#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 3.42 -0.01 4.03 1.43 -0.71 -4.93 118.68 121.90 2f52 s LEU 2 Ca 0.00 -0.67 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 2f52 s LEU 2 Cb 0.00 -1.98 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2f52 s LEU 2 CO 0.00 -0.40 -0.04 -1.61 0.23 0.00 0.00 176.35 174.53 2f52 s GLU 3 N -3.96 0.46 0.12 1.70 2.02 -1.26 -0.18 118.70 117.59 2f52 s GLU 3 Ca 0.41 -0.12 0.03 0.00 0.02 0.00 0.00 54.97 55.31 2f52 s GLU 3 Cb -0.04 -0.48 -0.04 0.00 0.10 0.00 0.00 34.13 33.67 2f52 s GLU 3 CO 0.25 0.04 -0.08 0.20 0.02 0.00 0.00 175.26 175.68 2f52 s GLY 4 N 0.25 0.90 -0.09 -1.39 0.00 -0.13 -4.32 107.32 102.54 2f52 s GLY 4 Ca -0.03 -1.39 -0.04 0.00 0.00 0.00 0.00 44.72 43.27 2f52 s GLY 4 CO -0.00 -1.49 0.08 0.54 0.00 0.00 0.00 173.10 172.23 2f52 s LYS 5 N -3.67 3.21 -0.29 2.90 1.02 0.51 -1.32 119.74 122.10 2f52 s LYS 5 Ca 0.13 -0.29 -0.29 0.00 0.02 0.00 0.00 55.97 55.54 2f52 s LYS 5 Cb 0.03 -2.99 -0.01 0.00 -0.52 0.00 0.00 37.83 34.35 2f52 s LYS 5 CO -0.02 0.73 1.42 0.08 -0.92 0.00 0.00 175.35 176.64 2f52 s VAL 6 N -1.00 3.96 0.02 3.17 1.01 -0.81 0.15 120.40 126.91 2f52 s VAL 6 Ca 0.16 1.07 -0.17 0.00 0.00 0.00 0.00 61.98 63.04 2f52 s VAL 6 Cb -0.12 -4.02 -0.30 0.00 0.00 0.00 0.00 36.38 31.94 2f52 s VAL 6 CO 0.05 -0.46 1.04 0.50 0.00 0.00 0.00 175.10 176.23 2f52 h LYS 7 N 9.98 0.52 -2.49 2.72 3.64 -1.17 1.49 116.57 131.26 2f52 h LYS 7 Ca -0.29 -0.75 -0.05 0.00 -1.27 0.00 0.00 60.65 58.30 2f52 h LYS 7 Cb 1.12 0.26 -0.16 0.00 -0.41 0.00 0.00 32.23 33.03 2f52 h LYS 7 CO 1.03 1.34 0.14 -0.46 -2.27 0.00 0.00 179.45 179.23 2f52 s TRP 8 N -2.82 -0.55 -0.19 1.91 -0.00 -1.07 -4.62 118.94 111.59 2f52 s TRP 8 Ca -0.11 0.72 -0.21 0.00 -0.00 0.00 0.00 56.10 56.51 2f52 s TRP 8 Cb 0.04 0.42 0.06 0.00 -0.00 0.00 0.00 33.47 33.99 2f52 s TRP 8 CO 0.90 -0.68 0.57 -0.59 -0.00 0.00 0.00 176.95 177.16 2f52 s PHE 9 N -2.20 -0.61 -0.09 5.86 -0.71 -1.26 -0.15 117.98 118.81 2f52 s PHE 9 Ca -0.06 1.43 0.02 0.00 -1.04 0.00 0.00 56.93 57.27 2f52 s PHE 9 Cb -0.01 0.23 0.02 0.00 -1.21 0.00 0.00 43.02 42.05 2f52 s PHE 9 CO 0.01 -0.34 -0.13 1.21 -1.34 0.00 0.00 175.22 174.63 2f52 s ASN 10 N 0.05 2.17 0.14 1.98 2.47 -0.99 -4.86 114.94 115.90 2f52 s ASN 10 Ca -0.02 -0.36 0.26 0.00 0.42 0.00 0.00 52.86 53.16 2f52 s ASN 10 Cb -0.04 -0.96 0.95 0.00 -1.45 0.00 0.00 41.25 39.76 2f52 s ASN 10 CO 0.02 -0.00 1.80 -1.54 -3.72 0.00 0.00 177.10 173.66 2f52 n SER 11 N 4.20 0.50 0.45 -4.21 3.41 -1.26 -2.23 113.62 114.47 2f52 n SER 11 Ca -0.19 0.56 -0.19 0.00 -0.26 0.00 0.00 58.87 58.78 2f52 n SER 11 Cb 0.51 -0.69 -0.10 0.00 -0.26 0.00 0.00 64.21 63.68 2f52 n SER 11 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2f52 h GLU 12 N 0.00 -1.12 -0.12 4.33 4.81 -1.94 -3.11 114.58 117.43 2f52 h GLU 12 Ca 0.00 0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 2f52 h GLU 12 Cb 0.60 0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.24 2f52 h GLU 12 CO 0.00 -0.74 -0.32 0.87 -0.73 0.00 0.00 179.01 178.08 2f52 h LYS 13 N -1.16 0.43 0.00 1.92 1.57 -2.01 -3.47 116.57 113.85 2f52 h LYS 13 Ca -0.11 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2f52 h LYS 13 Cb 0.90 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.26 2f52 h LYS 13 CO 0.16 0.92 0.00 0.41 -0.57 0.00 0.00 179.45 180.37 2f52 n GLY 14 N 0.52 1.59 3.50 3.86 0.00 -0.95 -4.97 105.19 108.74 2f52 n GLY 14 Ca -0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 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 0.70 0.30 1.61 -0.12 -1.18 -2.01 117.98 115.29 2f52 s PHE 15 Ca 0.00 -1.00 -0.07 0.00 -0.05 0.00 0.00 56.93 55.81 2f52 s PHE 15 Cb 0.00 -0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.39 2f52 s PHE 15 CO 0.00 -0.99 0.47 0.20 -0.05 0.00 0.00 175.22 174.85 2f52 s GLY 16 N -3.11 1.09 -0.11 1.99 0.00 -0.87 -2.34 107.32 103.96 2f52 s GLY 16 Ca 0.27 -1.26 -0.00 0.00 0.00 0.00 0.00 44.72 43.73 2f52 s GLY 16 CO 0.13 -0.86 -0.09 -1.36 0.00 0.00 0.00 173.10 170.92 2f52 s PHE 17 N -3.41 2.88 0.12 1.90 0.08 0.79 -1.00 117.98 119.33 2f52 s PHE 17 Ca 0.27 -0.32 0.11 0.00 0.12 0.00 0.00 56.93 57.10 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 0.15 0.02 -0.26 0.42 -0.10 0.00 0.00 175.22 175.45 2f52 s ILE 18 N -0.08 2.21 -0.19 0.64 1.01 -0.42 -0.60 121.20 123.76 2f52 s ILE 18 Ca -0.01 -1.71 -0.02 0.00 0.00 0.00 0.00 60.65 58.91 2f52 s ILE 18 Cb -0.14 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 2f52 s ILE 18 CO 0.03 0.11 -0.08 -0.70 0.00 0.00 0.00 174.94 174.30 2f52 s GLU 19 N -1.97 3.34 -0.23 2.79 2.56 0.40 -1.00 118.70 124.59 2f52 s GLU 19 Ca 0.13 -0.66 -0.18 0.00 0.00 0.00 0.00 54.97 54.26 2f52 s GLU 19 Cb -0.10 -2.87 -0.03 0.00 2.00 0.00 0.00 34.13 33.13 2f52 s GLU 19 CO 0.05 -0.10 0.53 0.08 -0.56 0.00 0.00 175.26 175.27 2f52 s VAL 20 N 1.18 5.08 -0.38 3.70 1.01 -1.25 -0.36 120.40 129.37 2f52 s VAL 20 Ca 0.02 0.94 -0.28 0.00 0.00 0.00 0.00 61.98 62.66 2f52 s VAL 20 Cb -0.14 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 2f52 s VAL 20 CO -0.02 0.12 1.75 -1.61 0.00 0.00 0.00 175.10 175.33 2f52 s GLU 21 N 2.03 3.28 0.00 2.72 2.02 -1.26 -1.97 118.70 125.51 2f52 s GLU 21 Ca 0.23 1.24 0.00 0.00 0.02 0.00 0.00 54.97 56.46 2f52 s GLU 21 Cb -0.15 -4.20 0.00 0.00 0.10 0.00 0.00 34.13 29.88 2f52 s GLU 21 CO 0.09 -1.93 0.00 0.41 0.02 0.00 0.00 175.26 173.85 2f52 n GLY 22 N 5.40 2.13 3.29 -1.39 0.00 -1.26 -5.07 105.19 108.30 2f52 n GLY 22 Ca 0.22 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 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 1.26 0.71 1.61 -0.21 -0.83 -5.14 119.66 117.05 2f52 s GLN 23 Ca 0.00 -1.64 -0.11 0.00 0.02 0.00 0.00 55.36 53.63 2f52 s GLN 23 Cb 0.00 -0.39 0.17 0.00 1.00 0.00 0.00 33.01 33.79 2f52 s GLN 23 CO 0.00 -0.16 0.37 -0.25 -2.12 0.00 0.00 175.29 173.13 2f52 n ASP 24 N -0.36 -2.73 -4.77 5.90 8.00 -1.26 -4.36 116.55 116.97 2f52 n ASP 24 Ca -0.04 -0.38 -0.38 0.00 0.71 0.00 0.00 54.79 54.70 2f52 n ASP 24 Cb 0.64 -0.50 -0.05 0.00 -0.02 0.00 0.00 41.12 41.19 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 7.02 -0.17 -2.24 1.47 -1.26 -3.90 116.67 115.37 2f52 s ASP 25 Ca 0.29 2.07 0.01 0.00 1.18 0.00 0.00 52.55 56.10 2f52 s ASP 25 Cb -0.05 -2.60 0.01 0.00 -0.34 0.00 0.00 42.92 39.94 2f52 s ASP 25 CO 0.24 -0.30 -0.18 -0.69 0.68 0.00 0.00 175.17 174.91 2f52 s VAL 26 N -1.49 2.25 0.60 2.11 1.01 -0.17 -4.62 120.40 120.09 2f52 s VAL 26 Ca 0.52 -0.89 -0.13 0.00 0.00 0.00 0.00 61.98 61.49 2f52 s VAL 26 Cb -0.25 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2f52 s VAL 26 CO 0.31 0.53 1.02 0.12 0.00 0.00 0.00 175.10 177.08 2f52 s PHE 27 N 1.18 3.48 -0.04 5.22 5.36 -1.21 -1.30 117.98 130.67 2f52 s PHE 27 Ca 0.02 1.37 0.02 0.00 -0.96 0.00 0.00 56.93 57.37 2f52 s PHE 27 Cb -0.14 -2.78 0.01 0.00 -0.34 0.00 0.00 43.02 39.78 2f52 s PHE 27 CO -0.09 -0.70 -0.07 0.08 -1.46 0.00 0.00 175.22 172.98 2f52 s VAL 28 N -2.98 0.71 0.16 3.12 1.01 -0.17 0.25 120.40 122.50 2f52 s VAL 28 Ca 0.57 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.33 2f52 s VAL 28 Cb -0.11 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 2f52 s VAL 28 CO 0.47 0.25 0.16 -2.28 0.00 0.00 0.00 175.10 173.70 2f52 s HIS 29 N 0.57 3.21 0.19 5.22 2.46 -1.26 -2.06 115.29 123.62 2f52 s HIS 29 Ca -0.09 0.01 -0.19 0.00 0.47 0.00 0.00 55.06 55.26 2f52 s HIS 29 Cb -0.12 -1.54 0.15 0.00 -0.13 0.00 0.00 32.58 30.94 2f52 s HIS 29 CO 0.01 0.52 1.60 0.27 -2.47 0.00 0.00 174.74 174.66 2f52 h PHE 30 N 2.36 -0.77 0.00 3.88 -5.15 -1.76 1.14 116.94 116.64 2f52 h PHE 30 Ca -0.48 0.07 -0.00 0.00 -0.20 0.00 0.00 57.97 57.36 2f52 h PHE 30 Cb 1.20 0.42 -0.00 0.00 0.22 0.00 0.00 35.95 37.79 2f52 h PHE 30 CO 0.57 -0.36 -0.00 0.66 -2.00 0.00 0.00 178.31 177.18 2f52 h SER 31 N -0.13 0.00 0.26 -0.68 4.64 -1.94 -0.64 113.55 115.06 2f52 h SER 31 Ca 0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 2f52 h SER 31 Cb 0.53 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2f52 h SER 31 CO -0.67 0.00 -0.06 0.00 -0.87 0.00 0.00 176.83 175.24 2f52 h ALA 32 N 2.00 1.27 -3.59 5.18 0.00 0.10 -3.41 119.26 120.81 2f52 h ALA 32 Ca -0.00 -0.05 -0.67 0.00 0.00 0.00 0.00 54.91 54.19 2f52 h ALA 32 Cb 0.01 -0.01 -0.21 0.00 0.00 0.00 0.00 17.79 17.58 2f52 h ALA 32 CO 0.00 0.07 -0.71 0.42 0.00 0.00 0.00 179.25 179.03 2f52 s ILE 33 N -4.25 3.56 0.11 0.00 1.09 -0.25 0.15 121.20 121.61 2f52 s ILE 33 Ca -0.03 -0.51 -0.11 0.00 -1.10 0.00 0.00 60.65 58.89 2f52 s ILE 33 Cb 0.13 -2.48 -0.06 0.00 -1.06 0.00 0.00 42.46 38.99 2f52 s ILE 33 CO 0.54 0.57 0.46 -1.10 -0.10 0.00 0.00 174.94 175.30 2f52 s GLN 34 N -0.39 3.84 0.00 2.79 -0.21 -1.25 -4.72 119.66 119.71 2f52 s GLN 34 Ca 0.05 0.29 0.00 0.00 0.02 0.00 0.00 55.36 55.72 2f52 s GLN 34 Cb -0.12 -2.96 0.00 0.00 1.00 0.00 0.00 33.01 30.93 2f52 s GLN 34 CO 0.02 0.52 0.00 0.41 -2.12 0.00 0.00 175.29 174.12 2f52 n GLY 35 N 0.82 3.48 0.10 3.09 0.00 -1.26 -4.57 105.19 106.86 2f52 n GLY 35 Ca -0.07 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 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 0.21 0.00 1.61 5.08 -2.02 -3.40 114.58 116.06 2f52 h GLU 36 Ca 0.00 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2f52 h GLU 36 Cb 0.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2f52 h GLU 36 CO 0.00 0.71 -0.47 0.41 -1.00 0.00 0.00 179.01 178.66 2f52 n GLY 37 N 0.40 0.52 0.79 -3.84 0.00 -1.26 -4.82 105.19 96.97 2f52 n GLY 37 Ca -0.08 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.22 1.61 -1.74 -1.26 -4.81 117.46 111.04 2f52 n PHE 38 Ca 0.00 -0.88 0.00 0.00 -0.56 0.00 0.00 57.45 56.01 2f52 n PHE 38 Cb 0.69 -0.17 0.23 0.00 1.52 0.00 0.00 39.48 41.75 2f52 n PHE 38 CO 0.00 0.00 0.00 0.87 -0.56 0.00 0.00 176.76 177.07 2f52 h LYS 39 N 0.69 1.00 -7.02 3.97 1.57 -1.81 -3.43 116.57 111.55 2f52 h LYS 39 Ca -0.07 -0.07 -0.54 0.00 -1.87 0.00 0.00 60.65 58.10 2f52 h LYS 39 Cb 1.35 -0.22 0.12 0.00 0.08 0.00 0.00 32.23 33.55 2f52 h LYS 39 CO 0.03 0.67 0.60 0.95 -0.57 0.00 0.00 179.45 181.14 2f52 s THR 40 N -5.83 2.29 0.27 -0.16 -4.23 -1.26 -4.56 115.64 102.16 2f52 s THR 40 Ca -0.11 0.22 0.03 0.00 -1.18 0.00 0.00 61.69 60.66 2f52 s THR 40 Cb 0.18 -3.12 0.05 0.00 1.34 0.00 0.00 72.50 70.95 2f52 s THR 40 CO 0.79 0.01 0.37 0.18 -0.54 0.00 0.00 174.62 175.43 2f52 n LEU 41 N -0.71 0.00 -4.36 4.79 4.32 -1.26 -5.12 117.00 114.66 2f52 n LEU 41 Ca 0.08 -1.07 -0.27 0.00 -0.02 0.00 0.00 56.01 54.73 2f52 n LEU 41 Cb 0.45 -0.21 -0.13 0.00 -1.62 0.00 0.00 43.42 41.91 2f52 n LEU 41 CO 0.53 -0.62 -0.55 -0.70 -1.22 0.00 0.00 177.39 174.83 2f52 s GLU 42 N -3.26 1.33 0.02 3.23 2.12 -1.26 -4.89 118.70 115.99 2f52 s GLU 42 Ca 0.28 -1.32 -0.30 0.00 0.36 0.00 0.00 54.97 53.98 2f52 s GLU 42 Cb -0.02 -1.73 -0.07 0.00 0.26 0.00 0.00 34.13 32.57 2f52 s GLU 42 CO 0.18 0.40 1.55 -2.00 -0.54 0.00 0.00 175.26 174.85 2f52 s GLU 43 N -2.11 4.23 0.00 4.30 2.12 -1.26 -1.67 118.70 124.31 2f52 s GLU 43 Ca 0.13 2.16 0.00 0.00 0.36 0.00 0.00 54.97 57.62 2f52 s GLU 43 Cb -0.10 -3.65 0.00 0.00 0.26 0.00 0.00 34.13 30.64 2f52 s GLU 43 CO 0.06 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 174.50 2f52 n GLY 44 N 3.88 0.95 3.72 -1.50 0.00 0.51 -4.94 105.19 107.81 2f52 n GLY 44 Ca 0.15 0.00 -0.41 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 -0.55 4.56 0.27 1.61 2.00 -0.67 -4.64 119.66 122.24 2f52 s GLN 45 Ca 0.00 1.29 -0.30 0.00 -2.00 0.00 0.00 55.36 54.36 2f52 s GLN 45 Cb 0.00 -3.43 -0.09 0.00 0.80 0.00 0.00 33.01 30.29 2f52 s GLN 45 CO 0.00 0.07 1.04 0.00 -0.50 0.00 0.00 175.29 175.90 2f52 s ALA 46 N 0.62 3.37 0.06 1.58 0.00 -1.26 -1.93 121.76 124.20 2f52 s ALA 46 Ca 0.47 0.79 -0.02 0.00 0.00 0.00 0.00 51.96 53.19 2f52 s ALA 46 Cb -0.21 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 2f52 s ALA 46 CO 0.26 -0.02 0.01 0.14 0.00 0.00 0.00 175.76 176.15 2f52 s VAL 47 N -1.18 0.21 0.20 0.00 -7.23 -0.44 -0.75 120.40 111.20 2f52 s VAL 47 Ca 0.43 -1.69 0.08 0.00 -1.81 0.00 0.00 61.98 59.00 2f52 s VAL 47 Cb -0.29 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 2f52 s VAL 47 CO 0.37 -0.93 -0.04 -0.44 -0.31 0.00 0.00 175.10 173.74 2f52 s SER 48 N -2.90 4.49 0.00 4.85 0.01 -0.27 -0.96 113.70 118.92 2f52 s SER 48 Ca 0.07 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 56.80 2f52 s SER 48 Cb 0.07 -0.85 0.00 0.00 0.21 0.00 0.00 66.02 65.45 2f52 s SER 48 CO -0.10 0.08 0.00 2.22 0.41 0.00 0.00 173.24 175.85 2f52 n PHE 49 N -0.20 0.00 -3.76 2.43 1.16 0.75 -0.86 117.46 116.98 2f52 n PHE 49 Ca -0.09 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.24 2f52 n PHE 49 Cb 0.56 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.41 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 3.47 -0.20 3.97 2.02 -0.98 -1.75 118.70 123.24 2f52 s GLU 50 Ca 0.00 -0.51 -0.12 0.00 0.02 0.00 0.00 54.97 54.35 2f52 s GLU 50 Cb 0.00 -2.84 -0.05 0.00 0.10 0.00 0.00 34.13 31.35 2f52 s GLU 50 CO 0.00 0.37 0.22 0.42 0.02 0.00 0.00 175.26 176.30 2f52 s ILE 51 N -1.98 5.34 -0.23 -1.63 1.01 -1.26 -1.65 121.20 120.79 2f52 s ILE 51 Ca 0.37 0.36 -0.05 0.00 0.00 0.00 0.00 60.65 61.33 2f52 s ILE 51 Cb -0.10 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 2f52 s ILE 51 CO 0.30 0.38 -0.00 0.68 0.00 0.00 0.00 174.94 176.30 2f52 s VAL 52 N 0.70 3.68 -0.89 2.92 -7.23 -0.34 -4.86 120.40 114.36 2f52 s VAL 52 Ca 0.12 -0.41 -0.19 0.00 -1.81 0.00 0.00 61.98 59.68 2f52 s VAL 52 Cb -0.13 -2.70 0.12 0.00 0.56 0.00 0.00 36.38 34.23 2f52 s VAL 52 CO 0.03 0.38 1.11 -1.61 -0.31 0.00 0.00 175.10 174.70 2f52 s GLU 53 N 1.52 3.53 0.41 4.82 2.02 -1.26 0.16 118.70 129.89 2f52 s GLU 53 Ca 0.06 -1.61 0.04 0.00 0.02 0.00 0.00 54.97 53.48 2f52 s GLU 53 Cb -0.15 -4.84 0.07 0.00 0.10 0.00 0.00 34.13 29.32 2f52 s GLU 53 CO -0.01 -1.79 0.56 0.41 0.02 0.00 0.00 175.26 174.45 2f52 n GLY 54 N 5.53 1.49 0.42 -1.39 0.00 1.00 -4.90 105.19 107.34 2f52 n GLY 54 Ca 0.20 -2.12 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 2f52 n GLY 54 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2f52 h ASN 55 N -0.10 -1.25 -1.03 1.61 -1.24 -2.01 -0.90 115.58 110.66 2f52 h ASN 55 Ca -0.19 0.11 0.27 0.00 0.71 0.00 0.00 56.30 57.20 2f52 h ASN 55 Cb 0.79 0.43 -0.12 0.00 0.73 0.00 0.00 38.32 40.15 2f52 h ASN 55 CO 0.24 -0.54 0.62 0.03 -1.29 0.00 0.00 177.43 176.50 2f52 h ARG 56 N -0.78 0.47 0.00 6.67 3.08 -1.99 -3.47 114.38 118.36 2f52 h ARG 56 Ca -0.04 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2f52 h ARG 56 Cb 0.71 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2f52 h ARG 56 CO -0.12 0.31 0.00 0.41 -1.07 0.00 0.00 179.97 179.50 2f52 n GLY 57 N -1.36 0.36 3.76 0.04 0.00 -0.34 -5.10 105.19 102.55 2f52 n GLY 57 Ca 0.28 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 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 4.43 0.21 1.61 0.04 -1.25 -0.00 135.00 138.05 2f52 s PRO 58 Ca 0.00 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.00 2f52 s PRO 58 Cb 0.00 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.44 2f52 s PRO 58 CO 0.00 -0.02 0.07 -0.65 0.04 0.00 0.00 177.00 176.43 2f52 s GLN 59 N -1.73 1.26 -0.08 4.56 -0.21 0.12 -3.32 119.66 120.26 2f52 s GLN 59 Ca 0.48 -1.65 -0.12 0.00 0.02 0.00 0.00 55.36 54.10 2f52 s GLN 59 Cb -0.34 -0.18 -0.05 0.00 1.00 0.00 0.00 33.01 33.44 2f52 s GLN 59 CO 0.45 -0.25 0.28 0.00 -2.12 0.00 0.00 175.29 173.65 2f52 s ALA 60 N -3.78 3.74 0.18 6.09 0.00 0.70 -1.20 121.76 127.48 2f52 s ALA 60 Ca 0.32 -0.43 0.08 0.00 0.00 0.00 0.00 51.96 51.94 2f52 s ALA 60 Cb 0.07 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 2f52 s ALA 60 CO 0.09 0.44 -0.17 0.00 0.00 0.00 0.00 175.76 176.12 2f52 s ALA 61 N -0.69 2.04 -0.61 0.00 0.00 -0.66 -4.59 121.76 117.25 2f52 s ALA 61 Ca 0.19 -1.55 -0.17 0.00 0.00 0.00 0.00 51.96 50.43 2f52 s ALA 61 Cb -0.14 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.84 2f52 s ALA 61 CO 0.08 0.19 0.59 0.09 0.00 0.00 0.00 175.76 176.71 2f52 n ASN 62 N 0.07 -4.75 -4.72 0.00 3.02 -1.24 -2.31 115.26 105.34 2f52 n ASN 62 Ca -0.11 -0.58 -0.39 0.00 -0.03 0.00 0.00 54.58 53.47 2f52 n ASN 62 Cb 0.58 -1.49 -0.05 0.00 -0.61 0.00 0.00 39.78 38.21 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 -2.21 5.12 -0.15 2.41 1.01 0.40 -3.86 120.40 123.12 2f52 s VAL 63 Ca 0.17 1.19 0.01 0.00 0.00 0.00 0.00 61.98 63.35 2f52 s VAL 63 Cb -0.02 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2f52 s VAL 63 CO 0.83 0.28 -0.19 -0.89 0.00 0.00 0.00 175.10 175.13 2f52 s THR 64 N 0.78 2.30 -0.38 3.92 2.01 -0.04 -3.90 115.64 120.33 2f52 s THR 64 Ca 0.31 -0.89 -0.28 0.00 0.31 0.00 0.00 61.69 61.14 2f52 s THR 64 Cb -0.16 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.38 2f52 s THR 64 CO 0.14 0.53 1.88 -0.54 -0.69 0.00 0.00 174.62 175.95 2f52 s LYS 65 N 0.87 3.10 0.49 4.92 1.02 -1.26 -1.12 119.74 127.76 2f52 s LYS 65 Ca -0.05 1.32 0.05 0.00 0.02 0.00 0.00 55.97 57.31 2f52 s LYS 65 Cb -0.15 -4.27 0.03 0.00 -0.52 0.00 0.00 37.83 32.91 2f52 s LYS 65 CO -0.02 -2.13 0.67 -1.21 -0.92 0.00 0.00 175.35 171.74 2f52 s GLU 66 N 6.14 2.66 0.00 1.68 0.41 0.07 -4.96 118.70 124.70 2f52 s GLU 66 Ca 0.80 -1.07 0.00 0.00 -0.41 0.00 0.00 54.97 54.29 2f52 s GLU 66 Cb -0.21 -2.63 0.00 0.00 -1.78 0.00 0.00 34.13 29.50 2f52 s GLU 66 CO 0.31 -0.51 0.00 0.00 -0.49 0.00 0.00 175.26 174.57