#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hnu s ARG 8 N 0.00 2.08 0.56 7.34 1.70 -1.26 -4.65 118.95 124.72 2hnu s ARG 8 Ca 0.00 1.68 -0.17 0.00 -0.47 0.00 0.00 55.73 56.77 2hnu s ARG 8 Cb 0.00 -1.84 -0.05 0.00 -0.57 0.00 0.00 34.95 32.49 2hnu s ARG 8 CO 0.00 -1.86 1.05 0.99 -1.08 0.00 0.00 175.30 174.40 2hnu s THR 9 N -2.13 3.85 0.99 4.99 2.01 -1.25 -1.00 115.64 123.11 2hnu s THR 9 Ca 0.72 0.95 -0.14 0.00 0.31 0.00 0.00 61.69 63.53 2hnu s THR 9 Cb -0.27 -3.42 0.19 0.00 0.01 0.00 0.00 72.50 69.00 2hnu s THR 9 CO 0.47 -0.45 1.13 0.00 -0.69 0.00 0.00 174.62 175.07 2hnu n LEU 11 N -4.08 2.33 -4.76 0.00 4.77 -1.26 -4.50 117.00 109.49 2hnu n LEU 11 Ca 0.07 1.01 -0.30 0.00 -0.03 0.00 0.00 56.01 56.77 2hnu n LEU 11 Cb 0.59 -1.32 0.11 0.00 -2.33 0.00 0.00 43.42 40.46 2hnu n LEU 11 CO 0.55 -1.67 0.69 -2.84 -1.33 0.00 0.00 177.39 172.79 2hnu s PRO 12 N -1.98 1.85 0.12 3.23 0.02 -1.26 -1.40 135.00 135.58 2hnu s PRO 12 Ca 0.64 0.84 -0.26 0.00 0.02 0.00 0.00 61.00 62.24 2hnu s PRO 12 Cb -0.56 -1.88 0.08 0.00 0.02 0.00 0.00 34.50 32.16 2hnu s PRO 12 CO 0.56 -1.84 1.05 0.00 -0.33 0.00 0.00 177.00 176.45 2hnu n GLY 14 N -0.53 -2.15 3.68 0.00 0.00 -1.18 -0.21 105.19 104.79 2hnu n GLY 14 Ca -0.06 -1.46 -0.53 0.00 0.00 0.00 0.00 46.02 43.98 2hnu n GLY 14 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hnu n PRO 15 N -0.93 1.61 -1.16 1.61 -0.02 -1.26 -0.74 135.00 134.10 2hnu n PRO 15 Ca 0.00 0.58 -0.06 0.00 -2.02 0.00 0.00 63.50 62.01 2hnu n PRO 15 Cb 0.04 -2.39 -0.02 0.00 -0.02 0.00 0.00 33.50 31.11 2hnu n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hnu n GLY 16 N 4.53 0.65 2.52 -1.23 0.00 -1.26 -2.16 105.19 108.23 2hnu n GLY 16 Ca 0.26 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 2hnu n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hnu n GLY 17 N -0.42 1.20 0.00 -0.02 0.00 0.08 -4.86 105.19 101.17 2hnu n GLY 17 Ca -0.06 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.87 2hnu n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hnu n LYS 18 N -1.93 0.72 -3.80 1.61 5.02 -0.92 -4.22 118.16 114.63 2hnu n LYS 18 Ca -0.11 0.01 -0.22 0.00 -2.02 0.00 0.00 58.31 55.96 2hnu n LYS 18 Cb 0.47 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.93 2hnu n LYS 18 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2hnu s GLY 19 N -2.11 2.19 0.05 0.72 0.00 0.70 -4.62 107.32 104.24 2hnu s GLY 19 Ca 0.36 -1.96 0.03 0.00 0.00 0.00 0.00 44.72 43.15 2hnu s GLY 19 CO 0.32 -1.78 -0.10 0.50 0.00 0.00 0.00 173.10 172.04 2hnu s ARG 20 N -4.03 0.64 0.19 2.90 1.81 0.31 -0.44 118.95 120.33 2hnu s ARG 20 Ca 0.45 -0.79 -0.30 0.00 -1.72 0.00 0.00 55.73 53.37 2hnu s ARG 20 Cb -0.01 -0.51 -0.08 0.00 -0.45 0.00 0.00 34.95 33.90 2hnu s ARG 20 CO 0.26 0.11 1.01 0.00 -0.68 0.00 0.00 175.30 176.00 2hnu n PHE 22 N 2.13 0.00 -3.62 0.00 3.01 0.14 -4.46 117.46 114.65 2hnu n PHE 22 Ca 0.01 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.48 2hnu n PHE 22 Cb 0.47 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.94 2hnu n PHE 22 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2hnu s GLY 23 N -0.93 -0.41 0.41 1.37 0.00 -1.21 -3.30 107.32 103.25 2hnu s GLY 23 Ca 0.03 0.69 0.22 0.00 0.00 0.00 0.00 44.72 45.66 2hnu s GLY 23 CO 0.12 0.12 1.72 -2.55 0.00 0.00 0.00 173.10 172.51 2hnu h PRO 24 N 2.00 0.28 -0.39 2.90 0.11 -1.73 -2.30 132.00 132.87 2hnu h PRO 24 Ca -0.30 -0.02 -0.29 0.00 0.11 0.00 0.00 66.00 65.50 2hnu h PRO 24 Cb 1.20 -0.06 -0.35 0.00 0.11 0.00 0.00 31.00 31.90 2hnu h PRO 24 CO 0.28 0.19 -0.93 -1.13 -0.21 0.00 0.00 178.00 176.20 2hnu n SER 25 N -4.67 2.51 -3.81 -2.05 3.41 -1.26 -1.80 113.62 105.94 2hnu n SER 25 Ca 0.29 -2.81 -0.25 0.00 -0.26 0.00 0.00 58.87 55.84 2hnu n SER 25 Cb 1.06 -0.41 -0.17 0.00 -0.26 0.00 0.00 64.21 64.42 2hnu n SER 25 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2hnu s ILE 26 N -3.29 0.63 -0.15 -1.33 1.01 -0.87 -0.24 121.20 116.97 2hnu s ILE 26 Ca 0.37 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.85 2hnu s ILE 26 Cb 0.37 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 42.03 2hnu s ILE 26 CO -0.04 0.18 -0.18 0.00 0.00 0.00 0.00 174.94 174.90 2hnu s GLY 29 N -2.59 -0.31 0.32 0.00 0.00 -0.78 -0.53 107.32 103.43 2hnu s GLY 29 Ca 0.05 0.82 0.04 0.00 0.00 0.00 0.00 44.72 45.63 2hnu s GLY 29 CO -0.03 0.58 1.90 -0.55 0.00 0.00 0.00 173.10 175.00 2hnu h ASP 30 N 4.01 0.80 -0.58 1.64 3.32 -1.85 0.01 116.42 123.78 2hnu h ASP 30 Ca -0.28 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.79 2hnu h ASP 30 Cb 1.17 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.57 2hnu h ASP 30 CO 0.35 0.47 0.00 -0.62 -1.72 0.00 0.00 179.24 177.73 2hnu n GLU 31 N -4.52 3.28 0.00 3.56 1.02 -1.26 -4.40 120.64 118.32 2hnu n GLU 31 Ca 0.15 -2.47 0.00 0.00 -0.02 0.00 0.00 57.16 54.82 2hnu n GLU 31 Cb 0.30 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 2hnu n GLU 31 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2hnu n LEU 32 N 1.01 0.41 0.00 -4.62 4.77 -0.49 -5.15 117.00 112.94 2hnu n LEU 32 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2hnu n LEU 32 Cb 0.76 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 2hnu n LEU 32 CO 0.20 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 2hnu n GLY 33 N 2.18 -1.53 3.21 -0.72 0.00 -0.13 -4.89 105.19 103.31 2hnu n GLY 33 Ca 0.00 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.93 2hnu n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnu s PHE 35 N -0.12 3.10 -0.31 0.00 0.40 0.16 -4.97 117.98 116.23 2hnu s PHE 35 Ca -0.02 -0.56 0.01 0.00 -0.60 0.00 0.00 56.93 55.76 2hnu s PHE 35 Cb -0.12 -2.25 0.07 0.00 0.51 0.00 0.00 43.02 41.24 2hnu s PHE 35 CO 0.03 -0.42 0.00 0.08 0.70 0.00 0.00 175.22 175.61 2hnu s VAL 36 N 1.59 2.58 0.00 -0.44 1.01 -1.26 -0.57 120.40 123.31 2hnu s VAL 36 Ca 0.06 -1.81 0.00 0.00 0.00 0.00 0.00 61.98 60.23 2hnu s VAL 36 Cb -0.16 -2.64 0.00 0.00 0.00 0.00 0.00 36.38 33.58 2hnu s VAL 36 CO 0.03 -0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.45 2hnu n GLY 37 N 4.46 0.63 3.96 4.51 0.00 0.67 -5.02 105.19 114.40 2hnu n GLY 37 Ca -0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 2hnu n GLY 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hnu s THR 38 N -2.45 2.85 0.33 2.61 -4.23 -1.26 -4.96 115.64 108.53 2hnu s THR 38 Ca 0.00 -0.53 0.07 0.00 -1.18 0.00 0.00 61.69 60.05 2hnu s THR 38 Cb 0.00 -3.10 0.31 0.00 1.34 0.00 0.00 72.50 71.05 2hnu s THR 38 CO 0.00 -0.08 1.86 0.00 -0.54 0.00 0.00 174.62 175.86 2hnu h ALA 39 N -0.02 1.74 -0.23 3.99 0.00 -1.98 0.14 119.26 122.91 2hnu h ALA 39 Ca -0.43 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.56 2hnu h ALA 39 Cb 1.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2hnu h ALA 39 CO 0.55 0.01 0.25 0.93 0.00 0.00 0.00 179.25 180.99 2hnu h GLU 40 N 0.78 0.00 -0.42 0.00 3.07 -1.96 -2.16 114.58 113.88 2hnu h GLU 40 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 2hnu h GLU 40 Cb 0.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 2hnu h GLU 40 CO -0.23 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.38 2hnu n ALA 41 N -2.33 2.39 -0.27 3.43 0.00 0.03 -3.13 120.51 120.63 2hnu n ALA 41 Ca 0.03 -1.04 -0.01 0.00 0.00 0.00 0.00 53.44 52.41 2hnu n ALA 41 Cb 0.38 -0.80 0.17 0.00 0.00 0.00 0.00 19.45 19.21 2hnu n ALA 41 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hnu h LEU 42 N 4.04 0.98 -2.20 0.00 3.38 -1.39 -1.86 115.31 118.26 2hnu h LEU 42 Ca 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2hnu h LEU 42 Cb 0.93 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2hnu h LEU 42 CO 0.00 0.76 -0.02 -0.09 0.09 0.00 0.00 178.44 179.18 2hnu h ARG 43 N 1.13 0.00 0.00 1.13 2.43 -1.80 -2.42 114.38 114.85 2hnu h ARG 43 Ca 0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2hnu h ARG 43 Cb -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2hnu h ARG 43 CO -0.06 0.02 0.00 0.00 -1.51 0.00 0.00 179.97 178.42 2hnu h GLN 45 N 0.00 0.00 0.00 0.00 4.20 -0.82 -3.13 115.11 115.36 2hnu h GLN 45 Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2hnu h GLN 45 Cb 0.25 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 2hnu h GLN 45 CO 0.00 0.22 -0.12 0.93 -0.67 0.00 0.00 178.83 179.19 2hnu h GLU 46 N 0.00 0.00 -0.09 1.46 4.39 -1.45 -2.02 114.58 116.86 2hnu h GLU 46 Ca -0.00 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.72 2hnu h GLU 46 Cb 0.92 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.57 2hnu h GLU 46 CO 0.03 0.12 0.08 1.49 -1.16 0.00 0.00 179.01 179.57 2hnu h GLU 47 N 0.00 0.00 0.00 2.33 4.57 -1.69 -0.30 114.58 119.49 2hnu h GLU 47 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2hnu h GLU 47 Cb 0.35 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 2hnu h GLU 47 CO 0.02 0.00 -0.02 -0.91 -1.18 0.00 0.00 179.01 176.91 2hnu h ASN 48 N 0.00 0.00 1.13 1.04 -0.26 -1.58 -1.45 115.58 114.46 2hnu h ASN 48 Ca 0.04 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.78 2hnu h ASN 48 Cb 0.20 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.46 2hnu h ASN 48 CO -0.00 0.02 -0.47 1.88 -1.06 0.00 0.00 177.43 177.81 2hnu h TYR 49 N 0.00 0.00 -3.29 1.19 -1.99 -1.23 -3.45 116.97 108.19 2hnu h TYR 49 Ca -0.00 0.00 -0.59 0.00 2.00 0.00 0.00 58.73 60.14 2hnu h TYR 49 Cb 0.06 0.00 -0.08 0.00 2.00 0.00 0.00 36.73 38.71 2hnu h TYR 49 CO 0.00 0.00 0.43 -0.51 -0.00 0.00 0.00 178.16 178.08 2hnu s LEU 50 N -4.61 4.11 0.00 3.88 1.43 -0.55 -4.94 118.68 118.00 2hnu s LEU 50 Ca 0.07 1.07 0.15 0.00 -1.03 0.00 0.00 54.13 54.39 2hnu s LEU 50 Cb 0.12 -3.19 0.77 0.00 0.03 0.00 0.00 46.19 43.92 2hnu s LEU 50 CO 0.70 -0.47 1.43 -0.81 0.23 0.00 0.00 176.35 177.42 2hnu n PRO 51 N 5.74 0.22 -3.95 1.29 -0.04 -1.26 -4.76 135.00 132.24 2hnu n PRO 51 Ca 0.05 0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 63.31 2hnu n PRO 51 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2hnu n PRO 51 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2hnu s SER 52 N -2.57 6.22 0.57 3.54 1.04 -1.26 -5.09 113.70 116.15 2hnu s SER 52 Ca 0.14 0.33 -0.18 0.00 0.48 0.00 0.00 55.95 56.73 2hnu s SER 52 Cb 0.10 -1.93 -0.04 0.00 0.10 0.00 0.00 66.02 64.25 2hnu s SER 52 CO 0.23 0.30 1.09 -2.16 0.98 0.00 0.00 173.24 173.68 2hnu s PRO 53 N -1.69 3.29 0.05 4.02 0.04 -1.26 -5.06 135.00 134.38 2hnu s PRO 53 Ca 0.24 1.43 -0.01 0.00 0.04 0.00 0.00 61.00 62.69 2hnu s PRO 53 Cb -0.12 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 2hnu s PRO 53 CO 0.14 -0.87 -0.02 0.00 0.04 0.00 0.00 177.00 176.29 2hnu s GLN 55 N -3.85 0.65 0.31 0.00 0.74 -0.17 -4.85 119.66 112.49 2hnu s GLN 55 Ca 0.06 1.05 0.08 0.00 0.05 0.00 0.00 55.36 56.60 2hnu s GLN 55 Cb 0.07 0.16 -0.04 0.00 1.10 0.00 0.00 33.01 34.30 2hnu s GLN 55 CO -0.10 -0.14 0.17 -1.12 -0.55 0.00 0.00 175.29 173.56 2hnu s SER 56 N 1.28 4.97 0.00 6.67 0.01 -1.26 -3.82 113.70 121.54 2hnu s SER 56 Ca -0.08 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.59 2hnu s SER 56 Cb -0.06 -0.92 0.00 0.00 0.21 0.00 0.00 66.02 65.25 2hnu s SER 56 CO -0.13 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 173.90 2hnu n GLY 57 N -1.18 -0.67 0.00 3.44 0.00 -1.26 -4.88 105.19 100.64 2hnu n GLY 57 Ca -0.04 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.25 2hnu n GLY 57 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hnu n GLN 58 N -0.71 1.34 -4.06 1.61 6.02 -1.26 -5.03 117.38 115.29 2hnu n GLN 58 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 2hnu n GLN 58 Cb 0.00 -0.74 -0.13 0.00 1.02 0.00 0.00 30.24 30.40 2hnu n GLN 58 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2hnu s LYS 59 N -1.48 3.62 0.61 -1.09 2.20 -1.26 -5.00 119.74 117.34 2hnu s LYS 59 Ca 0.00 -0.52 -0.18 0.00 -0.36 0.00 0.00 55.97 54.91 2hnu s LYS 59 Cb 0.00 -3.09 -0.03 0.00 -1.51 0.00 0.00 37.83 33.20 2hnu s LYS 59 CO 0.00 0.01 1.21 -2.14 -0.36 0.00 0.00 175.35 174.06 2hnu s PRO 60 N 1.02 2.89 0.14 4.03 0.02 -1.26 -0.52 135.00 141.32 2hnu s PRO 60 Ca 0.02 1.81 -0.24 0.00 0.02 0.00 0.00 61.00 62.61 2hnu s PRO 60 Cb -0.14 -1.92 0.07 0.00 0.02 0.00 0.00 34.50 32.52 2hnu s PRO 60 CO 0.02 -1.26 0.73 0.00 -0.33 0.00 0.00 177.00 176.15 2hnu n GLY 62 N -0.37 0.96 3.29 0.00 0.00 -1.26 -2.07 105.19 105.73 2hnu n GLY 62 Ca -0.11 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 2hnu n GLY 62 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hnu s SER 63 N -4.00 5.89 -0.80 1.61 0.15 -1.26 -4.42 113.70 110.87 2hnu s SER 63 Ca 0.00 -1.60 0.00 0.00 0.70 0.00 0.00 55.95 55.05 2hnu s SER 63 Cb 0.00 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 2hnu s SER 63 CO 0.00 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.39 2hnu n GLY 64 N 5.05 0.94 3.94 9.45 0.00 -1.26 -4.90 105.19 118.41 2hnu n GLY 64 Ca -0.11 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 2hnu n GLY 64 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2hnu s GLY 65 N -2.71 2.13 -0.01 -0.02 0.00 -0.88 -4.58 107.32 101.25 2hnu s GLY 65 Ca 0.00 -1.65 -0.12 0.00 0.00 0.00 0.00 44.72 42.95 2hnu s GLY 65 CO 0.00 -1.81 0.25 0.50 0.00 0.00 0.00 173.10 172.04 2hnu s ARG 66 N -4.37 0.59 -0.09 2.90 0.52 0.43 -1.90 118.95 117.02 2hnu s ARG 66 Ca 0.45 -0.24 -0.29 0.00 -0.52 0.00 0.00 55.73 55.13 2hnu s ARG 66 Cb -0.04 0.26 -0.06 0.00 0.52 0.00 0.00 34.95 35.64 2hnu s ARG 66 CO 0.28 -0.15 1.82 0.00 0.02 0.00 0.00 175.30 177.26 2hnu n ALA 68 N 8.24 1.98 -3.82 0.00 0.00 -0.07 -4.29 120.51 122.56 2hnu n ALA 68 Ca 0.20 -0.96 -0.07 0.00 0.00 0.00 0.00 53.44 52.61 2hnu n ALA 68 Cb 0.43 -0.35 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 2hnu n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hnu s ALA 69 N -2.80 -1.27 -0.41 0.00 0.00 -1.14 -3.77 121.76 112.37 2hnu s ALA 69 Ca -0.09 -0.22 -0.40 0.00 0.00 0.00 0.00 51.96 51.26 2hnu s ALA 69 Cb 0.08 0.85 -0.15 0.00 0.00 0.00 0.00 23.12 23.90 2hnu s ALA 69 CO 0.79 -1.02 2.13 0.00 0.00 0.00 0.00 175.76 177.67 2hnu n ALA 70 N -0.45 0.59 -1.32 0.00 0.00 -1.26 -0.02 120.51 118.05 2hnu n ALA 70 Ca -0.05 0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.37 2hnu n ALA 70 Cb 0.60 -2.32 -0.05 0.00 0.00 0.00 0.00 19.45 17.68 2hnu n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hnu n GLY 71 N 6.77 1.21 2.99 0.00 0.00 -0.16 -4.89 105.19 111.11 2hnu n GLY 71 Ca 0.46 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 2hnu n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hnu s ILE 72 N -2.36 1.10 -0.18 -0.61 1.01 0.97 -0.92 121.20 120.20 2hnu s ILE 72 Ca 0.00 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.17 2hnu s ILE 72 Cb 0.00 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 2hnu s ILE 72 CO 0.00 0.36 -0.01 0.00 0.00 0.00 0.00 174.94 175.28 2hnu s SER 75 N -0.97 4.33 0.36 0.00 1.04 0.16 -0.43 113.70 118.19 2hnu s SER 75 Ca 0.04 -1.40 0.24 0.00 0.48 0.00 0.00 55.95 55.31 2hnu s SER 75 Cb -0.08 0.25 1.30 0.00 0.10 0.00 0.00 66.02 67.60 2hnu s SER 75 CO 0.01 -0.85 1.74 -0.65 0.98 0.00 0.00 173.24 174.47 2hnu h PRO 76 N 1.19 0.00 0.00 4.02 0.11 -1.80 -2.97 132.00 132.55 2hnu h PRO 76 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2hnu h PRO 76 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2hnu h PRO 76 CO 0.68 0.00 -0.01 -0.40 -0.21 0.00 0.00 178.00 178.06 2hnu n ASP 77 N -2.35 1.83 0.00 -2.05 5.75 -1.26 -4.12 116.55 114.35 2hnu n ASP 77 Ca -0.01 -2.14 0.00 0.00 -0.01 0.00 0.00 54.79 52.63 2hnu n ASP 77 Cb 0.05 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 2hnu n ASP 77 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2hnu n GLY 78 N -0.64 1.27 3.08 6.12 0.00 -1.12 -5.15 105.19 108.75 2hnu n GLY 78 Ca 0.03 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.13 2hnu n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnu s HIS 80 N -1.25 -0.18 0.30 0.00 -3.43 -0.27 -4.98 115.29 105.49 2hnu s HIS 80 Ca -0.07 0.31 -0.29 0.00 -0.80 0.00 0.00 55.06 54.20 2hnu s HIS 80 Cb -0.09 0.08 -0.11 0.00 -1.43 0.00 0.00 32.58 31.03 2hnu s HIS 80 CO 0.01 -0.33 1.49 -1.21 -2.00 0.00 0.00 174.74 172.70 2hnu s GLU 81 N -1.07 4.19 -0.12 -0.38 2.02 -1.26 -1.35 118.70 120.72 2hnu s GLU 81 Ca -0.11 2.46 -0.04 0.00 0.02 0.00 0.00 54.97 57.29 2hnu s GLU 81 Cb -0.05 -3.04 0.06 0.00 0.10 0.00 0.00 34.13 31.20 2hnu s GLU 81 CO 0.03 -0.50 0.24 0.34 0.02 0.00 0.00 175.26 175.39 2hnu s ASP 82 N 0.21 0.46 0.36 -0.19 -1.08 -0.10 -4.83 116.67 111.51 2hnu s ASP 82 Ca 0.58 0.52 0.04 0.00 -0.52 0.00 0.00 52.55 53.17 2hnu s ASP 82 Cb -0.45 0.61 0.69 0.00 -1.46 0.00 0.00 42.92 42.31 2hnu s ASP 82 CO 0.50 -0.24 2.00 1.55 0.52 0.00 0.00 175.17 179.50 2hnu h PRO 83 N 8.30 0.72 0.00 4.34 0.13 -1.95 -0.96 132.00 142.58 2hnu h PRO 83 Ca -0.14 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2hnu h PRO 83 Cb 1.12 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2hnu h PRO 83 CO 0.14 0.50 0.10 0.00 -0.23 0.00 0.00 178.00 178.52 2hnu h ALA 84 N 1.62 1.10 -0.33 -0.56 0.00 -1.96 0.11 119.26 119.24 2hnu h ALA 84 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2hnu h ALA 84 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2hnu h ALA 84 CO -0.04 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.11 2hnu s ASP 86 N -1.50 6.64 0.00 0.00 1.01 0.38 -0.99 116.67 122.20 2hnu s ASP 86 Ca 0.37 2.02 0.00 0.00 0.71 0.00 0.00 52.55 55.64 2hnu s ASP 86 Cb 0.21 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.56 2hnu s ASP 86 CO 0.30 -0.57 0.30 -2.65 0.21 0.00 0.00 175.17 172.75