#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fo5 n SER 1 N 0.00 0.00 -4.75 7.83 7.64 -1.26 -4.67 113.62 118.42 1fo5 n SER 1 Ca 0.00 -0.15 -0.41 0.00 1.01 0.00 0.00 58.87 59.32 1fo5 n SER 1 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1fo5 n SER 1 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1fo5 s LYS 2 N -2.00 4.37 0.50 1.43 -2.85 -1.26 -4.99 119.74 114.93 1fo5 s LYS 2 Ca 0.06 2.13 -0.16 0.00 -1.00 0.00 0.00 55.97 57.00 1fo5 s LYS 2 Cb 0.03 -3.15 -0.08 0.00 -2.06 0.00 0.00 37.83 32.57 1fo5 s LYS 2 CO 0.05 -0.26 0.95 0.08 0.10 0.00 0.00 175.35 176.27 1fo5 s VAL 3 N -0.17 4.57 -0.18 1.79 1.01 0.13 -4.94 120.40 122.61 1fo5 s VAL 3 Ca 0.56 1.13 0.01 0.00 0.00 0.00 0.00 61.98 63.67 1fo5 s VAL 3 Cb -0.38 -3.72 0.03 0.00 0.00 0.00 0.00 36.38 32.31 1fo5 s VAL 3 CO 0.42 -0.67 -0.14 -0.54 0.00 0.00 0.00 175.10 174.17 1fo5 s LYS 4 N -4.05 2.40 -0.55 2.72 3.01 -0.07 -0.72 119.74 122.48 1fo5 s LYS 4 Ca 0.58 -0.80 -0.09 0.00 -1.01 0.00 0.00 55.97 54.65 1fo5 s LYS 4 Cb -0.10 -2.41 0.14 0.00 -1.01 0.00 0.00 37.83 34.46 1fo5 s LYS 4 CO 0.31 -0.32 0.43 0.42 0.51 0.00 0.00 175.35 176.70 1fo5 s ILE 5 N 1.37 4.37 -0.11 2.17 1.09 0.01 -3.67 121.20 126.44 1fo5 s ILE 5 Ca 0.02 -2.08 -0.05 0.00 -1.10 0.00 0.00 60.65 57.44 1fo5 s ILE 5 Cb -0.15 -3.84 -0.04 0.00 -1.06 0.00 0.00 42.46 37.38 1fo5 s ILE 5 CO -0.10 -0.84 0.08 -1.61 -0.10 0.00 0.00 174.94 172.37 1fo5 s GLU 6 N 0.95 3.25 -0.30 2.79 2.02 -0.60 -1.71 118.70 125.10 1fo5 s GLU 6 Ca 0.09 -0.26 -0.01 0.00 0.02 0.00 0.00 54.97 54.82 1fo5 s GLU 6 Cb -0.23 -3.02 0.09 0.00 0.10 0.00 0.00 34.13 31.08 1fo5 s GLU 6 CO -0.02 0.74 0.09 -0.51 0.02 0.00 0.00 175.26 175.57 1fo5 s LEU 7 N -0.94 2.10 -0.82 1.80 1.02 -0.02 -0.93 118.68 120.88 1fo5 s LEU 7 Ca 0.14 -1.53 -0.02 0.00 0.02 0.00 0.00 54.13 52.74 1fo5 s LEU 7 Cb -0.12 -0.83 0.20 0.00 0.02 0.00 0.00 46.19 45.46 1fo5 s LEU 7 CO 0.03 -0.40 0.69 0.12 0.02 0.00 0.00 176.35 176.81 1fo5 s PHE 8 N 1.65 3.77 0.35 0.29 5.36 -0.02 -0.95 117.98 128.43 1fo5 s PHE 8 Ca 0.08 -2.98 -0.15 0.00 -0.96 0.00 0.00 56.93 52.92 1fo5 s PHE 8 Cb -0.17 -3.20 0.06 0.00 -0.34 0.00 0.00 43.02 39.37 1fo5 s PHE 8 CO -0.23 -0.74 0.78 -2.37 -1.46 0.00 0.00 175.22 171.19 1fo5 n THR 9 N 2.55 0.00 -3.56 0.12 5.66 -1.25 -1.31 114.28 116.49 1fo5 n THR 9 Ca 0.18 -0.88 -0.29 0.00 -3.05 0.00 0.00 64.05 60.01 1fo5 n THR 9 Cb 0.37 0.91 -0.13 0.00 -1.55 0.00 0.00 70.33 69.93 1fo5 n THR 9 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1fo5 s SER 10 N -3.01 3.34 1.20 1.09 1.04 -1.26 -0.83 113.70 115.27 1fo5 s SER 10 Ca 0.16 -2.05 -0.14 0.00 0.48 0.00 0.00 55.95 54.39 1fo5 s SER 10 Cb -0.04 -0.58 0.21 0.00 0.10 0.00 0.00 66.02 65.71 1fo5 s SER 10 CO 0.10 -0.34 0.70 -0.81 0.98 0.00 0.00 173.24 173.87 1fo5 n PRO 11 N 4.25 -2.71 -1.49 4.02 -0.04 -1.26 -4.81 135.00 132.96 1fo5 n PRO 11 Ca 0.06 -1.12 -0.13 0.00 -0.04 0.00 0.00 63.50 62.27 1fo5 n PRO 11 Cb 0.38 -1.12 -0.10 0.00 -0.04 0.00 0.00 33.50 32.62 1fo5 n PRO 11 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 1fo5 n MET 12 N -3.87 0.24 -0.81 0.54 1.56 -1.26 -4.64 117.12 108.88 1fo5 n MET 12 Ca 0.10 -0.95 0.10 0.00 -0.27 0.00 0.00 57.70 56.68 1fo5 n MET 12 Cb 0.39 -3.10 -0.03 0.00 2.15 0.00 0.00 33.22 32.63 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 -2.62 0.20 -0.04 0.00 -0.04 -1.26 -2.23 135.00 129.01 1fo5 n PRO 14 Ca -0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1fo5 n PRO 14 Cb 0.59 -1.44 -0.05 0.00 -0.04 0.00 0.00 33.50 32.56 1fo5 n PRO 14 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1fo5 h HIS 15 N 0.00 0.25 -2.98 0.54 2.07 -1.94 -3.39 115.15 109.69 1fo5 h HIS 15 Ca 0.00 -0.01 -0.52 0.00 -2.85 0.00 0.00 60.37 56.98 1fo5 h HIS 15 Cb 0.00 -0.08 0.05 0.00 2.57 0.00 0.00 27.41 29.96 1fo5 h HIS 15 CO 0.00 0.28 0.88 0.00 -3.07 0.00 0.00 177.93 176.01 1fo5 h PRO 17 N 6.17 0.38 0.00 0.00 0.13 -1.85 -3.47 132.00 133.36 1fo5 h PRO 17 Ca -0.44 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 1fo5 h PRO 17 Cb 1.21 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1fo5 h PRO 17 CO 0.88 0.71 0.00 0.00 -0.23 0.00 0.00 178.00 179.36 1fo5 n ALA 18 N -2.40 0.00 -0.28 -0.56 0.00 -1.26 -1.93 120.51 114.08 1fo5 n ALA 18 Ca -0.06 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.43 1fo5 n ALA 18 Cb 0.34 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.97 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 0.00 1.16 -0.90 0.00 0.00 -1.96 -1.42 119.26 116.13 1fo5 h ALA 19 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.06 1fo5 h ALA 19 Cb 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.63 1fo5 h ALA 19 CO 0.00 -0.03 -0.53 1.17 0.00 0.00 0.00 179.25 179.85 1fo5 n LYS 20 N -4.84 -0.40 0.02 0.00 3.00 -0.81 0.04 118.16 115.17 1fo5 n LYS 20 Ca 0.14 1.37 -0.18 0.00 -0.00 0.00 0.00 58.31 59.64 1fo5 n LYS 20 Cb 0.35 -2.01 -0.08 0.00 0.00 0.00 0.00 35.03 33.29 1fo5 n LYS 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1fo5 h ARG 21 N 0.00 0.72 0.35 1.64 3.08 -1.57 -1.86 114.38 116.75 1fo5 h ARG 21 Ca 0.14 -0.69 -0.02 0.00 0.07 0.00 0.00 59.98 59.49 1fo5 h ARG 21 Cb 0.37 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1fo5 h ARG 21 CO -0.85 1.28 -0.17 0.28 -1.07 0.00 0.00 179.97 179.45 1fo5 h VAL 22 N 0.45 0.66 -0.27 2.04 2.07 -0.23 -0.38 116.25 120.60 1fo5 h VAL 22 Ca -0.09 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.46 1fo5 h VAL 22 Cb 1.56 0.68 -0.07 0.00 -1.52 0.00 0.00 31.29 31.94 1fo5 h VAL 22 CO 0.18 0.01 -0.21 0.58 0.02 0.00 0.00 177.57 178.15 1fo5 h VAL 23 N -0.48 0.44 -0.60 2.57 2.07 -0.48 -1.68 116.25 118.08 1fo5 h VAL 23 Ca -0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.50 1fo5 h VAL 23 Cb 0.37 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1fo5 h VAL 23 CO 0.08 0.00 0.36 -0.08 0.02 0.00 0.00 177.57 177.95 1fo5 h GLU 24 N -0.20 0.69 -0.63 1.57 4.81 -1.11 0.12 114.58 119.84 1fo5 h GLU 24 Ca 0.15 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1fo5 h GLU 24 Cb 0.43 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1fo5 h GLU 24 CO -0.39 0.46 0.34 1.49 -0.73 0.00 0.00 179.01 180.18 1fo5 h GLU 25 N 0.71 0.87 0.00 1.92 4.57 -0.58 -0.94 114.58 121.13 1fo5 h GLU 25 Ca 0.24 -0.11 -0.18 0.00 -1.18 0.00 0.00 59.36 58.13 1fo5 h GLU 25 Cb 0.04 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 1fo5 h GLU 25 CO -0.11 0.67 -0.87 -0.39 -1.18 0.00 0.00 179.01 177.13 1fo5 h VAL 26 N 0.85 1.57 0.00 0.32 -1.51 -1.07 -3.27 116.25 113.15 1fo5 h VAL 26 Ca 0.22 -3.05 -0.07 0.00 -1.23 0.00 0.00 66.70 62.56 1fo5 h VAL 26 Cb 0.05 2.67 -0.01 0.00 -2.13 0.00 0.00 31.29 31.87 1fo5 h VAL 26 CO -0.03 0.86 -0.34 0.00 -1.23 0.00 0.00 177.57 176.83 1fo5 h ALA 27 N 1.13 0.96 -0.09 5.19 0.00 -0.46 -0.18 119.26 125.81 1fo5 h ALA 27 Ca -0.01 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.62 1fo5 h ALA 27 Cb 1.60 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 1fo5 h ALA 27 CO 0.11 0.42 0.12 -0.91 0.00 0.00 0.00 179.25 179.00 1fo5 h ASN 28 N 0.00 0.00 0.00 0.00 2.35 -1.22 -2.33 115.58 114.38 1fo5 h ASN 28 Ca -0.00 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.70 1fo5 h ASN 28 Cb 0.91 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 1fo5 h ASN 28 CO 0.04 0.00 -0.63 -0.33 -1.65 0.00 0.00 177.43 174.87 1fo5 h GLU 29 N 0.00 0.00 -2.97 0.81 4.39 -1.49 -3.47 114.58 111.86 1fo5 h GLU 29 Ca 0.04 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 59.13 1fo5 h GLU 29 Cb 0.28 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.53 1fo5 h GLU 29 CO -0.00 0.20 -0.74 -1.64 -1.16 0.00 0.00 179.01 175.68 1fo5 s MET 30 N -2.23 1.33 0.00 2.33 -1.94 -0.16 -5.02 119.30 113.60 1fo5 s MET 30 Ca -0.17 -2.07 0.00 0.00 -1.71 0.00 0.00 55.69 51.74 1fo5 s MET 30 Cb 0.03 -2.35 0.00 0.00 2.01 0.00 0.00 34.83 34.51 1fo5 s MET 30 CO 0.28 -1.18 1.40 -0.35 -0.01 0.00 0.00 175.02 175.17 1fo5 n PRO 31 N 3.44 0.99 0.00 2.03 -0.04 -0.90 -3.08 135.00 137.44 1fo5 n PRO 31 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1fo5 n PRO 31 Cb 0.35 -1.01 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 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 0.93 -0.06 0.25 3.54 2.03 -1.26 -4.95 116.55 117.02 1fo5 n ASP 32 Ca 0.00 0.09 0.12 0.00 0.52 0.00 0.00 54.79 55.52 1fo5 n ASP 32 Cb 0.49 0.17 0.67 0.00 -0.72 0.00 0.00 41.12 41.73 1fo5 n ASP 32 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fo5 h ALA 33 N 0.00 1.22 -1.37 -1.67 0.00 -1.93 -3.31 119.26 112.20 1fo5 h ALA 33 Ca 0.00 -0.13 -0.49 0.00 0.00 0.00 0.00 54.91 54.29 1fo5 h ALA 33 Cb 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1fo5 h ALA 33 CO 0.00 0.18 1.24 0.08 0.00 0.00 0.00 179.25 180.75 1fo5 s VAL 34 N -4.08 3.45 0.08 0.00 1.01 -1.18 -0.69 120.40 119.00 1fo5 s VAL 34 Ca -0.02 0.16 -0.26 0.00 0.00 0.00 0.00 61.98 61.85 1fo5 s VAL 34 Cb 0.13 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 1fo5 s VAL 34 CO 0.60 -1.13 0.81 -0.70 0.00 0.00 0.00 175.10 174.67 1fo5 s GLU 35 N 6.72 4.55 0.03 2.72 2.12 0.10 -4.90 118.70 130.05 1fo5 s GLU 35 Ca 0.60 1.16 0.03 0.00 0.36 0.00 0.00 54.97 57.12 1fo5 s GLU 35 Cb -0.11 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.92 1fo5 s GLU 35 CO 0.16 0.33 -0.08 0.14 -0.54 0.00 0.00 175.26 175.27 1fo5 s VAL 36 N -0.28 0.60 -0.07 3.70 -7.23 -1.26 -0.81 120.40 115.06 1fo5 s VAL 36 Ca 0.39 -0.88 -0.03 0.00 -1.81 0.00 0.00 61.98 59.66 1fo5 s VAL 36 Cb -0.22 -0.61 0.04 0.00 0.56 0.00 0.00 36.38 36.15 1fo5 s VAL 36 CO 0.25 -0.21 0.07 -1.61 -0.31 0.00 0.00 175.10 173.29 1fo5 s GLU 37 N -1.19 -0.05 -0.99 4.82 2.02 -0.69 -4.99 118.70 117.62 1fo5 s GLU 37 Ca -0.05 0.28 -0.11 0.00 0.02 0.00 0.00 54.97 55.11 1fo5 s GLU 37 Cb -0.08 -0.79 0.25 0.00 0.10 0.00 0.00 34.13 33.62 1fo5 s GLU 37 CO 0.00 -0.40 0.97 -0.47 0.02 0.00 0.00 175.26 175.38 1fo5 s TYR 38 N 2.16 4.05 -1.23 1.61 5.04 -1.26 -0.84 117.35 126.88 1fo5 s TYR 38 Ca 0.04 -2.39 -0.11 0.00 -2.44 0.00 0.00 57.07 52.18 1fo5 s TYR 38 Cb -0.13 -3.84 0.18 0.00 0.35 0.00 0.00 41.96 38.53 1fo5 s TYR 38 CO -0.04 -0.97 1.61 0.44 -1.34 0.00 0.00 175.55 175.24 1fo5 n ILE 39 N 3.27 4.37 -1.58 3.14 -0.00 -0.12 -4.95 119.36 123.49 1fo5 n ILE 39 Ca 0.20 -4.69 -0.18 0.00 -0.00 0.00 0.00 62.75 58.07 1fo5 n ILE 39 Cb 0.43 -2.41 -0.06 0.00 -0.00 0.00 0.00 39.64 37.60 1fo5 n ILE 39 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.55 176.76 1fo5 s ASN 40 N 1.67 4.03 0.00 7.28 2.47 -1.26 -3.78 114.94 125.36 1fo5 s ASN 40 Ca 0.40 0.23 0.00 0.00 0.42 0.00 0.00 52.86 53.91 1fo5 s ASN 40 Cb 0.02 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.28 1fo5 s ASN 40 CO 0.00 -3.66 0.00 0.55 -3.72 0.00 0.00 177.10 170.28 1fo5 n VAL 41 N 8.61 0.00 -1.49 -5.21 3.14 -0.01 -4.86 118.33 118.51 1fo5 n VAL 41 Ca 0.44 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.46 1fo5 n VAL 41 Cb 0.46 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 33.30 1fo5 n VAL 41 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 1fo5 n MET 42 N 0.00 0.67 -2.76 1.45 1.56 -1.26 -2.29 117.12 114.49 1fo5 n MET 42 Ca 0.00 0.27 -0.17 0.00 -0.27 0.00 0.00 57.70 57.54 1fo5 n MET 42 Cb 0.00 -2.14 0.02 0.00 2.15 0.00 0.00 33.22 33.26 1fo5 n MET 42 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1fo5 n GLU 43 N -1.28 -3.42 -1.93 2.12 4.07 -1.26 -4.95 120.64 113.99 1fo5 n GLU 43 Ca 0.13 0.70 -0.40 0.00 -0.06 0.00 0.00 57.16 57.54 1fo5 n GLU 43 Cb 0.49 -5.11 -0.03 0.00 -0.06 0.00 0.00 31.44 26.73 1fo5 n GLU 43 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1fo5 s ASN 44 N -2.72 5.34 -0.02 4.31 2.20 -0.97 -4.97 114.94 118.12 1fo5 s ASN 44 Ca 0.20 0.84 -0.14 0.00 -0.94 0.00 0.00 52.86 52.82 1fo5 s ASN 44 Cb -0.09 -2.52 -0.05 0.00 -2.00 0.00 0.00 41.25 36.58 1fo5 s ASN 44 CO 0.25 -2.23 0.37 -2.16 -2.94 0.00 0.00 177.10 170.39 1fo5 s PRO 45 N 6.77 3.85 0.00 3.55 0.05 -1.26 -4.96 135.00 143.01 1fo5 s PRO 45 Ca 0.78 0.34 0.07 0.00 0.05 0.00 0.00 61.00 62.23 1fo5 s PRO 45 Cb -0.17 -3.22 0.33 0.00 0.05 0.00 0.00 34.50 31.49 1fo5 s PRO 45 CO 0.26 0.70 1.12 1.04 0.05 0.00 0.00 177.00 180.17 1fo5 n GLN 46 N 1.85 0.07 -0.32 4.56 3.00 -1.26 -3.63 117.38 121.64 1fo5 n GLN 46 Ca -0.15 0.27 0.19 0.00 -0.01 0.00 0.00 57.00 57.30 1fo5 n GLN 46 Cb 0.53 -1.50 0.39 0.00 0.00 0.00 0.00 30.24 29.66 1fo5 n GLN 46 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.06 178.63 1fo5 h LYS 47 N 0.00 0.34 0.00 -1.09 5.09 -2.00 0.16 116.57 119.07 1fo5 h LYS 47 Ca 0.00 -0.02 -0.24 0.00 0.09 0.00 0.00 60.65 60.48 1fo5 h LYS 47 Cb 0.08 -0.08 -0.04 0.00 0.10 0.00 0.00 32.23 32.29 1fo5 h LYS 47 CO 0.00 0.22 -1.74 0.00 -2.09 0.00 0.00 179.45 175.85 1fo5 n ALA 48 N -2.43 1.73 0.24 0.07 0.00 -1.24 -3.87 120.51 115.01 1fo5 n ALA 48 Ca 0.27 -0.77 0.02 0.00 0.00 0.00 0.00 53.44 52.96 1fo5 n ALA 48 Cb 0.83 -0.76 0.13 0.00 0.00 0.00 0.00 19.45 19.64 1fo5 n ALA 48 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1fo5 n MET 49 N -2.89 0.08 0.28 0.00 2.81 -0.10 -2.79 117.12 114.52 1fo5 n MET 49 Ca -0.16 0.21 0.13 0.00 -1.81 0.00 0.00 57.70 56.07 1fo5 n MET 49 Cb 0.97 -1.50 0.82 0.00 -0.71 0.00 0.00 33.22 32.80 1fo5 n MET 49 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 1fo5 h GLU 50 N 0.00 0.00 0.00 0.03 4.11 -0.89 -3.46 114.58 114.37 1fo5 h GLU 50 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1fo5 h GLU 50 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1fo5 h GLU 50 CO 0.00 0.05 0.00 0.66 0.07 0.00 0.00 179.01 179.79 1fo5 n TYR 51 N -3.85 0.00 -0.07 2.06 4.01 -1.12 -5.07 117.16 113.12 1fo5 n TYR 51 Ca -0.03 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1fo5 n TYR 51 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 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 5.00 -3.57 0.05 2.72 0.00 -1.26 -4.86 105.19 103.27 1fo5 n GLY 52 Ca 0.00 -1.26 -0.01 0.00 0.00 0.00 0.00 46.02 44.75 1fo5 n GLY 52 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1fo5 n ILE 53 N -2.97 -0.08 -3.31 -0.61 3.06 -1.26 -4.67 119.36 109.51 1fo5 n ILE 53 Ca 0.00 0.94 -0.22 0.00 -2.50 0.00 0.00 62.75 60.98 1fo5 n ILE 53 Cb 0.01 -1.22 -0.04 0.00 0.54 0.00 0.00 39.64 38.92 1fo5 n ILE 53 CO 0.00 0.00 0.00 0.23 -2.50 0.00 0.00 176.55 174.28 1fo5 n MET 54 N -3.02 -1.55 0.04 9.51 2.81 -1.26 -4.83 117.12 118.82 1fo5 n MET 54 Ca 0.00 0.07 -0.02 0.00 -1.81 0.00 0.00 57.70 55.95 1fo5 n MET 54 Cb 0.03 -3.93 -0.01 0.00 -0.71 0.00 0.00 33.22 28.60 1fo5 n MET 54 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1fo5 h ALA 55 N 1.09 -0.54 -2.83 3.04 0.00 -1.91 -3.35 119.26 114.76 1fo5 h ALA 55 Ca -0.30 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 1fo5 h ALA 55 Cb 1.04 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.79 1fo5 h ALA 55 CO 0.45 -0.53 -0.14 0.14 0.00 0.00 0.00 179.25 179.16 1fo5 s VAL 56 N -2.29 0.00 0.03 0.00 -7.23 -1.26 -4.65 120.40 104.99 1fo5 s VAL 56 Ca -0.02 -1.45 -0.30 0.00 -1.81 0.00 0.00 61.98 58.40 1fo5 s VAL 56 Cb 0.00 -2.29 -0.05 0.00 0.56 0.00 0.00 36.38 34.61 1fo5 s VAL 56 CO 0.05 0.00 1.17 -2.16 -0.31 0.00 0.00 175.10 173.85 1fo5 s PRO 57 N -3.88 4.43 -0.31 4.82 0.04 -1.26 -4.98 135.00 133.86 1fo5 s PRO 57 Ca 0.24 1.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.90 1fo5 s PRO 57 Cb -0.00 -3.41 0.01 0.00 0.04 0.00 0.00 34.50 31.13 1fo5 s PRO 57 CO 0.10 -0.27 0.12 0.99 0.04 0.00 0.00 177.00 177.99 1fo5 s THR 58 N 1.31 4.26 -0.07 1.26 2.01 -0.43 -4.31 115.64 119.67 1fo5 s THR 58 Ca 0.57 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.94 1fo5 s THR 58 Cb -0.27 -3.22 0.02 0.00 0.01 0.00 0.00 72.50 69.04 1fo5 s THR 58 CO 0.27 0.02 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.54 1fo5 s ILE 59 N 1.54 0.74 -0.19 1.82 -1.09 0.03 -0.84 121.20 123.21 1fo5 s ILE 59 Ca 0.03 -0.18 -0.13 0.00 -2.23 0.00 0.00 60.65 58.14 1fo5 s ILE 59 Cb -0.17 -0.77 -0.05 0.00 -1.58 0.00 0.00 42.46 39.89 1fo5 s ILE 59 CO 0.04 0.30 0.27 -0.69 -1.23 0.00 0.00 174.94 173.62 1fo5 s VAL 60 N 1.33 5.31 0.30 2.92 1.01 -0.10 -0.82 120.40 130.35 1fo5 s VAL 60 Ca -0.04 0.46 0.11 0.00 0.00 0.00 0.00 61.98 62.51 1fo5 s VAL 60 Cb -0.14 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 1fo5 s VAL 60 CO -0.03 0.36 -0.17 0.27 0.00 0.00 0.00 175.10 175.53 1fo5 s ILE 61 N 0.75 2.40 0.00 2.22 -5.25 -0.72 -1.56 121.20 119.05 1fo5 s ILE 61 Ca 0.14 -2.35 0.00 0.00 -0.99 0.00 0.00 60.65 57.45 1fo5 s ILE 61 Cb -0.13 -2.40 0.00 0.00 2.95 0.00 0.00 42.46 42.88 1fo5 s ILE 61 CO 0.04 -0.34 0.00 0.59 -1.79 0.00 0.00 174.94 173.44 1fo5 n ASN 62 N -0.67 0.00 0.00 4.36 4.13 -1.24 -0.01 115.26 121.83 1fo5 n ASN 62 Ca -0.05 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.21 1fo5 n ASN 62 Cb 0.61 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.85 1fo5 n ASN 62 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1fo5 n GLY 63 N 0.00 0.21 3.57 7.41 0.00 -1.26 -0.89 105.19 114.23 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 -0.02 6.42 0.39 1.61 1.01 0.98 -5.03 116.67 122.03 1fo5 s ASP 64 Ca 0.00 0.17 -0.27 0.00 0.71 0.00 0.00 52.55 53.16 1fo5 s ASP 64 Cb 0.00 -2.32 -0.11 0.00 1.01 0.00 0.00 42.92 41.50 1fo5 s ASP 64 CO 0.00 -0.56 1.34 0.55 0.21 0.00 0.00 175.17 176.71 1fo5 n VAL 65 N 5.54 2.25 -4.02 -1.27 3.14 -1.26 -1.75 118.33 120.97 1fo5 n VAL 65 Ca -0.02 -0.50 0.04 0.00 -2.96 0.00 0.00 64.34 60.90 1fo5 n VAL 65 Cb 0.49 -1.69 0.01 0.00 -1.06 0.00 0.00 33.84 31.59 1fo5 n VAL 65 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1fo5 n GLU 66 N 0.29 0.07 0.00 1.45 0.00 0.00 -4.95 120.64 117.50 1fo5 n GLU 66 Ca 0.05 -0.53 0.00 0.00 0.00 0.00 0.00 57.16 56.67 1fo5 n GLU 66 Cb 0.38 0.97 0.00 0.00 0.00 0.00 0.00 31.44 32.79 1fo5 n GLU 66 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.13 179.10 1fo5 n PHE 67 N -0.84 0.00 0.00 4.31 -1.74 -1.26 -0.79 117.46 117.13 1fo5 n PHE 67 Ca 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.94 1fo5 n PHE 67 Cb 0.50 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.50 1fo5 n PHE 67 CO 0.00 0.00 0.00 -0.89 -0.56 0.00 0.00 176.76 175.31 1fo5 n ILE 68 N -1.20 0.00 -3.32 1.97 2.08 -1.26 -3.55 119.36 114.08 1fo5 n ILE 68 Ca 0.00 0.00 -0.15 0.00 0.56 0.00 0.00 62.75 63.16 1fo5 n ILE 68 Cb 0.02 0.00 0.03 0.00 -0.75 0.00 0.00 39.64 38.94 1fo5 n ILE 68 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1fo5 n GLY 69 N 0.00 2.31 0.10 7.39 0.00 -1.26 -5.04 105.19 108.68 1fo5 n GLY 69 Ca 0.00 -2.22 -0.16 0.00 0.00 0.00 0.00 46.02 43.64 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 0.42 0.01 -2.09 4.61 0.00 -1.94 -3.40 119.26 116.87 1fo5 h ALA 70 Ca -0.21 -0.51 -0.42 0.00 0.00 0.00 0.00 54.91 53.78 1fo5 h ALA 70 Cb 0.86 0.03 0.20 0.00 0.00 0.00 0.00 17.79 18.87 1fo5 h ALA 70 CO 0.31 0.12 0.05 -1.25 0.00 0.00 0.00 179.25 178.48 1fo5 s PRO 71 N -2.85 -1.39 1.38 0.00 0.04 -1.26 -4.58 135.00 126.34 1fo5 s PRO 71 Ca -0.16 0.26 -0.22 0.00 0.04 0.00 0.00 61.00 60.92 1fo5 s PRO 71 Cb 0.00 -1.55 0.35 0.00 0.04 0.00 0.00 34.50 33.35 1fo5 s PRO 71 CO 0.75 -3.89 0.97 0.95 0.04 0.00 0.00 177.00 175.82 1fo5 s THR 72 N -2.69 1.29 -0.62 1.26 -4.23 -1.26 -4.75 115.64 104.64 1fo5 s THR 72 Ca 0.69 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 61.06 1fo5 s THR 72 Cb -0.15 -2.16 -0.12 0.00 1.34 0.00 0.00 72.50 71.40 1fo5 s THR 72 CO 0.59 0.00 1.82 1.17 -0.54 0.00 0.00 174.62 177.66 1fo5 n LYS 73 N -5.46 1.33 -0.03 3.99 4.81 -1.23 -4.36 118.16 117.20 1fo5 n LYS 73 Ca 0.13 -1.41 -0.13 0.00 -0.87 0.00 0.00 58.31 56.03 1fo5 n LYS 73 Cb 0.60 -2.56 -0.11 0.00 0.02 0.00 0.00 35.03 32.98 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 7.57 -0.03 -0.64 1.64 4.57 -1.85 -0.21 114.58 125.62 1fo5 h GLU 74 Ca 0.37 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.55 1fo5 h GLU 74 Cb 0.39 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 1fo5 h GLU 74 CO 1.64 0.68 0.38 0.00 -1.18 0.00 0.00 179.01 180.53 1fo5 h ALA 75 N 0.09 1.46 0.00 2.92 0.00 -1.95 -0.40 119.26 121.37 1fo5 h ALA 75 Ca -0.00 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1fo5 h ALA 75 Cb 0.73 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1fo5 h ALA 75 CO 0.01 0.47 -0.65 -0.07 0.00 0.00 0.00 179.25 179.00 1fo5 h LEU 76 N 0.89 0.00 -0.54 0.00 -0.00 -1.94 -2.59 115.31 111.13 1fo5 h LEU 76 Ca 0.23 0.00 0.08 0.00 -0.00 0.00 0.00 57.88 58.19 1fo5 h LEU 76 Cb -0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.57 1fo5 h LEU 76 CO -0.04 0.65 0.17 0.58 -0.00 0.00 0.00 178.44 179.80 1fo5 h VAL 77 N 0.00 0.77 0.00 1.22 2.07 0.46 0.17 116.25 120.95 1fo5 h VAL 77 Ca -0.01 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1fo5 h VAL 77 Cb 1.18 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1fo5 h VAL 77 CO 0.08 0.06 0.00 1.21 0.02 0.00 0.00 177.57 178.95 1fo5 n GLU 78 N -5.04 0.15 0.00 1.57 2.13 -0.31 -1.65 120.64 117.50 1fo5 n GLU 78 Ca 0.07 0.14 0.00 0.00 0.66 0.00 0.00 57.16 58.03 1fo5 n GLU 78 Cb 0.24 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.45 1fo5 n GLU 78 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1fo5 n ALA 79 N -1.19 2.55 0.30 4.31 0.00 -0.59 -4.63 120.51 121.26 1fo5 n ALA 79 Ca 0.04 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.65 1fo5 n ALA 79 Cb 0.05 0.49 0.94 0.00 0.00 0.00 0.00 19.45 20.92 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 0.39 -0.78 0.00 3.07 -0.67 -0.57 117.51 118.95 1fo5 h ILE 80 Ca 0.00 -0.16 0.09 0.00 1.55 0.00 0.00 64.86 66.34 1fo5 h ILE 80 Cb 0.98 1.11 -0.07 0.00 -0.27 0.00 0.00 36.82 38.56 1fo5 h ILE 80 CO 0.00 0.03 0.43 0.07 -1.05 0.00 0.00 178.15 177.63 1fo5 h LYS 81 N 0.00 0.70 0.00 0.16 2.10 -1.54 -3.24 116.57 114.76 1fo5 h LYS 81 Ca -0.00 -0.04 -0.03 0.00 -2.00 0.00 0.00 60.65 58.58 1fo5 h LYS 81 Cb 0.11 -0.16 -0.00 0.00 -0.90 0.00 0.00 32.23 31.27 1fo5 h LYS 81 CO 0.00 0.47 -0.20 1.57 -2.00 0.00 0.00 179.45 179.30 1fo5 h LYS 82 N 0.73 0.00 0.00 0.07 5.09 -1.43 -3.47 116.57 117.56 1fo5 h LYS 82 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.11 1fo5 h LYS 82 Cb 0.35 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.68 1fo5 h LYS 82 CO -0.25 0.63 0.00 0.54 -2.09 0.00 0.00 179.45 178.28 1fo5 n ARG 83 N -4.64 0.00 0.00 0.07 1.74 -0.45 -5.13 116.66 108.25 1fo5 n ARG 83 Ca -0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 1fo5 n ARG 83 Cb 0.34 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.78 1fo5 n ARG 83 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58