#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g47 h ALA 2 N 0.00 -0.13 -6.05 3.04 0.00 -2.07 -3.47 119.26 110.57 1g47 h ALA 2 Ca 0.00 -0.15 -0.41 0.00 0.00 0.00 0.00 54.91 54.35 1g47 h ALA 2 Cb 0.00 0.05 0.06 0.00 0.00 0.00 0.00 17.79 17.90 1g47 h ALA 2 CO 0.00 -0.14 -0.82 -1.71 0.00 0.00 0.00 179.25 176.58 1g47 n ASN 3 N -4.84 -1.54 -2.94 0.00 2.85 -1.26 -4.99 115.26 102.55 1g47 n ASN 3 Ca -0.04 -0.79 0.00 0.00 -0.11 0.00 0.00 54.58 53.63 1g47 n ASN 3 Cb 0.17 -4.17 0.00 0.00 1.24 0.00 0.00 39.78 37.01 1g47 n ASN 3 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1g47 n ALA 4 N -4.29 0.00 -1.00 5.20 0.00 -1.26 -5.06 120.51 114.09 1g47 n ALA 4 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1g47 n ALA 4 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1g47 n ALA 4 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1g47 n LEU 5 N 0.00 0.00 -4.55 0.00 -0.00 -1.26 -4.79 117.00 106.40 1g47 n LEU 5 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.71 1g47 n LEU 5 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.38 1g47 n LEU 5 CO 0.00 -0.55 1.67 0.00 -0.00 0.00 0.00 177.39 178.51 1g47 s ALA 6 N -3.27 1.50 0.00 1.47 0.00 -1.26 -4.82 121.76 115.37 1g47 s ALA 6 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1g47 s ALA 6 Cb 0.00 -4.42 0.00 0.00 0.00 0.00 0.00 23.12 18.70 1g47 s ALA 6 CO 0.00 -4.77 0.00 0.43 0.00 0.00 0.00 175.76 171.42 1g47 n SER 7 N 15.81 0.00 -1.13 0.00 7.64 -1.26 -5.08 113.62 129.60 1g47 n SER 7 Ca 0.36 -0.43 0.00 0.00 1.01 0.00 0.00 58.87 59.81 1g47 n SER 7 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1g47 n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g47 n ALA 8 N -3.00 -2.50 -2.50 -0.43 0.00 -1.26 -4.31 120.51 106.51 1g47 n ALA 8 Ca 0.00 0.25 -0.24 0.00 0.00 0.00 0.00 53.44 53.45 1g47 n ALA 8 Cb 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.35 1g47 n ALA 8 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1g47 s THR 9 N -0.96 2.20 0.42 0.00 -4.23 -1.26 -2.07 115.64 109.75 1g47 s THR 9 Ca 0.00 -2.26 -0.26 0.00 -1.18 0.00 0.00 61.69 57.99 1g47 s THR 9 Cb 0.00 -2.48 -0.09 0.00 1.34 0.00 0.00 72.50 71.26 1g47 s THR 9 CO 0.00 -0.30 1.43 0.00 -0.54 0.00 0.00 174.62 175.22 1g47 n GLU 11 N 0.05 0.99 0.00 0.00 4.07 -0.49 -1.20 120.64 124.06 1g47 n GLU 11 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1g47 n GLU 11 Cb 0.41 -1.46 0.00 0.00 -0.06 0.00 0.00 31.44 30.33 1g47 n GLU 11 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 1g47 n ARG 12 N -0.03 0.00 -0.00 5.31 1.85 -1.26 -4.88 116.66 117.64 1g47 n ARG 12 Ca 0.00 0.00 0.10 0.00 -1.00 0.00 0.00 57.85 56.95 1g47 n ARG 12 Cb 0.23 -0.07 -0.14 0.00 -1.05 0.00 0.00 32.46 31.44 1g47 n ARG 12 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1g47 n LYS 14 N -1.73 -7.14 -3.35 0.00 4.01 -0.34 -4.84 118.16 104.77 1g47 n LYS 14 Ca 0.02 0.79 -0.39 0.00 -0.51 0.00 0.00 58.31 58.21 1g47 n LYS 14 Cb 0.40 -5.78 -0.08 0.00 -0.51 0.00 0.00 35.03 29.06 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 -3.63 1.94 -0.58 0.72 0.00 -1.26 -4.42 107.32 100.09 1g47 s GLY 15 Ca 0.43 -0.67 -0.26 0.00 0.00 0.00 0.00 44.72 44.22 1g47 s GLY 15 CO 0.75 0.99 2.43 0.61 0.00 0.00 0.00 173.10 177.88 1g47 n GLY 16 N 4.36 0.07 1.29 0.20 0.00 -1.26 -1.86 105.19 107.99 1g47 n GLY 16 Ca -0.07 0.58 -0.08 0.00 0.00 0.00 0.00 46.02 46.45 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 16.40 -1.65 0.00 1.61 1.16 -0.88 -4.99 117.46 129.12 1g47 n PHE 17 Ca 0.41 -0.76 0.00 0.00 -1.87 0.00 0.00 57.45 55.23 1g47 n PHE 17 Cb 0.50 -0.16 0.00 0.00 -1.61 0.00 0.00 39.48 38.21 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 -2.66 0.00 -1.00 1.98 0.00 -1.26 -4.37 120.51 113.20 1g47 n ALA 18 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1g47 n ALA 18 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 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 0.00 0.00 0.00 0.00 -0.02 -1.26 -4.73 135.00 128.99 1g47 n PRO 19 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1g47 n PRO 19 Cb 0.00 -0.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.99 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 -3.00 0.00 0.32 3.55 0.00 -1.26 -4.69 120.51 115.42 1g47 n ALA 20 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 1g47 n ALA 20 Cb 0.00 0.00 1.06 0.00 0.00 0.00 0.00 19.45 20.51 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 0.00 0.00 0.00 3.07 -2.01 -2.17 114.58 113.47 1g47 h GLU 21 Ca 0.00 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 58.66 1g47 h GLU 21 Cb 0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 27.87 1g47 h GLU 21 CO 0.00 0.01 -1.82 1.63 -1.40 0.00 0.00 179.01 177.43 1g47 n LYS 22 N -3.34 1.82 -3.36 2.33 5.02 -1.26 -3.89 118.16 115.48 1g47 n LYS 22 Ca -0.03 -0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 55.84 1g47 n LYS 22 Cb 0.11 -1.32 -0.09 0.00 -0.02 0.00 0.00 35.03 33.71 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 -2.36 5.14 -0.15 -0.18 -1.09 -0.82 -4.14 121.20 117.60 1g47 s ILE 23 Ca -0.06 0.31 -0.04 0.00 -2.23 0.00 0.00 60.65 58.64 1g47 s ILE 23 Cb 0.04 -3.80 0.05 0.00 -1.58 0.00 0.00 42.46 37.17 1g47 s ILE 23 CO 0.51 -0.02 0.07 -0.69 -1.23 0.00 0.00 174.94 173.59 1g47 s VAL 24 N 2.11 0.03 0.05 2.92 1.01 -0.48 -4.44 120.40 121.60 1g47 s VAL 24 Ca 0.14 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1g47 s VAL 24 Cb -0.16 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 1g47 s VAL 24 CO 0.11 -0.16 0.12 0.21 0.00 0.00 0.00 175.10 175.38 1g47 s ASN 25 N 2.09 5.84 -0.18 3.32 3.84 -1.26 0.73 114.94 129.33 1g47 s ASN 25 Ca 0.02 0.13 -0.11 0.00 0.21 0.00 0.00 52.86 53.11 1g47 s ASN 25 Cb -0.15 -1.68 0.06 0.00 -0.55 0.00 0.00 41.25 38.92 1g47 s ASN 25 CO -0.08 0.20 0.44 -0.94 -2.79 0.00 0.00 177.10 173.94 1g47 s SER 26 N -2.23 -0.54 0.00 -4.21 1.04 -0.78 -4.96 113.70 102.02 1g47 s SER 26 Ca 0.29 0.95 0.00 0.00 0.48 0.00 0.00 55.95 57.67 1g47 s SER 26 Cb -0.12 0.86 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1g47 s SER 26 CO 0.21 -0.19 0.00 0.59 0.98 0.00 0.00 173.24 174.83 1g47 n ASN 27 N 3.92 0.00 -2.70 7.02 3.02 -1.26 -1.93 115.26 123.34 1g47 n ASN 27 Ca -0.21 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.30 1g47 n ASN 27 Cb 0.56 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.84 1g47 n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g47 n GLY 28 N 0.00 1.69 3.44 7.41 0.00 -1.26 -4.83 105.19 111.64 1g47 n GLY 28 Ca 0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.50 1.27 -0.13 1.61 2.02 -0.81 -4.18 118.70 117.98 1g47 s GLU 29 Ca 0.17 -0.97 0.01 0.00 0.02 0.00 0.00 54.97 54.20 1g47 s GLU 29 Cb 0.42 0.46 -0.01 0.00 0.10 0.00 0.00 34.13 35.10 1g47 s GLU 29 CO -0.09 -0.51 -0.15 -0.51 0.02 0.00 0.00 175.26 174.01 1g47 s LEU 30 N -2.90 2.55 0.09 1.80 2.01 -1.26 -1.86 118.68 119.11 1g47 s LEU 30 Ca 0.12 -0.41 0.05 0.00 0.01 0.00 0.00 54.13 53.90 1g47 s LEU 30 Cb 0.01 -1.57 -0.03 0.00 0.01 0.00 0.00 46.19 44.61 1g47 s LEU 30 CO -0.02 0.14 -0.12 -0.31 1.01 0.00 0.00 176.35 177.04 1g47 s TYR 31 N 0.50 1.17 0.91 0.29 1.51 0.22 -1.40 117.35 120.56 1g47 s TYR 31 Ca -0.10 -0.57 -0.11 0.00 -1.01 0.00 0.00 57.07 55.27 1g47 s TYR 31 Cb -0.16 -0.64 0.20 0.00 -0.11 0.00 0.00 41.96 41.25 1g47 s TYR 31 CO 0.04 0.05 1.25 -1.01 -1.11 0.00 0.00 175.55 174.77 1g47 s HIS 32 N -2.00 1.29 -1.56 2.71 3.76 -1.26 -1.38 115.29 116.84 1g47 s HIS 32 Ca 0.04 0.02 0.26 0.00 -0.15 0.00 0.00 55.06 55.23 1g47 s HIS 32 Cb -0.06 -3.84 1.36 0.00 1.11 0.00 0.00 32.58 31.15 1g47 s HIS 32 CO 0.01 -2.52 1.88 -0.85 -0.85 0.00 0.00 174.74 172.41 1g47 n GLU 33 N -3.55 0.47 -2.70 1.40 -0.00 -1.25 -3.57 120.64 111.45 1g47 n GLU 33 Ca 0.17 0.04 -0.06 0.00 -0.00 0.00 0.00 57.16 57.30 1g47 n GLU 33 Cb 0.60 -1.50 0.07 0.00 -0.00 0.00 0.00 31.44 30.61 1g47 n GLU 33 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 1g47 n GLN 34 N -1.22 1.26 0.00 3.44 7.27 -1.26 -3.77 117.38 123.10 1g47 n GLN 34 Ca 0.14 -2.64 0.00 0.00 0.07 0.00 0.00 57.00 54.57 1g47 n GLN 34 Cb 0.18 -0.75 0.00 0.00 2.41 0.00 0.00 30.24 32.08 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 -0.60 0.42 -3.89 0.00 3.01 -1.26 -4.59 117.46 110.55 1g47 n PHE 36 Ca 0.00 0.26 -0.21 0.00 1.01 0.00 0.00 57.45 58.51 1g47 n PHE 36 Cb 0.00 -1.84 -0.03 0.00 -0.01 0.00 0.00 39.48 37.60 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 6.49 4.18 -0.19 -4.37 -7.23 -1.26 -0.55 120.40 117.47 1g47 s VAL 37 Ca 1.34 -1.27 -0.22 0.00 -1.81 0.00 0.00 61.98 60.01 1g47 s VAL 37 Cb -1.11 -3.39 -0.02 0.00 0.56 0.00 0.00 36.38 32.42 1g47 s VAL 37 CO 0.51 -0.26 0.68 0.00 -0.31 0.00 0.00 175.10 175.72 1g47 n ALA 39 N 5.11 1.00 0.00 0.00 0.00 0.37 0.16 120.51 127.15 1g47 n ALA 39 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1g47 n ALA 39 Cb 0.49 -0.83 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.21 0.11 0.00 0.00 6.02 -1.26 -4.72 117.38 116.32 1g47 n GLN 40 Ca 0.00 0.04 0.13 0.00 -0.01 0.00 0.00 57.00 57.17 1g47 n GLN 40 Cb 0.05 -0.57 0.49 0.00 1.02 0.00 0.00 30.24 31.23 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 -1.42 -0.36 -2.74 0.00 3.01 0.42 -4.82 117.46 111.54 1g47 n PHE 42 Ca 0.08 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.11 1g47 n PHE 42 Cb 0.33 -2.98 -0.03 0.00 -0.01 0.00 0.00 39.48 36.79 1g47 n PHE 42 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 1g47 s GLN 43 N -3.60 4.40 0.95 -1.08 0.74 -1.26 -4.38 119.66 115.43 1g47 s GLN 43 Ca 0.00 1.30 -0.13 0.00 0.05 0.00 0.00 55.36 56.59 1g47 s GLN 43 Cb 0.00 -3.54 0.16 0.00 1.10 0.00 0.00 33.01 30.73 1g47 s GLN 43 CO 0.00 -0.30 1.13 1.14 -0.55 0.00 0.00 175.29 176.71 1g47 s GLN 44 N 1.98 0.85 -0.21 1.67 -2.07 -1.26 -2.15 119.66 118.47 1g47 s GLN 44 Ca 0.46 0.29 -0.07 0.00 -1.82 0.00 0.00 55.36 54.23 1g47 s GLN 44 Cb -0.18 -1.81 0.10 0.00 -1.09 0.00 0.00 33.01 30.03 1g47 s GLN 44 CO 0.17 -2.40 0.44 0.12 -1.32 0.00 0.00 175.29 172.30 1g47 s PHE 45 N -3.22 -0.86 -1.78 9.60 2.19 0.29 -4.88 117.98 119.32 1g47 s PHE 45 Ca 0.65 1.55 0.05 0.00 0.33 0.00 0.00 56.93 59.51 1g47 s PHE 45 Cb -0.15 0.33 0.29 0.00 -1.31 0.00 0.00 43.02 42.18 1g47 s PHE 45 CO 0.54 -0.53 0.87 -0.35 1.83 0.00 0.00 175.22 177.58 1g47 n PRO 46 N 5.40 0.13 -0.02 10.12 -0.04 -1.26 -2.96 135.00 146.37 1g47 n PRO 46 Ca -0.08 0.09 0.22 0.00 -0.04 0.00 0.00 63.50 63.69 1g47 n PRO 46 Cb 0.49 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 33.17 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 -3.45 114.58 114.81 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 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 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 -1.62 1.43 2.92 -3.84 0.00 -1.15 -4.79 105.19 98.14 1g47 n GLY 48 Ca 0.11 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.26 0.00 0.99 0.20 -1.26 -4.96 118.68 113.39 1g47 s LEU 49 Ca 0.00 -0.06 0.00 0.00 0.69 0.00 0.00 54.13 54.76 1g47 s LEU 49 Cb 0.00 0.70 0.00 0.00 -0.43 0.00 0.00 46.19 46.46 1g47 s LEU 49 CO 0.00 -0.04 0.00 2.22 -0.29 0.00 0.00 176.35 178.24 1g47 n PHE 50 N 4.28 0.00 -2.04 5.38 1.16 -1.26 -4.93 117.46 120.05 1g47 n PHE 50 Ca 0.07 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.28 1g47 n PHE 50 Cb 0.61 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.49 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 2.56 -2.61 2.97 4.01 0.44 -4.99 117.16 119.54 1g47 n TYR 51 Ca 0.00 -2.38 -0.34 0.00 -0.16 0.00 0.00 57.90 55.02 1g47 n TYR 51 Cb 0.00 -1.34 -0.04 0.00 -0.31 0.00 0.00 39.34 37.65 1g47 n TYR 51 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 1g47 s GLU 52 N -3.17 3.92 0.29 -0.72 1.03 -1.25 -1.58 118.70 117.22 1g47 s GLU 52 Ca 0.50 1.28 -0.03 0.00 0.03 0.00 0.00 54.97 56.75 1g47 s GLU 52 Cb 0.32 -2.12 -0.01 0.00 -0.80 0.00 0.00 34.13 31.51 1g47 s GLU 52 CO -0.25 -0.32 0.36 -0.06 -1.33 0.00 0.00 175.26 173.67 1g47 s PHE 53 N -2.07 1.04 -0.07 4.83 0.40 -1.00 -4.90 117.98 116.21 1g47 s PHE 53 Ca 0.65 -1.25 -0.30 0.00 -0.60 0.00 0.00 56.93 55.44 1g47 s PHE 53 Cb -0.14 -0.23 -0.04 0.00 0.51 0.00 0.00 43.02 43.12 1g47 s PHE 53 CO 0.19 -0.95 1.46 -1.83 0.70 0.00 0.00 175.22 174.79 1g47 s GLU 54 N -3.59 4.23 0.00 0.44 1.03 -1.26 -2.15 118.70 117.40 1g47 s GLU 54 Ca 0.32 1.96 0.00 0.00 0.03 0.00 0.00 54.97 57.28 1g47 s GLU 54 Cb 0.02 -3.80 0.00 0.00 -0.80 0.00 0.00 34.13 29.55 1g47 s GLU 54 CO 0.17 -0.73 0.00 0.41 -1.33 0.00 0.00 175.26 173.78 1g47 n GLY 55 N 3.83 0.31 3.37 -3.83 0.00 -1.26 -4.89 105.19 102.73 1g47 n GLY 55 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.85 1.68 -0.30 1.61 0.52 -0.91 -5.13 118.95 115.56 1g47 s ARG 56 Ca 0.00 -1.97 -0.16 0.00 -0.52 0.00 0.00 55.73 53.07 1g47 s ARG 56 Cb 0.00 -0.19 0.18 0.00 0.52 0.00 0.00 34.95 35.47 1g47 s ARG 56 CO 0.00 -0.46 1.14 -1.59 0.02 0.00 0.00 175.30 174.41 1g47 s LYS 57 N -3.76 0.18 -0.05 3.54 -2.85 -1.26 -2.38 119.74 113.15 1g47 s LYS 57 Ca 0.34 0.35 -0.09 0.00 -1.00 0.00 0.00 55.97 55.57 1g47 s LYS 57 Cb 0.04 0.10 0.02 0.00 -2.06 0.00 0.00 37.83 35.93 1g47 s LYS 57 CO 0.18 -0.04 0.21 0.71 0.10 0.00 0.00 175.35 176.51 1g47 s TYR 58 N 1.51 -0.15 0.74 1.78 2.02 -0.61 0.14 117.35 122.77 1g47 s TYR 58 Ca -0.06 0.34 -0.00 0.00 -0.37 0.00 0.00 57.07 56.98 1g47 s TYR 58 Cb -0.03 0.05 0.14 0.00 -0.40 0.00 0.00 41.96 41.72 1g47 s TYR 58 CO -0.13 -0.21 1.02 0.00 -1.57 0.00 0.00 175.55 174.65 1g47 n GLU 60 N -2.87 0.50 0.00 0.00 4.07 -1.26 -3.35 120.64 117.74 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 -1.10 0.00 0.00 -0.06 0.00 0.00 31.44 30.89 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 -0.21 0.00 0.21 4.31 -0.00 -1.26 -2.19 115.22 116.08 1g47 n HIS 61 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.77 1g47 n HIS 61 Cb 0.05 -0.26 0.51 0.00 -0.00 0.00 0.00 29.99 30.29 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 0.05 0.33 0.26 3.32 -1.96 -2.32 116.42 116.09 1g47 h ASP 62 Ca 0.00 -0.01 -0.27 0.00 0.02 0.00 0.00 57.03 56.77 1g47 h ASP 62 Cb 0.00 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 39.55 1g47 h ASP 62 CO 0.00 0.18 -1.16 -0.26 -1.72 0.00 0.00 179.24 176.28 1g47 h PHE 63 N 0.05 0.75 0.00 4.55 -1.00 -1.75 -2.93 116.94 116.61 1g47 h PHE 63 Ca 0.01 -0.47 -0.03 0.00 2.81 0.00 0.00 57.97 60.28 1g47 h PHE 63 Cb 0.25 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.74 1g47 h PHE 63 CO 0.00 1.32 -0.17 -0.56 -1.61 0.00 0.00 178.31 177.30 1g47 h GLN 64 N 0.20 0.00 -0.46 1.51 3.07 -1.10 -2.03 115.11 116.30 1g47 h GLN 64 Ca -0.14 0.00 -0.09 0.00 0.09 0.00 0.00 58.65 58.51 1g47 h GLN 64 Cb 1.83 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 29.38 1g47 h GLN 64 CO 0.21 0.17 -0.05 0.52 0.09 0.00 0.00 178.83 179.76 1g47 h MET 65 N 0.00 0.84 0.00 0.06 2.86 -1.34 -0.97 114.93 116.38 1g47 h MET 65 Ca -0.00 -0.29 -0.03 0.00 -2.06 0.00 0.00 59.70 57.31 1g47 h MET 65 Cb 0.60 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 1g47 h MET 65 CO 0.02 0.92 -0.16 -0.07 1.06 0.00 0.00 176.91 178.68 1g47 h LEU 66 N 0.69 0.00 -2.30 1.22 3.38 -1.21 -3.47 115.31 113.62 1g47 h LEU 66 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1g47 h LEU 66 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1g47 h LEU 66 CO 0.03 0.16 -0.71 0.33 0.09 0.00 0.00 178.44 178.35 1g47 n PHE 67 N -3.72 -3.34 -1.98 1.13 -0.00 -0.37 -4.86 117.46 104.31 1g47 n PHE 67 Ca -0.02 1.44 -0.42 0.00 -0.00 0.00 0.00 57.45 58.45 1g47 n PHE 67 Cb 0.28 -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 -1.79 3.64 -0.71 3.13 0.00 -1.26 -4.84 121.76 119.94 1g47 s ALA 68 Ca 0.08 1.08 0.11 0.00 0.00 0.00 0.00 51.96 53.23 1g47 s ALA 68 Cb -0.02 -3.71 0.54 0.00 0.00 0.00 0.00 23.12 19.93 1g47 s ALA 68 CO 0.68 -1.20 1.34 -0.35 0.00 0.00 0.00 175.76 176.23 1g47 n PRO 69 N 6.17 0.06 0.00 0.00 -0.04 -1.26 -5.16 135.00 134.77 1g47 n PRO 69 Ca 0.16 0.50 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 1g47 n PRO 69 Cb 0.42 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 1g47 n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46