#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g47 n ALA 2 N 0.00 0.00 -2.46 -5.12 0.00 -1.26 -4.59 120.51 107.08 1g47 n ALA 2 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1g47 n ALA 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1g47 n ALA 2 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1g47 s ASN 3 N -4.00 7.24 0.00 0.00 3.84 -1.26 -4.82 114.94 115.94 1g47 s ASN 3 Ca 0.00 1.89 0.00 0.00 0.21 0.00 0.00 52.86 54.96 1g47 s ASN 3 Cb 0.00 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 38.12 1g47 s ASN 3 CO 0.00 -0.33 0.03 0.00 -2.79 0.00 0.00 177.10 174.01 1g47 n ALA 4 N 3.60 0.72 -2.69 1.71 0.00 -1.26 -5.06 120.51 117.54 1g47 n ALA 4 Ca 0.06 -0.03 -0.42 0.00 0.00 0.00 0.00 53.44 53.06 1g47 n ALA 4 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 1g47 n ALA 4 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1g47 s LEU 5 N 0.00 3.82 0.31 0.00 1.02 -1.26 -4.83 118.68 117.74 1g47 s LEU 5 Ca 0.00 -1.04 0.09 0.00 0.02 0.00 0.00 54.13 53.19 1g47 s LEU 5 Cb 0.00 -2.50 0.49 0.00 0.02 0.00 0.00 46.19 44.20 1g47 s LEU 5 CO 0.00 -1.55 1.71 0.00 0.02 0.00 0.00 176.35 176.53 1g47 h ALA 6 N 9.69 1.14 -0.87 4.21 0.00 -1.99 -3.48 119.26 127.96 1g47 h ALA 6 Ca -0.11 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1g47 h ALA 6 Cb 1.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1g47 h ALA 6 CO 1.27 0.59 0.00 -1.13 0.00 0.00 0.00 179.25 179.98 1g47 n SER 7 N -4.00 -2.61 -4.76 0.00 3.41 -1.26 -4.56 113.62 99.83 1g47 n SER 7 Ca -0.02 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.21 1g47 n SER 7 Cb 0.49 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1g47 n SER 7 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1g47 s ALA 8 N -1.74 3.12 0.19 7.33 0.00 -1.26 -4.91 121.76 124.50 1g47 s ALA 8 Ca 0.00 1.22 0.09 0.00 0.00 0.00 0.00 51.96 53.26 1g47 s ALA 8 Cb 0.00 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1g47 s ALA 8 CO 0.00 -0.93 -0.17 0.95 0.00 0.00 0.00 175.76 175.61 1g47 s THR 9 N -1.32 1.88 0.96 0.00 -4.23 -1.26 -2.10 115.64 109.58 1g47 s THR 9 Ca 0.61 -2.07 -0.11 0.00 -1.18 0.00 0.00 61.69 58.94 1g47 s THR 9 Cb -0.37 -1.96 0.17 0.00 1.34 0.00 0.00 72.50 71.68 1g47 s THR 9 CO 0.47 -0.41 1.10 0.00 -0.54 0.00 0.00 174.62 175.24 1g47 h GLU 11 N -1.94 0.13 0.00 0.00 4.22 -1.58 -1.13 114.58 114.27 1g47 h GLU 11 Ca -0.49 -0.22 -0.04 0.00 0.08 0.00 0.00 59.36 58.69 1g47 h GLU 11 Cb 1.28 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 1g47 h GLU 11 CO 0.47 1.10 -1.04 0.07 -2.18 0.00 0.00 179.01 177.44 1g47 h ARG 12 N -0.66 0.00 0.00 1.92 -0.00 -1.88 -3.38 114.38 110.38 1g47 h ARG 12 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.76 1g47 h ARG 12 Cb 1.45 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.42 1g47 h ARG 12 CO -0.01 0.07 -0.43 0.00 -0.00 0.00 0.00 179.97 179.59 1g47 n LYS 14 N -1.22 -1.87 -2.55 0.00 -0.00 -0.43 -4.78 118.16 107.31 1g47 n LYS 14 Ca 0.00 0.79 -0.43 0.00 -0.00 0.00 0.00 58.31 58.67 1g47 n LYS 14 Cb 0.01 -5.34 -0.02 0.00 -0.00 0.00 0.00 35.03 29.68 1g47 n LYS 14 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1g47 s GLY 15 N -2.10 1.87 -0.51 2.58 0.00 -1.26 -4.16 107.32 103.74 1g47 s GLY 15 Ca 0.00 0.38 -0.26 0.00 0.00 0.00 0.00 44.72 44.84 1g47 s GLY 15 CO 0.00 2.25 2.42 0.61 0.00 0.00 0.00 173.10 178.38 1g47 n GLY 16 N 3.39 0.16 0.00 0.20 0.00 -1.26 -2.02 105.19 105.65 1g47 n GLY 16 Ca 0.12 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.78 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 16.09 -1.46 0.04 1.61 1.16 -0.89 -4.99 117.46 129.02 1g47 n PHE 17 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.96 1g47 n PHE 17 Cb 0.54 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.41 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 -3.00 0.00 -1.70 1.98 0.00 -1.26 -4.44 120.51 112.08 1g47 n ALA 18 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 1g47 n ALA 18 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 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 -2.71 1.57 0.24 0.00 -0.02 -1.26 -4.48 135.00 128.34 1g47 n PRO 19 Ca 0.00 0.58 0.18 0.00 -2.02 0.00 0.00 63.50 62.23 1g47 n PRO 19 Cb 0.00 -2.43 0.87 0.00 -0.02 0.00 0.00 33.50 31.92 1g47 n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g47 h ALA 20 N 1.39 1.65 -0.04 3.55 0.00 -2.01 1.36 119.26 125.15 1g47 h ALA 20 Ca -0.49 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.25 1g47 h ALA 20 Cb 1.32 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1g47 h ALA 20 CO 0.56 -0.29 -0.68 0.93 0.00 0.00 0.00 179.25 179.78 1g47 h GLU 21 N 0.00 0.20 0.00 0.00 4.39 -2.01 -3.23 114.58 113.94 1g47 h GLU 21 Ca 0.07 -0.16 -0.18 0.00 0.34 0.00 0.00 59.36 59.43 1g47 h GLU 21 Cb 0.50 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.14 1g47 h GLU 21 CO -0.00 0.80 -2.06 1.63 -1.16 0.00 0.00 179.01 178.22 1g47 n LYS 22 N -3.81 0.67 -3.38 2.33 5.02 0.52 -3.74 118.16 115.77 1g47 n LYS 22 Ca -0.02 -0.05 -0.40 0.00 -2.02 0.00 0.00 58.31 55.81 1g47 n LYS 22 Cb 0.67 -1.57 -0.09 0.00 -0.02 0.00 0.00 35.03 34.02 1g47 n LYS 22 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1g47 s ILE 23 N -3.00 5.16 -0.48 -0.18 -1.09 0.44 -4.08 121.20 117.97 1g47 s ILE 23 Ca -0.08 0.23 0.05 0.00 -2.23 0.00 0.00 60.65 58.62 1g47 s ILE 23 Cb 0.10 -3.80 0.19 0.00 -1.58 0.00 0.00 42.46 37.37 1g47 s ILE 23 CO 0.86 -0.03 0.43 0.52 -1.23 0.00 0.00 174.94 175.49 1g47 n VAL 24 N 5.23 -0.35 -2.83 2.92 0.31 0.86 -4.54 118.33 119.93 1g47 n VAL 24 Ca -0.09 -3.92 -0.38 0.00 -0.01 0.00 0.00 64.34 59.95 1g47 n VAL 24 Cb 0.50 -1.84 -0.06 0.00 -0.91 0.00 0.00 33.84 31.53 1g47 n VAL 24 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1g47 s ASN 25 N -0.62 7.38 -0.20 4.52 2.47 -1.26 -1.69 114.94 125.54 1g47 s ASN 25 Ca 0.32 1.80 -0.27 0.00 0.42 0.00 0.00 52.86 55.13 1g47 s ASN 25 Cb 0.05 -2.56 0.07 0.00 -1.45 0.00 0.00 41.25 37.37 1g47 s ASN 25 CO -0.17 0.01 0.73 -0.55 -3.72 0.00 0.00 177.10 173.40 1g47 s SER 26 N -1.50 -0.70 0.00 -4.21 0.15 -0.69 -4.90 113.70 101.85 1g47 s SER 26 Ca 0.46 1.16 0.00 0.00 0.70 0.00 0.00 55.95 58.27 1g47 s SER 26 Cb -0.20 1.11 0.00 0.00 -1.71 0.00 0.00 66.02 65.22 1g47 s SER 26 CO 0.25 -0.36 0.00 -0.46 1.20 0.00 0.00 173.24 173.87 1g47 n ASN 27 N 2.04 0.00 0.00 5.45 6.94 -1.26 -2.16 115.26 126.27 1g47 n ASN 27 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.41 1g47 n ASN 27 Cb 0.56 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.98 1g47 n ASN 27 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1g47 n GLY 28 N 0.00 0.45 4.01 4.83 0.00 -1.26 -4.79 105.19 108.43 1g47 n GLY 28 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1g47 n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g47 s GLU 29 N 0.00 2.04 0.03 1.61 2.02 -0.92 -5.10 118.70 118.39 1g47 s GLU 29 Ca 0.00 -1.36 0.08 0.00 0.02 0.00 0.00 54.97 53.71 1g47 s GLU 29 Cb 0.00 -2.50 -0.03 0.00 0.10 0.00 0.00 34.13 31.70 1g47 s GLU 29 CO 0.00 -1.11 -0.22 -0.51 0.02 0.00 0.00 175.26 173.45 1g47 s LEU 30 N -4.88 2.41 0.07 1.80 1.02 -1.26 -1.70 118.68 116.14 1g47 s LEU 30 Ca 0.64 -0.48 -0.07 0.00 0.02 0.00 0.00 54.13 54.24 1g47 s LEU 30 Cb -0.06 -1.42 -0.01 0.00 0.02 0.00 0.00 46.19 44.72 1g47 s LEU 30 CO 0.41 0.27 0.14 -0.31 0.02 0.00 0.00 176.35 176.88 1g47 s TYR 31 N -0.85 0.22 0.73 0.29 1.51 -0.68 -1.32 117.35 117.25 1g47 s TYR 31 Ca 0.13 -0.63 -0.01 0.00 -1.01 0.00 0.00 57.07 55.55 1g47 s TYR 31 Cb -0.10 -0.13 0.13 0.00 -0.11 0.00 0.00 41.96 41.75 1g47 s TYR 31 CO 0.03 -0.48 1.01 -1.01 -1.11 0.00 0.00 175.55 174.00 1g47 s HIS 32 N -3.56 1.50 -2.00 2.71 3.76 -1.26 -0.10 115.29 116.34 1g47 s HIS 32 Ca 0.03 -0.29 0.24 0.00 -0.15 0.00 0.00 55.06 54.88 1g47 s HIS 32 Cb 0.04 -3.01 1.41 0.00 1.11 0.00 0.00 32.58 32.12 1g47 s HIS 32 CO -0.09 -1.77 1.81 -0.85 -0.85 0.00 0.00 174.74 172.99 1g47 n GLU 33 N -2.87 0.82 -2.71 1.40 0.28 -1.25 -3.41 120.64 112.90 1g47 n GLU 33 Ca 0.15 0.00 -0.05 0.00 -0.16 0.00 0.00 57.16 57.11 1g47 n GLU 33 Cb 0.61 -1.45 0.09 0.00 1.43 0.00 0.00 31.44 32.12 1g47 n GLU 33 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1g47 n GLN 34 N -0.95 1.34 0.00 3.44 7.27 -1.26 -2.57 117.38 124.66 1g47 n GLN 34 Ca 0.18 -2.27 0.00 0.00 0.07 0.00 0.00 57.00 54.97 1g47 n GLN 34 Cb 0.08 -0.46 0.00 0.00 2.41 0.00 0.00 30.24 32.27 1g47 n GLN 34 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1g47 n PHE 36 N -0.58 0.98 -4.04 0.00 3.01 -1.26 -4.65 117.46 110.92 1g47 n PHE 36 Ca 0.00 0.42 -0.22 0.00 1.01 0.00 0.00 57.45 58.66 1g47 n PHE 36 Cb 0.00 -2.42 -0.05 0.00 -0.01 0.00 0.00 39.48 37.00 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 8.49 3.63 -0.21 -4.37 -7.23 -1.26 -1.37 120.40 118.08 1g47 s VAL 37 Ca 1.23 -1.55 -0.20 0.00 -1.81 0.00 0.00 61.98 59.65 1g47 s VAL 37 Cb -1.10 -3.13 -0.03 0.00 0.56 0.00 0.00 36.38 32.68 1g47 s VAL 37 CO 0.50 -0.25 0.58 0.00 -0.31 0.00 0.00 175.10 175.61 1g47 n ALA 39 N 5.04 0.93 -0.02 0.00 0.00 0.33 0.20 120.51 126.98 1g47 n ALA 39 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.38 1g47 n ALA 39 Cb 0.50 -0.86 -0.01 0.00 0.00 0.00 0.00 19.45 19.08 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 -1.35 0.21 0.03 0.00 6.02 -1.26 -4.69 117.38 116.34 1g47 n GLN 40 Ca 0.00 0.08 0.13 0.00 -0.01 0.00 0.00 57.00 57.20 1g47 n GLN 40 Cb 0.06 -0.80 0.37 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 -1.73 -0.20 -2.64 0.00 3.72 0.53 -4.84 117.46 112.32 1g47 n PHE 42 Ca 0.06 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.03 1g47 n PHE 42 Cb 0.37 -3.05 -0.03 0.00 -0.94 0.00 0.00 39.48 35.83 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 -3.48 4.50 0.37 -1.08 2.00 -1.26 -4.42 119.66 116.29 1g47 s GLN 43 Ca 0.00 1.49 -0.14 0.00 -2.00 0.00 0.00 55.36 54.71 1g47 s GLN 43 Cb 0.00 -3.46 -0.08 0.00 0.80 0.00 0.00 33.01 30.26 1g47 s GLN 43 CO 0.00 -0.17 0.78 -0.65 -0.50 0.00 0.00 175.29 174.75 1g47 s GLN 44 N 1.31 3.96 -0.04 1.67 -0.21 -1.26 -2.44 119.66 122.64 1g47 s GLN 44 Ca 0.53 0.67 0.01 0.00 0.02 0.00 0.00 55.36 56.59 1g47 s GLN 44 Cb -0.22 -2.38 0.02 0.00 1.00 0.00 0.00 33.01 31.43 1g47 s GLN 44 CO 0.26 0.06 -0.04 -0.06 -2.12 0.00 0.00 175.29 173.38 1g47 s PHE 45 N -2.15 0.69 -1.30 0.91 0.08 -0.47 -4.96 117.98 110.77 1g47 s PHE 45 Ca 0.54 -0.17 0.06 0.00 0.12 0.00 0.00 56.93 57.48 1g47 s PHE 45 Cb -0.10 -0.60 0.28 0.00 -0.57 0.00 0.00 43.02 42.02 1g47 s PHE 45 CO 0.22 -0.16 1.07 -0.35 -0.10 0.00 0.00 175.22 175.90 1g47 n PRO 46 N 3.90 0.06 0.01 0.24 -0.04 -1.26 -2.88 135.00 135.03 1g47 n PRO 46 Ca -0.24 0.28 0.22 0.00 -0.04 0.00 0.00 63.50 63.71 1g47 n PRO 46 Cb 0.51 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 33.20 1g47 n PRO 46 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1g47 h GLU 47 N 0.00 0.00 0.00 0.54 5.08 -1.95 -3.42 114.58 114.83 1g47 h GLU 47 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1g47 h GLU 47 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1g47 h GLU 47 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1g47 n GLY 48 N -1.59 0.50 3.19 -3.84 0.00 -1.06 -4.84 105.19 97.55 1g47 n GLY 48 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 1g47 n GLY 48 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g47 s LEU 49 N 0.00 -0.16 0.00 0.99 0.20 -1.26 -4.84 118.68 113.61 1g47 s LEU 49 Ca 0.00 0.17 0.00 0.00 0.69 0.00 0.00 54.13 54.99 1g47 s LEU 49 Cb 0.00 1.16 0.00 0.00 -0.43 0.00 0.00 46.19 46.92 1g47 s LEU 49 CO 0.00 -0.03 0.00 2.22 -0.29 0.00 0.00 176.35 178.25 1g47 n PHE 50 N 4.97 0.00 -1.63 5.38 1.16 -1.26 -4.98 117.46 121.09 1g47 n PHE 50 Ca -0.08 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.17 1g47 n PHE 50 Cb 0.55 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.43 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 2.40 -0.85 2.97 4.01 0.67 -4.99 117.16 121.38 1g47 n TYR 51 Ca 0.00 -2.23 -0.31 0.00 -0.16 0.00 0.00 57.90 55.20 1g47 n TYR 51 Cb 0.00 -1.27 0.15 0.00 -0.31 0.00 0.00 39.34 37.91 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 -3.04 1.18 0.34 -0.72 2.12 -1.22 -1.98 118.70 115.37 1g47 s GLU 52 Ca 0.55 1.36 -0.12 0.00 0.36 0.00 0.00 54.97 57.11 1g47 s GLU 52 Cb 0.41 -1.76 0.03 0.00 0.26 0.00 0.00 34.13 33.07 1g47 s GLU 52 CO -0.28 -2.46 0.65 -0.06 -0.54 0.00 0.00 175.26 172.57 1g47 s PHE 53 N -2.71 0.36 -0.11 5.30 0.08 -0.92 -4.79 117.98 115.19 1g47 s PHE 53 Ca 0.65 -0.84 -0.29 0.00 0.12 0.00 0.00 56.93 56.56 1g47 s PHE 53 Cb -0.21 0.48 -0.03 0.00 -0.57 0.00 0.00 43.02 42.68 1g47 s PHE 53 CO 0.58 -1.32 1.45 -1.21 -0.10 0.00 0.00 175.22 174.62 1g47 s GLU 54 N -3.00 4.21 0.00 0.44 8.01 -1.26 -2.39 118.70 124.71 1g47 s GLU 54 Ca 0.20 1.92 0.00 0.00 0.01 0.00 0.00 54.97 57.09 1g47 s GLU 54 Cb -0.03 -3.86 0.00 0.00 -4.31 0.00 0.00 34.13 25.92 1g47 s GLU 54 CO 0.13 -0.77 0.00 0.41 0.01 0.00 0.00 175.26 175.04 1g47 n GLY 55 N 3.86 0.08 3.27 -1.39 0.00 -1.26 -4.90 105.19 104.84 1g47 n GLY 55 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 1g47 n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g47 s ARG 56 N -1.65 1.60 -0.29 1.61 0.52 -1.01 -5.15 118.95 114.58 1g47 s ARG 56 Ca 0.00 -1.89 -0.16 0.00 -0.52 0.00 0.00 55.73 53.16 1g47 s ARG 56 Cb 0.00 0.32 0.15 0.00 0.52 0.00 0.00 34.95 35.94 1g47 s ARG 56 CO 0.00 -0.58 0.99 -1.59 0.02 0.00 0.00 175.30 174.14 1g47 s LYS 57 N -3.64 0.34 0.01 3.54 -2.85 -1.26 -2.16 119.74 113.71 1g47 s LYS 57 Ca 0.40 0.67 -0.06 0.00 -1.00 0.00 0.00 55.97 55.98 1g47 s LYS 57 Cb 0.04 0.20 -0.00 0.00 -2.06 0.00 0.00 37.83 36.01 1g47 s LYS 57 CO 0.23 -0.09 0.11 0.71 0.10 0.00 0.00 175.35 176.41 1g47 s TYR 58 N 1.73 0.10 0.54 1.78 2.02 -0.84 0.12 117.35 122.79 1g47 s TYR 58 Ca -0.07 -0.25 0.09 0.00 -0.37 0.00 0.00 57.07 56.47 1g47 s TYR 58 Cb -0.04 -0.08 0.09 0.00 -0.40 0.00 0.00 41.96 41.52 1g47 s TYR 58 CO -0.16 -0.29 0.74 0.00 -1.57 0.00 0.00 175.55 174.28 1g47 n GLU 60 N -2.17 0.47 0.00 0.00 4.07 -1.26 -3.25 120.64 118.50 1g47 n GLU 60 Ca 0.15 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.25 1g47 n GLU 60 Cb 0.55 -1.01 0.00 0.00 -0.06 0.00 0.00 31.44 30.92 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 -0.47 0.00 0.09 4.31 -0.00 -1.26 -2.09 115.22 115.80 1g47 n HIS 61 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 1g47 n HIS 61 Cb 0.01 -0.19 0.47 0.00 -0.00 0.00 0.00 29.99 30.27 1g47 n HIS 61 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 1g47 h ASP 62 N 0.00 0.30 0.30 0.26 3.32 -1.97 -2.51 116.42 116.13 1g47 h ASP 62 Ca 0.00 -0.02 -0.23 0.00 0.02 0.00 0.00 57.03 56.80 1g47 h ASP 62 Cb 0.00 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1g47 h ASP 62 CO 0.00 0.27 -0.94 -0.26 -1.72 0.00 0.00 179.24 176.59 1g47 h PHE 63 N 0.35 0.65 0.00 4.55 -1.00 -1.74 -2.92 116.94 116.83 1g47 h PHE 63 Ca 0.09 -0.35 -0.04 0.00 2.81 0.00 0.00 57.97 60.48 1g47 h PHE 63 Cb 0.06 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 1g47 h PHE 63 CO 0.00 1.17 -0.21 -0.56 -1.61 0.00 0.00 178.31 177.10 1g47 h GLN 64 N 0.25 0.00 -0.56 1.51 -0.00 -1.00 -1.42 115.11 113.88 1g47 h GLN 64 Ca -0.08 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.49 1g47 h GLN 64 Cb 1.57 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 29.03 1g47 h GLN 64 CO 0.16 0.21 0.05 0.52 -0.00 0.00 0.00 178.83 179.78 1g47 h MET 65 N 0.00 0.96 0.00 0.06 2.86 -1.33 0.16 114.93 117.64 1g47 h MET 65 Ca -0.00 -0.28 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1g47 h MET 65 Cb 0.58 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1g47 h MET 65 CO 0.03 0.94 0.00 -0.07 1.06 0.00 0.00 176.91 178.87 1g47 h LEU 66 N 0.85 0.00 -1.54 1.22 3.38 -1.14 -3.46 115.31 114.62 1g47 h LEU 66 Ca 0.17 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.93 1g47 h LEU 66 Cb 0.47 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.32 1g47 h LEU 66 CO 0.02 0.00 -0.45 0.33 0.09 0.00 0.00 178.44 178.43 1g47 n PHE 67 N -2.99 -1.43 -2.02 1.13 -0.00 0.04 -4.93 117.46 107.26 1g47 n PHE 67 Ca 0.00 0.58 -0.42 0.00 -0.00 0.00 0.00 57.45 57.61 1g47 n PHE 67 Cb 0.27 -3.73 -0.03 0.00 -0.00 0.00 0.00 39.48 36.00 1g47 n PHE 67 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1g47 s ALA 68 N -3.21 3.64 -0.77 3.13 0.00 -1.18 -4.84 121.76 118.53 1g47 s ALA 68 Ca 0.10 1.07 0.11 0.00 0.00 0.00 0.00 51.96 53.24 1g47 s ALA 68 Cb -0.04 -3.68 0.51 0.00 0.00 0.00 0.00 23.12 19.90 1g47 s ALA 68 CO 0.44 -1.12 1.33 -0.35 0.00 0.00 0.00 175.76 176.06 1g47 n PRO 69 N 5.87 0.05 -0.48 0.00 -0.04 -1.26 -4.99 135.00 134.16 1g47 n PRO 69 Ca 0.15 0.46 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 1g47 n PRO 69 Cb 0.42 -1.64 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 1g47 n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46