#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g47 s ALA 2 N 0.00 2.80 0.09 3.04 0.00 -1.26 -4.44 121.76 121.99 1g47 s ALA 2 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.11 1g47 s ALA 2 Cb 0.00 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 19.08 1g47 s ALA 2 CO 0.00 -2.76 0.00 -1.71 0.00 0.00 0.00 175.76 171.29 1g47 n ASN 3 N 10.50 -0.80 -1.23 0.00 5.15 -1.26 -4.96 115.26 122.66 1g47 n ASN 3 Ca 0.22 0.18 0.04 0.00 -0.60 0.00 0.00 54.58 54.42 1g47 n ASN 3 Cb 0.47 1.12 0.06 0.00 -0.53 0.00 0.00 39.78 40.91 1g47 n ASN 3 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1g47 n ALA 4 N -2.69 2.63 -3.55 5.20 0.00 -1.26 -5.02 120.51 115.82 1g47 n ALA 4 Ca 0.00 -2.50 -0.14 0.00 0.00 0.00 0.00 53.44 50.81 1g47 n ALA 4 Cb 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 19.45 18.70 1g47 n ALA 4 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1g47 s LEU 5 N -0.75 -0.34 0.00 0.00 2.34 -1.26 -4.99 118.68 113.68 1g47 s LEU 5 Ca 0.33 0.31 0.00 0.00 0.06 0.00 0.00 54.13 54.83 1g47 s LEU 5 Cb 0.36 0.74 0.00 0.00 -0.56 0.00 0.00 46.19 46.73 1g47 s LEU 5 CO -0.14 -0.28 0.00 0.00 -1.06 0.00 0.00 176.35 174.88 1g47 n ALA 6 N 5.35 0.00 -1.17 1.48 0.00 -1.26 -4.83 120.51 120.08 1g47 n ALA 6 Ca -0.06 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.52 1g47 n ALA 6 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 1g47 n ALA 6 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1g47 n SER 7 N -2.36 -6.93 -4.57 0.00 7.64 -1.26 -4.68 113.62 101.46 1g47 n SER 7 Ca 0.00 1.04 -0.28 0.00 1.01 0.00 0.00 58.87 60.64 1g47 n SER 7 Cb 0.00 -2.91 0.13 0.00 -1.01 0.00 0.00 64.21 60.41 1g47 n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g47 s ALA 8 N -2.01 2.77 0.22 -0.43 0.00 -1.26 -4.89 121.76 116.16 1g47 s ALA 8 Ca 0.00 -1.10 0.09 0.00 0.00 0.00 0.00 51.96 50.95 1g47 s ALA 8 Cb 0.00 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 1g47 s ALA 8 CO 0.00 -1.86 -0.16 0.95 0.00 0.00 0.00 175.76 174.69 1g47 s THR 9 N -3.56 1.92 0.97 0.00 -4.23 -1.26 -2.07 115.64 107.41 1g47 s THR 9 Ca 0.67 -2.22 -0.11 0.00 -1.18 0.00 0.00 61.69 58.85 1g47 s THR 9 Cb -0.07 -2.08 0.17 0.00 1.34 0.00 0.00 72.50 71.86 1g47 s THR 9 CO 0.49 -0.52 1.09 0.00 -0.54 0.00 0.00 174.62 175.14 1g47 h GLU 11 N -1.92 0.00 0.00 0.00 4.81 -1.75 -1.30 114.58 114.41 1g47 h GLU 11 Ca -0.50 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.66 1g47 h GLU 11 Cb 1.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 1g47 h GLU 11 CO 0.49 0.69 -0.54 0.07 -0.73 0.00 0.00 179.01 178.99 1g47 h ARG 12 N -1.00 0.00 0.00 1.92 -0.00 -1.84 -3.36 114.38 110.09 1g47 h ARG 12 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.86 1g47 h ARG 12 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.84 1g47 h ARG 12 CO -0.07 0.26 -1.05 0.00 -0.00 0.00 0.00 179.97 179.10 1g47 n LYS 14 N -1.56 -7.11 -3.16 0.00 4.01 -0.49 -4.81 118.16 105.03 1g47 n LYS 14 Ca -0.00 0.79 -0.40 0.00 -0.51 0.00 0.00 58.31 58.18 1g47 n LYS 14 Cb 0.08 -5.79 -0.07 0.00 -0.51 0.00 0.00 35.03 28.75 1g47 n LYS 14 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1g47 s GLY 15 N -3.24 1.93 -0.53 0.72 0.00 -1.26 -4.34 107.32 100.60 1g47 s GLY 15 Ca 0.57 -0.42 -0.26 0.00 0.00 0.00 0.00 44.72 44.60 1g47 s GLY 15 CO 0.71 1.30 2.44 0.61 0.00 0.00 0.00 173.10 178.15 1g47 n GLY 16 N 4.07 0.13 0.58 0.20 0.00 -1.26 -1.98 105.19 106.93 1g47 n GLY 16 Ca -0.02 0.69 -0.04 0.00 0.00 0.00 0.00 46.02 46.64 1g47 n GLY 16 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1g47 n PHE 17 N 15.60 -1.18 0.02 1.61 1.16 -0.88 -4.99 117.46 128.81 1g47 n PHE 17 Ca 0.39 -0.36 0.00 0.00 -1.87 0.00 0.00 57.45 55.61 1g47 n PHE 17 Cb 0.51 -0.07 0.00 0.00 -1.61 0.00 0.00 39.48 38.32 1g47 n PHE 17 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1g47 n ALA 18 N -2.82 0.00 -1.53 1.98 0.00 -1.26 -4.03 120.51 112.85 1g47 n ALA 18 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.05 1g47 n ALA 18 Cb 0.10 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.62 1g47 n ALA 18 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1g47 n PRO 19 N -2.59 0.77 0.16 0.00 -0.02 -1.26 -4.46 135.00 127.60 1g47 n PRO 19 Ca 0.00 0.32 0.11 0.00 -2.02 0.00 0.00 63.50 61.91 1g47 n PRO 19 Cb 0.00 -2.33 0.57 0.00 -0.02 0.00 0.00 33.50 31.72 1g47 n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g47 n ALA 20 N -2.19 1.13 0.06 3.55 0.00 -1.26 0.13 120.51 121.92 1g47 n ALA 20 Ca 0.14 0.18 -0.22 0.00 0.00 0.00 0.00 53.44 53.55 1g47 n ALA 20 Cb 0.49 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.47 1g47 n ALA 20 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1g47 h GLU 21 N 0.00 0.34 0.09 0.00 3.07 -2.02 -3.38 114.58 112.69 1g47 h GLU 21 Ca 0.00 -0.58 -0.33 0.00 -0.50 0.00 0.00 59.36 57.94 1g47 h GLU 21 Cb 0.05 0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 1g47 h GLU 21 CO 0.00 1.28 -1.83 0.87 -1.40 0.00 0.00 179.01 177.93 1g47 h LYS 22 N -0.16 0.20 -5.95 2.33 1.57 -1.68 -3.40 116.57 109.48 1g47 h LYS 22 Ca -0.27 -0.33 -0.57 0.00 -1.87 0.00 0.00 60.65 57.61 1g47 h LYS 22 Cb 1.87 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 34.24 1g47 h LYS 22 CO 0.14 1.00 0.18 -1.50 -0.57 0.00 0.00 179.45 178.70 1g47 s ILE 23 N -2.58 5.00 -0.18 1.86 -1.16 0.34 -4.32 121.20 120.16 1g47 s ILE 23 Ca -0.15 1.46 -0.05 0.00 -0.51 0.00 0.00 60.65 61.40 1g47 s ILE 23 Cb 0.07 -4.05 0.07 0.00 0.61 0.00 0.00 42.46 39.16 1g47 s ILE 23 CO 0.80 0.17 0.13 -0.69 -2.81 0.00 0.00 174.94 172.54 1g47 s VAL 24 N 1.36 -0.16 0.11 4.00 1.01 -0.06 -4.49 120.40 122.17 1g47 s VAL 24 Ca 0.36 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.17 1g47 s VAL 24 Cb -0.17 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 1g47 s VAL 24 CO 0.15 -0.27 0.29 0.21 0.00 0.00 0.00 175.10 175.49 1g47 s ASN 25 N 2.19 6.41 0.14 3.32 3.84 -1.26 0.17 114.94 129.75 1g47 s ASN 25 Ca 0.04 0.39 -0.24 0.00 0.21 0.00 0.00 52.86 53.26 1g47 s ASN 25 Cb -0.16 -2.01 0.07 0.00 -0.55 0.00 0.00 41.25 38.60 1g47 s ASN 25 CO -0.10 0.10 0.61 -0.94 -2.79 0.00 0.00 177.10 173.97 1g47 s SER 26 N -2.60 -0.58 -0.79 -4.21 1.04 -0.85 -4.93 113.70 100.78 1g47 s SER 26 Ca 0.37 0.07 -0.19 0.00 0.48 0.00 0.00 55.95 56.68 1g47 s SER 26 Cb -0.12 0.59 -0.20 0.00 0.10 0.00 0.00 66.02 66.39 1g47 s SER 26 CO 0.27 -0.93 2.01 0.59 0.98 0.00 0.00 173.24 176.16 1g47 n ASN 27 N -0.25 -0.20 0.00 7.02 4.13 -1.26 -1.98 115.26 122.72 1g47 n ASN 27 Ca -0.17 -0.03 0.00 0.00 1.68 0.00 0.00 54.58 56.05 1g47 n ASN 27 Cb 0.64 -0.64 0.00 0.00 -1.54 0.00 0.00 39.78 38.25 1g47 n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1g47 n GLY 28 N 4.92 1.68 0.00 7.41 0.00 -1.17 -0.82 105.19 117.21 1g47 n GLY 28 Ca 0.53 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1g47 n GLY 28 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1g47 n GLU 29 N 0.00 0.00 -4.06 1.61 2.13 -0.84 -3.97 120.64 115.51 1g47 n GLU 29 Ca 0.00 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.47 1g47 n GLU 29 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.64 1g47 n GLU 29 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1g47 s LEU 30 N 0.00 4.07 0.07 4.31 2.01 -1.26 -2.01 118.68 125.87 1g47 s LEU 30 Ca 0.00 0.30 -0.01 0.00 0.01 0.00 0.00 54.13 54.43 1g47 s LEU 30 Cb 0.00 -2.10 -0.04 0.00 0.01 0.00 0.00 46.19 44.06 1g47 s LEU 30 CO 0.00 0.36 -0.01 -0.31 1.01 0.00 0.00 176.35 177.39 1g47 s TYR 31 N -1.06 0.63 0.68 0.29 1.51 0.45 -1.85 117.35 118.00 1g47 s TYR 31 Ca 0.18 -1.09 0.04 0.00 -1.01 0.00 0.00 57.07 55.19 1g47 s TYR 31 Cb -0.12 -0.42 0.12 0.00 -0.11 0.00 0.00 41.96 41.43 1g47 s TYR 31 CO 0.07 -0.39 0.93 -1.01 -1.11 0.00 0.00 175.55 174.05 1g47 s HIS 32 N -3.92 1.26 -2.00 2.71 3.76 -1.26 -0.88 115.29 114.96 1g47 s HIS 32 Ca 0.11 -0.55 0.21 0.00 -0.15 0.00 0.00 55.06 54.68 1g47 s HIS 32 Cb 0.08 -2.62 1.27 0.00 1.11 0.00 0.00 32.58 32.42 1g47 s HIS 32 CO -0.07 -1.58 1.72 0.39 -0.85 0.00 0.00 174.74 174.35 1g47 n GLU 33 N -2.62 0.84 -2.71 1.40 4.71 -1.26 -3.37 120.64 117.62 1g47 n GLU 33 Ca 0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 57.16 57.23 1g47 n GLU 33 Cb 0.61 -1.40 0.07 0.00 -1.01 0.00 0.00 31.44 29.71 1g47 n GLU 33 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1g47 n GLN 34 N -0.90 1.15 0.00 3.49 0.00 -1.26 0.21 117.38 120.08 1g47 n GLN 34 Ca 0.16 -2.56 0.00 0.00 0.00 0.00 0.00 57.00 54.60 1g47 n GLN 34 Cb 0.07 -0.72 0.00 0.00 0.00 0.00 0.00 30.24 29.59 1g47 n GLN 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1g47 n PHE 36 N 0.00 1.22 -3.85 0.00 3.01 -1.26 -4.71 117.46 111.86 1g47 n PHE 36 Ca 0.00 0.12 -0.22 0.00 1.01 0.00 0.00 57.45 58.36 1g47 n PHE 36 Cb 0.10 -2.53 -0.05 0.00 -0.01 0.00 0.00 39.48 36.99 1g47 n PHE 36 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1g47 s VAL 37 N 11.94 2.68 -0.24 -4.37 -7.23 -1.26 0.86 120.40 122.79 1g47 s VAL 37 Ca 1.03 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 59.57 1g47 s VAL 37 Cb -0.32 -3.01 -0.05 0.00 0.56 0.00 0.00 36.38 33.56 1g47 s VAL 37 CO 0.27 -0.05 0.19 0.00 -0.31 0.00 0.00 175.10 175.20 1g47 n ALA 39 N 4.33 1.14 -0.01 0.00 0.00 0.27 0.13 120.51 126.37 1g47 n ALA 39 Ca -0.14 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.27 1g47 n ALA 39 Cb 0.52 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 1g47 n ALA 39 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1g47 n GLN 40 N -1.26 0.16 0.06 0.00 6.02 -1.26 -4.72 117.38 116.37 1g47 n GLN 40 Ca 0.00 0.06 0.12 0.00 -0.01 0.00 0.00 57.00 57.18 1g47 n GLN 40 Cb 0.02 -0.68 0.30 0.00 1.02 0.00 0.00 30.24 30.89 1g47 n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1g47 n PHE 42 N -1.99 0.00 -2.24 0.00 3.72 0.35 -4.86 117.46 112.43 1g47 n PHE 42 Ca 0.05 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.03 1g47 n PHE 42 Cb 0.41 -2.47 -0.03 0.00 -0.94 0.00 0.00 39.48 36.45 1g47 n PHE 42 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1g47 s GLN 43 N -2.58 4.39 0.17 -1.08 2.00 -1.26 -4.34 119.66 116.95 1g47 s GLN 43 Ca 0.00 2.01 -0.14 0.00 -2.00 0.00 0.00 55.36 55.23 1g47 s GLN 43 Cb 0.00 -3.23 -0.07 0.00 0.80 0.00 0.00 33.01 30.51 1g47 s GLN 43 CO 0.00 -0.28 0.57 -0.65 -0.50 0.00 0.00 175.29 174.43 1g47 s GLN 44 N 0.28 3.99 -0.42 1.67 -0.21 -1.26 -2.28 119.66 121.42 1g47 s GLN 44 Ca 0.58 0.51 0.02 0.00 0.02 0.00 0.00 55.36 56.49 1g47 s GLN 44 Cb -0.35 -2.89 0.15 0.00 1.00 0.00 0.00 33.01 30.92 1g47 s GLN 44 CO 0.35 0.45 0.27 -0.06 -2.12 0.00 0.00 175.29 174.18 1g47 s PHE 45 N -1.52 1.47 0.22 0.91 0.08 0.25 -4.94 117.98 114.45 1g47 s PHE 45 Ca 0.40 -2.19 -0.32 0.00 0.12 0.00 0.00 56.93 54.93 1g47 s PHE 45 Cb -0.15 -1.40 -0.13 0.00 -0.57 0.00 0.00 43.02 40.77 1g47 s PHE 45 CO 0.19 -0.79 1.49 -2.30 -0.10 0.00 0.00 175.22 173.72 1g47 n PRO 46 N 3.45 2.17 -3.00 0.24 -0.02 -1.26 -1.38 135.00 135.19 1g47 n PRO 46 Ca 0.15 0.77 -0.16 0.00 -2.02 0.00 0.00 63.50 62.25 1g47 n PRO 46 Cb 0.38 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.36 1g47 n PRO 46 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1g47 n GLU 47 N 2.55 -2.74 -0.00 -0.52 1.02 0.13 -4.80 120.64 116.28 1g47 n GLU 47 Ca 0.13 0.35 -0.15 0.00 -0.02 0.00 0.00 57.16 57.47 1g47 n GLU 47 Cb 0.31 -4.96 -0.14 0.00 -0.02 0.00 0.00 31.44 26.63 1g47 n GLU 47 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1g47 n GLY 48 N -0.89 -0.76 3.72 0.62 0.00 -0.48 -4.99 105.19 102.41 1g47 n GLY 48 Ca -0.03 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 1g47 n GLY 48 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1g47 n LEU 49 N -3.28 -2.56 0.00 0.99 0.00 -1.26 -4.96 117.00 105.92 1g47 n LEU 49 Ca -0.25 -1.01 0.00 0.00 0.00 0.00 0.00 56.01 54.76 1g47 n LEU 49 Cb 1.05 -2.25 0.00 0.00 0.00 0.00 0.00 43.42 42.22 1g47 n LEU 49 CO 0.44 0.43 0.00 2.22 0.00 0.00 0.00 177.39 180.48 1g47 n PHE 50 N -4.06 0.00 -3.14 1.96 1.16 -1.26 -4.94 117.46 107.18 1g47 n PHE 50 Ca -0.11 0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.20 1g47 n PHE 50 Cb 0.59 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.40 1g47 n PHE 50 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 1g47 n TYR 51 N 0.00 3.90 -0.77 2.97 4.01 -0.08 -4.94 117.16 122.24 1g47 n TYR 51 Ca 0.00 -4.06 -0.29 0.00 -0.16 0.00 0.00 57.90 53.39 1g47 n TYR 51 Cb 0.00 -0.52 0.21 0.00 -0.31 0.00 0.00 39.34 38.72 1g47 n TYR 51 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1g47 s GLU 52 N -3.06 -0.12 0.03 -0.72 2.56 -1.20 -1.82 118.70 114.37 1g47 s GLU 52 Ca 0.45 0.88 -0.14 0.00 0.00 0.00 0.00 54.97 56.16 1g47 s GLU 52 Cb 0.22 -1.64 0.02 0.00 2.00 0.00 0.00 34.13 34.73 1g47 s GLU 52 CO -0.08 -3.20 0.31 0.12 -0.56 0.00 0.00 175.26 171.85 1g47 s PHE 53 N -2.64 -0.13 0.12 5.30 5.36 -0.00 -4.68 117.98 121.30 1g47 s PHE 53 Ca 0.67 0.06 -0.31 0.00 -0.96 0.00 0.00 56.93 56.39 1g47 s PHE 53 Cb -0.23 0.10 -0.10 0.00 -0.34 0.00 0.00 43.02 42.46 1g47 s PHE 53 CO 0.61 -0.48 1.84 -2.00 -1.46 0.00 0.00 175.22 173.73 1g47 s GLU 54 N -2.26 4.14 0.00 10.12 -6.30 -1.08 -0.55 118.70 122.77 1g47 s GLU 54 Ca -0.07 2.59 0.00 0.00 -2.50 0.00 0.00 54.97 54.99 1g47 s GLU 54 Cb -0.02 -3.63 0.00 0.00 0.00 0.00 0.00 34.13 30.48 1g47 s GLU 54 CO -0.01 -0.85 0.00 0.41 0.02 0.00 0.00 175.26 174.83 1g47 n GLY 55 N 4.25 0.46 0.00 -1.50 0.00 -1.25 -4.82 105.19 102.32 1g47 n GLY 55 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1g47 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g47 n ARG 56 N -1.87 0.00 -3.65 1.61 5.12 0.29 -5.08 116.66 113.08 1g47 n ARG 56 Ca 0.00 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.90 1g47 n ARG 56 Cb 0.03 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.27 1g47 n ARG 56 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 1g47 s LYS 57 N -1.42 0.24 0.00 5.56 -2.85 -1.26 -2.48 119.74 117.54 1g47 s LYS 57 Ca 0.00 0.37 -0.09 0.00 -1.00 0.00 0.00 55.97 55.25 1g47 s LYS 57 Cb 0.00 0.07 0.00 0.00 -2.06 0.00 0.00 37.83 35.85 1g47 s LYS 57 CO 0.00 -0.04 0.17 0.71 0.10 0.00 0.00 175.35 176.28 1g47 s TYR 58 N 0.86 0.01 0.60 1.78 2.02 -0.76 0.95 117.35 122.82 1g47 s TYR 58 Ca -0.04 -0.10 0.09 0.00 -0.37 0.00 0.00 57.07 56.65 1g47 s TYR 58 Cb -0.04 -0.03 0.10 0.00 -0.40 0.00 0.00 41.96 41.60 1g47 s TYR 58 CO -0.12 -0.32 0.83 0.00 -1.57 0.00 0.00 175.55 174.37 1g47 n GLU 60 N -2.34 0.41 0.00 0.00 4.07 -1.26 -3.13 120.64 118.38 1g47 n GLU 60 Ca 0.17 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.27 1g47 n GLU 60 Cb 0.61 -1.04 0.00 0.00 -0.06 0.00 0.00 31.44 30.95 1g47 n GLU 60 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 1g47 n HIS 61 N -0.54 0.00 0.16 4.31 -0.00 -1.26 -1.93 115.22 115.96 1g47 n HIS 61 Ca 0.01 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 1g47 n HIS 61 Cb 0.00 -0.33 0.44 0.00 -0.00 0.00 0.00 29.99 30.10 1g47 n HIS 61 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.34 176.56 1g47 h ASP 62 N 0.00 0.12 0.34 0.26 1.82 -1.96 -2.62 116.42 114.38 1g47 h ASP 62 Ca 0.00 -0.02 -0.23 0.00 -0.39 0.00 0.00 57.03 56.38 1g47 h ASP 62 Cb 0.00 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 39.98 1g47 h ASP 62 CO 0.00 0.30 -0.97 -0.26 -1.61 0.00 0.00 179.24 176.70 1g47 h PHE 63 N 0.13 0.62 0.00 0.28 -1.00 -1.73 -2.94 116.94 112.30 1g47 h PHE 63 Ca 0.03 -0.35 -0.06 0.00 2.81 0.00 0.00 57.97 60.40 1g47 h PHE 63 Cb 0.36 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.84 1g47 h PHE 63 CO 0.00 1.17 -0.27 -0.56 -1.61 0.00 0.00 178.31 177.05 1g47 h GLN 64 N 0.23 0.00 -0.59 1.51 3.07 -1.09 -1.61 115.11 116.62 1g47 h GLN 64 Ca -0.09 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.61 1g47 h GLN 64 Cb 1.61 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 29.15 1g47 h GLN 64 CO 0.17 0.27 0.18 0.52 0.09 0.00 0.00 178.83 180.06 1g47 h MET 65 N 0.00 0.93 0.00 0.06 2.86 -1.35 0.74 114.93 118.17 1g47 h MET 65 Ca -0.00 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.42 1g47 h MET 65 Cb 0.66 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.18 1g47 h MET 65 CO 0.03 0.83 -0.09 -0.07 1.06 0.00 0.00 176.91 178.68 1g47 h LEU 66 N 0.84 0.00 0.48 1.22 3.38 -1.20 -3.46 115.31 116.59 1g47 h LEU 66 Ca 0.19 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.95 1g47 h LEU 66 Cb 0.29 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 1g47 h LEU 66 CO -0.01 0.09 -0.19 0.33 0.09 0.00 0.00 178.44 178.75 1g47 n PHE 67 N -3.30 0.00 -3.27 1.13 7.35 0.25 -3.76 117.46 115.86 1g47 n PHE 67 Ca -0.01 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.55 1g47 n PHE 67 Cb 0.29 -2.02 0.01 0.00 0.35 0.00 0.00 39.48 38.11 1g47 n PHE 67 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1g47 n ALA 68 N 1.19 -2.66 0.18 3.13 0.00 -1.22 -4.80 120.51 116.32 1g47 n ALA 68 Ca -0.10 0.21 0.06 0.00 0.00 0.00 0.00 53.44 53.61 1g47 n ALA 68 Cb 0.37 -1.85 0.30 0.00 0.00 0.00 0.00 19.45 18.27 1g47 n ALA 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1g47 n PRO 69 N -1.50 0.07 -0.58 0.00 -0.04 -1.25 -5.19 135.00 126.51 1g47 n PRO 69 Ca -0.07 0.50 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 1g47 n PRO 69 Cb 0.57 -1.70 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1g47 n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46