#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oq3 n LEU 2 N 0.00 -3.41 -4.03 4.03 0.00 -1.26 -5.01 117.00 107.34 1oq3 n LEU 2 Ca 0.00 -0.47 -0.22 0.00 0.00 0.00 0.00 56.01 55.32 1oq3 n LEU 2 Cb 0.00 -2.06 -0.16 0.00 0.00 0.00 0.00 43.42 41.21 1oq3 n LEU 2 CO 0.00 -0.22 -0.45 -0.44 0.00 0.00 0.00 177.39 176.28 1oq3 s SER 3 N -2.54 1.45 0.04 1.96 0.01 -1.26 -5.14 113.70 108.21 1oq3 s SER 3 Ca 0.13 -0.23 -0.22 0.00 1.31 0.00 0.00 55.95 56.94 1oq3 s SER 3 Cb -0.02 -0.43 0.05 0.00 0.21 0.00 0.00 66.02 65.83 1oq3 s SER 3 CO 0.86 0.07 0.52 -1.83 0.41 0.00 0.00 173.24 173.27 1oq3 s GLU 4 N 0.24 1.02 0.49 12.44 -1.05 -1.26 -5.19 118.70 125.40 1oq3 s GLU 4 Ca -0.05 -0.22 0.03 0.00 -0.15 0.00 0.00 54.97 54.58 1oq3 s GLU 4 Cb -0.10 0.47 0.02 0.00 -0.44 0.00 0.00 34.13 34.08 1oq3 s GLU 4 CO 0.01 -0.36 0.70 1.14 0.95 0.00 0.00 175.26 177.69 1oq3 s GLN 5 N -2.38 2.71 0.11 -4.83 -2.07 -1.26 -4.52 119.66 107.42 1oq3 s GLN 5 Ca -0.06 -0.87 -0.11 0.00 -1.82 0.00 0.00 55.36 52.50 1oq3 s GLN 5 Cb -0.01 -2.58 0.01 0.00 -1.09 0.00 0.00 33.01 29.34 1oq3 s GLN 5 CO -0.01 -0.51 0.28 0.15 -1.32 0.00 0.00 175.29 173.88 1oq3 s LYS 6 N -4.60 0.98 0.25 9.60 1.02 -0.33 -4.99 119.74 121.66 1oq3 s LYS 6 Ca 0.55 -0.90 -0.21 0.00 0.02 0.00 0.00 55.97 55.43 1oq3 s LYS 6 Cb -0.10 0.40 -0.09 0.00 -0.52 0.00 0.00 37.83 37.52 1oq3 s LYS 6 CO 0.37 -0.35 0.77 -1.83 -0.92 0.00 0.00 175.35 173.38 1oq3 s GLU 7 N -3.86 4.30 0.16 1.68 -1.05 -1.26 -1.18 118.70 117.49 1oq3 s GLU 7 Ca 0.06 0.94 0.09 0.00 -0.15 0.00 0.00 54.97 55.91 1oq3 s GLU 7 Cb 0.03 -2.83 -0.04 0.00 -0.44 0.00 0.00 34.13 30.85 1oq3 s GLU 7 CO -0.10 0.36 -0.19 -1.50 0.95 0.00 0.00 175.26 174.78 1oq3 s ILE 8 N -1.57 1.86 -0.05 1.83 1.10 0.34 -4.97 121.20 119.75 1oq3 s ILE 8 Ca 0.45 -1.88 -0.02 0.00 -0.51 0.00 0.00 60.65 58.70 1oq3 s ILE 8 Cb -0.17 -1.83 0.04 0.00 0.15 0.00 0.00 42.46 40.65 1oq3 s ILE 8 CO 0.21 -0.25 0.10 0.00 -2.11 0.00 0.00 174.94 172.88 1oq3 s ALA 9 N -1.87 -0.11 0.31 1.50 0.00 -1.26 -0.92 121.76 119.41 1oq3 s ALA 9 Ca 0.15 0.52 -0.16 0.00 0.00 0.00 0.00 51.96 52.47 1oq3 s ALA 9 Cb -0.07 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.69 1oq3 s ALA 9 CO 0.07 -0.15 0.66 0.00 0.00 0.00 0.00 175.76 176.33 1oq3 s MET 10 N 1.19 1.88 0.04 0.00 0.23 -0.34 -4.07 119.30 118.22 1oq3 s MET 10 Ca -0.09 -1.26 -0.01 0.00 -1.03 0.00 0.00 55.69 53.30 1oq3 s MET 10 Cb -0.12 0.57 -0.04 0.00 -1.53 0.00 0.00 34.83 33.70 1oq3 s MET 10 CO -0.05 -0.84 0.18 -0.65 -2.03 0.00 0.00 175.02 171.63 1oq3 s GLN 11 N -3.37 3.38 0.30 3.16 1.11 -1.26 -0.83 119.66 122.15 1oq3 s GLN 11 Ca 0.17 -0.42 0.11 0.00 0.01 0.00 0.00 55.36 55.22 1oq3 s GLN 11 Cb -0.04 -3.02 -0.05 0.00 -1.01 0.00 0.00 33.01 28.88 1oq3 s GLN 11 CO 0.10 0.63 -0.11 0.08 0.01 0.00 0.00 175.29 176.00 1oq3 s VAL 12 N -1.42 2.57 -0.08 1.09 1.01 -1.24 -1.07 120.40 121.26 1oq3 s VAL 12 Ca 0.31 -2.23 0.02 0.00 0.00 0.00 0.00 61.98 60.09 1oq3 s VAL 12 Cb -0.13 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1oq3 s VAL 12 CO 0.24 -0.32 -0.14 -0.55 0.00 0.00 0.00 175.10 174.34 1oq3 s SER 13 N -3.59 2.05 0.00 3.32 0.15 0.56 -4.79 113.70 111.40 1oq3 s SER 13 Ca 0.32 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.62 1oq3 s SER 13 Cb -0.03 -0.93 0.00 0.00 -1.71 0.00 0.00 66.02 63.35 1oq3 s SER 13 CO 0.17 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.25 1oq3 n GLY 14 N 3.93 1.20 3.63 9.45 0.00 -1.26 -3.11 105.19 119.03 1oq3 n GLY 14 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.54 2.40 -0.33 1.61 3.85 -1.26 -4.86 117.12 117.99 1oq3 n MET 15 Ca 0.00 0.80 0.01 0.00 -1.00 0.00 0.00 57.70 57.51 1oq3 n MET 15 Cb 0.00 -3.06 0.15 0.00 -1.05 0.00 0.00 33.22 29.25 1oq3 n MET 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1oq3 h THR 16 N 6.29 1.06 0.00 3.17 1.03 -1.98 -3.47 112.91 119.02 1oq3 h THR 16 Ca -0.46 -0.35 0.00 0.00 -0.01 0.00 0.00 66.41 65.59 1oq3 h THR 16 Cb 1.25 -0.06 0.00 0.00 -1.07 0.00 0.00 68.15 68.26 1oq3 h THR 16 CO 0.95 0.19 0.00 0.00 -0.01 0.00 0.00 175.52 176.65 1oq3 n ALA 18 N 0.00 0.00 -0.26 0.00 0.00 -1.26 -4.78 120.51 114.21 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 -3.00 3.13 0.18 0.00 0.00 -1.26 -4.07 120.51 115.49 1oq3 n ALA 19 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1oq3 n ALA 19 Cb 0.00 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.12 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 -1.17 1.89 -0.55 0.00 0.00 -1.93 0.31 119.26 117.81 1oq3 h ALA 21 Ca -0.05 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.94 1oq3 h ALA 21 Cb 0.40 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 1oq3 h ALA 21 CO 0.09 0.04 0.12 0.00 0.00 0.00 0.00 179.25 179.49 1oq3 h ALA 22 N 1.75 0.64 -0.21 0.00 0.00 -1.86 0.12 119.26 119.70 1oq3 h ALA 22 Ca 0.19 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1oq3 h ALA 22 Cb 0.24 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1oq3 h ALA 22 CO -0.05 -0.30 0.06 0.00 0.00 0.00 0.00 179.25 178.97 1oq3 h ARG 23 N 0.26 0.33 -0.18 0.00 2.47 -0.40 0.11 114.38 116.96 1oq3 h ARG 23 Ca 0.28 -0.07 0.03 0.00 -1.26 0.00 0.00 59.98 58.96 1oq3 h ARG 23 Cb 0.39 -0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 28.60 1oq3 h ARG 23 CO -0.36 0.43 -0.54 0.82 0.56 0.00 0.00 179.97 180.87 1oq3 h ILE 24 N 0.17 0.00 -0.20 2.04 2.04 -0.79 0.10 117.51 120.86 1oq3 h ILE 24 Ca 0.07 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.78 1oq3 h ILE 24 Cb 0.24 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 1oq3 h ILE 24 CO -0.00 0.00 -0.47 -0.08 0.00 0.00 0.00 178.15 177.59 1oq3 h GLU 25 N -0.55 0.52 -0.46 2.37 4.57 -0.89 -1.23 114.58 118.91 1oq3 h GLU 25 Ca 0.04 -0.29 0.06 0.00 -1.18 0.00 0.00 59.36 57.98 1oq3 h GLU 25 Cb 0.66 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 1oq3 h GLU 25 CO -0.46 0.89 0.31 0.87 -1.18 0.00 0.00 179.01 179.43 1oq3 h LYS 26 N 0.42 0.39 -0.41 1.92 1.79 -0.47 0.30 116.57 120.50 1oq3 h LYS 26 Ca 0.02 -0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 1oq3 h LYS 26 Cb 0.99 -0.09 -0.05 0.00 -1.58 0.00 0.00 32.23 31.50 1oq3 h LYS 26 CO 0.09 0.26 0.14 0.78 -1.08 0.00 0.00 179.45 179.64 1oq3 h GLY 27 N 0.40 0.53 2.00 3.86 0.00 0.25 -2.02 103.07 108.09 1oq3 h GLY 27 Ca 0.20 -0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.41 1oq3 h GLY 27 CO -0.05 0.02 -0.19 1.41 0.00 0.00 0.00 176.54 177.73 1oq3 h LEU 28 N 0.31 0.00 -2.20 3.11 3.38 -0.27 -0.66 115.31 118.97 1oq3 h LEU 28 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1oq3 h LEU 28 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1oq3 h LEU 28 CO -0.20 0.19 0.00 0.50 0.09 0.00 0.00 178.44 179.03 1oq3 h LYS 29 N 0.00 0.00 0.00 1.13 3.64 0.02 0.15 116.57 121.51 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 0.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 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 -6.68 1.90 -0.00 -1.01 -3.47 114.38 105.13 1oq3 h ARG 30 Ca 0.00 0.00 -0.51 0.00 -0.50 0.00 0.00 59.98 58.97 1oq3 h ARG 30 Cb 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 29.98 1oq3 h ARG 30 CO 0.00 0.00 0.44 -1.64 0.00 0.00 0.00 179.97 178.77 1oq3 s MET 31 N -3.17 4.66 -0.57 0.04 -1.94 0.53 -4.93 119.30 113.93 1oq3 s MET 31 Ca 0.09 1.65 -0.26 0.00 -1.71 0.00 0.00 55.69 55.46 1oq3 s MET 31 Cb 0.10 -3.28 -0.05 0.00 2.01 0.00 0.00 34.83 33.61 1oq3 s MET 31 CO 0.59 0.18 2.15 -1.25 -0.01 0.00 0.00 175.02 176.69 1oq3 s PRO 32 N -0.58 2.32 0.00 2.03 0.04 -1.26 -1.83 135.00 135.72 1oq3 s PRO 32 Ca 0.47 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.48 1oq3 s PRO 32 Cb -0.28 -4.52 0.00 0.00 0.04 0.00 0.00 34.50 29.74 1oq3 s PRO 32 CO 0.34 -3.09 0.00 0.41 0.04 0.00 0.00 177.00 174.70 1oq3 n GLY 33 N 5.93 1.03 3.76 0.56 0.00 -1.26 -4.31 105.19 110.90 1oq3 n GLY 33 Ca 0.30 0.00 -0.35 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 -0.43 2.95 -0.01 1.61 0.11 -0.76 -0.33 120.40 123.53 1oq3 s VAL 34 Ca 0.00 0.56 -0.03 0.00 -2.93 0.00 0.00 61.98 59.58 1oq3 s VAL 34 Cb 0.00 -3.19 -0.01 0.00 -1.53 0.00 0.00 36.38 31.65 1oq3 s VAL 34 CO 0.00 -0.16 -0.07 0.35 -3.33 0.00 0.00 175.10 171.90 1oq3 n THR 35 N -1.63 0.63 -3.74 5.04 -2.24 0.31 -4.91 114.28 107.75 1oq3 n THR 35 Ca 0.12 0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 62.03 1oq3 n THR 35 Cb 0.51 -1.53 -0.12 0.00 -2.10 0.00 0.00 70.33 67.08 1oq3 n THR 35 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1oq3 s ASP 36 N -5.23 -0.28 -0.09 3.42 1.01 -1.10 -4.99 116.67 109.41 1oq3 s ASP 36 Ca -0.06 0.55 0.01 0.00 0.71 0.00 0.00 52.55 53.76 1oq3 s ASP 36 Cb 0.01 0.46 -0.03 0.00 1.01 0.00 0.00 42.92 44.38 1oq3 s ASP 36 CO 0.08 -0.15 -0.09 0.00 0.21 0.00 0.00 175.17 175.22 1oq3 s ALA 37 N 0.97 2.84 -0.13 5.23 0.00 -1.26 -0.12 121.76 129.29 1oq3 s ALA 37 Ca -0.07 -0.90 -0.04 0.00 0.00 0.00 0.00 51.96 50.95 1oq3 s ALA 37 Cb -0.08 -1.21 0.05 0.00 0.00 0.00 0.00 23.12 21.88 1oq3 s ALA 37 CO -0.06 0.46 0.08 -0.80 0.00 0.00 0.00 175.76 175.43 1oq3 s ASN 38 N -0.42 2.01 0.18 0.00 0.01 0.40 -4.99 114.94 112.13 1oq3 s ASN 38 Ca 0.06 -0.42 -0.24 0.00 -0.71 0.00 0.00 52.86 51.55 1oq3 s ASN 38 Cb -0.12 -0.23 -0.08 0.00 0.41 0.00 0.00 41.25 41.23 1oq3 s ASN 38 CO 0.02 -0.32 0.76 0.54 -1.51 0.00 0.00 177.10 176.60 1oq3 s VAL 39 N 2.14 4.42 -0.41 1.60 0.11 -1.26 -0.82 120.40 126.17 1oq3 s VAL 39 Ca 0.03 1.60 0.09 0.00 -2.93 0.00 0.00 61.98 60.77 1oq3 s VAL 39 Cb -0.15 -4.07 0.30 0.00 -1.53 0.00 0.00 36.38 30.93 1oq3 s VAL 39 CO -0.07 0.45 0.65 0.59 -3.33 0.00 0.00 175.10 173.39 1oq3 n ASN 40 N 1.38 1.02 0.24 3.54 3.02 0.81 -4.92 115.26 120.35 1oq3 n ASN 40 Ca -0.05 -2.95 0.16 0.00 -0.03 0.00 0.00 54.58 51.72 1oq3 n ASN 40 Cb 0.49 -0.63 0.81 0.00 -0.61 0.00 0.00 39.78 39.84 1oq3 n ASN 40 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1oq3 h LEU 41 N 3.54 0.00 -1.63 3.41 3.38 -1.92 0.42 115.31 122.51 1oq3 h LEU 41 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1oq3 h LEU 41 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1oq3 h LEU 41 CO 0.53 0.00 0.11 0.00 0.09 0.00 0.00 178.44 179.17 1oq3 h ALA 42 N 2.04 1.09 0.00 1.53 0.00 -1.91 -1.60 119.26 120.41 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 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1oq3 h ALA 42 CO 0.00 -0.09 -0.37 2.41 0.00 0.00 0.00 179.25 181.21 1oq3 n THR 43 N -2.42 0.36 -4.14 0.00 -1.04 0.03 -5.01 114.28 102.06 1oq3 n THR 43 Ca -0.02 -0.43 -0.34 0.00 -2.04 0.00 0.00 64.05 61.23 1oq3 n THR 43 Cb 0.15 0.40 -0.01 0.00 -1.82 0.00 0.00 70.33 69.04 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 -0.27 -3.69 -4.08 -2.82 4.71 -0.60 -4.93 120.64 108.95 1oq3 n GLU 44 Ca 0.03 0.42 -0.10 0.00 -0.01 0.00 0.00 57.16 57.50 1oq3 n GLU 44 Cb 0.67 -5.15 -0.11 0.00 -1.01 0.00 0.00 31.44 25.85 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 -3.34 0.41 0.04 2.62 2.01 -0.58 -3.69 115.64 113.12 1oq3 s THR 45 Ca 0.67 -1.49 0.03 0.00 0.31 0.00 0.00 61.69 61.22 1oq3 s THR 45 Cb -0.36 -1.09 -0.02 0.00 0.01 0.00 0.00 72.50 71.04 1oq3 s THR 45 CO 0.90 -0.71 -0.09 0.54 -0.69 0.00 0.00 174.62 174.57 1oq3 s VAL 46 N -2.72 0.70 0.12 3.82 0.11 -0.01 -0.14 120.40 122.28 1oq3 s VAL 46 Ca -0.00 -1.05 0.10 0.00 -2.93 0.00 0.00 61.98 58.09 1oq3 s VAL 46 Cb -0.01 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 1oq3 s VAL 46 CO -0.04 -0.28 -0.24 0.54 -3.33 0.00 0.00 175.10 171.76 1oq3 s ASN 47 N -1.46 2.91 -0.09 3.54 4.22 0.00 -1.20 114.94 122.86 1oq3 s ASN 47 Ca -0.06 -0.72 -0.12 0.00 -2.14 0.00 0.00 52.86 49.81 1oq3 s ASN 47 Cb -0.09 -0.18 0.03 0.00 1.28 0.00 0.00 41.25 42.29 1oq3 s ASN 47 CO 0.01 0.11 0.31 0.54 -2.04 0.00 0.00 177.10 176.03 1oq3 s VAL 48 N -1.15 0.02 -0.20 3.54 0.11 -0.10 -0.45 120.40 122.17 1oq3 s VAL 48 Ca 0.10 -0.14 -0.08 0.00 -2.93 0.00 0.00 61.98 58.94 1oq3 s VAL 48 Cb -0.10 -0.49 -0.04 0.00 -1.53 0.00 0.00 36.38 34.22 1oq3 s VAL 48 CO 0.05 -0.08 0.07 -0.63 -3.33 0.00 0.00 175.10 171.19 1oq3 s ILE 49 N -0.24 4.72 0.25 7.04 1.01 0.83 -0.51 121.20 134.30 1oq3 s ILE 49 Ca -0.04 -0.05 -0.13 0.00 0.00 0.00 0.00 60.65 60.43 1oq3 s ILE 49 Cb -0.03 -3.15 -0.00 0.00 0.01 0.00 0.00 42.46 39.29 1oq3 s ILE 49 CO 0.01 0.43 0.49 -0.72 0.00 0.00 0.00 174.94 175.15 1oq3 s TYR 50 N 0.67 0.35 -0.34 3.97 -0.85 -0.32 -0.53 117.35 120.30 1oq3 s TYR 50 Ca 0.04 -0.72 -0.10 0.00 -0.52 0.00 0.00 57.07 55.76 1oq3 s TYR 50 Cb -0.13 0.21 0.01 0.00 0.38 0.00 0.00 41.96 42.43 1oq3 s TYR 50 CO 0.02 -1.01 0.18 0.34 -1.52 0.00 0.00 175.55 173.56 1oq3 s ASP 51 N -3.02 5.65 0.00 -0.18 -1.08 0.55 -1.19 116.67 117.40 1oq3 s ASP 51 Ca 0.22 -0.74 0.00 0.00 -0.52 0.00 0.00 52.55 51.51 1oq3 s ASP 51 Cb -0.01 -2.02 0.00 0.00 -1.46 0.00 0.00 42.92 39.43 1oq3 s ASP 51 CO 0.09 -0.29 0.43 -0.81 0.52 0.00 0.00 175.17 175.12 1oq3 n PRO 52 N 4.99 0.44 0.08 4.34 -0.04 -1.04 -0.24 135.00 143.52 1oq3 n PRO 52 Ca -0.13 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.12 1oq3 n PRO 52 Cb 0.48 -1.01 -0.15 0.00 -0.04 0.00 0.00 33.50 32.78 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 1.86 -0.09 0.01 0.55 0.00 -1.93 -3.39 119.26 116.27 1oq3 h ALA 53 Ca 0.00 -0.78 -0.41 0.00 0.00 0.00 0.00 54.91 53.72 1oq3 h ALA 53 Cb 0.01 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1oq3 h ALA 53 CO 0.00 0.52 -2.39 0.39 0.00 0.00 0.00 179.25 177.77 1oq3 n GLU 54 N -3.98 0.63 -3.92 0.00 1.02 -0.96 -5.07 120.64 108.36 1oq3 n GLU 54 Ca -0.16 0.24 -0.16 0.00 -0.02 0.00 0.00 57.16 57.05 1oq3 n GLU 54 Cb 0.92 -1.54 -0.16 0.00 -0.02 0.00 0.00 31.44 30.64 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 -2.51 0.15 0.00 2.62 2.01 0.66 -4.94 115.64 113.64 1oq3 s THR 55 Ca -0.35 0.08 0.00 0.00 0.31 0.00 0.00 61.69 61.73 1oq3 s THR 55 Cb 0.11 -0.24 0.00 0.00 0.01 0.00 0.00 72.50 72.38 1oq3 s THR 55 CO 0.57 0.13 0.00 0.61 -0.69 0.00 0.00 174.62 175.23 1oq3 n GLY 56 N 4.02 2.79 0.21 4.40 0.00 -1.26 -2.51 105.19 112.85 1oq3 n GLY 56 Ca -0.26 -0.67 0.10 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.26 -0.13 2.61 5.66 -1.26 -0.53 114.28 120.37 1oq3 n THR 57 Ca 0.00 1.33 -0.11 0.00 -3.05 0.00 0.00 64.05 62.22 1oq3 n THR 57 Cb 0.00 -1.96 -0.06 0.00 -1.55 0.00 0.00 70.33 66.76 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 1.22 -0.50 -0.10 1.79 0.00 -1.99 0.13 119.26 119.80 1oq3 h ALA 58 Ca 0.38 0.05 -0.22 0.00 0.00 0.00 0.00 54.91 55.12 1oq3 h ALA 58 Cb 0.81 0.94 0.01 0.00 0.00 0.00 0.00 17.79 19.54 1oq3 h ALA 58 CO -0.56 -0.90 -0.82 0.00 0.00 0.00 0.00 179.25 176.96 1oq3 h ALA 59 N 0.32 0.36 0.76 0.00 0.00 -1.18 -3.30 119.26 116.24 1oq3 h ALA 59 Ca 0.12 -0.63 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 1oq3 h ALA 59 Cb 0.59 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1oq3 h ALA 59 CO -0.58 0.72 -0.37 0.82 0.00 0.00 0.00 179.25 179.84 1oq3 h ILE 60 N 0.43 0.13 -0.61 0.00 2.04 -0.74 -2.09 117.51 116.67 1oq3 h ILE 60 Ca -0.06 -0.18 0.12 0.00 1.00 0.00 0.00 64.86 65.74 1oq3 h ILE 60 Cb 1.44 0.16 -0.12 0.00 -0.74 0.00 0.00 36.82 37.56 1oq3 h ILE 60 CO 0.16 0.01 -0.24 1.56 0.00 0.00 0.00 178.15 179.64 1oq3 h GLN 61 N -1.18 -0.08 -0.78 2.37 7.50 -0.90 0.27 115.11 122.31 1oq3 h GLN 61 Ca -0.10 0.01 0.12 0.00 0.50 0.00 0.00 58.65 59.17 1oq3 h GLN 61 Cb 0.80 0.02 -0.13 0.00 0.05 0.00 0.00 27.48 28.22 1oq3 h GLN 61 CO 0.17 -0.05 -0.41 1.49 -1.50 0.00 0.00 178.83 178.53 1oq3 h GLU 62 N -0.08 -0.10 -0.32 1.46 4.22 -1.60 0.95 114.58 119.10 1oq3 h GLU 62 Ca 0.28 0.01 -0.17 0.00 0.08 0.00 0.00 59.36 59.56 1oq3 h GLU 62 Cb 0.51 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1oq3 h GLU 62 CO -0.67 -0.07 -0.45 0.87 -2.18 0.00 0.00 179.01 176.52 1oq3 h LYS 63 N -0.11 0.87 -0.57 1.92 6.56 -0.22 -2.91 116.57 122.11 1oq3 h LYS 63 Ca 0.25 -0.51 0.08 0.00 -1.06 0.00 0.00 60.65 59.41 1oq3 h LYS 63 Cb 0.56 0.04 -0.07 0.00 -0.57 0.00 0.00 32.23 32.19 1oq3 h LYS 63 CO -0.82 1.15 0.21 0.82 -2.06 0.00 0.00 179.45 178.75 1oq3 h ILE 64 N 0.66 0.80 -0.37 1.86 1.08 0.45 0.18 117.51 122.17 1oq3 h ILE 64 Ca 0.04 -0.14 0.08 0.00 -0.39 0.00 0.00 64.86 64.45 1oq3 h ILE 64 Cb 1.05 0.37 -0.08 0.00 -3.07 0.00 0.00 36.82 35.08 1oq3 h ILE 64 CO 0.10 0.07 -0.20 -0.33 -0.69 0.00 0.00 178.15 177.11 1oq3 h GLU 65 N 0.40 -0.13 -0.68 2.37 4.39 -0.66 -2.40 114.58 117.86 1oq3 h GLU 65 Ca 0.28 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.97 1oq3 h GLU 65 Cb 0.32 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1oq3 h GLU 65 CO -0.28 -0.09 0.36 -0.22 -1.16 0.00 0.00 179.01 177.63 1oq3 h LYS 66 N -0.14 0.97 0.00 2.33 1.63 -0.77 0.81 116.57 121.40 1oq3 h LYS 66 Ca 0.19 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1oq3 h LYS 66 Cb 0.42 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1oq3 h LYS 66 CO -0.46 0.74 0.37 -0.07 -3.45 0.00 0.00 179.45 176.58 1oq3 h LEU 67 N 0.94 0.00 0.00 5.20 4.07 -0.28 -3.45 115.31 121.80 1oq3 h LEU 67 Ca 0.24 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.20 1oq3 h LEU 67 Cb 0.07 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1oq3 h LEU 67 CO -0.04 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.93 1oq3 n GLY 68 N -1.24 1.55 3.16 0.83 0.00 0.28 -5.04 105.19 104.73 1oq3 n GLY 68 Ca -0.02 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 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 0.87 -0.08 1.61 1.51 -0.95 -5.01 117.35 113.30 1oq3 s TYR 69 Ca 0.00 -1.09 0.03 0.00 -1.01 0.00 0.00 57.07 55.00 1oq3 s TYR 69 Cb 0.00 -0.52 -0.02 0.00 -0.11 0.00 0.00 41.96 41.32 1oq3 s TYR 69 CO 0.00 -0.34 -0.17 -1.58 -1.11 0.00 0.00 175.55 172.35 1oq3 s HIS 70 N -3.85 2.67 0.07 2.71 5.65 -1.18 -2.76 115.29 118.61 1oq3 s HIS 70 Ca 0.18 -0.52 0.01 0.00 0.25 0.00 0.00 55.06 54.98 1oq3 s HIS 70 Cb 0.07 -1.71 -0.04 0.00 -1.18 0.00 0.00 32.58 29.72 1oq3 s HIS 70 CO -0.02 -0.09 0.17 0.54 -0.65 0.00 0.00 174.74 174.69 1oq3 s VAL 71 N -0.14 5.13 0.40 0.89 0.11 -1.26 -0.32 120.40 125.22 1oq3 s VAL 71 Ca -0.02 -0.50 0.08 0.00 -2.93 0.00 0.00 61.98 58.60 1oq3 s VAL 71 Cb -0.14 -3.50 -0.02 0.00 -1.53 0.00 0.00 36.38 31.20 1oq3 s VAL 71 CO 0.04 0.13 0.40 0.68 -3.33 0.00 0.00 175.10 173.02 1oq3 s VAL 72 N -1.48 2.90 -0.64 2.04 -7.23 -0.23 -4.97 120.40 110.80 1oq3 s VAL 72 Ca 0.33 -1.27 0.05 0.00 -1.81 0.00 0.00 61.98 59.28 1oq3 s VAL 72 Cb -0.13 -3.04 0.16 0.00 0.56 0.00 0.00 36.38 33.93 1oq3 s VAL 72 CO 0.26 -0.03 0.43 -0.63 -0.31 0.00 0.00 175.10 174.82 1oq3 s ILE 73 N -2.42 2.60 -0.43 -0.62 -1.09 -1.26 -4.12 121.20 113.86 1oq3 s ILE 73 Ca 0.48 -3.92 0.02 0.00 -2.23 0.00 0.00 60.65 55.01 1oq3 s ILE 73 Cb -0.05 -2.73 0.15 0.00 -1.58 0.00 0.00 42.46 38.25 1oq3 s ILE 73 CO 0.29 -0.98 0.29 -1.61 -1.23 0.00 0.00 174.94 171.70 1oq3 s GLU 74 N -1.06 1.03 0.00 2.79 2.02 -1.26 -5.03 118.70 117.20 1oq3 s GLU 74 Ca 0.24 -1.95 0.00 0.00 0.02 0.00 0.00 54.97 53.28 1oq3 s GLU 74 Cb -0.09 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.34 1oq3 s GLU 74 CO -0.13 -1.26 0.00 0.41 0.02 0.00 0.00 175.26 174.30 1oq3 n GLY 75 N 3.32 0.82 2.97 -1.39 0.00 -1.26 -4.66 105.19 104.99 1oq3 n GLY 75 Ca 0.18 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1oq3 n GLY 75 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36