#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 -0.98 -0.09 7.83 0.15 -1.26 -5.15 113.70 114.20 1fo5 s SER 1 Ca 0.00 -0.67 -0.04 0.00 0.70 0.00 0.00 55.95 55.94 1fo5 s SER 1 Cb 0.00 1.26 0.05 0.00 -1.71 0.00 0.00 66.02 65.62 1fo5 s SER 1 CO 0.00 -0.09 0.18 -0.75 1.20 0.00 0.00 173.24 173.79 1fo5 s LYS 2 N 1.64 0.08 -0.37 5.44 2.20 -1.26 -4.82 119.74 122.64 1fo5 s LYS 2 Ca 0.18 0.57 -0.15 0.00 -0.36 0.00 0.00 55.97 56.22 1fo5 s LYS 2 Cb 0.01 -0.20 -0.00 0.00 -1.51 0.00 0.00 37.83 36.13 1fo5 s LYS 2 CO -0.10 -0.27 0.32 0.08 -0.36 0.00 0.00 175.35 175.02 1fo5 s VAL 3 N 2.07 5.21 0.20 4.02 1.01 -0.04 -4.98 120.40 127.89 1fo5 s VAL 3 Ca -0.00 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.42 1fo5 s VAL 3 Cb -0.12 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 1fo5 s VAL 3 CO -0.07 -0.17 0.95 -0.54 0.00 0.00 0.00 175.10 175.28 1fo5 s LYS 4 N 1.87 4.80 -0.01 2.72 -0.14 -0.52 -1.21 119.74 127.24 1fo5 s LYS 4 Ca 0.08 1.49 0.02 0.00 -1.36 0.00 0.00 55.97 56.21 1fo5 s LYS 4 Cb -0.17 -3.30 0.00 0.00 -1.68 0.00 0.00 37.83 32.67 1fo5 s LYS 4 CO 0.11 0.42 -0.06 0.42 -0.76 0.00 0.00 175.35 175.48 1fo5 s ILE 5 N -0.83 0.51 0.03 2.17 1.09 -0.30 -0.87 121.20 123.00 1fo5 s ILE 5 Ca 0.43 -0.24 0.02 0.00 -1.10 0.00 0.00 60.65 59.76 1fo5 s ILE 5 Cb -0.26 -0.46 -0.02 0.00 -1.06 0.00 0.00 42.46 40.67 1fo5 s ILE 5 CO 0.32 0.16 -0.06 -1.61 -0.10 0.00 0.00 174.94 173.65 1fo5 s GLU 6 N 0.12 0.43 -0.44 2.79 2.02 -0.68 -0.80 118.70 122.13 1fo5 s GLU 6 Ca -0.01 -0.55 0.04 0.00 0.02 0.00 0.00 54.97 54.46 1fo5 s GLU 6 Cb -0.06 -0.22 0.17 0.00 0.10 0.00 0.00 34.13 34.12 1fo5 s GLU 6 CO -0.00 0.04 0.35 -1.17 0.02 0.00 0.00 175.26 174.50 1fo5 s LEU 7 N -1.13 1.78 -0.71 1.80 2.96 0.38 -0.80 118.68 122.94 1fo5 s LEU 7 Ca -0.08 -3.13 -0.20 0.00 -0.22 0.00 0.00 54.13 50.51 1fo5 s LEU 7 Cb -0.08 -0.57 0.11 0.00 0.50 0.00 0.00 46.19 46.15 1fo5 s LEU 7 CO -0.00 -0.17 0.90 0.12 -1.32 0.00 0.00 176.35 175.89 1fo5 s PHE 8 N -0.08 2.96 -0.07 5.38 5.36 -0.11 -1.33 117.98 130.10 1fo5 s PHE 8 Ca 0.31 -0.99 -0.31 0.00 -0.96 0.00 0.00 56.93 54.98 1fo5 s PHE 8 Cb 0.02 -4.17 0.12 0.00 -0.34 0.00 0.00 43.02 38.65 1fo5 s PHE 8 CO -0.19 -1.45 1.37 -0.08 -1.46 0.00 0.00 175.22 173.42 1fo5 s THR 9 N 3.02 0.00 -0.39 0.12 -1.32 -1.15 -1.31 115.64 114.61 1fo5 s THR 9 Ca 0.21 -0.07 0.11 0.00 -1.21 0.00 0.00 61.69 60.72 1fo5 s THR 9 Cb -0.16 -2.44 0.32 0.00 -1.51 0.00 0.00 72.50 68.72 1fo5 s THR 9 CO 0.03 0.00 0.68 -1.20 -2.21 0.00 0.00 174.62 171.92 1fo5 n SER 10 N -0.73 0.84 -4.57 8.08 7.64 -1.26 -1.71 113.62 121.91 1fo5 n SER 10 Ca -0.03 -2.95 -0.42 0.00 1.01 0.00 0.00 58.87 56.48 1fo5 n SER 10 Cb 0.61 -0.62 -0.02 0.00 -1.01 0.00 0.00 64.21 63.17 1fo5 n SER 10 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1fo5 s PRO 11 N -2.12 3.77 -1.45 1.43 0.04 -1.26 -4.18 135.00 131.22 1fo5 s PRO 11 Ca 0.39 -1.52 -0.11 0.00 0.04 0.00 0.00 61.00 59.81 1fo5 s PRO 11 Cb 0.29 -5.43 0.05 0.00 0.04 0.00 0.00 34.50 29.45 1fo5 s PRO 11 CO -0.09 -2.23 1.03 -1.33 0.04 0.00 0.00 177.00 174.42 1fo5 n MET 12 N 8.64 -6.32 -0.25 4.56 2.81 -1.26 -4.47 117.12 120.83 1fo5 n MET 12 Ca 0.40 0.68 -0.03 0.00 -1.81 0.00 0.00 57.70 56.94 1fo5 n MET 12 Cb 0.49 -5.61 0.03 0.00 -0.71 0.00 0.00 33.22 27.42 1fo5 n MET 12 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1fo5 n PRO 14 N -5.45 0.74 0.00 0.00 -0.04 -1.26 -2.55 135.00 126.43 1fo5 n PRO 14 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1fo5 n PRO 14 Cb 0.37 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 1fo5 n PRO 14 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1fo5 n HIS 15 N 1.53 -1.13 -4.05 0.54 8.25 0.17 -5.08 115.22 115.46 1fo5 n HIS 15 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 1fo5 n HIS 15 Cb 0.37 0.44 -0.15 0.00 1.12 0.00 0.00 29.99 31.77 1fo5 n HIS 15 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fo5 n PRO 17 N 4.35 2.73 0.00 0.00 -0.04 -1.26 -4.19 135.00 136.59 1fo5 n PRO 17 Ca -0.06 -2.82 0.00 0.00 -0.04 0.00 0.00 63.50 60.59 1fo5 n PRO 17 Cb 0.42 -3.40 0.00 0.00 -0.04 0.00 0.00 33.50 30.48 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 8.26 -0.11 0.04 0.55 0.00 -1.26 -1.52 120.51 126.47 1fo5 n ALA 18 Ca 0.50 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.97 1fo5 n ALA 18 Cb 0.43 0.16 0.43 0.00 0.00 0.00 0.00 19.45 20.47 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 -1.82 1.67 -0.33 0.00 0.00 -1.95 -1.82 119.26 115.01 1fo5 h ALA 19 Ca 0.00 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.91 1fo5 h ALA 19 Cb 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 1fo5 h ALA 19 CO 0.00 0.27 -0.12 0.87 0.00 0.00 0.00 179.25 180.27 1fo5 h LYS 20 N 0.44 -0.06 0.70 0.00 1.79 -1.88 0.31 116.57 117.88 1fo5 h LYS 20 Ca 0.11 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.56 1fo5 h LYS 20 Cb 0.05 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 1fo5 h LYS 20 CO -0.02 -0.04 -0.38 0.00 -1.08 0.00 0.00 179.45 177.94 1fo5 h ARG 21 N -0.06 -0.97 -0.72 3.15 3.08 -0.76 -1.56 114.38 116.53 1fo5 h ARG 21 Ca 0.16 0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.34 1fo5 h ARG 21 Cb 0.31 0.22 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 1fo5 h ARG 21 CO -0.37 -0.65 0.48 0.28 -1.07 0.00 0.00 179.97 178.64 1fo5 h VAL 22 N -1.00 1.02 0.01 2.04 2.07 -0.37 0.13 116.25 120.14 1fo5 h VAL 22 Ca -0.09 -0.26 -0.20 0.00 0.82 0.00 0.00 66.70 66.97 1fo5 h VAL 22 Cb 0.79 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1fo5 h VAL 22 CO 0.13 0.14 -0.93 -0.37 0.02 0.00 0.00 177.57 176.55 1fo5 h VAL 23 N 0.75 1.63 -0.53 2.57 -1.51 -0.46 -1.90 116.25 116.80 1fo5 h VAL 23 Ca 0.31 -3.08 0.00 0.00 -1.23 0.00 0.00 66.70 62.70 1fo5 h VAL 23 Cb 0.26 2.68 -0.03 0.00 -2.13 0.00 0.00 31.29 32.08 1fo5 h VAL 23 CO -0.10 0.88 0.33 -0.08 -1.23 0.00 0.00 177.57 177.37 1fo5 h GLU 24 N 0.01 0.71 0.44 5.19 4.57 -0.15 -1.19 114.58 124.16 1fo5 h GLU 24 Ca -0.02 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 1fo5 h GLU 24 Cb 1.63 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 30.05 1fo5 h GLU 24 CO 0.12 0.49 -0.32 1.49 -1.18 0.00 0.00 179.01 179.62 1fo5 h GLU 25 N 0.71 -0.71 0.00 1.92 4.57 -0.63 -1.09 114.58 119.35 1fo5 h GLU 25 Ca 0.19 0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.30 1fo5 h GLU 25 Cb -0.04 0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.69 1fo5 h GLU 25 CO -0.04 -0.48 -0.55 -0.39 -1.18 0.00 0.00 179.01 176.38 1fo5 h VAL 26 N -0.74 1.28 0.00 0.32 -1.51 -1.39 -2.53 116.25 111.67 1fo5 h VAL 26 Ca -0.04 -1.96 -0.01 0.00 -1.23 0.00 0.00 66.70 63.45 1fo5 h VAL 26 Cb 0.63 2.09 -0.00 0.00 -2.13 0.00 0.00 31.29 31.88 1fo5 h VAL 26 CO 0.02 0.54 -0.06 0.00 -1.23 0.00 0.00 177.57 176.84 1fo5 h ALA 27 N 1.45 1.36 0.00 5.19 0.00 -0.82 0.23 119.26 126.67 1fo5 h ALA 27 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1fo5 h ALA 27 Cb 1.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1fo5 h ALA 27 CO 0.07 0.07 0.01 -0.97 0.00 0.00 0.00 179.25 178.44 1fo5 h ASN 28 N 0.00 0.00 0.00 0.00 -1.24 -0.75 -3.11 115.58 110.48 1fo5 h ASN 28 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1fo5 h ASN 28 Cb 0.17 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.22 1fo5 h ASN 28 CO 0.01 0.00 -0.38 -0.62 -1.29 0.00 0.00 177.43 175.15 1fo5 n GLU 29 N -2.56 1.27 -3.26 6.67 -0.58 -0.65 -4.93 120.64 116.59 1fo5 n GLU 29 Ca -0.02 0.00 -0.25 0.00 -0.42 0.00 0.00 57.16 56.47 1fo5 n GLU 29 Cb 0.06 -0.69 -0.07 0.00 -0.57 0.00 0.00 31.44 30.17 1fo5 n GLU 29 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1fo5 n MET 30 N -1.21 1.84 -0.07 3.49 2.81 0.73 -5.00 117.12 119.71 1fo5 n MET 30 Ca 0.00 -4.07 0.00 0.00 -1.81 0.00 0.00 57.70 51.82 1fo5 n MET 30 Cb 0.19 -1.84 0.00 0.00 -0.71 0.00 0.00 33.22 30.86 1fo5 n MET 30 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1fo5 n PRO 31 N 0.86 0.53 0.02 0.03 -0.04 -1.17 -3.55 135.00 131.67 1fo5 n PRO 31 Ca 0.26 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1fo5 n PRO 31 Cb 0.47 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 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 1.01 -0.30 -0.21 3.54 2.03 -1.26 -4.94 116.55 116.42 1fo5 n ASP 32 Ca 0.00 0.39 0.00 0.00 0.52 0.00 0.00 54.79 55.70 1fo5 n ASP 32 Cb 0.26 0.61 0.00 0.00 -0.72 0.00 0.00 41.12 41.27 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 -2.76 2.07 -2.97 -1.67 0.00 -1.23 -4.77 120.51 109.18 1fo5 n ALA 33 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 1fo5 n ALA 33 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 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 -1.59 4.78 -1.10 0.00 0.11 -1.23 -0.86 120.40 120.51 1fo5 s VAL 34 Ca 0.00 -1.53 -0.12 0.00 -2.93 0.00 0.00 61.98 57.40 1fo5 s VAL 34 Cb 0.00 -4.73 0.23 0.00 -1.53 0.00 0.00 36.38 30.35 1fo5 s VAL 34 CO 0.00 -1.44 1.17 -0.70 -3.33 0.00 0.00 175.10 170.80 1fo5 s GLU 35 N 2.56 4.06 -0.05 1.54 -6.30 -0.35 -5.02 118.70 115.15 1fo5 s GLU 35 Ca 0.29 -2.86 -0.12 0.00 -2.50 0.00 0.00 54.97 49.78 1fo5 s GLU 35 Cb -0.07 -4.71 -0.05 0.00 0.00 0.00 0.00 34.13 29.29 1fo5 s GLU 35 CO -0.07 -1.43 0.32 0.14 0.02 0.00 0.00 175.26 174.24 1fo5 s VAL 36 N -0.02 5.20 -0.25 3.70 -7.23 -1.26 -1.15 120.40 119.39 1fo5 s VAL 36 Ca 0.33 0.63 -0.00 0.00 -1.81 0.00 0.00 61.98 61.12 1fo5 s VAL 36 Cb -0.08 -3.61 0.07 0.00 0.56 0.00 0.00 36.38 33.33 1fo5 s VAL 36 CO -0.06 0.57 0.02 -0.70 -0.31 0.00 0.00 175.10 174.62 1fo5 s GLU 37 N -0.92 1.12 -0.21 4.82 2.56 0.02 -4.95 118.70 121.13 1fo5 s GLU 37 Ca 0.21 -0.95 -0.29 0.00 0.00 0.00 0.00 54.97 53.94 1fo5 s GLU 37 Cb -0.15 -2.36 0.00 0.00 2.00 0.00 0.00 34.13 33.63 1fo5 s GLU 37 CO 0.10 -0.74 1.01 -0.47 -0.56 0.00 0.00 175.26 174.59 1fo5 s TYR 38 N 1.53 3.36 -0.41 5.30 5.04 -1.26 -0.47 117.35 130.44 1fo5 s TYR 38 Ca 0.01 1.45 0.02 0.00 -2.44 0.00 0.00 57.07 56.10 1fo5 s TYR 38 Cb -0.18 -3.23 0.13 0.00 0.35 0.00 0.00 41.96 39.03 1fo5 s TYR 38 CO -0.12 -0.43 0.21 0.96 -1.34 0.00 0.00 175.55 174.83 1fo5 s ILE 39 N 2.97 1.29 -0.31 3.14 -0.00 -0.44 -4.93 121.20 122.92 1fo5 s ILE 39 Ca 0.43 -2.32 -0.36 0.00 -0.00 0.00 0.00 60.65 58.40 1fo5 s ILE 39 Cb -0.16 -1.92 -0.13 0.00 -0.00 0.00 0.00 42.46 40.26 1fo5 s ILE 39 CO 0.08 -0.85 2.06 -0.46 -0.00 0.00 0.00 174.94 175.77 1fo5 n ASN 40 N 3.81 2.29 -4.53 4.36 6.94 -1.25 -2.93 115.26 123.95 1fo5 n ASN 40 Ca 0.07 0.62 -0.47 0.00 -0.02 0.00 0.00 54.58 54.78 1fo5 n ASN 40 Cb 0.36 -1.24 -0.05 0.00 -2.36 0.00 0.00 39.78 36.49 1fo5 n ASN 40 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1fo5 n VAL 41 N 6.41 0.27 0.01 3.53 0.31 -0.69 -3.67 118.33 124.50 1fo5 n VAL 41 Ca 0.37 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1fo5 n VAL 41 Cb 0.21 -2.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.01 1fo5 n VAL 41 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1fo5 n MET 42 N 8.49 0.00 -3.25 5.55 2.00 -1.26 -4.57 117.12 124.08 1fo5 n MET 42 Ca 0.35 0.00 -0.04 0.00 0.00 0.00 0.00 57.70 58.01 1fo5 n MET 42 Cb 0.34 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.53 1fo5 n MET 42 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1fo5 s GLU 43 N -1.88 0.51 0.06 0.03 2.02 -1.24 -5.15 118.70 113.05 1fo5 s GLU 43 Ca 0.00 0.19 -0.19 0.00 0.02 0.00 0.00 54.97 55.00 1fo5 s GLU 43 Cb 0.00 -0.10 0.04 0.00 0.10 0.00 0.00 34.13 34.17 1fo5 s GLU 43 CO 0.00 -1.06 0.43 1.21 0.02 0.00 0.00 175.26 175.86 1fo5 s ASN 44 N 2.53 -0.31 1.01 -0.19 3.84 -1.26 -4.88 114.94 115.68 1fo5 s ASN 44 Ca 0.11 -0.04 -0.11 0.00 0.21 0.00 0.00 52.86 53.03 1fo5 s ASN 44 Cb -0.11 0.45 0.20 0.00 -0.55 0.00 0.00 41.25 41.24 1fo5 s ASN 44 CO -0.26 -0.72 1.09 -2.16 -2.79 0.00 0.00 177.10 172.26 1fo5 s PRO 45 N -2.78 0.27 0.00 0.43 0.04 -1.26 -4.93 135.00 126.76 1fo5 s PRO 45 Ca -0.03 1.20 0.20 0.00 0.04 0.00 0.00 61.00 62.40 1fo5 s PRO 45 Cb -0.00 -1.67 0.95 0.00 0.04 0.00 0.00 34.50 33.82 1fo5 s PRO 45 CO -0.05 -3.03 1.63 1.04 0.04 0.00 0.00 177.00 176.63 1fo5 n GLN 46 N -4.47 0.18 -0.38 4.56 3.00 -1.26 -4.28 117.38 114.72 1fo5 n GLN 46 Ca 0.08 0.12 0.30 0.00 -0.01 0.00 0.00 57.00 57.49 1fo5 n GLN 46 Cb 0.53 -1.50 0.57 0.00 0.00 0.00 0.00 30.24 29.84 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 0.21 0.00 -1.09 -0.00 -2.00 0.23 116.57 113.92 1fo5 h LYS 47 Ca 0.00 -0.01 -0.26 0.00 -0.00 0.00 0.00 60.65 60.38 1fo5 h LYS 47 Cb 0.24 -0.05 -0.05 0.00 -0.00 0.00 0.00 32.23 32.38 1fo5 h LYS 47 CO 0.00 0.14 -1.71 0.00 -0.00 0.00 0.00 179.45 177.88 1fo5 n ALA 48 N -2.45 1.64 0.41 0.07 0.00 -1.26 -3.53 120.51 115.39 1fo5 n ALA 48 Ca 0.33 -0.77 0.06 0.00 0.00 0.00 0.00 53.44 53.06 1fo5 n ALA 48 Cb 1.17 -0.80 0.25 0.00 0.00 0.00 0.00 19.45 20.08 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 -2.95 0.02 0.24 0.00 2.81 0.55 -2.32 117.12 115.47 1fo5 n MET 49 Ca -0.17 0.29 0.10 0.00 -1.81 0.00 0.00 57.70 56.12 1fo5 n MET 49 Cb 1.00 -1.50 0.62 0.00 -0.71 0.00 0.00 33.22 32.62 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 -7.31 0.03 4.11 -0.84 -3.46 114.58 107.12 1fo5 h GLU 50 Ca 0.00 0.00 -0.51 0.00 0.07 0.00 0.00 59.36 58.92 1fo5 h GLU 50 Cb 0.19 0.00 0.11 0.00 0.50 0.00 0.00 28.75 29.55 1fo5 h GLU 50 CO 0.00 0.18 0.35 0.71 0.07 0.00 0.00 179.01 180.31 1fo5 s TYR 51 N -4.16 2.84 0.17 2.06 2.02 -0.98 -4.95 117.35 114.35 1fo5 s TYR 51 Ca -0.02 1.50 -0.33 0.00 -0.37 0.00 0.00 57.07 57.84 1fo5 s TYR 51 Cb 0.13 -2.98 -0.14 0.00 -0.40 0.00 0.00 41.96 38.57 1fo5 s TYR 51 CO 0.62 -1.50 1.52 0.41 -1.57 0.00 0.00 175.55 175.03 1fo5 n GLY 52 N -1.47 1.00 4.98 0.71 0.00 -1.26 -2.64 105.19 106.52 1fo5 n GLY 52 Ca 0.08 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.73 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 3.02 0.00 0.00 -0.61 -5.35 -1.26 -4.69 119.36 110.47 1fo5 n ILE 53 Ca 0.16 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.64 1fo5 n ILE 53 Cb 0.29 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.19 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 -0.63 0.00 0.00 6.28 2.81 -1.08 -4.85 117.12 119.65 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 0.00 0.00 -0.44 3.04 0.00 -1.26 -4.61 120.51 117.23 1fo5 n ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1fo5 n ALA 55 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1fo5 n ALA 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1fo5 n VAL 56 N 0.00 -2.42 -1.19 0.00 0.31 -1.26 -5.02 118.33 108.75 1fo5 n VAL 56 Ca 0.00 0.34 -0.30 0.00 -0.01 0.00 0.00 64.34 64.38 1fo5 n VAL 56 Cb 0.00 -1.84 0.14 0.00 -0.91 0.00 0.00 33.84 31.23 1fo5 n VAL 56 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1fo5 s PRO 57 N -3.27 1.22 -0.27 5.55 0.04 -1.26 -4.98 135.00 132.03 1fo5 s PRO 57 Ca 0.00 0.82 -0.02 0.00 0.04 0.00 0.00 61.00 61.85 1fo5 s PRO 57 Cb 0.00 -1.80 0.12 0.00 0.04 0.00 0.00 34.50 32.86 1fo5 s PRO 57 CO 0.00 -2.27 0.25 0.99 0.04 0.00 0.00 177.00 176.01 1fo5 s THR 58 N -2.93 -0.32 -0.06 1.26 2.01 -0.43 -4.74 115.64 110.43 1fo5 s THR 58 Ca 0.64 -0.46 0.04 0.00 0.31 0.00 0.00 61.69 62.22 1fo5 s THR 58 Cb -0.18 -0.92 -0.00 0.00 0.01 0.00 0.00 72.50 71.41 1fo5 s THR 58 CO 0.57 -0.46 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.22 1fo5 s ILE 59 N 2.30 1.55 -0.18 1.82 1.09 -0.65 -0.93 121.20 126.20 1fo5 s ILE 59 Ca 0.09 -0.76 -0.09 0.00 -1.10 0.00 0.00 60.65 58.78 1fo5 s ILE 59 Cb -0.15 -1.35 -0.05 0.00 -1.06 0.00 0.00 42.46 39.86 1fo5 s ILE 59 CO -0.29 0.44 0.13 -0.69 -0.10 0.00 0.00 174.94 174.43 1fo5 s VAL 60 N 0.19 5.43 0.02 2.92 1.01 0.02 -0.83 120.40 129.15 1fo5 s VAL 60 Ca -0.08 0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.17 1fo5 s VAL 60 Cb -0.14 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 1fo5 s VAL 60 CO 0.04 0.48 -0.25 0.27 0.00 0.00 0.00 175.10 175.64 1fo5 s ILE 61 N 0.07 2.01 0.00 2.22 -5.25 -0.84 -1.69 121.20 117.71 1fo5 s ILE 61 Ca 0.09 -1.23 0.00 0.00 -0.99 0.00 0.00 60.65 58.52 1fo5 s ILE 61 Cb -0.11 -1.70 0.00 0.00 2.95 0.00 0.00 42.46 43.60 1fo5 s ILE 61 CO -0.01 0.42 0.00 0.59 -1.79 0.00 0.00 174.94 174.16 1fo5 n ASN 62 N 2.07 0.00 0.00 4.36 3.02 -0.05 -0.71 115.26 123.94 1fo5 n ASN 62 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.39 1fo5 n ASN 62 Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 1fo5 n ASN 62 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fo5 n GLY 63 N 0.00 0.24 3.53 7.41 0.00 -1.10 -1.44 105.19 113.84 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 0.00 6.34 0.14 1.61 1.01 0.11 -5.02 116.67 120.86 1fo5 s ASP 64 Ca 0.00 -0.19 -0.31 0.00 0.71 0.00 0.00 52.55 52.76 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 -0.68 1.40 0.54 0.21 0.00 0.00 175.17 176.64 1fo5 s VAL 65 N 2.69 3.17 0.22 -1.27 0.11 -1.26 -1.99 120.40 122.07 1fo5 s VAL 65 Ca 0.22 0.86 -0.10 0.00 -2.93 0.00 0.00 61.98 60.03 1fo5 s VAL 65 Cb -0.15 -3.55 0.04 0.00 -1.53 0.00 0.00 36.38 31.19 1fo5 s VAL 65 CO 0.17 0.08 0.51 1.21 -3.33 0.00 0.00 175.10 173.74 1fo5 n GLU 66 N 3.66 0.66 -3.64 1.54 0.00 -0.01 -4.98 120.64 117.86 1fo5 n GLU 66 Ca 0.11 -1.30 -0.03 0.00 0.00 0.00 0.00 57.16 55.93 1fo5 n GLU 66 Cb 0.42 1.64 -0.07 0.00 0.00 0.00 0.00 31.44 33.43 1fo5 n GLU 66 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.13 176.54 1fo5 s PHE 67 N -4.61 -0.61 -0.66 4.31 -0.71 -1.26 -1.64 117.98 112.79 1fo5 s PHE 67 Ca 0.10 1.24 0.05 0.00 -1.04 0.00 0.00 56.93 57.29 1fo5 s PHE 67 Cb -0.03 0.37 0.20 0.00 -1.21 0.00 0.00 43.02 42.36 1fo5 s PHE 67 CO 0.07 -0.30 0.59 -0.89 -1.34 0.00 0.00 175.22 173.34 1fo5 n ILE 68 N 3.66 1.74 0.00 -4.49 5.41 -1.26 -5.05 119.36 119.37 1fo5 n ILE 68 Ca -0.18 -4.92 0.00 0.00 1.00 0.00 0.00 62.75 58.64 1fo5 n ILE 68 Cb 0.58 -2.13 0.00 0.00 -0.71 0.00 0.00 39.64 37.38 1fo5 n ILE 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1fo5 n GLY 69 N 1.55 -1.48 0.26 7.39 0.00 -1.26 -4.47 105.19 107.18 1fo5 n GLY 69 Ca 0.24 -2.08 -0.03 0.00 0.00 0.00 0.00 46.02 44.15 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 1.13 -2.09 4.61 0.00 -1.97 -3.40 119.26 117.55 1fo5 h ALA 70 Ca 0.00 -0.29 -0.43 0.00 0.00 0.00 0.00 54.91 54.19 1fo5 h ALA 70 Cb 0.00 -0.15 0.18 0.00 0.00 0.00 0.00 17.79 17.81 1fo5 h ALA 70 CO 0.00 0.54 0.24 -1.25 0.00 0.00 0.00 179.25 178.78 1fo5 s PRO 71 N -4.75 -0.35 1.02 0.00 0.04 -1.26 -4.70 135.00 125.00 1fo5 s PRO 71 Ca -0.08 -0.09 -0.17 0.00 0.04 0.00 0.00 61.00 60.70 1fo5 s PRO 71 Cb 0.14 -1.70 0.26 0.00 0.04 0.00 0.00 34.50 33.24 1fo5 s PRO 71 CO 0.80 -3.13 0.76 0.25 0.04 0.00 0.00 177.00 175.71 1fo5 n THR 72 N -4.34 0.00 0.68 1.26 -2.24 -1.26 -4.52 114.28 103.85 1fo5 n THR 72 Ca 0.13 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1fo5 n THR 72 Cb 0.59 -0.99 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 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 -4.43 0.72 0.31 -0.78 3.00 -1.26 -4.50 118.16 111.21 1fo5 n LYS 73 Ca 0.11 0.00 0.20 0.00 -0.00 0.00 0.00 58.31 58.62 1fo5 n LYS 73 Cb 0.45 -1.14 0.96 0.00 0.00 0.00 0.00 35.03 35.30 1fo5 n LYS 73 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1fo5 h GLU 74 N 0.61 0.00 -0.09 1.64 5.08 -1.88 0.19 114.58 120.12 1fo5 h GLU 74 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1fo5 h GLU 74 Cb 0.72 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1fo5 h GLU 74 CO 0.00 0.01 0.03 0.00 -1.00 0.00 0.00 179.01 178.05 1fo5 h ALA 75 N 1.99 0.12 0.00 3.43 0.00 -1.87 -1.70 119.26 121.23 1fo5 h ALA 75 Ca -0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1fo5 h ALA 75 Cb 0.24 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1fo5 h ALA 75 CO 0.00 -0.26 -0.35 1.25 0.00 0.00 0.00 179.25 179.89 1fo5 h LEU 76 N -0.04 0.00 -0.74 0.00 7.12 -1.43 -3.18 115.31 117.04 1fo5 h LEU 76 Ca 0.03 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 57.94 1fo5 h LEU 76 Cb 0.23 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.34 1fo5 h LEU 76 CO -0.00 0.35 -0.07 1.62 -0.13 0.00 0.00 178.44 180.21 1fo5 h VAL 77 N 0.00 1.26 -0.34 1.05 3.04 -0.59 0.03 116.25 120.70 1fo5 h VAL 77 Ca -0.00 -1.16 0.10 0.00 -1.01 0.00 0.00 66.70 64.62 1fo5 h VAL 77 Cb 1.05 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.26 1fo5 h VAL 77 CO 0.05 0.41 0.36 -0.33 -1.01 0.00 0.00 177.57 177.05 1fo5 h GLU 78 N 0.81 0.00 0.24 4.17 4.39 -1.28 -0.55 114.58 122.35 1fo5 h GLU 78 Ca 0.14 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.83 1fo5 h GLU 78 Cb 0.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1fo5 h GLU 78 CO 0.04 0.00 -0.12 0.00 -1.16 0.00 0.00 179.01 177.77 1fo5 h ALA 79 N 1.59 -0.33 -0.74 3.43 0.00 -1.12 -1.01 119.26 121.08 1fo5 h ALA 79 Ca 0.16 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1fo5 h ALA 79 Cb 0.88 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1fo5 h ALA 79 CO -0.00 -0.35 0.49 -0.84 0.00 0.00 0.00 179.25 178.54 1fo5 h ILE 80 N -0.99 0.89 0.00 0.00 3.07 -0.35 -0.53 117.51 119.61 1fo5 h ILE 80 Ca -0.03 -0.20 0.00 0.00 1.55 0.00 0.00 64.86 66.18 1fo5 h ILE 80 Cb 0.44 0.27 0.00 0.00 -0.27 0.00 0.00 36.82 37.26 1fo5 h ILE 80 CO 0.05 0.11 -0.45 0.07 -1.05 0.00 0.00 178.15 176.88 1fo5 h LYS 81 N 0.58 0.00 -0.16 0.16 2.10 -1.27 -2.50 116.57 115.48 1fo5 h LYS 81 Ca 0.35 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.93 1fo5 h LYS 81 Cb 0.57 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 1fo5 h LYS 81 CO -0.12 0.00 -0.20 1.57 -2.00 0.00 0.00 179.45 178.69 1fo5 h LYS 82 N 0.00 0.27 0.00 0.07 5.09 0.29 -3.47 116.57 118.81 1fo5 h LYS 82 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 60.65 60.66 1fo5 h LYS 82 Cb 0.86 -0.03 0.00 0.00 0.10 0.00 0.00 32.23 33.16 1fo5 h LYS 82 CO 0.00 0.47 0.00 -2.13 -2.09 0.00 0.00 179.45 175.70 1fo5 n ARG 83 N -4.20 0.00 -0.61 0.07 0.63 -0.75 -5.09 116.66 106.71 1fo5 n ARG 83 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1fo5 n ARG 83 Cb 0.33 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.24 1fo5 n ARG 83 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40