#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 3.18 -0.01 4.03 1.02 -0.76 -4.97 118.68 121.17 2f52 s LEU 2 Ca 0.00 -0.87 0.03 0.00 0.02 0.00 0.00 54.13 53.31 2f52 s LEU 2 Cb 0.00 -1.61 -0.01 0.00 0.02 0.00 0.00 46.19 44.60 2f52 s LEU 2 CO 0.00 -0.32 -0.10 -0.70 0.02 0.00 0.00 176.35 175.25 2f52 s GLU 3 N -3.82 0.80 0.05 1.70 2.12 -1.26 -1.65 118.70 116.64 2f52 s GLU 3 Ca 0.38 -0.35 -0.01 0.00 0.36 0.00 0.00 54.97 55.34 2f52 s GLU 3 Cb -0.01 -0.78 -0.04 0.00 0.26 0.00 0.00 34.13 33.57 2f52 s GLU 3 CO 0.22 0.21 -0.02 0.20 -0.54 0.00 0.00 175.26 175.33 2f52 s GLY 4 N -0.23 0.42 -0.09 -1.50 0.00 -1.03 -4.32 107.32 100.57 2f52 s GLY 4 Ca 0.04 -1.10 -0.02 0.00 0.00 0.00 0.00 44.72 43.64 2f52 s GLY 4 CO -0.00 -1.21 0.00 0.54 0.00 0.00 0.00 173.10 172.43 2f52 s LYS 5 N -3.61 3.00 -0.35 2.90 1.02 0.60 -2.41 119.74 120.90 2f52 s LYS 5 Ca 0.04 -0.41 -0.29 0.00 0.02 0.00 0.00 55.97 55.33 2f52 s LYS 5 Cb 0.06 -2.80 -0.00 0.00 -0.52 0.00 0.00 37.83 34.57 2f52 s LYS 5 CO -0.09 0.69 1.50 0.08 -0.92 0.00 0.00 175.35 176.61 2f52 s VAL 6 N -0.84 3.82 0.03 3.17 1.01 -0.97 0.11 120.40 126.72 2f52 s VAL 6 Ca 0.13 0.87 -0.16 0.00 0.00 0.00 0.00 61.98 62.81 2f52 s VAL 6 Cb -0.11 -4.01 -0.33 0.00 0.00 0.00 0.00 36.38 31.93 2f52 s VAL 6 CO 0.02 -0.57 1.03 0.50 0.00 0.00 0.00 175.10 176.08 2f52 h LYS 7 N 10.92 0.55 -2.58 2.72 3.64 -1.33 1.41 116.57 131.90 2f52 h LYS 7 Ca -0.30 -0.85 -0.05 0.00 -1.27 0.00 0.00 60.65 58.19 2f52 h LYS 7 Cb 1.12 0.30 -0.16 0.00 -0.41 0.00 0.00 32.23 33.09 2f52 h LYS 7 CO 1.05 1.40 0.14 -0.46 -2.27 0.00 0.00 179.45 179.31 2f52 s TRP 8 N -2.73 -0.54 -0.18 1.91 -0.00 -1.07 -4.69 118.94 111.64 2f52 s TRP 8 Ca -0.10 0.65 -0.19 0.00 -0.00 0.00 0.00 56.10 56.46 2f52 s TRP 8 Cb 0.04 0.43 0.05 0.00 -0.00 0.00 0.00 33.47 33.99 2f52 s TRP 8 CO 0.93 -0.70 0.53 -0.59 -0.00 0.00 0.00 176.95 177.13 2f52 s PHE 9 N -2.42 -0.57 -0.05 5.86 -0.71 -1.26 0.04 117.98 118.86 2f52 s PHE 9 Ca -0.05 1.36 0.01 0.00 -1.04 0.00 0.00 56.93 57.21 2f52 s PHE 9 Cb -0.01 0.21 0.02 0.00 -1.21 0.00 0.00 43.02 42.03 2f52 s PHE 9 CO -0.01 -0.31 -0.06 1.21 -1.34 0.00 0.00 175.22 174.71 2f52 s ASN 10 N 0.13 1.24 0.46 1.98 2.47 -1.06 -4.91 114.94 115.24 2f52 s ASN 10 Ca -0.01 -0.18 0.25 0.00 0.42 0.00 0.00 52.86 53.34 2f52 s ASN 10 Cb -0.04 -0.56 0.50 0.00 -1.45 0.00 0.00 41.25 39.70 2f52 s ASN 10 CO 0.01 -0.04 1.67 0.77 -3.72 0.00 0.00 177.10 175.79 2f52 h SER 11 N 7.21 0.00 -0.31 -4.21 4.64 -1.94 -0.83 113.55 118.11 2f52 h SER 11 Ca -0.35 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 2f52 h SER 11 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 2f52 h SER 11 CO 0.46 0.00 0.08 -0.33 -0.87 0.00 0.00 176.83 176.17 2f52 h GLU 12 N 0.00 0.50 -0.06 4.77 4.39 -1.94 -2.52 114.58 119.72 2f52 h GLU 12 Ca -0.00 -0.12 -0.19 0.00 0.34 0.00 0.00 59.36 59.39 2f52 h GLU 12 Cb 0.93 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.50 2f52 h GLU 12 CO 0.00 0.56 -0.76 0.87 -1.16 0.00 0.00 179.01 178.52 2f52 h LYS 13 N 0.35 0.39 0.00 2.33 1.57 -1.97 -3.47 116.57 115.78 2f52 h LYS 13 Ca 0.10 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2f52 h LYS 13 Cb 0.28 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2f52 h LYS 13 CO 0.00 0.98 0.00 0.41 -0.57 0.00 0.00 179.45 180.27 2f52 n GLY 14 N 0.61 0.69 3.24 3.86 0.00 -0.33 -4.98 105.19 108.29 2f52 n GLY 14 Ca -0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 2f52 n GLY 14 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2f52 s PHE 15 N -2.65 1.35 0.25 1.61 -0.71 -1.19 -2.66 117.98 113.98 2f52 s PHE 15 Ca 0.00 -1.40 0.01 0.00 -1.04 0.00 0.00 56.93 54.51 2f52 s PHE 15 Cb 0.00 -0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 41.11 2f52 s PHE 15 CO 0.00 -0.62 0.15 0.20 -1.34 0.00 0.00 175.22 173.61 2f52 s GLY 16 N -3.24 1.72 -0.10 1.99 0.00 -0.35 -2.57 107.32 104.77 2f52 s GLY 16 Ca 0.39 -1.79 0.02 0.00 0.00 0.00 0.00 44.72 43.34 2f52 s GLY 16 CO 0.15 -1.47 -0.15 -1.36 0.00 0.00 0.00 173.10 170.27 2f52 s PHE 17 N -3.90 2.73 0.20 1.90 0.08 0.11 -0.89 117.98 118.20 2f52 s PHE 17 Ca 0.38 -0.56 0.11 0.00 0.12 0.00 0.00 56.93 56.98 2f52 s PHE 17 Cb 0.06 -1.75 -0.04 0.00 -0.57 0.00 0.00 43.02 40.71 2f52 s PHE 17 CO 0.15 -0.13 -0.22 0.42 -0.10 0.00 0.00 175.22 175.34 2f52 s ILE 18 N 0.03 2.27 -0.17 0.64 1.01 -0.59 -0.89 121.20 123.50 2f52 s ILE 18 Ca -0.05 -2.07 0.00 0.00 0.00 0.00 0.00 60.65 58.53 2f52 s ILE 18 Cb -0.15 -2.10 0.00 0.00 0.01 0.00 0.00 42.46 40.23 2f52 s ILE 18 CO 0.05 -0.20 -0.15 -0.70 0.00 0.00 0.00 174.94 173.93 2f52 s GLU 19 N -2.82 3.17 -0.25 2.79 2.56 0.31 -1.43 118.70 123.02 2f52 s GLU 19 Ca 0.21 -0.76 -0.12 0.00 0.00 0.00 0.00 54.97 54.30 2f52 s GLU 19 Cb -0.07 -2.65 -0.05 0.00 2.00 0.00 0.00 34.13 33.37 2f52 s GLU 19 CO 0.10 -0.07 0.25 0.08 -0.56 0.00 0.00 175.26 175.07 2f52 s VAL 20 N 1.01 5.28 -0.41 3.70 1.01 -1.26 -0.29 120.40 129.45 2f52 s VAL 20 Ca -0.02 0.35 -0.28 0.00 0.00 0.00 0.00 61.98 62.03 2f52 s VAL 20 Cb -0.15 -3.59 -0.00 0.00 0.00 0.00 0.00 36.38 32.65 2f52 s VAL 20 CO -0.04 0.27 1.58 -1.61 0.00 0.00 0.00 175.10 175.31 2f52 s GLU 21 N 1.45 3.40 0.00 2.72 0.41 -1.26 -2.41 118.70 123.01 2f52 s GLU 21 Ca 0.11 1.05 0.00 0.00 -0.41 0.00 0.00 54.97 55.71 2f52 s GLU 21 Cb -0.15 -4.12 0.00 0.00 -1.78 0.00 0.00 34.13 28.08 2f52 s GLU 21 CO 0.08 -1.78 0.00 0.41 -0.49 0.00 0.00 175.26 173.47 2f52 n GLY 22 N 5.26 1.57 3.26 -1.39 0.00 -1.26 -5.06 105.19 107.58 2f52 n GLY 22 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 1.23 0.84 1.61 -0.21 -1.01 -5.15 119.66 116.97 2f52 s GLN 23 Ca 0.00 -1.64 -0.12 0.00 0.02 0.00 0.00 55.36 53.62 2f52 s GLN 23 Cb 0.00 -0.16 0.19 0.00 1.00 0.00 0.00 33.01 34.04 2f52 s GLN 23 CO 0.00 -0.24 0.42 -0.25 -2.12 0.00 0.00 175.29 173.10 2f52 n ASP 24 N -0.33 -2.90 -4.77 5.90 8.00 -1.26 -4.41 116.55 116.78 2f52 n ASP 24 Ca -0.03 -0.43 -0.38 0.00 0.71 0.00 0.00 54.79 54.66 2f52 n ASP 24 Cb 0.65 -0.60 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 2f52 n ASP 24 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2f52 s ASP 25 N -2.21 6.97 -0.20 -2.24 1.47 -1.26 -4.03 116.67 115.17 2f52 s ASP 25 Ca 0.33 2.16 -0.01 0.00 1.18 0.00 0.00 52.55 56.20 2f52 s ASP 25 Cb -0.06 -2.61 0.01 0.00 -0.34 0.00 0.00 42.92 39.93 2f52 s ASP 25 CO 0.27 -0.34 -0.12 -0.69 0.68 0.00 0.00 175.17 174.97 2f52 s VAL 26 N -1.42 2.66 0.63 2.11 1.01 -0.52 -4.71 120.40 120.16 2f52 s VAL 26 Ca 0.52 -0.78 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2f52 s VAL 26 Cb -0.27 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 2f52 s VAL 26 CO 0.34 0.45 1.04 0.12 0.00 0.00 0.00 175.10 177.05 2f52 s PHE 27 N 1.37 3.38 -0.07 5.22 5.36 -1.22 -1.54 117.98 130.47 2f52 s PHE 27 Ca 0.05 1.38 0.00 0.00 -0.96 0.00 0.00 56.93 57.40 2f52 s PHE 27 Cb -0.14 -2.81 0.02 0.00 -0.34 0.00 0.00 43.02 39.76 2f52 s PHE 27 CO -0.08 -0.86 -0.05 0.08 -1.46 0.00 0.00 175.22 172.85 2f52 s VAL 28 N -3.00 0.66 0.16 3.12 1.01 -0.07 0.16 120.40 122.44 2f52 s VAL 28 Ca 0.57 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.42 2f52 s VAL 28 Cb -0.12 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 2f52 s VAL 28 CO 0.50 0.27 0.32 -2.28 0.00 0.00 0.00 175.10 173.92 2f52 s HIS 29 N 1.27 3.49 0.20 5.22 2.46 -1.26 -1.21 115.29 125.45 2f52 s HIS 29 Ca -0.05 0.25 -0.20 0.00 0.47 0.00 0.00 55.06 55.53 2f52 s HIS 29 Cb -0.14 -1.77 0.15 0.00 -0.13 0.00 0.00 32.58 30.69 2f52 s HIS 29 CO -0.02 0.46 1.58 0.27 -2.47 0.00 0.00 174.74 174.57 2f52 h PHE 30 N 2.23 -0.89 -0.29 3.88 -5.15 -1.84 1.39 116.94 116.27 2f52 h PHE 30 Ca -0.48 0.08 0.09 0.00 -0.20 0.00 0.00 57.97 57.45 2f52 h PHE 30 Cb 1.19 0.49 -0.01 0.00 0.22 0.00 0.00 35.95 37.83 2f52 h PHE 30 CO 0.55 -0.38 0.35 0.66 -2.00 0.00 0.00 178.31 177.50 2f52 h SER 31 N -0.13 0.00 0.18 -0.68 4.64 -1.93 0.29 113.55 115.92 2f52 h SER 31 Ca 0.26 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.57 2f52 h SER 31 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2f52 h SER 31 CO -0.72 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.19 2f52 h ALA 32 N 1.57 1.36 -3.45 5.18 0.00 0.16 -3.41 119.26 120.68 2f52 h ALA 32 Ca 0.14 -0.05 -0.67 0.00 0.00 0.00 0.00 54.91 54.34 2f52 h ALA 32 Cb 0.84 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 18.43 2f52 h ALA 32 CO -0.00 0.07 -0.67 0.42 0.00 0.00 0.00 179.25 179.06 2f52 s ILE 33 N -4.38 3.89 -0.35 0.00 1.09 0.10 0.62 121.20 122.17 2f52 s ILE 33 Ca -0.04 -0.39 -0.12 0.00 -1.10 0.00 0.00 60.65 59.00 2f52 s ILE 33 Cb 0.14 -2.64 -0.00 0.00 -1.06 0.00 0.00 42.46 38.89 2f52 s ILE 33 CO 0.55 0.56 0.23 -1.58 -0.10 0.00 0.00 174.94 174.60 2f52 s GLN 34 N -0.36 3.30 -0.19 2.79 0.74 -1.26 -4.87 119.66 119.81 2f52 s GLN 34 Ca 0.06 -0.77 -0.35 0.00 0.05 0.00 0.00 55.36 54.34 2f52 s GLN 34 Cb -0.12 -3.77 0.14 0.00 1.10 0.00 0.00 33.01 30.35 2f52 s GLN 34 CO 0.02 -0.52 1.29 0.20 -0.55 0.00 0.00 175.29 175.73 2f52 s GLY 35 N 1.67 -0.30 -0.60 2.59 0.00 -1.26 -4.93 107.32 104.50 2f52 s GLY 35 Ca 0.05 1.52 0.03 0.00 0.00 0.00 0.00 44.72 46.32 2f52 s GLY 35 CO 0.09 0.48 0.37 -0.54 0.00 0.00 0.00 173.10 173.50 2f52 s GLU 36 N -2.28 2.26 0.00 2.90 2.02 -1.26 -4.33 118.70 118.01 2f52 s GLU 36 Ca 0.11 -2.80 0.00 0.00 0.02 0.00 0.00 54.97 52.31 2f52 s GLU 36 Cb 0.00 -3.46 0.00 0.00 0.10 0.00 0.00 34.13 30.78 2f52 s GLU 36 CO -0.04 -1.17 0.00 0.41 0.02 0.00 0.00 175.26 174.48 2f52 n GLY 37 N 2.90 1.35 0.48 -1.39 0.00 -1.26 -4.89 105.19 102.38 2f52 n GLY 37 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 0.00 -0.24 1.61 1.16 -1.26 -4.77 117.46 113.96 2f52 n PHE 38 Ca 0.00 -1.09 0.10 0.00 -1.87 0.00 0.00 57.45 54.60 2f52 n PHE 38 Cb 0.00 -0.19 0.37 0.00 -1.61 0.00 0.00 39.48 38.05 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 0.54 0.69 -6.78 3.97 1.57 -1.90 -3.41 116.57 111.26 2f52 h LYS 39 Ca -0.02 -0.04 -0.51 0.00 -1.87 0.00 0.00 60.65 58.20 2f52 h LYS 39 Cb 1.12 -0.16 0.03 0.00 0.08 0.00 0.00 32.23 33.30 2f52 h LYS 39 CO 0.01 0.46 0.54 0.99 -0.57 0.00 0.00 179.45 180.88 2f52 s THR 40 N -5.67 3.34 0.96 -0.16 2.01 -1.26 -4.60 115.64 110.26 2f52 s THR 40 Ca -0.10 1.27 -0.16 0.00 0.31 0.00 0.00 61.69 63.01 2f52 s THR 40 Cb 0.21 -3.81 0.21 0.00 0.01 0.00 0.00 72.50 69.12 2f52 s THR 40 CO 0.78 0.27 1.32 -0.76 -0.69 0.00 0.00 174.62 175.55 2f52 s LEU 41 N -1.14 2.74 -0.03 4.42 1.02 -1.26 -5.08 118.68 119.36 2f52 s LEU 41 Ca 0.48 0.20 0.05 0.00 0.02 0.00 0.00 54.13 54.88 2f52 s LEU 41 Cb -0.34 -2.21 -0.02 0.00 0.02 0.00 0.00 46.19 43.63 2f52 s LEU 41 CO 0.42 -2.77 -0.19 -0.70 0.02 0.00 0.00 176.35 173.14 2f52 s GLU 42 N -5.89 2.33 0.10 1.70 2.12 -1.26 -4.87 118.70 112.94 2f52 s GLU 42 Ca 0.75 -0.80 -0.31 0.00 0.36 0.00 0.00 54.97 54.97 2f52 s GLU 42 Cb -0.03 -2.24 -0.09 0.00 0.26 0.00 0.00 34.13 32.02 2f52 s GLU 42 CO 0.53 0.60 1.75 -2.00 -0.54 0.00 0.00 175.26 175.59 2f52 s GLU 43 N -0.72 4.16 0.00 4.30 2.12 -1.26 -0.89 118.70 126.41 2f52 s GLU 43 Ca 0.11 2.48 0.00 0.00 0.36 0.00 0.00 54.97 57.92 2f52 s GLU 43 Cb -0.10 -3.58 0.00 0.00 0.26 0.00 0.00 34.13 30.71 2f52 s GLU 43 CO 0.00 -0.79 0.00 0.41 -0.54 0.00 0.00 175.26 174.34 2f52 n GLY 44 N 4.12 1.21 3.73 -1.50 0.00 0.48 -4.93 105.19 108.30 2f52 n GLY 44 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.53 4.62 0.24 1.61 0.74 -0.07 -4.66 119.66 121.61 2f52 s GLN 45 Ca 0.00 1.31 -0.30 0.00 0.05 0.00 0.00 55.36 56.42 2f52 s GLN 45 Cb 0.00 -3.38 -0.09 0.00 1.10 0.00 0.00 33.01 30.64 2f52 s GLN 45 CO 0.00 0.23 0.94 0.00 -0.55 0.00 0.00 175.29 175.91 2f52 s ALA 46 N 0.02 3.34 0.02 1.58 0.00 -1.26 -2.30 121.76 123.16 2f52 s ALA 46 Ca 0.44 0.61 -0.01 0.00 0.00 0.00 0.00 51.96 53.00 2f52 s ALA 46 Cb -0.22 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 2f52 s ALA 46 CO 0.27 0.21 -0.01 0.14 0.00 0.00 0.00 175.76 176.37 2f52 s VAL 47 N -1.20 0.13 0.04 0.00 -7.23 -1.01 -0.76 120.40 110.37 2f52 s VAL 47 Ca 0.41 -1.04 -0.00 0.00 -1.81 0.00 0.00 61.98 59.54 2f52 s VAL 47 Cb -0.26 -0.49 -0.04 0.00 0.56 0.00 0.00 36.38 36.15 2f52 s VAL 47 CO 0.32 -0.57 0.19 -0.55 -0.31 0.00 0.00 175.10 174.18 2f52 s SER 48 N -1.71 6.28 0.00 4.85 0.15 -0.19 -2.46 113.70 120.62 2f52 s SER 48 Ca -0.12 0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2f52 s SER 48 Cb -0.07 -1.92 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 2f52 s SER 48 CO -0.02 0.20 0.00 2.22 1.20 0.00 0.00 173.24 176.83 2f52 n PHE 49 N 0.49 0.00 -3.95 3.44 1.16 -0.66 -0.31 117.46 117.63 2f52 n PHE 49 Ca -0.07 0.00 -0.21 0.00 -1.87 0.00 0.00 57.45 55.30 2f52 n PHE 49 Cb 0.51 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.35 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 3.06 -0.13 3.97 2.02 -0.25 -1.84 118.70 123.54 2f52 s GLU 50 Ca 0.00 -1.00 -0.05 0.00 0.02 0.00 0.00 54.97 53.94 2f52 s GLU 50 Cb 0.00 -2.67 -0.04 0.00 0.10 0.00 0.00 34.13 31.52 2f52 s GLU 50 CO 0.00 0.32 0.05 0.42 0.02 0.00 0.00 175.26 176.07 2f52 s ILE 51 N -2.12 4.68 -0.08 -1.63 1.01 -1.26 -0.19 121.20 121.61 2f52 s ILE 51 Ca 0.36 -0.09 0.04 0.00 0.00 0.00 0.00 60.65 60.96 2f52 s ILE 51 Cb -0.08 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.35 2f52 s ILE 51 CO 0.27 0.55 -0.21 0.68 0.00 0.00 0.00 174.94 176.23 2f52 s VAL 52 N -0.39 1.82 -1.12 2.92 -7.23 -0.71 -4.87 120.40 110.82 2f52 s VAL 52 Ca 0.09 -0.90 -0.17 0.00 -1.81 0.00 0.00 61.98 59.19 2f52 s VAL 52 Cb -0.12 -1.58 0.13 0.00 0.56 0.00 0.00 36.38 35.37 2f52 s VAL 52 CO 0.02 0.51 1.40 -0.70 -0.31 0.00 0.00 175.10 176.02 2f52 s GLU 53 N 0.29 3.87 0.83 4.82 2.12 -1.26 -0.89 118.70 128.48 2f52 s GLU 53 Ca -0.14 -2.07 -0.08 0.00 0.36 0.00 0.00 54.97 53.04 2f52 s GLU 53 Cb -0.16 -5.14 0.15 0.00 0.26 0.00 0.00 34.13 29.24 2f52 s GLU 53 CO 0.06 -1.91 1.15 0.20 -0.54 0.00 0.00 175.26 174.23 2f52 s GLY 54 N 3.56 1.76 0.15 -1.50 0.00 0.17 -4.86 107.32 106.61 2f52 s GLY 54 Ca 0.42 -1.41 -0.24 0.00 0.00 0.00 0.00 44.72 43.49 2f52 s GLY 54 CO -0.03 -0.77 1.61 -0.57 0.00 0.00 0.00 173.10 173.35 2f52 h ASN 55 N -1.05 -0.97 -0.67 1.64 -1.24 -2.02 0.12 115.58 111.40 2f52 h ASN 55 Ca -0.41 0.16 0.07 0.00 0.71 0.00 0.00 56.30 56.83 2f52 h ASN 55 Cb 1.26 0.44 -0.04 0.00 0.73 0.00 0.00 38.32 40.70 2f52 h ASN 55 CO 0.41 -0.32 0.44 0.03 -1.29 0.00 0.00 177.43 176.70 2f52 h ARG 56 N -0.31 0.63 0.00 6.67 3.08 -1.99 -3.48 114.38 118.99 2f52 h ARG 56 Ca 0.13 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2f52 h ARG 56 Cb 0.52 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2f52 h ARG 56 CO -0.43 0.42 0.00 0.41 -1.07 0.00 0.00 179.97 179.30 2f52 n GLY 57 N -1.47 0.47 3.75 0.04 0.00 0.43 -5.10 105.19 103.32 2f52 n GLY 57 Ca 0.10 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 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 4.45 0.19 1.61 0.04 -1.25 0.42 135.00 138.47 2f52 s PRO 58 Ca 0.00 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.07 2f52 s PRO 58 Cb 0.00 -3.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.33 2f52 s PRO 58 CO 0.00 -0.11 0.03 -0.65 0.04 0.00 0.00 177.00 176.32 2f52 s GLN 59 N -0.90 1.18 -0.06 4.56 -0.21 -0.07 -3.46 119.66 120.70 2f52 s GLN 59 Ca 0.51 -1.59 -0.14 0.00 0.02 0.00 0.00 55.36 54.17 2f52 s GLN 59 Cb -0.36 -0.22 -0.05 0.00 1.00 0.00 0.00 33.01 33.38 2f52 s GLN 59 CO 0.43 -0.19 0.36 0.00 -2.12 0.00 0.00 175.29 173.77 2f52 s ALA 60 N -3.72 3.68 0.17 6.09 0.00 0.41 -1.74 121.76 126.66 2f52 s ALA 60 Ca 0.28 -0.32 0.09 0.00 0.00 0.00 0.00 51.96 52.01 2f52 s ALA 60 Cb 0.07 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.79 2f52 s ALA 60 CO 0.06 0.38 -0.19 0.00 0.00 0.00 0.00 175.76 176.01 2f52 s ALA 61 N -0.61 2.12 -0.67 0.00 0.00 0.74 -4.64 121.76 118.70 2f52 s ALA 61 Ca 0.21 -1.52 -0.14 0.00 0.00 0.00 0.00 51.96 50.51 2f52 s ALA 61 Cb -0.15 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.77 2f52 s ALA 61 CO 0.10 0.28 0.63 0.09 0.00 0.00 0.00 175.76 176.86 2f52 n ASN 62 N 0.28 -5.50 -4.69 0.00 3.02 -1.25 -1.09 115.26 106.03 2f52 n ASN 62 Ca -0.13 -0.54 -0.39 0.00 -0.03 0.00 0.00 54.58 53.49 2f52 n ASN 62 Cb 0.57 -2.19 -0.06 0.00 -0.61 0.00 0.00 39.78 37.49 2f52 n ASN 62 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2f52 s VAL 63 N -2.46 5.09 -0.15 2.41 1.01 0.20 -3.41 120.40 123.08 2f52 s VAL 63 Ca 0.14 1.15 0.01 0.00 0.00 0.00 0.00 61.98 63.29 2f52 s VAL 63 Cb -0.02 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.45 2f52 s VAL 63 CO 0.87 0.21 -0.19 -0.89 0.00 0.00 0.00 175.10 175.11 2f52 s THR 64 N 1.25 2.31 -0.35 3.92 2.01 0.58 -4.06 115.64 121.31 2f52 s THR 64 Ca 0.29 -0.89 -0.29 0.00 0.31 0.00 0.00 61.69 61.12 2f52 s THR 64 Cb -0.16 -1.96 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 2f52 s THR 64 CO 0.12 0.53 1.57 -0.54 -0.69 0.00 0.00 174.62 175.62 2f52 s LYS 65 N 0.90 3.54 0.51 4.92 1.02 -1.26 -1.02 119.74 128.36 2f52 s LYS 65 Ca -0.04 1.24 -0.03 0.00 0.02 0.00 0.00 55.97 57.16 2f52 s LYS 65 Cb -0.15 -4.08 -0.00 0.00 -0.52 0.00 0.00 37.83 33.08 2f52 s LYS 65 CO -0.03 -1.60 0.78 -1.21 -0.92 0.00 0.00 175.35 172.37 2f52 s GLU 66 N 5.11 3.06 0.00 1.68 2.02 0.06 -4.97 118.70 125.65 2f52 s GLU 66 Ca 0.69 -0.22 0.16 0.00 0.02 0.00 0.00 54.97 55.63 2f52 s GLU 66 Cb -0.19 -2.42 0.13 0.00 0.10 0.00 0.00 34.13 31.75 2f52 s GLU 66 CO 0.32 -0.44 1.01 0.00 0.02 0.00 0.00 175.26 176.18