#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oq3 s LEU 2 N 0.00 1.70 0.09 4.03 1.02 -1.26 -5.09 118.68 119.17 1oq3 s LEU 2 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 54.13 52.94 1oq3 s LEU 2 Cb 0.00 0.33 0.00 0.00 0.02 0.00 0.00 46.19 46.54 1oq3 s LEU 2 CO 0.00 -0.74 0.00 -0.24 0.02 0.00 0.00 176.35 175.39 1oq3 n SER 3 N -0.11 -3.63 -3.71 2.29 2.88 -1.26 -5.12 113.62 104.96 1oq3 n SER 3 Ca -0.05 0.31 -0.14 0.00 -1.33 0.00 0.00 58.87 57.66 1oq3 n SER 3 Cb 0.64 -0.38 -0.08 0.00 -0.75 0.00 0.00 64.21 63.64 1oq3 n SER 3 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1oq3 s GLU 4 N -3.74 0.72 0.58 -1.46 -1.05 -1.26 -5.18 118.70 107.31 1oq3 s GLU 4 Ca 0.00 0.00 -0.02 0.00 -0.15 0.00 0.00 54.97 54.81 1oq3 s GLU 4 Cb 0.00 0.33 0.03 0.00 -0.44 0.00 0.00 34.13 34.05 1oq3 s GLU 4 CO 0.00 -0.19 0.84 1.14 0.95 0.00 0.00 175.26 178.00 1oq3 s GLN 5 N -1.08 2.56 0.14 -4.83 -2.07 -1.26 -4.47 119.66 108.64 1oq3 s GLN 5 Ca -0.11 -0.51 -0.11 0.00 -1.82 0.00 0.00 55.36 52.81 1oq3 s GLN 5 Cb -0.04 -2.39 0.00 0.00 -1.09 0.00 0.00 33.01 29.50 1oq3 s GLN 5 CO 0.05 -0.80 0.30 0.15 -1.32 0.00 0.00 175.29 173.67 1oq3 s LYS 6 N -4.89 1.06 0.15 9.60 1.02 -0.29 -4.99 119.74 121.40 1oq3 s LYS 6 Ca 0.56 -1.00 -0.25 0.00 0.02 0.00 0.00 55.97 55.31 1oq3 s LYS 6 Cb -0.10 0.40 -0.08 0.00 -0.52 0.00 0.00 37.83 37.52 1oq3 s LYS 6 CO 0.41 -0.39 0.78 -1.83 -0.92 0.00 0.00 175.35 173.40 1oq3 s GLU 7 N -3.90 4.56 0.15 1.68 -1.05 -1.26 -1.27 118.70 117.62 1oq3 s GLU 7 Ca 0.10 1.15 0.10 0.00 -0.15 0.00 0.00 54.97 56.18 1oq3 s GLU 7 Cb 0.03 -3.27 -0.04 0.00 -0.44 0.00 0.00 34.13 30.41 1oq3 s GLU 7 CO -0.06 0.54 -0.22 -1.50 0.95 0.00 0.00 175.26 174.97 1oq3 s ILE 8 N -1.03 2.56 -0.07 1.83 1.10 0.40 -4.97 121.20 121.01 1oq3 s ILE 8 Ca 0.36 -1.75 -0.03 0.00 -0.51 0.00 0.00 60.65 58.72 1oq3 s ILE 8 Cb -0.23 -2.19 0.04 0.00 0.15 0.00 0.00 42.46 40.24 1oq3 s ILE 8 CO 0.26 0.01 0.14 0.00 -2.11 0.00 0.00 174.94 173.24 1oq3 s ALA 9 N -1.33 -0.07 0.24 1.50 0.00 -1.26 -0.97 121.76 119.87 1oq3 s ALA 9 Ca 0.18 0.47 -0.18 0.00 0.00 0.00 0.00 51.96 52.43 1oq3 s ALA 9 Cb -0.09 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.28 1oq3 s ALA 9 CO 0.09 -0.54 0.59 0.00 0.00 0.00 0.00 175.76 175.90 1oq3 s MET 10 N 2.24 1.57 0.22 0.00 0.23 -0.27 -4.39 119.30 118.90 1oq3 s MET 10 Ca 0.03 -0.99 0.02 0.00 -1.03 0.00 0.00 55.69 53.72 1oq3 s MET 10 Cb -0.12 0.54 -0.04 0.00 -1.53 0.00 0.00 34.83 33.69 1oq3 s MET 10 CO -0.05 -0.68 0.38 -0.65 -2.03 0.00 0.00 175.02 171.99 1oq3 s GLN 11 N -3.92 3.47 0.28 3.16 1.11 -1.26 -0.52 119.66 121.98 1oq3 s GLN 11 Ca 0.13 -0.52 0.10 0.00 0.01 0.00 0.00 55.36 55.08 1oq3 s GLN 11 Cb -0.03 -2.86 -0.05 0.00 -1.01 0.00 0.00 33.01 29.07 1oq3 s GLN 11 CO 0.03 0.40 -0.05 0.08 0.01 0.00 0.00 175.29 175.76 1oq3 s VAL 12 N -1.94 3.08 -0.11 1.09 1.01 -1.06 -0.85 120.40 121.62 1oq3 s VAL 12 Ca 0.36 -2.06 0.01 0.00 0.00 0.00 0.00 61.98 60.30 1oq3 s VAL 12 Cb -0.10 -2.69 0.02 0.00 0.00 0.00 0.00 36.38 33.61 1oq3 s VAL 12 CO 0.30 -0.36 -0.12 -0.55 0.00 0.00 0.00 175.10 174.36 1oq3 s SER 13 N -3.64 2.33 0.00 3.32 0.15 0.77 -4.83 113.70 111.82 1oq3 s SER 13 Ca 0.31 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.58 1oq3 s SER 13 Cb -0.05 -1.01 0.00 0.00 -1.71 0.00 0.00 66.02 63.25 1oq3 s SER 13 CO 0.19 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.20 1oq3 n GLY 14 N 4.49 2.22 3.51 9.45 0.00 -1.26 -2.70 105.19 120.90 1oq3 n GLY 14 Ca -0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.41 1oq3 n GLY 14 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1oq3 n MET 15 N -0.23 0.82 -0.43 1.61 3.85 -1.26 -4.94 117.12 116.53 1oq3 n MET 15 Ca 0.00 0.29 0.06 0.00 -1.00 0.00 0.00 57.70 57.05 1oq3 n MET 15 Cb 0.00 -1.57 0.11 0.00 -1.05 0.00 0.00 33.22 30.71 1oq3 n MET 15 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1oq3 n THR 16 N -0.20 1.28 -2.96 3.17 -2.24 -1.26 -5.04 114.28 107.02 1oq3 n THR 16 Ca 0.12 -1.76 0.00 0.00 -2.27 0.00 0.00 64.05 60.14 1oq3 n THR 16 Cb 0.33 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1oq3 n THR 16 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oq3 n ALA 18 N 9.74 0.00 -1.65 0.00 0.00 -1.26 -0.55 120.51 126.79 1oq3 n ALA 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1oq3 n ALA 18 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1oq3 n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oq3 n ALA 19 N 1.55 1.38 0.17 0.00 0.00 -1.26 -4.99 120.51 117.36 1oq3 n ALA 19 Ca 0.00 -0.39 -0.08 0.00 0.00 0.00 0.00 53.44 52.97 1oq3 n ALA 19 Cb 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 19.45 19.31 1oq3 n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oq3 h ALA 21 N -1.27 1.76 0.10 0.00 0.00 -1.96 0.13 119.26 118.02 1oq3 h ALA 21 Ca -0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1oq3 h ALA 21 Cb 0.38 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1oq3 h ALA 21 CO 0.08 0.22 -0.20 0.00 0.00 0.00 0.00 179.25 179.35 1oq3 h ALA 22 N 1.79 -0.33 -0.27 0.00 0.00 -1.90 -0.61 119.26 117.93 1oq3 h ALA 22 Ca 0.12 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1oq3 h ALA 22 Cb -0.04 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1oq3 h ALA 22 CO -0.03 -0.73 -0.05 0.00 0.00 0.00 0.00 179.25 178.45 1oq3 h ARG 23 N -0.38 0.02 -0.14 0.00 2.47 0.10 0.12 114.38 116.57 1oq3 h ARG 23 Ca 0.03 -0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.78 1oq3 h ARG 23 Cb 0.41 -0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.66 1oq3 h ARG 23 CO -0.12 0.01 -0.51 0.82 0.56 0.00 0.00 179.97 180.73 1oq3 h ILE 24 N 0.02 0.00 -0.37 2.04 2.04 -0.57 0.08 117.51 120.75 1oq3 h ILE 24 Ca 0.13 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.85 1oq3 h ILE 24 Cb 0.20 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1oq3 h ILE 24 CO -0.27 0.00 -0.34 -0.08 0.00 0.00 0.00 178.15 177.46 1oq3 h GLU 25 N -0.54 0.85 -0.14 2.37 4.22 -0.96 -2.43 114.58 117.95 1oq3 h GLU 25 Ca 0.03 -0.42 0.04 0.00 0.08 0.00 0.00 59.36 59.09 1oq3 h GLU 25 Cb 0.63 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1oq3 h GLU 25 CO -0.42 1.06 0.12 0.87 -2.18 0.00 0.00 179.01 178.46 1oq3 h LYS 26 N 0.71 0.00 0.00 1.92 1.79 -0.30 0.56 116.57 121.25 1oq3 h LYS 26 Ca 0.07 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.56 1oq3 h LYS 26 Cb 0.90 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.52 1oq3 h LYS 26 CO 0.08 0.00 -0.14 0.78 -1.08 0.00 0.00 179.45 179.09 1oq3 h GLY 27 N 0.00 -0.18 2.00 3.86 0.00 -0.48 -2.95 103.07 105.32 1oq3 h GLY 27 Ca 0.07 0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 1oq3 h GLY 27 CO -0.00 -0.14 -0.20 1.41 0.00 0.00 0.00 176.54 177.61 1oq3 h LEU 28 N -0.24 0.00 -1.97 3.11 3.38 0.03 -0.30 115.31 119.33 1oq3 h LEU 28 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1oq3 h LEU 28 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1oq3 h LEU 28 CO -0.14 0.20 0.23 0.50 0.09 0.00 0.00 178.44 179.32 1oq3 h LYS 29 N 0.00 0.00 0.00 1.13 1.63 -0.59 0.19 116.57 118.93 1oq3 h LYS 29 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1oq3 h LYS 29 Cb 0.36 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 1oq3 h LYS 29 CO 0.03 0.00 -0.46 0.54 -3.45 0.00 0.00 179.45 176.11 1oq3 n ARG 30 N -2.73 0.28 -2.41 1.90 3.00 -0.12 -4.91 116.66 111.66 1oq3 n ARG 30 Ca -0.02 0.12 -0.41 0.00 -0.01 0.00 0.00 57.85 57.53 1oq3 n ARG 30 Cb 0.28 -1.72 -0.04 0.00 0.00 0.00 0.00 32.46 30.98 1oq3 n ARG 30 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 1oq3 s MET 31 N -3.15 4.57 -0.83 5.56 -1.94 0.66 -4.90 119.30 119.27 1oq3 s MET 31 Ca 0.07 1.87 -0.25 0.00 -1.71 0.00 0.00 55.69 55.67 1oq3 s MET 31 Cb 0.13 -3.19 -0.06 0.00 2.01 0.00 0.00 34.83 33.72 1oq3 s MET 31 CO 0.69 0.08 2.02 -1.25 -0.01 0.00 0.00 175.02 176.54 1oq3 s PRO 32 N -1.10 2.41 0.00 2.03 0.04 -1.26 -1.55 135.00 135.57 1oq3 s PRO 32 Ca 0.47 0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.53 1oq3 s PRO 32 Cb -0.33 -4.90 0.00 0.00 0.04 0.00 0.00 34.50 29.31 1oq3 s PRO 32 CO 0.41 -3.43 0.00 0.41 0.04 0.00 0.00 177.00 174.43 1oq3 n GLY 33 N 6.64 0.72 3.75 0.56 0.00 -1.26 -4.21 105.19 111.40 1oq3 n GLY 33 Ca 0.38 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.02 1oq3 n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oq3 s VAL 34 N -0.34 2.22 -0.02 1.61 0.11 -0.59 -0.26 120.40 123.11 1oq3 s VAL 34 Ca 0.00 0.17 -0.03 0.00 -2.93 0.00 0.00 61.98 59.19 1oq3 s VAL 34 Cb 0.00 -3.09 -0.01 0.00 -1.53 0.00 0.00 36.38 31.75 1oq3 s VAL 34 CO 0.00 0.00 -0.06 0.41 -3.33 0.00 0.00 175.10 172.12 1oq3 n THR 35 N -0.86 0.32 -3.69 5.04 -1.04 0.40 -4.89 114.28 109.56 1oq3 n THR 35 Ca 0.09 0.34 -0.11 0.00 -2.04 0.00 0.00 64.05 62.33 1oq3 n THR 35 Cb 0.45 -1.55 -0.11 0.00 -1.82 0.00 0.00 70.33 67.30 1oq3 n THR 35 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1oq3 s ASP 36 N -4.62 -0.29 0.24 8.00 1.01 -0.90 -4.99 116.67 115.11 1oq3 s ASP 36 Ca -0.05 0.79 -0.09 0.00 0.71 0.00 0.00 52.55 53.91 1oq3 s ASP 36 Cb 0.01 0.78 -0.07 0.00 1.01 0.00 0.00 42.92 44.65 1oq3 s ASP 36 CO 0.07 -0.20 0.55 0.00 0.21 0.00 0.00 175.17 175.80 1oq3 s ALA 37 N 1.73 3.58 -0.29 5.23 0.00 -1.26 -0.44 121.76 130.31 1oq3 s ALA 37 Ca -0.07 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.60 1oq3 s ALA 37 Cb -0.10 -2.41 0.17 0.00 0.00 0.00 0.00 23.12 20.79 1oq3 s ALA 37 CO -0.11 0.47 0.47 -0.80 0.00 0.00 0.00 175.76 175.79 1oq3 s ASN 38 N -2.49 -0.29 0.15 0.00 0.01 0.11 -4.96 114.94 107.46 1oq3 s ASN 38 Ca 0.47 -0.19 -0.23 0.00 -0.71 0.00 0.00 52.86 52.20 1oq3 s ASN 38 Cb -0.11 1.42 -0.08 0.00 0.41 0.00 0.00 41.25 42.89 1oq3 s ASN 38 CO 0.23 -0.34 0.71 0.54 -1.51 0.00 0.00 177.10 176.73 1oq3 s VAL 39 N 2.64 4.50 -0.43 1.60 0.11 -1.26 -0.60 120.40 126.96 1oq3 s VAL 39 Ca 0.10 1.50 0.08 0.00 -2.93 0.00 0.00 61.98 60.72 1oq3 s VAL 39 Cb -0.12 -4.03 0.25 0.00 -1.53 0.00 0.00 36.38 30.96 1oq3 s VAL 39 CO -0.29 0.48 0.57 -3.20 -3.33 0.00 0.00 175.10 169.33 1oq3 n ASN 40 N 1.49 0.78 0.17 3.54 5.15 0.12 -4.95 115.26 121.56 1oq3 n ASN 40 Ca -0.06 -2.83 0.13 0.00 -0.60 0.00 0.00 54.58 51.22 1oq3 n ASN 40 Cb 0.50 -0.64 0.60 0.00 -0.53 0.00 0.00 39.78 39.70 1oq3 n ASN 40 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1oq3 h LEU 41 N 3.98 0.00 -1.69 1.20 3.38 -1.92 0.02 115.31 120.27 1oq3 h LEU 41 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1oq3 h LEU 41 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1oq3 h LEU 41 CO 0.52 0.00 0.17 0.00 0.09 0.00 0.00 178.44 179.23 1oq3 h ALA 42 N 2.12 1.14 0.00 1.53 0.00 -1.92 -1.43 119.26 120.70 1oq3 h ALA 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1oq3 h ALA 42 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1oq3 h ALA 42 CO 0.00 -0.14 -0.37 2.41 0.00 0.00 0.00 179.25 181.15 1oq3 n THR 43 N -2.50 0.31 -2.87 0.00 -1.04 -0.10 -5.00 114.28 103.07 1oq3 n THR 43 Ca -0.02 -0.36 -0.15 0.00 -2.04 0.00 0.00 64.05 61.48 1oq3 n THR 43 Cb 0.21 0.43 -0.01 0.00 -1.82 0.00 0.00 70.33 69.15 1oq3 n THR 43 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1oq3 n GLU 44 N -0.23 -2.73 -4.24 -2.82 4.71 -0.54 -4.90 120.64 109.88 1oq3 n GLU 44 Ca 0.02 0.39 -0.20 0.00 -0.01 0.00 0.00 57.16 57.36 1oq3 n GLU 44 Cb 0.66 -5.01 -0.12 0.00 -1.01 0.00 0.00 31.44 25.97 1oq3 n GLU 44 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1oq3 s THR 45 N -2.61 1.43 0.01 2.62 2.01 -0.63 -2.57 115.64 115.90 1oq3 s THR 45 Ca 0.18 -1.54 0.03 0.00 0.31 0.00 0.00 61.69 60.67 1oq3 s THR 45 Cb -0.10 -1.41 -0.01 0.00 0.01 0.00 0.00 72.50 70.99 1oq3 s THR 45 CO 0.22 -0.22 -0.08 0.54 -0.69 0.00 0.00 174.62 174.38 1oq3 s VAL 46 N -1.50 0.65 0.00 3.82 0.11 0.32 0.16 120.40 123.96 1oq3 s VAL 46 Ca 0.05 -0.53 0.06 0.00 -2.93 0.00 0.00 61.98 58.63 1oq3 s VAL 46 Cb -0.08 -0.58 -0.03 0.00 -1.53 0.00 0.00 36.38 34.16 1oq3 s VAL 46 CO 0.03 0.05 -0.19 0.21 -3.33 0.00 0.00 175.10 171.88 1oq3 s ASN 47 N -0.53 3.68 -0.12 3.54 2.47 0.23 -1.11 114.94 123.09 1oq3 s ASN 47 Ca 0.01 -0.38 -0.12 0.00 0.42 0.00 0.00 52.86 52.79 1oq3 s ASN 47 Cb -0.05 -0.61 0.03 0.00 -1.45 0.00 0.00 41.25 39.18 1oq3 s ASN 47 CO 0.00 0.30 0.34 0.54 -3.72 0.00 0.00 177.10 174.55 1oq3 s VAL 48 N -0.80 0.00 -0.22 -5.21 0.11 -0.15 0.03 120.40 114.18 1oq3 s VAL 48 Ca 0.13 -0.02 -0.10 0.00 -2.93 0.00 0.00 61.98 59.06 1oq3 s VAL 48 Cb -0.10 -0.48 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1oq3 s VAL 48 CO 0.02 -0.01 0.13 -0.63 -3.33 0.00 0.00 175.10 171.29 1oq3 s ILE 49 N 0.12 5.27 0.26 7.04 1.01 0.42 -0.45 121.20 134.86 1oq3 s ILE 49 Ca -0.01 0.14 -0.10 0.00 0.00 0.00 0.00 60.65 60.69 1oq3 s ILE 49 Cb -0.02 -3.43 -0.01 0.00 0.01 0.00 0.00 42.46 39.01 1oq3 s ILE 49 CO 0.01 0.40 0.44 -0.72 0.00 0.00 0.00 174.94 175.06 1oq3 s TYR 50 N 0.71 0.57 -0.41 3.97 -0.85 -0.39 -0.45 117.35 120.49 1oq3 s TYR 50 Ca 0.07 -0.90 -0.11 0.00 -0.52 0.00 0.00 57.07 55.62 1oq3 s TYR 50 Cb -0.12 0.06 0.06 0.00 0.38 0.00 0.00 41.96 42.34 1oq3 s TYR 50 CO 0.01 -0.98 0.26 0.34 -1.52 0.00 0.00 175.55 173.67 1oq3 s ASP 51 N -3.07 5.74 0.00 -0.18 -1.08 0.63 -1.14 116.67 117.57 1oq3 s ASP 51 Ca 0.26 -1.34 0.00 0.00 -0.52 0.00 0.00 52.55 50.95 1oq3 s ASP 51 Cb 0.00 -2.02 0.00 0.00 -1.46 0.00 0.00 42.92 39.44 1oq3 s ASP 51 CO 0.11 -0.51 0.30 -0.81 0.52 0.00 0.00 175.17 174.78 1oq3 n PRO 52 N 4.98 0.54 0.03 4.34 -0.04 -1.01 -0.26 135.00 143.58 1oq3 n PRO 52 Ca -0.11 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.13 1oq3 n PRO 52 Cb 0.44 -1.27 -0.14 0.00 -0.04 0.00 0.00 33.50 32.49 1oq3 n PRO 52 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1oq3 h ALA 53 N 1.58 0.23 0.00 0.55 0.00 -1.93 -3.42 119.26 116.27 1oq3 h ALA 53 Ca 0.00 -1.19 -0.38 0.00 0.00 0.00 0.00 54.91 53.34 1oq3 h ALA 53 Cb 0.30 0.53 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 1oq3 h ALA 53 CO 0.00 1.03 -2.27 0.39 0.00 0.00 0.00 179.25 178.40 1oq3 n GLU 54 N -3.69 0.48 -4.71 0.00 1.02 -0.76 -5.08 120.64 107.91 1oq3 n GLU 54 Ca -0.27 0.21 -0.25 0.00 -0.02 0.00 0.00 57.16 56.83 1oq3 n GLU 54 Cb 1.01 -1.31 -0.16 0.00 -0.02 0.00 0.00 31.44 30.95 1oq3 n GLU 54 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1oq3 s THR 55 N -2.42 1.29 0.00 2.62 2.01 0.65 -4.95 115.64 114.83 1oq3 s THR 55 Ca -0.32 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.09 1oq3 s THR 55 Cb 0.12 -1.15 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1oq3 s THR 55 CO 0.40 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 175.33 1oq3 n GLY 56 N 3.56 2.58 0.20 4.40 0.00 -1.26 -2.42 105.19 112.25 1oq3 n GLY 56 Ca -0.21 -0.77 0.11 0.00 0.00 0.00 0.00 46.02 45.15 1oq3 n GLY 56 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1oq3 n THR 57 N 0.00 -0.24 -0.11 2.61 5.66 -1.26 -0.40 114.28 120.54 1oq3 n THR 57 Ca 0.00 1.24 -0.10 0.00 -3.05 0.00 0.00 64.05 62.14 1oq3 n THR 57 Cb 0.00 -1.86 -0.05 0.00 -1.55 0.00 0.00 70.33 66.87 1oq3 n THR 57 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1oq3 h ALA 58 N 1.15 -0.45 -0.09 1.79 0.00 -1.99 0.12 119.26 119.79 1oq3 h ALA 58 Ca 0.38 0.05 -0.20 0.00 0.00 0.00 0.00 54.91 55.15 1oq3 h ALA 58 Cb 0.86 0.88 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1oq3 h ALA 58 CO -0.52 -0.87 -0.77 0.00 0.00 0.00 0.00 179.25 177.09 1oq3 h ALA 59 N 0.39 0.49 0.39 0.00 0.00 -1.09 -3.29 119.26 116.14 1oq3 h ALA 59 Ca 0.13 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1oq3 h ALA 59 Cb 0.59 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1oq3 h ALA 59 CO -0.55 0.75 -0.19 0.82 0.00 0.00 0.00 179.25 180.08 1oq3 h ILE 60 N 0.34 0.60 -0.48 0.00 2.04 -0.69 -2.01 117.51 117.31 1oq3 h ILE 60 Ca -0.04 -0.37 0.10 0.00 1.00 0.00 0.00 64.86 65.55 1oq3 h ILE 60 Cb 1.37 0.78 -0.10 0.00 -0.74 0.00 0.00 36.82 38.13 1oq3 h ILE 60 CO 0.14 0.07 -0.17 1.56 0.00 0.00 0.00 178.15 179.74 1oq3 h GLN 61 N -0.74 -0.06 -0.76 2.37 7.50 -0.92 0.16 115.11 122.66 1oq3 h GLN 61 Ca -0.05 0.00 0.11 0.00 0.50 0.00 0.00 58.65 59.21 1oq3 h GLN 61 Cb 0.51 0.01 -0.12 0.00 0.05 0.00 0.00 27.48 27.93 1oq3 h GLN 61 CO 0.09 -0.04 -0.44 1.49 -1.50 0.00 0.00 178.83 178.42 1oq3 h GLU 62 N -0.06 -0.12 -0.32 1.46 4.22 -1.58 0.13 114.58 118.30 1oq3 h GLU 62 Ca 0.23 0.01 -0.13 0.00 0.08 0.00 0.00 59.36 59.55 1oq3 h GLU 62 Cb 0.42 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1oq3 h GLU 62 CO -0.53 -0.08 -0.31 0.87 -2.18 0.00 0.00 179.01 176.77 1oq3 h LYS 63 N -0.13 0.77 -0.68 1.92 6.56 -0.59 -3.14 116.57 121.29 1oq3 h LYS 63 Ca 0.22 -0.41 0.11 0.00 -1.06 0.00 0.00 60.65 59.52 1oq3 h LYS 63 Cb 0.55 0.01 -0.08 0.00 -0.57 0.00 0.00 32.23 32.14 1oq3 h LYS 63 CO -0.81 1.03 0.28 0.82 -2.06 0.00 0.00 179.45 178.71 1oq3 h ILE 64 N 0.54 0.75 -0.30 1.86 1.08 0.41 0.11 117.51 121.95 1oq3 h ILE 64 Ca 0.05 -0.16 0.07 0.00 -0.39 0.00 0.00 64.86 64.43 1oq3 h ILE 64 Cb 0.89 0.25 -0.08 0.00 -3.07 0.00 0.00 36.82 34.81 1oq3 h ILE 64 CO 0.08 0.08 -0.24 -0.33 -0.69 0.00 0.00 178.15 177.05 1oq3 h GLU 65 N 0.46 -0.21 -0.51 2.37 4.39 -0.65 -2.45 114.58 117.98 1oq3 h GLU 65 Ca 0.35 0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.99 1oq3 h GLU 65 Cb 0.46 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 1oq3 h GLU 65 CO -0.33 -0.14 0.01 -0.22 -1.16 0.00 0.00 179.01 177.17 1oq3 h LYS 66 N -0.22 0.85 0.00 2.33 3.11 -1.01 0.13 116.57 121.76 1oq3 h LYS 66 Ca 0.16 -0.23 0.00 0.00 -2.81 0.00 0.00 60.65 57.76 1oq3 h LYS 66 Cb 0.46 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 31.59 1oq3 h LYS 66 CO -0.43 0.84 0.28 -0.07 -2.81 0.00 0.00 179.45 177.26 1oq3 h LEU 67 N 0.79 0.00 0.00 5.20 4.07 -0.44 -3.45 115.31 121.48 1oq3 h LEU 67 Ca 0.15 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1oq3 h LEU 67 Cb 0.46 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.20 1oq3 h LEU 67 CO 0.02 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.99 1oq3 n GLY 68 N -1.20 1.87 3.31 0.83 0.00 0.45 -5.00 105.19 105.46 1oq3 n GLY 68 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1oq3 n GLY 68 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oq3 s TYR 69 N -2.00 1.05 -0.08 1.61 1.51 -0.98 -5.01 117.35 113.44 1oq3 s TYR 69 Ca 0.00 -1.27 0.02 0.00 -1.01 0.00 0.00 57.07 54.82 1oq3 s TYR 69 Cb 0.00 -0.39 0.01 0.00 -0.11 0.00 0.00 41.96 41.47 1oq3 s TYR 69 CO 0.00 -0.77 -0.15 -1.58 -1.11 0.00 0.00 175.55 171.94 1oq3 s HIS 70 N -3.98 1.81 0.02 2.71 5.65 -1.10 -2.86 115.29 117.54 1oq3 s HIS 70 Ca 0.35 -0.74 -0.12 0.00 0.25 0.00 0.00 55.06 54.81 1oq3 s HIS 70 Cb 0.04 -1.29 -0.06 0.00 -1.18 0.00 0.00 32.58 30.10 1oq3 s HIS 70 CO 0.14 -0.36 0.38 0.54 -0.65 0.00 0.00 174.74 174.78 1oq3 s VAL 71 N 0.68 5.11 0.40 0.89 0.11 -1.26 -0.16 120.40 126.17 1oq3 s VAL 71 Ca -0.13 0.60 -0.00 0.00 -2.93 0.00 0.00 61.98 59.51 1oq3 s VAL 71 Cb -0.16 -3.65 -0.02 0.00 -1.53 0.00 0.00 36.38 31.02 1oq3 s VAL 71 CO 0.04 0.46 0.62 0.68 -3.33 0.00 0.00 175.10 173.56 1oq3 s VAL 72 N -1.21 4.68 -0.47 2.04 -7.23 -0.03 -4.95 120.40 113.22 1oq3 s VAL 72 Ca 0.27 -0.41 0.03 0.00 -1.81 0.00 0.00 61.98 60.06 1oq3 s VAL 72 Cb -0.15 -3.72 0.13 0.00 0.56 0.00 0.00 36.38 33.20 1oq3 s VAL 72 CO 0.15 -0.51 0.24 -0.63 -0.31 0.00 0.00 175.10 174.04 1oq3 s ILE 73 N -2.45 1.93 -0.14 -0.62 -1.09 -1.26 -3.99 121.20 113.58 1oq3 s ILE 73 Ca 0.44 -2.85 -0.04 0.00 -2.23 0.00 0.00 60.65 55.96 1oq3 s ILE 73 Cb -0.10 -2.35 0.07 0.00 -1.58 0.00 0.00 42.46 38.50 1oq3 s ILE 73 CO 0.38 -0.84 0.23 -0.70 -1.23 0.00 0.00 174.94 172.78 1oq3 s GLU 74 N 0.12 0.14 0.00 2.79 2.12 -1.26 -4.99 118.70 117.62 1oq3 s GLU 74 Ca 0.17 0.55 0.00 0.00 0.36 0.00 0.00 54.97 56.05 1oq3 s GLU 74 Cb -0.25 -0.42 0.00 0.00 0.26 0.00 0.00 34.13 33.72 1oq3 s GLU 74 CO -0.01 -0.40 0.00 0.41 -0.54 0.00 0.00 175.26 174.73 1oq3 n GLY 75 N 5.34 1.92 0.00 -1.50 0.00 -1.26 -4.67 105.19 105.01 1oq3 n GLY 75 Ca -0.05 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1oq3 n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19