#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 1.59 -1.46 -0.89 7.94 -1.26 -5.03 117.00 117.89 1oq3 n LEU 2 Ca 0.00 -5.03 0.19 0.00 -1.11 0.00 0.00 56.01 50.06 1oq3 n LEU 2 Cb 0.00 0.21 -0.07 0.00 0.53 0.00 0.00 43.42 44.09 1oq3 n LEU 2 CO 0.00 2.13 -0.43 -1.54 -1.11 0.00 0.00 177.39 176.44 1oq3 n SER 3 N 0.94 -8.77 -3.17 1.96 3.41 -1.26 -5.06 113.62 101.67 1oq3 n SER 3 Ca 0.25 0.96 0.04 0.00 -0.26 0.00 0.00 58.87 59.86 1oq3 n SER 3 Cb 0.51 -4.67 -0.03 0.00 -0.26 0.00 0.00 64.21 59.75 1oq3 n SER 3 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1oq3 s GLU 4 N -3.08 0.03 0.59 4.33 2.12 -1.26 -5.19 118.70 116.23 1oq3 s GLU 4 Ca 0.00 0.06 0.03 0.00 0.36 0.00 0.00 54.97 55.42 1oq3 s GLU 4 Cb 0.00 0.03 0.07 0.00 0.26 0.00 0.00 34.13 34.50 1oq3 s GLU 4 CO 0.00 -0.01 0.82 1.14 -0.54 0.00 0.00 175.26 176.67 1oq3 s GLN 5 N 2.30 2.25 0.04 4.30 -2.07 -1.26 -4.54 119.66 120.67 1oq3 s GLN 5 Ca -0.02 -1.14 -0.10 0.00 -1.82 0.00 0.00 55.36 52.28 1oq3 s GLN 5 Cb -0.03 -2.51 0.01 0.00 -1.09 0.00 0.00 33.01 29.39 1oq3 s GLN 5 CO -0.14 -0.92 0.20 0.15 -1.32 0.00 0.00 175.29 173.27 1oq3 s LYS 6 N -4.81 0.70 0.06 9.60 -0.14 -0.15 -4.99 119.74 120.02 1oq3 s LYS 6 Ca 0.61 -0.62 -0.22 0.00 -1.36 0.00 0.00 55.97 54.38 1oq3 s LYS 6 Cb -0.08 0.29 -0.06 0.00 -1.68 0.00 0.00 37.83 36.30 1oq3 s LYS 6 CO 0.40 -0.20 0.67 -1.83 -0.76 0.00 0.00 175.35 173.62 1oq3 s GLU 7 N -2.56 4.38 0.19 1.68 -1.05 -1.26 -1.08 118.70 119.01 1oq3 s GLU 7 Ca -0.05 0.90 0.08 0.00 -0.15 0.00 0.00 54.97 55.75 1oq3 s GLU 7 Cb -0.01 -3.31 -0.04 0.00 -0.44 0.00 0.00 34.13 30.33 1oq3 s GLU 7 CO -0.04 0.45 -0.02 -1.50 0.95 0.00 0.00 175.26 175.10 1oq3 s ILE 8 N -0.57 3.55 -0.05 1.83 1.10 0.02 -4.98 121.20 122.10 1oq3 s ILE 8 Ca 0.33 -1.57 -0.02 0.00 -0.51 0.00 0.00 60.65 58.88 1oq3 s ILE 8 Cb -0.20 -2.80 0.03 0.00 0.15 0.00 0.00 42.46 39.64 1oq3 s ILE 8 CO 0.21 -0.16 0.11 0.00 -2.11 0.00 0.00 174.94 172.99 1oq3 s ALA 9 N -1.84 -0.17 0.31 1.50 0.00 -1.26 -1.18 121.76 119.12 1oq3 s ALA 9 Ca 0.28 0.56 -0.15 0.00 0.00 0.00 0.00 51.96 52.64 1oq3 s ALA 9 Cb -0.09 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.67 1oq3 s ALA 9 CO 0.18 -0.14 0.65 0.00 0.00 0.00 0.00 175.76 176.45 1oq3 s MET 10 N 1.09 1.87 0.09 0.00 0.23 -0.10 -4.59 119.30 117.89 1oq3 s MET 10 Ca -0.09 -1.27 -0.03 0.00 -1.03 0.00 0.00 55.69 53.28 1oq3 s MET 10 Cb -0.11 0.56 -0.05 0.00 -1.53 0.00 0.00 34.83 33.70 1oq3 s MET 10 CO -0.05 -0.84 0.28 -0.65 -2.03 0.00 0.00 175.02 171.74 1oq3 s GLN 11 N -3.39 3.53 0.03 3.16 1.11 -1.24 -0.79 119.66 122.07 1oq3 s GLN 11 Ca 0.17 -0.26 0.07 0.00 0.01 0.00 0.00 55.36 55.35 1oq3 s GLN 11 Cb -0.04 -2.96 -0.02 0.00 -1.01 0.00 0.00 33.01 28.98 1oq3 s GLN 11 CO 0.10 0.55 -0.20 0.08 0.01 0.00 0.00 175.29 175.84 1oq3 s VAL 12 N -1.55 1.57 0.06 1.09 1.01 -1.09 -1.24 120.40 120.25 1oq3 s VAL 12 Ca 0.37 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 61.27 1oq3 s VAL 12 Cb -0.13 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1oq3 s VAL 12 CO 0.25 0.24 0.17 -0.55 0.00 0.00 0.00 175.10 175.22 1oq3 s SER 13 N -1.00 6.15 0.00 3.32 0.15 0.31 -4.68 113.70 117.95 1oq3 s SER 13 Ca 0.07 0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.92 1oq3 s SER 13 Cb -0.08 -1.84 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1oq3 s SER 13 CO 0.01 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.24 1oq3 n GLY 14 N 0.39 1.35 3.48 9.45 0.00 -1.26 -3.80 105.19 114.80 1oq3 n GLY 14 Ca -0.06 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.94 1.44 0.00 1.61 0.00 -1.26 -4.70 117.12 113.27 1oq3 n MET 15 Ca 0.00 -2.25 0.13 0.00 0.00 0.00 0.00 57.70 55.58 1oq3 n MET 15 Cb 0.19 -3.54 0.73 0.00 0.00 0.00 0.00 33.22 30.60 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 7.50 0.07 -0.14 1.12 -2.24 -1.26 -5.02 114.28 114.30 1oq3 n THR 16 Ca 0.46 0.02 0.02 0.00 -2.27 0.00 0.00 64.05 62.27 1oq3 n THR 16 Cb 0.45 -0.60 -0.01 0.00 -2.10 0.00 0.00 70.33 68.07 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 -1.77 -2.03 -1.85 0.00 0.00 -1.26 -3.82 120.51 109.77 1oq3 n ALA 18 Ca -0.00 0.06 -0.20 0.00 0.00 0.00 0.00 53.44 53.30 1oq3 n ALA 18 Cb 0.07 -3.01 -0.06 0.00 0.00 0.00 0.00 19.45 16.45 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 -2.26 -0.41 0.01 0.00 0.00 -1.26 -4.87 120.51 111.71 1oq3 n ALA 19 Ca -0.03 0.28 -0.12 0.00 0.00 0.00 0.00 53.44 53.57 1oq3 n ALA 19 Cb 0.55 -2.06 -0.09 0.00 0.00 0.00 0.00 19.45 17.85 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 0.01 1.25 -0.01 0.00 0.00 -1.89 -1.04 119.26 117.57 1oq3 h ALA 21 Ca -0.01 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1oq3 h ALA 21 Cb 0.59 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1oq3 h ALA 21 CO 0.02 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.64 1oq3 h ALA 22 N 1.71 0.01 -0.52 0.00 0.00 -1.94 -2.82 119.26 115.71 1oq3 h ALA 22 Ca -0.00 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.91 1oq3 h ALA 22 Cb 0.63 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 1oq3 h ALA 22 CO 0.04 -0.38 -0.10 0.00 0.00 0.00 0.00 179.25 178.80 1oq3 h ARG 23 N -0.18 0.02 -0.44 0.00 2.47 -0.10 0.19 114.38 116.34 1oq3 h ARG 23 Ca 0.00 -0.00 0.05 0.00 -1.26 0.00 0.00 59.98 58.77 1oq3 h ARG 23 Cb 0.20 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 28.45 1oq3 h ARG 23 CO -0.00 0.01 -0.42 0.82 0.56 0.00 0.00 179.97 180.94 1oq3 h ILE 24 N 0.02 0.00 -0.08 2.04 2.04 -1.14 -0.61 117.51 119.78 1oq3 h ILE 24 Ca 0.25 0.00 -0.19 0.00 1.00 0.00 0.00 64.86 65.93 1oq3 h ILE 24 Cb 0.39 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1oq3 h ILE 24 CO -0.51 0.00 -0.73 -0.08 0.00 0.00 0.00 178.15 176.83 1oq3 h GLU 25 N -0.20 0.43 -0.71 2.37 4.57 -1.20 -2.92 114.58 116.92 1oq3 h GLU 25 Ca 0.07 -0.35 0.05 0.00 -1.18 0.00 0.00 59.36 57.95 1oq3 h GLU 25 Cb 0.40 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 29.02 1oq3 h GLU 25 CO -0.52 0.99 0.47 0.87 -1.18 0.00 0.00 179.01 179.64 1oq3 h LYS 26 N 0.30 0.78 -0.25 1.92 1.79 -0.33 0.27 116.57 121.04 1oq3 h LYS 26 Ca -0.03 -0.05 0.06 0.00 -2.18 0.00 0.00 60.65 58.45 1oq3 h LYS 26 Cb 1.31 -0.18 -0.06 0.00 -1.58 0.00 0.00 32.23 31.72 1oq3 h LYS 26 CO 0.13 0.51 -0.12 0.78 -1.08 0.00 0.00 179.45 179.67 1oq3 h GLY 27 N 0.80 0.08 1.66 3.86 0.00 -0.92 -2.67 103.07 105.88 1oq3 h GLY 27 Ca 0.30 0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.74 1oq3 h GLY 27 CO -0.09 -0.14 -0.02 1.41 0.00 0.00 0.00 176.54 177.69 1oq3 h LEU 28 N -0.09 0.40 -2.30 3.11 3.38 -0.56 -0.17 115.31 119.08 1oq3 h LEU 28 Ca 0.13 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1oq3 h LEU 28 Cb 0.30 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1oq3 h LEU 28 CO -0.31 0.48 0.10 0.50 0.09 0.00 0.00 178.44 179.30 1oq3 h LYS 29 N 0.41 0.00 0.00 1.13 3.64 -0.40 0.16 116.57 121.51 1oq3 h LYS 29 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1oq3 h LYS 29 Cb 0.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1oq3 h LYS 29 CO 0.01 0.00 -0.31 0.54 -2.27 0.00 0.00 179.45 177.42 1oq3 n ARG 30 N -2.80 0.10 -2.25 1.90 3.00 -0.08 -4.89 116.66 111.65 1oq3 n ARG 30 Ca -0.02 0.05 -0.39 0.00 -0.01 0.00 0.00 57.85 57.48 1oq3 n ARG 30 Cb 0.16 -1.58 -0.02 0.00 0.00 0.00 0.00 32.46 31.01 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 -3.05 4.07 -0.42 5.56 -1.94 0.55 -4.94 119.30 119.12 1oq3 s MET 31 Ca 0.11 1.91 -0.28 0.00 -1.71 0.00 0.00 55.69 55.72 1oq3 s MET 31 Cb 0.16 -2.72 -0.02 0.00 2.01 0.00 0.00 34.83 34.26 1oq3 s MET 31 CO 0.64 -0.33 1.81 -1.25 -0.01 0.00 0.00 175.02 175.88 1oq3 s PRO 32 N -2.24 3.10 0.00 2.03 0.04 -1.26 -2.71 135.00 133.97 1oq3 s PRO 32 Ca 0.56 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1oq3 s PRO 32 Cb -0.32 -4.25 0.00 0.00 0.04 0.00 0.00 34.50 29.96 1oq3 s PRO 32 CO 0.41 -2.14 0.00 0.41 0.04 0.00 0.00 177.00 175.72 1oq3 n GLY 33 N 5.50 1.20 3.77 0.56 0.00 -1.26 -4.00 105.19 110.96 1oq3 n GLY 33 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.99 3.31 0.03 1.61 0.11 -1.10 -0.28 120.40 123.10 1oq3 s VAL 34 Ca 0.00 0.43 -0.01 0.00 -2.93 0.00 0.00 61.98 59.47 1oq3 s VAL 34 Cb 0.00 -2.94 -0.00 0.00 -1.53 0.00 0.00 36.38 31.91 1oq3 s VAL 34 CO 0.00 -0.56 -0.01 0.35 -3.33 0.00 0.00 175.10 171.55 1oq3 n THR 35 N -3.53 0.54 -3.86 5.04 -2.24 0.56 -4.88 114.28 105.91 1oq3 n THR 35 Ca 0.09 0.19 -0.11 0.00 -2.27 0.00 0.00 64.05 61.94 1oq3 n THR 35 Cb 0.53 -1.30 -0.11 0.00 -2.10 0.00 0.00 70.33 67.36 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 -5.38 -0.01 -0.02 3.42 1.01 -1.09 -4.96 116.67 109.63 1oq3 s ASP 36 Ca -0.01 -0.09 0.04 0.00 0.71 0.00 0.00 52.55 53.20 1oq3 s ASP 36 Cb 0.00 0.23 -0.01 0.00 1.01 0.00 0.00 42.92 44.16 1oq3 s ASP 36 CO 0.01 -0.29 -0.12 0.00 0.21 0.00 0.00 175.17 174.98 1oq3 s ALA 37 N -1.02 1.06 -0.06 5.23 0.00 -1.26 -0.19 121.76 125.52 1oq3 s ALA 37 Ca -0.11 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.32 1oq3 s ALA 37 Cb -0.06 -0.31 0.03 0.00 0.00 0.00 0.00 23.12 22.78 1oq3 s ALA 37 CO 0.01 0.23 0.06 -0.80 0.00 0.00 0.00 175.76 175.26 1oq3 s ASN 38 N -0.12 1.33 0.06 0.00 0.01 0.23 -5.00 114.94 111.44 1oq3 s ASN 38 Ca 0.02 -0.03 -0.23 0.00 -0.71 0.00 0.00 52.86 51.91 1oq3 s ASN 38 Cb -0.07 -0.16 -0.06 0.00 0.41 0.00 0.00 41.25 41.38 1oq3 s ASN 38 CO 0.00 -0.27 0.69 0.54 -1.51 0.00 0.00 177.10 176.56 1oq3 s VAL 39 N 2.17 4.72 -0.52 1.60 0.11 -1.26 -0.84 120.40 126.37 1oq3 s VAL 39 Ca 0.05 1.48 0.07 0.00 -2.93 0.00 0.00 61.98 60.64 1oq3 s VAL 39 Cb -0.13 -4.04 0.25 0.00 -1.53 0.00 0.00 36.38 30.94 1oq3 s VAL 39 CO -0.04 0.43 0.65 -3.20 -3.33 0.00 0.00 175.10 169.61 1oq3 n ASN 40 N 2.42 2.14 0.27 3.54 5.15 0.12 -4.94 115.26 123.96 1oq3 n ASN 40 Ca -0.05 -3.11 0.18 0.00 -0.60 0.00 0.00 54.58 51.00 1oq3 n ASN 40 Cb 0.50 -0.65 0.89 0.00 -0.53 0.00 0.00 39.78 39.99 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 4.06 0.00 -1.95 1.20 3.38 -1.93 0.16 115.31 120.23 1oq3 h LEU 41 Ca 0.14 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 0.00 0.19 0.00 0.09 0.00 0.00 178.44 179.38 1oq3 h ALA 42 N 2.03 1.17 0.00 1.53 0.00 -1.92 -0.70 119.26 121.37 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 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1oq3 h ALA 42 CO 0.00 -0.17 -0.24 2.41 0.00 0.00 0.00 179.25 181.25 1oq3 n THR 43 N -2.68 0.70 -4.34 0.00 -1.04 -0.04 -5.00 114.28 101.87 1oq3 n THR 43 Ca -0.02 -0.82 -0.39 0.00 -2.04 0.00 0.00 64.05 60.78 1oq3 n THR 43 Cb 0.24 0.31 -0.07 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 -0.51 -1.26 -4.22 -2.82 1.02 -0.27 -4.91 120.64 107.67 1oq3 n GLU 44 Ca 0.05 0.17 -0.19 0.00 -0.02 0.00 0.00 57.16 57.18 1oq3 n GLU 44 Cb 0.62 -4.77 -0.12 0.00 -0.02 0.00 0.00 31.44 27.16 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 -3.16 1.27 0.03 2.62 2.01 -0.66 -2.66 115.64 115.08 1oq3 s THR 45 Ca 0.76 -1.54 0.03 0.00 0.31 0.00 0.00 61.69 61.25 1oq3 s THR 45 Cb -0.44 -1.35 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 1oq3 s THR 45 CO 0.94 -0.31 -0.10 0.54 -0.69 0.00 0.00 174.62 174.99 1oq3 s VAL 46 N -1.73 0.73 0.07 3.82 0.11 0.03 0.13 120.40 123.56 1oq3 s VAL 46 Ca 0.04 -0.91 0.10 0.00 -2.93 0.00 0.00 61.98 58.28 1oq3 s VAL 46 Cb -0.07 -0.71 -0.03 0.00 -1.53 0.00 0.00 36.38 34.03 1oq3 s VAL 46 CO 0.03 -0.16 -0.26 0.54 -3.33 0.00 0.00 175.10 171.91 1oq3 s ASN 47 N -1.19 3.25 -0.06 3.54 4.22 -0.02 -0.92 114.94 123.76 1oq3 s ASN 47 Ca -0.04 -0.62 -0.04 0.00 -2.14 0.00 0.00 52.86 50.02 1oq3 s ASN 47 Cb -0.08 -0.29 0.02 0.00 1.28 0.00 0.00 41.25 42.18 1oq3 s ASN 47 CO 0.01 0.24 0.15 0.54 -2.04 0.00 0.00 177.10 176.00 1oq3 s VAL 48 N -0.88 -0.02 -0.28 3.54 0.11 -0.33 -0.60 120.40 121.96 1oq3 s VAL 48 Ca 0.12 0.06 -0.09 0.00 -2.93 0.00 0.00 61.98 59.14 1oq3 s VAL 48 Cb -0.10 -0.23 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 1oq3 s VAL 48 CO 0.03 0.02 0.13 -0.63 -3.33 0.00 0.00 175.10 171.33 1oq3 s ILE 49 N 0.45 4.72 0.21 7.04 1.01 0.73 -0.80 121.20 134.57 1oq3 s ILE 49 Ca -0.03 -0.12 -0.07 0.00 0.00 0.00 0.00 60.65 60.43 1oq3 s ILE 49 Cb -0.04 -3.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.13 1oq3 s ILE 49 CO -0.02 0.24 0.30 -0.72 0.00 0.00 0.00 174.94 174.74 1oq3 s TYR 50 N 1.66 0.69 -0.22 3.97 -0.85 -0.24 -0.32 117.35 122.05 1oq3 s TYR 50 Ca 0.06 -1.00 -0.14 0.00 -0.52 0.00 0.00 57.07 55.48 1oq3 s TYR 50 Cb -0.16 -0.16 -0.04 0.00 0.38 0.00 0.00 41.96 41.98 1oq3 s TYR 50 CO 0.07 -0.79 0.30 0.34 -1.52 0.00 0.00 175.55 173.94 1oq3 s ASP 51 N -3.06 6.31 0.00 -0.18 -1.08 0.62 -0.98 116.67 118.29 1oq3 s ASP 51 Ca 0.28 0.35 0.07 0.00 -0.52 0.00 0.00 52.55 52.73 1oq3 s ASP 51 Cb 0.03 -2.18 0.42 0.00 -1.46 0.00 0.00 42.92 39.74 1oq3 s ASP 51 CO 0.08 -0.01 1.00 -0.81 0.52 0.00 0.00 175.17 175.95 1oq3 n PRO 52 N 4.37 0.67 -0.08 4.34 -0.04 -1.25 -1.17 135.00 141.84 1oq3 n PRO 52 Ca -0.11 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.24 1oq3 n PRO 52 Cb 0.51 -1.17 -0.07 0.00 -0.04 0.00 0.00 33.50 32.74 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 2.67 0.08 0.00 0.55 0.00 -1.94 -3.42 119.26 117.21 1oq3 h ALA 53 Ca 0.00 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.26 1oq3 h ALA 53 Cb 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1oq3 h ALA 53 CO 0.00 0.32 -0.45 0.93 0.00 0.00 0.00 179.25 180.05 1oq3 h GLU 54 N -1.00 0.00 -6.96 0.00 4.39 -1.86 -3.48 114.58 105.67 1oq3 h GLU 54 Ca -0.10 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.11 1oq3 h GLU 54 Cb 0.76 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.44 1oq3 h GLU 54 CO -0.06 0.41 0.13 0.99 -1.16 0.00 0.00 179.01 179.32 1oq3 s THR 55 N -2.08 4.86 0.01 1.13 2.01 -0.32 -4.97 115.64 116.29 1oq3 s THR 55 Ca -0.15 0.22 -0.28 0.00 0.31 0.00 0.00 61.69 61.79 1oq3 s THR 55 Cb 0.01 -3.85 0.10 0.00 0.01 0.00 0.00 72.50 68.77 1oq3 s THR 55 CO 0.33 -0.85 0.90 -0.83 -0.69 0.00 0.00 174.62 173.48 1oq3 s GLY 56 N -4.12 -0.44 0.48 4.40 0.00 -1.26 -3.95 107.32 102.44 1oq3 s GLY 56 Ca 0.48 0.91 0.26 0.00 0.00 0.00 0.00 44.72 46.37 1oq3 s GLY 56 CO 0.45 0.30 1.87 0.00 0.00 0.00 0.00 173.10 175.72 1oq3 h THR 57 N 2.00 0.60 -0.71 0.90 1.03 -1.99 0.84 112.91 115.58 1oq3 h THR 57 Ca -0.22 -0.06 0.06 0.00 -0.01 0.00 0.00 66.41 66.18 1oq3 h THR 57 Cb 1.24 0.41 -0.08 0.00 -1.07 0.00 0.00 68.15 68.64 1oq3 h THR 57 CO 0.30 0.03 -0.42 0.00 -0.01 0.00 0.00 175.52 175.43 1oq3 n ALA 58 N -2.62 -0.45 -0.04 0.00 0.00 -1.26 -0.38 120.51 115.75 1oq3 n ALA 58 Ca 0.19 0.60 -0.12 0.00 0.00 0.00 0.00 53.44 54.11 1oq3 n ALA 58 Cb 0.86 -0.05 0.02 0.00 0.00 0.00 0.00 19.45 20.28 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 0.25 0.61 0.45 0.00 0.00 -1.23 -2.94 119.26 116.40 1oq3 h ALA 59 Ca 0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1oq3 h ALA 59 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1oq3 h ALA 59 CO -0.66 0.68 -0.39 0.82 0.00 0.00 0.00 179.25 179.69 1oq3 h ILE 60 N 0.56 0.00 -0.51 0.00 5.03 -1.08 -1.72 117.51 119.79 1oq3 h ILE 60 Ca 0.02 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 64.85 1oq3 h ILE 60 Cb 1.08 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 34.77 1oq3 h ILE 60 CO 0.11 0.00 -0.32 1.56 -0.68 0.00 0.00 178.15 178.81 1oq3 h GLN 61 N -0.83 -0.19 -0.91 2.37 7.50 -0.67 0.28 115.11 122.67 1oq3 h GLN 61 Ca -0.06 0.01 0.11 0.00 0.50 0.00 0.00 58.65 59.22 1oq3 h GLN 61 Cb 0.70 0.04 -0.13 0.00 0.05 0.00 0.00 27.48 28.14 1oq3 h GLN 61 CO -0.02 -0.12 -0.48 1.49 -1.50 0.00 0.00 178.83 178.19 1oq3 h GLU 62 N -0.19 -0.05 -0.26 1.46 4.22 -1.42 0.46 114.58 118.80 1oq3 h GLU 62 Ca 0.21 0.00 -0.18 0.00 0.08 0.00 0.00 59.36 59.47 1oq3 h GLU 62 Cb 0.54 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1oq3 h GLU 62 CO -0.62 -0.03 -0.56 0.87 -2.18 0.00 0.00 179.01 176.49 1oq3 h LYS 63 N -0.05 0.84 -0.55 1.92 6.56 0.06 -2.93 116.57 122.41 1oq3 h LYS 63 Ca 0.24 -0.55 0.10 0.00 -1.06 0.00 0.00 60.65 59.37 1oq3 h LYS 63 Cb 0.52 0.07 -0.08 0.00 -0.57 0.00 0.00 32.23 32.17 1oq3 h LYS 63 CO -0.91 1.18 0.11 0.82 -2.06 0.00 0.00 179.45 178.59 1oq3 h ILE 64 N 0.60 0.68 -0.84 1.86 1.08 0.30 0.29 117.51 121.48 1oq3 h ILE 64 Ca 0.00 -0.08 0.13 0.00 -0.39 0.00 0.00 64.86 64.52 1oq3 h ILE 64 Cb 1.17 0.41 -0.09 0.00 -3.07 0.00 0.00 36.82 35.25 1oq3 h ILE 64 CO 0.12 0.04 0.45 -0.33 -0.69 0.00 0.00 178.15 177.74 1oq3 h GLU 65 N 0.24 0.66 -0.28 2.37 4.39 -0.82 -2.03 114.58 119.12 1oq3 h GLU 65 Ca 0.28 -0.04 -0.18 0.00 0.34 0.00 0.00 59.36 59.77 1oq3 h GLU 65 Cb 0.40 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1oq3 h GLU 65 CO -0.37 0.44 -0.52 -0.22 -1.16 0.00 0.00 179.01 177.17 1oq3 h LYS 66 N 0.68 0.81 -0.26 2.33 1.63 -0.41 -1.48 116.57 119.86 1oq3 h LYS 66 Ca 0.44 -0.50 0.07 0.00 -0.85 0.00 0.00 60.65 59.81 1oq3 h LYS 66 Cb 0.55 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.22 1oq3 h LYS 66 CO -0.32 1.13 0.31 -0.07 -3.45 0.00 0.00 179.45 177.05 1oq3 h LEU 67 N 0.62 0.00 0.00 5.20 -0.00 -0.04 -3.45 115.31 117.64 1oq3 h LEU 67 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 1oq3 h LEU 67 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.78 1oq3 h LEU 67 CO 0.11 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.16 1oq3 n GLY 68 N -1.42 1.97 3.18 0.83 0.00 -0.56 -4.96 105.19 104.24 1oq3 n GLY 68 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.15 1.61 1.51 -0.92 -5.03 117.35 113.25 1oq3 s TYR 69 Ca 0.00 -1.22 0.01 0.00 -1.01 0.00 0.00 57.07 54.86 1oq3 s TYR 69 Cb 0.00 -0.45 0.02 0.00 -0.11 0.00 0.00 41.96 41.41 1oq3 s TYR 69 CO 0.00 -0.56 -0.18 -1.58 -1.11 0.00 0.00 175.55 172.12 1oq3 s HIS 70 N -4.06 2.45 -0.07 2.71 5.65 -1.25 -2.93 115.29 117.78 1oq3 s HIS 70 Ca 0.26 -1.34 -0.05 0.00 0.25 0.00 0.00 55.06 54.19 1oq3 s HIS 70 Cb 0.07 -1.72 -0.04 0.00 -1.18 0.00 0.00 32.58 29.71 1oq3 s HIS 70 CO 0.04 -0.67 0.15 0.54 -0.65 0.00 0.00 174.74 174.14 1oq3 s VAL 71 N 1.19 5.39 0.11 0.89 0.11 -1.26 -0.53 120.40 126.30 1oq3 s VAL 71 Ca 0.00 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.11 1oq3 s VAL 71 Cb -0.14 -3.41 -0.04 0.00 -1.53 0.00 0.00 36.38 31.26 1oq3 s VAL 71 CO -0.08 0.50 0.13 0.68 -3.33 0.00 0.00 175.10 173.00 1oq3 s VAL 72 N -1.14 4.71 -0.57 2.04 -7.23 -0.37 -4.97 120.40 112.88 1oq3 s VAL 72 Ca 0.20 -0.80 0.07 0.00 -1.81 0.00 0.00 61.98 59.64 1oq3 s VAL 72 Cb -0.12 -3.33 0.27 0.00 0.56 0.00 0.00 36.38 33.76 1oq3 s VAL 72 CO 0.10 0.04 0.74 -0.38 -0.31 0.00 0.00 175.10 175.29 1oq3 n ILE 73 N 0.11 1.79 -2.85 -0.62 2.08 -1.26 -3.61 119.36 115.00 1oq3 n ILE 73 Ca -0.08 -5.03 -0.43 0.00 0.56 0.00 0.00 62.75 57.77 1oq3 n ILE 73 Cb 0.53 -1.85 -0.04 0.00 -0.75 0.00 0.00 39.64 37.53 1oq3 n ILE 73 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1oq3 s GLU 74 N -2.42 3.14 -0.18 0.38 -6.30 -1.26 -4.77 118.70 107.30 1oq3 s GLU 74 Ca 0.41 -0.74 -0.02 0.00 -2.50 0.00 0.00 54.97 52.12 1oq3 s GLU 74 Cb 0.19 -4.20 0.00 0.00 0.00 0.00 0.00 34.13 30.12 1oq3 s GLU 74 CO -0.06 -1.78 0.12 0.41 0.02 0.00 0.00 175.26 173.97 1oq3 n GLY 75 N 5.30 -0.22 0.00 -1.50 0.00 -1.26 -4.97 105.19 102.54 1oq3 n GLY 75 Ca -0.03 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1oq3 n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86