#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 -0.46 1.07 -5.12 0.00 -1.26 -5.17 121.76 110.82 1g47 s ALA 2 Ca 0.00 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 50.99 1g47 s ALA 2 Cb 0.00 0.83 0.16 0.00 0.00 0.00 0.00 23.12 24.11 1g47 s ALA 2 CO 0.00 -0.94 0.76 0.27 0.00 0.00 0.00 175.76 175.85 1g47 n ASN 3 N -1.21 -0.68 -4.71 0.00 6.94 -1.26 -4.94 115.26 109.40 1g47 n ASN 3 Ca -0.05 -1.13 -0.42 0.00 -0.02 0.00 0.00 54.58 52.95 1g47 n ASN 3 Cb 0.60 -0.63 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 1g47 n ASN 3 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1g47 s ALA 4 N -3.57 3.73 -0.09 -2.53 0.00 -1.26 -4.86 121.76 113.19 1g47 s ALA 4 Ca 0.46 1.29 0.30 0.00 0.00 0.00 0.00 51.96 54.01 1g47 s ALA 4 Cb -0.03 -3.64 1.33 0.00 0.00 0.00 0.00 23.12 20.79 1g47 s ALA 4 CO 0.33 -0.86 1.89 -0.07 0.00 0.00 0.00 175.76 177.05 1g47 h LEU 5 N 7.36 0.00 0.00 0.00 4.07 -2.06 -3.48 115.31 121.20 1g47 h LEU 5 Ca -0.42 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.54 1g47 h LEU 5 Cb 1.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.94 1g47 h LEU 5 CO 0.91 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 178.27 1g47 n ALA 6 N -1.93 0.00 0.00 1.53 0.00 -1.26 -4.83 120.51 114.02 1g47 n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1g47 n ALA 6 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 1g47 n ALA 6 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1g47 n SER 7 N -2.96 0.00 -3.64 0.00 3.41 -1.26 -5.11 113.62 104.05 1g47 n SER 7 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 1g47 n SER 7 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 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 -0.17 -1.89 0.21 7.33 0.00 -1.26 -5.12 121.76 120.85 1g47 s ALA 8 Ca 0.00 2.34 0.08 0.00 0.00 0.00 0.00 51.96 54.38 1g47 s ALA 8 Cb 0.00 -1.41 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 1g47 s ALA 8 CO 0.00 -0.37 -0.15 0.95 0.00 0.00 0.00 175.76 176.19 1g47 s THR 9 N 1.38 1.77 0.45 0.00 -4.23 -1.26 -2.22 115.64 111.54 1g47 s THR 9 Ca -0.08 -2.22 -0.25 0.00 -1.18 0.00 0.00 61.69 57.96 1g47 s THR 9 Cb -0.05 -2.05 -0.08 0.00 1.34 0.00 0.00 72.50 71.66 1g47 s THR 9 CO -0.16 -0.58 1.41 0.00 -0.54 0.00 0.00 174.62 174.75 1g47 h GLU 11 N 2.32 0.00 0.00 0.00 4.57 -0.70 0.22 114.58 120.99 1g47 h GLU 11 Ca -0.51 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 57.43 1g47 h GLU 11 Cb 1.27 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.81 1g47 h GLU 11 CO 0.61 0.00 -1.88 0.54 -1.18 0.00 0.00 179.01 177.10 1g47 n ARG 12 N -3.02 0.37 -0.00 1.92 1.74 -1.26 -4.69 116.66 111.72 1g47 n ARG 12 Ca 0.02 0.10 0.08 0.00 -0.77 0.00 0.00 57.85 57.28 1g47 n ARG 12 Cb 0.37 -1.26 -0.10 0.00 -1.02 0.00 0.00 32.46 30.45 1g47 n ARG 12 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1g47 n LYS 14 N -1.53 -6.88 -3.37 0.00 4.76 0.78 -4.82 118.16 107.10 1g47 n LYS 14 Ca 0.02 0.75 -0.39 0.00 -2.87 0.00 0.00 58.31 55.82 1g47 n LYS 14 Cb 0.29 -5.72 -0.08 0.00 -1.84 0.00 0.00 35.03 27.68 1g47 n LYS 14 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1g47 s GLY 15 N -3.56 1.97 -0.47 0.72 0.00 -1.26 -4.39 107.32 100.34 1g47 s GLY 15 Ca 0.48 -0.65 -0.28 0.00 0.00 0.00 0.00 44.72 44.26 1g47 s GLY 15 CO 0.76 0.93 2.38 0.61 0.00 0.00 0.00 173.10 177.78 1g47 n GLY 16 N 4.28 0.34 0.01 0.20 0.00 -1.26 -2.07 105.19 106.69 1g47 n GLY 16 Ca -0.08 0.77 -0.00 0.00 0.00 0.00 0.00 46.02 46.71 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 13.61 -0.53 0.02 1.61 1.16 -0.94 -5.00 117.46 127.40 1g47 n PHE 17 Ca 0.39 -0.01 0.00 0.00 -1.87 0.00 0.00 57.45 55.96 1g47 n PHE 17 Cb 0.43 -0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.29 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 -0.88 1.98 0.00 -1.26 -4.62 120.51 112.73 1g47 n ALA 18 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.11 1g47 n ALA 18 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.60 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 -2.66 -0.16 0.31 0.00 -0.02 -1.26 -4.37 135.00 126.84 1g47 n PRO 19 Ca 0.00 0.02 0.21 0.00 -2.02 0.00 0.00 63.50 61.71 1g47 n PRO 19 Cb 0.00 -2.31 1.02 0.00 -0.02 0.00 0.00 33.50 32.18 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 -1.40 1.02 0.13 3.55 0.00 -2.02 1.28 119.26 121.81 1g47 h ALA 20 Ca -0.44 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.18 1g47 h ALA 20 Cb 1.29 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.09 1g47 h ALA 20 CO 0.42 0.01 -1.23 0.93 0.00 0.00 0.00 179.25 179.37 1g47 h GLU 21 N 0.00 0.35 0.05 0.00 3.07 -2.01 -3.37 114.58 112.68 1g47 h GLU 21 Ca -0.00 -0.55 -0.35 0.00 -0.50 0.00 0.00 59.36 57.96 1g47 h GLU 21 Cb 0.19 0.20 -0.04 0.00 -0.84 0.00 0.00 28.75 28.26 1g47 h GLU 21 CO 0.00 1.25 -1.97 1.63 -1.40 0.00 0.00 179.01 178.51 1g47 n LYS 22 N -3.61 0.67 -2.96 2.33 5.02 -0.72 -4.02 118.16 114.87 1g47 n LYS 22 Ca -0.10 0.32 -0.40 0.00 -2.02 0.00 0.00 58.31 56.11 1g47 n LYS 22 Cb 1.00 -1.66 -0.04 0.00 -0.02 0.00 0.00 35.03 34.32 1g47 n LYS 22 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1g47 s ILE 23 N -2.50 5.00 -0.30 -0.18 -1.16 0.43 -4.17 121.20 118.33 1g47 s ILE 23 Ca -0.29 1.60 -0.01 0.00 -0.51 0.00 0.00 60.65 61.45 1g47 s ILE 23 Cb 0.08 -4.11 0.13 0.00 0.61 0.00 0.00 42.46 39.17 1g47 s ILE 23 CO 0.66 0.23 0.27 -0.69 -2.81 0.00 0.00 174.94 172.59 1g47 s VAL 24 N 0.87 -0.30 0.41 4.00 1.01 0.11 -4.41 120.40 122.09 1g47 s VAL 24 Ca 0.41 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 1g47 s VAL 24 Cb -0.19 -0.95 -0.09 0.00 0.00 0.00 0.00 36.38 35.15 1g47 s VAL 24 CO 0.20 -0.56 0.87 0.21 0.00 0.00 0.00 175.10 175.83 1g47 s ASN 25 N 2.13 6.77 -0.29 3.32 3.84 -1.26 0.11 114.94 129.56 1g47 s ASN 25 Ca 0.11 1.47 -0.13 0.00 0.21 0.00 0.00 52.86 54.52 1g47 s ASN 25 Cb -0.15 -2.46 0.11 0.00 -0.55 0.00 0.00 41.25 38.20 1g47 s ASN 25 CO -0.28 -0.37 0.67 -0.94 -2.79 0.00 0.00 177.10 173.40 1g47 s SER 26 N -2.51 -1.04 0.00 -4.21 1.04 -0.27 -4.87 113.70 101.82 1g47 s SER 26 Ca 0.58 1.54 0.00 0.00 0.48 0.00 0.00 55.95 58.55 1g47 s SER 26 Cb -0.10 1.85 0.00 0.00 0.10 0.00 0.00 66.02 67.87 1g47 s SER 26 CO 0.20 -0.23 0.00 -3.20 0.98 0.00 0.00 173.24 171.00 1g47 n ASN 27 N 4.88 -0.66 0.00 7.02 2.85 -1.26 -2.04 115.26 126.05 1g47 n ASN 27 Ca -0.16 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.31 1g47 n ASN 27 Cb 0.54 -1.92 0.00 0.00 1.24 0.00 0.00 39.78 39.63 1g47 n ASN 27 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1g47 n GLY 28 N -1.76 0.67 3.93 8.20 0.00 -1.26 -4.50 105.19 110.47 1g47 n GLY 28 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 1.47 -0.10 1.61 2.02 -0.87 -5.05 118.70 117.78 1g47 s GLU 29 Ca 0.00 -0.31 0.01 0.00 0.02 0.00 0.00 54.97 54.68 1g47 s GLU 29 Cb 0.00 -2.00 -0.02 0.00 0.10 0.00 0.00 34.13 32.21 1g47 s GLU 29 CO 0.00 -1.82 -0.12 -0.51 0.02 0.00 0.00 175.26 172.84 1g47 s LEU 30 N -5.58 2.84 0.13 1.80 2.01 -1.26 -1.12 118.68 117.51 1g47 s LEU 30 Ca 0.67 -0.23 0.02 0.00 0.01 0.00 0.00 54.13 54.60 1g47 s LEU 30 Cb -0.08 -1.62 -0.04 0.00 0.01 0.00 0.00 46.19 44.46 1g47 s LEU 30 CO 0.49 0.24 -0.03 -0.31 1.01 0.00 0.00 176.35 177.76 1g47 s TYR 31 N -0.11 1.03 0.60 0.29 1.51 0.30 0.11 117.35 121.08 1g47 s TYR 31 Ca -0.01 -0.98 0.02 0.00 -1.01 0.00 0.00 57.07 55.09 1g47 s TYR 31 Cb -0.14 -0.59 0.07 0.00 -0.11 0.00 0.00 41.96 41.20 1g47 s TYR 31 CO 0.03 -0.20 0.84 -1.01 -1.11 0.00 0.00 175.55 174.10 1g47 s HIS 32 N -3.67 2.30 -2.00 2.71 3.76 -1.26 0.05 115.29 117.18 1g47 s HIS 32 Ca 0.18 -0.18 0.02 0.00 -0.15 0.00 0.00 55.06 54.93 1g47 s HIS 32 Cb 0.06 -2.77 0.10 0.00 1.11 0.00 0.00 32.58 31.07 1g47 s HIS 32 CO -0.01 -1.16 0.82 -0.85 -0.85 0.00 0.00 174.74 172.70 1g47 n GLU 33 N -2.48 0.75 -2.69 1.40 -0.00 -1.26 -3.21 120.64 113.16 1g47 n GLU 33 Ca 0.11 0.00 -0.04 0.00 -0.00 0.00 0.00 57.16 57.23 1g47 n GLU 33 Cb 0.60 -1.03 0.12 0.00 -0.00 0.00 0.00 31.44 31.13 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 -0.53 1.31 0.00 3.44 7.27 -1.26 -1.63 117.38 125.98 1g47 n GLN 34 Ca 0.01 -1.55 0.00 0.00 0.07 0.00 0.00 57.00 55.53 1g47 n GLN 34 Cb 0.01 0.16 0.00 0.00 2.41 0.00 0.00 30.24 32.81 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 -0.45 0.84 -3.56 0.00 3.01 -1.26 -4.68 117.46 111.36 1g47 n PHE 36 Ca 0.00 0.01 -0.21 0.00 1.01 0.00 0.00 57.45 58.26 1g47 n PHE 36 Cb 0.00 -2.02 -0.01 0.00 -0.01 0.00 0.00 39.48 37.44 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 10.38 4.60 -0.06 -4.37 -7.23 -1.26 0.17 120.40 122.64 1g47 s VAL 37 Ca 1.06 -0.86 -0.24 0.00 -1.81 0.00 0.00 61.98 60.13 1g47 s VAL 37 Cb -0.37 -3.63 -0.04 0.00 0.56 0.00 0.00 36.38 32.90 1g47 s VAL 37 CO 0.24 -0.29 0.73 0.00 -0.31 0.00 0.00 175.10 175.47 1g47 n ALA 39 N 3.77 1.11 0.03 0.00 0.00 -0.49 0.38 120.51 125.31 1g47 n ALA 39 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1g47 n ALA 39 Cb 0.51 -0.99 -0.00 0.00 0.00 0.00 0.00 19.45 18.97 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 -1.39 0.04 0.00 0.00 6.02 -1.26 -4.73 117.38 116.07 1g47 n GLN 40 Ca 0.00 0.02 0.14 0.00 -0.01 0.00 0.00 57.00 57.14 1g47 n GLN 40 Cb 0.00 -0.50 0.60 0.00 1.02 0.00 0.00 30.24 31.36 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 -1.50 -0.17 -2.59 0.00 3.72 0.16 -4.83 117.46 112.25 1g47 n PHE 42 Ca 0.07 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.04 1g47 n PHE 42 Cb 0.33 -2.68 -0.02 0.00 -0.94 0.00 0.00 39.48 36.16 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 -3.00 4.32 1.02 -1.08 2.00 -1.26 -4.36 119.66 117.29 1g47 s GLN 43 Ca 0.00 1.47 -0.13 0.00 -2.00 0.00 0.00 55.36 54.70 1g47 s GLN 43 Cb 0.00 -3.62 0.20 0.00 0.80 0.00 0.00 33.01 30.39 1g47 s GLN 43 CO 0.00 -0.52 1.11 1.14 -0.50 0.00 0.00 175.29 176.51 1g47 s GLN 44 N 2.75 0.28 -0.06 1.67 -2.07 -1.26 -2.02 119.66 118.96 1g47 s GLN 44 Ca 0.49 0.36 -0.01 0.00 -1.82 0.00 0.00 55.36 54.38 1g47 s GLN 44 Cb -0.19 -1.73 0.03 0.00 -1.09 0.00 0.00 33.01 30.03 1g47 s GLN 44 CO 0.14 -2.80 0.01 0.12 -1.32 0.00 0.00 175.29 171.44 1g47 s PHE 45 N -3.05 0.47 1.41 9.60 2.19 0.13 -4.84 117.98 123.87 1g47 s PHE 45 Ca 0.66 -0.04 -0.22 0.00 0.33 0.00 0.00 56.93 57.66 1g47 s PHE 45 Cb -0.16 -0.65 0.36 0.00 -1.31 0.00 0.00 43.02 41.26 1g47 s PHE 45 CO 0.57 -0.25 0.94 -1.25 1.83 0.00 0.00 175.22 177.05 1g47 s PRO 46 N 1.80 -2.80 0.00 10.12 0.04 -1.26 -3.30 135.00 139.59 1g47 s PRO 46 Ca 0.02 0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.26 1g47 s PRO 46 Cb -0.13 -1.39 0.00 0.00 0.04 0.00 0.00 34.50 33.03 1g47 s PRO 46 CO -0.04 -4.81 0.00 -1.91 0.04 0.00 0.00 177.00 170.28 1g47 n GLU 47 N -5.59 0.00 -0.90 4.56 4.07 -0.64 -3.95 120.64 118.18 1g47 n GLU 47 Ca 0.12 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 1g47 n GLU 47 Cb 0.59 -0.19 0.00 0.00 -0.06 0.00 0.00 31.44 31.78 1g47 n GLU 47 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1g47 n GLY 48 N 0.00 0.65 3.65 8.31 0.00 -0.94 -4.74 105.19 112.12 1g47 n GLY 48 Ca 0.00 -0.37 -0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.21 -0.17 0.00 0.99 0.20 -1.25 -4.94 118.68 112.29 1g47 s LEU 49 Ca 0.00 0.29 0.00 0.00 0.69 0.00 0.00 54.13 55.11 1g47 s LEU 49 Cb 0.00 1.27 0.00 0.00 -0.43 0.00 0.00 46.19 47.03 1g47 s LEU 49 CO 0.00 -0.05 0.00 2.22 -0.29 0.00 0.00 176.35 178.23 1g47 n PHE 50 N 2.92 0.00 -1.84 5.38 1.16 -1.26 -4.94 117.46 118.88 1g47 n PHE 50 Ca -0.16 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.02 1g47 n PHE 50 Cb 0.57 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 2.56 -0.78 2.97 4.01 0.43 -4.97 117.16 121.38 1g47 n TYR 51 Ca 0.00 -2.88 -0.29 0.00 -0.16 0.00 0.00 57.90 54.57 1g47 n TYR 51 Cb 0.00 -1.98 0.21 0.00 -0.31 0.00 0.00 39.34 37.26 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 -0.42 -0.04 0.25 -0.72 1.03 -1.25 -1.16 118.70 116.38 1g47 s GLU 52 Ca 0.58 0.91 -0.14 0.00 0.03 0.00 0.00 54.97 56.35 1g47 s GLU 52 Cb 0.18 -1.65 -0.00 0.00 -0.80 0.00 0.00 34.13 31.86 1g47 s GLU 52 CO -0.09 -3.15 0.52 -0.06 -1.33 0.00 0.00 175.26 171.15 1g47 s PHE 53 N -2.65 0.29 -0.18 4.83 0.40 -0.39 -4.74 117.98 115.56 1g47 s PHE 53 Ca 0.67 -0.67 -0.29 0.00 -0.60 0.00 0.00 56.93 56.04 1g47 s PHE 53 Cb -0.22 0.27 -0.02 0.00 0.51 0.00 0.00 43.02 43.55 1g47 s PHE 53 CO 0.61 -1.04 1.43 -1.83 0.70 0.00 0.00 175.22 175.09 1g47 s GLU 54 N -3.97 4.07 0.00 0.44 -1.05 -1.26 -2.45 118.70 114.48 1g47 s GLU 54 Ca 0.21 1.70 0.00 0.00 -0.15 0.00 0.00 54.97 56.73 1g47 s GLU 54 Cb -0.01 -3.89 0.00 0.00 -0.44 0.00 0.00 34.13 29.78 1g47 s GLU 54 CO 0.09 -0.94 0.00 0.41 0.95 0.00 0.00 175.26 175.77 1g47 n GLY 55 N 4.08 0.21 3.49 -3.83 0.00 -1.26 -4.90 105.19 102.97 1g47 n GLY 55 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.15 1.94 -0.13 1.61 0.52 -1.03 -5.18 118.95 115.53 1g47 s ARG 56 Ca 0.00 -1.79 -0.30 0.00 -0.52 0.00 0.00 55.73 53.12 1g47 s ARG 56 Cb 0.00 0.44 0.11 0.00 0.52 0.00 0.00 34.95 36.03 1g47 s ARG 56 CO 0.00 -0.81 0.92 -1.59 0.02 0.00 0.00 175.30 173.84 1g47 s LYS 57 N -2.99 0.71 -0.16 3.54 -2.85 -1.26 -1.26 119.74 115.47 1g47 s LYS 57 Ca 0.31 0.17 -0.10 0.00 -1.00 0.00 0.00 55.97 55.35 1g47 s LYS 57 Cb -0.01 0.33 0.05 0.00 -2.06 0.00 0.00 37.83 36.15 1g47 s LYS 57 CO 0.21 -0.22 0.40 0.71 0.10 0.00 0.00 175.35 176.55 1g47 s TYR 58 N -1.14 -0.55 0.89 1.78 2.02 -0.31 -1.39 117.35 118.65 1g47 s TYR 58 Ca -0.04 1.21 -0.14 0.00 -0.37 0.00 0.00 57.07 57.74 1g47 s TYR 58 Cb -0.00 0.23 0.16 0.00 -0.40 0.00 0.00 41.96 41.94 1g47 s TYR 58 CO 0.04 -0.31 1.25 0.00 -1.57 0.00 0.00 175.55 174.96 1g47 h GLU 60 N -1.37 0.00 0.15 0.00 4.81 -1.94 -2.80 114.58 113.42 1g47 h GLU 60 Ca -0.44 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.78 1g47 h GLU 60 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1g47 h GLU 60 CO 0.47 0.00 -0.07 1.25 -0.73 0.00 0.00 179.01 179.93 1g47 h HIS 61 N 0.00 -0.19 -0.87 0.92 2.76 -1.96 0.38 115.15 116.19 1g47 h HIS 61 Ca 0.01 -0.00 0.15 0.00 -2.20 0.00 0.00 60.37 58.33 1g47 h HIS 61 Cb 0.27 0.06 -0.09 0.00 1.55 0.00 0.00 27.41 29.19 1g47 h HIS 61 CO 0.00 -0.12 0.47 0.22 -1.30 0.00 0.00 177.93 177.20 1g47 h ASP 62 N -0.26 0.58 -0.05 3.26 3.58 -1.89 0.12 116.42 121.76 1g47 h ASP 62 Ca -0.02 0.09 -0.18 0.00 0.42 0.00 0.00 57.03 57.34 1g47 h ASP 62 Cb 0.15 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.19 1g47 h ASP 62 CO 0.03 0.25 -0.59 0.15 -2.88 0.00 0.00 179.24 176.20 1g47 h PHE 63 N 0.66 0.83 0.00 0.28 3.57 -1.54 -2.35 116.94 118.39 1g47 h PHE 63 Ca 0.47 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.67 1g47 h PHE 63 Cb 0.66 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.25 1g47 h PHE 63 CO -0.08 1.08 0.00 0.00 -2.23 0.00 0.00 178.31 177.08 1g47 n GLN 64 N -3.96 0.73 0.06 1.11 10.64 0.13 -1.70 117.38 124.39 1g47 n GLN 64 Ca -0.04 0.01 -0.18 0.00 -1.83 0.00 0.00 57.00 54.95 1g47 n GLN 64 Cb 0.63 -1.50 -0.14 0.00 -0.86 0.00 0.00 30.24 28.37 1g47 n GLN 64 CO 0.00 0.00 0.00 1.98 -1.83 0.00 0.00 177.06 177.21 1g47 h MET 65 N 0.00 0.28 0.26 2.61 4.05 -0.28 -3.36 114.93 118.49 1g47 h MET 65 Ca 0.00 -0.47 -0.01 0.00 -0.28 0.00 0.00 59.70 58.93 1g47 h MET 65 Cb 0.10 0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 1g47 h MET 65 CO 0.00 1.14 -0.12 -0.07 0.23 0.00 0.00 176.91 178.09 1g47 h LEU 66 N 0.08 -0.29 0.00 3.39 3.38 -1.22 -3.48 115.31 117.16 1g47 h LEU 66 Ca -0.29 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1g47 h LEU 66 Cb 2.04 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.87 1g47 h LEU 66 CO 0.16 0.18 0.00 0.33 0.09 0.00 0.00 178.44 179.19 1g47 n PHE 67 N -5.01 0.00 -3.43 1.13 7.35 -0.69 -5.05 117.46 111.76 1g47 n PHE 67 Ca -0.05 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.49 1g47 n PHE 67 Cb 0.16 0.00 0.01 0.00 0.35 0.00 0.00 39.48 40.00 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 0.00 -2.61 0.21 3.13 0.00 -0.71 -4.73 120.51 115.79 1g47 n ALA 68 Ca 0.00 -0.13 0.08 0.00 0.00 0.00 0.00 53.44 53.39 1g47 n ALA 68 Cb 0.00 -2.05 0.41 0.00 0.00 0.00 0.00 19.45 17.81 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 -2.64 0.11 -0.59 0.00 -0.04 -1.26 -4.96 135.00 125.61 1g47 n PRO 69 Ca -0.12 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1g47 n PRO 69 Cb 0.59 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1g47 n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46