#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 2.84 -0.01 4.03 1.02 -0.73 -4.98 118.68 120.85 2f52 s LEU 2 Ca 0.00 -0.67 0.06 0.00 0.02 0.00 0.00 54.13 53.54 2f52 s LEU 2 Cb 0.00 -1.52 -0.02 0.00 0.02 0.00 0.00 46.19 44.67 2f52 s LEU 2 CO 0.00 0.10 -0.20 -0.70 0.02 0.00 0.00 176.35 175.57 2f52 s GLU 3 N -2.86 1.59 0.00 1.70 2.12 -1.26 -1.15 118.70 118.83 2f52 s GLU 3 Ca 0.24 -0.73 -0.07 0.00 0.36 0.00 0.00 54.97 54.77 2f52 s GLU 3 Cb -0.08 -1.55 0.00 0.00 0.26 0.00 0.00 34.13 32.76 2f52 s GLU 3 CO 0.14 0.42 0.13 0.20 -0.54 0.00 0.00 175.26 175.62 2f52 s GLY 4 N -0.53 0.05 -0.12 -1.50 0.00 -1.05 -4.28 107.32 99.89 2f52 s GLY 4 Ca 0.08 -0.14 -0.08 0.00 0.00 0.00 0.00 44.72 44.58 2f52 s GLY 4 CO -0.01 -0.28 0.16 0.54 0.00 0.00 0.00 173.10 173.52 2f52 s LYS 5 N -1.38 3.51 -0.22 2.90 1.02 -0.52 -2.34 119.74 122.72 2f52 s LYS 5 Ca -0.15 -0.10 -0.29 0.00 0.02 0.00 0.00 55.97 55.46 2f52 s LYS 5 Cb -0.08 -3.20 -0.03 0.00 -0.52 0.00 0.00 37.83 34.00 2f52 s LYS 5 CO 0.02 0.75 1.60 0.08 -0.92 0.00 0.00 175.35 176.87 2f52 s VAL 6 N -0.97 3.72 0.01 3.17 1.01 -1.00 0.27 120.40 126.61 2f52 s VAL 6 Ca 0.15 0.81 -0.18 0.00 0.00 0.00 0.00 61.98 62.77 2f52 s VAL 6 Cb -0.12 -3.72 -0.31 0.00 0.00 0.00 0.00 36.38 32.23 2f52 s VAL 6 CO 0.04 -0.29 1.01 0.50 0.00 0.00 0.00 175.10 176.36 2f52 h LYS 7 N 10.58 0.47 -2.48 2.72 3.64 -0.75 1.12 116.57 131.87 2f52 h LYS 7 Ca -0.33 -0.70 -0.04 0.00 -1.27 0.00 0.00 60.65 58.31 2f52 h LYS 7 Cb 1.15 0.24 -0.16 0.00 -0.41 0.00 0.00 32.23 33.06 2f52 h LYS 7 CO 1.00 1.31 0.21 -0.46 -2.27 0.00 0.00 179.45 179.24 2f52 s TRP 8 N -2.74 -0.60 -0.16 1.91 -0.00 -1.05 -4.64 118.94 111.66 2f52 s TRP 8 Ca -0.11 0.73 -0.19 0.00 -0.00 0.00 0.00 56.10 56.53 2f52 s TRP 8 Cb 0.03 0.48 0.05 0.00 -0.00 0.00 0.00 33.47 34.04 2f52 s TRP 8 CO 0.89 -0.72 0.51 -0.59 -0.00 0.00 0.00 176.95 177.03 2f52 s PHE 9 N -2.45 -0.53 -0.04 5.86 -0.71 -1.26 0.31 117.98 119.16 2f52 s PHE 9 Ca -0.05 1.25 0.03 0.00 -1.04 0.00 0.00 56.93 57.12 2f52 s PHE 9 Cb -0.00 0.20 0.01 0.00 -1.21 0.00 0.00 43.02 42.01 2f52 s PHE 9 CO -0.01 -0.31 -0.12 1.21 -1.34 0.00 0.00 175.22 174.65 2f52 s ASN 10 N 0.00 1.59 0.42 1.98 2.47 -1.03 -4.89 114.94 115.48 2f52 s ASN 10 Ca -0.02 -0.26 0.22 0.00 0.42 0.00 0.00 52.86 53.23 2f52 s ASN 10 Cb -0.03 -0.55 0.41 0.00 -1.45 0.00 0.00 41.25 39.63 2f52 s ASN 10 CO 0.02 0.07 1.62 0.77 -3.72 0.00 0.00 177.10 175.86 2f52 h SER 11 N 6.58 0.00 -0.35 -4.21 4.64 -1.94 0.11 113.55 118.37 2f52 h SER 11 Ca -0.33 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.95 2f52 h SER 11 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2f52 h SER 11 CO 0.48 0.11 0.04 -0.33 -0.87 0.00 0.00 176.83 176.26 2f52 h GLU 12 N 0.00 0.60 -0.03 4.77 5.08 -1.94 -2.76 114.58 120.30 2f52 h GLU 12 Ca -0.00 -0.17 -0.24 0.00 -1.00 0.00 0.00 59.36 57.95 2f52 h GLU 12 Cb 1.02 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.21 2f52 h GLU 12 CO 0.01 0.69 -0.94 0.87 -1.00 0.00 0.00 179.01 178.64 2f52 h LYS 13 N 0.43 0.56 0.00 2.33 1.57 -1.96 -3.47 116.57 116.03 2f52 h LYS 13 Ca 0.11 -0.57 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2f52 h LYS 13 Cb 0.39 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2f52 h LYS 13 CO 0.01 1.19 0.00 0.41 -0.57 0.00 0.00 179.45 180.49 2f52 n GLY 14 N 0.93 0.73 3.23 3.86 0.00 0.36 -4.97 105.19 109.34 2f52 n GLY 14 Ca -0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.77 1.27 0.29 1.61 -0.71 -1.19 -2.57 117.98 113.91 2f52 s PHE 15 Ca 0.00 -1.32 0.04 0.00 -1.04 0.00 0.00 56.93 54.61 2f52 s PHE 15 Cb 0.00 -0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 41.12 2f52 s PHE 15 CO 0.00 -0.55 0.20 0.20 -1.34 0.00 0.00 175.22 173.73 2f52 s GLY 16 N -3.20 2.01 -0.10 1.99 0.00 -0.23 -2.48 107.32 105.30 2f52 s GLY 16 Ca 0.39 -1.86 0.03 0.00 0.00 0.00 0.00 44.72 43.27 2f52 s GLY 16 CO 0.12 -1.49 -0.18 -1.36 0.00 0.00 0.00 173.10 170.19 2f52 s PHE 17 N -3.69 2.66 0.10 1.90 0.08 0.15 -0.67 117.98 118.50 2f52 s PHE 17 Ca 0.38 -0.69 0.09 0.00 0.12 0.00 0.00 56.93 56.84 2f52 s PHE 17 Cb 0.04 -1.73 -0.04 0.00 -0.57 0.00 0.00 43.02 40.72 2f52 s PHE 17 CO 0.20 -0.21 -0.20 0.42 -0.10 0.00 0.00 175.22 175.34 2f52 s ILE 18 N 0.09 2.73 -0.22 0.64 1.01 -0.09 -0.01 121.20 125.34 2f52 s ILE 18 Ca -0.08 -1.46 -0.05 0.00 0.00 0.00 0.00 60.65 59.06 2f52 s ILE 18 Cb -0.15 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 2f52 s ILE 18 CO 0.05 0.16 -0.02 -0.70 0.00 0.00 0.00 174.94 174.44 2f52 s GLU 19 N -1.94 3.48 -0.27 2.79 2.56 0.14 -1.20 118.70 124.26 2f52 s GLU 19 Ca 0.16 -0.58 -0.14 0.00 0.00 0.00 0.00 54.97 54.41 2f52 s GLU 19 Cb -0.10 -3.07 -0.04 0.00 2.00 0.00 0.00 34.13 32.92 2f52 s GLU 19 CO 0.08 -0.14 0.35 0.08 -0.56 0.00 0.00 175.26 175.07 2f52 s VAL 20 N 1.36 5.19 -0.40 3.70 1.01 -1.26 -1.43 120.40 128.58 2f52 s VAL 20 Ca 0.04 0.52 -0.28 0.00 0.00 0.00 0.00 61.98 62.26 2f52 s VAL 20 Cb -0.14 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 2f52 s VAL 20 CO -0.01 0.17 1.61 -1.61 0.00 0.00 0.00 175.10 175.26 2f52 s GLU 21 N 2.03 3.40 0.00 2.72 8.01 -1.26 -2.37 118.70 131.23 2f52 s GLU 21 Ca 0.14 1.09 0.00 0.00 0.01 0.00 0.00 54.97 56.21 2f52 s GLU 21 Cb -0.16 -4.13 0.00 0.00 -4.31 0.00 0.00 34.13 25.53 2f52 s GLU 21 CO 0.10 -1.79 0.00 0.41 0.01 0.00 0.00 175.26 173.99 2f52 n GLY 22 N 5.28 1.84 3.22 -1.39 0.00 -1.26 -5.04 105.19 107.84 2f52 n GLY 22 Ca 0.19 0.00 -0.13 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 1.22 0.87 1.61 -0.21 -1.00 -5.15 119.66 117.01 2f52 s GLN 23 Ca 0.00 -1.64 -0.13 0.00 0.02 0.00 0.00 55.36 53.61 2f52 s GLN 23 Cb 0.00 0.16 0.20 0.00 1.00 0.00 0.00 33.01 34.36 2f52 s GLN 23 CO 0.00 -0.36 0.44 -0.25 -2.12 0.00 0.00 175.29 173.00 2f52 n ASP 24 N -0.30 -2.96 -4.77 5.90 8.00 -1.26 -4.45 116.55 116.71 2f52 n ASP 24 Ca 0.01 -0.45 -0.38 0.00 0.71 0.00 0.00 54.79 54.69 2f52 n ASP 24 Cb 0.66 -0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 41.09 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 -2.23 7.05 -0.19 -2.24 1.47 -1.26 -4.05 116.67 115.23 2f52 s ASP 25 Ca 0.34 2.07 -0.01 0.00 1.18 0.00 0.00 52.55 56.14 2f52 s ASP 25 Cb -0.06 -2.60 0.01 0.00 -0.34 0.00 0.00 42.92 39.93 2f52 s ASP 25 CO 0.29 -0.28 -0.14 -0.69 0.68 0.00 0.00 175.17 175.02 2f52 s VAL 26 N -1.47 2.56 0.64 2.11 1.01 -0.34 -4.80 120.40 120.11 2f52 s VAL 26 Ca 0.52 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 2f52 s VAL 26 Cb -0.25 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 2f52 s VAL 26 CO 0.31 0.50 1.04 0.12 0.00 0.00 0.00 175.10 177.07 2f52 s PHE 27 N 1.27 3.55 -0.05 5.22 5.36 -1.25 -0.92 117.98 131.16 2f52 s PHE 27 Ca 0.04 1.21 -0.00 0.00 -0.96 0.00 0.00 56.93 57.22 2f52 s PHE 27 Cb -0.14 -2.79 0.03 0.00 -0.34 0.00 0.00 43.02 39.78 2f52 s PHE 27 CO -0.08 -0.80 -0.01 0.08 -1.46 0.00 0.00 175.22 172.95 2f52 s VAL 28 N -3.21 0.38 0.21 3.12 1.01 0.15 0.17 120.40 122.23 2f52 s VAL 28 Ca 0.56 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.57 2f52 s VAL 28 Cb -0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 2f52 s VAL 28 CO 0.53 0.22 0.41 -2.28 0.00 0.00 0.00 175.10 173.99 2f52 s HIS 29 N 1.45 3.48 0.19 5.22 2.46 -1.26 -1.07 115.29 125.76 2f52 s HIS 29 Ca -0.03 0.39 -0.19 0.00 0.47 0.00 0.00 55.06 55.69 2f52 s HIS 29 Cb -0.13 -1.89 0.15 0.00 -0.13 0.00 0.00 32.58 30.58 2f52 s HIS 29 CO -0.03 0.36 1.59 0.27 -2.47 0.00 0.00 174.74 174.46 2f52 h PHE 30 N 2.00 -0.83 -0.31 3.88 -5.15 -1.83 1.05 116.94 115.74 2f52 h PHE 30 Ca -0.48 0.07 0.09 0.00 -0.20 0.00 0.00 57.97 57.45 2f52 h PHE 30 Cb 1.19 0.46 -0.01 0.00 0.22 0.00 0.00 35.95 37.80 2f52 h PHE 30 CO 0.56 -0.37 0.29 0.66 -2.00 0.00 0.00 178.31 177.45 2f52 h SER 31 N -0.14 0.00 -0.34 -0.68 4.64 -1.93 0.84 113.55 115.94 2f52 h SER 31 Ca 0.25 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.51 2f52 h SER 31 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2f52 h SER 31 CO -0.69 0.00 0.03 0.00 -0.87 0.00 0.00 176.83 175.30 2f52 h ALA 32 N 1.72 1.24 -2.59 5.18 0.00 0.82 -3.42 119.26 122.20 2f52 h ALA 32 Ca 0.15 -0.23 -0.56 0.00 0.00 0.00 0.00 54.91 54.27 2f52 h ALA 32 Cb 0.72 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2f52 h ALA 32 CO -0.00 0.51 -0.16 0.42 0.00 0.00 0.00 179.25 180.02 2f52 s ILE 33 N -5.02 4.98 0.05 0.00 1.01 0.29 -1.20 121.20 121.31 2f52 s ILE 33 Ca -0.09 0.49 0.07 0.00 0.00 0.00 0.00 60.65 61.13 2f52 s ILE 33 Cb 0.15 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 2f52 s ILE 33 CO 0.79 0.09 -0.20 -1.10 0.00 0.00 0.00 174.94 174.52 2f52 s GLN 34 N -2.42 1.30 -0.25 2.79 -0.21 -1.25 -4.94 119.66 114.68 2f52 s GLN 34 Ca 0.41 -0.94 -0.37 0.00 0.02 0.00 0.00 55.36 54.48 2f52 s GLN 34 Cb -0.13 -1.41 0.16 0.00 1.00 0.00 0.00 33.01 32.63 2f52 s GLN 34 CO 0.21 0.36 1.38 0.20 -2.12 0.00 0.00 175.29 175.31 2f52 s GLY 35 N -1.24 -0.26 0.09 3.09 0.00 -1.26 -4.85 107.32 102.89 2f52 s GLY 35 Ca 0.06 1.73 -0.08 0.00 0.00 0.00 0.00 44.72 46.44 2f52 s GLY 35 CO 0.02 0.55 1.21 0.83 0.00 0.00 0.00 173.10 175.71 2f52 h GLU 36 N 2.00 0.45 0.00 2.90 5.08 -2.02 -3.41 114.58 119.58 2f52 h GLU 36 Ca -0.08 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 2f52 h GLU 36 Cb 1.14 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2f52 h GLU 36 CO 0.21 1.22 -0.17 0.41 -1.00 0.00 0.00 179.01 179.67 2f52 n GLY 37 N 1.20 0.29 2.54 -3.84 0.00 -1.26 -4.93 105.19 99.20 2f52 n GLY 37 Ca -0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 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 2.57 0.18 1.61 -1.74 -1.26 -4.83 117.46 113.99 2f52 n PHE 38 Ca 0.00 -2.98 0.03 0.00 -0.56 0.00 0.00 57.45 53.93 2f52 n PHE 38 Cb 0.57 -0.19 0.38 0.00 1.52 0.00 0.00 39.48 41.76 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 2.73 0.03 -6.42 3.97 1.57 -1.89 -3.41 116.57 113.15 2f52 h LYS 39 Ca 0.15 -0.01 -0.57 0.00 -1.87 0.00 0.00 60.65 58.35 2f52 h LYS 39 Cb 1.02 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.29 2f52 h LYS 39 CO 0.72 0.35 1.11 0.99 -0.57 0.00 0.00 179.45 182.05 2f52 s THR 40 N -4.31 3.81 1.34 -0.16 2.01 -1.26 -4.79 115.64 112.28 2f52 s THR 40 Ca -0.03 0.85 -0.19 0.00 0.31 0.00 0.00 61.69 62.63 2f52 s THR 40 Cb 0.15 -4.01 0.34 0.00 0.01 0.00 0.00 72.50 68.98 2f52 s THR 40 CO 0.72 -0.59 0.92 0.18 -0.69 0.00 0.00 174.62 175.16 2f52 n LEU 41 N 8.95 -1.18 -4.30 4.42 4.77 -1.26 -5.03 117.00 123.37 2f52 n LEU 41 Ca 0.18 -0.53 -0.26 0.00 -0.03 0.00 0.00 56.01 55.36 2f52 n LEU 41 Cb 0.47 -1.12 -0.14 0.00 -2.33 0.00 0.00 43.42 40.30 2f52 n LEU 41 CO 0.68 -3.98 -0.54 -0.70 -1.33 0.00 0.00 177.39 171.52 2f52 s GLU 42 N -4.68 1.38 -0.01 3.23 2.56 -1.26 -4.91 118.70 115.01 2f52 s GLU 42 Ca 0.68 -1.10 -0.30 0.00 0.00 0.00 0.00 54.97 54.24 2f52 s GLU 42 Cb -0.19 -1.62 -0.05 0.00 2.00 0.00 0.00 34.13 34.28 2f52 s GLU 42 CO 0.61 0.40 1.28 -2.00 -0.56 0.00 0.00 175.26 174.99 2f52 s GLU 43 N -1.55 4.34 0.00 4.30 2.12 -1.26 -2.40 118.70 124.25 2f52 s GLU 43 Ca 0.09 1.80 0.00 0.00 0.36 0.00 0.00 54.97 57.22 2f52 s GLU 43 Cb -0.10 -3.52 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2f52 s GLU 43 CO 0.03 -0.47 0.00 0.41 -0.54 0.00 0.00 175.26 174.70 2f52 n GLY 44 N 3.45 1.00 3.68 -1.50 0.00 0.39 -4.95 105.19 107.26 2f52 n GLY 44 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.59 4.37 0.37 1.61 2.00 -1.01 -4.64 119.66 121.77 2f52 s GLN 45 Ca 0.00 1.29 -0.25 0.00 -2.00 0.00 0.00 55.36 54.39 2f52 s GLN 45 Cb 0.00 -3.56 -0.09 0.00 0.80 0.00 0.00 33.01 30.16 2f52 s GLN 45 CO 0.00 -0.35 1.06 0.00 -0.50 0.00 0.00 175.29 175.50 2f52 s ALA 46 N 2.17 3.16 0.21 1.58 0.00 -1.26 -2.36 121.76 125.25 2f52 s ALA 46 Ca 0.45 0.74 -0.10 0.00 0.00 0.00 0.00 51.96 53.06 2f52 s ALA 46 Cb -0.17 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 2f52 s ALA 46 CO 0.15 -0.20 0.35 0.14 0.00 0.00 0.00 175.76 176.20 2f52 s VAL 47 N -1.54 0.02 0.15 0.00 -7.23 -0.99 -0.16 120.40 110.65 2f52 s VAL 47 Ca 0.55 -1.48 0.08 0.00 -1.81 0.00 0.00 61.98 59.31 2f52 s VAL 47 Cb -0.24 -2.10 -0.04 0.00 0.56 0.00 0.00 36.38 34.55 2f52 s VAL 47 CO 0.31 -0.11 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.98 2f52 s SER 48 N -3.02 4.51 0.00 4.85 1.04 0.11 -2.53 113.70 118.65 2f52 s SER 48 Ca 0.23 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2f52 s SER 48 Cb 0.02 -0.88 0.00 0.00 0.10 0.00 0.00 66.02 65.26 2f52 s SER 48 CO 0.06 0.13 0.00 2.22 0.98 0.00 0.00 173.24 176.63 2f52 n PHE 49 N 0.24 0.00 -3.55 5.02 1.16 -0.30 0.18 117.46 120.21 2f52 n PHE 49 Ca -0.11 0.00 -0.19 0.00 -1.87 0.00 0.00 57.45 55.27 2f52 n PHE 49 Cb 0.54 0.00 -0.01 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 3.14 -0.24 3.97 2.02 -0.68 -1.77 118.70 123.14 2f52 s GLU 50 Ca 0.00 -1.00 -0.09 0.00 0.02 0.00 0.00 54.97 53.90 2f52 s GLU 50 Cb 0.00 -2.81 -0.04 0.00 0.10 0.00 0.00 34.13 31.38 2f52 s GLU 50 CO 0.00 0.11 0.13 0.42 0.02 0.00 0.00 175.26 175.94 2f52 s ILE 51 N -2.16 5.06 -0.20 -1.63 1.01 -1.26 -0.99 121.20 121.04 2f52 s ILE 51 Ca 0.43 0.08 -0.04 0.00 0.00 0.00 0.00 60.65 61.13 2f52 s ILE 51 Cb -0.09 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 39.01 2f52 s ILE 51 CO 0.31 0.35 -0.04 0.68 0.00 0.00 0.00 174.94 176.23 2f52 s VAL 52 N 1.13 3.52 -0.85 2.92 -7.23 0.08 -4.87 120.40 115.10 2f52 s VAL 52 Ca 0.06 -0.46 -0.17 0.00 -1.81 0.00 0.00 61.98 59.61 2f52 s VAL 52 Cb -0.14 -2.58 0.17 0.00 0.56 0.00 0.00 36.38 34.39 2f52 s VAL 52 CO 0.05 0.45 0.91 -1.61 -0.31 0.00 0.00 175.10 174.58 2f52 s GLU 53 N 1.09 3.54 0.37 4.82 2.02 -1.26 0.10 118.70 129.38 2f52 s GLU 53 Ca 0.01 -2.04 -0.00 0.00 0.02 0.00 0.00 54.97 52.96 2f52 s GLU 53 Cb -0.15 -4.62 0.07 0.00 0.10 0.00 0.00 34.13 29.54 2f52 s GLU 53 CO -0.00 -1.52 0.51 0.41 0.02 0.00 0.00 175.26 174.67 2f52 n GLY 54 N 4.76 0.65 0.39 -1.39 0.00 0.11 -4.87 105.19 104.84 2f52 n GLY 54 Ca 0.16 -1.99 -0.14 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.32 -1.10 -0.96 1.61 -1.24 -2.01 -1.51 115.58 110.05 2f52 h ASN 55 Ca -0.17 0.09 0.27 0.00 0.71 0.00 0.00 56.30 57.20 2f52 h ASN 55 Cb 0.61 0.37 -0.14 0.00 0.73 0.00 0.00 38.32 39.90 2f52 h ASN 55 CO 0.18 -0.50 0.49 0.03 -1.29 0.00 0.00 177.43 176.34 2f52 h ARG 56 N -0.75 0.39 0.00 6.67 3.08 -2.00 -3.47 114.38 118.30 2f52 h ARG 56 Ca -0.04 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2f52 h ARG 56 Cb 0.66 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2f52 h ARG 56 CO -0.08 0.26 0.00 0.41 -1.07 0.00 0.00 179.97 179.49 2f52 n GLY 57 N -1.32 -0.06 3.77 0.04 0.00 -0.57 -5.12 105.19 101.93 2f52 n GLY 57 Ca 0.27 -1.40 -0.38 0.00 0.00 0.00 0.00 46.02 44.51 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 4.14 0.24 1.61 0.04 -1.25 0.05 135.00 137.83 2f52 s PRO 58 Ca 0.00 1.75 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 2f52 s PRO 58 Cb 0.00 -2.70 -0.03 0.00 0.04 0.00 0.00 34.50 31.81 2f52 s PRO 58 CO 0.00 -0.22 0.22 -0.65 0.04 0.00 0.00 177.00 176.39 2f52 s GLN 59 N -2.25 1.39 0.03 4.56 -0.21 0.28 -3.84 119.66 119.62 2f52 s GLN 59 Ca 0.56 -1.67 -0.12 0.00 0.02 0.00 0.00 55.36 54.15 2f52 s GLN 59 Cb -0.29 0.31 -0.06 0.00 1.00 0.00 0.00 33.01 33.98 2f52 s GLN 59 CO 0.36 -0.49 0.38 0.00 -2.12 0.00 0.00 175.29 173.42 2f52 s ALA 60 N -3.93 3.73 0.14 6.09 0.00 0.45 -0.74 121.76 127.49 2f52 s ALA 60 Ca 0.37 -0.33 0.09 0.00 0.00 0.00 0.00 51.96 52.09 2f52 s ALA 60 Cb 0.05 -2.30 -0.04 0.00 0.00 0.00 0.00 23.12 20.83 2f52 s ALA 60 CO 0.15 0.53 -0.20 0.00 0.00 0.00 0.00 175.76 176.25 2f52 s ALA 61 N -1.23 1.99 -0.63 0.00 0.00 -0.16 -4.71 121.76 117.01 2f52 s ALA 61 Ca 0.28 -1.41 -0.15 0.00 0.00 0.00 0.00 51.96 50.69 2f52 s ALA 61 Cb -0.15 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.76 2f52 s ALA 61 CO 0.15 0.31 0.58 -1.71 0.00 0.00 0.00 175.76 175.10 2f52 n ASN 62 N 0.63 -4.70 -4.71 0.00 5.15 -1.26 -1.69 115.26 108.69 2f52 n ASN 62 Ca -0.16 -0.62 -0.40 0.00 -0.60 0.00 0.00 54.58 52.80 2f52 n ASN 62 Cb 0.55 -1.48 -0.05 0.00 -0.53 0.00 0.00 39.78 38.28 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 5.05 -0.21 3.44 1.01 -0.34 -3.71 120.40 123.34 2f52 s VAL 63 Ca 0.14 1.41 -0.02 0.00 0.00 0.00 0.00 61.98 63.51 2f52 s VAL 63 Cb -0.01 -4.02 0.01 0.00 0.00 0.00 0.00 36.38 32.35 2f52 s VAL 63 CO 0.83 0.24 -0.11 -0.89 0.00 0.00 0.00 175.10 175.17 2f52 s THR 64 N 0.93 2.80 -0.40 3.92 2.01 0.13 -3.96 115.64 121.08 2f52 s THR 64 Ca 0.36 -0.72 -0.28 0.00 0.31 0.00 0.00 61.69 61.36 2f52 s THR 64 Cb -0.17 -2.26 -0.01 0.00 0.01 0.00 0.00 72.50 70.06 2f52 s THR 64 CO 0.17 0.45 1.73 -0.54 -0.69 0.00 0.00 174.62 175.74 2f52 s LYS 65 N 1.39 3.26 0.56 4.92 1.02 -1.26 -0.71 119.74 128.91 2f52 s LYS 65 Ca 0.05 1.19 -0.05 0.00 0.02 0.00 0.00 55.97 57.18 2f52 s LYS 65 Cb -0.14 -4.20 0.00 0.00 -0.52 0.00 0.00 37.83 32.98 2f52 s LYS 65 CO -0.07 -1.95 0.85 -1.21 -0.92 0.00 0.00 175.35 172.05 2f52 s GLU 66 N 5.75 3.03 0.00 1.68 2.02 0.77 -4.96 118.70 126.98 2f52 s GLU 66 Ca 0.74 -0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.68 2f52 s GLU 66 Cb -0.19 -2.33 0.00 0.00 0.10 0.00 0.00 34.13 31.71 2f52 s GLU 66 CO 0.31 -0.57 0.00 0.00 0.02 0.00 0.00 175.26 175.02