#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 0.56 0.02 4.03 1.02 -1.26 -5.19 118.68 117.86 1oq3 s LEU 2 Ca 0.00 -1.09 -0.16 0.00 0.02 0.00 0.00 54.13 52.90 1oq3 s LEU 2 Cb 0.00 1.48 0.03 0.00 0.02 0.00 0.00 46.19 47.72 1oq3 s LEU 2 CO 0.00 -1.11 0.35 -0.94 0.02 0.00 0.00 176.35 174.67 1oq3 s SER 3 N -3.07 -0.21 -0.28 2.29 1.04 -1.26 -5.16 113.70 107.05 1oq3 s SER 3 Ca 0.27 -0.01 -0.24 0.00 0.48 0.00 0.00 55.95 56.44 1oq3 s SER 3 Cb 0.01 0.37 0.09 0.00 0.10 0.00 0.00 66.02 66.59 1oq3 s SER 3 CO 0.11 -0.57 0.83 -1.83 0.98 0.00 0.00 173.24 172.76 1oq3 s GLU 4 N -2.08 0.70 0.46 4.02 -1.05 -1.26 -5.19 118.70 114.31 1oq3 s GLU 4 Ca -0.08 0.87 0.07 0.00 -0.15 0.00 0.00 54.97 55.69 1oq3 s GLU 4 Cb -0.02 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.99 1oq3 s GLU 4 CO -0.00 -0.09 0.42 1.14 0.95 0.00 0.00 175.26 177.68 1oq3 s GLN 5 N 0.46 2.45 0.13 -4.83 -2.07 -1.26 -4.48 119.66 110.06 1oq3 s GLN 5 Ca -0.00 -1.65 -0.09 0.00 -1.82 0.00 0.00 55.36 51.80 1oq3 s GLN 5 Cb -0.05 -2.34 -0.00 0.00 -1.09 0.00 0.00 33.01 29.52 1oq3 s GLN 5 CO -0.04 -0.35 0.24 0.15 -1.32 0.00 0.00 175.29 173.98 1oq3 s LYS 6 N -4.22 1.01 0.25 9.60 1.02 -0.51 -5.00 119.74 121.88 1oq3 s LYS 6 Ca 0.46 -1.05 -0.23 0.00 0.02 0.00 0.00 55.97 55.17 1oq3 s LYS 6 Cb -0.03 0.36 -0.09 0.00 -0.52 0.00 0.00 37.83 37.55 1oq3 s LYS 6 CO 0.27 -0.35 0.82 -1.83 -0.92 0.00 0.00 175.35 173.35 1oq3 s GLU 7 N -3.91 4.46 0.08 1.68 -1.05 -1.26 -1.13 118.70 117.57 1oq3 s GLU 7 Ca 0.11 1.12 0.08 0.00 -0.15 0.00 0.00 54.97 56.12 1oq3 s GLU 7 Cb 0.04 -2.94 -0.03 0.00 -0.44 0.00 0.00 34.13 30.76 1oq3 s GLU 7 CO -0.06 0.39 -0.20 -1.50 0.95 0.00 0.00 175.26 174.84 1oq3 s ILE 8 N -1.47 1.65 -0.04 1.83 1.10 0.42 -4.97 121.20 119.72 1oq3 s ILE 8 Ca 0.44 -1.40 -0.01 0.00 -0.51 0.00 0.00 60.65 59.17 1oq3 s ILE 8 Cb -0.19 -1.48 0.03 0.00 0.15 0.00 0.00 42.46 40.96 1oq3 s ILE 8 CO 0.23 0.02 0.02 0.00 -2.11 0.00 0.00 174.94 173.10 1oq3 s ALA 9 N -1.04 0.39 0.16 1.50 0.00 -1.26 -0.65 121.76 120.86 1oq3 s ALA 9 Ca 0.06 0.10 -0.19 0.00 0.00 0.00 0.00 51.96 51.93 1oq3 s ALA 9 Cb -0.10 -0.52 0.04 0.00 0.00 0.00 0.00 23.12 22.55 1oq3 s ALA 9 CO 0.03 -0.30 0.51 0.00 0.00 0.00 0.00 175.76 176.00 1oq3 s MET 10 N 1.61 1.24 0.07 0.00 0.23 -0.31 -4.96 119.30 117.18 1oq3 s MET 10 Ca -0.02 -0.69 -0.07 0.00 -1.03 0.00 0.00 55.69 53.89 1oq3 s MET 10 Cb -0.13 0.52 -0.05 0.00 -1.53 0.00 0.00 34.83 33.65 1oq3 s MET 10 CO -0.03 -0.52 0.33 -0.65 -2.03 0.00 0.00 175.02 172.12 1oq3 s GLN 11 N -3.81 3.63 -0.00 3.16 1.11 -1.26 -0.96 119.66 121.53 1oq3 s GLN 11 Ca 0.04 -0.03 0.08 0.00 0.01 0.00 0.00 55.36 55.47 1oq3 s GLN 11 Cb -0.00 -2.98 -0.02 0.00 -1.01 0.00 0.00 33.01 28.99 1oq3 s GLN 11 CO -0.09 0.57 -0.26 0.08 0.01 0.00 0.00 175.29 175.60 1oq3 s VAL 12 N -1.45 2.12 -0.29 1.09 1.01 -1.25 -0.73 120.40 120.90 1oq3 s VAL 12 Ca 0.34 -1.18 -0.25 0.00 0.00 0.00 0.00 61.98 60.88 1oq3 s VAL 12 Cb -0.13 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.49 1oq3 s VAL 12 CO 0.20 0.51 0.88 -0.55 0.00 0.00 0.00 175.10 176.14 1oq3 s SER 13 N -0.81 6.79 0.00 3.32 0.15 0.00 -4.47 113.70 118.68 1oq3 s SER 13 Ca 0.11 0.88 0.00 0.00 0.70 0.00 0.00 55.95 57.63 1oq3 s SER 13 Cb -0.10 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 1oq3 s SER 13 CO 0.00 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.40 1oq3 n GLY 14 N 3.97 -0.13 0.67 9.45 0.00 -1.26 -4.09 105.19 113.80 1oq3 n GLY 14 Ca 0.06 -0.32 -0.05 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.42 0.46 -2.40 1.61 3.85 -1.26 -4.68 117.12 114.28 1oq3 n MET 15 Ca 0.00 -0.69 -0.10 0.00 -1.00 0.00 0.00 57.70 55.91 1oq3 n MET 15 Cb 0.09 0.47 -0.01 0.00 -1.05 0.00 0.00 33.22 32.73 1oq3 n MET 15 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 1oq3 n THR 16 N -0.16 -0.44 -2.48 3.17 5.66 -1.26 -4.85 114.28 113.93 1oq3 n THR 16 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 1oq3 n THR 16 Cb 0.12 -1.35 0.01 0.00 -1.55 0.00 0.00 70.33 67.57 1oq3 n THR 16 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1oq3 n ALA 18 N -0.42 -2.32 -2.35 0.00 0.00 -1.26 -4.60 120.51 109.56 1oq3 n ALA 18 Ca 0.31 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.57 1oq3 n ALA 18 Cb 0.74 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.18 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 -0.42 -0.64 0.16 0.00 0.00 -1.26 -4.90 120.51 113.45 1oq3 n ALA 19 Ca 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 53.44 53.53 1oq3 n ALA 19 Cb 0.02 -1.97 -0.03 0.00 0.00 0.00 0.00 19.45 17.46 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 -1.34 1.55 0.29 0.00 0.00 -1.91 0.23 119.26 118.08 1oq3 h ALA 21 Ca -0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1oq3 h ALA 21 Cb 0.36 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1oq3 h ALA 21 CO 0.08 0.19 -0.47 0.00 0.00 0.00 0.00 179.25 179.05 1oq3 h ALA 22 N 1.55 -0.94 -0.13 0.00 0.00 -1.96 0.72 119.26 118.51 1oq3 h ALA 22 Ca 0.51 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.31 1oq3 h ALA 22 Cb 0.54 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1oq3 h ALA 22 CO -0.28 -1.08 0.01 0.00 0.00 0.00 0.00 179.25 177.90 1oq3 h ARG 23 N -0.82 0.05 -0.28 0.00 2.47 0.18 0.97 114.38 116.96 1oq3 h ARG 23 Ca -0.02 -0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.74 1oq3 h ARG 23 Cb 0.77 -0.01 -0.08 0.00 -1.65 0.00 0.00 29.97 29.00 1oq3 h ARG 23 CO -0.16 0.04 -0.52 0.82 0.56 0.00 0.00 179.97 180.70 1oq3 h ILE 24 N 0.06 0.03 -0.29 2.04 2.04 -0.50 -0.41 117.51 120.47 1oq3 h ILE 24 Ca 0.06 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.84 1oq3 h ILE 24 Cb 0.06 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 1oq3 h ILE 24 CO -0.09 0.00 -0.11 -0.08 0.00 0.00 0.00 178.15 177.87 1oq3 h GLU 25 N -0.47 0.58 -0.98 2.37 4.22 -0.69 -2.78 114.58 116.83 1oq3 h GLU 25 Ca 0.07 -0.24 0.22 0.00 0.08 0.00 0.00 59.36 59.49 1oq3 h GLU 25 Cb 0.63 -0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.77 1oq3 h GLU 25 CO -0.52 0.80 0.63 0.87 -2.18 0.00 0.00 179.01 178.61 1oq3 h LYS 26 N 0.33 0.47 -0.31 1.92 1.79 -0.35 0.88 116.57 121.30 1oq3 h LYS 26 Ca 0.07 -0.03 0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1oq3 h LYS 26 Cb 0.61 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.12 1oq3 h LYS 26 CO 0.04 0.31 0.10 0.78 -1.08 0.00 0.00 179.45 179.60 1oq3 h GLY 27 N 0.49 0.38 2.00 3.86 0.00 -0.80 -2.39 103.07 106.60 1oq3 h GLY 27 Ca 0.54 -0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.77 1oq3 h GLY 27 CO -0.27 0.02 -0.22 1.41 0.00 0.00 0.00 176.54 177.48 1oq3 h LEU 28 N 0.23 0.00 -2.49 3.11 3.38 0.69 -0.75 115.31 119.48 1oq3 h LEU 28 Ca 0.14 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1oq3 h LEU 28 Cb 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1oq3 h LEU 28 CO -0.15 0.22 0.03 0.50 0.09 0.00 0.00 178.44 179.14 1oq3 h LYS 29 N 0.00 0.00 0.00 1.13 3.64 -0.02 0.21 116.57 121.53 1oq3 h LYS 29 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1oq3 h LYS 29 Cb 0.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1oq3 h LYS 29 CO 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.21 1oq3 h ARG 30 N 0.00 0.00 -6.64 1.90 -0.00 -0.97 -3.47 114.38 105.20 1oq3 h ARG 30 Ca 0.00 0.00 -0.52 0.00 -0.50 0.00 0.00 59.98 58.96 1oq3 h ARG 30 Cb 0.07 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.05 1oq3 h ARG 30 CO 0.00 0.00 0.51 -1.64 0.00 0.00 0.00 179.97 178.84 1oq3 s MET 31 N -3.33 4.55 -0.76 0.04 -1.94 0.74 -4.93 119.30 113.67 1oq3 s MET 31 Ca 0.06 1.76 -0.26 0.00 -1.71 0.00 0.00 55.69 55.55 1oq3 s MET 31 Cb 0.08 -3.27 -0.03 0.00 2.01 0.00 0.00 34.83 33.62 1oq3 s MET 31 CO 0.57 -0.00 1.85 -1.25 -0.01 0.00 0.00 175.02 176.18 1oq3 s PRO 32 N -0.21 2.67 0.00 2.03 0.04 -1.26 -2.08 135.00 136.19 1oq3 s PRO 32 Ca 0.51 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.65 1oq3 s PRO 32 Cb -0.30 -4.72 0.00 0.00 0.04 0.00 0.00 34.50 29.52 1oq3 s PRO 32 CO 0.35 -2.96 0.00 0.41 0.04 0.00 0.00 177.00 174.84 1oq3 n GLY 33 N 6.24 0.78 3.75 0.56 0.00 -1.26 -4.47 105.19 110.78 1oq3 n GLY 33 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 2.88 0.10 1.61 0.11 -0.88 -0.60 120.40 123.62 1oq3 s VAL 34 Ca 0.00 0.40 -0.00 0.00 -2.93 0.00 0.00 61.98 59.45 1oq3 s VAL 34 Cb 0.00 -2.91 -0.00 0.00 -1.53 0.00 0.00 36.38 31.94 1oq3 s VAL 34 CO 0.00 -0.26 -0.01 0.41 -3.33 0.00 0.00 175.10 171.91 1oq3 n THR 35 N -2.67 1.24 -3.80 5.04 -1.04 0.17 -4.89 114.28 108.32 1oq3 n THR 35 Ca 0.11 0.41 -0.12 0.00 -2.04 0.00 0.00 64.05 62.40 1oq3 n THR 35 Cb 0.51 -1.60 -0.11 0.00 -1.82 0.00 0.00 70.33 67.31 1oq3 n THR 35 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1oq3 s ASP 36 N -6.00 -0.19 -0.06 8.00 -1.08 -1.06 -5.01 116.67 111.27 1oq3 s ASP 36 Ca -0.00 0.33 0.03 0.00 -0.52 0.00 0.00 52.55 52.39 1oq3 s ASP 36 Cb 0.00 0.41 -0.03 0.00 -1.46 0.00 0.00 42.92 41.85 1oq3 s ASP 36 CO 0.01 -0.14 -0.13 0.00 0.52 0.00 0.00 175.17 175.42 1oq3 s ALA 37 N -0.19 2.71 -0.16 3.66 0.00 -1.26 -0.23 121.76 126.29 1oq3 s ALA 37 Ca -0.03 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.93 1oq3 s ALA 37 Cb -0.03 -1.02 0.07 0.00 0.00 0.00 0.00 23.12 22.14 1oq3 s ALA 37 CO 0.01 0.54 0.18 -0.80 0.00 0.00 0.00 175.76 175.69 1oq3 s ASN 38 N -0.68 1.31 0.25 0.00 0.01 0.47 -4.99 114.94 111.31 1oq3 s ASN 38 Ca 0.10 -0.09 -0.26 0.00 -0.71 0.00 0.00 52.86 51.90 1oq3 s ASN 38 Cb -0.11 0.25 -0.09 0.00 0.41 0.00 0.00 41.25 41.71 1oq3 s ASN 38 CO 0.01 -0.30 0.88 0.54 -1.51 0.00 0.00 177.10 176.72 1oq3 s VAL 39 N 2.29 4.25 -0.51 1.60 0.11 -1.26 -0.48 120.40 126.38 1oq3 s VAL 39 Ca 0.05 1.81 0.07 0.00 -2.93 0.00 0.00 61.98 60.98 1oq3 s VAL 39 Cb -0.14 -4.11 0.26 0.00 -1.53 0.00 0.00 36.38 30.86 1oq3 s VAL 39 CO -0.09 0.33 0.66 -3.20 -3.33 0.00 0.00 175.10 169.47 1oq3 n ASN 40 N 1.06 2.10 0.31 3.54 5.15 0.72 -4.91 115.26 123.23 1oq3 n ASN 40 Ca -0.01 -3.11 0.20 0.00 -0.60 0.00 0.00 54.58 51.05 1oq3 n ASN 40 Cb 0.49 -0.65 1.04 0.00 -0.53 0.00 0.00 39.78 40.13 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 3.96 0.00 -2.42 1.20 3.38 -1.94 -0.20 115.31 119.29 1oq3 h LEU 41 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1oq3 h LEU 41 Cb 0.76 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1oq3 h LEU 41 CO 0.66 0.01 0.19 0.00 0.09 0.00 0.00 178.44 179.39 1oq3 h ALA 42 N 1.99 1.22 0.00 1.53 0.00 -1.91 -1.13 119.26 120.95 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 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1oq3 h ALA 42 CO 0.00 -0.20 -0.23 2.41 0.00 0.00 0.00 179.25 181.24 1oq3 n THR 43 N -3.00 0.82 -3.96 0.00 -1.04 -0.16 -5.01 114.28 101.92 1oq3 n THR 43 Ca -0.02 -0.97 -0.31 0.00 -2.04 0.00 0.00 64.05 60.71 1oq3 n THR 43 Cb 0.25 0.25 -0.02 0.00 -1.82 0.00 0.00 70.33 68.99 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 -0.60 -0.63 -3.92 -2.82 1.02 -0.43 -4.94 120.64 108.32 1oq3 n GLU 44 Ca 0.06 -0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.08 1oq3 n GLU 44 Cb 0.63 -2.08 -0.09 0.00 -0.02 0.00 0.00 31.44 29.87 1oq3 n GLU 44 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1oq3 s THR 45 N -3.95 0.13 0.05 2.62 2.01 -0.73 -3.95 115.64 111.81 1oq3 s THR 45 Ca 0.22 -1.05 0.06 0.00 0.31 0.00 0.00 61.69 61.23 1oq3 s THR 45 Cb -0.12 -0.85 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 1oq3 s THR 45 CO 0.75 -0.58 -0.16 0.54 -0.69 0.00 0.00 174.62 174.48 1oq3 s VAL 46 N -2.49 1.29 0.02 3.82 0.11 -0.14 -0.20 120.40 122.82 1oq3 s VAL 46 Ca -0.06 -1.17 0.06 0.00 -2.93 0.00 0.00 61.98 57.89 1oq3 s VAL 46 Cb -0.02 -1.17 -0.03 0.00 -1.53 0.00 0.00 36.38 33.63 1oq3 s VAL 46 CO -0.04 -0.01 -0.18 0.21 -3.33 0.00 0.00 175.10 171.75 1oq3 s ASN 47 N -1.36 3.81 -0.08 3.54 2.47 0.36 -1.16 114.94 122.52 1oq3 s ASN 47 Ca 0.03 -0.38 -0.08 0.00 0.42 0.00 0.00 52.86 52.84 1oq3 s ASN 47 Cb -0.09 -0.64 0.02 0.00 -1.45 0.00 0.00 41.25 39.09 1oq3 s ASN 47 CO 0.02 0.28 0.23 0.54 -3.72 0.00 0.00 177.10 174.44 1oq3 s VAL 48 N -0.87 0.01 -0.26 -5.21 0.11 0.17 -0.40 120.40 113.95 1oq3 s VAL 48 Ca 0.14 -0.07 -0.10 0.00 -2.93 0.00 0.00 61.98 59.02 1oq3 s VAL 48 Cb -0.10 -0.35 -0.05 0.00 -1.53 0.00 0.00 36.38 34.35 1oq3 s VAL 48 CO 0.04 -0.04 0.16 -0.63 -3.33 0.00 0.00 175.10 171.31 1oq3 s ILE 49 N -0.04 5.23 0.19 7.04 1.01 0.68 -0.44 121.20 134.87 1oq3 s ILE 49 Ca -0.02 0.14 -0.08 0.00 0.00 0.00 0.00 60.65 60.69 1oq3 s ILE 49 Cb -0.02 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.97 1oq3 s ILE 49 CO 0.01 0.30 0.29 -0.72 0.00 0.00 0.00 174.94 174.82 1oq3 s TYR 50 N 1.43 0.57 -0.37 3.97 -0.85 -0.28 -0.66 117.35 121.16 1oq3 s TYR 50 Ca 0.07 -0.91 -0.13 0.00 -0.52 0.00 0.00 57.07 55.58 1oq3 s TYR 50 Cb -0.15 -0.12 0.00 0.00 0.38 0.00 0.00 41.96 42.07 1oq3 s TYR 50 CO 0.08 -0.77 0.26 0.34 -1.52 0.00 0.00 175.55 173.94 1oq3 s ASP 51 N -3.03 6.03 0.00 -0.18 -1.08 0.24 -1.43 116.67 117.22 1oq3 s ASP 51 Ca 0.24 -0.65 0.00 0.00 -0.52 0.00 0.00 52.55 51.62 1oq3 s ASP 51 Cb 0.03 -2.13 0.00 0.00 -1.46 0.00 0.00 42.92 39.36 1oq3 s ASP 51 CO 0.05 -0.32 0.46 -0.81 0.52 0.00 0.00 175.17 175.06 1oq3 n PRO 52 N 5.11 0.46 -0.08 4.34 -0.04 -1.07 -0.25 135.00 143.47 1oq3 n PRO 52 Ca -0.12 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.19 1oq3 n PRO 52 Cb 0.48 -1.01 -0.12 0.00 -0.04 0.00 0.00 33.50 32.82 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 1.91 0.06 0.05 0.55 0.00 -1.94 -3.40 119.26 116.50 1oq3 h ALA 53 Ca 0.00 -0.63 -0.34 0.00 0.00 0.00 0.00 54.91 53.94 1oq3 h ALA 53 Cb 0.01 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1oq3 h ALA 53 CO 0.00 0.17 -1.97 0.39 0.00 0.00 0.00 179.25 177.84 1oq3 n GLU 54 N -4.58 0.69 -3.73 0.00 -0.58 -1.03 -5.02 120.64 106.39 1oq3 n GLU 54 Ca -0.14 0.24 -0.12 0.00 -0.42 0.00 0.00 57.16 56.71 1oq3 n GLU 54 Cb 0.49 -1.70 -0.13 0.00 -0.57 0.00 0.00 31.44 29.53 1oq3 n GLU 54 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1oq3 s THR 55 N -2.56 -0.04 0.00 2.62 2.01 0.65 -4.88 115.64 113.44 1oq3 s THR 55 Ca -0.15 0.15 0.00 0.00 0.31 0.00 0.00 61.69 61.99 1oq3 s THR 55 Cb 0.07 -0.37 0.00 0.00 0.01 0.00 0.00 72.50 72.21 1oq3 s THR 55 CO 0.78 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 175.38 1oq3 n GLY 56 N 4.20 2.09 0.17 4.40 0.00 -1.26 -2.61 105.19 112.17 1oq3 n GLY 56 Ca -0.25 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.21 -0.11 2.61 5.66 -1.26 -0.32 114.28 120.64 1oq3 n THR 57 Ca 0.00 1.06 -0.09 0.00 -3.05 0.00 0.00 64.05 61.97 1oq3 n THR 57 Cb 0.00 -1.45 -0.03 0.00 -1.55 0.00 0.00 70.33 67.30 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 0.82 -0.33 -0.12 1.79 0.00 -2.01 0.72 119.26 120.14 1oq3 h ALA 58 Ca 0.20 0.08 -0.22 0.00 0.00 0.00 0.00 54.91 54.97 1oq3 h ALA 58 Cb 0.32 0.79 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1oq3 h ALA 58 CO -0.47 -0.80 -0.79 0.00 0.00 0.00 0.00 179.25 177.19 1oq3 h ALA 59 N 0.56 0.37 0.30 0.00 0.00 -1.06 -3.30 119.26 116.12 1oq3 h ALA 59 Ca 0.15 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1oq3 h ALA 59 Cb 0.57 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1oq3 h ALA 59 CO -0.54 0.71 -0.14 0.82 0.00 0.00 0.00 179.25 180.09 1oq3 h ILE 60 N 0.46 0.73 -0.49 0.00 2.04 -0.41 -1.89 117.51 117.94 1oq3 h ILE 60 Ca -0.05 -0.47 0.10 0.00 1.00 0.00 0.00 64.86 65.43 1oq3 h ILE 60 Cb 1.41 0.98 -0.10 0.00 -0.74 0.00 0.00 36.82 38.37 1oq3 h ILE 60 CO 0.16 0.10 -0.22 1.56 0.00 0.00 0.00 178.15 179.74 1oq3 h GLN 61 N -0.67 -0.10 -0.67 2.37 7.50 -1.03 0.22 115.11 122.73 1oq3 h GLN 61 Ca -0.04 0.01 0.14 0.00 0.50 0.00 0.00 58.65 59.26 1oq3 h GLN 61 Cb 0.47 0.02 -0.11 0.00 0.05 0.00 0.00 27.48 27.91 1oq3 h GLN 61 CO 0.07 -0.07 0.02 1.49 -1.50 0.00 0.00 178.83 178.84 1oq3 h GLU 62 N -0.11 0.13 -0.15 1.46 4.57 -1.59 0.11 114.58 118.99 1oq3 h GLU 62 Ca 0.23 -0.01 -0.15 0.00 -1.18 0.00 0.00 59.36 58.25 1oq3 h GLU 62 Cb 0.47 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1oq3 h GLU 62 CO -0.56 0.08 -0.50 0.87 -1.18 0.00 0.00 179.01 177.72 1oq3 h LYS 63 N 0.13 0.60 -0.69 1.92 6.56 -0.52 -3.28 116.57 121.29 1oq3 h LYS 63 Ca 0.36 -0.45 0.12 0.00 -1.06 0.00 0.00 60.65 59.62 1oq3 h LYS 63 Cb 0.60 0.08 -0.09 0.00 -0.57 0.00 0.00 32.23 32.25 1oq3 h LYS 63 CO -0.57 1.07 0.25 0.82 -2.06 0.00 0.00 179.45 178.96 1oq3 h ILE 64 N 0.25 0.69 -0.80 1.86 1.08 0.93 0.37 117.51 121.88 1oq3 h ILE 64 Ca -0.02 -0.14 0.18 0.00 -0.39 0.00 0.00 64.86 64.49 1oq3 h ILE 64 Cb 1.12 0.25 -0.11 0.00 -3.07 0.00 0.00 36.82 35.01 1oq3 h ILE 64 CO 0.11 0.07 0.28 -0.33 -0.69 0.00 0.00 178.15 177.59 1oq3 h GLU 65 N 0.41 0.34 -0.31 2.37 4.39 -0.61 -1.04 114.58 120.12 1oq3 h GLU 65 Ca 0.37 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.89 1oq3 h GLU 65 Cb 0.52 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1oq3 h GLU 65 CO -0.37 0.22 -0.44 -0.22 -1.16 0.00 0.00 179.01 177.04 1oq3 h LYS 66 N 0.35 0.80 -0.32 2.33 1.63 -0.44 -1.53 116.57 119.40 1oq3 h LYS 66 Ca 0.47 -0.44 0.09 0.00 -0.85 0.00 0.00 60.65 59.92 1oq3 h LYS 66 Cb 0.83 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.47 1oq3 h LYS 66 CO -0.50 1.08 0.35 -0.07 -3.45 0.00 0.00 179.45 176.85 1oq3 h LEU 67 N 0.65 0.00 0.00 5.20 -0.00 0.31 -3.45 115.31 118.01 1oq3 h LEU 67 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.92 1oq3 h LEU 67 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.67 1oq3 h LEU 67 CO 0.10 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.15 1oq3 n GLY 68 N -1.46 1.75 3.28 0.83 0.00 -0.58 -4.99 105.19 104.03 1oq3 n GLY 68 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 0.49 -0.11 1.61 1.51 -1.07 -5.03 117.35 112.76 1oq3 s TYR 69 Ca 0.00 -0.87 0.03 0.00 -1.01 0.00 0.00 57.07 55.22 1oq3 s TYR 69 Cb 0.00 -0.16 -0.00 0.00 -0.11 0.00 0.00 41.96 41.69 1oq3 s TYR 69 CO 0.00 -0.65 -0.22 -3.38 -1.11 0.00 0.00 175.55 170.19 1oq3 s HIS 70 N -3.98 2.62 -0.09 2.71 -3.43 -1.26 -2.63 115.29 109.24 1oq3 s HIS 70 Ca 0.18 -1.03 -0.10 0.00 -0.80 0.00 0.00 55.06 53.31 1oq3 s HIS 70 Cb 0.04 -1.75 -0.05 0.00 -1.43 0.00 0.00 32.58 29.40 1oq3 s HIS 70 CO -0.01 -0.42 0.23 0.54 -2.00 0.00 0.00 174.74 173.09 1oq3 s VAL 71 N 0.43 5.34 0.43 -5.38 0.11 -1.26 -0.82 120.40 119.25 1oq3 s VAL 71 Ca -0.16 0.43 0.01 0.00 -2.93 0.00 0.00 61.98 59.33 1oq3 s VAL 71 Cb -0.17 -3.52 -0.01 0.00 -1.53 0.00 0.00 36.38 31.15 1oq3 s VAL 71 CO 0.07 0.59 0.64 0.68 -3.33 0.00 0.00 175.10 173.75 1oq3 s VAL 72 N -0.92 4.12 -0.57 2.04 -7.23 0.09 -4.98 120.40 112.94 1oq3 s VAL 72 Ca 0.18 -0.53 0.05 0.00 -1.81 0.00 0.00 61.98 59.87 1oq3 s VAL 72 Cb -0.14 -3.51 0.19 0.00 0.56 0.00 0.00 36.38 33.48 1oq3 s VAL 72 CO 0.07 -0.34 0.50 -0.38 -0.31 0.00 0.00 175.10 174.63 1oq3 n ILE 73 N -2.01 0.65 -4.33 -0.62 2.08 -1.26 -4.00 119.36 109.86 1oq3 n ILE 73 Ca 0.01 -4.40 -0.20 0.00 0.56 0.00 0.00 62.75 58.71 1oq3 n ILE 73 Cb 0.58 -1.99 -0.13 0.00 -0.75 0.00 0.00 39.64 37.35 1oq3 n ILE 73 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1oq3 s GLU 74 N -1.16 0.96 0.00 0.38 2.02 -1.26 -4.98 118.70 114.67 1oq3 s GLU 74 Ca 0.31 -0.84 0.00 0.00 0.02 0.00 0.00 54.97 54.46 1oq3 s GLU 74 Cb 0.04 -0.99 0.00 0.00 0.10 0.00 0.00 34.13 33.28 1oq3 s GLU 74 CO -0.15 0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.78 1oq3 n GLY 75 N 1.71 -2.20 3.68 -1.39 0.00 -1.26 -4.75 105.19 100.99 1oq3 n GLY 75 Ca -0.19 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1oq3 n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19