00 178.44 178.72 1hra h GLN 66 N -0.35 0.44 0.00 1.13 7.50 -0.63 0.67 115.11 123.88 1hra h GLN 66 Ca -0.03 -0.63 -0.13 0.00 0.50 0.00 0.00 58.65 58.36 1hra h GLN 66 Cb 0.27 0.22 -0.02 0.00 0.05 0.00 0.00 27.48 28.00 1hra h GLN 66 CO 0.04 1.27 -0.63 0.87 -1.50 0.00 0.00 178.83 178.88 1hra h LYS 67 N 0.18 0.00 0.02 1.46 6.56 -1.47 -2.47 116.57 120.85 1hra h LYS 67 Ca -0.15 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.23 1hra h LYS 67 Cb 1.89 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 33.53 1hra h LYS 67 CO 0.21 0.63 -0.96 0.00 -2.06 0.00 0.00 179.45 177.28 1hra h PHE 69 N 0.04 0.00 -0.23 0.00 0.04 0.34 -0.38 116.94 116.75 1hra h PHE 69 Ca -0.04 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.80 1hra h PHE 69 Cb 1.65 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.79 1hra h PHE 69 CO 0.02 0.00 0.42 0.93 -0.60 0.00 0.00 178.31 179.07 1hra h GLU 70 N 0.00 0.00 -1.89 1.51 5.08 -1.32 -0.33 114.58 117.63 1hra h GLU 70 Ca 0.40 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 58.12 1hra h GLU 70 Cb 1.70 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.57 1hra h GLU 70 CO -0.00 0.00 -0.25 0.28 -1.00 0.00 0.00 179.01 178.04 1hra n VAL 71 N -3.32 3.15 0.00 3.13 0.31 -0.15 -5.00 118.33 116.44 1hra n VAL 71 Ca 0.03 -5.14 0.00 0.00 -0.01 0.00 0.00 64.34 59.23 1hra n VAL 71 Cb 0.53 -1.33 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 1hra n VAL 71 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1hra n GLY 72 N -0.38 0.00 3.82 2.92 0.00 -0.13 -4.27 105.19 107.15 1hra n GLY 72 Ca 0.40 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.07 1hra n GLY 72 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hra s MET 73 N 0.00 4.24 -0.84 1.61 -1.94 -1.26 -4.31 119.30 116.80 1hra s MET 73 Ca 0.00 0.96 0.01 0.00 -1.71 0.00 0.00 55.69 54.95 1hra s MET 73 Cb 0.00 -2.57 0.31 0.00 2.01 0.00 0.00 34.83 34.57 1hra s MET 73 CO 0.00 0.20 1.27 0.45 -0.01 0.00 0.00 175.02 176.94 1hra n SER 74 N 0.06 5.58 -4.32 3.03 2.88 -1.20 -4.10 113.62 115.54 1hra n SER 74 Ca 0.02 -3.56 -0.46 0.00 -1.33 0.00 0.00 58.87 53.54 1hra n SER 74 Cb 0.52 -0.93 -0.05 0.00 -0.75 0.00 0.00 64.21 63.00 1hra n SER 74 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1hra s LYS 75 N -3.30 2.99 0.00 -1.46 -0.14 -1.26 -4.94 119.74 111.63 1hra s LYS 75 Ca 0.40 -1.65 0.00 0.00 -1.36 0.00 0.00 55.97 53.36 1hra s LYS 75 Cb 0.17 -4.27 0.00 0.00 -1.68 0.00 0.00 37.83 32.05 1hra s LYS 75 CO -0.04 -1.28 0.00 -1.91 -0.76 0.00 0.00 175.35 171.36 1hra n GLU 76 N 5.24 0.00 -3.66 1.68 2.13 -1.26 -4.77 120.64 120.01 1hra n GLU 76 Ca -0.14 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.33 1hra n GLU 76 Cb 0.41 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.05 1hra n GLU 76 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1hra s SER 77 N -0.02 5.87 -0.17 4.31 0.15 -1.26 -5.05 113.70 117.53 1hra s SER 77 Ca 0.00 -3.66 -0.03 0.00 0.70 0.00 0.00 55.95 52.96 1hra s SER 77 Cb 0.00 -1.89 -0.02 0.00 -1.71 0.00 0.00 66.02 62.40 1hra s SER 77 CO 0.00 -0.19 -0.05 0.54 1.20 0.00 0.00 173.24 174.73 1hra s VAL 78 N -1.25 3.61 -0.75 4.45 0.11 -1.26 -1.49 120.40 123.82 1hra s VAL 78 Ca 0.26 -0.45 0.03 0.00 -2.93 0.00 0.00 61.98 58.90 1hra s VAL 78 Cb -0.08 -2.59 0.29 0.00 -1.53 0.00 0.00 36.38 32.48 1hra s VAL 78 CO -0.12 0.48 1.06 0.54 -3.33 0.00 0.00 175.10 173.73 1hra n ARG 79 N 3.88 3.41 0.00 1.54 1.74 -1.26 -3.20 116.66 122.77 1hra n ARG 79 Ca -0.18 -4.71 0.00 0.00 -0.77 0.00 0.00 57.85 52.19 1hra n ARG 79 Cb 0.52 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.64 1hra n ARG 79 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38