#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f52 s LEU 2 N 0.00 3.31 -0.03 4.03 1.43 -0.81 -4.91 118.68 121.70 2f52 s LEU 2 Ca 0.00 -0.74 0.02 0.00 -1.03 0.00 0.00 54.13 52.38 2f52 s LEU 2 Cb 0.00 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2f52 s LEU 2 CO 0.00 -0.91 -0.07 -1.61 0.23 0.00 0.00 176.35 174.00 2f52 s GLU 3 N -4.34 0.79 0.04 1.70 2.02 -1.26 -2.09 118.70 115.56 2f52 s GLU 3 Ca 0.51 -0.21 -0.01 0.00 0.02 0.00 0.00 54.97 55.29 2f52 s GLU 3 Cb -0.06 -0.76 -0.03 0.00 0.10 0.00 0.00 34.13 33.37 2f52 s GLU 3 CO 0.31 0.05 -0.03 0.20 0.02 0.00 0.00 175.26 175.81 2f52 s GLY 4 N 0.36 0.42 -0.11 -1.39 0.00 -0.61 -4.11 107.32 101.88 2f52 s GLY 4 Ca -0.05 -1.04 -0.01 0.00 0.00 0.00 0.00 44.72 43.62 2f52 s GLY 4 CO 0.00 -1.14 -0.08 0.54 0.00 0.00 0.00 173.10 172.42 2f52 s LYS 5 N -3.20 3.23 -0.14 2.90 1.02 -0.83 -1.00 119.74 121.72 2f52 s LYS 5 Ca 0.01 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.12 2f52 s LYS 5 Cb 0.03 -2.70 -0.05 0.00 -0.52 0.00 0.00 37.83 34.58 2f52 s LYS 5 CO -0.07 0.39 1.90 0.08 -0.92 0.00 0.00 175.35 176.72 2f52 s VAL 6 N -0.07 3.29 0.02 3.17 1.01 -0.36 -0.12 120.40 127.33 2f52 s VAL 6 Ca 0.00 0.33 -0.18 0.00 0.00 0.00 0.00 61.98 62.13 2f52 s VAL 6 Cb -0.13 -3.29 -0.29 0.00 0.00 0.00 0.00 36.38 32.66 2f52 s VAL 6 CO 0.03 -0.12 1.04 0.50 0.00 0.00 0.00 175.10 176.55 2f52 h LYS 7 N 11.91 0.50 -2.42 2.72 1.63 0.30 1.39 116.57 132.60 2f52 h LYS 7 Ca -0.41 -0.68 0.00 0.00 -0.85 0.00 0.00 60.65 58.71 2f52 h LYS 7 Cb 1.20 0.23 -0.16 0.00 -0.60 0.00 0.00 32.23 32.91 2f52 h LYS 7 CO 0.97 1.30 0.29 -0.46 -3.45 0.00 0.00 179.45 178.10 2f52 s TRP 8 N -2.86 -0.52 -0.18 1.91 -0.00 -1.05 -4.60 118.94 111.63 2f52 s TRP 8 Ca -0.11 0.57 -0.18 0.00 -0.00 0.00 0.00 56.10 56.38 2f52 s TRP 8 Cb 0.04 0.50 0.05 0.00 -0.00 0.00 0.00 33.47 34.06 2f52 s TRP 8 CO 0.89 -0.67 0.51 -0.59 -0.00 0.00 0.00 176.95 177.09 2f52 s PHE 9 N -2.61 -0.55 -0.28 5.86 -0.71 -1.26 0.43 117.98 118.86 2f52 s PHE 9 Ca -0.02 1.33 -0.06 0.00 -1.04 0.00 0.00 56.93 57.14 2f52 s PHE 9 Cb -0.01 0.19 0.01 0.00 -1.21 0.00 0.00 43.02 42.01 2f52 s PHE 9 CO -0.04 -0.28 0.04 1.21 -1.34 0.00 0.00 175.22 174.81 2f52 s ASN 10 N 0.19 4.91 0.67 1.98 3.84 -0.97 -4.91 114.94 120.64 2f52 s ASN 10 Ca -0.01 -0.69 0.43 0.00 0.21 0.00 0.00 52.86 52.81 2f52 s ASN 10 Cb -0.04 -1.83 2.36 0.00 -0.55 0.00 0.00 41.25 41.20 2f52 s ASN 10 CO 0.01 -0.16 2.34 0.77 -2.79 0.00 0.00 177.10 177.27 2f52 h SER 11 N 8.18 0.00 0.27 -4.21 4.64 -1.93 -1.06 113.55 119.44 2f52 h SER 11 Ca -0.33 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.66 2f52 h SER 11 Cb 1.13 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.24 2f52 h SER 11 CO 0.60 0.00 -1.60 -0.08 -0.87 0.00 0.00 176.83 174.88 2f52 h GLU 12 N 0.00 0.43 -0.21 4.77 4.81 -1.94 -3.34 114.58 119.10 2f52 h GLU 12 Ca 0.00 -0.74 -0.06 0.00 -0.13 0.00 0.00 59.36 58.43 2f52 h GLU 12 Cb 0.05 0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 2f52 h GLU 12 CO -0.00 1.34 -0.12 0.87 -0.73 0.00 0.00 179.01 180.37 2f52 h LYS 13 N 0.12 0.45 0.00 1.92 1.57 -1.65 -3.47 116.57 115.50 2f52 h LYS 13 Ca -0.29 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2f52 h LYS 13 Cb 2.11 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.42 2f52 h LYS 13 CO 0.22 0.75 0.00 0.41 -0.57 0.00 0.00 179.45 180.25 2f52 n GLY 14 N 0.03 0.69 2.11 3.86 0.00 -0.58 -5.04 105.19 106.26 2f52 n GLY 14 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 2f52 n GLY 14 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2f52 n PHE 15 N -1.39 -0.77 -3.92 1.61 -1.74 -1.26 -2.71 117.46 107.29 2f52 n PHE 15 Ca 0.00 -1.67 -0.10 0.00 -0.56 0.00 0.00 57.45 55.11 2f52 n PHE 15 Cb 0.00 0.26 -0.01 0.00 1.52 0.00 0.00 39.48 41.25 2f52 n PHE 15 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 2f52 s GLY 16 N -2.45 0.69 -0.10 4.97 0.00 -1.00 -2.30 107.32 107.12 2f52 s GLY 16 Ca 0.23 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 44.00 2f52 s GLY 16 CO 0.16 -0.53 -0.13 -1.36 0.00 0.00 0.00 173.10 171.24 2f52 s PHE 17 N -2.89 2.79 0.05 1.90 0.08 0.17 -1.17 117.98 118.91 2f52 s PHE 17 Ca 0.20 -0.46 0.07 0.00 0.12 0.00 0.00 56.93 56.86 2f52 s PHE 17 Cb -0.03 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.61 2f52 s PHE 17 CO 0.13 -0.07 -0.18 0.42 -0.10 0.00 0.00 175.22 175.43 2f52 s ILE 18 N -0.01 2.79 -0.28 0.64 1.01 -0.03 0.98 121.20 126.30 2f52 s ILE 18 Ca -0.03 -1.21 -0.07 0.00 0.00 0.00 0.00 60.65 59.34 2f52 s ILE 18 Cb -0.14 -2.18 -0.00 0.00 0.01 0.00 0.00 42.46 40.15 2f52 s ILE 18 CO 0.04 0.32 0.07 -0.70 0.00 0.00 0.00 174.94 174.67 2f52 s GLU 19 N -1.48 3.25 -0.15 2.79 2.12 0.82 -0.79 118.70 125.26 2f52 s GLU 19 Ca 0.15 -0.75 -0.22 0.00 0.36 0.00 0.00 54.97 54.51 2f52 s GLU 19 Cb -0.10 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 30.93 2f52 s GLU 19 CO 0.06 -0.36 0.67 0.08 -0.54 0.00 0.00 175.26 175.16 2f52 s VAL 20 N 1.53 5.02 -0.57 3.70 1.01 -1.25 -1.97 120.40 127.87 2f52 s VAL 20 Ca 0.04 1.30 -0.27 0.00 0.00 0.00 0.00 61.98 63.05 2f52 s VAL 20 Cb -0.16 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 2f52 s VAL 20 CO 0.02 0.16 1.83 -1.61 0.00 0.00 0.00 175.10 175.50 2f52 s GLU 21 N 1.51 2.75 0.00 2.72 2.02 -1.26 -1.90 118.70 124.55 2f52 s GLU 21 Ca 0.32 0.72 0.00 0.00 0.02 0.00 0.00 54.97 56.03 2f52 s GLU 21 Cb -0.16 -4.35 0.00 0.00 0.10 0.00 0.00 34.13 29.72 2f52 s GLU 21 CO 0.13 -2.58 0.00 0.41 0.02 0.00 0.00 175.26 173.24 2f52 n GLY 22 N 5.64 1.60 3.40 -1.39 0.00 -1.26 -5.05 105.19 108.12 2f52 n GLY 22 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 2f52 n GLY 22 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2f52 s GLN 23 N 0.00 1.47 0.15 1.61 -0.21 -0.80 -5.13 119.66 116.76 2f52 s GLN 23 Ca 0.00 -1.63 -0.02 0.00 0.02 0.00 0.00 55.36 53.73 2f52 s GLN 23 Cb 0.00 -1.46 0.04 0.00 1.00 0.00 0.00 33.01 32.59 2f52 s GLN 23 CO 0.00 0.27 0.08 -0.25 -2.12 0.00 0.00 175.29 173.27 2f52 n ASP 24 N -0.32 -1.75 -4.73 5.90 8.00 -1.26 -4.19 116.55 118.20 2f52 n ASP 24 Ca -0.08 -0.08 -0.41 0.00 0.71 0.00 0.00 54.79 54.92 2f52 n ASP 24 Cb 0.59 -0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 2f52 n ASP 24 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2f52 s ASP 25 N -1.84 7.11 -0.18 -2.24 1.01 -1.26 -3.89 116.67 115.37 2f52 s ASP 25 Ca 0.06 2.13 -0.03 0.00 0.71 0.00 0.00 52.55 55.42 2f52 s ASP 25 Cb -0.01 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.31 2f52 s ASP 25 CO 0.05 -0.38 -0.05 -0.69 0.21 0.00 0.00 175.17 174.31 2f52 s VAL 26 N 0.34 3.54 0.62 -1.27 1.01 0.03 -4.55 120.40 120.11 2f52 s VAL 26 Ca 0.55 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 2f52 s VAL 26 Cb -0.31 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2f52 s VAL 26 CO 0.33 0.46 1.03 0.12 0.00 0.00 0.00 175.10 177.05 2f52 s PHE 27 N 0.90 3.55 -0.01 5.22 5.36 -0.77 -0.85 117.98 131.36 2f52 s PHE 27 Ca -0.01 1.32 0.02 0.00 -0.96 0.00 0.00 56.93 57.30 2f52 s PHE 27 Cb -0.15 -2.75 -0.00 0.00 -0.34 0.00 0.00 43.02 39.79 2f52 s PHE 27 CO 0.01 -0.75 -0.07 0.08 -1.46 0.00 0.00 175.22 173.03 2f52 s VAL 28 N -3.12 0.61 0.11 3.12 1.01 -0.32 0.30 120.40 122.11 2f52 s VAL 28 Ca 0.56 -0.30 0.06 0.00 0.00 0.00 0.00 61.98 62.30 2f52 s VAL 28 Cb -0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 2f52 s VAL 28 CO 0.53 0.19 -0.05 -2.28 0.00 0.00 0.00 175.10 173.48 2f52 s HIS 29 N 0.03 2.84 0.17 5.22 2.46 -1.26 -2.37 115.29 122.37 2f52 s HIS 29 Ca -0.00 -0.11 -0.22 0.00 0.47 0.00 0.00 55.06 55.20 2f52 s HIS 29 Cb -0.05 -1.46 0.07 0.00 -0.13 0.00 0.00 32.58 31.01 2f52 s HIS 29 CO -0.00 0.46 1.60 0.27 -2.47 0.00 0.00 174.74 174.60 2f52 h PHE 30 N 3.43 -0.88 -0.44 3.88 -5.15 -1.86 0.48 116.94 116.41 2f52 h PHE 30 Ca -0.48 0.06 0.12 0.00 -0.20 0.00 0.00 57.97 57.46 2f52 h PHE 30 Cb 1.17 0.45 -0.02 0.00 0.22 0.00 0.00 35.95 37.77 2f52 h PHE 30 CO 0.61 -0.38 0.31 1.03 -2.00 0.00 0.00 178.31 177.88 2f52 h SER 31 N -0.23 0.05 0.32 -0.68 0.87 -1.95 0.56 113.55 112.48 2f52 h SER 31 Ca 0.18 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2f52 h SER 31 Cb 0.53 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2f52 h SER 31 CO -0.55 0.03 0.00 0.00 -0.53 0.00 0.00 176.83 175.78 2f52 h ALA 32 N 1.78 1.00 -4.10 6.23 0.00 -0.34 -3.41 119.26 120.42 2f52 h ALA 32 Ca 0.21 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.43 2f52 h ALA 32 Cb 0.75 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.30 2f52 h ALA 32 CO -0.01 0.00 -0.84 0.42 0.00 0.00 0.00 179.25 178.81 2f52 s ILE 33 N -3.74 2.48 0.24 0.00 1.09 0.19 0.25 121.20 121.71 2f52 s ILE 33 Ca -0.01 -1.32 0.10 0.00 -1.10 0.00 0.00 60.65 58.31 2f52 s ILE 33 Cb 0.10 -2.02 -0.05 0.00 -1.06 0.00 0.00 42.46 39.43 2f52 s ILE 33 CO 0.37 0.33 -0.18 -1.10 -0.10 0.00 0.00 174.94 174.26 2f52 s GLN 34 N -1.42 1.49 0.00 2.79 -0.21 -1.26 -4.90 119.66 116.16 2f52 s GLN 34 Ca 0.13 -1.66 0.00 0.00 0.02 0.00 0.00 55.36 53.86 2f52 s GLN 34 Cb -0.10 -1.46 0.00 0.00 1.00 0.00 0.00 33.01 32.45 2f52 s GLN 34 CO 0.04 0.27 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 2f52 n GLY 35 N -0.42 3.91 3.12 3.09 0.00 -1.26 -4.88 105.19 108.74 2f52 n GLY 35 Ca -0.07 -1.08 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 2f52 n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2f52 s GLU 36 N -2.68 2.90 0.00 1.61 2.02 -1.26 -4.32 118.70 116.97 2f52 s GLU 36 Ca 0.00 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.09 2f52 s GLU 36 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 34.13 31.61 2f52 s GLU 36 CO 0.00 -0.26 0.00 0.41 0.02 0.00 0.00 175.26 175.43 2f52 n GLY 37 N 4.60 0.27 2.48 -1.39 0.00 -1.26 -4.86 105.19 105.02 2f52 n GLY 37 Ca -0.20 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 2f52 n GLY 37 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2f52 n PHE 38 N -2.00 -0.69 0.27 1.61 1.16 -1.26 -4.92 117.46 111.63 2f52 n PHE 38 Ca 0.00 -1.65 0.12 0.00 -1.87 0.00 0.00 57.45 54.06 2f52 n PHE 38 Cb 0.00 0.79 0.76 0.00 -1.61 0.00 0.00 39.48 39.42 2f52 n PHE 38 CO 0.00 0.00 0.00 0.87 -1.87 0.00 0.00 176.76 175.76 2f52 h LYS 39 N 1.40 0.00 -6.35 3.97 1.57 -1.90 -3.41 116.57 111.85 2f52 h LYS 39 Ca -0.35 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.88 2f52 h LYS 39 Cb 1.34 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.63 2f52 h LYS 39 CO -0.07 0.09 0.68 0.95 -0.57 0.00 0.00 179.45 180.53 2f52 s THR 40 N -4.38 4.21 0.32 -0.16 -4.23 -1.26 -4.94 115.64 105.20 2f52 s THR 40 Ca -0.04 1.55 -0.28 0.00 -1.18 0.00 0.00 61.69 61.74 2f52 s THR 40 Cb 0.14 -3.99 -0.09 0.00 1.34 0.00 0.00 72.50 69.89 2f52 s THR 40 CO 0.59 0.02 1.15 -0.76 -0.54 0.00 0.00 174.62 175.08 2f52 s LEU 41 N 2.01 4.44 -0.15 4.79 1.02 -1.26 -5.01 118.68 124.52 2f52 s LEU 41 Ca 0.57 2.35 -0.12 0.00 0.02 0.00 0.00 54.13 56.94 2f52 s LEU 41 Cb -0.26 -3.74 -0.05 0.00 0.02 0.00 0.00 46.19 42.17 2f52 s LEU 41 CO 0.23 -0.34 0.26 -0.70 0.02 0.00 0.00 176.35 175.83 2f52 s GLU 42 N -1.74 4.11 0.19 1.70 2.12 -1.26 -4.79 118.70 119.04 2f52 s GLU 42 Ca 0.48 0.05 -0.32 0.00 0.36 0.00 0.00 54.97 55.54 2f52 s GLU 42 Cb -0.33 -3.38 -0.12 0.00 0.26 0.00 0.00 34.13 30.57 2f52 s GLU 42 CO 0.42 0.36 1.74 -1.91 -0.54 0.00 0.00 175.26 175.33 2f52 n GLU 43 N 3.20 2.74 -0.06 4.30 2.13 -1.26 -0.83 120.64 130.85 2f52 n GLU 43 Ca -0.14 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.67 2f52 n GLU 43 Cb 0.52 -2.84 0.00 0.00 0.27 0.00 0.00 31.44 29.39 2f52 n GLU 43 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2f52 n GLY 44 N 3.99 0.88 3.69 8.31 0.00 0.48 -4.95 105.19 117.60 2f52 n GLY 44 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2f52 n GLY 44 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2f52 s GLN 45 N -0.69 4.42 0.25 1.61 2.00 -0.01 -4.56 119.66 122.69 2f52 s GLN 45 Ca 0.00 1.50 -0.24 0.00 -2.00 0.00 0.00 55.36 54.62 2f52 s GLN 45 Cb 0.00 -3.52 -0.09 0.00 0.80 0.00 0.00 33.01 30.20 2f52 s GLN 45 CO 0.00 -0.31 0.83 0.00 -0.50 0.00 0.00 175.29 175.31 2f52 s ALA 46 N 1.86 3.34 0.18 1.58 0.00 -1.26 -1.23 121.76 126.23 2f52 s ALA 46 Ca 0.52 0.37 -0.06 0.00 0.00 0.00 0.00 51.96 52.79 2f52 s ALA 46 Cb -0.21 -3.01 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 2f52 s ALA 46 CO 0.21 0.26 0.22 0.14 0.00 0.00 0.00 175.76 176.58 2f52 s VAL 47 N -1.46 0.05 0.17 0.00 -7.23 -0.17 -0.11 120.40 111.65 2f52 s VAL 47 Ca 0.44 -1.67 0.07 0.00 -1.81 0.00 0.00 61.98 59.01 2f52 s VAL 47 Cb -0.19 -2.10 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 2f52 s VAL 47 CO 0.24 -0.23 0.03 -0.55 -0.31 0.00 0.00 175.10 174.28 2f52 s SER 48 N -3.04 4.93 0.00 4.85 0.15 0.30 -1.58 113.70 119.32 2f52 s SER 48 Ca 0.25 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.56 2f52 s SER 48 Cb 0.05 -1.11 0.00 0.00 -1.71 0.00 0.00 66.02 63.25 2f52 s SER 48 CO 0.05 0.09 0.00 2.22 1.20 0.00 0.00 173.24 176.79 2f52 n PHE 49 N -0.16 0.00 -3.56 3.44 1.16 -0.89 0.86 117.46 118.31 2f52 n PHE 49 Ca -0.09 0.00 -0.23 0.00 -1.87 0.00 0.00 57.45 55.25 2f52 n PHE 49 Cb 0.55 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.40 2f52 n PHE 49 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2f52 s GLU 50 N -2.00 3.48 -0.22 3.97 0.41 -1.08 -1.93 118.70 121.33 2f52 s GLU 50 Ca 0.00 -0.45 -0.10 0.00 -0.41 0.00 0.00 54.97 54.01 2f52 s GLU 50 Cb 0.00 -2.74 -0.05 0.00 -1.78 0.00 0.00 34.13 29.57 2f52 s GLU 50 CO 0.00 0.24 0.14 0.42 -0.49 0.00 0.00 175.26 175.57 2f52 s ILE 51 N -2.20 5.30 -0.17 -1.63 1.09 -1.26 -2.16 121.20 120.17 2f52 s ILE 51 Ca 0.38 0.15 -0.00 0.00 -1.10 0.00 0.00 60.65 60.08 2f52 s ILE 51 Cb -0.09 -3.44 -0.00 0.00 -1.06 0.00 0.00 42.46 37.86 2f52 s ILE 51 CO 0.34 0.40 -0.14 0.68 -0.10 0.00 0.00 174.94 176.12 2f52 s VAL 52 N 0.71 2.74 -0.66 2.92 -7.23 -0.48 -4.91 120.40 113.48 2f52 s VAL 52 Ca 0.07 -0.73 -0.18 0.00 -1.81 0.00 0.00 61.98 59.33 2f52 s VAL 52 Cb -0.12 -2.17 0.13 0.00 0.56 0.00 0.00 36.38 34.77 2f52 s VAL 52 CO 0.01 0.50 0.74 -1.61 -0.31 0.00 0.00 175.10 174.43 2f52 s GLU 53 N 0.95 3.20 0.73 4.82 2.02 -1.26 0.64 118.70 129.80 2f52 s GLU 53 Ca -0.02 -1.62 -0.02 0.00 0.02 0.00 0.00 54.97 53.33 2f52 s GLU 53 Cb -0.15 -4.37 0.15 0.00 0.10 0.00 0.00 34.13 29.85 2f52 s GLU 53 CO -0.02 -1.50 0.99 0.41 0.02 0.00 0.00 175.26 175.17 2f52 n GLY 54 N 5.08 0.44 0.15 -1.39 0.00 0.72 -4.90 105.19 105.29 2f52 n GLY 54 Ca -0.02 -2.00 -0.07 0.00 0.00 0.00 0.00 46.02 43.93 2f52 n GLY 54 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2f52 h ASN 55 N -0.68 -0.32 -0.72 1.61 -1.07 -2.02 -1.71 115.58 110.66 2f52 h ASN 55 Ca -0.33 0.09 -0.01 0.00 0.07 0.00 0.00 56.30 56.12 2f52 h ASN 55 Cb 1.17 0.20 -0.03 0.00 -2.07 0.00 0.00 38.32 37.59 2f52 h ASN 55 CO 0.34 -0.12 0.41 0.03 0.07 0.00 0.00 177.43 178.16 2f52 h ARG 56 N -0.03 1.00 0.00 4.14 3.08 -2.00 -3.48 114.38 117.08 2f52 h ARG 56 Ca 0.14 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2f52 h ARG 56 Cb 0.24 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2f52 h ARG 56 CO -0.30 0.73 0.00 0.41 -1.07 0.00 0.00 179.97 179.74 2f52 n GLY 57 N -1.12 -0.79 3.77 0.04 0.00 -0.65 -5.12 105.19 101.31 2f52 n GLY 57 Ca 0.06 -1.21 -0.41 0.00 0.00 0.00 0.00 46.02 44.46 2f52 n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2f52 s PRO 58 N -2.00 4.42 0.18 1.61 0.04 -1.25 -0.20 135.00 137.79 2f52 s PRO 58 Ca 0.00 2.13 0.01 0.00 0.04 0.00 0.00 61.00 63.18 2f52 s PRO 58 Cb 0.00 -3.10 -0.05 0.00 0.04 0.00 0.00 34.50 31.39 2f52 s PRO 58 CO 0.00 -0.11 0.02 -0.65 0.04 0.00 0.00 177.00 176.31 2f52 s GLN 59 N -1.66 1.13 -0.07 4.56 -0.21 0.21 -1.85 119.66 121.77 2f52 s GLN 59 Ca 0.48 -1.56 -0.07 0.00 0.02 0.00 0.00 55.36 54.24 2f52 s GLN 59 Cb -0.38 -0.19 -0.04 0.00 1.00 0.00 0.00 33.01 33.40 2f52 s GLN 59 CO 0.50 -0.18 0.19 0.00 -2.12 0.00 0.00 175.29 173.68 2f52 s ALA 60 N -3.73 3.88 0.18 6.09 0.00 0.88 -1.39 121.76 127.67 2f52 s ALA 60 Ca 0.26 -0.63 0.09 0.00 0.00 0.00 0.00 51.96 51.69 2f52 s ALA 60 Cb 0.06 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 2f52 s ALA 60 CO 0.05 0.64 -0.19 0.00 0.00 0.00 0.00 175.76 176.27 2f52 s ALA 61 N -1.13 2.12 -0.84 0.00 0.00 -0.92 -4.55 121.76 116.43 2f52 s ALA 61 Ca 0.20 -1.54 -0.10 0.00 0.00 0.00 0.00 51.96 50.51 2f52 s ALA 61 Cb -0.13 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.81 2f52 s ALA 61 CO 0.10 0.25 0.55 -1.71 0.00 0.00 0.00 175.76 174.95 2f52 n ASN 62 N 0.19 -4.00 -4.71 0.00 4.05 -1.24 -2.62 115.26 106.93 2f52 n ASN 62 Ca -0.12 -0.97 -0.42 0.00 0.45 0.00 0.00 54.58 53.52 2f52 n ASN 62 Cb 0.57 -1.39 -0.03 0.00 1.23 0.00 0.00 39.78 40.16 2f52 n ASN 62 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2f52 s VAL 63 N -3.14 4.65 -0.17 3.44 1.01 0.70 -3.98 120.40 122.92 2f52 s VAL 63 Ca 0.14 1.96 0.00 0.00 0.00 0.00 0.00 61.98 64.09 2f52 s VAL 63 Cb -0.08 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2f52 s VAL 63 CO 0.81 0.18 -0.16 -0.89 0.00 0.00 0.00 175.10 175.05 2f52 s THR 64 N 0.80 2.53 -0.28 3.92 2.01 0.25 -4.07 115.64 120.80 2f52 s THR 64 Ca 0.52 -0.80 -0.29 0.00 0.31 0.00 0.00 61.69 61.43 2f52 s THR 64 Cb -0.23 -2.07 -0.00 0.00 0.01 0.00 0.00 72.50 70.21 2f52 s THR 64 CO 0.29 0.51 1.34 -0.54 -0.69 0.00 0.00 174.62 175.53 2f52 s LYS 65 N 1.01 3.93 0.41 4.92 1.02 -1.26 0.11 119.74 129.88 2f52 s LYS 65 Ca -0.02 1.34 0.08 0.00 0.02 0.00 0.00 55.97 57.39 2f52 s LYS 65 Cb -0.15 -3.89 0.01 0.00 -0.52 0.00 0.00 37.83 33.28 2f52 s LYS 65 CO -0.04 -1.10 0.56 -1.21 -0.92 0.00 0.00 175.35 172.64 2f52 s GLU 66 N 4.17 2.87 0.00 1.68 2.02 0.84 -4.93 118.70 125.35 2f52 s GLU 66 Ca 0.58 -1.19 0.00 0.00 0.02 0.00 0.00 54.97 54.38 2f52 s GLU 66 Cb -0.18 -2.76 0.00 0.00 0.10 0.00 0.00 34.13 31.29 2f52 s GLU 66 CO 0.23 -0.23 0.00 0.00 0.02 0.00 0.00 175.26 175.28