#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 3.47 0.03 4.03 1.02 -0.69 -4.93 118.68 121.61 2f52 s LEU 2 Ca 0.00 -0.52 0.06 0.00 0.02 0.00 0.00 54.13 53.69 2f52 s LEU 2 Cb 0.00 -2.00 -0.02 0.00 0.02 0.00 0.00 46.19 44.19 2f52 s LEU 2 CO 0.00 -0.13 -0.16 -1.61 0.02 0.00 0.00 176.35 174.47 2f52 s GLU 3 N -3.81 1.14 0.03 1.70 2.02 -1.26 0.04 118.70 118.56 2f52 s GLU 3 Ca 0.35 -0.77 -0.00 0.00 0.02 0.00 0.00 54.97 54.56 2f52 s GLU 3 Cb -0.06 -1.17 -0.03 0.00 0.10 0.00 0.00 34.13 32.97 2f52 s GLU 3 CO 0.23 0.30 -0.03 0.20 0.02 0.00 0.00 175.26 175.98 2f52 s GLY 4 N -0.99 0.32 -0.11 -1.39 0.00 0.40 -4.26 107.32 101.29 2f52 s GLY 4 Ca 0.04 -0.80 -0.04 0.00 0.00 0.00 0.00 44.72 43.92 2f52 s GLY 4 CO 0.01 -0.88 0.06 0.54 0.00 0.00 0.00 173.10 172.83 2f52 s LYS 5 N -2.30 3.23 -0.37 2.90 1.02 0.41 -1.01 119.74 123.62 2f52 s LYS 5 Ca -0.08 -0.30 -0.29 0.00 0.02 0.00 0.00 55.97 55.33 2f52 s LYS 5 Cb -0.04 -2.98 -0.00 0.00 -0.52 0.00 0.00 37.83 34.29 2f52 s LYS 5 CO -0.04 0.70 1.60 0.08 -0.92 0.00 0.00 175.35 176.77 2f52 s VAL 6 N -0.85 3.70 0.05 3.17 1.01 -0.93 0.15 120.40 126.71 2f52 s VAL 6 Ca 0.13 0.71 0.02 0.00 0.00 0.00 0.00 61.98 62.84 2f52 s VAL 6 Cb -0.12 -3.94 -0.25 0.00 0.00 0.00 0.00 36.38 32.08 2f52 s VAL 6 CO 0.03 -0.60 1.04 0.07 0.00 0.00 0.00 175.10 175.64 2f52 h LYS 7 N 11.73 0.13 -3.02 2.72 2.10 -1.17 1.92 116.57 130.99 2f52 h LYS 7 Ca -0.31 -0.23 -0.03 0.00 -2.00 0.00 0.00 60.65 58.08 2f52 h LYS 7 Cb 1.14 0.09 -0.13 0.00 -0.90 0.00 0.00 32.23 32.42 2f52 h LYS 7 CO 1.06 1.01 0.15 -0.46 -2.00 0.00 0.00 179.45 179.21 2f52 s TRP 8 N -2.65 -0.48 -0.28 0.07 -0.00 -1.06 -4.76 118.94 109.78 2f52 s TRP 8 Ca -0.04 0.29 -0.18 0.00 -0.00 0.00 0.00 56.10 56.17 2f52 s TRP 8 Cb 0.08 0.49 0.09 0.00 -0.00 0.00 0.00 33.47 34.12 2f52 s TRP 8 CO 0.84 -0.80 0.74 -0.59 -0.00 0.00 0.00 176.95 177.14 2f52 s PHE 9 N -3.58 -0.94 -0.10 5.86 -0.71 -1.26 0.44 117.98 117.69 2f52 s PHE 9 Ca 0.00 1.97 0.01 0.00 -1.04 0.00 0.00 56.93 57.87 2f52 s PHE 9 Cb -0.00 0.52 0.02 0.00 -1.21 0.00 0.00 43.02 42.35 2f52 s PHE 9 CO -0.11 -0.46 -0.11 1.21 -1.34 0.00 0.00 175.22 174.41 2f52 s ASN 10 N 1.29 2.15 0.39 1.98 2.47 -0.96 -4.92 114.94 117.33 2f52 s ASN 10 Ca -0.07 -0.34 0.26 0.00 0.42 0.00 0.00 52.86 53.13 2f52 s ASN 10 Cb -0.05 -0.91 0.76 0.00 -1.45 0.00 0.00 41.25 39.61 2f52 s ASN 10 CO -0.15 -0.05 1.75 0.28 -3.72 0.00 0.00 177.10 175.21 2f52 h SER 11 N 7.72 0.00 0.61 -4.21 0.02 -1.94 -1.93 113.55 113.82 2f52 h SER 11 Ca -0.31 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.61 2f52 h SER 11 Cb 1.15 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.70 2f52 h SER 11 CO 0.45 0.00 -0.30 -0.33 -1.14 0.00 0.00 176.83 175.51 2f52 h GLU 12 N 0.00 -0.80 -0.43 3.45 5.08 -1.94 -2.72 114.58 117.23 2f52 h GLU 12 Ca 0.00 0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 2f52 h GLU 12 Cb 0.75 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2f52 h GLU 12 CO 0.00 -0.53 -0.08 0.87 -1.00 0.00 0.00 179.01 178.27 2f52 h LYS 13 N -0.83 0.81 0.00 2.33 1.57 -1.99 -3.47 116.57 115.00 2f52 h LYS 13 Ca -0.08 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2f52 h LYS 13 Cb 0.64 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.90 2f52 h LYS 13 CO 0.13 0.92 0.00 0.41 -0.57 0.00 0.00 179.45 180.34 2f52 n GLY 14 N -0.24 1.01 3.29 3.86 0.00 -0.73 -5.07 105.19 107.31 2f52 n GLY 14 Ca -0.01 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 1.49 0.27 1.61 -0.71 -1.17 -3.10 117.98 114.37 2f52 s PHE 15 Ca 0.00 -1.38 0.02 0.00 -1.04 0.00 0.00 56.93 54.53 2f52 s PHE 15 Cb 0.00 -0.77 -0.04 0.00 -1.21 0.00 0.00 43.02 41.00 2f52 s PHE 15 CO 0.00 -0.56 0.15 0.20 -1.34 0.00 0.00 175.22 173.66 2f52 s GLY 16 N -3.31 1.84 -0.07 1.99 0.00 -0.82 -2.28 107.32 104.67 2f52 s GLY 16 Ca 0.37 -1.79 0.05 0.00 0.00 0.00 0.00 44.72 43.35 2f52 s GLY 16 CO 0.17 -1.53 -0.24 -1.36 0.00 0.00 0.00 173.10 170.14 2f52 s PHE 17 N -3.78 2.51 0.19 1.90 0.08 0.17 -1.43 117.98 117.62 2f52 s PHE 17 Ca 0.37 -0.78 0.11 0.00 0.12 0.00 0.00 56.93 56.75 2f52 s PHE 17 Cb 0.06 -1.65 -0.04 0.00 -0.57 0.00 0.00 43.02 40.82 2f52 s PHE 17 CO 0.16 -0.25 -0.23 0.42 -0.10 0.00 0.00 175.22 175.21 2f52 s ILE 18 N -0.02 2.27 -0.17 0.64 1.01 -0.83 -0.61 121.20 123.48 2f52 s ILE 18 Ca -0.08 -2.02 0.00 0.00 0.00 0.00 0.00 60.65 58.56 2f52 s ILE 18 Cb -0.15 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.25 2f52 s ILE 18 CO 0.05 -0.15 -0.17 -0.70 0.00 0.00 0.00 174.94 173.97 2f52 s GLU 19 N -2.69 3.13 -0.26 2.79 2.56 0.41 -1.67 118.70 122.96 2f52 s GLU 19 Ca 0.20 -0.78 -0.17 0.00 0.00 0.00 0.00 54.97 54.22 2f52 s GLU 19 Cb -0.08 -2.62 -0.03 0.00 2.00 0.00 0.00 34.13 33.40 2f52 s GLU 19 CO 0.09 -0.09 0.46 0.08 -0.56 0.00 0.00 175.26 175.25 2f52 s VAL 20 N 1.05 5.11 -0.33 3.70 1.01 -1.25 -0.44 120.40 129.24 2f52 s VAL 20 Ca -0.01 0.77 -0.28 0.00 0.00 0.00 0.00 61.98 62.46 2f52 s VAL 20 Cb -0.14 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2f52 s VAL 20 CO -0.05 0.12 1.86 -1.61 0.00 0.00 0.00 175.10 175.41 2f52 s GLU 21 N 2.20 3.26 0.00 2.72 2.02 -1.26 -1.81 118.70 125.83 2f52 s GLU 21 Ca 0.19 1.45 0.00 0.00 0.02 0.00 0.00 54.97 56.63 2f52 s GLU 21 Cb -0.16 -4.23 0.00 0.00 0.10 0.00 0.00 34.13 29.84 2f52 s GLU 21 CO 0.09 -1.95 0.00 0.41 0.02 0.00 0.00 175.26 173.83 2f52 n GLY 22 N 5.48 1.63 3.33 -1.39 0.00 -1.26 -5.05 105.19 107.92 2f52 n GLY 22 Ca 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 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 1.32 0.63 1.61 -0.21 -0.75 -5.14 119.66 117.12 2f52 s GLN 23 Ca 0.00 -1.65 -0.10 0.00 0.02 0.00 0.00 55.36 53.63 2f52 s GLN 23 Cb 0.00 -0.66 0.15 0.00 1.00 0.00 0.00 33.01 33.50 2f52 s GLN 23 CO 0.00 -0.06 0.34 -0.25 -2.12 0.00 0.00 175.29 173.19 2f52 n ASP 24 N -0.40 -2.63 -4.77 5.90 8.00 -1.26 -4.34 116.55 117.06 2f52 n ASP 24 Ca -0.06 -0.34 -0.39 0.00 0.71 0.00 0.00 54.79 54.71 2f52 n ASP 24 Cb 0.63 -0.45 -0.04 0.00 -0.02 0.00 0.00 41.12 41.25 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 -2.19 7.06 -0.21 -2.24 1.47 -1.26 -3.96 116.67 115.34 2f52 s ASP 25 Ca 0.26 2.22 -0.00 0.00 1.18 0.00 0.00 52.55 56.21 2f52 s ASP 25 Cb -0.05 -2.61 0.02 0.00 -0.34 0.00 0.00 42.92 39.94 2f52 s ASP 25 CO 0.22 -0.29 -0.14 -0.69 0.68 0.00 0.00 175.17 174.95 2f52 s VAL 26 N -1.32 2.42 0.61 2.11 1.01 -0.67 -4.74 120.40 119.82 2f52 s VAL 26 Ca 0.49 -0.96 -0.15 0.00 0.00 0.00 0.00 61.98 61.37 2f52 s VAL 26 Cb -0.29 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2f52 s VAL 26 CO 0.37 0.40 1.05 0.72 0.00 0.00 0.00 175.10 177.64 2f52 s PHE 27 N 1.31 3.08 -0.01 5.22 -0.71 -1.19 -1.97 117.98 123.71 2f52 s PHE 27 Ca 0.03 1.48 0.03 0.00 -1.04 0.00 0.00 56.93 57.42 2f52 s PHE 27 Cb -0.15 -2.95 -0.01 0.00 -1.21 0.00 0.00 43.02 38.71 2f52 s PHE 27 CO -0.09 -1.06 -0.08 0.08 -1.34 0.00 0.00 175.22 172.73 2f52 s VAL 28 N -2.63 0.66 0.12 -2.49 1.01 -0.51 0.09 120.40 116.65 2f52 s VAL 28 Ca 0.62 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.32 2f52 s VAL 28 Cb -0.15 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2f52 s VAL 28 CO 0.41 0.19 -0.13 -2.28 0.00 0.00 0.00 175.10 173.28 2f52 s HIS 29 N -0.19 2.65 0.22 5.22 2.46 -1.26 -1.94 115.29 122.44 2f52 s HIS 29 Ca 0.03 -0.21 -0.17 0.00 0.47 0.00 0.00 55.06 55.19 2f52 s HIS 29 Cb -0.03 -1.38 0.23 0.00 -0.13 0.00 0.00 32.58 31.26 2f52 s HIS 29 CO -0.00 0.42 1.58 0.27 -2.47 0.00 0.00 174.74 174.53 2f52 h PHE 30 N 3.61 -0.79 -0.02 3.88 -5.15 -1.84 2.01 116.94 118.64 2f52 h PHE 30 Ca -0.49 0.08 0.01 0.00 -0.20 0.00 0.00 57.97 57.36 2f52 h PHE 30 Cb 1.17 0.46 -0.00 0.00 0.22 0.00 0.00 35.95 37.80 2f52 h PHE 30 CO 0.61 -0.38 0.12 1.03 -2.00 0.00 0.00 178.31 177.69 2f52 h SER 31 N -0.07 0.00 0.81 -0.68 0.87 -1.94 0.12 113.55 112.66 2f52 h SER 31 Ca 0.31 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.85 2f52 h SER 31 Cb 0.58 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.53 2f52 h SER 31 CO -0.81 0.00 -0.13 0.00 -0.53 0.00 0.00 176.83 175.36 2f52 h ALA 32 N 1.77 1.06 -2.98 6.23 0.00 0.29 -3.43 119.26 122.20 2f52 h ALA 32 Ca 0.01 -0.12 -0.66 0.00 0.00 0.00 0.00 54.91 54.14 2f52 h ALA 32 Cb 0.26 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.93 2f52 h ALA 32 CO -0.00 0.16 -0.55 0.42 0.00 0.00 0.00 179.25 179.28 2f52 s ILE 33 N -3.78 4.95 0.17 0.00 1.09 0.40 0.11 121.20 124.15 2f52 s ILE 33 Ca -0.00 -0.20 -0.29 0.00 -1.10 0.00 0.00 60.65 59.06 2f52 s ILE 33 Cb 0.10 -3.22 -0.02 0.00 -1.06 0.00 0.00 42.46 38.26 2f52 s ILE 33 CO 0.59 0.45 1.54 1.56 -0.10 0.00 0.00 174.94 178.98 2f52 h GLN 34 N 4.42 -0.04 0.00 2.79 4.20 -1.82 -3.45 115.11 121.21 2f52 h GLN 34 Ca -0.51 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2f52 h GLN 34 Cb 1.20 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.98 2f52 h GLN 34 CO 0.61 -0.03 0.00 0.41 -0.67 0.00 0.00 178.83 179.15 2f52 n GLY 35 N -1.30 0.72 0.55 3.46 0.00 -1.26 -4.90 105.19 102.47 2f52 n GLY 35 Ca 0.03 0.00 0.35 0.00 0.00 0.00 0.00 46.02 46.39 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 3.84 0.00 0.00 1.61 4.81 -2.01 -3.32 114.58 119.51 2f52 h GLU 36 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2f52 h GLU 36 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2f52 h GLU 36 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.69 2f52 n GLY 37 N -1.74 0.00 2.39 1.92 0.00 -1.26 -5.04 105.19 101.46 2f52 n GLY 37 Ca 0.26 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.54 0.12 1.61 1.16 -1.25 -4.99 117.46 113.57 2f52 n PHE 38 Ca 0.00 -0.69 0.04 0.00 -1.87 0.00 0.00 57.45 54.93 2f52 n PHE 38 Cb 0.00 1.08 0.46 0.00 -1.61 0.00 0.00 39.48 39.41 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 0.92 0.27 -6.42 3.97 1.57 -1.93 -3.39 116.57 111.56 2f52 h LYS 39 Ca -0.42 -0.04 -0.56 0.00 -1.87 0.00 0.00 60.65 57.76 2f52 h LYS 39 Cb 1.19 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.40 2f52 h LYS 39 CO -0.15 0.29 1.13 0.99 -0.57 0.00 0.00 179.45 181.14 2f52 s THR 40 N -5.01 3.76 0.43 -0.16 2.01 -1.26 -4.77 115.64 110.65 2f52 s THR 40 Ca -0.06 0.74 -0.23 0.00 0.31 0.00 0.00 61.69 62.45 2f52 s THR 40 Cb 0.16 -4.14 -0.09 0.00 0.01 0.00 0.00 72.50 68.45 2f52 s THR 40 CO 0.72 -0.80 1.06 -0.76 -0.69 0.00 0.00 174.62 174.15 2f52 s LEU 41 N 6.08 4.03 0.02 4.42 1.02 -1.26 -5.04 118.68 127.95 2f52 s LEU 41 Ca 0.63 2.03 0.01 0.00 0.02 0.00 0.00 54.13 56.82 2f52 s LEU 41 Cb -0.14 -4.31 -0.04 0.00 0.02 0.00 0.00 46.19 41.72 2f52 s LEU 41 CO 0.30 -0.64 0.06 -1.61 0.02 0.00 0.00 176.35 174.49 2f52 s GLU 42 N -2.75 2.95 0.12 1.70 2.02 -1.26 -4.77 118.70 116.71 2f52 s GLU 42 Ca 0.61 -0.56 -0.31 0.00 0.02 0.00 0.00 54.97 54.73 2f52 s GLU 42 Cb -0.21 -2.78 -0.08 0.00 0.10 0.00 0.00 34.13 31.16 2f52 s GLU 42 CO 0.26 0.62 1.34 -2.00 0.02 0.00 0.00 175.26 175.51 2f52 s GLU 43 N -1.84 4.35 0.00 1.61 2.12 -1.26 -2.24 118.70 121.43 2f52 s GLU 43 Ca 0.23 2.02 0.00 0.00 0.36 0.00 0.00 54.97 57.58 2f52 s GLU 43 Cb -0.12 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 31.02 2f52 s GLU 43 CO 0.15 -0.37 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 2f52 n GLY 44 N 3.26 0.89 3.69 -1.50 0.00 0.65 -4.92 105.19 107.26 2f52 n GLY 44 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.66 4.40 0.37 1.61 2.00 -0.95 -4.65 119.66 121.78 2f52 s GLN 45 Ca 0.00 1.24 -0.26 0.00 -2.00 0.00 0.00 55.36 54.34 2f52 s GLN 45 Cb 0.00 -3.54 -0.09 0.00 0.80 0.00 0.00 33.01 30.18 2f52 s GLN 45 CO 0.00 -0.26 1.10 0.00 -0.50 0.00 0.00 175.29 175.63 2f52 s ALA 46 N 1.86 3.18 0.07 1.58 0.00 -1.26 -2.18 121.76 125.01 2f52 s ALA 46 Ca 0.45 0.84 -0.07 0.00 0.00 0.00 0.00 51.96 53.18 2f52 s ALA 46 Cb -0.18 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 2f52 s ALA 46 CO 0.17 -0.32 0.14 0.14 0.00 0.00 0.00 175.76 175.89 2f52 s VAL 47 N -1.46 0.15 0.17 0.00 -7.23 -0.18 -0.51 120.40 111.35 2f52 s VAL 47 Ca 0.55 -1.25 0.07 0.00 -1.81 0.00 0.00 61.98 59.53 2f52 s VAL 47 Cb -0.27 -1.28 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 2f52 s VAL 47 CO 0.35 -0.69 0.01 -0.94 -0.31 0.00 0.00 175.10 173.51 2f52 s SER 48 N -2.71 4.82 0.00 4.85 1.04 0.55 -0.45 113.70 121.80 2f52 s SER 48 Ca 0.03 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.09 2f52 s SER 48 Cb 0.04 -1.04 0.00 0.00 0.10 0.00 0.00 66.02 65.12 2f52 s SER 48 CO -0.09 0.09 0.00 2.22 0.98 0.00 0.00 173.24 176.44 2f52 n PHE 49 N -0.12 0.00 -3.68 5.02 1.16 0.11 -0.43 117.46 119.52 2f52 n PHE 49 Ca -0.10 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.28 2f52 n PHE 49 Cb 0.55 0.00 -0.02 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 2.89 -0.15 3.97 2.02 0.15 -1.70 118.70 123.88 2f52 s GLU 50 Ca 0.00 -1.18 -0.05 0.00 0.02 0.00 0.00 54.97 53.76 2f52 s GLU 50 Cb 0.00 -2.62 -0.03 0.00 0.10 0.00 0.00 34.13 31.58 2f52 s GLU 50 CO 0.00 0.09 0.01 0.42 0.02 0.00 0.00 175.26 175.80 2f52 s ILE 51 N -2.25 4.38 -0.07 -1.63 1.01 -1.26 0.36 121.20 121.74 2f52 s ILE 51 Ca 0.42 -0.19 0.05 0.00 0.00 0.00 0.00 60.65 60.93 2f52 s ILE 51 Cb -0.07 -2.93 -0.00 0.00 0.01 0.00 0.00 42.46 39.47 2f52 s ILE 51 CO 0.28 0.51 -0.23 0.68 0.00 0.00 0.00 174.94 176.18 2f52 s VAL 52 N 0.08 1.92 -1.18 2.92 -7.23 -0.72 -4.85 120.40 111.34 2f52 s VAL 52 Ca 0.03 -0.97 -0.17 0.00 -1.81 0.00 0.00 61.98 59.05 2f52 s VAL 52 Cb -0.13 -1.65 0.11 0.00 0.56 0.00 0.00 36.38 35.28 2f52 s VAL 52 CO 0.02 0.53 1.50 -0.70 -0.31 0.00 0.00 175.10 176.15 2f52 s GLU 53 N 0.09 3.93 0.85 4.82 2.12 -1.26 -0.53 118.70 128.72 2f52 s GLU 53 Ca -0.10 -2.08 -0.10 0.00 0.36 0.00 0.00 54.97 53.05 2f52 s GLU 53 Cb -0.15 -5.25 0.16 0.00 0.26 0.00 0.00 34.13 29.14 2f52 s GLU 53 CO 0.05 -2.00 1.18 0.20 -0.54 0.00 0.00 175.26 174.15 2f52 s GLY 54 N 3.71 1.76 0.18 -1.50 0.00 0.40 -4.83 107.32 107.03 2f52 s GLY 54 Ca 0.46 -1.31 -0.18 0.00 0.00 0.00 0.00 44.72 43.68 2f52 s GLY 54 CO 0.00 -0.66 1.63 3.45 0.00 0.00 0.00 173.10 177.53 2f52 h ASN 55 N -1.15 -0.69 -0.07 1.64 -1.07 -2.01 0.27 115.58 112.49 2f52 h ASN 55 Ca -0.42 0.16 -0.03 0.00 0.07 0.00 0.00 56.30 56.09 2f52 h ASN 55 Cb 1.26 0.38 -0.01 0.00 -2.07 0.00 0.00 38.32 37.88 2f52 h ASN 55 CO 0.43 -0.23 -0.01 0.03 0.07 0.00 0.00 177.43 177.71 2f52 h ARG 56 N -0.11 0.24 0.00 4.14 3.08 -1.98 -3.48 114.38 116.27 2f52 h ARG 56 Ca 0.21 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2f52 h ARG 56 Cb 0.44 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2f52 h ARG 56 CO -0.52 0.28 0.00 0.41 -1.07 0.00 0.00 179.97 179.08 2f52 n GLY 57 N -1.16 0.51 3.73 0.04 0.00 0.94 -5.09 105.19 104.17 2f52 n GLY 57 Ca -0.00 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.18 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 4.42 0.21 1.61 0.04 -1.24 0.15 135.00 138.19 2f52 s PRO 58 Ca 0.00 1.96 0.06 0.00 0.04 0.00 0.00 61.00 63.06 2f52 s PRO 58 Cb 0.00 -3.24 -0.05 0.00 0.04 0.00 0.00 34.50 31.26 2f52 s PRO 58 CO 0.00 -0.21 -0.11 -0.65 0.04 0.00 0.00 177.00 176.07 2f52 s GLN 59 N 0.12 1.31 -0.43 4.56 -0.21 0.32 -3.17 119.66 122.17 2f52 s GLN 59 Ca 0.56 -1.60 -0.20 0.00 0.02 0.00 0.00 55.36 54.14 2f52 s GLN 59 Cb -0.34 -0.98 0.02 0.00 1.00 0.00 0.00 33.01 32.71 2f52 s GLN 59 CO 0.36 0.11 0.62 0.00 -2.12 0.00 0.00 175.29 174.26 2f52 s ALA 60 N -3.09 3.36 0.22 6.09 0.00 0.11 -1.76 121.76 126.69 2f52 s ALA 60 Ca 0.23 -1.20 -0.05 0.00 0.00 0.00 0.00 51.96 50.93 2f52 s ALA 60 Cb 0.01 -3.27 -0.06 0.00 0.00 0.00 0.00 23.12 19.81 2f52 s ALA 60 CO 0.07 -1.73 0.48 0.00 0.00 0.00 0.00 175.76 174.58 2f52 s ALA 61 N 2.75 3.69 -0.51 0.00 0.00 0.16 -4.56 121.76 123.29 2f52 s ALA 61 Ca 0.22 -0.52 -0.29 0.00 0.00 0.00 0.00 51.96 51.36 2f52 s ALA 61 Cb -0.14 -2.24 0.04 0.00 0.00 0.00 0.00 23.12 20.78 2f52 s ALA 61 CO 0.18 0.46 0.65 0.09 0.00 0.00 0.00 175.76 177.15 2f52 n ASN 62 N -0.39 -5.81 -4.68 0.00 3.02 -1.24 -0.67 115.26 105.48 2f52 n ASN 62 Ca -0.02 -0.18 -0.38 0.00 -0.03 0.00 0.00 54.58 53.97 2f52 n ASN 62 Cb 0.53 -2.28 -0.07 0.00 -0.61 0.00 0.00 39.78 37.35 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 -1.90 5.16 -0.10 2.41 1.01 0.31 -3.42 120.40 123.88 2f52 s VAL 63 Ca 0.30 0.85 0.04 0.00 0.00 0.00 0.00 61.98 63.17 2f52 s VAL 63 Cb -0.04 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2f52 s VAL 63 CO 0.86 0.24 -0.23 -0.89 0.00 0.00 0.00 175.10 175.08 2f52 s THR 64 N 1.29 2.01 -0.34 3.92 2.01 0.42 -3.32 115.64 121.63 2f52 s THR 64 Ca 0.22 -0.99 -0.29 0.00 0.31 0.00 0.00 61.69 60.94 2f52 s THR 64 Cb -0.15 -1.74 0.01 0.00 0.01 0.00 0.00 72.50 70.63 2f52 s THR 64 CO 0.09 0.55 1.26 -0.54 -0.69 0.00 0.00 174.62 175.29 2f52 s LYS 65 N 0.34 3.87 0.46 4.92 1.02 -1.26 -0.33 119.74 128.75 2f52 s LYS 65 Ca -0.18 1.10 0.08 0.00 0.02 0.00 0.00 55.97 57.00 2f52 s LYS 65 Cb -0.18 -3.88 0.02 0.00 -0.52 0.00 0.00 37.83 33.28 2f52 s LYS 65 CO 0.08 -1.17 0.59 -1.21 -0.92 0.00 0.00 175.35 172.72 2f52 s GLU 66 N 4.22 2.67 0.00 1.68 0.41 0.33 -4.96 118.70 123.05 2f52 s GLU 66 Ca 0.54 -1.38 0.24 0.00 -0.41 0.00 0.00 54.97 53.97 2f52 s GLU 66 Cb -0.15 -2.68 0.20 0.00 -1.78 0.00 0.00 34.13 29.73 2f52 s GLU 66 CO 0.24 -0.39 1.26 0.00 -0.49 0.00 0.00 175.26 175.88