#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hnu n ARG 8 N 0.00 -4.93 -3.22 7.34 0.63 -1.26 -4.04 116.66 111.18 2hnu n ARG 8 Ca 0.00 3.60 -0.35 0.00 -0.92 0.00 0.00 57.85 60.18 2hnu n ARG 8 Cb 0.00 -4.00 -0.06 0.00 0.45 0.00 0.00 32.46 28.85 2hnu n ARG 8 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2hnu s THR 9 N -2.54 4.71 1.17 5.15 2.01 -1.26 -1.00 115.64 123.88 2hnu s THR 9 Ca 0.00 1.02 -0.16 0.00 0.31 0.00 0.00 61.69 62.86 2hnu s THR 9 Cb 0.00 -3.76 0.27 0.00 0.01 0.00 0.00 72.50 69.02 2hnu s THR 9 CO 0.00 0.13 1.05 0.00 -0.69 0.00 0.00 174.62 175.12 2hnu s LEU 11 N -7.01 3.58 0.63 0.00 1.43 -1.26 -4.60 118.68 111.45 2hnu s LEU 11 Ca 0.68 2.54 -0.13 0.00 -1.03 0.00 0.00 54.13 56.19 2hnu s LEU 11 Cb -0.17 -4.61 -0.02 0.00 0.03 0.00 0.00 46.19 41.41 2hnu s LEU 11 CO 0.59 -1.91 1.04 -2.16 0.23 0.00 0.00 176.35 174.14 2hnu s PRO 12 N -3.40 3.31 0.22 1.29 0.04 -1.26 -0.73 135.00 134.46 2hnu s PRO 12 Ca 0.81 0.96 -0.22 0.00 0.04 0.00 0.00 61.00 62.58 2hnu s PRO 12 Cb -0.35 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.21 2hnu s PRO 12 CO 0.38 -0.80 0.91 0.00 0.04 0.00 0.00 177.00 177.53 2hnu n GLY 14 N -0.53 -2.08 3.47 0.00 0.00 -1.21 -0.75 105.19 104.09 2hnu n GLY 14 Ca -0.05 -1.38 -0.61 0.00 0.00 0.00 0.00 46.02 43.97 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 -2.04 0.25 -2.47 1.61 -0.02 -1.26 -0.14 135.00 130.92 2hnu n PRO 15 Ca 0.00 0.08 -0.19 0.00 -2.02 0.00 0.00 63.50 61.38 2hnu n PRO 15 Cb 0.22 -1.68 -0.01 0.00 -0.02 0.00 0.00 33.50 32.02 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 6.03 -0.50 2.47 -1.23 0.00 -1.26 -1.98 105.19 108.72 2hnu n GLY 16 Ca 0.43 0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.99 -0.50 0.10 -0.02 0.00 0.80 -4.81 105.19 99.77 2hnu n GLY 17 Ca -0.21 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.83 0.25 -2.96 1.61 5.02 -0.84 -4.30 118.16 114.12 2hnu n LYS 18 Ca -0.14 0.22 -0.19 0.00 -2.02 0.00 0.00 58.31 56.19 2hnu n LYS 18 Cb 0.61 -1.80 0.04 0.00 -0.02 0.00 0.00 35.03 33.85 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 -3.56 1.85 0.04 0.72 0.00 0.07 -4.74 107.32 101.69 2hnu s GLY 19 Ca 0.10 -1.81 0.03 0.00 0.00 0.00 0.00 44.72 43.05 2hnu s GLY 19 CO 0.58 -1.50 -0.10 0.50 0.00 0.00 0.00 173.10 172.59 2hnu s ARG 20 N -4.55 0.67 0.05 2.90 1.81 0.18 -1.24 118.95 118.78 2hnu s ARG 20 Ca 0.58 -0.73 -0.30 0.00 -1.72 0.00 0.00 55.73 53.56 2hnu s ARG 20 Cb -0.08 -0.56 -0.05 0.00 -0.45 0.00 0.00 34.95 33.81 2hnu s ARG 20 CO 0.36 0.13 1.06 0.00 -0.68 0.00 0.00 175.30 176.17 2hnu n PHE 22 N 3.58 0.00 -3.81 0.00 3.01 0.30 -4.57 117.46 115.97 2hnu n PHE 22 Ca 0.06 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.44 2hnu n PHE 22 Cb 0.49 -0.12 -0.03 0.00 -0.01 0.00 0.00 39.48 39.81 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 -2.56 -0.08 0.62 1.37 0.00 -1.15 -3.43 107.32 102.09 2hnu s GLY 23 Ca -0.00 -0.28 0.31 0.00 0.00 0.00 0.00 44.72 44.76 2hnu s GLY 23 CO 0.41 -0.14 2.09 -0.56 0.00 0.00 0.00 173.10 174.90 2hnu h PRO 24 N 2.05 0.00 0.00 2.90 0.13 -1.76 -2.45 132.00 132.87 2hnu h PRO 24 Ca -0.23 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.82 2hnu h PRO 24 Cb 1.26 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.21 2hnu h PRO 24 CO 0.28 0.00 -0.73 -1.13 -0.23 0.00 0.00 178.00 176.19 2hnu n SER 25 N -3.52 1.33 -3.81 1.44 3.41 -1.26 -2.35 113.62 108.87 2hnu n SER 25 Ca 0.01 -2.90 -0.25 0.00 -0.26 0.00 0.00 58.87 55.46 2hnu n SER 25 Cb 0.33 -0.40 -0.17 0.00 -0.26 0.00 0.00 64.21 63.71 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 -1.58 0.64 -0.19 -1.33 1.01 -0.92 -0.21 121.20 118.62 2hnu s ILE 26 Ca 0.34 -0.19 0.01 0.00 0.00 0.00 0.00 60.65 60.81 2hnu s ILE 26 Cb 0.36 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 42.01 2hnu s ILE 26 CO -0.11 0.18 -0.18 0.00 0.00 0.00 0.00 174.94 174.83 2hnu s GLY 29 N -1.85 0.16 0.27 0.00 0.00 0.11 -0.64 107.32 105.37 2hnu s GLY 29 Ca 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 44.72 44.49 2hnu s GLY 29 CO 0.03 -0.23 1.63 -1.80 0.00 0.00 0.00 173.10 172.73 2hnu h ASP 30 N 5.74 -0.20 0.00 1.64 3.58 -1.86 0.63 116.42 125.95 2hnu h ASP 30 Ca -0.27 0.21 -0.24 0.00 0.42 0.00 0.00 57.03 57.15 2hnu h ASP 30 Cb 1.20 0.33 -0.05 0.00 1.72 0.00 0.00 39.33 42.54 2hnu h ASP 30 CO 0.48 -0.19 -2.24 -1.84 -2.88 0.00 0.00 179.24 172.57 2hnu n GLU 31 N -5.31 0.71 0.16 0.28 0.28 -1.26 -2.95 120.64 112.54 2hnu n GLU 31 Ca 0.19 -0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.11 2hnu n GLU 31 Cb 0.61 -1.51 0.26 0.00 1.43 0.00 0.00 31.44 32.23 2hnu n GLU 31 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2hnu h LEU 32 N 0.00 0.02 0.00 -1.84 3.38 -1.80 -3.50 115.31 111.57 2hnu h LEU 32 Ca -0.35 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2hnu h LEU 32 Cb 1.80 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.55 2hnu h LEU 32 CO 0.02 0.51 0.00 0.61 0.09 0.00 0.00 178.44 179.67 2hnu n GLY 33 N -0.11 -1.67 3.19 0.83 0.00 0.16 -4.83 105.19 102.76 2hnu n GLY 33 Ca -0.02 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 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 0.10 3.15 -0.34 0.00 0.40 0.16 -4.96 117.98 116.50 2hnu s PHE 35 Ca -0.09 -0.31 0.02 0.00 -0.60 0.00 0.00 56.93 55.95 2hnu s PHE 35 Cb -0.14 -2.32 0.09 0.00 0.51 0.00 0.00 43.02 41.16 2hnu s PHE 35 CO 0.05 -0.33 0.05 0.08 0.70 0.00 0.00 175.22 175.76 2hnu s VAL 36 N 1.66 2.57 0.00 -0.44 1.01 -1.26 -0.77 120.40 123.17 2hnu s VAL 36 Ca 0.06 -2.04 0.00 0.00 0.00 0.00 0.00 61.98 60.01 2hnu s VAL 36 Cb -0.16 -2.74 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2hnu s VAL 36 CO 0.07 -0.45 0.00 0.61 0.00 0.00 0.00 175.10 175.32 2hnu n GLY 37 N 4.41 0.46 4.02 4.51 0.00 0.70 -5.02 105.19 114.26 2hnu n GLY 37 Ca -0.03 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.00 2.17 0.37 2.61 -4.23 -1.26 -4.98 115.64 108.32 2hnu s THR 38 Ca 0.00 -0.85 0.07 0.00 -1.18 0.00 0.00 61.69 59.73 2hnu s THR 38 Cb 0.00 -2.31 0.30 0.00 1.34 0.00 0.00 72.50 71.82 2hnu s THR 38 CO 0.00 0.00 1.97 0.00 -0.54 0.00 0.00 174.62 176.05 2hnu h ALA 39 N -0.07 1.75 -0.01 3.99 0.00 -1.98 -1.94 119.26 121.00 2hnu h ALA 39 Ca -0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2hnu h ALA 39 Cb 1.28 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2hnu h ALA 39 CO 0.41 0.14 0.01 0.93 0.00 0.00 0.00 179.25 180.73 2hnu h GLU 40 N 0.69 0.00 -0.02 0.00 3.07 -1.95 -2.72 114.58 113.65 2hnu h GLU 40 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 2hnu h GLU 40 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 2hnu h GLU 40 CO -0.10 0.00 -0.09 0.00 -1.40 0.00 0.00 179.01 177.42 2hnu n ALA 41 N -2.54 2.72 -0.25 3.43 0.00 -0.73 -3.33 120.51 119.80 2hnu n ALA 41 Ca -0.03 -0.55 0.01 0.00 0.00 0.00 0.00 53.44 52.87 2hnu n ALA 41 Cb 0.10 -0.99 0.13 0.00 0.00 0.00 0.00 19.45 18.69 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 3.07 0.54 -2.01 0.00 3.38 -1.46 -1.33 115.31 117.51 2hnu h LEU 42 Ca 0.00 0.05 0.14 0.00 0.09 0.00 0.00 57.88 58.15 2hnu h LEU 42 Cb 0.71 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2hnu h LEU 42 CO 0.00 0.32 0.35 -0.09 0.09 0.00 0.00 178.44 179.11 2hnu h ARG 43 N 0.68 0.00 0.00 1.13 2.43 -1.79 -2.17 114.38 114.65 2hnu h ARG 43 Ca 0.35 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 2hnu h ARG 43 Cb 0.31 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2hnu h ARG 43 CO -0.24 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 178.22 2hnu h GLN 45 N 0.00 0.00 -0.51 0.00 4.20 -0.99 -3.01 115.11 114.80 2hnu h GLN 45 Ca 0.00 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.73 2hnu h GLN 45 Cb 0.16 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 2hnu h GLN 45 CO 0.00 0.06 0.31 0.93 -0.67 0.00 0.00 178.83 179.46 2hnu h GLU 46 N 0.00 0.61 -1.17 1.46 5.08 -1.66 -2.58 114.58 116.32 2hnu h GLU 46 Ca -0.00 -0.04 0.33 0.00 -1.00 0.00 0.00 59.36 58.65 2hnu h GLU 46 Cb 0.48 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.52 2hnu h GLU 46 CO 0.01 0.41 0.80 1.49 -1.00 0.00 0.00 179.01 180.72 2hnu h GLU 47 N 0.63 0.14 -0.33 2.33 4.57 -1.74 0.13 114.58 120.31 2hnu h GLU 47 Ca 0.20 -0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.47 2hnu h GLU 47 Cb -0.01 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2hnu h GLU 47 CO -0.08 0.09 0.30 -0.91 -1.18 0.00 0.00 179.01 177.23 2hnu h ASN 48 N 0.15 0.00 -0.20 1.04 -0.26 -1.63 -1.57 115.58 113.10 2hnu h ASN 48 Ca 0.61 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.35 2hnu h ASN 48 Cb 2.07 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.33 2hnu h ASN 48 CO -0.14 0.00 0.00 -1.22 -1.06 0.00 0.00 177.43 175.01 2hnu n TYR 49 N -3.99 0.24 -3.14 1.19 4.02 0.45 -4.95 117.16 110.98 2hnu n TYR 49 Ca 0.05 -0.16 -0.39 0.00 -0.01 0.00 0.00 57.90 57.39 2hnu n TYR 49 Cb 0.46 -0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.73 2hnu n TYR 49 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2hnu s LEU 50 N -1.36 4.37 0.45 7.72 1.43 -0.59 -5.00 118.68 125.69 2hnu s LEU 50 Ca 0.27 1.16 0.15 0.00 -1.03 0.00 0.00 54.13 54.68 2hnu s LEU 50 Cb 0.17 -2.98 1.01 0.00 0.03 0.00 0.00 46.19 44.42 2hnu s LEU 50 CO 0.24 0.01 1.98 1.55 0.23 0.00 0.00 176.35 180.36 2hnu h PRO 51 N 6.15 0.00 -6.32 1.29 0.13 -1.92 -3.44 132.00 127.89 2hnu h PRO 51 Ca -0.43 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.14 2hnu h PRO 51 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 2hnu h PRO 51 CO 0.72 0.20 -0.15 -1.54 -0.23 0.00 0.00 178.00 177.00 2hnu s SER 52 N -6.92 6.66 0.56 1.44 1.04 -1.26 -5.06 113.70 110.16 2hnu s SER 52 Ca -0.04 0.90 -0.17 0.00 0.48 0.00 0.00 55.95 57.12 2hnu s SER 52 Cb 0.15 -2.22 -0.05 0.00 0.10 0.00 0.00 66.02 64.00 2hnu s SER 52 CO 0.69 0.03 1.03 -2.16 0.98 0.00 0.00 173.24 173.82 2hnu s PRO 53 N -2.42 3.55 0.16 4.02 0.04 -1.26 -5.06 135.00 134.04 2hnu s PRO 53 Ca 0.42 1.16 0.03 0.00 0.04 0.00 0.00 61.00 62.64 2hnu s PRO 53 Cb -0.13 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 2hnu s PRO 53 CO 0.20 -0.61 -0.03 0.00 0.04 0.00 0.00 177.00 176.60 2hnu s GLN 55 N -3.86 0.22 -0.03 0.00 0.74 -0.17 -4.84 119.66 111.73 2hnu s GLN 55 Ca 0.21 0.47 0.10 0.00 0.05 0.00 0.00 55.36 56.19 2hnu s GLN 55 Cb 0.05 -0.06 -0.15 0.00 1.10 0.00 0.00 33.01 33.95 2hnu s GLN 55 CO 0.03 -0.13 0.19 0.43 -0.55 0.00 0.00 175.29 175.26 2hnu n SER 56 N 3.91 2.66 -4.06 6.67 7.64 -1.26 -3.50 113.62 125.68 2hnu n SER 56 Ca -0.22 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.36 2hnu n SER 56 Cb 0.54 1.34 0.22 0.00 -1.01 0.00 0.00 64.21 65.31 2hnu n SER 56 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2hnu s GLY 57 N -3.35 1.58 -0.03 0.23 0.00 -1.26 -4.97 107.32 99.51 2hnu s GLY 57 Ca -0.04 -0.79 0.01 0.00 0.00 0.00 0.00 44.72 43.91 2hnu s GLY 57 CO 0.42 0.02 -0.01 -1.06 0.00 0.00 0.00 173.10 172.47 2hnu n GLN 58 N -4.62 1.90 -4.40 2.90 3.00 -1.26 -4.99 117.38 109.91 2hnu n GLN 58 Ca 0.11 0.01 -0.21 0.00 -0.01 0.00 0.00 57.00 56.90 2hnu n GLN 58 Cb 0.59 -1.07 -0.16 0.00 0.00 0.00 0.00 30.24 29.60 2hnu n GLN 58 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 2hnu s LYS 59 N -2.07 1.00 0.53 -1.09 2.20 -1.26 -5.02 119.74 114.02 2hnu s LYS 59 Ca -0.03 -0.31 -0.20 0.00 -0.36 0.00 0.00 55.97 55.07 2hnu s LYS 59 Cb 0.01 -0.93 -0.06 0.00 -1.51 0.00 0.00 37.83 35.34 2hnu s LYS 59 CO 0.10 0.11 1.13 -1.25 -0.36 0.00 0.00 175.35 175.08 2hnu s PRO 60 N 0.21 3.45 0.21 4.03 0.04 -1.26 -0.60 135.00 141.07 2hnu s PRO 60 Ca -0.03 1.62 -0.21 0.00 0.04 0.00 0.00 61.00 62.41 2hnu s PRO 60 Cb -0.09 -2.07 0.04 0.00 0.04 0.00 0.00 34.50 32.42 2hnu s PRO 60 CO 0.01 -0.77 0.62 0.00 0.04 0.00 0.00 177.00 176.89 2hnu n GLY 62 N -0.39 1.19 3.38 0.00 0.00 -1.26 -2.00 105.19 106.11 2hnu n GLY 62 Ca -0.11 -0.41 -0.45 0.00 0.00 0.00 0.00 46.02 45.05 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 6.17 -1.45 1.61 0.15 -1.26 -4.44 113.70 110.48 2hnu s SER 63 Ca 0.00 -1.34 -0.09 0.00 0.70 0.00 0.00 55.95 55.22 2hnu s SER 63 Cb 0.00 -2.22 0.03 0.00 -1.71 0.00 0.00 66.02 62.12 2hnu s SER 63 CO 0.00 -0.77 0.93 0.61 1.20 0.00 0.00 173.24 175.21 2hnu n GLY 64 N 5.21 -0.53 3.60 9.45 0.00 -1.26 -4.90 105.19 116.78 2hnu n GLY 64 Ca -0.11 0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.09 2.64 0.01 -0.02 0.00 -0.85 -4.57 107.32 101.45 2hnu s GLY 65 Ca 0.51 -1.25 -0.02 0.00 0.00 0.00 0.00 44.72 43.96 2hnu s GLY 65 CO 0.63 -2.00 0.02 0.50 0.00 0.00 0.00 173.10 172.26 2hnu s ARG 66 N -3.80 0.31 -0.07 2.90 0.52 0.21 -1.11 118.95 117.90 2hnu s ARG 66 Ca 0.22 -0.44 -0.29 0.00 -0.52 0.00 0.00 55.73 54.70 2hnu s ARG 66 Cb 0.04 0.12 -0.07 0.00 0.52 0.00 0.00 34.95 35.56 2hnu s ARG 66 CO 0.11 -0.06 1.98 0.00 0.02 0.00 0.00 175.30 177.35 2hnu n ALA 68 N 8.79 1.45 -2.78 0.00 0.00 -0.06 -4.01 120.51 123.90 2hnu n ALA 68 Ca 0.22 -1.18 -0.12 0.00 0.00 0.00 0.00 53.44 52.36 2hnu n ALA 68 Cb 0.43 -0.14 -0.06 0.00 0.00 0.00 0.00 19.45 19.67 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 -2.51 0.60 -0.34 0.00 0.00 -1.13 -3.96 121.76 114.42 2hnu s ALA 69 Ca -0.26 -1.39 -0.35 0.00 0.00 0.00 0.00 51.96 49.96 2hnu s ALA 69 Cb 0.08 1.20 -0.11 0.00 0.00 0.00 0.00 23.12 24.29 2hnu s ALA 69 CO 0.68 -0.76 2.19 0.00 0.00 0.00 0.00 175.76 177.87 2hnu n ALA 70 N -0.44 1.10 -1.40 0.00 0.00 -1.15 -0.60 120.51 118.03 2hnu n ALA 70 Ca 0.01 -0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.28 2hnu n ALA 70 Cb 0.63 -2.56 -0.04 0.00 0.00 0.00 0.00 19.45 17.48 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 6.53 1.12 2.99 0.00 0.00 -0.63 -4.87 105.19 110.34 2hnu n GLY 71 Ca 0.41 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.42 0.98 -0.14 -0.61 1.01 0.24 -0.39 121.20 119.87 2hnu s ILE 72 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 60.65 60.22 2hnu s ILE 72 Cb 0.00 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.53 2hnu s ILE 72 CO 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 174.94 175.23 2hnu s SER 75 N -1.48 4.17 0.39 0.00 1.04 0.11 -0.62 113.70 117.30 2hnu s SER 75 Ca -0.04 -1.54 0.27 0.00 0.48 0.00 0.00 55.95 55.12 2hnu s SER 75 Cb -0.09 0.34 1.38 0.00 0.10 0.00 0.00 66.02 67.75 2hnu s SER 75 CO 0.01 -0.81 1.82 -0.65 0.98 0.00 0.00 173.24 174.59 2hnu h PRO 76 N 1.34 0.00 -0.04 4.02 0.11 -1.83 -2.99 132.00 132.61 2hnu h PRO 76 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 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 0.73 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.12 2hnu n ASP 77 N -2.45 1.70 -3.61 -2.05 5.75 -1.26 -4.18 116.55 110.45 2hnu n ASP 77 Ca -0.01 -1.55 -0.01 0.00 -0.01 0.00 0.00 54.79 53.21 2hnu n ASP 77 Cb 0.09 -0.03 -0.01 0.00 -1.03 0.00 0.00 41.12 40.14 2hnu n ASP 77 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2hnu s GLY 78 N -0.60 -0.36 0.04 6.12 0.00 -1.13 -5.15 107.32 106.25 2hnu s GLY 78 Ca 0.04 1.16 0.02 0.00 0.00 0.00 0.00 44.72 45.94 2hnu s GLY 78 CO 0.03 0.33 -0.07 0.00 0.00 0.00 0.00 173.10 173.39 2hnu s HIS 80 N -1.58 -0.43 0.34 0.00 -3.43 0.82 -4.98 115.29 106.03 2hnu s HIS 80 Ca -0.09 0.87 -0.29 0.00 -0.80 0.00 0.00 55.06 54.75 2hnu s HIS 80 Cb -0.09 0.21 -0.11 0.00 -1.43 0.00 0.00 32.58 31.16 2hnu s HIS 80 CO -0.00 -0.40 1.54 0.39 -2.00 0.00 0.00 174.74 174.26 2hnu n GLU 81 N 1.71 2.70 -3.41 -0.38 1.02 -1.26 -0.76 120.64 120.26 2hnu n GLU 81 Ca -0.18 0.95 -0.07 0.00 -0.02 0.00 0.00 57.16 57.84 2hnu n GLU 81 Cb 0.56 -2.71 -0.07 0.00 -0.02 0.00 0.00 31.44 29.20 2hnu n GLU 81 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2hnu s ASP 82 N 0.15 -0.11 0.59 1.62 -1.08 0.48 -4.80 116.67 113.51 2hnu s ASP 82 Ca 0.58 0.52 0.28 0.00 -0.52 0.00 0.00 52.55 53.41 2hnu s ASP 82 Cb -0.48 1.32 1.72 0.00 -1.46 0.00 0.00 42.92 44.02 2hnu s ASP 82 CO 0.57 -0.28 2.18 1.55 0.52 0.00 0.00 175.17 179.72 2hnu h PRO 83 N 8.16 0.00 0.00 4.34 0.13 -1.95 0.13 132.00 142.80 2hnu h PRO 83 Ca -0.19 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2hnu h PRO 83 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 2hnu h PRO 83 CO 0.23 0.00 -0.00 0.00 -0.23 0.00 0.00 178.00 178.00 2hnu h ALA 84 N 1.89 1.14 -0.03 -0.56 0.00 -1.95 -0.28 119.26 119.47 2hnu h ALA 84 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2hnu h ALA 84 Cb 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2hnu h ALA 84 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2hnu s ASP 86 N -1.98 4.64 0.00 0.00 1.01 -0.12 -1.60 116.67 118.62 2hnu s ASP 86 Ca 0.34 2.55 0.00 0.00 0.71 0.00 0.00 52.55 56.14 2hnu s ASP 86 Cb 0.21 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2hnu s ASP 86 CO 0.32 -1.97 0.33 -2.65 0.21 0.00 0.00 175.17 171.41