#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 0.00 -3.54 4.03 7.94 -1.26 -5.13 117.00 119.04 1oq3 n LEU 2 Ca 0.00 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.78 1oq3 n LEU 2 Cb 0.00 -0.01 -0.04 0.00 0.53 0.00 0.00 43.42 43.89 1oq3 n LEU 2 CO 0.00 -0.02 0.67 -0.94 -1.11 0.00 0.00 177.39 175.98 1oq3 s SER 3 N -0.34 -0.44 -0.29 1.96 1.04 -1.26 -5.10 113.70 109.28 1oq3 s SER 3 Ca 0.00 0.35 -0.24 0.00 0.48 0.00 0.00 55.95 56.53 1oq3 s SER 3 Cb 0.00 0.39 0.14 0.00 0.10 0.00 0.00 66.02 66.64 1oq3 s SER 3 CO 0.00 -0.50 1.11 -1.83 0.98 0.00 0.00 173.24 173.00 1oq3 s GLU 4 N -1.76 0.41 0.29 4.02 4.04 -1.26 -5.19 118.70 119.24 1oq3 s GLU 4 Ca -0.02 0.50 0.11 0.00 0.04 0.00 0.00 54.97 55.60 1oq3 s GLU 4 Cb -0.01 0.19 -0.05 0.00 0.02 0.00 0.00 34.13 34.28 1oq3 s GLU 4 CO -0.00 -0.05 -0.12 1.14 -1.84 0.00 0.00 175.26 174.38 1oq3 s GLN 5 N 0.30 1.88 0.06 -4.83 -2.07 -1.26 -4.38 119.66 109.36 1oq3 s GLN 5 Ca 0.03 -1.70 -0.08 0.00 -1.82 0.00 0.00 55.36 51.79 1oq3 s GLN 5 Cb -0.05 -1.87 -0.00 0.00 -1.09 0.00 0.00 33.01 30.00 1oq3 s GLN 5 CO -0.09 0.30 0.17 0.15 -1.32 0.00 0.00 175.29 174.51 1oq3 s LYS 6 N -3.58 0.75 0.26 9.60 -0.14 -0.21 -4.98 119.74 121.45 1oq3 s LYS 6 Ca 0.31 -0.83 -0.21 0.00 -1.36 0.00 0.00 55.97 53.87 1oq3 s LYS 6 Cb -0.04 0.31 -0.09 0.00 -1.68 0.00 0.00 37.83 36.33 1oq3 s LYS 6 CO 0.17 -0.22 0.79 -1.83 -0.76 0.00 0.00 175.35 173.50 1oq3 s GLU 7 N -3.28 4.34 0.16 1.68 -1.05 -1.26 -1.12 118.70 118.17 1oq3 s GLU 7 Ca 0.01 1.00 0.10 0.00 -0.15 0.00 0.00 54.97 55.93 1oq3 s GLU 7 Cb 0.02 -2.82 -0.04 0.00 -0.44 0.00 0.00 34.13 30.85 1oq3 s GLU 7 CO -0.08 0.34 -0.22 -1.50 0.95 0.00 0.00 175.26 174.75 1oq3 s ILE 8 N -1.58 2.10 -0.03 1.83 1.10 0.25 -4.97 121.20 119.90 1oq3 s ILE 8 Ca 0.46 -1.89 -0.01 0.00 -0.51 0.00 0.00 60.65 58.70 1oq3 s ILE 8 Cb -0.17 -1.95 0.03 0.00 0.15 0.00 0.00 42.46 40.52 1oq3 s ILE 8 CO 0.21 -0.14 0.04 0.00 -2.11 0.00 0.00 174.94 172.95 1oq3 s ALA 9 N -1.62 0.14 0.21 1.50 0.00 -1.26 -0.98 121.76 119.74 1oq3 s ALA 9 Ca 0.16 0.26 -0.17 0.00 0.00 0.00 0.00 51.96 52.22 1oq3 s ALA 9 Cb -0.08 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.67 1oq3 s ALA 9 CO 0.08 -0.26 0.53 0.00 0.00 0.00 0.00 175.76 176.11 1oq3 s MET 10 N 1.50 1.43 0.08 0.00 0.23 -0.17 -4.79 119.30 117.58 1oq3 s MET 10 Ca -0.04 -0.94 -0.05 0.00 -1.03 0.00 0.00 55.69 53.63 1oq3 s MET 10 Cb -0.13 0.52 -0.05 0.00 -1.53 0.00 0.00 34.83 33.64 1oq3 s MET 10 CO -0.03 -0.61 0.32 -0.65 -2.03 0.00 0.00 175.02 172.02 1oq3 s GLN 11 N -3.90 3.60 0.33 3.16 1.11 -1.26 -0.74 119.66 121.95 1oq3 s GLN 11 Ca 0.11 -0.10 0.09 0.00 0.01 0.00 0.00 55.36 55.47 1oq3 s GLN 11 Cb -0.01 -2.97 -0.05 0.00 -1.01 0.00 0.00 33.01 28.96 1oq3 s GLN 11 CO -0.00 0.56 0.01 0.08 0.01 0.00 0.00 175.29 175.95 1oq3 s VAL 12 N -1.48 2.73 -0.06 1.09 1.01 -1.22 -0.59 120.40 121.88 1oq3 s VAL 12 Ca 0.35 -1.97 0.03 0.00 0.00 0.00 0.00 61.98 60.38 1oq3 s VAL 12 Cb -0.13 -2.79 0.01 0.00 0.00 0.00 0.00 36.38 33.47 1oq3 s VAL 12 CO 0.21 -0.23 -0.13 -0.55 0.00 0.00 0.00 175.10 174.41 1oq3 s SER 13 N -3.71 1.84 0.00 3.32 0.15 0.24 -4.82 113.70 110.72 1oq3 s SER 13 Ca 0.34 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.68 1oq3 s SER 13 Cb -0.01 -0.80 0.00 0.00 -1.71 0.00 0.00 66.02 63.50 1oq3 s SER 13 CO 0.19 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.30 1oq3 n GLY 14 N 3.71 2.10 3.64 9.45 0.00 -1.26 -3.41 105.19 119.42 1oq3 n GLY 14 Ca -0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.78 0.81 -1.55 1.61 0.00 -1.26 -4.97 117.12 110.99 1oq3 n MET 15 Ca 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 57.70 58.01 1oq3 n MET 15 Cb 0.00 -2.26 0.09 0.00 0.00 0.00 0.00 33.22 31.04 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 -2.04 1.39 -0.26 3.17 -2.24 -1.26 -5.06 114.28 107.99 1oq3 n THR 16 Ca 0.14 -2.65 0.00 0.00 -2.27 0.00 0.00 64.05 59.27 1oq3 n THR 16 Cb 0.48 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 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 11.45 -1.72 -1.81 0.00 0.00 -1.26 -0.31 120.51 126.85 1oq3 n ALA 18 Ca 0.00 -0.27 -0.13 0.00 0.00 0.00 0.00 53.44 53.03 1oq3 n ALA 18 Cb 0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 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 -2.84 -0.43 0.12 0.00 0.00 -1.26 -4.87 120.51 111.22 1oq3 n ALA 19 Ca -0.06 0.17 -0.06 0.00 0.00 0.00 0.00 53.44 53.50 1oq3 n ALA 19 Cb 0.26 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 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 -1.28 1.61 -0.82 0.00 0.00 -1.90 0.78 119.26 117.66 1oq3 h ALA 21 Ca -0.04 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.94 1oq3 h ALA 21 Cb 0.28 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.93 1oq3 h ALA 21 CO 0.06 0.16 0.30 0.00 0.00 0.00 0.00 179.25 179.77 1oq3 h ALA 22 N 1.88 1.19 -0.59 0.00 0.00 -1.92 -0.43 119.26 119.39 1oq3 h ALA 22 Ca -0.00 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1oq3 h ALA 22 Cb 0.25 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1oq3 h ALA 22 CO 0.02 -0.31 0.11 0.00 0.00 0.00 0.00 179.25 179.06 1oq3 h ARG 23 N 0.37 0.97 0.13 0.00 3.08 -0.90 0.82 114.38 118.85 1oq3 h ARG 23 Ca 0.48 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 60.29 1oq3 h ARG 23 Cb 0.85 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.74 1oq3 h ARG 23 CO -0.50 0.91 -0.49 0.82 -1.07 0.00 0.00 179.97 179.64 1oq3 h ILE 24 N 0.87 0.05 -0.21 2.04 2.04 -1.07 -1.10 117.51 120.13 1oq3 h ILE 24 Ca 0.18 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 65.88 1oq3 h ILE 24 Cb 0.41 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1oq3 h ILE 24 CO 0.01 0.00 -0.52 -0.08 0.00 0.00 0.00 178.15 177.56 1oq3 h GLU 25 N -0.73 0.61 -0.99 2.37 4.57 -1.03 -1.82 114.58 117.56 1oq3 h GLU 25 Ca 0.00 -0.37 0.19 0.00 -1.18 0.00 0.00 59.36 58.00 1oq3 h GLU 25 Cb 0.74 0.04 -0.11 0.00 -0.16 0.00 0.00 28.75 29.26 1oq3 h GLU 25 CO -0.27 0.98 0.59 0.87 -1.18 0.00 0.00 179.01 180.00 1oq3 h LYS 26 N 0.48 0.71 -0.48 1.92 1.79 -0.68 0.34 116.57 120.63 1oq3 h LYS 26 Ca 0.02 -0.04 0.09 0.00 -2.18 0.00 0.00 60.65 58.53 1oq3 h LYS 26 Cb 1.07 -0.16 -0.07 0.00 -1.58 0.00 0.00 32.23 31.49 1oq3 h LYS 26 CO 0.10 0.47 0.05 0.78 -1.08 0.00 0.00 179.45 179.77 1oq3 h GLY 27 N 0.73 0.54 1.79 3.86 0.00 -0.32 -2.07 103.07 107.60 1oq3 h GLY 27 Ca 0.57 0.02 -0.09 0.00 0.00 0.00 0.00 47.33 47.83 1oq3 h GLY 27 CO -0.39 -0.10 -0.35 1.41 0.00 0.00 0.00 176.54 177.11 1oq3 h LEU 28 N 0.17 0.25 -2.08 3.11 3.38 -0.34 -0.92 115.31 118.88 1oq3 h LEU 28 Ca 0.24 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1oq3 h LEU 28 Cb 0.35 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1oq3 h LEU 28 CO -0.36 0.59 0.02 0.50 0.09 0.00 0.00 178.44 179.27 1oq3 h LYS 29 N 0.21 0.00 -0.02 1.13 3.64 0.02 0.11 116.57 121.67 1oq3 h LYS 29 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1oq3 h LYS 29 Cb 0.72 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1oq3 h LYS 29 CO 0.05 0.00 -0.00 0.54 -2.27 0.00 0.00 179.45 177.77 1oq3 n ARG 30 N -2.61 1.78 -2.70 1.90 1.74 -0.35 -4.89 116.66 111.53 1oq3 n ARG 30 Ca -0.02 -1.14 -0.38 0.00 -0.77 0.00 0.00 57.85 55.54 1oq3 n ARG 30 Cb 0.07 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 29.97 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 -2.01 4.62 -0.55 5.56 -1.94 0.40 -4.98 119.30 120.41 1oq3 s MET 31 Ca 0.36 1.46 -0.27 0.00 -1.71 0.00 0.00 55.69 55.53 1oq3 s MET 31 Cb 0.21 -2.96 -0.01 0.00 2.01 0.00 0.00 34.83 34.07 1oq3 s MET 31 CO 0.33 0.29 1.75 -1.25 -0.01 0.00 0.00 175.02 176.13 1oq3 s PRO 32 N -1.76 2.91 0.00 2.03 0.04 -1.26 -2.56 135.00 134.39 1oq3 s PRO 32 Ca 0.48 0.72 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1oq3 s PRO 32 Cb -0.23 -4.30 0.00 0.00 0.04 0.00 0.00 34.50 30.01 1oq3 s PRO 32 CO 0.29 -2.40 0.00 0.41 0.04 0.00 0.00 177.00 175.34 1oq3 n GLY 33 N 5.55 0.50 3.78 0.56 0.00 -1.26 -4.05 105.19 110.27 1oq3 n GLY 33 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.09 3.43 0.01 1.61 0.11 -1.06 -0.36 120.40 123.04 1oq3 s VAL 34 Ca 0.00 0.57 -0.03 0.00 -2.93 0.00 0.00 61.98 59.59 1oq3 s VAL 34 Cb 0.00 -3.10 -0.01 0.00 -1.53 0.00 0.00 36.38 31.74 1oq3 s VAL 34 CO 0.00 -0.50 -0.06 0.35 -3.33 0.00 0.00 175.10 171.56 1oq3 n THR 35 N -2.82 0.80 -4.00 5.04 -2.24 0.54 -4.90 114.28 106.69 1oq3 n THR 35 Ca 0.09 0.26 -0.08 0.00 -2.27 0.00 0.00 64.05 62.05 1oq3 n THR 35 Cb 0.53 -1.56 -0.10 0.00 -2.10 0.00 0.00 70.33 67.10 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 -5.47 0.33 -0.01 3.42 1.01 -1.03 -5.01 116.67 109.90 1oq3 s ASP 36 Ca -0.05 -0.77 0.01 0.00 0.71 0.00 0.00 52.55 52.45 1oq3 s ASP 36 Cb 0.01 0.21 0.00 0.00 1.01 0.00 0.00 42.92 44.15 1oq3 s ASP 36 CO 0.08 -0.55 -0.04 0.00 0.21 0.00 0.00 175.17 174.87 1oq3 s ALA 37 N -3.25 0.40 -0.11 5.23 0.00 -1.26 -0.27 121.76 122.50 1oq3 s ALA 37 Ca 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.82 1oq3 s ALA 37 Cb 0.03 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 23.02 1oq3 s ALA 37 CO -0.08 0.05 0.07 -0.80 0.00 0.00 0.00 175.76 175.01 1oq3 s ASN 38 N 0.20 1.80 0.13 0.00 0.01 0.31 -4.99 114.94 112.40 1oq3 s ASN 38 Ca -0.02 -0.29 -0.26 0.00 -0.71 0.00 0.00 52.86 51.59 1oq3 s ASN 38 Cb -0.05 -0.22 -0.07 0.00 0.41 0.00 0.00 41.25 41.31 1oq3 s ASN 38 CO -0.00 -0.30 0.79 0.54 -1.51 0.00 0.00 177.10 176.62 1oq3 s VAL 39 N 2.13 4.46 -0.46 1.60 0.11 -1.26 -0.94 120.40 126.05 1oq3 s VAL 39 Ca 0.03 1.72 0.09 0.00 -2.93 0.00 0.00 61.98 60.89 1oq3 s VAL 39 Cb -0.14 -4.15 0.31 0.00 -1.53 0.00 0.00 36.38 30.87 1oq3 s VAL 39 CO -0.06 0.47 0.73 -3.20 -3.33 0.00 0.00 175.10 169.71 1oq3 n ASN 40 N 1.99 1.88 0.16 3.54 5.15 0.78 -4.93 115.26 123.83 1oq3 n ASN 40 Ca -0.04 -3.14 0.13 0.00 -0.60 0.00 0.00 54.58 50.92 1oq3 n ASN 40 Cb 0.49 -0.62 0.57 0.00 -0.53 0.00 0.00 39.78 39.69 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 3.39 0.00 -2.02 1.20 3.38 -1.92 0.61 115.31 119.95 1oq3 h LEU 41 Ca 0.11 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.19 1oq3 h LEU 41 Cb 0.80 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1oq3 h LEU 41 CO 0.61 0.00 0.40 0.00 0.09 0.00 0.00 178.44 179.53 1oq3 h ALA 42 N 2.16 2.04 0.00 1.53 0.00 -1.92 -0.63 119.26 122.45 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 0.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1oq3 h ALA 42 CO 0.00 -0.58 -0.05 2.41 0.00 0.00 0.00 179.25 181.03 1oq3 n THR 43 N -3.71 1.43 -3.92 0.00 -1.04 0.14 -5.00 114.28 102.19 1oq3 n THR 43 Ca 0.06 -1.68 -0.31 0.00 -2.04 0.00 0.00 64.05 60.08 1oq3 n THR 43 Cb 0.56 0.05 -0.02 0.00 -1.82 0.00 0.00 70.33 69.10 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 -1.03 -3.20 -4.08 -2.82 1.02 -0.25 -4.93 120.64 105.35 1oq3 n GLU 44 Ca 0.10 0.38 -0.11 0.00 -0.02 0.00 0.00 57.16 57.52 1oq3 n GLU 44 Cb 0.55 -5.11 -0.11 0.00 -0.02 0.00 0.00 31.44 26.76 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 0.45 0.07 2.62 2.01 -0.78 -3.40 115.64 113.49 1oq3 s THR 45 Ca 0.62 -1.41 0.03 0.00 0.31 0.00 0.00 61.69 61.25 1oq3 s THR 45 Cb -0.34 -0.99 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 1oq3 s THR 45 CO 0.77 -0.64 -0.10 0.54 -0.69 0.00 0.00 174.62 174.49 1oq3 s VAL 46 N -2.44 0.84 0.10 3.82 0.11 0.08 -0.15 120.40 122.76 1oq3 s VAL 46 Ca -0.02 -1.40 0.07 0.00 -2.93 0.00 0.00 61.98 57.71 1oq3 s VAL 46 Cb -0.03 -1.07 -0.03 0.00 -1.53 0.00 0.00 36.38 33.72 1oq3 s VAL 46 CO -0.03 -0.44 -0.19 0.54 -3.33 0.00 0.00 175.10 171.65 1oq3 s ASN 47 N -2.03 2.34 -0.14 3.54 4.22 -0.11 -0.99 114.94 121.77 1oq3 s ASN 47 Ca -0.01 -0.69 -0.12 0.00 -2.14 0.00 0.00 52.86 49.90 1oq3 s ASN 47 Cb -0.06 -0.12 0.04 0.00 1.28 0.00 0.00 41.25 42.39 1oq3 s ASN 47 CO 0.00 0.01 0.37 0.54 -2.04 0.00 0.00 177.10 175.98 1oq3 s VAL 48 N -1.30 -0.01 -0.24 3.54 0.11 -0.16 -0.53 120.40 121.82 1oq3 s VAL 48 Ca 0.05 0.02 -0.06 0.00 -2.93 0.00 0.00 61.98 59.07 1oq3 s VAL 48 Cb -0.09 -0.52 -0.02 0.00 -1.53 0.00 0.00 36.38 34.21 1oq3 s VAL 48 CO 0.04 0.01 0.03 -0.63 -3.33 0.00 0.00 175.10 171.21 1oq3 s ILE 49 N 0.42 3.94 0.26 7.04 1.09 0.62 -0.58 121.20 133.99 1oq3 s ILE 49 Ca -0.02 -0.30 -0.05 0.00 -1.10 0.00 0.00 60.65 59.19 1oq3 s ILE 49 Cb -0.04 -2.83 -0.02 0.00 -1.06 0.00 0.00 42.46 38.52 1oq3 s ILE 49 CO -0.02 0.37 0.34 -0.72 -0.10 0.00 0.00 174.94 174.81 1oq3 s TYR 50 N 1.56 0.92 -0.23 3.97 -0.85 -0.28 -0.34 117.35 122.11 1oq3 s TYR 50 Ca 0.06 -1.17 -0.04 0.00 -0.52 0.00 0.00 57.07 55.41 1oq3 s TYR 50 Cb -0.15 -0.21 -0.00 0.00 0.38 0.00 0.00 41.96 41.98 1oq3 s TYR 50 CO 0.01 -0.90 -0.03 0.34 -1.52 0.00 0.00 175.55 173.45 1oq3 s ASP 51 N -3.15 4.39 0.00 -0.18 -1.08 0.51 -1.04 116.67 116.12 1oq3 s ASP 51 Ca 0.32 -0.48 0.00 0.00 -0.52 0.00 0.00 52.55 51.87 1oq3 s ASP 51 Cb 0.02 -1.75 0.02 0.00 -1.46 0.00 0.00 42.92 39.76 1oq3 s ASP 51 CO 0.14 -0.05 0.38 -0.81 0.52 0.00 0.00 175.17 175.36 1oq3 n PRO 52 N 4.79 0.36 0.09 4.34 -0.04 -1.08 -0.26 135.00 143.21 1oq3 n PRO 52 Ca -0.18 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.06 1oq3 n PRO 52 Cb 0.50 -1.01 -0.14 0.00 -0.04 0.00 0.00 33.50 32.81 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 1.75 -0.04 0.00 0.55 0.00 -1.95 -3.41 119.26 116.17 1oq3 h ALA 53 Ca 0.00 -0.77 -0.18 0.00 0.00 0.00 0.00 54.91 53.95 1oq3 h ALA 53 Cb 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1oq3 h ALA 53 CO 0.00 0.65 -1.62 0.39 0.00 0.00 0.00 179.25 178.68 1oq3 n GLU 54 N -3.82 0.23 -4.44 0.00 1.02 -0.95 -5.07 120.64 107.62 1oq3 n GLU 54 Ca -0.14 0.10 -0.34 0.00 -0.02 0.00 0.00 57.16 56.76 1oq3 n GLU 54 Cb 0.98 -0.91 -0.13 0.00 -0.02 0.00 0.00 31.44 31.37 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 -2.20 3.55 0.21 2.62 2.01 0.64 -4.95 115.64 117.52 1oq3 s THR 55 Ca -0.15 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.33 1oq3 s THR 55 Cb 0.06 -2.55 0.02 0.00 0.01 0.00 0.00 72.50 70.04 1oq3 s THR 55 CO 0.20 0.49 0.36 0.61 -0.69 0.00 0.00 174.62 175.58 1oq3 n GLY 56 N 3.74 2.00 0.16 4.40 0.00 -1.26 -2.63 105.19 111.59 1oq3 n GLY 56 Ca -0.18 -1.33 0.08 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.31 -0.19 -0.07 2.61 5.66 -1.26 -0.41 114.28 120.30 1oq3 n THR 57 Ca -0.02 0.99 -0.09 0.00 -3.05 0.00 0.00 64.05 61.88 1oq3 n THR 57 Cb 0.33 -1.48 -0.03 0.00 -1.55 0.00 0.00 70.33 67.60 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 0.92 -0.30 -0.17 1.79 0.00 -2.00 0.15 119.26 119.65 1oq3 h ALA 58 Ca 0.30 0.07 -0.22 0.00 0.00 0.00 0.00 54.91 55.06 1oq3 h ALA 58 Cb 0.67 0.70 0.01 0.00 0.00 0.00 0.00 17.79 19.17 1oq3 h ALA 58 CO -0.42 -0.78 -0.75 0.00 0.00 0.00 0.00 179.25 177.30 1oq3 h ALA 59 N 0.57 0.32 0.64 0.00 0.00 -1.11 -3.27 119.26 116.41 1oq3 h ALA 59 Ca 0.14 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1oq3 h ALA 59 Cb 0.55 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1oq3 h ALA 59 CO -0.48 0.68 -0.31 0.82 0.00 0.00 0.00 179.25 179.96 1oq3 h ILE 60 N 0.56 0.31 -0.53 0.00 2.04 -0.74 -1.69 117.51 117.46 1oq3 h ILE 60 Ca -0.05 -0.16 0.11 0.00 1.00 0.00 0.00 64.86 65.76 1oq3 h ILE 60 Cb 1.38 0.37 -0.10 0.00 -0.74 0.00 0.00 36.82 37.72 1oq3 h ILE 60 CO 0.16 0.02 -0.19 1.56 0.00 0.00 0.00 178.15 179.70 1oq3 h GLN 61 N -0.98 -0.06 -0.57 2.37 7.50 -0.87 0.21 115.11 122.71 1oq3 h GLN 61 Ca -0.09 0.00 0.11 0.00 0.50 0.00 0.00 58.65 59.18 1oq3 h GLN 61 Cb 0.70 0.01 -0.11 0.00 0.05 0.00 0.00 27.48 28.13 1oq3 h GLN 61 CO 0.15 -0.04 -0.15 1.49 -1.50 0.00 0.00 178.83 178.77 1oq3 h GLU 62 N -0.06 -0.01 -0.14 1.46 4.22 -1.55 0.70 114.58 119.19 1oq3 h GLU 62 Ca 0.25 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.63 1oq3 h GLU 62 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1oq3 h GLU 62 CO -0.58 -0.01 -0.17 0.87 -2.18 0.00 0.00 179.01 176.95 1oq3 h LYS 63 N -0.01 0.36 -0.63 1.92 6.56 -0.29 -3.16 116.57 121.31 1oq3 h LYS 63 Ca 0.27 -0.20 0.13 0.00 -1.06 0.00 0.00 60.65 59.79 1oq3 h LYS 63 Cb 0.42 0.01 -0.10 0.00 -0.57 0.00 0.00 32.23 32.00 1oq3 h LYS 63 CO -0.59 0.77 0.05 0.82 -2.06 0.00 0.00 179.45 178.44 1oq3 h ILE 64 N -0.03 0.52 -0.57 1.86 1.08 0.31 0.30 117.51 120.98 1oq3 h ILE 64 Ca 0.02 -0.05 0.11 0.00 -0.39 0.00 0.00 64.86 64.55 1oq3 h ILE 64 Cb 0.72 0.35 -0.11 0.00 -3.07 0.00 0.00 36.82 34.70 1oq3 h ILE 64 CO 0.04 0.03 -0.16 -0.33 -0.69 0.00 0.00 178.15 177.04 1oq3 h GLU 65 N 0.16 -0.02 -0.10 2.37 4.39 -0.75 -1.88 114.58 118.75 1oq3 h GLU 65 Ca 0.33 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.90 1oq3 h GLU 65 Cb 0.54 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1oq3 h GLU 65 CO -0.50 -0.01 -0.54 -0.22 -1.16 0.00 0.00 179.01 176.57 1oq3 h LYS 66 N -0.02 0.29 -0.37 2.33 1.63 -0.53 -0.10 116.57 119.79 1oq3 h LYS 66 Ca 0.27 -0.18 0.11 0.00 -0.85 0.00 0.00 60.65 60.00 1oq3 h LYS 66 Cb 0.44 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.07 1oq3 h LYS 66 CO -0.60 0.76 0.44 -0.07 -3.45 0.00 0.00 179.45 176.53 1oq3 h LEU 67 N 0.22 0.00 0.00 5.20 -0.00 0.05 -3.45 115.31 117.33 1oq3 h LEU 67 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1oq3 h LEU 67 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.69 1oq3 h LEU 67 CO 0.09 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.14 1oq3 n GLY 68 N -1.47 1.94 3.37 0.83 0.00 -0.05 -4.98 105.19 104.83 1oq3 n GLY 68 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 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 0.37 -0.01 1.61 1.51 -1.13 -5.00 117.35 112.70 1oq3 s TYR 69 Ca 0.00 -0.73 0.08 0.00 -1.01 0.00 0.00 57.07 55.41 1oq3 s TYR 69 Cb 0.00 -0.01 -0.02 0.00 -0.11 0.00 0.00 41.96 41.82 1oq3 s TYR 69 CO 0.00 -0.76 -0.25 -3.38 -1.11 0.00 0.00 175.55 170.05 1oq3 s HIS 70 N -3.97 2.26 -0.00 2.71 -3.43 -1.22 -2.86 115.29 108.77 1oq3 s HIS 70 Ca 0.18 -0.42 -0.12 0.00 -0.80 0.00 0.00 55.06 53.89 1oq3 s HIS 70 Cb 0.03 -1.44 -0.05 0.00 -1.43 0.00 0.00 32.58 29.68 1oq3 s HIS 70 CO 0.01 -0.02 0.35 0.54 -2.00 0.00 0.00 174.74 173.61 1oq3 s VAL 71 N -0.61 5.14 0.39 -5.38 0.11 -1.26 -0.59 120.40 118.21 1oq3 s VAL 71 Ca 0.10 0.60 0.04 0.00 -2.93 0.00 0.00 61.98 59.79 1oq3 s VAL 71 Cb -0.10 -3.63 -0.00 0.00 -1.53 0.00 0.00 36.38 31.12 1oq3 s VAL 71 CO -0.01 0.51 0.56 0.68 -3.33 0.00 0.00 175.10 173.52 1oq3 s VAL 72 N -1.15 3.88 -0.57 2.04 -7.23 0.24 -4.99 120.40 112.62 1oq3 s VAL 72 Ca 0.24 -0.81 0.05 0.00 -1.81 0.00 0.00 61.98 59.65 1oq3 s VAL 72 Cb -0.15 -3.38 0.19 0.00 0.56 0.00 0.00 36.38 33.61 1oq3 s VAL 72 CO 0.13 -0.19 0.49 -0.38 -0.31 0.00 0.00 175.10 174.84 1oq3 n ILE 73 N -1.85 0.61 -4.53 -0.62 2.08 -1.26 -4.06 119.36 109.73 1oq3 n ILE 73 Ca 0.01 -4.39 -0.33 0.00 0.56 0.00 0.00 62.75 58.60 1oq3 n ILE 73 Cb 0.58 -1.98 -0.13 0.00 -0.75 0.00 0.00 39.64 37.36 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 -1.13 3.55 0.00 0.38 2.02 -1.26 -5.01 118.70 117.25 1oq3 s GLU 74 Ca 0.31 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.71 1oq3 s GLU 74 Cb 0.04 -2.81 0.00 0.00 0.10 0.00 0.00 34.13 31.46 1oq3 s GLU 74 CO -0.15 0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.76 1oq3 n GLY 75 N 3.57 -0.40 0.00 -1.39 0.00 -1.26 -4.70 105.19 101.00 1oq3 n GLY 75 Ca -0.18 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1oq3 n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86