#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fif s GLN 2 N 0.00 4.18 0.17 3.17 -0.21 -1.26 -1.46 119.66 124.25 2fif s GLN 2 Ca 0.00 -0.14 0.08 0.00 0.02 0.00 0.00 55.36 55.31 2fif s GLN 2 Cb 0.00 -3.45 -0.04 0.00 1.00 0.00 0.00 33.01 30.52 2fif s GLN 2 CO 0.00 0.23 -0.16 0.96 -2.12 0.00 0.00 175.29 174.20 2fif s ILE 3 N 0.54 1.72 0.00 1.08 -4.36 -1.04 0.02 121.20 119.16 2fif s ILE 3 Ca 0.10 -1.99 0.06 0.00 -0.26 0.00 0.00 60.65 58.56 2fif s ILE 3 Cb -0.12 -1.87 -0.03 0.00 1.25 0.00 0.00 42.46 41.69 2fif s ILE 3 CO 0.01 -0.43 -0.19 -0.36 0.24 0.00 0.00 174.94 174.21 2fif s PHE 4 N -2.39 2.55 -0.31 1.37 0.08 0.38 -2.21 117.98 117.44 2fif s PHE 4 Ca 0.17 -0.27 0.01 0.00 0.12 0.00 0.00 56.93 56.97 2fif s PHE 4 Cb -0.04 -1.52 0.10 0.00 -0.57 0.00 0.00 43.02 40.99 2fif s PHE 4 CO 0.06 0.17 0.06 0.08 -0.10 0.00 0.00 175.22 175.49 2fif s VAL 5 N -0.80 1.53 -0.11 -0.44 1.01 -0.80 0.21 120.40 121.00 2fif s VAL 5 Ca 0.13 -1.77 -0.27 0.00 0.00 0.00 0.00 61.98 60.06 2fif s VAL 5 Cb -0.10 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 2fif s VAL 5 CO 0.02 -0.58 0.90 -0.75 0.00 0.00 0.00 175.10 174.70 2fif s LYS 6 N 1.30 4.40 0.38 2.72 2.20 -0.69 -1.11 119.74 128.93 2fif s LYS 6 Ca 0.09 1.20 -0.02 0.00 -0.36 0.00 0.00 55.97 56.88 2fif s LYS 6 Cb -0.18 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 2fif s LYS 6 CO -0.16 -0.23 0.61 -0.08 -0.36 0.00 0.00 175.35 175.13 2fif s THR 7 N 1.76 5.04 -1.50 3.43 -1.32 0.24 -2.39 115.64 120.90 2fif s THR 7 Ca 0.44 -0.23 0.26 0.00 -1.21 0.00 0.00 61.69 60.94 2fif s THR 7 Cb -0.18 -3.85 0.49 0.00 -1.51 0.00 0.00 72.50 67.44 2fif s THR 7 CO 0.17 -0.62 1.88 0.18 -2.21 0.00 0.00 174.62 174.02 2fif n LEU 8 N -1.84 0.00 -0.06 9.08 4.77 -1.26 -1.82 117.00 125.87 2fif n LEU 8 Ca -0.03 0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 56.11 2fif n LEU 8 Cb 0.56 -0.25 0.07 0.00 -2.33 0.00 0.00 43.42 41.46 2fif n LEU 8 CO 0.50 -0.04 0.61 0.74 -1.33 0.00 0.00 177.39 177.87 2fif h THR 9 N 0.00 1.28 0.00 -5.08 2.02 -1.94 -3.47 112.91 105.72 2fif h THR 9 Ca 0.00 -1.51 0.00 0.00 0.77 0.00 0.00 66.41 65.67 2fif h THR 9 Cb 0.21 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 2fif h THR 9 CO 0.00 0.49 0.00 0.61 0.37 0.00 0.00 175.52 176.99 2fif n GLY 10 N -0.03 1.26 3.74 2.16 0.00 -0.76 -5.13 105.19 106.44 2fif n GLY 10 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2fif n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fif s LYS 11 N 0.00 4.48 -0.21 1.61 2.20 -1.25 -4.76 119.74 121.81 2fif s LYS 11 Ca 0.00 1.92 -0.05 0.00 -0.36 0.00 0.00 55.97 57.48 2fif s LYS 11 Cb 0.00 -3.22 -0.02 0.00 -1.51 0.00 0.00 37.83 33.08 2fif s LYS 11 CO 0.00 -0.10 -0.00 0.99 -0.36 0.00 0.00 175.35 175.87 2fif s THR 12 N -0.16 3.87 -0.06 3.43 2.01 -1.26 -0.60 115.64 122.87 2fif s THR 12 Ca 0.53 -0.34 -0.22 0.00 0.31 0.00 0.00 61.69 61.97 2fif s THR 12 Cb -0.34 -2.75 -0.04 0.00 0.01 0.00 0.00 72.50 69.38 2fif s THR 12 CO 0.38 0.42 0.66 -0.63 -0.69 0.00 0.00 174.62 174.76 2fif s ILE 13 N 1.13 5.03 -0.03 1.82 -1.09 -0.27 -4.91 121.20 122.88 2fif s ILE 13 Ca 0.02 1.36 -0.19 0.00 -2.23 0.00 0.00 60.65 59.61 2fif s ILE 13 Cb -0.14 -4.00 -0.05 0.00 -1.58 0.00 0.00 42.46 36.69 2fif s ILE 13 CO 0.01 0.29 0.54 -0.89 -1.23 0.00 0.00 174.94 173.67 2fif s THR 14 N 0.57 4.99 -0.01 2.92 2.01 -1.26 -1.91 115.64 122.95 2fif s THR 14 Ca 0.35 1.12 0.02 0.00 0.31 0.00 0.00 61.69 63.49 2fif s THR 14 Cb -0.18 -3.87 -0.00 0.00 0.01 0.00 0.00 72.50 68.46 2fif s THR 14 CO 0.17 0.42 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.68 2fif s LEU 15 N -0.13 1.93 -0.36 4.42 1.02 -0.94 -5.03 118.68 119.60 2fif s LEU 15 Ca 0.29 -0.15 -0.15 0.00 0.02 0.00 0.00 54.13 54.13 2fif s LEU 15 Cb -0.17 -0.45 -0.01 0.00 0.02 0.00 0.00 46.19 45.59 2fif s LEU 15 CO 0.15 0.09 0.35 -0.70 0.02 0.00 0.00 176.35 176.25 2fif s GLU 16 N -0.06 3.43 0.35 1.70 2.56 -1.26 -2.50 118.70 122.92 2fif s GLU 16 Ca 0.01 -0.55 0.04 0.00 0.00 0.00 0.00 54.97 54.47 2fif s GLU 16 Cb -0.05 -3.84 -0.03 0.00 2.00 0.00 0.00 34.13 32.20 2fif s GLU 16 CO -0.00 -0.58 0.15 0.14 -0.56 0.00 0.00 175.26 174.41 2fif s VAL 17 N 1.96 0.48 0.10 3.70 -7.23 -0.54 -4.93 120.40 113.94 2fif s VAL 17 Ca 0.10 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.36 2fif s VAL 17 Cb -0.17 -2.47 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 2fif s VAL 17 CO 0.12 0.00 -0.21 -1.61 -0.31 0.00 0.00 175.10 173.08 2fif s GLU 18 N -3.75 1.18 0.48 4.82 0.41 -1.26 -0.14 118.70 120.44 2fif s GLU 18 Ca 0.32 -1.16 0.20 0.00 -0.41 0.00 0.00 54.97 53.92 2fif s GLU 18 Cb 0.04 -1.45 1.22 0.00 -1.78 0.00 0.00 34.13 32.16 2fif s GLU 18 CO 0.17 0.34 1.98 -1.35 -0.49 0.00 0.00 175.26 175.91 2fif h PRO 19 N 4.15 0.20 0.00 0.39 0.11 -1.98 0.22 132.00 135.09 2fif h PRO 19 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2fif h PRO 19 Cb 1.18 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2fif h PRO 19 CO 0.40 0.13 0.00 0.66 -0.21 0.00 0.00 178.00 178.98 2fif h SER 20 N 0.20 0.00 -3.16 -2.05 4.64 -1.97 -0.96 113.55 110.25 2fif h SER 20 Ca 0.28 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.04 2fif h SER 20 Cb 0.82 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.00 2fif h SER 20 CO -0.05 0.00 0.66 0.47 -0.87 0.00 0.00 176.83 177.04 2fif n ASP 21 N -2.51 3.14 -4.85 4.97 8.00 0.06 -4.78 116.55 120.59 2fif n ASP 21 Ca 0.03 1.17 -0.30 0.00 0.71 0.00 0.00 54.79 56.40 2fif n ASP 21 Cb 0.33 -1.51 0.05 0.00 -0.02 0.00 0.00 41.12 39.97 2fif n ASP 21 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2fif s THR 22 N -0.49 3.77 0.13 -3.53 -1.32 -1.26 -1.78 115.64 111.16 2fif s THR 22 Ca 0.61 0.57 -0.15 0.00 -1.21 0.00 0.00 61.69 61.52 2fif s THR 22 Cb -0.57 -3.46 -0.00 0.00 -1.51 0.00 0.00 72.50 66.96 2fif s THR 22 CO 0.55 -0.75 1.63 0.40 -2.21 0.00 0.00 174.62 174.24 2fif h ILE 23 N -0.69 1.23 0.00 5.08 1.08 -0.60 -2.01 117.51 121.60 2fif h ILE 23 Ca -0.45 -0.81 -0.01 0.00 -0.39 0.00 0.00 64.86 63.21 2fif h ILE 23 Cb 1.23 0.94 -0.00 0.00 -3.07 0.00 0.00 36.82 35.93 2fif h ILE 23 CO 0.61 0.28 -0.03 1.05 -0.69 0.00 0.00 178.15 179.37 2fif h GLU 24 N 0.56 0.00 -0.19 2.37 4.11 -1.79 0.53 114.58 120.17 2fif h GLU 24 Ca 0.13 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.39 2fif h GLU 24 Cb 0.32 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 2fif h GLU 24 CO 0.00 0.03 -0.60 -0.97 0.07 0.00 0.00 179.01 177.55 2fif h ASN 25 N 0.00 0.69 -0.22 3.06 -0.00 -1.75 -2.51 115.58 114.86 2fif h ASN 25 Ca -0.00 -0.39 -0.07 0.00 -0.00 0.00 0.00 56.30 55.84 2fif h ASN 25 Cb 0.07 -0.20 -0.00 0.00 -0.00 0.00 0.00 38.32 38.19 2fif h ASN 25 CO 0.00 1.13 -0.13 0.58 -0.00 0.00 0.00 177.43 179.01 2fif h VAL 26 N 0.46 1.31 -0.42 2.57 2.07 -0.48 -2.02 116.25 119.74 2fif h VAL 26 Ca -0.00 -1.23 0.03 0.00 0.82 0.00 0.00 66.70 66.32 2fif h VAL 26 Cb 1.16 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 32.56 2fif h VAL 26 CO 0.12 0.38 0.28 0.11 0.02 0.00 0.00 177.57 178.47 2fif h LYS 27 N 0.17 0.43 -0.31 1.57 1.57 -1.01 -0.80 116.57 118.20 2fif h LYS 27 Ca 0.04 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.64 2fif h LYS 27 Cb 0.64 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 2fif h LYS 27 CO 0.04 0.28 -0.45 0.00 -0.57 0.00 0.00 179.45 178.75 2fif h ALA 28 N 1.76 0.47 0.00 3.86 0.00 -1.35 -2.00 119.26 121.99 2fif h ALA 28 Ca 0.17 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2fif h ALA 28 Cb 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2fif h ALA 28 CO -0.04 0.61 -0.20 0.87 0.00 0.00 0.00 179.25 180.49 2fif h LYS 29 N 0.62 0.00 -0.10 0.00 1.57 -0.51 -1.21 116.57 116.94 2fif h LYS 29 Ca 0.03 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.57 2fif h LYS 29 Cb 1.05 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.37 2fif h LYS 29 CO 0.10 0.20 -0.87 0.82 -0.57 0.00 0.00 179.45 179.14 2fif h ILE 30 N 0.00 1.28 0.12 1.86 2.04 -1.15 -3.17 117.51 118.48 2fif h ILE 30 Ca -0.00 -2.07 -0.01 0.00 1.00 0.00 0.00 64.86 63.78 2fif h ILE 30 Cb 0.37 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2fif h ILE 30 CO 0.03 0.65 -0.06 -0.61 0.00 0.00 0.00 178.15 178.16 2fif h GLN 31 N 0.48 -0.16 0.00 2.37 4.15 -0.56 0.19 115.11 121.58 2fif h GLN 31 Ca -0.08 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.35 2fif h GLN 31 Cb 1.51 0.04 0.00 0.00 0.21 0.00 0.00 27.48 29.24 2fif h GLN 31 CO 0.18 -0.08 0.00 -0.40 -1.93 0.00 0.00 178.83 176.60 2fif n ASP 32 N -5.15 0.60 -0.08 -0.69 5.68 -0.54 -0.32 116.55 116.05 2fif n ASP 32 Ca -0.08 0.60 -0.23 0.00 -0.50 0.00 0.00 54.79 54.58 2fif n ASP 32 Cb 0.10 -0.74 -0.12 0.00 -1.14 0.00 0.00 41.12 39.22 2fif n ASP 32 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2fif n LYS 33 N -2.11 0.65 -0.13 0.11 5.02 -1.14 -4.82 118.16 115.74 2fif n LYS 33 Ca 0.04 0.33 -0.27 0.00 -2.02 0.00 0.00 58.31 56.39 2fif n LYS 33 Cb 0.31 -1.64 -0.09 0.00 -0.02 0.00 0.00 35.03 33.59 2fif n LYS 33 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2fif n GLU 34 N -3.88 0.57 0.00 1.97 -0.58 0.66 -5.05 120.64 114.34 2fif n GLU 34 Ca -0.40 0.25 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2fif n GLU 34 Cb 0.90 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 30.30 2fif n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2fif n GLY 35 N 1.30 1.39 3.68 0.62 0.00 0.56 -5.04 105.19 107.71 2fif n GLY 35 Ca -0.49 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 2fif n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fif s ILE 36 N -1.40 3.41 0.26 -0.61 1.09 -1.26 -4.95 121.20 117.75 2fif s ILE 36 Ca 0.00 0.74 -0.30 0.00 -1.10 0.00 0.00 60.65 59.99 2fif s ILE 36 Cb 0.00 -3.48 -0.13 0.00 -1.06 0.00 0.00 42.46 37.79 2fif s ILE 36 CO 0.00 -0.02 1.40 -2.65 -0.10 0.00 0.00 174.94 173.57 2fif n PRO 37 N 6.03 2.10 -0.06 2.79 -0.02 -1.26 -4.04 135.00 140.54 2fif n PRO 37 Ca 0.15 0.75 0.02 0.00 -2.02 0.00 0.00 63.50 62.41 2fif n PRO 37 Cb 0.42 -2.40 0.36 0.00 -0.02 0.00 0.00 33.50 31.86 2fif n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2fif h PRO 38 N 3.94 0.66 0.00 0.52 0.11 -1.93 -2.39 132.00 132.91 2fif h PRO 38 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2fif h PRO 38 Cb 1.27 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2fif h PRO 38 CO 0.73 0.47 0.00 0.38 -0.21 0.00 0.00 178.00 179.37 2fif h ASP 39 N 0.68 0.00 -0.27 -2.05 2.03 -1.95 -2.84 116.42 112.01 2fif h ASP 39 Ca 0.18 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.48 2fif h ASP 39 Cb -0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.47 2fif h ASP 39 CO -0.03 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.18 2fif n GLN 40 N -2.37 2.25 -3.46 4.15 6.02 -0.91 -4.96 117.38 118.11 2fif n GLN 40 Ca 0.03 -2.07 -0.36 0.00 -0.01 0.00 0.00 57.00 54.59 2fif n GLN 40 Cb 0.28 -1.45 -0.06 0.00 1.02 0.00 0.00 30.24 30.04 2fif n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2fif s GLN 41 N -1.46 3.90 -0.13 -1.09 -0.21 -1.07 -1.02 119.66 118.58 2fif s GLN 41 Ca 0.32 0.38 -0.02 0.00 0.02 0.00 0.00 55.36 56.06 2fif s GLN 41 Cb 0.20 -3.03 0.04 0.00 1.00 0.00 0.00 33.01 31.22 2fif s GLN 41 CO 0.28 0.56 0.01 1.03 -2.12 0.00 0.00 175.29 175.04 2fif s ARG 42 N -1.72 0.73 -0.09 2.91 0.52 -0.90 -4.97 118.95 115.43 2fif s ARG 42 Ca 0.33 -0.16 -0.11 0.00 -0.52 0.00 0.00 55.73 55.27 2fif s ARG 42 Cb -0.15 -1.52 -0.05 0.00 0.52 0.00 0.00 34.95 33.75 2fif s ARG 42 CO 0.18 -0.44 0.26 -0.51 0.02 0.00 0.00 175.30 174.80 2fif s LEU 43 N 1.89 4.38 -0.07 2.53 1.43 -1.26 -0.99 118.68 126.59 2fif s LEU 43 Ca 0.02 0.62 0.05 0.00 -1.03 0.00 0.00 54.13 53.80 2fif s LEU 43 Cb -0.14 -2.30 -0.01 0.00 0.03 0.00 0.00 46.19 43.77 2fif s LEU 43 CO -0.07 0.31 -0.24 -0.63 0.23 0.00 0.00 176.35 175.95 2fif s ILE 44 N -0.67 2.00 -0.11 -0.59 1.09 0.58 -1.29 121.20 122.21 2fif s ILE 44 Ca 0.18 -1.01 -0.08 0.00 -1.10 0.00 0.00 60.65 58.63 2fif s ILE 44 Cb -0.14 -1.70 0.03 0.00 -1.06 0.00 0.00 42.46 39.59 2fif s ILE 44 CO 0.07 0.55 0.27 0.12 -0.10 0.00 0.00 174.94 175.85 2fif s PHE 45 N 0.05 -0.32 -1.50 3.97 5.36 -0.52 -1.02 117.98 124.00 2fif s PHE 45 Ca -0.10 0.77 -0.06 0.00 -0.96 0.00 0.00 56.93 56.58 2fif s PHE 45 Cb -0.15 0.10 0.02 0.00 -0.34 0.00 0.00 43.02 42.65 2fif s PHE 45 CO 0.06 -0.17 0.62 0.00 -1.46 0.00 0.00 175.22 174.27 2fif n ALA 46 N 3.28 -1.02 -1.82 11.12 0.00 -1.26 -1.70 120.51 129.12 2fif n ALA 46 Ca -0.16 0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.46 2fif n ALA 46 Cb 0.57 -3.79 -0.01 0.00 0.00 0.00 0.00 19.45 16.22 2fif n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fif n GLY 47 N -1.49 0.39 3.00 0.00 0.00 -1.26 -5.03 105.19 100.80 2fif n GLY 47 Ca -0.09 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.22 2fif n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fif s LYS 48 N -3.77 0.37 -0.08 1.61 -0.14 -0.69 -5.14 119.74 111.90 2fif s LYS 48 Ca 0.00 -0.58 -0.19 0.00 -1.36 0.00 0.00 55.97 53.83 2fif s LYS 48 Cb 0.00 -0.08 -0.04 0.00 -1.68 0.00 0.00 37.83 36.03 2fif s LYS 48 CO 0.00 0.00 0.53 -0.65 -0.76 0.00 0.00 175.35 174.47 2fif s GLN 49 N -1.29 4.32 -0.17 1.68 -0.21 -1.26 -1.44 119.66 121.29 2fif s GLN 49 Ca -0.11 0.57 -0.24 0.00 0.02 0.00 0.00 55.36 55.59 2fif s GLN 49 Cb -0.09 -3.40 -0.02 0.00 1.00 0.00 0.00 33.01 30.50 2fif s GLN 49 CO -0.00 0.22 0.79 -0.51 -2.12 0.00 0.00 175.29 173.67 2fif s LEU 50 N 0.36 4.18 0.16 2.90 1.43 -0.41 -4.99 118.68 122.30 2fif s LEU 50 Ca 0.29 1.11 -0.29 0.00 -1.03 0.00 0.00 54.13 54.21 2fif s LEU 50 Cb -0.16 -3.16 -0.07 0.00 0.03 0.00 0.00 46.19 42.82 2fif s LEU 50 CO 0.13 -0.36 0.92 -0.70 0.23 0.00 0.00 176.35 176.57 2fif s GLU 51 N 2.04 4.73 0.20 1.70 2.12 -1.26 -4.73 118.70 123.50 2fif s GLU 51 Ca 0.36 1.41 -0.11 0.00 0.36 0.00 0.00 54.97 56.99 2fif s GLU 51 Cb -0.16 -3.33 0.24 0.00 0.26 0.00 0.00 34.13 31.13 2fif s GLU 51 CO 0.12 0.36 1.73 -0.44 -0.54 0.00 0.00 175.26 176.50 2fif h ASP 52 N 4.95 0.15 0.00 -1.70 3.32 -1.96 -1.98 116.42 119.21 2fif h ASP 52 Ca -0.44 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.69 2fif h ASP 52 Cb 1.21 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2fif h ASP 52 CO 0.70 0.10 0.00 0.61 -1.72 0.00 0.00 179.24 178.93 2fif n GLY 53 N -1.29 -0.81 3.98 2.75 0.00 -1.26 -2.78 105.19 105.78 2fif n GLY 53 Ca 0.07 -0.12 -0.20 0.00 0.00 0.00 0.00 46.02 45.77 2fif n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fif s ARG 54 N -2.00 3.28 0.22 1.61 1.81 -0.74 -4.92 118.95 118.22 2fif s ARG 54 Ca 0.29 -0.84 0.06 0.00 -1.72 0.00 0.00 55.73 53.52 2fif s ARG 54 Cb 0.13 -2.84 -0.04 0.00 -0.45 0.00 0.00 34.95 31.76 2fif s ARG 54 CO 0.22 0.22 0.17 0.95 -0.68 0.00 0.00 175.30 176.19 2fif s THR 55 N -2.11 4.45 0.19 0.02 -4.23 -1.26 -0.28 115.64 112.42 2fif s THR 55 Ca 0.40 -1.31 -0.15 0.00 -1.18 0.00 0.00 61.69 59.45 2fif s THR 55 Cb -0.09 -3.36 0.18 0.00 1.34 0.00 0.00 72.50 70.56 2fif s THR 55 CO 0.31 -0.27 1.64 -0.07 -0.54 0.00 0.00 174.62 175.68 2fif h LEU 56 N 1.79 -0.52 -2.09 4.79 4.07 -1.30 -1.05 115.31 121.00 2fif h LEU 56 Ca -0.48 0.16 0.09 0.00 0.08 0.00 0.00 57.88 57.73 2fif h LEU 56 Cb 1.23 0.34 -0.01 0.00 1.08 0.00 0.00 40.66 43.30 2fif h LEU 56 CO 0.61 -0.18 0.33 0.77 -1.08 0.00 0.00 178.44 178.89 2fif h SER 57 N -0.01 0.00 0.52 -0.43 4.64 -1.41 -0.41 113.55 116.45 2fif h SER 57 Ca 0.26 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.54 2fif h SER 57 Cb 0.40 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2fif h SER 57 CO -0.56 0.00 -0.16 0.44 -0.87 0.00 0.00 176.83 175.68 2fif h ASP 58 N 0.00 0.00 -0.38 4.97 3.32 -1.47 -2.58 116.42 120.29 2fif h ASP 58 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2fif h ASP 58 Cb 0.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2fif h ASP 58 CO -0.00 0.16 0.00 -1.22 -1.72 0.00 0.00 179.24 176.46 2fif n TYR 59 N -3.58 0.68 -2.22 4.55 4.01 -0.20 -4.96 117.16 115.45 2fif n TYR 59 Ca -0.01 -0.59 -0.19 0.00 -0.16 0.00 0.00 57.90 56.95 2fif n TYR 59 Cb 0.30 -0.10 -0.02 0.00 -0.31 0.00 0.00 39.34 39.20 2fif n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2fif n ASN 60 N 0.42 -5.36 -4.55 7.72 4.05 -0.97 -4.90 115.26 111.66 2fif n ASN 60 Ca 0.16 0.13 -0.38 0.00 0.45 0.00 0.00 54.58 54.93 2fif n ASN 60 Cb 0.58 -4.54 -0.03 0.00 1.23 0.00 0.00 39.78 37.01 2fif n ASN 60 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2fif s ILE 61 N -2.87 3.30 0.32 -1.44 1.01 -1.01 -4.95 121.20 115.56 2fif s ILE 61 Ca 0.00 0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.85 2fif s ILE 61 Cb 0.00 -3.77 0.06 0.00 0.01 0.00 0.00 42.46 38.76 2fif s ILE 61 CO 0.00 -0.74 0.44 0.00 0.00 0.00 0.00 174.94 174.64 2fif n GLN 62 N 9.12 0.47 -1.80 2.79 6.02 -1.26 -4.53 117.38 128.19 2fif n GLN 62 Ca 0.23 -1.34 -0.40 0.00 -0.01 0.00 0.00 57.00 55.48 2fif n GLN 62 Cb 0.52 -0.24 0.01 0.00 1.02 0.00 0.00 30.24 31.55 2fif n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2fif s LYS 63 N -3.51 3.86 -0.71 -1.09 -2.85 -1.26 -2.76 119.74 111.42 2fif s LYS 63 Ca 0.30 2.49 0.00 0.00 -1.00 0.00 0.00 55.97 57.76 2fif s LYS 63 Cb -0.02 -2.79 0.00 0.00 -2.06 0.00 0.00 37.83 32.96 2fif s LYS 63 CO 0.20 -0.70 0.00 -1.91 0.10 0.00 0.00 175.35 173.03 2fif n GLU 64 N 0.07 -0.77 -2.45 1.78 4.07 0.10 -5.00 120.64 118.45 2fif n GLU 64 Ca 0.03 0.65 -0.37 0.00 -0.06 0.00 0.00 57.16 57.41 2fif n GLU 64 Cb 0.41 -4.50 -0.03 0.00 -0.06 0.00 0.00 31.44 27.25 2fif n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 2fif s SER 65 N -2.61 6.69 -0.20 4.31 0.01 -1.11 -4.82 113.70 115.97 2fif s SER 65 Ca 0.00 2.16 -0.03 0.00 1.31 0.00 0.00 55.95 59.40 2fif s SER 65 Cb 0.00 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 2fif s SER 65 CO 0.00 -0.55 -0.07 -0.89 0.41 0.00 0.00 173.24 172.14 2fif s THR 66 N -1.54 3.21 0.40 1.44 2.01 -1.26 -0.47 115.64 119.43 2fif s THR 66 Ca 0.57 -0.56 0.08 0.00 0.31 0.00 0.00 61.69 62.08 2fif s THR 66 Cb -0.26 -2.43 -0.01 0.00 0.01 0.00 0.00 72.50 69.82 2fif s THR 66 CO 0.32 0.46 0.46 -0.76 -0.69 0.00 0.00 174.62 174.40 2fif s LEU 67 N 1.20 3.58 0.15 4.42 1.43 0.13 -4.91 118.68 124.69 2fif s LEU 67 Ca 0.02 -0.53 0.11 0.00 -1.03 0.00 0.00 54.13 52.70 2fif s LEU 67 Cb -0.14 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 2fif s LEU 67 CO -0.02 -0.64 -0.24 -1.00 0.23 0.00 0.00 176.35 174.67 2fif s HIS 68 N -2.37 2.20 -0.11 0.29 3.76 -0.19 -1.71 115.29 117.16 2fif s HIS 68 Ca 0.50 -0.38 0.03 0.00 -0.15 0.00 0.00 55.06 55.06 2fif s HIS 68 Cb -0.07 -1.14 0.00 0.00 1.11 0.00 0.00 32.58 32.48 2fif s HIS 68 CO 0.30 0.38 -0.21 -1.17 -0.85 0.00 0.00 174.74 173.19 2fif s LEU 69 N -2.32 2.01 -0.16 0.89 2.96 -1.01 -0.31 118.68 120.75 2fif s LEU 69 Ca 0.16 -0.53 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 2fif s LEU 69 Cb -0.09 -1.33 -0.02 0.00 0.50 0.00 0.00 46.19 45.26 2fif s LEU 69 CO 0.07 0.12 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.45 2fif s VAL 70 N 0.54 3.37 -0.15 1.68 1.01 -0.17 -4.06 120.40 122.61 2fif s VAL 70 Ca -0.15 -0.53 -0.19 0.00 0.00 0.00 0.00 61.98 61.11 2fif s VAL 70 Cb -0.17 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 2fif s VAL 70 CO 0.05 0.49 0.54 -0.76 0.00 0.00 0.00 175.10 175.42 2fif s LEU 71 N 0.70 4.22 0.45 3.92 2.01 -1.26 -2.13 118.68 126.58 2fif s LEU 71 Ca -0.04 0.82 -0.22 0.00 0.01 0.00 0.00 54.13 54.70 2fif s LEU 71 Cb -0.15 -2.78 -0.09 0.00 0.01 0.00 0.00 46.19 43.18 2fif s LEU 71 CO 0.02 -0.12 1.03 -0.13 1.01 0.00 0.00 176.35 178.16 2fif s ARG 72 N 1.19 3.99 0.00 1.70 0.52 -0.19 -5.04 118.95 121.12 2fif s ARG 72 Ca 0.27 1.38 0.15 0.00 -0.52 0.00 0.00 55.73 57.02 2fif s ARG 72 Cb -0.16 -2.27 0.12 0.00 0.52 0.00 0.00 34.95 33.17 2fif s ARG 72 CO 0.11 -0.27 0.99 1.28 0.02 0.00 0.00 175.30 177.42