#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fo5 s SER 1 N 0.00 6.18 -0.08 7.83 0.01 -1.26 -4.97 113.70 121.41 1fo5 s SER 1 Ca 0.00 1.68 -0.03 0.00 1.31 0.00 0.00 55.95 58.90 1fo5 s SER 1 Cb 0.00 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.75 1fo5 s SER 1 CO 0.00 -1.41 0.17 -0.75 0.41 0.00 0.00 173.24 171.66 1fo5 s LYS 2 N 5.05 0.09 -0.45 12.44 2.47 -1.26 -4.68 119.74 133.40 1fo5 s LYS 2 Ca 0.78 0.48 -0.10 0.00 -1.56 0.00 0.00 55.97 55.56 1fo5 s LYS 2 Cb -0.27 -0.19 0.09 0.00 -1.46 0.00 0.00 37.83 36.00 1fo5 s LYS 2 CO 0.32 -0.22 0.31 0.54 0.16 0.00 0.00 175.35 176.46 1fo5 s VAL 3 N 1.62 4.42 0.68 4.02 0.11 -0.15 -4.94 120.40 126.16 1fo5 s VAL 3 Ca -0.05 -1.45 -0.12 0.00 -2.93 0.00 0.00 61.98 57.43 1fo5 s VAL 3 Cb -0.12 -3.75 0.01 0.00 -1.53 0.00 0.00 36.38 30.99 1fo5 s VAL 3 CO -0.06 -0.60 1.07 -0.54 -3.33 0.00 0.00 175.10 171.63 1fo5 s LYS 4 N 1.45 2.87 -0.05 1.54 3.01 -0.52 -1.58 119.74 126.46 1fo5 s LYS 4 Ca 0.04 1.11 -0.04 0.00 -1.01 0.00 0.00 55.97 56.07 1fo5 s LYS 4 Cb -0.24 -1.98 0.01 0.00 -1.01 0.00 0.00 37.83 34.62 1fo5 s LYS 4 CO 0.02 -1.16 0.12 0.42 0.51 0.00 0.00 175.35 175.26 1fo5 s ILE 5 N -2.80 -0.01 0.03 2.17 1.09 0.67 -1.95 121.20 120.41 1fo5 s ILE 5 Ca 0.61 0.02 0.05 0.00 -1.10 0.00 0.00 60.65 60.23 1fo5 s ILE 5 Cb -0.16 -0.18 -0.02 0.00 -1.06 0.00 0.00 42.46 41.04 1fo5 s ILE 5 CO 0.49 0.01 -0.15 -1.61 -0.10 0.00 0.00 174.94 173.58 1fo5 s GLU 6 N 0.18 1.05 -0.37 2.79 2.02 -0.66 -1.20 118.70 122.52 1fo5 s GLU 6 Ca -0.01 -0.72 0.00 0.00 0.02 0.00 0.00 54.97 54.27 1fo5 s GLU 6 Cb -0.02 -1.06 0.14 0.00 0.10 0.00 0.00 34.13 33.29 1fo5 s GLU 6 CO -0.00 0.27 0.22 -0.51 0.02 0.00 0.00 175.26 175.26 1fo5 s LEU 7 N -0.94 1.25 -0.46 1.80 1.43 0.23 -0.63 118.68 121.36 1fo5 s LEU 7 Ca 0.03 -2.28 -0.02 0.00 -1.03 0.00 0.00 54.13 50.83 1fo5 s LEU 7 Cb -0.07 -0.49 0.12 0.00 0.03 0.00 0.00 46.19 45.78 1fo5 s LEU 7 CO 0.01 -0.30 0.26 0.12 0.23 0.00 0.00 176.35 176.67 1fo5 s PHE 8 N 0.93 3.54 -0.05 0.29 2.19 0.45 -1.59 117.98 123.74 1fo5 s PHE 8 Ca 0.18 -2.56 -0.22 0.00 0.33 0.00 0.00 56.93 54.67 1fo5 s PHE 8 Cb -0.22 -3.19 0.07 0.00 -1.31 0.00 0.00 43.02 38.37 1fo5 s PHE 8 CO 0.00 -0.93 0.98 -2.37 1.83 0.00 0.00 175.22 174.73 1fo5 n THR 9 N 4.24 0.00 -2.79 0.12 5.66 -1.18 -1.01 114.28 119.31 1fo5 n THR 9 Ca 0.01 -0.04 -0.09 0.00 -3.05 0.00 0.00 64.05 60.88 1fo5 n THR 9 Cb 0.40 0.38 0.04 0.00 -1.55 0.00 0.00 70.33 69.60 1fo5 n THR 9 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1fo5 n SER 10 N -0.76 -2.62 -4.70 1.09 2.88 -1.26 -1.51 113.62 106.73 1fo5 n SER 10 Ca 0.04 -3.27 -0.42 0.00 -1.33 0.00 0.00 58.87 53.90 1fo5 n SER 10 Cb 0.42 1.62 -0.03 0.00 -0.75 0.00 0.00 64.21 65.48 1fo5 n SER 10 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1fo5 s PRO 11 N 0.52 4.23 -0.41 -1.46 0.04 -1.26 -4.85 135.00 131.81 1fo5 s PRO 11 Ca 0.32 2.28 -0.30 0.00 0.04 0.00 0.00 61.00 63.35 1fo5 s PRO 11 Cb 0.23 -3.37 -0.09 0.00 0.04 0.00 0.00 34.50 31.31 1fo5 s PRO 11 CO -0.23 -0.63 2.32 -0.12 0.04 0.00 0.00 177.00 178.38 1fo5 n MET 12 N 4.69 1.26 0.00 4.56 1.56 -1.26 -1.63 117.12 126.30 1fo5 n MET 12 Ca 0.14 0.24 0.00 0.00 -0.27 0.00 0.00 57.70 57.82 1fo5 n MET 12 Cb 0.40 -2.96 0.00 0.00 2.15 0.00 0.00 33.22 32.81 1fo5 n MET 12 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1fo5 n PRO 14 N 0.00 0.42 -0.27 0.00 -0.04 -1.15 -3.85 135.00 130.11 1fo5 n PRO 14 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1fo5 n PRO 14 Cb 0.00 -1.31 -0.04 0.00 -0.04 0.00 0.00 33.50 32.11 1fo5 n PRO 14 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1fo5 n HIS 15 N -0.81 0.00 0.08 0.54 1.44 -0.65 -3.74 115.22 112.08 1fo5 n HIS 15 Ca 0.06 -0.43 0.00 0.00 -2.01 0.00 0.00 57.72 55.35 1fo5 n HIS 15 Cb 0.03 -0.67 0.00 0.00 0.12 0.00 0.00 29.99 29.47 1fo5 n HIS 15 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fo5 n PRO 17 N -3.05 0.07 0.00 0.00 -0.04 -1.25 -4.51 135.00 126.23 1fo5 n PRO 17 Ca 0.00 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1fo5 n PRO 17 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1fo5 n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fo5 n ALA 18 N -1.41 0.00 0.26 0.55 0.00 -1.26 -0.86 120.51 117.80 1fo5 n ALA 18 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1fo5 n ALA 18 Cb 0.12 0.10 0.73 0.00 0.00 0.00 0.00 19.45 20.39 1fo5 n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fo5 h ALA 19 N -2.06 1.35 0.88 0.00 0.00 -1.95 -1.72 119.26 115.76 1fo5 h ALA 19 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1fo5 h ALA 19 Cb 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1fo5 h ALA 19 CO 0.00 0.14 -0.42 -0.22 0.00 0.00 0.00 179.25 178.75 1fo5 h LYS 20 N 0.00 -1.14 -0.62 0.00 3.11 -1.76 0.27 116.57 116.43 1fo5 h LYS 20 Ca -0.00 0.08 -0.01 0.00 -2.81 0.00 0.00 60.65 57.90 1fo5 h LYS 20 Cb 0.30 0.26 -0.03 0.00 -1.00 0.00 0.00 32.23 31.75 1fo5 h LYS 20 CO 0.01 -0.76 0.34 0.00 -2.81 0.00 0.00 179.45 176.24 1fo5 h ARG 21 N -1.25 0.87 -0.22 1.90 3.08 -0.90 -0.74 114.38 117.10 1fo5 h ARG 21 Ca -0.12 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 59.75 1fo5 h ARG 21 Cb 0.91 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1fo5 h ARG 21 CO 0.20 0.66 -0.21 0.28 -1.07 0.00 0.00 179.97 179.83 1fo5 h VAL 22 N 0.85 1.24 0.00 2.04 2.07 -1.23 0.13 116.25 121.35 1fo5 h VAL 22 Ca 0.22 -1.12 -0.15 0.00 0.82 0.00 0.00 66.70 66.47 1fo5 h VAL 22 Cb 0.04 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1fo5 h VAL 22 CO -0.04 0.35 -0.71 1.62 0.02 0.00 0.00 177.57 178.82 1fo5 h VAL 23 N 0.36 1.25 0.73 2.57 3.04 -0.75 -1.87 116.25 121.58 1fo5 h VAL 23 Ca 0.06 -2.69 -0.04 0.00 -1.01 0.00 0.00 66.70 63.02 1fo5 h VAL 23 Cb 0.57 2.57 0.01 0.00 -2.01 0.00 0.00 31.29 32.43 1fo5 h VAL 23 CO 0.04 0.70 -0.35 -0.33 -1.01 0.00 0.00 177.57 176.62 1fo5 h GLU 24 N 0.00 -0.94 -0.02 4.17 5.08 -0.54 -0.52 114.58 121.81 1fo5 h GLU 24 Ca -0.01 0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1fo5 h GLU 24 Cb 1.51 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.95 1fo5 h GLU 24 CO 0.09 -0.61 -0.21 1.49 -1.00 0.00 0.00 179.01 178.77 1fo5 h GLU 25 N -1.04 -0.23 0.00 2.33 4.57 -0.80 -1.38 114.58 118.03 1fo5 h GLU 25 Ca -0.10 0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 1fo5 h GLU 25 Cb 0.76 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.40 1fo5 h GLU 25 CO 0.16 -0.16 -0.22 0.28 -1.18 0.00 0.00 179.01 177.90 1fo5 h VAL 26 N -0.24 0.95 0.00 0.32 2.07 -1.43 -0.49 116.25 117.43 1fo5 h VAL 26 Ca 0.01 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1fo5 h VAL 26 Cb 0.27 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1fo5 h VAL 26 CO -0.15 0.21 -0.17 0.00 0.02 0.00 0.00 177.57 177.48 1fo5 h ALA 27 N 1.78 1.36 -0.38 1.67 0.00 -0.41 0.12 119.26 123.39 1fo5 h ALA 27 Ca -0.00 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.82 1fo5 h ALA 27 Cb 0.44 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1fo5 h ALA 27 CO 0.03 0.21 -0.01 -0.91 0.00 0.00 0.00 179.25 178.57 1fo5 h ASN 28 N 0.00 -0.17 0.11 0.00 2.35 -0.00 -1.53 115.58 116.34 1fo5 h ASN 28 Ca -0.00 0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 1fo5 h ASN 28 Cb 0.40 0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.93 1fo5 h ASN 28 CO 0.02 -0.05 -0.05 -0.33 -1.65 0.00 0.00 177.43 175.37 1fo5 h GLU 29 N 0.10 -0.15 -2.35 0.81 3.07 -1.30 -3.43 114.58 111.33 1fo5 h GLU 29 Ca 0.19 0.01 -0.52 0.00 -0.50 0.00 0.00 59.36 58.54 1fo5 h GLU 29 Cb 0.27 0.03 -0.36 0.00 -0.84 0.00 0.00 28.75 27.85 1fo5 h GLU 29 CO -0.32 0.21 -0.82 -1.64 -1.40 0.00 0.00 179.01 175.05 1fo5 s MET 30 N -4.63 0.63 0.00 2.33 -1.94 0.29 -5.00 119.30 110.97 1fo5 s MET 30 Ca -0.15 -1.30 0.00 0.00 -1.71 0.00 0.00 55.69 52.53 1fo5 s MET 30 Cb 0.02 -1.13 0.00 0.00 2.01 0.00 0.00 34.83 35.73 1fo5 s MET 30 CO 0.62 -1.23 0.71 -0.35 -0.01 0.00 0.00 175.02 174.75 1fo5 n PRO 31 N 3.91 0.82 0.03 2.03 -0.04 -0.58 -3.55 135.00 137.62 1fo5 n PRO 31 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 1fo5 n PRO 31 Cb 0.41 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 1fo5 n PRO 31 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1fo5 n ASP 32 N 0.45 -0.45 0.00 3.54 -0.08 -1.26 -4.90 116.55 113.86 1fo5 n ASP 32 Ca 0.00 0.13 0.08 0.00 -1.51 0.00 0.00 54.79 53.49 1fo5 n ASP 32 Cb 0.35 0.68 0.44 0.00 2.34 0.00 0.00 41.12 44.93 1fo5 n ASP 32 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1fo5 n ALA 33 N -2.67 1.96 -1.79 -1.67 0.00 -1.25 -4.84 120.51 110.24 1fo5 n ALA 33 Ca 0.00 -0.08 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1fo5 n ALA 33 Cb 0.00 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.14 1fo5 n ALA 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1fo5 s VAL 34 N -2.50 3.18 -0.07 0.00 0.11 -1.23 -0.98 120.40 118.91 1fo5 s VAL 34 Ca 0.17 1.17 -0.00 0.00 -2.93 0.00 0.00 61.98 60.38 1fo5 s VAL 34 Cb 0.11 -3.74 0.03 0.00 -1.53 0.00 0.00 36.38 31.25 1fo5 s VAL 34 CO 0.25 0.27 -0.03 -1.61 -3.33 0.00 0.00 175.10 170.66 1fo5 s GLU 35 N -1.44 0.81 -0.03 1.54 2.02 -0.61 -4.90 118.70 116.09 1fo5 s GLU 35 Ca 0.47 -0.02 0.06 0.00 0.02 0.00 0.00 54.97 55.50 1fo5 s GLU 35 Cb -0.35 -1.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.84 1fo5 s GLU 35 CO 0.45 -0.22 -0.20 0.08 0.02 0.00 0.00 175.26 175.39 1fo5 s VAL 36 N 1.57 2.57 -0.37 2.63 1.01 -1.26 -0.24 120.40 126.32 1fo5 s VAL 36 Ca -0.01 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.07 1fo5 s VAL 36 Cb -0.13 -1.95 0.10 0.00 0.00 0.00 0.00 36.38 34.40 1fo5 s VAL 36 CO -0.04 0.58 0.11 -1.61 0.00 0.00 0.00 175.10 174.15 1fo5 s GLU 37 N -0.68 1.75 -0.31 2.72 0.41 -0.34 -4.97 118.70 117.29 1fo5 s GLU 37 Ca 0.11 -1.82 -0.29 0.00 -0.41 0.00 0.00 54.97 52.56 1fo5 s GLU 37 Cb -0.10 -3.36 0.01 0.00 -1.78 0.00 0.00 34.13 28.90 1fo5 s GLU 37 CO -0.00 -0.97 1.21 -0.47 -0.49 0.00 0.00 175.26 174.53 1fo5 s TYR 38 N 1.02 2.88 -0.30 1.61 5.04 -1.26 -0.60 117.35 125.73 1fo5 s TYR 38 Ca 0.09 1.00 0.00 0.00 -2.44 0.00 0.00 57.07 55.72 1fo5 s TYR 38 Cb -0.21 -3.82 0.09 0.00 0.35 0.00 0.00 41.96 38.38 1fo5 s TYR 38 CO -0.06 -1.33 0.07 0.96 -1.34 0.00 0.00 175.55 173.85 1fo5 s ILE 39 N 4.04 1.19 0.12 3.14 -0.00 -0.62 -4.96 121.20 124.10 1fo5 s ILE 39 Ca 0.52 -1.53 -0.31 0.00 -0.00 0.00 0.00 60.65 59.33 1fo5 s ILE 39 Cb -0.15 -1.85 -0.08 0.00 -0.00 0.00 0.00 42.46 40.38 1fo5 s ILE 39 CO 0.20 -0.59 1.48 0.21 -0.00 0.00 0.00 174.94 176.24 1fo5 s ASN 40 N 1.47 6.72 -0.41 4.36 2.47 -1.26 -3.13 114.94 125.16 1fo5 s ASN 40 Ca 0.08 2.43 -0.27 0.00 0.42 0.00 0.00 52.86 55.52 1fo5 s ASN 40 Cb -0.18 -2.58 -0.06 0.00 -1.45 0.00 0.00 41.25 36.98 1fo5 s ASN 40 CO -0.19 -0.74 2.33 -0.69 -3.72 0.00 0.00 177.10 174.08 1fo5 s VAL 41 N 1.40 3.02 0.00 -5.21 1.01 -0.57 -3.91 120.40 116.15 1fo5 s VAL 41 Ca 0.67 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.67 1fo5 s VAL 41 Cb -0.39 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1fo5 s VAL 41 CO 0.30 -0.04 0.00 0.80 0.00 0.00 0.00 175.10 176.16 1fo5 n MET 42 N 8.93 0.00 -0.00 2.72 0.00 -1.26 -4.80 117.12 122.72 1fo5 n MET 42 Ca 0.34 0.00 -0.18 0.00 0.00 0.00 0.00 57.70 57.86 1fo5 n MET 42 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 33.22 33.65 1fo5 n MET 42 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1fo5 h GLU 43 N 0.00 0.62 -6.94 2.12 5.08 -2.00 -3.47 114.58 110.00 1fo5 h GLU 43 Ca 0.00 -0.58 -0.55 0.00 -1.00 0.00 0.00 59.36 57.23 1fo5 h GLU 43 Cb 0.00 0.14 0.12 0.00 0.50 0.00 0.00 28.75 29.52 1fo5 h GLU 43 CO 0.00 1.19 0.63 0.27 -1.00 0.00 0.00 179.01 180.11 1fo5 n ASN 44 N -4.05 3.07 -4.75 1.42 6.94 -1.25 -4.94 115.26 111.70 1fo5 n ASN 44 Ca -0.09 1.11 -0.41 0.00 -0.02 0.00 0.00 54.58 55.17 1fo5 n ASN 44 Cb 0.73 -1.57 -0.03 0.00 -2.36 0.00 0.00 39.78 36.55 1fo5 n ASN 44 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1fo5 s PRO 45 N -2.39 4.43 0.19 -0.53 0.04 -1.26 -4.89 135.00 130.59 1fo5 s PRO 45 Ca 0.61 2.04 0.11 0.00 0.04 0.00 0.00 61.00 63.80 1fo5 s PRO 45 Cb -0.47 -3.17 0.60 0.00 0.04 0.00 0.00 34.50 31.51 1fo5 s PRO 45 CO 0.57 -0.16 1.29 1.04 0.04 0.00 0.00 177.00 179.78 1fo5 n GLN 46 N 2.02 0.07 0.00 4.56 6.02 -1.26 -3.91 117.38 124.88 1fo5 n GLN 46 Ca 0.04 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.56 1fo5 n GLN 46 Cb 0.43 -1.83 0.00 0.00 1.02 0.00 0.00 30.24 29.86 1fo5 n GLN 46 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1fo5 n LYS 47 N -1.88 0.00 -0.04 -1.09 -0.00 -1.26 -0.76 118.16 113.13 1fo5 n LYS 47 Ca -0.01 0.12 -0.03 0.00 -0.00 0.00 0.00 58.31 58.39 1fo5 n LYS 47 Cb 0.11 -1.58 -0.01 0.00 -0.00 0.00 0.00 35.03 33.55 1fo5 n LYS 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1fo5 n ALA 48 N -1.01 0.31 0.21 0.58 0.00 -1.25 -4.59 120.51 114.76 1fo5 n ALA 48 Ca 0.00 -0.34 0.07 0.00 0.00 0.00 0.00 53.44 53.17 1fo5 n ALA 48 Cb 0.08 0.01 0.14 0.00 0.00 0.00 0.00 19.45 19.69 1fo5 n ALA 48 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1fo5 h MET 49 N -0.61 0.00 -0.03 0.00 1.85 -1.29 -1.61 114.93 113.24 1fo5 h MET 49 Ca 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.10 1fo5 h MET 49 Cb 0.35 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.38 1fo5 h MET 49 CO 0.00 0.00 0.36 1.05 -0.40 0.00 0.00 176.91 177.92 1fo5 h GLU 50 N 0.00 0.00 -6.44 0.39 4.11 -1.19 -3.39 114.58 108.05 1fo5 h GLU 50 Ca 0.11 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.21 1fo5 h GLU 50 Cb 2.13 0.00 0.18 0.00 0.50 0.00 0.00 28.75 31.56 1fo5 h GLU 50 CO -0.00 0.00 -0.54 0.66 0.07 0.00 0.00 179.01 179.20 1fo5 n TYR 51 N -2.93 -2.21 -1.59 2.06 4.01 -0.61 -4.69 117.16 111.20 1fo5 n TYR 51 Ca -0.01 -0.09 -0.58 0.00 -0.16 0.00 0.00 57.90 57.05 1fo5 n TYR 51 Cb 0.41 -1.45 -0.08 0.00 -0.31 0.00 0.00 39.34 37.92 1fo5 n TYR 51 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fo5 n GLY 52 N 2.16 0.15 4.99 2.72 0.00 -1.26 -1.24 105.19 112.71 1fo5 n GLY 52 Ca 0.05 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.87 1fo5 n GLY 52 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fo5 n ILE 53 N 2.53 0.00 0.00 -0.61 -5.35 -1.26 -4.74 119.36 109.93 1fo5 n ILE 53 Ca 0.22 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.70 1fo5 n ILE 53 Cb 0.10 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 1fo5 n ILE 53 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 1fo5 n MET 54 N -0.60 0.00 0.00 6.28 2.81 -0.37 -4.93 117.12 120.31 1fo5 n MET 54 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1fo5 n MET 54 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 1fo5 n MET 54 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1fo5 n ALA 55 N 0.27 0.00 -3.64 3.04 0.00 -1.26 -4.81 120.51 114.11 1fo5 n ALA 55 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1fo5 n ALA 55 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1fo5 n ALA 55 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1fo5 s VAL 56 N 0.00 0.00 1.38 0.00 1.01 -1.26 -4.92 120.40 116.62 1fo5 s VAL 56 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 61.98 61.75 1fo5 s VAL 56 Cb 0.00 -1.00 0.35 0.00 0.00 0.00 0.00 36.38 35.73 1fo5 s VAL 56 CO 0.00 0.00 0.96 -0.81 0.00 0.00 0.00 175.10 175.25 1fo5 n PRO 57 N 0.29 -4.23 -4.40 2.72 -0.04 -1.26 -5.00 135.00 123.08 1fo5 n PRO 57 Ca 0.02 -1.58 -0.25 0.00 -0.04 0.00 0.00 63.50 61.65 1fo5 n PRO 57 Cb 0.58 -1.80 -0.17 0.00 -0.04 0.00 0.00 33.50 32.07 1fo5 n PRO 57 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1fo5 s THR 58 N -2.46 1.13 0.22 0.52 2.01 -0.18 -4.73 115.64 112.16 1fo5 s THR 58 Ca 0.69 -0.44 0.05 0.00 0.31 0.00 0.00 61.69 62.29 1fo5 s THR 58 Cb -0.10 -1.06 -0.05 0.00 0.01 0.00 0.00 72.50 71.30 1fo5 s THR 58 CO 0.56 0.36 -0.05 -0.63 -0.69 0.00 0.00 174.62 174.17 1fo5 s ILE 59 N 0.95 1.27 -0.02 1.82 1.09 -0.27 -0.41 121.20 125.62 1fo5 s ILE 59 Ca -0.09 -2.08 0.00 0.00 -1.10 0.00 0.00 60.65 57.38 1fo5 s ILE 59 Cb -0.15 -2.24 0.03 0.00 -1.06 0.00 0.00 42.46 39.04 1fo5 s ILE 59 CO 0.00 -0.43 0.01 -0.69 -0.10 0.00 0.00 174.94 173.73 1fo5 s VAL 60 N -3.27 0.08 0.00 2.92 1.01 0.20 -1.26 120.40 120.09 1fo5 s VAL 60 Ca 0.26 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.36 1fo5 s VAL 60 Cb 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 36.38 36.24 1fo5 s VAL 60 CO 0.08 0.11 0.00 2.30 0.00 0.00 0.00 175.10 177.59 1fo5 n ILE 61 N 4.05 0.00 -0.00 2.22 -5.35 -0.02 -1.65 119.36 118.61 1fo5 n ILE 61 Ca -0.26 0.00 -0.00 0.00 -0.27 0.00 0.00 62.75 62.22 1fo5 n ILE 61 Cb 0.51 -1.04 -0.00 0.00 -1.74 0.00 0.00 39.64 37.37 1fo5 n ILE 61 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1fo5 n ASN 62 N -0.57 -0.01 0.00 7.28 2.85 -0.82 -2.14 115.26 121.85 1fo5 n ASN 62 Ca 0.00 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 1fo5 n ASN 62 Cb 0.00 -0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1fo5 n ASN 62 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1fo5 n GLY 63 N -1.00 0.64 3.56 8.20 0.00 -1.26 -1.44 105.19 113.88 1fo5 n GLY 63 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1fo5 n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fo5 s ASP 64 N -0.43 6.39 0.29 1.61 1.01 -0.91 -5.02 116.67 119.61 1fo5 s ASP 64 Ca 0.00 0.04 -0.30 0.00 0.71 0.00 0.00 52.55 53.00 1fo5 s ASP 64 Cb 0.00 -2.32 -0.12 0.00 1.01 0.00 0.00 42.92 41.49 1fo5 s ASP 64 CO 0.00 -0.62 1.54 0.52 0.21 0.00 0.00 175.17 176.83 1fo5 n VAL 65 N 5.62 1.07 -3.58 -1.27 0.31 -1.26 -0.84 118.33 118.38 1fo5 n VAL 65 Ca -0.02 -0.27 0.03 0.00 -0.01 0.00 0.00 64.34 64.07 1fo5 n VAL 65 Cb 0.48 -1.84 -0.00 0.00 -0.91 0.00 0.00 33.84 31.57 1fo5 n VAL 65 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1fo5 s GLU 66 N -0.58 0.13 -0.26 5.55 2.12 -0.39 -4.95 118.70 120.33 1fo5 s GLU 66 Ca 0.64 -0.07 -0.23 0.00 0.36 0.00 0.00 54.97 55.67 1fo5 s GLU 66 Cb -0.53 0.04 0.07 0.00 0.26 0.00 0.00 34.13 33.97 1fo5 s GLU 66 CO 0.50 -0.06 0.68 -0.59 -0.54 0.00 0.00 175.26 175.25 1fo5 s PHE 67 N -2.14 -0.76 -0.17 5.30 -0.12 -1.26 -1.11 117.98 117.72 1fo5 s PHE 67 Ca 0.14 1.83 -0.12 0.00 -0.05 0.00 0.00 56.93 58.74 1fo5 s PHE 67 Cb 0.06 0.27 0.05 0.00 -0.63 0.00 0.00 43.02 42.78 1fo5 s PHE 67 CO -0.06 -0.37 0.42 0.42 -0.05 0.00 0.00 175.22 175.59 1fo5 s ILE 68 N 0.41 -0.01 0.00 -4.49 1.01 -1.26 -5.01 121.20 111.84 1fo5 s ILE 68 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.70 1fo5 s ILE 68 Cb -0.05 -0.62 0.00 0.00 0.01 0.00 0.00 42.46 41.81 1fo5 s ILE 68 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.57 1fo5 n GLY 69 N 3.72 -0.84 0.14 6.18 0.00 -1.26 -4.15 105.19 108.98 1fo5 n GLY 69 Ca -0.19 -1.69 -0.21 0.00 0.00 0.00 0.00 46.02 43.93 1fo5 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fo5 h ALA 70 N 0.00 -0.03 -3.31 4.61 0.00 -2.00 -3.40 119.26 115.12 1fo5 h ALA 70 Ca 0.00 -0.70 -0.27 0.00 0.00 0.00 0.00 54.91 53.94 1fo5 h ALA 70 Cb 0.00 0.09 0.13 0.00 0.00 0.00 0.00 17.79 18.02 1fo5 h ALA 70 CO 0.00 0.50 0.11 -0.35 0.00 0.00 0.00 179.25 179.50 1fo5 n PRO 71 N -4.01 -2.26 -0.28 0.00 -0.04 -1.26 -4.70 135.00 122.45 1fo5 n PRO 71 Ca -0.13 -1.22 -0.18 0.00 -0.04 0.00 0.00 63.50 61.93 1fo5 n PRO 71 Cb 0.86 -1.09 0.17 0.00 -0.04 0.00 0.00 33.50 33.40 1fo5 n PRO 71 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1fo5 n THR 72 N -4.00 0.00 0.29 0.52 -2.24 -1.26 -4.73 114.28 102.85 1fo5 n THR 72 Ca 0.10 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1fo5 n THR 72 Cb 0.40 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 1fo5 n THR 72 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1fo5 n LYS 73 N -4.09 0.52 -0.15 -0.78 4.81 -1.26 -4.53 118.16 112.68 1fo5 n LYS 73 Ca 0.09 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.65 1fo5 n LYS 73 Cb 0.36 -1.24 0.47 0.00 0.02 0.00 0.00 35.03 34.64 1fo5 n LYS 73 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1fo5 h GLU 74 N 1.40 0.47 -0.48 1.64 4.81 -1.87 0.16 114.58 120.71 1fo5 h GLU 74 Ca 0.00 -0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.29 1fo5 h GLU 74 Cb 0.52 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.73 1fo5 h GLU 74 CO 0.00 0.31 0.07 0.00 -0.73 0.00 0.00 179.01 178.66 1fo5 h ALA 75 N 1.65 0.52 0.00 2.92 0.00 -1.84 -1.64 119.26 120.88 1fo5 h ALA 75 Ca 0.34 0.11 -0.20 0.00 0.00 0.00 0.00 54.91 55.16 1fo5 h ALA 75 Cb 0.66 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1fo5 h ALA 75 CO -0.11 -0.33 -1.06 1.25 0.00 0.00 0.00 179.25 178.99 1fo5 h LEU 76 N 0.20 0.00 -0.99 0.00 7.12 -1.55 -3.36 115.31 116.73 1fo5 h LEU 76 Ca 0.24 0.00 0.02 0.00 0.13 0.00 0.00 57.88 58.27 1fo5 h LEU 76 Cb 0.33 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.41 1fo5 h LEU 76 CO -0.34 0.88 0.65 1.62 -0.13 0.00 0.00 178.44 181.12 1fo5 h VAL 77 N 0.00 1.23 0.00 1.05 3.04 -0.03 0.26 116.25 121.80 1fo5 h VAL 77 Ca -0.07 -0.45 0.00 0.00 -1.01 0.00 0.00 66.70 65.17 1fo5 h VAL 77 Cb 1.73 -0.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.81 1fo5 h VAL 77 CO 0.10 0.24 0.00 -1.84 -1.01 0.00 0.00 177.57 175.06 1fo5 n GLU 78 N -4.41 0.08 -0.08 4.17 -0.00 -0.68 -1.82 120.64 117.90 1fo5 n GLU 78 Ca 0.12 0.51 -0.10 0.00 -0.00 0.00 0.00 57.16 57.69 1fo5 n GLU 78 Cb 0.03 -1.73 -0.08 0.00 -0.00 0.00 0.00 31.44 29.66 1fo5 n GLU 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1fo5 n ALA 79 N -1.65 1.65 -0.12 -1.84 0.00 0.19 -4.46 120.51 114.29 1fo5 n ALA 79 Ca 0.00 -0.75 0.11 0.00 0.00 0.00 0.00 53.44 52.80 1fo5 n ALA 79 Cb 0.07 0.08 0.47 0.00 0.00 0.00 0.00 19.45 20.06 1fo5 n ALA 79 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1fo5 h ILE 80 N 0.00 0.91 -0.82 0.00 3.07 -0.12 0.58 117.51 121.12 1fo5 h ILE 80 Ca -0.37 -0.17 0.16 0.00 1.55 0.00 0.00 64.86 66.03 1fo5 h ILE 80 Cb 1.64 0.37 -0.06 0.00 -0.27 0.00 0.00 36.82 38.50 1fo5 h ILE 80 CO -0.04 0.09 0.54 0.07 -1.05 0.00 0.00 178.15 177.77 1fo5 h LYS 81 N 0.49 0.49 0.02 0.16 2.10 -1.58 -0.56 116.57 117.69 1fo5 h LYS 81 Ca 0.30 -0.03 -0.31 0.00 -2.00 0.00 0.00 60.65 58.61 1fo5 h LYS 81 Cb 0.52 -0.11 -0.05 0.00 -0.90 0.00 0.00 32.23 31.70 1fo5 h LYS 81 CO -0.09 0.32 -1.80 0.36 -2.00 0.00 0.00 179.45 176.24 1fo5 n LYS 82 N -4.51 0.65 0.05 0.07 -0.00 -0.67 -4.77 118.16 108.99 1fo5 n LYS 82 Ca 0.16 0.27 -0.06 0.00 -0.00 0.00 0.00 58.31 58.68 1fo5 n LYS 82 Cb 0.54 -1.76 -0.04 0.00 -0.00 0.00 0.00 35.03 33.77 1fo5 n LYS 82 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 1fo5 h ARG 83 N 0.01 -0.29 0.00 -1.58 1.12 0.76 -3.52 114.38 110.88 1fo5 h ARG 83 Ca -0.33 0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.56 1fo5 h ARG 83 Cb 2.03 0.07 0.00 0.00 -0.01 0.00 0.00 29.97 32.06 1fo5 h ARG 83 CO 0.08 -0.19 0.00 -0.11 -3.11 0.00 0.00 179.97 176.63