#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 2.93 -0.01 4.03 1.02 -0.73 -4.99 118.68 120.93 2f52 s LEU 2 Ca 0.00 -0.86 0.05 0.00 0.02 0.00 0.00 54.13 53.34 2f52 s LEU 2 Cb 0.00 -1.41 -0.01 0.00 0.02 0.00 0.00 46.19 44.78 2f52 s LEU 2 CO 0.00 -0.03 -0.16 -0.70 0.02 0.00 0.00 176.35 175.48 2f52 s GLU 3 N -3.62 1.29 0.04 1.70 2.12 -1.26 -1.49 118.70 117.48 2f52 s GLU 3 Ca 0.32 -0.59 -0.02 0.00 0.36 0.00 0.00 54.97 55.04 2f52 s GLU 3 Cb -0.05 -1.25 -0.03 0.00 0.26 0.00 0.00 34.13 33.06 2f52 s GLU 3 CO 0.18 0.34 0.00 0.20 -0.54 0.00 0.00 175.26 175.45 2f52 s GLY 4 N -0.41 0.31 -0.09 -1.50 0.00 -0.86 -4.02 107.32 100.74 2f52 s GLY 4 Ca 0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 44.72 43.95 2f52 s GLY 4 CO -0.01 -0.93 -0.04 0.54 0.00 0.00 0.00 173.10 172.67 2f52 s LYS 5 N -2.73 3.03 -0.29 2.90 1.02 0.33 -1.55 119.74 122.45 2f52 s LYS 5 Ca -0.04 -0.49 -0.29 0.00 0.02 0.00 0.00 55.97 55.17 2f52 s LYS 5 Cb -0.01 -2.73 -0.02 0.00 -0.52 0.00 0.00 37.83 34.56 2f52 s LYS 5 CO -0.06 0.59 1.63 0.08 -0.92 0.00 0.00 175.35 176.68 2f52 s VAL 6 N -0.59 3.67 0.03 3.17 1.01 -0.37 0.12 120.40 127.45 2f52 s VAL 6 Ca 0.09 0.72 -0.16 0.00 0.00 0.00 0.00 61.98 62.63 2f52 s VAL 6 Cb -0.12 -3.78 -0.31 0.00 0.00 0.00 0.00 36.38 32.18 2f52 s VAL 6 CO 0.02 -0.41 1.05 0.50 0.00 0.00 0.00 175.10 176.26 2f52 h LYS 7 N 11.36 0.56 -2.46 2.72 3.64 -0.51 1.34 116.57 133.21 2f52 h LYS 7 Ca -0.32 -0.80 -0.01 0.00 -1.27 0.00 0.00 60.65 58.24 2f52 h LYS 7 Cb 1.15 0.27 -0.16 0.00 -0.41 0.00 0.00 32.23 33.09 2f52 h LYS 7 CO 1.02 1.37 0.26 -0.46 -2.27 0.00 0.00 179.45 179.37 2f52 s TRP 8 N -2.83 -0.55 -0.19 1.91 -0.00 -1.05 -4.57 118.94 111.66 2f52 s TRP 8 Ca -0.10 0.62 -0.18 0.00 -0.00 0.00 0.00 56.10 56.44 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 0.92 -0.70 0.51 -0.59 -0.00 0.00 0.00 176.95 177.10 2f52 s PHE 9 N -2.59 -0.57 -0.22 5.86 -0.71 -1.26 0.48 117.98 118.97 2f52 s PHE 9 Ca -0.03 1.39 -0.02 0.00 -1.04 0.00 0.00 56.93 57.22 2f52 s PHE 9 Cb -0.01 0.20 0.01 0.00 -1.21 0.00 0.00 43.02 42.01 2f52 s PHE 9 CO -0.03 -0.27 -0.08 1.21 -1.34 0.00 0.00 175.22 174.71 2f52 s ASN 10 N 0.30 4.10 0.44 1.98 3.04 -1.02 -4.89 114.94 118.89 2f52 s ASN 10 Ca -0.00 -0.61 0.30 0.00 0.04 0.00 0.00 52.86 52.59 2f52 s ASN 10 Cb -0.04 -1.67 1.52 0.00 -1.54 0.00 0.00 41.25 39.52 2f52 s ASN 10 CO 0.00 -0.06 1.92 0.77 -3.04 0.00 0.00 177.10 176.70 2f52 h SER 11 N 8.05 0.00 0.21 -4.21 4.64 -1.94 -1.97 113.55 118.33 2f52 h SER 11 Ca -0.39 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.58 2f52 h SER 11 Cb 1.14 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2f52 h SER 11 CO 0.60 0.00 -1.75 -0.08 -0.87 0.00 0.00 176.83 174.73 2f52 h GLU 12 N 0.00 0.38 -0.43 4.77 4.81 -1.94 -3.35 114.58 118.83 2f52 h GLU 12 Ca 0.00 -0.64 -0.08 0.00 -0.13 0.00 0.00 59.36 58.51 2f52 h GLU 12 Cb 0.16 0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2f52 h GLU 12 CO 0.00 1.30 -0.03 0.87 -0.73 0.00 0.00 179.01 180.41 2f52 h LYS 13 N 0.10 0.78 0.00 1.92 1.57 -1.82 -3.47 116.57 115.66 2f52 h LYS 13 Ca -0.34 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.17 2f52 h LYS 13 Cb 2.09 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.34 2f52 h LYS 13 CO 0.17 0.87 0.00 0.41 -0.57 0.00 0.00 179.45 180.33 2f52 n GLY 14 N -0.31 0.63 3.43 3.86 0.00 -0.80 -5.03 105.19 106.97 2f52 n GLY 14 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.00 1.33 0.28 1.61 -0.71 -1.25 -2.50 117.98 114.75 2f52 s PHE 15 Ca 0.00 -1.45 -0.07 0.00 -1.04 0.00 0.00 56.93 54.38 2f52 s PHE 15 Cb 0.00 -0.29 -0.01 0.00 -1.21 0.00 0.00 43.02 41.52 2f52 s PHE 15 CO 0.00 -1.08 0.43 0.20 -1.34 0.00 0.00 175.22 173.43 2f52 s GLY 16 N -3.30 1.08 -0.12 1.99 0.00 -0.69 -2.44 107.32 103.85 2f52 s GLY 16 Ca 0.34 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.78 2f52 s GLY 16 CO 0.24 -0.90 -0.12 -1.36 0.00 0.00 0.00 173.10 170.96 2f52 s PHE 17 N -3.59 2.83 0.12 1.90 0.08 0.18 -1.01 117.98 118.49 2f52 s PHE 17 Ca 0.28 -0.48 0.10 0.00 0.12 0.00 0.00 56.93 56.96 2f52 s PHE 17 Cb 0.00 -1.81 -0.04 0.00 -0.57 0.00 0.00 43.02 40.60 2f52 s PHE 17 CO 0.14 -0.09 -0.25 0.42 -0.10 0.00 0.00 175.22 175.35 2f52 s ILE 18 N 0.09 2.40 -0.20 0.64 1.01 -0.34 0.25 121.20 125.05 2f52 s ILE 18 Ca -0.05 -1.66 -0.03 0.00 0.00 0.00 0.00 60.65 58.90 2f52 s ILE 18 Cb -0.14 -2.06 -0.01 0.00 0.01 0.00 0.00 42.46 40.25 2f52 s ILE 18 CO 0.04 0.12 -0.06 -0.70 0.00 0.00 0.00 174.94 174.34 2f52 s GLU 19 N -2.01 3.40 -0.19 2.79 2.12 0.33 -0.84 118.70 124.30 2f52 s GLU 19 Ca 0.15 -0.63 -0.19 0.00 0.36 0.00 0.00 54.97 54.66 2f52 s GLU 19 Cb -0.10 -2.95 -0.03 0.00 0.26 0.00 0.00 34.13 31.31 2f52 s GLU 19 CO 0.07 -0.11 0.53 0.08 -0.54 0.00 0.00 175.26 175.29 2f52 s VAL 20 N 1.23 5.10 -0.52 3.70 1.01 -1.25 -0.51 120.40 129.17 2f52 s VAL 20 Ca 0.03 0.99 -0.27 0.00 0.00 0.00 0.00 61.98 62.72 2f52 s VAL 20 Cb -0.14 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2f52 s VAL 20 CO -0.02 0.19 1.77 -1.61 0.00 0.00 0.00 175.10 175.43 2f52 s GLU 21 N 1.53 2.95 0.00 2.72 2.02 -1.26 -1.95 118.70 124.71 2f52 s GLU 21 Ca 0.25 0.82 0.00 0.00 0.02 0.00 0.00 54.97 56.06 2f52 s GLU 21 Cb -0.15 -4.29 0.00 0.00 0.10 0.00 0.00 34.13 29.79 2f52 s GLU 21 CO 0.10 -2.34 0.00 0.41 0.02 0.00 0.00 175.26 173.45 2f52 n GLY 22 N 5.54 2.11 3.32 -1.39 0.00 -1.26 -5.03 105.19 108.48 2f52 n GLY 22 Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 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 1.27 0.79 1.61 -0.21 -0.82 -5.14 119.66 117.15 2f52 s GLN 23 Ca 0.00 -1.60 -0.12 0.00 0.02 0.00 0.00 55.36 53.67 2f52 s GLN 23 Cb 0.00 -0.77 0.18 0.00 1.00 0.00 0.00 33.01 33.42 2f52 s GLN 23 CO 0.00 0.03 0.41 -0.25 -2.12 0.00 0.00 175.29 173.36 2f52 n ASP 24 N -0.36 -2.85 -4.74 5.90 8.00 -1.26 -4.24 116.55 117.00 2f52 n ASP 24 Ca -0.07 -0.41 -0.41 0.00 0.71 0.00 0.00 54.79 54.60 2f52 n ASP 24 Cb 0.62 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 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 -2.24 7.15 -0.20 -2.24 1.47 -1.26 -3.86 116.67 115.49 2f52 s ASP 25 Ca 0.32 2.23 -0.03 0.00 1.18 0.00 0.00 52.55 56.25 2f52 s ASP 25 Cb -0.06 -2.61 -0.01 0.00 -0.34 0.00 0.00 42.92 39.91 2f52 s ASP 25 CO 0.27 -0.30 -0.07 -0.69 0.68 0.00 0.00 175.17 175.05 2f52 s VAL 26 N -0.34 3.20 0.59 2.11 1.01 -0.02 -4.57 120.40 122.39 2f52 s VAL 26 Ca 0.50 -0.56 -0.14 0.00 0.00 0.00 0.00 61.98 61.78 2f52 s VAL 26 Cb -0.32 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 2f52 s VAL 26 CO 0.38 0.46 1.03 0.12 0.00 0.00 0.00 175.10 177.08 2f52 s PHE 27 N 1.20 3.37 -0.05 5.22 5.36 -1.07 -1.20 117.98 130.82 2f52 s PHE 27 Ca 0.02 1.41 0.02 0.00 -0.96 0.00 0.00 56.93 57.42 2f52 s PHE 27 Cb -0.14 -2.82 0.02 0.00 -0.34 0.00 0.00 43.02 39.73 2f52 s PHE 27 CO -0.02 -0.75 -0.08 0.08 -1.46 0.00 0.00 175.22 172.98 2f52 s VAL 28 N -2.85 0.76 0.16 3.12 1.01 -0.18 0.06 120.40 122.49 2f52 s VAL 28 Ca 0.58 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.33 2f52 s VAL 28 Cb -0.12 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 2f52 s VAL 28 CO 0.44 0.27 0.13 -2.28 0.00 0.00 0.00 175.10 173.65 2f52 s HIS 29 N 0.67 3.14 0.19 5.22 2.46 -1.26 -1.70 115.29 124.01 2f52 s HIS 29 Ca -0.11 -0.02 -0.20 0.00 0.47 0.00 0.00 55.06 55.21 2f52 s HIS 29 Cb -0.14 -1.51 0.13 0.00 -0.13 0.00 0.00 32.58 30.93 2f52 s HIS 29 CO 0.01 0.52 1.59 0.27 -2.47 0.00 0.00 174.74 174.67 2f52 h PHE 30 N 2.47 -0.82 -0.18 3.88 -5.15 -1.80 1.08 116.94 116.43 2f52 h PHE 30 Ca -0.48 0.07 0.05 0.00 -0.20 0.00 0.00 57.97 57.41 2f52 h PHE 30 Cb 1.20 0.44 -0.01 0.00 0.22 0.00 0.00 35.95 37.80 2f52 h PHE 30 CO 0.58 -0.36 0.24 0.66 -2.00 0.00 0.00 178.31 177.43 2f52 h SER 31 N -0.15 0.00 0.63 -0.68 4.64 -1.92 0.23 113.55 116.29 2f52 h SER 31 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2f52 h SER 31 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2f52 h SER 31 CO -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.31 2f52 h ALA 32 N 1.68 1.00 -3.40 5.18 0.00 0.92 -3.41 119.26 121.23 2f52 h ALA 32 Ca 0.08 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.34 2f52 h ALA 32 Cb 0.56 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.13 2f52 h ALA 32 CO -0.00 0.00 -0.70 0.42 0.00 0.00 0.00 179.25 178.97 2f52 s ILE 33 N -3.85 3.60 0.04 0.00 1.09 0.80 0.15 121.20 123.02 2f52 s ILE 33 Ca -0.01 -0.48 0.04 0.00 -1.10 0.00 0.00 60.65 59.10 2f52 s ILE 33 Cb 0.10 -2.54 -0.04 0.00 -1.06 0.00 0.00 42.46 38.93 2f52 s ILE 33 CO 0.49 0.53 -0.06 -1.10 -0.10 0.00 0.00 174.94 174.70 2f52 s GLN 34 N 0.08 2.49 0.00 2.79 -0.21 -1.25 -4.64 119.66 118.92 2f52 s GLN 34 Ca -0.02 -0.79 0.00 0.00 0.02 0.00 0.00 55.36 54.57 2f52 s GLN 34 Cb -0.14 -2.48 0.00 0.00 1.00 0.00 0.00 33.01 31.39 2f52 s GLN 34 CO 0.03 0.58 0.00 0.41 -2.12 0.00 0.00 175.29 174.19 2f52 n GLY 35 N 1.23 -1.49 0.19 3.09 0.00 -1.26 -4.83 105.19 102.12 2f52 n GLY 35 Ca -0.14 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 2f52 n GLY 35 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2f52 h GLU 36 N 0.00 0.53 0.00 1.61 5.08 -2.04 -3.43 114.58 116.33 2f52 h GLU 36 Ca 0.00 -0.43 -0.03 0.00 -1.00 0.00 0.00 59.36 57.90 2f52 h GLU 36 Cb 0.00 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2f52 h GLU 36 CO 0.00 1.06 -0.06 0.41 -1.00 0.00 0.00 179.01 179.42 2f52 n GLY 37 N 0.58 -0.30 0.62 -3.84 0.00 -1.26 -4.99 105.19 96.01 2f52 n GLY 37 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.27 1.61 1.16 -1.26 -4.78 117.46 113.93 2f52 n PHE 38 Ca -0.06 -1.28 0.27 0.00 -1.87 0.00 0.00 57.45 54.51 2f52 n PHE 38 Cb 0.34 -0.22 0.63 0.00 -1.61 0.00 0.00 39.48 38.62 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 0.82 0.18 -6.83 3.97 1.57 -1.88 -3.40 116.57 111.00 2f52 h LYS 39 Ca -0.03 -0.01 -0.53 0.00 -1.87 0.00 0.00 60.65 58.21 2f52 h LYS 39 Cb 1.11 -0.04 0.08 0.00 0.08 0.00 0.00 32.23 33.46 2f52 h LYS 39 CO 0.01 0.12 0.81 0.99 -0.57 0.00 0.00 179.45 180.82 2f52 s THR 40 N -5.20 2.23 0.57 -0.16 2.01 -1.26 -4.60 115.64 109.23 2f52 s THR 40 Ca -0.07 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.15 2f52 s THR 40 Cb 0.23 -3.13 0.04 0.00 0.01 0.00 0.00 72.50 69.65 2f52 s THR 40 CO 0.79 0.04 0.81 -0.76 -0.69 0.00 0.00 174.62 174.80 2f52 s LEU 41 N -0.99 3.22 0.10 4.42 1.02 -1.26 -5.11 118.68 120.09 2f52 s LEU 41 Ca 0.59 -0.05 0.09 0.00 0.02 0.00 0.00 54.13 54.77 2f52 s LEU 41 Cb -0.46 -2.76 -0.04 0.00 0.02 0.00 0.00 46.19 42.95 2f52 s LEU 41 CO 0.51 -1.24 -0.18 -0.70 0.02 0.00 0.00 176.35 174.77 2f52 s GLU 42 N -4.82 1.84 -0.02 1.70 2.12 -1.26 -4.86 118.70 113.40 2f52 s GLU 42 Ca 0.58 -1.14 -0.30 0.00 0.36 0.00 0.00 54.97 54.47 2f52 s GLU 42 Cb -0.10 -2.13 -0.05 0.00 0.26 0.00 0.00 34.13 32.11 2f52 s GLU 42 CO 0.39 0.49 1.40 -2.00 -0.54 0.00 0.00 175.26 175.00 2f52 s GLU 43 N -2.04 4.28 0.00 4.30 2.12 -1.26 -2.18 118.70 123.91 2f52 s GLU 43 Ca 0.18 1.94 0.00 0.00 0.36 0.00 0.00 54.97 57.45 2f52 s GLU 43 Cb -0.11 -3.61 0.00 0.00 0.26 0.00 0.00 34.13 30.67 2f52 s GLU 43 CO 0.10 -0.60 0.00 0.41 -0.54 0.00 0.00 175.26 174.63 2f52 n GLY 44 N 3.66 1.04 3.73 -1.50 0.00 0.46 -4.97 105.19 107.61 2f52 n GLY 44 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.60 4.58 0.25 1.61 2.00 -0.93 -4.66 119.66 121.92 2f52 s GLN 45 Ca 0.00 1.28 -0.21 0.00 -2.00 0.00 0.00 55.36 54.43 2f52 s GLN 45 Cb 0.00 -3.40 -0.09 0.00 0.80 0.00 0.00 33.01 30.33 2f52 s GLN 45 CO 0.00 0.16 0.78 0.00 -0.50 0.00 0.00 175.29 175.73 2f52 s ALA 46 N 0.27 3.35 0.13 1.58 0.00 -1.26 -1.24 121.76 124.59 2f52 s ALA 46 Ca 0.45 0.24 -0.06 0.00 0.00 0.00 0.00 51.96 52.58 2f52 s ALA 46 Cb -0.21 -2.90 -0.02 0.00 0.00 0.00 0.00 23.12 19.98 2f52 s ALA 46 CO 0.26 0.29 0.17 0.14 0.00 0.00 0.00 175.76 176.63 2f52 s VAL 47 N -1.59 0.11 0.14 0.00 -7.23 -0.60 0.02 120.40 111.25 2f52 s VAL 47 Ca 0.46 -1.52 0.06 0.00 -1.81 0.00 0.00 61.98 59.17 2f52 s VAL 47 Cb -0.16 -1.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.98 2f52 s VAL 47 CO 0.21 -0.49 0.05 -0.94 -0.31 0.00 0.00 175.10 173.63 2f52 s SER 48 N -2.96 5.14 0.00 4.85 1.04 0.10 -2.02 113.70 119.85 2f52 s SER 48 Ca 0.15 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2f52 s SER 48 Cb 0.05 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.93 2f52 s SER 48 CO -0.03 0.11 0.00 2.22 0.98 0.00 0.00 173.24 176.52 2f52 n PHE 49 N 0.02 0.00 -3.63 5.02 1.16 -0.55 -0.26 117.46 119.21 2f52 n PHE 49 Ca -0.09 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.29 2f52 n PHE 49 Cb 0.54 0.00 -0.02 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 2.94 -0.22 3.97 2.02 -0.66 -1.78 118.70 122.97 2f52 s GLU 50 Ca 0.00 -1.14 -0.09 0.00 0.02 0.00 0.00 54.97 53.76 2f52 s GLU 50 Cb 0.00 -2.66 -0.04 0.00 0.10 0.00 0.00 34.13 31.52 2f52 s GLU 50 CO 0.00 0.08 0.11 0.42 0.02 0.00 0.00 175.26 175.89 2f52 s ILE 51 N -2.23 4.96 -0.16 -1.63 1.01 -1.26 -0.80 121.20 121.09 2f52 s ILE 51 Ca 0.43 0.04 -0.01 0.00 0.00 0.00 0.00 60.65 61.11 2f52 s ILE 51 Cb -0.08 -3.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 2f52 s ILE 51 CO 0.29 0.38 -0.12 0.68 0.00 0.00 0.00 174.94 176.17 2f52 s VAL 52 N 0.93 3.00 -0.08 2.92 -7.23 -0.56 -4.89 120.40 114.50 2f52 s VAL 52 Ca 0.06 -0.66 -0.30 0.00 -1.81 0.00 0.00 61.98 59.27 2f52 s VAL 52 Cb -0.13 -2.29 -0.05 0.00 0.56 0.00 0.00 36.38 34.46 2f52 s VAL 52 CO 0.03 0.50 1.72 -0.70 -0.31 0.00 0.00 175.10 176.34 2f52 s GLU 53 N 0.75 4.06 0.22 4.82 2.12 -1.26 -1.44 118.70 127.96 2f52 s GLU 53 Ca -0.05 2.15 0.10 0.00 0.36 0.00 0.00 54.97 57.53 2f52 s GLU 53 Cb -0.15 -4.04 -0.05 0.00 0.26 0.00 0.00 34.13 30.15 2f52 s GLU 53 CO 0.01 -1.00 -0.20 0.20 -0.54 0.00 0.00 175.26 173.74 2f52 s GLY 54 N 3.89 1.67 0.21 -1.50 0.00 0.31 -4.95 107.32 106.94 2f52 s GLY 54 Ca 0.76 -1.70 -0.13 0.00 0.00 0.00 0.00 44.72 43.65 2f52 s GLY 54 CO 0.31 -1.77 1.64 3.45 0.00 0.00 0.00 173.10 176.73 2f52 h ASN 55 N 2.77 -0.51 0.33 1.64 7.08 -2.00 0.97 115.58 125.85 2f52 h ASN 55 Ca -0.42 0.18 -0.02 0.00 -3.08 0.00 0.00 56.30 52.96 2f52 h ASN 55 Cb 1.23 0.36 -0.00 0.00 -2.08 0.00 0.00 38.32 37.82 2f52 h ASN 55 CO 0.55 -0.19 -0.12 0.03 -2.08 0.00 0.00 177.43 175.63 2f52 h ARG 56 N 0.02 0.00 0.00 4.14 3.08 -2.00 -3.48 114.38 116.14 2f52 h ARG 56 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 2f52 h ARG 56 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2f52 h ARG 56 CO -0.61 0.12 0.00 0.41 -1.07 0.00 0.00 179.97 178.82 2f52 n GLY 57 N -0.75 0.63 3.75 0.04 0.00 0.34 -5.09 105.19 104.10 2f52 n GLY 57 Ca -0.02 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 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 4.46 0.25 1.61 0.04 -1.26 0.11 135.00 138.21 2f52 s PRO 58 Ca 0.00 2.00 0.06 0.00 0.04 0.00 0.00 61.00 63.10 2f52 s PRO 58 Cb 0.00 -3.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.31 2f52 s PRO 58 CO 0.00 -0.09 -0.06 -0.65 0.04 0.00 0.00 177.00 176.24 2f52 s GLN 59 N -0.87 1.43 -0.01 4.56 -0.21 -0.52 -2.58 119.66 121.45 2f52 s GLN 59 Ca 0.51 -1.70 -0.09 0.00 0.02 0.00 0.00 55.36 54.10 2f52 s GLN 59 Cb -0.35 -0.98 -0.05 0.00 1.00 0.00 0.00 33.01 32.62 2f52 s GLN 59 CO 0.42 0.03 0.29 0.00 -2.12 0.00 0.00 175.29 173.92 2f52 s ALA 60 N -3.12 3.80 0.15 6.09 0.00 0.11 -1.49 121.76 127.30 2f52 s ALA 60 Ca 0.27 -0.48 0.09 0.00 0.00 0.00 0.00 51.96 51.84 2f52 s ALA 60 Cb 0.03 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 2f52 s ALA 60 CO 0.09 0.59 -0.19 0.00 0.00 0.00 0.00 175.76 176.26 2f52 s ALA 61 N -1.21 2.01 -1.04 0.00 0.00 0.02 -4.70 121.76 116.84 2f52 s ALA 61 Ca 0.25 -1.45 -0.19 0.00 0.00 0.00 0.00 51.96 50.57 2f52 s ALA 61 Cb -0.14 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.79 2f52 s ALA 61 CO 0.13 0.28 0.67 -1.71 0.00 0.00 0.00 175.76 175.13 2f52 n ASN 62 N 0.45 -4.73 -4.71 0.00 5.15 -1.22 -1.66 115.26 108.54 2f52 n ASN 62 Ca -0.14 -1.09 -0.42 0.00 -0.60 0.00 0.00 54.58 52.33 2f52 n ASN 62 Cb 0.56 -2.05 -0.03 0.00 -0.53 0.00 0.00 39.78 37.73 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 -3.29 4.63 -0.13 3.44 1.01 0.39 -3.81 120.40 122.63 2f52 s VAL 63 Ca 0.28 1.89 0.03 0.00 0.00 0.00 0.00 61.98 64.18 2f52 s VAL 63 Cb -0.15 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.03 2f52 s VAL 63 CO 0.92 0.11 -0.22 -0.89 0.00 0.00 0.00 175.10 175.03 2f52 s THR 64 N 1.27 2.13 -0.27 3.92 2.01 0.64 -3.80 115.64 121.54 2f52 s THR 64 Ca 0.53 -0.96 -0.29 0.00 0.31 0.00 0.00 61.69 61.28 2f52 s THR 64 Cb -0.23 -1.85 -0.01 0.00 0.01 0.00 0.00 72.50 70.43 2f52 s THR 64 CO 0.26 0.55 1.43 -0.54 -0.69 0.00 0.00 174.62 175.63 2f52 s LYS 65 N 0.69 3.85 0.42 4.92 1.02 -1.26 -0.72 119.74 128.66 2f52 s LYS 65 Ca -0.10 1.40 -0.01 0.00 0.02 0.00 0.00 55.97 57.28 2f52 s LYS 65 Cb -0.16 -3.95 -0.02 0.00 -0.52 0.00 0.00 37.83 33.18 2f52 s LYS 65 CO 0.01 -1.21 0.65 -1.21 -0.92 0.00 0.00 175.35 172.67 2f52 s GLU 66 N 4.40 3.30 0.00 1.68 2.02 0.10 -4.96 118.70 125.24 2f52 s GLU 66 Ca 0.62 -0.30 0.31 0.00 0.02 0.00 0.00 54.97 55.62 2f52 s GLU 66 Cb -0.20 -2.56 1.61 0.00 0.10 0.00 0.00 34.13 33.09 2f52 s GLU 66 CO 0.26 -0.11 2.06 0.00 0.02 0.00 0.00 175.26 177.49