#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 0.55 0.11 4.03 2.96 -1.26 -5.10 118.68 119.97 1oq3 s LEU 2 Ca 0.00 0.97 -0.01 0.00 -0.22 0.00 0.00 54.13 54.87 1oq3 s LEU 2 Cb 0.00 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.87 1oq3 s LEU 2 CO 0.00 -4.16 0.02 -0.55 -1.32 0.00 0.00 176.35 170.33 1oq3 s SER 3 N -3.37 0.50 0.00 3.68 0.15 -1.26 -5.18 113.70 108.22 1oq3 s SER 3 Ca 0.69 -1.13 -0.28 0.00 0.70 0.00 0.00 55.95 55.92 1oq3 s SER 3 Cb -0.16 0.24 0.07 0.00 -1.71 0.00 0.00 66.02 64.46 1oq3 s SER 3 CO 0.58 -0.66 0.65 -1.83 1.20 0.00 0.00 173.24 173.18 1oq3 s GLU 4 N -3.98 1.10 0.73 5.44 1.03 -1.26 -5.18 118.70 116.57 1oq3 s GLU 4 Ca 0.18 0.07 -0.05 0.00 0.03 0.00 0.00 54.97 55.20 1oq3 s GLU 4 Cb 0.07 0.51 0.11 0.00 -0.80 0.00 0.00 34.13 34.03 1oq3 s GLU 4 CO -0.02 -0.38 1.03 1.14 -1.33 0.00 0.00 175.26 175.70 1oq3 s GLN 5 N -1.80 1.75 0.11 -4.83 -2.07 -1.26 -4.48 119.66 107.08 1oq3 s GLN 5 Ca -0.08 -0.72 -0.08 0.00 -1.82 0.00 0.00 55.36 52.66 1oq3 s GLN 5 Cb -0.00 -2.23 -0.01 0.00 -1.09 0.00 0.00 33.01 29.68 1oq3 s GLN 5 CO 0.04 -1.46 0.19 0.21 -1.32 0.00 0.00 175.29 172.96 1oq3 s LYS 6 N -5.25 0.91 0.07 9.60 2.20 -0.30 -4.99 119.74 121.99 1oq3 s LYS 6 Ca 0.65 -1.05 -0.24 0.00 -0.36 0.00 0.00 55.97 54.96 1oq3 s LYS 6 Cb -0.07 0.34 -0.06 0.00 -1.51 0.00 0.00 37.83 36.52 1oq3 s LYS 6 CO 0.45 -0.29 0.73 -1.83 -0.36 0.00 0.00 175.35 174.05 1oq3 s GLU 7 N -3.90 4.47 0.15 4.03 4.04 -1.26 -1.18 118.70 125.05 1oq3 s GLU 7 Ca 0.09 1.02 0.05 0.00 0.04 0.00 0.00 54.97 56.18 1oq3 s GLU 7 Cb 0.05 -3.33 -0.04 0.00 0.02 0.00 0.00 34.13 30.83 1oq3 s GLU 7 CO -0.08 0.39 0.08 -1.50 -1.84 0.00 0.00 175.26 172.31 1oq3 s ILE 8 N -0.41 4.23 -0.08 1.83 1.10 0.14 -4.97 121.20 123.04 1oq3 s ILE 8 Ca 0.36 -1.14 -0.04 0.00 -0.51 0.00 0.00 60.65 59.33 1oq3 s ILE 8 Cb -0.21 -3.13 0.04 0.00 0.15 0.00 0.00 42.46 39.32 1oq3 s ILE 8 CO 0.23 -0.07 0.18 0.00 -2.11 0.00 0.00 174.94 173.18 1oq3 s ALA 9 N -1.67 -0.36 0.30 1.50 0.00 -1.26 -0.98 121.76 119.29 1oq3 s ALA 9 Ca 0.29 0.78 -0.16 0.00 0.00 0.00 0.00 51.96 52.87 1oq3 s ALA 9 Cb -0.10 -0.57 0.02 0.00 0.00 0.00 0.00 23.12 22.46 1oq3 s ALA 9 CO 0.21 -0.23 0.65 0.00 0.00 0.00 0.00 175.76 176.39 1oq3 s MET 10 N 1.37 1.82 0.37 0.00 0.23 -0.26 -4.99 119.30 117.84 1oq3 s MET 10 Ca -0.08 -1.21 -0.04 0.00 -1.03 0.00 0.00 55.69 53.33 1oq3 s MET 10 Cb -0.11 0.56 -0.04 0.00 -1.53 0.00 0.00 34.83 33.70 1oq3 s MET 10 CO -0.07 -0.81 0.64 -0.65 -2.03 0.00 0.00 175.02 172.10 1oq3 s GLN 11 N -3.57 3.59 -0.07 3.16 1.11 -1.18 -0.81 119.66 121.89 1oq3 s GLN 11 Ca 0.17 0.04 0.04 0.00 0.01 0.00 0.00 55.36 55.61 1oq3 s GLN 11 Cb -0.04 -2.54 0.00 0.00 -1.01 0.00 0.00 33.01 29.42 1oq3 s GLN 11 CO 0.09 0.05 -0.20 0.08 0.01 0.00 0.00 175.29 175.33 1oq3 s VAL 12 N -2.35 1.71 -0.28 1.09 1.01 -1.19 -1.35 120.40 119.04 1oq3 s VAL 12 Ca 0.45 -0.84 -0.22 0.00 0.00 0.00 0.00 61.98 61.37 1oq3 s VAL 12 Cb -0.10 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 1oq3 s VAL 12 CO 0.36 0.48 0.70 -0.55 0.00 0.00 0.00 175.10 176.09 1oq3 s SER 13 N 0.26 6.63 0.00 3.32 0.15 0.55 -4.60 113.70 120.01 1oq3 s SER 13 Ca -0.12 0.69 0.00 0.00 0.70 0.00 0.00 55.95 57.22 1oq3 s SER 13 Cb -0.15 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1oq3 s SER 13 CO 0.05 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.62 1oq3 n GLY 14 N 4.16 0.47 3.68 9.45 0.00 -1.26 -2.81 105.19 118.88 1oq3 n GLY 14 Ca 0.01 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 1oq3 n GLY 14 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1oq3 n MET 15 N 0.00 -1.75 0.17 1.61 0.00 -1.26 -4.87 117.12 111.02 1oq3 n MET 15 Ca 0.00 0.49 0.13 0.00 0.00 0.00 0.00 57.70 58.32 1oq3 n MET 15 Cb 0.00 -4.34 0.54 0.00 0.00 0.00 0.00 33.22 29.43 1oq3 n MET 15 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 1oq3 h THR 16 N -1.84 0.00 -0.97 1.12 2.02 -1.96 -3.50 112.91 107.78 1oq3 h THR 16 Ca -0.65 -0.31 0.12 0.00 0.77 0.00 0.00 66.41 66.33 1oq3 h THR 16 Cb 1.36 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 68.86 1oq3 h THR 16 CO 0.50 0.00 -0.17 0.00 0.37 0.00 0.00 175.52 176.22 1oq3 n ALA 18 N -1.55 -2.43 -1.23 0.00 0.00 -1.26 -3.20 120.51 110.84 1oq3 n ALA 18 Ca 0.00 0.12 -0.08 0.00 0.00 0.00 0.00 53.44 53.49 1oq3 n ALA 18 Cb 0.20 -5.49 -0.03 0.00 0.00 0.00 0.00 19.45 14.12 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 -3.27 -0.12 0.17 0.00 0.00 -1.26 -4.89 120.51 111.14 1oq3 n ALA 19 Ca -0.09 0.13 -0.09 0.00 0.00 0.00 0.00 53.44 53.39 1oq3 n ALA 19 Cb 0.62 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.68 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 -0.98 2.18 -0.15 0.00 0.00 -1.90 0.34 119.26 118.75 1oq3 h ALA 21 Ca -0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1oq3 h ALA 21 Cb 0.45 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1oq3 h ALA 21 CO 0.09 -0.38 -0.06 0.00 0.00 0.00 0.00 179.25 178.89 1oq3 h ALA 22 N 1.81 0.21 -0.72 0.00 0.00 -1.92 -3.15 119.26 115.50 1oq3 h ALA 22 Ca 0.14 -0.26 0.12 0.00 0.00 0.00 0.00 54.91 54.91 1oq3 h ALA 22 Cb 0.60 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.25 1oq3 h ALA 22 CO -0.00 -0.00 0.31 0.00 0.00 0.00 0.00 179.25 179.56 1oq3 h ARG 23 N -0.02 0.49 -0.43 0.00 3.08 0.81 0.13 114.38 118.43 1oq3 h ARG 23 Ca 0.03 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.10 1oq3 h ARG 23 Cb 0.52 -0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.39 1oq3 h ARG 23 CO 0.02 0.32 -0.46 0.82 -1.07 0.00 0.00 179.97 179.61 1oq3 h ILE 24 N 0.50 0.00 -0.15 2.04 2.04 -1.35 0.69 117.51 121.28 1oq3 h ILE 24 Ca 0.38 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 66.04 1oq3 h ILE 24 Cb 0.50 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1oq3 h ILE 24 CO -0.34 0.00 -0.72 -0.08 0.00 0.00 0.00 178.15 177.01 1oq3 h GLU 25 N -0.26 0.66 -0.60 2.37 4.57 -1.44 -2.98 114.58 116.90 1oq3 h GLU 25 Ca 0.07 -0.51 0.07 0.00 -1.18 0.00 0.00 59.36 57.81 1oq3 h GLU 25 Cb 0.45 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.10 1oq3 h GLU 25 CO -0.54 1.13 0.40 0.87 -1.18 0.00 0.00 179.01 179.69 1oq3 h LYS 26 N 0.46 0.54 -0.22 1.92 1.79 -0.38 0.31 116.57 120.99 1oq3 h LYS 26 Ca -0.03 -0.03 0.04 0.00 -2.18 0.00 0.00 60.65 58.45 1oq3 h LYS 26 Cb 1.32 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 31.81 1oq3 h LYS 26 CO 0.14 0.36 -0.04 0.78 -1.08 0.00 0.00 179.45 179.61 1oq3 h GLY 27 N 0.56 0.18 1.75 3.86 0.00 -0.71 -2.68 103.07 106.01 1oq3 h GLY 27 Ca 0.26 0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.60 1oq3 h GLY 27 CO -0.08 -0.07 -0.11 1.41 0.00 0.00 0.00 176.54 177.69 1oq3 h LEU 28 N 0.02 0.30 -1.72 3.11 3.38 -0.48 0.09 115.31 120.00 1oq3 h LEU 28 Ca 0.11 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1oq3 h LEU 28 Cb 0.16 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1oq3 h LEU 28 CO -0.22 0.44 0.09 0.50 0.09 0.00 0.00 178.44 179.34 1oq3 h LYS 29 N 0.30 0.00 -0.03 1.13 3.64 -0.32 0.13 116.57 121.42 1oq3 h LYS 29 Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1oq3 h LYS 29 Cb 0.38 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1oq3 h LYS 29 CO 0.02 0.00 -0.04 0.54 -2.27 0.00 0.00 179.45 177.70 1oq3 n ARG 30 N -2.46 2.08 -2.73 1.90 1.74 0.01 -4.90 116.66 112.31 1oq3 n ARG 30 Ca -0.02 -1.64 -0.41 0.00 -0.77 0.00 0.00 57.85 55.01 1oq3 n ARG 30 Cb 0.13 -1.47 -0.05 0.00 -1.02 0.00 0.00 32.46 30.06 1oq3 n ARG 30 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1oq3 s MET 31 N -2.05 4.73 -0.08 5.56 -1.94 0.44 -4.99 119.30 120.96 1oq3 s MET 31 Ca 0.29 1.46 -0.29 0.00 -1.71 0.00 0.00 55.69 55.44 1oq3 s MET 31 Cb 0.20 -3.36 -0.06 0.00 2.01 0.00 0.00 34.83 33.62 1oq3 s MET 31 CO 0.33 0.27 1.90 -1.25 -0.01 0.00 0.00 175.02 176.26 1oq3 s PRO 32 N -0.21 3.87 0.00 2.03 0.04 -1.26 -2.37 135.00 137.10 1oq3 s PRO 32 Ca 0.46 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.74 1oq3 s PRO 32 Cb -0.24 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 30.15 1oq3 s PRO 32 CO 0.30 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.50 1oq3 n GLY 33 N 4.76 1.65 3.82 0.56 0.00 -1.26 -4.47 105.19 110.24 1oq3 n GLY 33 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.36 4.10 0.07 1.61 0.11 -1.00 -0.46 120.40 123.46 1oq3 s VAL 34 Ca 0.00 0.75 0.00 0.00 -2.93 0.00 0.00 61.98 59.80 1oq3 s VAL 34 Cb 0.00 -3.47 0.00 0.00 -1.53 0.00 0.00 36.38 31.38 1oq3 s VAL 34 CO 0.00 -0.82 0.00 0.41 -3.33 0.00 0.00 175.10 171.36 1oq3 n THR 35 N -2.79 0.85 -4.09 5.04 -1.04 0.31 -4.91 114.28 107.63 1oq3 n THR 35 Ca 0.08 0.28 -0.13 0.00 -2.04 0.00 0.00 64.05 62.23 1oq3 n THR 35 Cb 0.53 -1.39 -0.11 0.00 -1.82 0.00 0.00 70.33 67.54 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 -5.68 1.00 -0.00 8.00 1.01 -1.09 -5.00 116.67 114.92 1oq3 s ASP 36 Ca 0.00 -0.64 0.01 0.00 0.71 0.00 0.00 52.55 52.63 1oq3 s ASP 36 Cb 0.00 0.04 -0.00 0.00 1.01 0.00 0.00 42.92 43.96 1oq3 s ASP 36 CO 0.00 -0.24 -0.04 0.00 0.21 0.00 0.00 175.17 175.11 1oq3 s ALA 37 N -1.78 0.29 -0.12 5.23 0.00 -1.26 0.06 121.76 124.18 1oq3 s ALA 37 Ca -0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 51.96 51.69 1oq3 s ALA 37 Cb -0.07 -0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.02 1oq3 s ALA 37 CO -0.00 0.07 0.28 -0.80 0.00 0.00 0.00 175.76 175.31 1oq3 s ASN 38 N -0.09 -0.32 -0.08 0.00 0.01 0.23 -4.99 114.94 109.70 1oq3 s ASN 38 Ca 0.01 0.60 -0.15 0.00 -0.71 0.00 0.00 52.86 52.62 1oq3 s ASN 38 Cb -0.01 0.49 -0.05 0.00 0.41 0.00 0.00 41.25 42.08 1oq3 s ASN 38 CO -0.00 -0.17 0.39 0.54 -1.51 0.00 0.00 177.10 176.34 1oq3 s VAL 39 N 1.30 5.16 -0.56 1.60 0.11 -1.26 -0.72 120.40 126.03 1oq3 s VAL 39 Ca -0.09 0.77 0.07 0.00 -2.93 0.00 0.00 61.98 59.80 1oq3 s VAL 39 Cb -0.10 -3.71 0.29 0.00 -1.53 0.00 0.00 36.38 31.34 1oq3 s VAL 39 CO -0.09 0.47 0.79 -3.20 -3.33 0.00 0.00 175.10 169.73 1oq3 n ASN 40 N 2.76 3.25 0.33 3.54 5.15 0.99 -4.92 115.26 126.35 1oq3 n ASN 40 Ca -0.12 -3.39 0.21 0.00 -0.60 0.00 0.00 54.58 50.68 1oq3 n ASN 40 Cb 0.52 -0.62 1.11 0.00 -0.53 0.00 0.00 39.78 40.26 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 3.58 0.00 -2.09 1.20 3.38 -1.93 0.36 115.31 119.81 1oq3 h LEU 41 Ca 0.15 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.19 1oq3 h LEU 41 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1oq3 h LEU 41 CO 0.75 0.00 0.33 0.00 0.09 0.00 0.00 178.44 179.61 1oq3 h ALA 42 N 2.00 1.86 0.00 1.53 0.00 -1.91 -0.66 119.26 122.08 1oq3 h ALA 42 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1oq3 h ALA 42 Cb 0.10 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1oq3 h ALA 42 CO 0.00 -0.46 -0.09 2.41 0.00 0.00 0.00 179.25 181.11 1oq3 n THR 43 N -3.60 1.12 -3.98 0.00 -1.04 0.03 -4.99 114.28 101.81 1oq3 n THR 43 Ca 0.04 -1.29 -0.32 0.00 -2.04 0.00 0.00 64.05 60.43 1oq3 n THR 43 Cb 0.47 0.22 -0.03 0.00 -1.82 0.00 0.00 70.33 69.17 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 -0.78 -2.83 -4.18 -2.82 1.02 -0.26 -4.93 120.64 105.86 1oq3 n GLU 44 Ca 0.07 0.34 -0.16 0.00 -0.02 0.00 0.00 57.16 57.39 1oq3 n GLU 44 Cb 0.53 -5.03 -0.11 0.00 -0.02 0.00 0.00 31.44 26.80 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 -3.12 1.03 0.06 2.62 2.01 -0.65 -3.15 115.64 114.44 1oq3 s THR 45 Ca 0.64 -1.50 0.04 0.00 0.31 0.00 0.00 61.69 61.18 1oq3 s THR 45 Cb -0.35 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 1oq3 s THR 45 CO 0.79 -0.41 -0.11 0.54 -0.69 0.00 0.00 174.62 174.74 1oq3 s VAL 46 N -1.92 0.84 0.08 3.82 0.11 0.01 -0.01 120.40 123.33 1oq3 s VAL 46 Ca 0.02 -1.19 0.08 0.00 -2.93 0.00 0.00 61.98 57.96 1oq3 s VAL 46 Cb -0.06 -0.85 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 1oq3 s VAL 46 CO 0.01 -0.29 -0.20 0.54 -3.33 0.00 0.00 175.10 171.83 1oq3 s ASN 47 N -1.64 2.48 -0.13 3.54 4.22 0.10 -1.10 114.94 122.41 1oq3 s ASN 47 Ca -0.06 -0.63 -0.07 0.00 -2.14 0.00 0.00 52.86 49.96 1oq3 s ASN 47 Cb -0.10 -0.15 0.05 0.00 1.28 0.00 0.00 41.25 42.32 1oq3 s ASN 47 CO 0.01 0.08 0.30 0.54 -2.04 0.00 0.00 177.10 176.00 1oq3 s VAL 48 N -1.05 -0.03 -0.27 3.54 0.11 -0.15 -0.60 120.40 121.95 1oq3 s VAL 48 Ca 0.06 0.11 -0.15 0.00 -2.93 0.00 0.00 61.98 59.07 1oq3 s VAL 48 Cb -0.10 -0.46 -0.04 0.00 -1.53 0.00 0.00 36.38 34.26 1oq3 s VAL 48 CO 0.03 0.05 0.39 -0.63 -3.33 0.00 0.00 175.10 171.61 1oq3 s ILE 49 N 1.17 5.17 0.24 7.04 1.01 0.11 -0.68 121.20 135.25 1oq3 s ILE 49 Ca -0.08 0.60 -0.10 0.00 0.00 0.00 0.00 60.65 61.07 1oq3 s ILE 49 Cb -0.09 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.66 1oq3 s ILE 49 CO -0.09 0.15 0.41 -0.72 0.00 0.00 0.00 174.94 174.69 1oq3 s TYR 50 N 2.07 0.54 -0.25 3.97 -0.85 -0.33 -0.53 117.35 121.97 1oq3 s TYR 50 Ca 0.16 -0.87 -0.08 0.00 -0.52 0.00 0.00 57.07 55.76 1oq3 s TYR 50 Cb -0.16 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.18 1oq3 s TYR 50 CO 0.10 -0.92 0.10 0.34 -1.52 0.00 0.00 175.55 173.64 1oq3 s ASP 51 N -3.05 5.40 0.00 -0.18 -1.08 0.39 -1.14 116.67 117.00 1oq3 s ASP 51 Ca 0.26 -0.13 0.07 0.00 -0.52 0.00 0.00 52.55 52.24 1oq3 s ASP 51 Cb 0.01 -1.97 0.43 0.00 -1.46 0.00 0.00 42.92 39.93 1oq3 s ASP 51 CO 0.10 -0.01 0.84 -0.81 0.52 0.00 0.00 175.17 175.81 1oq3 n PRO 52 N 4.78 0.31 -0.05 4.34 -0.04 -1.14 -0.29 135.00 142.91 1oq3 n PRO 52 Ca -0.16 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.18 1oq3 n PRO 52 Cb 0.52 -1.37 -0.11 0.00 -0.04 0.00 0.00 33.50 32.50 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 2.35 -0.02 0.07 0.55 0.00 -1.94 -3.39 119.26 116.88 1oq3 h ALA 53 Ca 0.00 -0.40 -0.32 0.00 0.00 0.00 0.00 54.91 54.19 1oq3 h ALA 53 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1oq3 h ALA 53 CO 0.00 -0.06 -1.74 0.39 0.00 0.00 0.00 179.25 177.84 1oq3 n GLU 54 N -4.68 0.68 -4.10 0.00 -0.58 -1.11 -5.01 120.64 105.84 1oq3 n GLU 54 Ca -0.09 0.38 -0.28 0.00 -0.42 0.00 0.00 57.16 56.76 1oq3 n GLU 54 Cb 0.39 -1.71 -0.17 0.00 -0.57 0.00 0.00 31.44 29.38 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 -2.48 1.30 0.22 2.62 2.01 0.60 -4.97 115.64 114.94 1oq3 s THR 55 Ca -0.26 -0.48 -0.07 0.00 0.31 0.00 0.00 61.69 61.19 1oq3 s THR 55 Cb 0.07 -1.24 -0.02 0.00 0.01 0.00 0.00 72.50 71.31 1oq3 s THR 55 CO 0.69 0.41 0.30 -0.83 -0.69 0.00 0.00 174.62 174.50 1oq3 s GLY 56 N 1.42 0.94 0.36 4.40 0.00 -1.26 -2.87 107.32 110.31 1oq3 s GLY 56 Ca 0.01 -1.26 0.20 0.00 0.00 0.00 0.00 44.72 43.68 1oq3 s GLY 56 CO -0.07 -1.00 1.54 -0.37 0.00 0.00 0.00 173.10 173.21 1oq3 n THR 57 N -0.32 -0.41 -0.38 0.90 5.66 -1.26 -0.67 114.28 117.80 1oq3 n THR 57 Ca -0.00 1.98 -0.10 0.00 -3.05 0.00 0.00 64.05 62.88 1oq3 n THR 57 Cb 0.64 -3.22 -0.09 0.00 -1.55 0.00 0.00 70.33 66.11 1oq3 n THR 57 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1oq3 n ALA 58 N -2.28 -0.57 0.04 1.79 0.00 -1.26 -0.38 120.51 117.85 1oq3 n ALA 58 Ca 0.37 0.78 -0.11 0.00 0.00 0.00 0.00 53.44 54.49 1oq3 n ALA 58 Cb 1.26 -0.14 0.02 0.00 0.00 0.00 0.00 19.45 20.58 1oq3 n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oq3 h ALA 59 N 0.49 0.56 0.97 0.00 0.00 -1.27 -3.16 119.26 116.85 1oq3 h ALA 59 Ca 0.15 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1oq3 h ALA 59 Cb 0.38 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.13 1oq3 h ALA 59 CO -0.86 0.75 -0.47 0.82 0.00 0.00 0.00 179.25 179.49 1oq3 h ILE 60 N 0.31 0.00 -0.48 0.00 5.03 -1.08 -2.51 117.51 118.78 1oq3 h ILE 60 Ca -0.03 -0.04 0.10 0.00 -0.12 0.00 0.00 64.86 64.77 1oq3 h ILE 60 Cb 1.32 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 35.01 1oq3 h ILE 60 CO 0.13 0.00 -0.22 1.56 -0.68 0.00 0.00 178.15 178.94 1oq3 h GLN 61 N -1.34 -0.11 -0.68 2.37 7.50 -0.79 0.23 115.11 122.30 1oq3 h GLN 61 Ca -0.13 0.01 0.13 0.00 0.50 0.00 0.00 58.65 59.15 1oq3 h GLN 61 Cb 1.00 0.02 -0.13 0.00 0.05 0.00 0.00 27.48 28.43 1oq3 h GLN 61 CO 0.22 -0.07 -0.23 1.49 -1.50 0.00 0.00 178.83 178.74 1oq3 h GLU 62 N -0.11 -0.05 -0.14 1.46 4.22 -1.50 0.15 114.58 118.60 1oq3 h GLU 62 Ca 0.23 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.60 1oq3 h GLU 62 Cb 0.46 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 1oq3 h GLU 62 CO -0.55 -0.03 -0.17 0.87 -2.18 0.00 0.00 179.01 176.94 1oq3 h LYS 63 N -0.05 0.37 -0.72 1.92 6.56 -0.72 -3.26 116.57 120.66 1oq3 h LYS 63 Ca 0.31 -0.21 0.12 0.00 -1.06 0.00 0.00 60.65 59.82 1oq3 h LYS 63 Cb 0.53 0.01 -0.09 0.00 -0.57 0.00 0.00 32.23 32.12 1oq3 h LYS 63 CO -0.72 0.78 0.30 0.82 -2.06 0.00 0.00 179.45 178.56 1oq3 h ILE 64 N -0.01 0.71 -0.50 1.86 1.08 0.98 0.30 117.51 121.94 1oq3 h ILE 64 Ca 0.02 -0.16 0.10 0.00 -0.39 0.00 0.00 64.86 64.43 1oq3 h ILE 64 Cb 0.72 0.20 -0.10 0.00 -3.07 0.00 0.00 36.82 34.57 1oq3 h ILE 64 CO 0.04 0.08 -0.19 -0.33 -0.69 0.00 0.00 178.15 177.06 1oq3 h GLU 65 N 0.46 -0.08 0.00 2.37 4.39 -0.67 -2.22 114.58 118.84 1oq3 h GLU 65 Ca 0.38 0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.97 1oq3 h GLU 65 Cb 0.54 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 1oq3 h GLU 65 CO -0.36 -0.05 -0.58 -0.22 -1.16 0.00 0.00 179.01 176.63 1oq3 h LYS 66 N -0.08 0.00 -0.30 2.33 3.64 -0.59 0.52 116.57 122.09 1oq3 h LYS 66 Ca 0.24 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.70 1oq3 h LYS 66 Cb 0.44 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1oq3 h LYS 66 CO -0.55 0.58 0.34 -0.07 -2.27 0.00 0.00 179.45 177.48 1oq3 h LEU 67 N 0.00 0.00 0.00 5.20 -0.00 -0.16 -3.46 115.31 116.89 1oq3 h LEU 67 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1oq3 h LEU 67 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.77 1oq3 h LEU 67 CO 0.08 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.13 1oq3 n GLY 68 N -1.44 1.99 3.32 0.83 0.00 0.17 -4.97 105.19 105.10 1oq3 n GLY 68 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 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 0.84 -0.14 1.61 1.51 -1.01 -5.04 117.35 113.12 1oq3 s TYR 69 Ca 0.00 -1.12 0.00 0.00 -1.01 0.00 0.00 57.07 54.94 1oq3 s TYR 69 Cb 0.00 -0.29 0.02 0.00 -0.11 0.00 0.00 41.96 41.58 1oq3 s TYR 69 CO 0.00 -0.74 -0.12 -1.01 -1.11 0.00 0.00 175.55 172.56 1oq3 s HIS 70 N -4.09 1.96 0.28 2.71 0.09 -1.13 -2.98 115.29 112.14 1oq3 s HIS 70 Ca 0.31 -1.06 -0.13 0.00 -0.00 0.00 0.00 55.06 54.17 1oq3 s HIS 70 Cb 0.04 -1.48 -0.08 0.00 -0.00 0.00 0.00 32.58 31.06 1oq3 s HIS 70 CO 0.09 -0.61 0.67 0.54 -0.00 0.00 0.00 174.74 175.43 1oq3 s VAL 71 N 1.51 4.76 -0.24 -0.90 0.11 -1.26 -0.33 120.40 124.04 1oq3 s VAL 71 Ca 0.04 0.81 0.01 0.00 -2.93 0.00 0.00 61.98 59.91 1oq3 s VAL 71 Cb -0.13 -3.62 0.06 0.00 -1.53 0.00 0.00 36.38 31.16 1oq3 s VAL 71 CO -0.09 -0.12 -0.04 0.68 -3.33 0.00 0.00 175.10 172.19 1oq3 s VAL 72 N -1.90 1.56 -0.86 2.04 -7.23 -0.46 -4.91 120.40 108.64 1oq3 s VAL 72 Ca 0.51 -1.30 -0.00 0.00 -1.81 0.00 0.00 61.98 59.38 1oq3 s VAL 72 Cb -0.11 -1.85 0.21 0.00 0.56 0.00 0.00 36.38 35.19 1oq3 s VAL 72 CO 0.19 -0.15 0.75 -0.38 -0.31 0.00 0.00 175.10 175.19 1oq3 n ILE 73 N 4.65 2.79 -4.24 -0.62 5.41 -1.26 -3.11 119.36 122.98 1oq3 n ILE 73 Ca -0.11 -5.09 -0.21 0.00 1.00 0.00 0.00 62.75 58.34 1oq3 n ILE 73 Cb 0.44 -2.33 -0.12 0.00 -0.71 0.00 0.00 39.64 36.92 1oq3 n ILE 73 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1oq3 s GLU 74 N -1.48 1.00 0.00 0.38 0.41 -1.26 -5.02 118.70 112.74 1oq3 s GLU 74 Ca 0.28 -1.10 0.00 0.00 -0.41 0.00 0.00 54.97 53.74 1oq3 s GLU 74 Cb -0.05 -1.11 0.00 0.00 -1.78 0.00 0.00 34.13 31.18 1oq3 s GLU 74 CO -0.13 0.25 0.00 0.41 -0.49 0.00 0.00 175.26 175.30 1oq3 n GLY 75 N 1.08 -0.02 0.94 -1.39 0.00 -1.26 -4.99 105.19 99.55 1oq3 n GLY 75 Ca -0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.94 1oq3 n GLY 75 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36