#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 3.52 -0.06 4.03 1.02 -0.84 -4.94 118.68 121.42 2f52 s LEU 2 Ca 0.00 -0.57 0.01 0.00 0.02 0.00 0.00 54.13 53.59 2f52 s LEU 2 Cb 0.00 -2.12 0.02 0.00 0.02 0.00 0.00 46.19 44.11 2f52 s LEU 2 CO 0.00 -0.38 -0.07 -1.61 0.02 0.00 0.00 176.35 174.31 2f52 s GLU 3 N -3.99 1.14 0.14 1.70 2.02 -1.26 -1.62 118.70 116.84 2f52 s GLU 3 Ca 0.41 -0.20 0.07 0.00 0.02 0.00 0.00 54.97 55.28 2f52 s GLU 3 Cb -0.05 -1.10 -0.04 0.00 0.10 0.00 0.00 34.13 33.05 2f52 s GLU 3 CO 0.26 -0.09 -0.16 0.20 0.02 0.00 0.00 175.26 175.50 2f52 s GLY 4 N 1.00 1.22 -0.11 -1.39 0.00 -0.96 -4.43 107.32 102.66 2f52 s GLY 4 Ca -0.09 -1.40 -0.04 0.00 0.00 0.00 0.00 44.72 43.19 2f52 s GLY 4 CO -0.00 -1.45 0.06 0.54 0.00 0.00 0.00 173.10 172.24 2f52 s LYS 5 N -2.80 3.29 -0.28 2.90 1.02 -0.40 -2.21 119.74 121.27 2f52 s LYS 5 Ca 0.13 -0.30 -0.29 0.00 0.02 0.00 0.00 55.97 55.53 2f52 s LYS 5 Cb -0.05 -3.00 -0.01 0.00 -0.52 0.00 0.00 37.83 34.25 2f52 s LYS 5 CO 0.05 0.67 1.56 0.08 -0.92 0.00 0.00 175.35 176.78 2f52 s VAL 6 N -0.75 3.76 0.02 3.17 1.01 -0.99 0.13 120.40 126.76 2f52 s VAL 6 Ca 0.12 0.84 -0.17 0.00 0.00 0.00 0.00 61.98 62.77 2f52 s VAL 6 Cb -0.12 -3.85 -0.35 0.00 0.00 0.00 0.00 36.38 32.06 2f52 s VAL 6 CO 0.03 -0.42 0.98 0.50 0.00 0.00 0.00 175.10 176.18 2f52 h LYS 7 N 10.86 0.51 -2.67 2.72 3.64 -0.51 1.23 116.57 132.35 2f52 h LYS 7 Ca -0.31 -0.87 -0.05 0.00 -1.27 0.00 0.00 60.65 58.15 2f52 h LYS 7 Cb 1.14 0.32 -0.15 0.00 -0.41 0.00 0.00 32.23 33.13 2f52 h LYS 7 CO 1.03 1.42 0.13 -0.46 -2.27 0.00 0.00 179.45 179.29 2f52 s TRP 8 N -2.57 -0.52 -0.22 1.91 -0.00 -1.06 -4.68 118.94 111.80 2f52 s TRP 8 Ca -0.10 0.58 -0.19 0.00 -0.00 0.00 0.00 56.10 56.39 2f52 s TRP 8 Cb 0.04 0.43 0.06 0.00 -0.00 0.00 0.00 33.47 33.99 2f52 s TRP 8 CO 0.93 -0.70 0.58 -0.59 -0.00 0.00 0.00 176.95 177.17 2f52 s PHE 9 N -2.59 -0.69 -0.07 5.86 -0.71 -1.26 0.65 117.98 119.16 2f52 s PHE 9 Ca -0.04 1.61 0.02 0.00 -1.04 0.00 0.00 56.93 57.47 2f52 s PHE 9 Cb -0.01 0.27 0.01 0.00 -1.21 0.00 0.00 43.02 42.09 2f52 s PHE 9 CO -0.03 -0.34 -0.13 1.21 -1.34 0.00 0.00 175.22 174.60 2f52 s ASN 10 N 0.56 1.92 0.48 1.98 2.47 -1.03 -4.89 114.94 116.43 2f52 s ASN 10 Ca -0.02 -0.32 0.28 0.00 0.42 0.00 0.00 52.86 53.21 2f52 s ASN 10 Cb -0.05 -0.88 0.81 0.00 -1.45 0.00 0.00 41.25 39.69 2f52 s ASN 10 CO -0.03 0.03 1.78 0.28 -3.72 0.00 0.00 177.10 175.44 2f52 h SER 11 N 7.06 0.00 -0.46 -4.21 0.02 -1.94 0.91 113.55 114.93 2f52 h SER 11 Ca -0.30 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.57 2f52 h SER 11 Cb 1.19 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 2f52 h SER 11 CO 0.47 0.00 -0.01 -0.08 -1.14 0.00 0.00 176.83 176.08 2f52 h GLU 12 N 0.00 0.82 -0.01 3.45 4.81 -1.94 -2.78 114.58 118.93 2f52 h GLU 12 Ca 0.00 -0.26 -0.26 0.00 -0.13 0.00 0.00 59.36 58.71 2f52 h GLU 12 Cb 0.77 -0.07 0.02 0.00 0.63 0.00 0.00 28.75 30.09 2f52 h GLU 12 CO 0.00 0.88 -1.01 0.87 -0.73 0.00 0.00 179.01 179.02 2f52 h LYS 13 N 0.67 0.67 0.00 1.92 1.57 -1.92 -3.47 116.57 116.01 2f52 h LYS 13 Ca 0.13 -0.70 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2f52 h LYS 13 Cb 0.51 0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.02 2f52 h LYS 13 CO 0.02 1.29 0.00 0.41 -0.57 0.00 0.00 179.45 180.61 2f52 n GLY 14 N 1.03 0.72 3.23 3.86 0.00 0.29 -5.00 105.19 109.33 2f52 n GLY 14 Ca -0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.42 1.34 0.24 1.61 -0.71 -1.20 -2.68 117.98 114.15 2f52 s PHE 15 Ca 0.00 -1.47 0.01 0.00 -1.04 0.00 0.00 56.93 54.43 2f52 s PHE 15 Cb 0.00 -0.60 -0.04 0.00 -1.21 0.00 0.00 43.02 41.17 2f52 s PHE 15 CO 0.00 -0.72 0.18 0.20 -1.34 0.00 0.00 175.22 173.54 2f52 s GLY 16 N -3.23 1.64 -0.11 1.99 0.00 -0.78 -2.46 107.32 104.38 2f52 s GLY 16 Ca 0.39 -1.77 0.01 0.00 0.00 0.00 0.00 44.72 43.35 2f52 s GLY 16 CO 0.17 -1.40 -0.13 -1.36 0.00 0.00 0.00 173.10 170.38 2f52 s PHE 17 N -3.97 2.79 0.14 1.90 0.08 0.21 -0.88 117.98 118.25 2f52 s PHE 17 Ca 0.39 -0.49 0.09 0.00 0.12 0.00 0.00 56.93 57.04 2f52 s PHE 17 Cb 0.06 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.68 2f52 s PHE 17 CO 0.16 -0.09 -0.17 0.42 -0.10 0.00 0.00 175.22 175.44 2f52 s ILE 18 N 0.04 2.88 -0.23 0.64 1.01 -0.43 0.25 121.20 125.35 2f52 s ILE 18 Ca -0.04 -1.60 -0.01 0.00 0.00 0.00 0.00 60.65 58.99 2f52 s ILE 18 Cb -0.14 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 39.99 2f52 s ILE 18 CO 0.04 0.03 -0.08 -0.70 0.00 0.00 0.00 174.94 174.22 2f52 s GLU 19 N -2.37 2.96 -0.27 2.79 2.12 0.35 -1.32 118.70 122.96 2f52 s GLU 19 Ca 0.20 -0.89 -0.16 0.00 0.36 0.00 0.00 54.97 54.48 2f52 s GLU 19 Cb -0.10 -2.91 -0.03 0.00 0.26 0.00 0.00 34.13 31.35 2f52 s GLU 19 CO 0.11 -0.33 0.43 0.08 -0.54 0.00 0.00 175.26 175.02 2f52 s VAL 20 N 1.34 5.13 -0.33 3.70 1.01 -1.26 -1.27 120.40 128.73 2f52 s VAL 20 Ca 0.02 0.69 -0.29 0.00 0.00 0.00 0.00 61.98 62.40 2f52 s VAL 20 Cb -0.16 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 2f52 s VAL 20 CO -0.06 0.12 1.72 -1.61 0.00 0.00 0.00 175.10 175.27 2f52 s GLU 21 N 2.18 3.44 0.00 2.72 2.02 -1.26 -2.49 118.70 125.30 2f52 s GLU 21 Ca 0.18 1.39 0.00 0.00 0.02 0.00 0.00 54.97 56.56 2f52 s GLU 21 Cb -0.16 -4.15 0.00 0.00 0.10 0.00 0.00 34.13 29.92 2f52 s GLU 21 CO 0.10 -1.74 0.00 0.41 0.02 0.00 0.00 175.26 174.05 2f52 n GLY 22 N 5.28 2.93 3.56 -1.39 0.00 -1.26 -5.08 105.19 109.23 2f52 n GLY 22 Ca 0.21 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 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 1.84 0.77 1.61 -0.21 -1.04 -5.13 119.66 117.50 2f52 s GLN 23 Ca 0.00 -1.97 -0.11 0.00 0.02 0.00 0.00 55.36 53.30 2f52 s GLN 23 Cb 0.00 -1.64 0.17 0.00 1.00 0.00 0.00 33.01 32.53 2f52 s GLN 23 CO 0.00 0.08 0.38 -0.25 -2.12 0.00 0.00 175.29 173.38 2f52 n ASP 24 N -0.82 -2.73 -4.77 5.90 8.00 -1.26 -4.41 116.55 116.46 2f52 n ASP 24 Ca -0.05 -0.38 -0.39 0.00 0.71 0.00 0.00 54.79 54.68 2f52 n ASP 24 Cb 0.64 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.12 41.14 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 -2.10 7.08 -0.22 -2.24 1.01 -1.26 -4.07 116.67 114.86 2f52 s ASP 25 Ca 0.29 2.21 -0.02 0.00 0.71 0.00 0.00 52.55 55.74 2f52 s ASP 25 Cb -0.05 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.28 2f52 s ASP 25 CO 0.24 -0.28 -0.08 -0.69 0.21 0.00 0.00 175.17 174.57 2f52 s VAL 26 N -1.32 2.87 0.69 -1.27 1.01 -0.43 -4.57 120.40 117.39 2f52 s VAL 26 Ca 0.49 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 2f52 s VAL 26 Cb -0.29 -2.36 0.01 0.00 0.00 0.00 0.00 36.38 33.74 2f52 s VAL 26 CO 0.37 0.35 1.06 0.12 0.00 0.00 0.00 175.10 177.01 2f52 s PHE 27 N 1.37 3.22 -0.03 5.22 5.36 -0.85 -1.31 117.98 130.96 2f52 s PHE 27 Ca 0.03 1.31 0.02 0.00 -0.96 0.00 0.00 56.93 57.33 2f52 s PHE 27 Cb -0.15 -2.89 0.01 0.00 -0.34 0.00 0.00 43.02 39.65 2f52 s PHE 27 CO -0.06 -1.17 -0.07 0.08 -1.46 0.00 0.00 175.22 172.55 2f52 s VAL 28 N -3.12 0.62 0.10 3.12 1.01 -0.06 0.32 120.40 122.38 2f52 s VAL 28 Ca 0.58 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.35 2f52 s VAL 28 Cb -0.13 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 2f52 s VAL 28 CO 0.54 0.21 0.12 -2.28 0.00 0.00 0.00 175.10 173.69 2f52 s HIS 29 N 0.42 3.23 0.19 5.22 2.46 -1.26 -1.86 115.29 123.69 2f52 s HIS 29 Ca -0.06 0.08 -0.20 0.00 0.47 0.00 0.00 55.06 55.35 2f52 s HIS 29 Cb -0.10 -1.61 0.15 0.00 -0.13 0.00 0.00 32.58 30.88 2f52 s HIS 29 CO 0.00 0.53 1.58 0.27 -2.47 0.00 0.00 174.74 174.65 2f52 h PHE 30 N 3.02 -0.93 0.00 3.88 -5.15 -1.87 1.53 116.94 117.43 2f52 h PHE 30 Ca -0.47 0.08 0.00 0.00 -0.20 0.00 0.00 57.97 57.38 2f52 h PHE 30 Cb 1.17 0.51 0.00 0.00 0.22 0.00 0.00 35.95 37.85 2f52 h PHE 30 CO 0.60 -0.38 0.00 0.66 -2.00 0.00 0.00 178.31 177.18 2f52 h SER 31 N -0.13 0.00 0.57 -0.68 4.64 -1.95 -0.27 113.55 115.73 2f52 h SER 31 Ca 0.25 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.54 2f52 h SER 31 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2f52 h SER 31 CO -0.73 0.00 -0.17 0.00 -0.87 0.00 0.00 176.83 175.07 2f52 h ALA 32 N 2.00 1.18 -3.36 5.18 0.00 0.19 -3.41 119.26 121.04 2f52 h ALA 32 Ca 0.00 -0.15 -0.65 0.00 0.00 0.00 0.00 54.91 54.11 2f52 h ALA 32 Cb 0.02 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 17.57 2f52 h ALA 32 CO 0.00 0.21 -0.67 0.42 0.00 0.00 0.00 179.25 179.21 2f52 s ILE 33 N -3.98 3.90 0.18 0.00 1.09 -0.11 0.17 121.20 122.44 2f52 s ILE 33 Ca -0.02 -0.37 -0.21 0.00 -1.10 0.00 0.00 60.65 58.96 2f52 s ILE 33 Cb 0.12 -2.68 0.10 0.00 -1.06 0.00 0.00 42.46 38.94 2f52 s ILE 33 CO 0.61 0.52 1.60 -0.61 -0.10 0.00 0.00 174.94 176.96 2f52 h GLN 34 N 6.31 -0.18 -4.52 2.79 4.15 -1.80 -3.45 115.11 118.41 2f52 h GLN 34 Ca -0.36 0.01 -0.37 0.00 0.77 0.00 0.00 58.65 58.70 2f52 h GLN 34 Cb 1.19 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.92 2f52 h GLN 34 CO 0.60 -0.12 -0.54 0.41 -1.93 0.00 0.00 178.83 177.25 2f52 n GLY 35 N -1.42 -0.51 0.44 2.39 0.00 -1.26 -4.76 105.19 100.07 2f52 n GLY 35 Ca 0.03 0.08 0.21 0.00 0.00 0.00 0.00 46.02 46.34 2f52 n GLY 35 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2f52 h GLU 36 N -0.89 0.00 0.00 1.61 4.81 -2.00 -2.85 114.58 115.25 2f52 h GLU 36 Ca -0.46 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.69 2f52 h GLU 36 Cb 1.32 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.62 2f52 h GLU 36 CO 0.53 0.00 -0.18 0.41 -0.73 0.00 0.00 179.01 179.03 2f52 n GLY 37 N -1.55 0.54 2.38 1.92 0.00 -1.26 -4.97 105.19 102.25 2f52 n GLY 37 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.19 0.31 1.61 1.16 -1.08 -4.97 117.46 113.31 2f52 n PHE 38 Ca -0.17 -1.06 0.18 0.00 -1.87 0.00 0.00 57.45 54.52 2f52 n PHE 38 Cb 0.59 1.22 0.92 0.00 -1.61 0.00 0.00 39.48 40.60 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 1.01 0.00 -5.88 3.97 1.57 -1.87 -3.39 116.57 111.98 2f52 h LYS 39 Ca -0.34 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 57.96 2f52 h LYS 39 Cb 1.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 2f52 h LYS 39 CO -0.12 0.00 1.40 0.99 -0.57 0.00 0.00 179.45 181.14 2f52 s THR 40 N -4.19 3.27 0.82 -0.16 2.01 -1.26 -4.92 115.64 111.22 2f52 s THR 40 Ca -0.04 0.14 -0.12 0.00 0.31 0.00 0.00 61.69 61.98 2f52 s THR 40 Cb 0.11 -3.72 0.09 0.00 0.01 0.00 0.00 72.50 68.99 2f52 s THR 40 CO 0.35 -0.70 1.16 -0.76 -0.69 0.00 0.00 174.62 173.98 2f52 s LEU 41 N 9.88 3.05 -0.03 4.42 1.02 -1.26 -5.02 118.68 130.74 2f52 s LEU 41 Ca 0.74 2.20 0.07 0.00 0.02 0.00 0.00 54.13 57.16 2f52 s LEU 41 Cb -0.13 -4.57 -0.02 0.00 0.02 0.00 0.00 46.19 41.49 2f52 s LEU 41 CO 0.21 -2.63 -0.25 -0.70 0.02 0.00 0.00 176.35 173.00 2f52 s GLU 42 N -4.41 2.22 0.12 1.70 2.12 -1.26 -4.89 118.70 114.30 2f52 s GLU 42 Ca 0.69 -0.91 -0.31 0.00 0.36 0.00 0.00 54.97 54.79 2f52 s GLU 42 Cb -0.24 -2.05 -0.08 0.00 0.26 0.00 0.00 34.13 32.01 2f52 s GLU 42 CO 0.53 0.50 1.45 -2.00 -0.54 0.00 0.00 175.26 175.19 2f52 s GLU 43 N -0.46 4.29 0.00 4.30 2.12 -1.26 -1.81 118.70 125.87 2f52 s GLU 43 Ca 0.06 2.16 0.00 0.00 0.36 0.00 0.00 54.97 57.55 2f52 s GLU 43 Cb -0.11 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 31.04 2f52 s GLU 43 CO 0.00 -0.50 0.00 0.41 -0.54 0.00 0.00 175.26 174.64 2f52 n GLY 44 N 3.59 1.13 3.69 -1.50 0.00 0.42 -4.94 105.19 107.58 2f52 n GLY 44 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 4.42 0.29 1.61 0.74 -0.75 -4.64 119.66 120.80 2f52 s GLN 45 Ca 0.00 1.30 -0.28 0.00 0.05 0.00 0.00 55.36 56.44 2f52 s GLN 45 Cb 0.00 -3.53 -0.09 0.00 1.10 0.00 0.00 33.01 30.49 2f52 s GLN 45 CO 0.00 -0.25 0.96 0.00 -0.55 0.00 0.00 175.29 175.45 2f52 s ALA 46 N 1.81 3.27 0.20 1.58 0.00 -1.26 -2.34 121.76 125.01 2f52 s ALA 46 Ca 0.47 0.60 -0.05 0.00 0.00 0.00 0.00 51.96 52.98 2f52 s ALA 46 Cb -0.18 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2f52 s ALA 46 CO 0.19 0.13 0.23 0.14 0.00 0.00 0.00 175.76 176.44 2f52 s VAL 47 N -1.42 0.02 0.19 0.00 -7.23 -0.94 0.03 120.40 111.06 2f52 s VAL 47 Ca 0.47 -1.75 0.09 0.00 -1.81 0.00 0.00 61.98 58.97 2f52 s VAL 47 Cb -0.23 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 2f52 s VAL 47 CO 0.29 -0.11 -0.09 -0.55 -0.31 0.00 0.00 175.10 174.33 2f52 s SER 48 N -3.08 4.25 0.00 4.85 0.15 0.18 -2.26 113.70 117.79 2f52 s SER 48 Ca 0.30 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.34 2f52 s SER 48 Cb 0.05 -0.71 0.00 0.00 -1.71 0.00 0.00 66.02 63.64 2f52 s SER 48 CO 0.08 0.09 0.00 2.22 1.20 0.00 0.00 173.24 176.83 2f52 n PHE 49 N -0.09 0.00 -3.94 3.44 1.16 -0.64 0.62 117.46 118.02 2f52 n PHE 49 Ca -0.10 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.17 2f52 n PHE 49 Cb 0.56 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.39 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 3.38 -0.19 3.97 2.02 -0.91 -1.98 118.70 122.98 2f52 s GLU 50 Ca 0.00 -0.48 -0.23 0.00 0.02 0.00 0.00 54.97 54.28 2f52 s GLU 50 Cb 0.00 -3.00 -0.02 0.00 0.10 0.00 0.00 34.13 31.21 2f52 s GLU 50 CO 0.00 0.60 0.72 0.42 0.02 0.00 0.00 175.26 177.02 2f52 s ILE 51 N -1.51 4.95 -0.24 -1.63 1.01 -1.26 -1.64 121.20 120.88 2f52 s ILE 51 Ca 0.34 1.38 -0.07 0.00 0.00 0.00 0.00 60.65 62.30 2f52 s ILE 51 Cb -0.13 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.29 2f52 s ILE 51 CO 0.27 0.06 0.05 0.68 0.00 0.00 0.00 174.94 176.00 2f52 s VAL 52 N 2.10 4.17 -1.08 2.92 -7.23 -0.92 -4.91 120.40 115.46 2f52 s VAL 52 Ca 0.32 -0.22 -0.17 0.00 -1.81 0.00 0.00 61.98 60.11 2f52 s VAL 52 Cb -0.16 -2.94 0.14 0.00 0.56 0.00 0.00 36.38 33.98 2f52 s VAL 52 CO 0.11 0.36 1.32 -1.61 -0.31 0.00 0.00 175.10 174.97 2f52 s GLU 53 N 1.49 3.83 0.54 4.82 2.02 -1.26 -1.52 118.70 128.62 2f52 s GLU 53 Ca 0.06 -2.09 -0.01 0.00 0.02 0.00 0.00 54.97 52.95 2f52 s GLU 53 Cb -0.15 -5.05 0.11 0.00 0.10 0.00 0.00 34.13 29.15 2f52 s GLU 53 CO 0.03 -1.83 0.75 0.41 0.02 0.00 0.00 175.26 174.63 2f52 n GLY 54 N 4.98 0.51 0.35 -1.39 0.00 -0.21 -4.90 105.19 104.52 2f52 n GLY 54 Ca 0.32 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.50 -0.91 -0.93 1.61 -1.07 -2.03 -1.59 115.58 110.16 2f52 h ASN 55 Ca -0.25 0.09 0.15 0.00 0.07 0.00 0.00 56.30 56.37 2f52 h ASN 55 Cb 0.88 0.33 -0.10 0.00 -2.07 0.00 0.00 38.32 37.37 2f52 h ASN 55 CO 0.25 -0.44 0.53 0.03 0.07 0.00 0.00 177.43 177.88 2f52 h ARG 56 N -0.62 0.72 0.00 4.14 3.08 -1.98 -3.48 114.38 116.24 2f52 h ARG 56 Ca 0.01 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2f52 h ARG 56 Cb 0.60 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2f52 h ARG 56 CO -0.13 0.48 0.00 0.41 -1.07 0.00 0.00 179.97 179.66 2f52 n GLY 57 N -1.33 0.36 3.71 0.04 0.00 -0.60 -5.09 105.19 102.28 2f52 n GLY 57 Ca 0.19 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 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 4.33 0.21 1.61 0.04 -1.26 -1.04 135.00 136.90 2f52 s PRO 58 Ca 0.00 2.00 0.04 0.00 0.04 0.00 0.00 61.00 63.08 2f52 s PRO 58 Cb 0.00 -3.32 -0.05 0.00 0.04 0.00 0.00 34.50 31.17 2f52 s PRO 58 CO 0.00 -0.43 -0.03 -0.65 0.04 0.00 0.00 177.00 175.94 2f52 s GLN 59 N 1.30 1.28 -0.15 4.56 -0.21 -0.58 -2.02 119.66 123.85 2f52 s GLN 59 Ca 0.63 -1.63 -0.19 0.00 0.02 0.00 0.00 55.36 54.19 2f52 s GLN 59 Cb -0.35 -0.64 -0.03 0.00 1.00 0.00 0.00 33.01 32.99 2f52 s GLN 59 CO 0.29 -0.05 0.55 0.00 -2.12 0.00 0.00 175.29 173.96 2f52 s ALA 60 N -3.38 3.49 0.06 6.09 0.00 0.94 -2.16 121.76 126.80 2f52 s ALA 60 Ca 0.26 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.04 2f52 s ALA 60 Cb 0.05 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 2f52 s ALA 60 CO 0.07 -0.25 -0.03 0.00 0.00 0.00 0.00 175.76 175.55 2f52 s ALA 61 N 1.19 3.17 -0.63 0.00 0.00 -0.65 -4.57 121.76 120.26 2f52 s ALA 61 Ca 0.28 -1.09 -0.14 0.00 0.00 0.00 0.00 51.96 51.01 2f52 s ALA 61 Cb -0.16 -1.15 0.02 0.00 0.00 0.00 0.00 23.12 21.83 2f52 s ALA 61 CO 0.11 0.66 0.57 -1.71 0.00 0.00 0.00 175.76 175.39 2f52 n ASN 62 N 0.97 -4.57 -4.71 0.00 5.15 -1.24 -2.14 115.26 108.71 2f52 n ASN 62 Ca -0.13 -0.62 -0.40 0.00 -0.60 0.00 0.00 54.58 52.83 2f52 n ASN 62 Cb 0.52 -1.44 -0.04 0.00 -0.53 0.00 0.00 39.78 38.29 2f52 n ASN 62 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2f52 s VAL 63 N -2.31 4.99 -0.19 3.44 1.01 0.45 -3.85 120.40 123.94 2f52 s VAL 63 Ca 0.13 1.61 -0.01 0.00 0.00 0.00 0.00 61.98 63.71 2f52 s VAL 63 Cb -0.01 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.25 2f52 s VAL 63 CO 0.81 0.22 -0.11 -0.89 0.00 0.00 0.00 175.10 175.12 2f52 s THR 64 N 0.93 2.83 -0.28 3.92 2.01 0.20 -3.70 115.64 121.55 2f52 s THR 64 Ca 0.41 -0.69 -0.29 0.00 0.31 0.00 0.00 61.69 61.44 2f52 s THR 64 Cb -0.18 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 2f52 s THR 64 CO 0.20 0.48 1.39 -0.54 -0.69 0.00 0.00 174.62 175.46 2f52 s LYS 65 N 1.26 3.87 0.40 4.92 1.02 -1.26 0.50 119.74 130.45 2f52 s LYS 65 Ca 0.03 1.35 0.06 0.00 0.02 0.00 0.00 55.97 57.43 2f52 s LYS 65 Cb -0.14 -3.93 0.00 0.00 -0.52 0.00 0.00 37.83 33.25 2f52 s LYS 65 CO -0.05 -1.18 0.56 -1.21 -0.92 0.00 0.00 175.35 172.54 2f52 s GLU 66 N 4.33 2.92 0.00 1.68 2.02 0.10 -4.95 118.70 124.81 2f52 s GLU 66 Ca 0.61 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 54.52 2f52 s GLU 66 Cb -0.19 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.30 2f52 s GLU 66 CO 0.25 -0.20 0.00 0.00 0.02 0.00 0.00 175.26 175.33