#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 -0.40 0.20 7.83 0.01 -1.26 -5.20 113.70 114.89 1fo5 s SER 1 Ca 0.00 0.40 0.05 0.00 1.31 0.00 0.00 55.95 57.71 1fo5 s SER 1 Cb 0.00 0.33 -0.05 0.00 0.21 0.00 0.00 66.02 66.52 1fo5 s SER 1 CO 0.00 -0.40 -0.08 -1.59 0.41 0.00 0.00 173.24 171.58 1fo5 s LYS 2 N -1.31 1.28 0.06 12.44 -2.85 -1.26 -4.96 119.74 123.14 1fo5 s LYS 2 Ca -0.02 -1.60 -0.29 0.00 -1.00 0.00 0.00 55.97 53.07 1fo5 s LYS 2 Cb -0.00 -0.85 -0.05 0.00 -2.06 0.00 0.00 37.83 34.87 1fo5 s LYS 2 CO 0.01 0.06 0.91 0.08 0.10 0.00 0.00 175.35 176.51 1fo5 s VAL 3 N -3.20 4.67 -0.17 1.79 1.01 -0.08 -5.00 120.40 119.42 1fo5 s VAL 3 Ca 0.23 1.94 0.01 0.00 0.00 0.00 0.00 61.98 64.16 1fo5 s VAL 3 Cb 0.03 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 32.17 1fo5 s VAL 3 CO 0.06 0.29 -0.12 -0.54 0.00 0.00 0.00 175.10 174.78 1fo5 s LYS 4 N 0.28 2.16 0.14 2.72 3.01 -0.65 -1.64 119.74 125.75 1fo5 s LYS 4 Ca 0.46 -0.70 0.11 0.00 -1.01 0.00 0.00 55.97 54.83 1fo5 s LYS 4 Cb -0.22 -2.26 -0.04 0.00 -1.01 0.00 0.00 37.83 34.31 1fo5 s LYS 4 CO 0.27 -0.33 -0.26 0.42 0.51 0.00 0.00 175.35 175.96 1fo5 s ILE 5 N 1.45 2.23 -0.00 2.17 1.09 0.35 -3.00 121.20 125.49 1fo5 s ILE 5 Ca 0.02 -1.80 -0.00 0.00 -1.10 0.00 0.00 60.65 57.77 1fo5 s ILE 5 Cb -0.14 -1.99 0.00 0.00 -1.06 0.00 0.00 42.46 39.27 1fo5 s ILE 5 CO -0.09 0.04 0.00 -1.61 -0.10 0.00 0.00 174.94 173.18 1fo5 s GLU 6 N -2.17 -0.00 -0.82 2.79 2.02 -0.64 -1.54 118.70 118.34 1fo5 s GLU 6 Ca 0.15 0.02 0.01 0.00 0.02 0.00 0.00 54.97 55.17 1fo5 s GLU 6 Cb -0.10 -0.02 0.21 0.00 0.10 0.00 0.00 34.13 34.32 1fo5 s GLU 6 CO 0.07 -0.02 0.73 1.28 0.02 0.00 0.00 175.26 177.34 1fo5 n LEU 7 N 3.19 3.91 -4.56 1.80 7.99 0.10 -0.85 117.00 128.57 1fo5 n LEU 7 Ca -0.14 -5.21 -0.41 0.00 -0.01 0.00 0.00 56.01 50.24 1fo5 n LEU 7 Cb 0.59 -0.95 -0.03 0.00 -0.11 0.00 0.00 43.42 42.93 1fo5 n LEU 7 CO 0.26 1.70 1.55 0.12 -1.51 0.00 0.00 177.39 179.50 1fo5 s PHE 8 N -1.64 2.59 0.00 -1.77 2.19 -0.13 -1.75 117.98 117.46 1fo5 s PHE 8 Ca 0.29 -0.98 0.00 0.00 0.33 0.00 0.00 56.93 56.56 1fo5 s PHE 8 Cb -0.02 -4.70 0.00 0.00 -1.31 0.00 0.00 43.02 36.99 1fo5 s PHE 8 CO -0.11 -1.91 0.00 0.25 1.83 0.00 0.00 175.22 175.28 1fo5 n THR 9 N 6.77 0.00 0.00 0.12 -2.24 -0.86 -1.13 114.28 116.95 1fo5 n THR 9 Ca 0.35 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 1fo5 n THR 9 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1fo5 n THR 9 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1fo5 n SER 10 N 0.00 0.00 -4.74 3.42 2.88 -1.26 -0.79 113.62 113.13 1fo5 n SER 10 Ca 0.00 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.18 1fo5 n SER 10 Cb 0.00 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.52 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 0.00 2.65 0.05 -1.46 0.04 -1.26 -4.99 135.00 130.03 1fo5 s PRO 11 Ca 0.00 1.97 -0.02 0.00 0.04 0.00 0.00 61.00 62.99 1fo5 s PRO 11 Cb 0.00 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1fo5 s PRO 11 CO 0.00 -1.50 -0.01 -1.64 0.04 0.00 0.00 177.00 173.89 1fo5 s MET 12 N -3.41 0.61 0.00 4.56 -1.94 -1.26 -4.91 119.30 112.94 1fo5 s MET 12 Ca 0.80 -1.15 0.00 0.00 -1.71 0.00 0.00 55.69 53.63 1fo5 s MET 12 Cb -0.35 0.21 0.00 0.00 2.01 0.00 0.00 34.83 36.71 1fo5 s MET 12 CO 0.38 -0.12 0.00 0.00 -0.01 0.00 0.00 175.02 175.27 1fo5 h PRO 14 N 0.00 0.00 -4.94 0.00 0.13 -1.93 -3.40 132.00 121.87 1fo5 h PRO 14 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.82 1fo5 h PRO 14 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 1fo5 h PRO 14 CO 0.00 0.00 -0.69 -3.38 -0.23 0.00 0.00 178.00 173.70 1fo5 s HIS 15 N -3.77 1.26 0.00 1.56 -3.43 -1.26 -4.42 115.29 105.23 1fo5 s HIS 15 Ca -0.00 -0.89 0.00 0.00 -0.80 0.00 0.00 55.06 53.37 1fo5 s HIS 15 Cb 0.10 -0.69 0.00 0.00 -1.43 0.00 0.00 32.58 30.56 1fo5 s HIS 15 CO 0.50 -0.06 0.00 0.00 -2.00 0.00 0.00 174.74 173.18 1fo5 h PRO 17 N 0.00 0.00 0.00 0.00 0.13 -1.99 -3.45 132.00 126.69 1fo5 h PRO 17 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1fo5 h PRO 17 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1fo5 h PRO 17 CO 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.77 1fo5 n ALA 18 N -2.12 0.00 -0.27 -0.56 0.00 -1.26 -1.48 120.51 114.83 1fo5 n ALA 18 Ca -0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.49 1fo5 n ALA 18 Cb 0.31 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.05 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 -0.21 1.60 -0.67 0.00 0.00 -1.93 -0.58 119.26 117.48 1fo5 h ALA 19 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1fo5 h ALA 19 Cb 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1fo5 h ALA 19 CO 0.00 0.25 0.38 0.87 0.00 0.00 0.00 179.25 180.75 1fo5 h LYS 20 N 0.91 0.91 0.12 0.00 1.57 -1.65 0.12 116.57 118.55 1fo5 h LYS 20 Ca 0.38 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 59.06 1fo5 h LYS 20 Cb 0.28 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1fo5 h LYS 20 CO -0.14 0.66 -0.06 0.00 -0.57 0.00 0.00 179.45 179.33 1fo5 h ARG 21 N 0.93 -0.16 -0.14 3.15 3.08 -1.31 -1.05 114.38 118.89 1fo5 h ARG 21 Ca 0.24 0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.24 1fo5 h ARG 21 Cb -0.00 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1fo5 h ARG 21 CO -0.04 0.17 -0.19 0.28 -1.07 0.00 0.00 179.97 179.11 1fo5 h VAL 22 N -0.49 1.21 0.28 2.04 2.07 -0.79 0.18 116.25 120.75 1fo5 h VAL 22 Ca -0.02 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1fo5 h VAL 22 Cb 0.39 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1fo5 h VAL 22 CO 0.03 0.29 -0.32 0.58 0.02 0.00 0.00 177.57 178.17 1fo5 h VAL 23 N 0.21 0.00 -0.87 2.57 2.07 -0.80 -1.91 116.25 117.53 1fo5 h VAL 23 Ca 0.04 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.59 1fo5 h VAL 23 Cb 0.47 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.19 1fo5 h VAL 23 CO 0.03 0.00 0.58 -0.08 0.02 0.00 0.00 177.57 178.12 1fo5 h GLU 24 N -0.60 1.07 0.39 1.57 4.81 -0.15 0.37 114.58 122.03 1fo5 h GLU 24 Ca -0.03 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1fo5 h GLU 24 Cb 0.53 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1fo5 h GLU 24 CO -0.06 0.71 -0.19 1.49 -0.73 0.00 0.00 179.01 180.23 1fo5 h GLU 25 N 1.10 -0.50 -0.27 1.92 4.57 -0.69 -0.69 114.58 120.02 1fo5 h GLU 25 Ca 0.34 0.03 -0.18 0.00 -1.18 0.00 0.00 59.36 58.37 1fo5 h GLU 25 Cb 0.00 0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1fo5 h GLU 25 CO -0.10 -0.31 -0.55 0.28 -1.18 0.00 0.00 179.01 177.14 1fo5 h VAL 26 N -0.56 1.28 0.00 0.32 2.07 -0.88 -3.19 116.25 115.29 1fo5 h VAL 26 Ca -0.05 -1.75 -0.03 0.00 0.82 0.00 0.00 66.70 65.69 1fo5 h VAL 26 Cb 0.42 1.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1fo5 h VAL 26 CO 0.09 0.57 -0.13 0.00 0.02 0.00 0.00 177.57 178.12 1fo5 h ALA 27 N 0.73 1.35 -1.00 1.67 0.00 -0.19 0.20 119.26 122.02 1fo5 h ALA 27 Ca 0.01 -0.12 0.16 0.00 0.00 0.00 0.00 54.91 54.96 1fo5 h ALA 27 Cb 1.16 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 1fo5 h ALA 27 CO 0.12 0.16 0.62 -0.97 0.00 0.00 0.00 179.25 179.18 1fo5 h ASN 28 N 0.00 0.85 0.03 0.00 -0.73 -1.10 -2.43 115.58 112.19 1fo5 h ASN 28 Ca -0.00 0.07 -0.33 0.00 1.87 0.00 0.00 56.30 57.91 1fo5 h ASN 28 Cb 0.32 -0.09 -0.04 0.00 0.27 0.00 0.00 38.32 38.78 1fo5 h ASN 28 CO 0.02 0.37 -1.86 -0.62 -0.37 0.00 0.00 177.43 174.97 1fo5 n GLU 29 N -4.69 0.62 -3.66 6.67 -0.58 -0.01 -4.80 120.64 114.19 1fo5 n GLU 29 Ca 0.21 0.39 -0.29 0.00 -0.42 0.00 0.00 57.16 57.06 1fo5 n GLU 29 Cb 0.48 -1.65 -0.12 0.00 -0.57 0.00 0.00 31.44 29.57 1fo5 n GLU 29 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 1fo5 s MET 30 N -2.46 1.28 0.00 3.49 1.75 0.49 -5.00 119.30 118.86 1fo5 s MET 30 Ca -0.31 -2.09 0.00 0.00 -1.25 0.00 0.00 55.69 52.04 1fo5 s MET 30 Cb 0.09 -2.20 0.00 0.00 2.84 0.00 0.00 34.83 35.56 1fo5 s MET 30 CO 0.60 -1.21 0.49 -0.35 -0.65 0.00 0.00 175.02 173.90 1fo5 n PRO 31 N 3.32 0.58 0.08 4.11 -0.04 -0.92 -3.78 135.00 138.36 1fo5 n PRO 31 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1fo5 n PRO 31 Cb 0.37 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.29 -0.37 -2.12 3.54 2.03 -1.26 -4.89 116.55 113.19 1fo5 n ASP 32 Ca 0.00 0.29 -0.16 0.00 0.52 0.00 0.00 54.79 55.43 1fo5 n ASP 32 Cb 0.04 0.49 -0.10 0.00 -0.72 0.00 0.00 41.12 40.83 1fo5 n ASP 32 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fo5 n ALA 33 N -3.00 6.12 -3.68 -1.67 0.00 -1.25 -4.75 120.51 112.28 1fo5 n ALA 33 Ca 0.00 -2.07 -0.28 0.00 0.00 0.00 0.00 53.44 51.09 1fo5 n ALA 33 Cb 0.00 -2.09 -0.12 0.00 0.00 0.00 0.00 19.45 17.25 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 -0.40 1.61 -0.10 0.00 0.11 -1.26 -0.90 120.40 119.46 1fo5 s VAL 34 Ca 0.56 -3.20 -0.22 0.00 -2.93 0.00 0.00 61.98 56.19 1fo5 s VAL 34 Cb 0.31 -2.09 -0.04 0.00 -1.53 0.00 0.00 36.38 33.03 1fo5 s VAL 34 CO -0.08 -1.04 0.63 -0.70 -3.33 0.00 0.00 175.10 170.59 1fo5 s GLU 35 N -0.38 4.37 -0.31 1.54 -6.30 -0.65 -5.03 118.70 111.93 1fo5 s GLU 35 Ca 0.25 0.72 0.00 0.00 -2.50 0.00 0.00 54.97 53.45 1fo5 s GLU 35 Cb -0.09 -3.47 0.14 0.00 0.00 0.00 0.00 34.13 30.72 1fo5 s GLU 35 CO -0.12 0.04 0.30 0.08 0.02 0.00 0.00 175.26 175.58 1fo5 s VAL 36 N 0.95 -0.34 0.32 3.70 1.01 -1.25 -0.49 120.40 124.29 1fo5 s VAL 36 Ca 0.33 -0.69 -0.26 0.00 0.00 0.00 0.00 61.98 61.36 1fo5 s VAL 36 Cb -0.17 -0.92 -0.10 0.00 0.00 0.00 0.00 36.38 35.20 1fo5 s VAL 36 CO 0.15 -0.54 0.94 -1.61 0.00 0.00 0.00 175.10 174.04 1fo5 s GLU 37 N 2.05 4.60 -0.27 2.72 0.41 -0.59 -4.96 118.70 122.66 1fo5 s GLU 37 Ca 0.12 1.33 -0.05 0.00 -0.41 0.00 0.00 54.97 55.96 1fo5 s GLU 37 Cb -0.15 -2.83 0.01 0.00 -1.78 0.00 0.00 34.13 29.38 1fo5 s GLU 37 CO -0.24 0.30 0.03 -0.47 -0.49 0.00 0.00 175.26 174.38 1fo5 s TYR 38 N -1.59 3.11 -0.49 1.61 5.04 -1.26 -0.73 117.35 123.05 1fo5 s TYR 38 Ca 0.49 -1.11 0.03 0.00 -2.44 0.00 0.00 57.07 54.05 1fo5 s TYR 38 Cb -0.19 -2.19 0.15 0.00 0.35 0.00 0.00 41.96 40.08 1fo5 s TYR 38 CO 0.24 -0.61 0.30 0.96 -1.34 0.00 0.00 175.55 175.11 1fo5 s ILE 39 N 1.46 1.54 0.08 3.14 -0.00 -0.72 -4.97 121.20 121.74 1fo5 s ILE 39 Ca 0.02 -2.92 -0.34 0.00 -0.00 0.00 0.00 60.65 57.41 1fo5 s ILE 39 Cb -0.17 -2.06 -0.13 0.00 -0.00 0.00 0.00 42.46 40.10 1fo5 s ILE 39 CO 0.00 -0.97 1.65 -3.20 -0.00 0.00 0.00 174.94 172.43 1fo5 n ASN 40 N 3.12 3.12 -4.58 4.36 5.15 -1.26 -2.02 115.26 123.15 1fo5 n ASN 40 Ca 0.14 1.05 -0.42 0.00 -0.60 0.00 0.00 54.58 54.75 1fo5 n ASN 40 Cb 0.37 -1.40 0.00 0.00 -0.53 0.00 0.00 39.78 38.22 1fo5 n ASN 40 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 1fo5 n VAL 41 N 3.87 2.23 0.00 3.44 3.14 0.03 -4.93 118.33 126.10 1fo5 n VAL 41 Ca 0.19 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 61.07 1fo5 n VAL 41 Cb 0.28 -1.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.07 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 0.35 0.00 0.00 1.45 1.56 -1.26 -4.92 117.12 114.30 1fo5 n MET 42 Ca 0.10 0.00 0.11 0.00 -0.27 0.00 0.00 57.70 57.64 1fo5 n MET 42 Cb 0.37 0.00 0.61 0.00 2.15 0.00 0.00 33.22 36.35 1fo5 n MET 42 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1fo5 n GLU 43 N -0.78 0.51 -4.00 2.12 1.02 -1.26 -4.91 120.64 113.33 1fo5 n GLU 43 Ca 0.00 0.04 -0.35 0.00 -0.02 0.00 0.00 57.16 56.83 1fo5 n GLU 43 Cb 0.00 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 29.91 1fo5 n GLU 43 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1fo5 n ASN 44 N -1.14 -2.34 -4.75 1.62 5.15 -1.26 -4.86 115.26 107.67 1fo5 n ASN 44 Ca 0.14 -1.04 -0.41 0.00 -0.60 0.00 0.00 54.58 52.67 1fo5 n ASN 44 Cb 0.12 -1.25 -0.03 0.00 -0.53 0.00 0.00 39.78 38.09 1fo5 n ASN 44 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1fo5 s PRO 45 N -6.88 4.39 0.66 1.20 0.04 -1.26 -4.89 135.00 128.26 1fo5 s PRO 45 Ca 0.31 2.11 0.43 0.00 0.04 0.00 0.00 61.00 63.88 1fo5 s PRO 45 Cb -0.17 -3.14 2.35 0.00 0.04 0.00 0.00 34.50 33.58 1fo5 s PRO 45 CO 0.78 -0.19 2.36 1.96 0.04 0.00 0.00 177.00 181.95 1fo5 h GLN 46 N 4.41 0.00 -0.87 4.56 1.08 -1.93 -2.61 115.11 119.75 1fo5 h GLN 46 Ca -0.47 0.00 0.22 0.00 -1.45 0.00 0.00 58.65 56.95 1fo5 h GLN 46 Cb 1.22 0.00 -0.16 0.00 -0.05 0.00 0.00 27.48 28.49 1fo5 h GLN 46 CO 0.72 0.00 -0.06 1.17 -0.95 0.00 0.00 178.83 179.70 1fo5 n LYS 47 N -3.18 -0.07 -0.02 1.46 0.00 -1.26 -0.14 118.16 114.94 1fo5 n LYS 47 Ca -0.03 1.32 -0.13 0.00 0.00 0.00 0.00 58.31 59.47 1fo5 n LYS 47 Cb 0.08 -2.05 -0.14 0.00 0.00 0.00 0.00 35.03 32.92 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 -3.38 1.30 1.88 3.14 0.00 -0.99 -4.60 120.51 117.86 1fo5 n ALA 48 Ca 0.18 -0.75 0.11 0.00 0.00 0.00 0.00 53.44 52.98 1fo5 n ALA 48 Cb 0.59 -0.74 0.61 0.00 0.00 0.00 0.00 19.45 19.91 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 -3.17 1.12 0.00 0.00 2.81 0.21 -4.71 117.12 113.38 1fo5 n MET 49 Ca -0.23 -0.18 0.00 0.00 -1.81 0.00 0.00 57.70 55.48 1fo5 n MET 49 Cb 1.06 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 32.21 1fo5 n MET 49 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1fo5 n GLU 50 N -0.65 3.59 0.00 0.03 0.28 0.80 -4.39 120.64 120.30 1fo5 n GLU 50 Ca 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.16 1fo5 n GLU 50 Cb 0.12 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.99 1fo5 n GLU 50 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1fo5 n TYR 51 N 0.00 -1.32 1.02 -1.84 4.01 -1.26 -2.32 117.16 115.45 1fo5 n TYR 51 Ca 0.00 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.84 1fo5 n TYR 51 Cb 0.00 0.15 0.31 0.00 -0.31 0.00 0.00 39.34 39.49 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 0.00 0.56 0.08 2.72 0.00 -1.26 -4.36 105.19 102.94 1fo5 n GLY 52 Ca 0.00 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.49 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 0.52 1.46 -0.75 -0.61 3.06 -1.26 -4.98 119.36 116.81 1fo5 n ILE 53 Ca 0.16 0.16 -0.03 0.00 -2.50 0.00 0.00 62.75 60.54 1fo5 n ILE 53 Cb 0.36 -2.36 -0.01 0.00 0.54 0.00 0.00 39.64 38.17 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 -4.53 -1.75 -3.57 9.51 2.81 -0.98 -4.88 117.12 113.73 1fo5 n MET 54 Ca -0.12 0.36 -0.26 0.00 -1.81 0.00 0.00 57.70 55.87 1fo5 n MET 54 Cb 0.41 -4.07 -0.16 0.00 -0.71 0.00 0.00 33.22 28.69 1fo5 n MET 54 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1fo5 s ALA 55 N -0.94 0.42 0.87 3.04 0.00 -1.26 -4.96 121.76 118.93 1fo5 s ALA 55 Ca 0.00 -0.55 -0.13 0.00 0.00 0.00 0.00 51.96 51.29 1fo5 s ALA 55 Cb 0.00 -1.20 0.07 0.00 0.00 0.00 0.00 23.12 21.99 1fo5 s ALA 55 CO 0.00 -1.36 0.87 1.33 0.00 0.00 0.00 175.76 176.60 1fo5 n VAL 56 N 5.27 0.82 -2.18 0.00 0.24 -1.26 -4.32 118.33 116.90 1fo5 n VAL 56 Ca -0.06 -0.17 -0.43 0.00 -2.04 0.00 0.00 64.34 61.64 1fo5 n VAL 56 Cb 0.46 -0.92 -0.02 0.00 -1.47 0.00 0.00 33.84 31.89 1fo5 n VAL 56 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1fo5 s PRO 57 N -3.96 3.66 -0.44 7.34 0.04 -1.26 -5.11 135.00 135.26 1fo5 s PRO 57 Ca 0.66 1.39 -0.24 0.00 0.04 0.00 0.00 61.00 62.85 1fo5 s PRO 57 Cb -0.26 -4.05 0.02 0.00 0.04 0.00 0.00 34.50 30.26 1fo5 s PRO 57 CO 0.59 -1.46 0.84 0.99 0.04 0.00 0.00 177.00 178.00 1fo5 s THR 58 N 5.51 4.59 0.15 1.26 2.01 -0.28 -4.46 115.64 124.42 1fo5 s THR 58 Ca 0.69 0.62 0.09 0.00 0.31 0.00 0.00 61.69 63.40 1fo5 s THR 58 Cb -0.21 -4.35 -0.04 0.00 0.01 0.00 0.00 72.50 67.91 1fo5 s THR 58 CO 0.30 -0.72 -0.14 -0.63 -0.69 0.00 0.00 174.62 172.73 1fo5 s ILE 59 N 3.45 3.00 -0.08 1.82 -1.09 -0.51 -0.96 121.20 126.83 1fo5 s ILE 59 Ca 0.33 -1.58 0.04 0.00 -2.23 0.00 0.00 60.65 57.21 1fo5 s ILE 59 Cb -0.11 -2.43 -0.01 0.00 -1.58 0.00 0.00 42.46 38.33 1fo5 s ILE 59 CO 0.23 0.00 -0.22 -0.69 -1.23 0.00 0.00 174.94 173.03 1fo5 s VAL 60 N -1.41 2.27 0.17 2.92 1.01 -0.03 -0.62 120.40 124.70 1fo5 s VAL 60 Ca 0.21 -0.97 0.10 0.00 0.00 0.00 0.00 61.98 61.32 1fo5 s VAL 60 Cb -0.10 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1fo5 s VAL 60 CO 0.12 0.56 -0.22 0.27 0.00 0.00 0.00 175.10 175.84 1fo5 s ILE 61 N 0.06 2.07 0.00 2.22 -5.25 -0.61 -1.61 121.20 118.08 1fo5 s ILE 61 Ca -0.09 -1.91 0.00 0.00 -0.99 0.00 0.00 60.65 57.66 1fo5 s ILE 61 Cb -0.15 -1.94 0.00 0.00 2.95 0.00 0.00 42.46 43.32 1fo5 s ILE 61 CO 0.06 -0.16 0.00 0.59 -1.79 0.00 0.00 174.94 173.63 1fo5 n ASN 62 N 0.43 0.00 0.00 4.36 4.13 -1.16 -0.03 115.26 122.99 1fo5 n ASN 62 Ca -0.14 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.12 1fo5 n ASN 62 Cb 0.56 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.80 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 0.58 3.62 7.41 0.00 -1.25 -1.63 105.19 113.92 1fo5 n GLY 63 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 6.51 0.15 1.61 1.01 0.96 -5.07 116.67 121.85 1fo5 s ASP 64 Ca 0.00 0.63 -0.30 0.00 0.71 0.00 0.00 52.55 53.58 1fo5 s ASP 64 Cb 0.00 -2.31 -0.08 0.00 1.01 0.00 0.00 42.92 41.54 1fo5 s ASP 64 CO 0.00 -0.32 1.21 0.54 0.21 0.00 0.00 175.17 176.81 1fo5 s VAL 65 N 2.37 3.65 0.16 -1.27 0.11 -1.26 -1.57 120.40 122.59 1fo5 s VAL 65 Ca 0.24 1.33 -0.24 0.00 -2.93 0.00 0.00 61.98 60.38 1fo5 s VAL 65 Cb -0.16 -3.85 0.06 0.00 -1.53 0.00 0.00 36.38 30.91 1fo5 s VAL 65 CO 0.09 0.18 0.70 -0.70 -3.33 0.00 0.00 175.10 172.04 1fo5 s GLU 66 N 0.11 1.32 0.14 1.54 2.56 0.21 -4.98 118.70 119.60 1fo5 s GLU 66 Ca 0.55 -0.58 0.08 0.00 0.00 0.00 0.00 54.97 55.01 1fo5 s GLU 66 Cb -0.32 0.55 -0.04 0.00 2.00 0.00 0.00 34.13 36.32 1fo5 s GLU 66 CO 0.35 -0.59 -0.18 -0.59 -0.56 0.00 0.00 175.26 173.69 1fo5 s PHE 67 N -3.66 1.69 0.01 5.30 -0.71 -1.26 -1.42 117.98 117.93 1fo5 s PHE 67 Ca 0.05 -0.48 -0.03 0.00 -1.04 0.00 0.00 56.93 55.43 1fo5 s PHE 67 Cb -0.02 -0.88 -0.01 0.00 -1.21 0.00 0.00 43.02 40.90 1fo5 s PHE 67 CO -0.07 0.25 0.04 0.42 -1.34 0.00 0.00 175.22 174.52 1fo5 s ILE 68 N -1.83 0.09 0.00 -4.49 -1.09 -1.26 -5.03 121.20 107.59 1fo5 s ILE 68 Ca 0.11 -0.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.79 1fo5 s ILE 68 Cb -0.07 -0.31 0.00 0.00 -1.58 0.00 0.00 42.46 40.50 1fo5 s ILE 68 CO 0.05 -0.41 0.00 0.61 -1.23 0.00 0.00 174.94 173.97 1fo5 n GLY 69 N 1.68 -0.75 0.11 6.18 0.00 -1.26 -4.27 105.19 106.88 1fo5 n GLY 69 Ca -0.22 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.76 0.24 -3.00 4.61 0.00 -2.01 -3.48 119.26 114.86 1fo5 h ALA 70 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1fo5 h ALA 70 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1fo5 h ALA 70 CO 0.00 0.96 0.00 -0.35 0.00 0.00 0.00 179.25 179.86 1fo5 n PRO 71 N -3.57 0.00 0.00 0.00 -0.04 -1.26 -4.67 135.00 125.45 1fo5 n PRO 71 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1fo5 n PRO 71 Cb 0.94 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.40 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 0.00 0.00 0.95 0.52 -2.24 -1.26 -4.73 114.28 107.52 1fo5 n THR 72 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1fo5 n THR 72 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 0.00 0.95 0.25 -0.78 4.81 -1.26 -4.33 118.16 117.81 1fo5 n LYS 73 Ca 0.00 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 57.52 1fo5 n LYS 73 Cb 0.00 -1.44 0.64 0.00 0.02 0.00 0.00 35.03 34.24 1fo5 n LYS 73 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1fo5 h GLU 74 N 0.05 0.00 -0.62 1.64 5.08 -1.94 0.31 114.58 119.10 1fo5 h GLU 74 Ca 0.00 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.49 1fo5 h GLU 74 Cb 0.51 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.65 1fo5 h GLU 74 CO 0.00 0.07 -0.03 0.00 -1.00 0.00 0.00 179.01 178.05 1fo5 h ALA 75 N 1.93 0.57 0.09 3.43 0.00 -1.90 -0.75 119.26 122.63 1fo5 h ALA 75 Ca -0.00 0.20 -0.26 0.00 0.00 0.00 0.00 54.91 54.85 1fo5 h ALA 75 Cb 0.14 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1fo5 h ALA 75 CO 0.01 -0.40 -1.17 1.25 0.00 0.00 0.00 179.25 178.94 1fo5 h LEU 76 N 0.09 0.33 -0.63 0.00 7.12 -0.84 -3.32 115.31 118.07 1fo5 h LEU 76 Ca 0.32 -0.35 -0.13 0.00 0.13 0.00 0.00 57.88 57.86 1fo5 h LEU 76 Cb 0.52 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 40.53 1fo5 h LEU 76 CO -0.55 1.26 -0.26 -0.37 -0.13 0.00 0.00 178.44 178.39 1fo5 h VAL 77 N 0.06 1.27 0.00 1.05 -1.51 -0.38 0.33 116.25 117.08 1fo5 h VAL 77 Ca -0.10 -1.40 0.00 0.00 -1.23 0.00 0.00 66.70 63.97 1fo5 h VAL 77 Cb 1.90 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 32.32 1fo5 h VAL 77 CO 0.18 0.47 0.31 -0.08 -1.23 0.00 0.00 177.57 177.23 1fo5 h GLU 78 N 0.68 0.00 0.03 5.19 4.81 -1.31 -0.61 114.58 123.37 1fo5 h GLU 78 Ca 0.09 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.95 1fo5 h GLU 78 Cb 0.79 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.13 1fo5 h GLU 78 CO 0.07 0.00 -2.04 0.00 -0.73 0.00 0.00 179.01 176.30 1fo5 n ALA 79 N -1.87 1.06 -0.01 2.92 0.00 0.43 -4.34 120.51 118.70 1fo5 n ALA 79 Ca -0.02 -0.82 0.22 0.00 0.00 0.00 0.00 53.44 52.82 1fo5 n ALA 79 Cb 0.36 -0.29 0.71 0.00 0.00 0.00 0.00 19.45 20.24 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 -0.59 0.62 0.00 0.00 3.07 0.10 0.12 117.51 120.84 1fo5 h ILE 80 Ca -0.52 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.89 1fo5 h ILE 80 Cb 1.67 0.69 0.00 0.00 -0.27 0.00 0.00 36.82 38.90 1fo5 h ILE 80 CO -0.19 0.00 0.00 2.29 -1.05 0.00 0.00 178.15 179.20 1fo5 n LYS 81 N -4.20 0.00 0.21 0.16 2.85 -0.75 -4.17 118.16 112.26 1fo5 n LYS 81 Ca 0.11 0.05 0.14 0.00 -1.05 0.00 0.00 58.31 57.55 1fo5 n LYS 81 Cb 0.67 -1.00 0.75 0.00 -0.65 0.00 0.00 35.03 34.81 1fo5 n LYS 81 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 1fo5 h LYS 82 N 0.00 0.00 0.00 -1.58 5.09 -1.53 -1.40 116.57 117.15 1fo5 h LYS 82 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1fo5 h LYS 82 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 1fo5 h LYS 82 CO 0.00 0.00 0.00 0.54 -2.09 0.00 0.00 179.45 177.90 1fo5 n ARG 83 N -2.48 0.01 0.00 0.07 5.12 0.34 -5.11 116.66 114.62 1fo5 n ARG 83 Ca -0.02 0.33 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 1fo5 n ARG 83 Cb 0.06 -1.53 0.00 0.00 -1.16 0.00 0.00 32.46 29.83 1fo5 n ARG 83 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17