#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 -3.16 -3.99 4.03 7.94 -1.26 -5.11 117.00 115.45 1oq3 n LEU 2 Ca 0.00 -0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.80 1oq3 n LEU 2 Cb 0.00 -1.55 -0.11 0.00 0.53 0.00 0.00 43.42 42.29 1oq3 n LEU 2 CO 0.00 -0.29 -0.36 -0.44 -1.11 0.00 0.00 177.39 175.18 1oq3 s SER 3 N -2.17 0.31 -0.07 1.96 0.01 -1.26 -5.10 113.70 107.38 1oq3 s SER 3 Ca 0.00 -0.52 -0.26 0.00 1.31 0.00 0.00 55.95 56.49 1oq3 s SER 3 Cb -0.00 0.10 0.06 0.00 0.21 0.00 0.00 66.02 66.38 1oq3 s SER 3 CO 0.18 -0.30 0.59 -0.70 0.41 0.00 0.00 173.24 173.42 1oq3 s GLU 4 N -1.52 0.92 0.56 12.44 2.12 -1.26 -5.13 118.70 126.83 1oq3 s GLU 4 Ca -0.15 0.26 -0.06 0.00 0.36 0.00 0.00 54.97 55.37 1oq3 s GLU 4 Cb -0.10 0.43 -0.01 0.00 0.26 0.00 0.00 34.13 34.71 1oq3 s GLU 4 CO -0.01 -0.26 0.88 1.14 -0.54 0.00 0.00 175.26 176.47 1oq3 s GLN 5 N -0.98 3.21 0.11 4.30 -2.07 -1.26 -4.36 119.66 118.61 1oq3 s GLN 5 Ca -0.10 0.16 -0.18 0.00 -1.82 0.00 0.00 55.36 53.43 1oq3 s GLN 5 Cb -0.02 -2.28 0.04 0.00 -1.09 0.00 0.00 33.01 29.66 1oq3 s GLN 5 CO 0.07 -0.52 0.44 0.15 -1.32 0.00 0.00 175.29 174.11 1oq3 s LYS 6 N -4.93 1.07 -0.37 9.60 -0.14 -0.26 -4.98 119.74 119.72 1oq3 s LYS 6 Ca 0.52 -0.56 -0.26 0.00 -1.36 0.00 0.00 55.97 54.30 1oq3 s LYS 6 Cb -0.10 0.47 0.02 0.00 -1.68 0.00 0.00 37.83 36.54 1oq3 s LYS 6 CO 0.46 -0.41 0.93 -1.83 -0.76 0.00 0.00 175.35 173.74 1oq3 s GLU 7 N -3.41 3.83 0.15 1.68 -1.05 -1.26 -1.01 118.70 117.63 1oq3 s GLU 7 Ca 0.00 0.56 -0.06 0.00 -0.15 0.00 0.00 54.97 55.32 1oq3 s GLU 7 Cb 0.01 -3.81 -0.06 0.00 -0.44 0.00 0.00 34.13 29.83 1oq3 s GLU 7 CO -0.09 -0.96 0.41 -1.50 0.95 0.00 0.00 175.26 174.06 1oq3 s ILE 8 N 3.50 5.11 -0.04 1.83 -1.16 0.10 -4.95 121.20 125.59 1oq3 s ILE 8 Ca 0.38 0.17 -0.01 0.00 -0.51 0.00 0.00 60.65 60.68 1oq3 s ILE 8 Cb -0.12 -3.62 0.03 0.00 0.61 0.00 0.00 42.46 39.36 1oq3 s ILE 8 CO 0.19 0.05 0.03 0.00 -2.81 0.00 0.00 174.94 172.41 1oq3 s ALA 9 N -1.65 0.31 0.23 1.50 0.00 -1.26 -0.71 121.76 120.18 1oq3 s ALA 9 Ca 0.41 0.15 -0.19 0.00 0.00 0.00 0.00 51.96 52.33 1oq3 s ALA 9 Cb -0.12 -0.52 0.03 0.00 0.00 0.00 0.00 23.12 22.51 1oq3 s ALA 9 CO 0.23 -0.33 0.60 0.00 0.00 0.00 0.00 175.76 176.26 1oq3 s MET 10 N 1.71 1.54 -0.11 0.00 0.23 -0.18 -4.94 119.30 117.55 1oq3 s MET 10 Ca -0.00 -0.90 -0.06 0.00 -1.03 0.00 0.00 55.69 53.69 1oq3 s MET 10 Cb -0.13 0.56 -0.04 0.00 -1.53 0.00 0.00 34.83 33.70 1oq3 s MET 10 CO -0.03 -0.68 0.11 -0.65 -2.03 0.00 0.00 175.02 171.74 1oq3 s GLN 11 N -3.89 3.34 0.01 3.16 1.11 -1.26 -0.80 119.66 121.34 1oq3 s GLN 11 Ca 0.10 -0.19 0.08 0.00 0.01 0.00 0.00 55.36 55.36 1oq3 s GLN 11 Cb -0.03 -3.11 -0.03 0.00 -1.01 0.00 0.00 33.01 28.84 1oq3 s GLN 11 CO 0.01 0.76 -0.24 0.08 0.01 0.00 0.00 175.29 175.91 1oq3 s VAL 12 N -1.00 2.28 -0.32 1.09 1.01 -1.26 -1.26 120.40 120.93 1oq3 s VAL 12 Ca 0.15 -1.18 -0.23 0.00 0.00 0.00 0.00 61.98 60.72 1oq3 s VAL 12 Cb -0.12 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1oq3 s VAL 12 CO 0.04 0.48 0.79 -0.55 0.00 0.00 0.00 175.10 175.86 1oq3 s SER 13 N -0.94 6.64 0.00 3.32 0.15 0.10 -4.44 113.70 118.53 1oq3 s SER 13 Ca 0.11 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.35 1oq3 s SER 13 Cb -0.10 -2.41 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 1oq3 s SER 13 CO 0.01 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.41 1oq3 n GLY 14 N 4.28 0.30 1.72 9.45 0.00 -1.26 -4.05 105.19 115.64 1oq3 n GLY 14 Ca 0.04 -0.50 -0.13 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 -0.33 0.80 -4.14 1.61 3.85 -1.26 -4.56 117.12 113.09 1oq3 n MET 15 Ca 0.00 -1.77 -0.33 0.00 -1.00 0.00 0.00 57.70 54.60 1oq3 n MET 15 Cb 0.13 0.93 -0.02 0.00 -1.05 0.00 0.00 33.22 33.21 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 -0.48 -1.65 -2.71 3.17 5.66 -1.26 -4.88 114.28 112.12 1oq3 n THR 16 Ca -0.04 -0.16 -0.13 0.00 -3.05 0.00 0.00 64.05 60.67 1oq3 n THR 16 Cb 0.31 -1.99 0.02 0.00 -1.55 0.00 0.00 70.33 67.12 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 -0.09 -2.17 -2.83 0.00 0.00 -1.26 -4.54 120.51 109.62 1oq3 n ALA 18 Ca 0.16 0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.45 1oq3 n ALA 18 Cb 0.76 -0.27 0.02 0.00 0.00 0.00 0.00 19.45 19.97 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 -0.84 -0.82 0.16 0.00 0.00 -1.26 -4.94 120.51 112.80 1oq3 n ALA 19 Ca 0.01 0.25 -0.07 0.00 0.00 0.00 0.00 53.44 53.62 1oq3 n ALA 19 Cb 0.32 -3.31 -0.03 0.00 0.00 0.00 0.00 19.45 16.42 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 -1.42 1.82 0.32 0.00 0.00 -1.91 0.19 119.26 118.25 1oq3 h ALA 21 Ca -0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1oq3 h ALA 21 Cb 0.34 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1oq3 h ALA 21 CO 0.07 0.06 -0.32 0.00 0.00 0.00 0.00 179.25 179.07 1oq3 h ALA 22 N 1.65 -0.68 -0.06 0.00 0.00 -1.96 0.68 119.26 118.90 1oq3 h ALA 22 Ca 0.29 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1oq3 h ALA 22 Cb 0.34 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1oq3 h ALA 22 CO -0.09 -0.92 -0.00 0.00 0.00 0.00 0.00 179.25 178.24 1oq3 h ARG 23 N -0.67 0.02 -0.43 0.00 2.47 0.36 0.11 114.38 116.25 1oq3 h ARG 23 Ca -0.02 -0.00 0.05 0.00 -1.26 0.00 0.00 59.98 58.75 1oq3 h ARG 23 Cb 0.61 -0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.84 1oq3 h ARG 23 CO -0.06 0.01 -0.56 0.82 0.56 0.00 0.00 179.97 180.75 1oq3 h ILE 24 N 0.02 0.00 -0.18 2.04 2.04 -0.59 0.91 117.51 121.75 1oq3 h ILE 24 Ca 0.03 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.74 1oq3 h ILE 24 Cb 0.03 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 1oq3 h ILE 24 CO -0.05 0.00 -0.52 -0.08 0.00 0.00 0.00 178.15 177.50 1oq3 h GLU 25 N -0.38 0.52 -0.13 2.37 4.57 -0.72 -1.70 114.58 119.12 1oq3 h GLU 25 Ca 0.08 -0.31 0.02 0.00 -1.18 0.00 0.00 59.36 57.97 1oq3 h GLU 25 Cb 0.59 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.21 1oq3 h GLU 25 CO -0.61 0.91 0.09 0.87 -1.18 0.00 0.00 179.01 179.09 1oq3 h LYS 26 N 0.41 0.06 -0.04 1.92 1.79 -0.21 0.32 116.57 120.82 1oq3 h LYS 26 Ca 0.01 -0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.51 1oq3 h LYS 26 Cb 1.05 -0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.65 1oq3 h LYS 26 CO 0.10 0.04 -0.16 0.78 -1.08 0.00 0.00 179.45 179.12 1oq3 h GLY 27 N 0.06 -0.18 2.00 3.86 0.00 0.11 -2.81 103.07 106.11 1oq3 h GLY 27 Ca 0.06 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.55 1oq3 h GLY 27 CO -0.01 -0.16 -0.15 1.41 0.00 0.00 0.00 176.54 177.64 1oq3 h LEU 28 N -0.25 0.00 -1.98 3.11 3.38 -0.30 -0.13 115.31 119.14 1oq3 h LEU 28 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1oq3 h LEU 28 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1oq3 h LEU 28 CO -0.18 0.15 0.25 0.50 0.09 0.00 0.00 178.44 179.25 1oq3 h LYS 29 N 0.00 0.00 0.00 1.13 1.63 -0.38 0.17 116.57 119.12 1oq3 h LYS 29 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1oq3 h LYS 29 Cb 0.27 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.90 1oq3 h LYS 29 CO 0.02 0.00 -0.32 0.00 -3.45 0.00 0.00 179.45 175.70 1oq3 h ARG 30 N 0.00 0.00 -6.71 1.90 -0.00 -1.00 -3.47 114.38 105.10 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 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.47 1oq3 h ARG 30 CO 0.00 0.00 0.43 -1.64 0.00 0.00 0.00 179.97 178.76 1oq3 s MET 31 N -3.14 4.69 -0.54 0.04 -1.94 0.61 -4.94 119.30 114.08 1oq3 s MET 31 Ca 0.08 1.65 -0.27 0.00 -1.71 0.00 0.00 55.69 55.45 1oq3 s MET 31 Cb 0.13 -3.27 -0.03 0.00 2.01 0.00 0.00 34.83 33.66 1oq3 s MET 31 CO 0.66 0.24 2.02 -1.25 -0.01 0.00 0.00 175.02 176.68 1oq3 s PRO 32 N -0.81 2.55 0.00 2.03 0.04 -1.26 -1.85 135.00 135.70 1oq3 s PRO 32 Ca 0.46 0.94 0.00 0.00 0.04 0.00 0.00 61.00 62.43 1oq3 s PRO 32 Cb -0.28 -4.43 0.00 0.00 0.04 0.00 0.00 34.50 29.83 1oq3 s PRO 32 CO 0.35 -2.80 0.00 0.41 0.04 0.00 0.00 177.00 175.00 1oq3 n GLY 33 N 5.76 1.07 3.75 0.56 0.00 -1.26 -3.82 105.19 111.26 1oq3 n GLY 33 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.76 2.46 -0.03 1.61 0.11 -0.77 -0.24 120.40 122.79 1oq3 s VAL 34 Ca 0.00 0.33 -0.08 0.00 -2.93 0.00 0.00 61.98 59.30 1oq3 s VAL 34 Cb 0.00 -3.16 -0.03 0.00 -1.53 0.00 0.00 36.38 31.67 1oq3 s VAL 34 CO 0.00 -0.02 -0.16 0.41 -3.33 0.00 0.00 175.10 172.00 1oq3 n THR 35 N -1.09 1.30 -3.65 5.04 -1.04 0.47 -4.88 114.28 110.42 1oq3 n THR 35 Ca 0.11 0.28 -0.15 0.00 -2.04 0.00 0.00 64.05 62.25 1oq3 n THR 35 Cb 0.47 -1.91 -0.08 0.00 -1.82 0.00 0.00 70.33 66.99 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 -5.90 -0.42 -0.03 8.00 2.15 -0.95 -4.99 116.67 114.52 1oq3 s ASP 36 Ca -0.13 0.45 0.02 0.00 0.43 0.00 0.00 52.55 53.32 1oq3 s ASP 36 Cb 0.02 0.49 -0.03 0.00 -0.30 0.00 0.00 42.92 43.10 1oq3 s ASP 36 CO 0.19 -0.49 -0.06 0.00 -0.17 0.00 0.00 175.17 174.65 1oq3 s ALA 37 N -1.09 3.03 -0.27 3.66 0.00 -1.26 -0.28 121.76 125.55 1oq3 s ALA 37 Ca -0.11 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.88 1oq3 s ALA 37 Cb -0.03 -1.20 0.12 0.00 0.00 0.00 0.00 23.12 22.01 1oq3 s ALA 37 CO 0.06 0.60 0.25 -0.80 0.00 0.00 0.00 175.76 175.87 1oq3 s ASN 38 N -1.14 1.96 0.05 0.00 -0.87 0.82 -4.99 114.94 110.77 1oq3 s ASN 38 Ca 0.15 -0.73 -0.26 0.00 -1.57 0.00 0.00 52.86 50.45 1oq3 s ASN 38 Cb -0.11 0.32 -0.05 0.00 -0.02 0.00 0.00 41.25 41.38 1oq3 s ASN 38 CO 0.05 -0.38 0.81 0.54 -2.57 0.00 0.00 177.10 175.54 1oq3 s VAL 39 N 2.30 4.70 -0.50 1.60 0.11 -1.26 -0.50 120.40 126.85 1oq3 s VAL 39 Ca 0.09 1.72 0.07 0.00 -2.93 0.00 0.00 61.98 60.93 1oq3 s VAL 39 Cb -0.15 -4.16 0.25 0.00 -1.53 0.00 0.00 36.38 30.80 1oq3 s VAL 39 CO -0.29 0.35 0.62 0.59 -3.33 0.00 0.00 175.10 173.04 1oq3 n ASN 40 N 2.86 1.76 0.27 3.54 3.02 -0.01 -4.93 115.26 121.77 1oq3 n ASN 40 Ca -0.01 -3.02 0.13 0.00 -0.03 0.00 0.00 54.58 51.65 1oq3 n ASN 40 Cb 0.50 -0.65 0.77 0.00 -0.61 0.00 0.00 39.78 39.79 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 4.09 0.00 -2.18 3.41 3.38 -1.95 0.67 115.31 122.74 1oq3 h LEU 41 Ca 0.13 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1oq3 h LEU 41 Cb 0.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1oq3 h LEU 41 CO 0.63 0.09 0.27 0.00 0.09 0.00 0.00 178.44 179.53 1oq3 h ALA 42 N 1.91 1.74 -0.04 1.53 0.00 -1.91 -0.44 119.26 122.04 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 0.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1oq3 h ALA 42 CO 0.01 -0.38 0.00 2.41 0.00 0.00 0.00 179.25 181.30 1oq3 n THR 43 N -3.56 1.13 -4.08 0.00 -1.04 0.16 -5.01 114.28 101.88 1oq3 n THR 43 Ca 0.02 -1.18 -0.29 0.00 -2.04 0.00 0.00 64.05 60.57 1oq3 n THR 43 Cb 0.39 0.39 -0.04 0.00 -1.82 0.00 0.00 70.33 69.26 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 -0.52 -2.82 -3.58 -2.82 1.02 -0.18 -4.94 120.64 106.81 1oq3 n GLU 44 Ca 0.03 0.34 -0.11 0.00 -0.02 0.00 0.00 57.16 57.40 1oq3 n GLU 44 Cb 0.33 -4.47 -0.04 0.00 -0.02 0.00 0.00 31.44 27.23 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 -3.90 0.05 0.06 2.62 2.01 -0.98 -4.34 115.64 111.15 1oq3 s THR 45 Ca 0.16 -0.39 0.07 0.00 0.31 0.00 0.00 61.69 61.84 1oq3 s THR 45 Cb -0.09 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1oq3 s THR 45 CO 0.92 -0.22 -0.20 0.54 -0.69 0.00 0.00 174.62 174.98 1oq3 s VAL 46 N -3.54 1.59 -0.01 3.82 0.11 0.02 -0.83 120.40 121.57 1oq3 s VAL 46 Ca 0.01 -1.30 0.07 0.00 -2.93 0.00 0.00 61.98 57.83 1oq3 s VAL 46 Cb 0.01 -1.42 -0.03 0.00 -1.53 0.00 0.00 36.38 33.41 1oq3 s VAL 46 CO -0.10 0.07 -0.21 0.21 -3.33 0.00 0.00 175.10 171.74 1oq3 s ASN 47 N -1.44 3.51 -0.06 3.54 2.47 0.34 -1.01 114.94 122.29 1oq3 s ASN 47 Ca 0.06 -0.39 -0.03 0.00 0.42 0.00 0.00 52.86 52.92 1oq3 s ASN 47 Cb -0.09 -0.54 0.03 0.00 -1.45 0.00 0.00 41.25 39.20 1oq3 s ASN 47 CO 0.03 0.31 0.13 0.54 -3.72 0.00 0.00 177.10 174.38 1oq3 s VAL 48 N -0.73 -0.04 -0.17 -5.21 0.11 0.12 -0.13 120.40 114.35 1oq3 s VAL 48 Ca 0.12 0.14 -0.18 0.00 -2.93 0.00 0.00 61.98 59.13 1oq3 s VAL 48 Cb -0.10 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.50 1oq3 s VAL 48 CO 0.01 0.06 0.50 -0.63 -3.33 0.00 0.00 175.10 171.71 1oq3 s ILE 49 N 0.92 5.14 0.28 7.04 1.01 0.62 -0.72 121.20 135.49 1oq3 s ILE 49 Ca -0.07 0.94 -0.05 0.00 0.00 0.00 0.00 60.65 61.47 1oq3 s ILE 49 Cb -0.09 -3.83 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1oq3 s ILE 49 CO -0.04 0.23 0.40 -0.72 0.00 0.00 0.00 174.94 174.81 1oq3 s TYR 50 N 1.28 0.86 -0.23 3.97 -0.85 -0.18 -0.40 117.35 121.81 1oq3 s TYR 50 Ca 0.24 -1.13 -0.05 0.00 -0.52 0.00 0.00 57.07 55.62 1oq3 s TYR 50 Cb -0.15 -0.10 -0.01 0.00 0.38 0.00 0.00 41.96 42.07 1oq3 s TYR 50 CO 0.10 -0.98 -0.01 0.34 -1.52 0.00 0.00 175.55 173.47 1oq3 s ASP 51 N -3.15 4.51 0.00 -0.18 -1.08 0.67 -1.10 116.67 116.34 1oq3 s ASP 51 Ca 0.30 -0.34 0.04 0.00 -0.52 0.00 0.00 52.55 52.02 1oq3 s ASP 51 Cb 0.01 -1.79 0.24 0.00 -1.46 0.00 0.00 42.92 39.93 1oq3 s ASP 51 CO 0.15 -0.02 0.69 -0.81 0.52 0.00 0.00 175.17 175.70 1oq3 n PRO 52 N 4.83 0.47 0.12 4.34 -0.04 -1.11 -0.32 135.00 143.28 1oq3 n PRO 52 Ca -0.18 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.09 1oq3 n PRO 52 Cb 0.51 -1.14 -0.14 0.00 -0.04 0.00 0.00 33.50 32.70 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 2.20 0.01 0.00 0.55 0.00 -1.94 -3.42 119.26 116.67 1oq3 h ALA 53 Ca 0.00 -0.85 -0.07 0.00 0.00 0.00 0.00 54.91 53.98 1oq3 h ALA 53 Cb 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1oq3 h ALA 53 CO 0.00 0.84 -0.96 0.39 0.00 0.00 0.00 179.25 179.51 1oq3 n GLU 54 N -3.64 0.15 -4.05 0.00 1.02 -1.00 -5.07 120.64 108.04 1oq3 n GLU 54 Ca -0.12 0.06 -0.34 0.00 -0.02 0.00 0.00 57.16 56.74 1oq3 n GLU 54 Cb 1.04 -0.75 -0.10 0.00 -0.02 0.00 0.00 31.44 31.61 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 -2.17 4.68 0.13 2.62 2.01 0.57 -4.95 115.64 118.53 1oq3 s THR 55 Ca -0.09 -0.07 -0.02 0.00 0.31 0.00 0.00 61.69 61.81 1oq3 s THR 55 Cb 0.03 -3.10 0.01 0.00 0.01 0.00 0.00 72.50 69.44 1oq3 s THR 55 CO 0.12 0.47 0.21 0.61 -0.69 0.00 0.00 174.62 175.34 1oq3 n GLY 56 N 3.52 2.32 0.25 4.40 0.00 -1.26 -2.75 105.19 111.66 1oq3 n GLY 56 Ca -0.17 -1.31 0.22 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.19 -0.32 -0.09 2.61 5.66 -1.26 -0.45 114.28 120.23 1oq3 n THR 57 Ca -0.01 1.57 -0.11 0.00 -3.05 0.00 0.00 64.05 62.45 1oq3 n THR 57 Cb 0.20 -2.50 -0.06 0.00 -1.55 0.00 0.00 70.33 66.43 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 1.52 -0.51 -0.13 1.79 0.00 -2.00 0.16 119.26 120.10 1oq3 h ALA 58 Ca 0.62 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 55.36 1oq3 h ALA 58 Cb 1.58 0.89 0.00 0.00 0.00 0.00 0.00 17.79 20.26 1oq3 h ALA 58 CO -0.61 -0.90 -0.73 0.00 0.00 0.00 0.00 179.25 177.01 1oq3 h ALA 59 N 0.29 0.47 0.74 0.00 0.00 -1.13 -3.21 119.26 116.41 1oq3 h ALA 59 Ca 0.11 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1oq3 h ALA 59 Cb 0.60 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.35 1oq3 h ALA 59 CO -0.53 0.72 -0.35 0.82 0.00 0.00 0.00 179.25 179.91 1oq3 h ILE 60 N 0.42 0.21 -0.64 0.00 2.04 -0.90 -1.97 117.51 116.67 1oq3 h ILE 60 Ca -0.04 -0.13 0.13 0.00 1.00 0.00 0.00 64.86 65.82 1oq3 h ILE 60 Cb 1.33 0.24 -0.12 0.00 -0.74 0.00 0.00 36.82 37.53 1oq3 h ILE 60 CO 0.14 0.01 -0.21 1.56 0.00 0.00 0.00 178.15 179.65 1oq3 h GLN 61 N -1.09 -0.05 -0.68 2.37 7.50 -0.81 0.24 115.11 122.58 1oq3 h GLN 61 Ca -0.10 0.00 0.13 0.00 0.50 0.00 0.00 58.65 59.18 1oq3 h GLN 61 Cb 0.78 0.01 -0.13 0.00 0.05 0.00 0.00 27.48 28.19 1oq3 h GLN 61 CO 0.17 -0.03 -0.25 1.49 -1.50 0.00 0.00 178.83 178.70 1oq3 h GLU 62 N -0.05 -0.06 -0.20 1.46 4.22 -1.50 0.13 114.58 118.58 1oq3 h GLU 62 Ca 0.30 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.62 1oq3 h GLU 62 Cb 0.51 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1oq3 h GLU 62 CO -0.68 -0.04 -0.33 0.87 -2.18 0.00 0.00 179.01 176.65 1oq3 h LYS 63 N -0.07 0.57 -0.65 1.92 6.56 -0.35 -3.12 116.57 121.43 1oq3 h LYS 63 Ca 0.30 -0.35 0.11 0.00 -1.06 0.00 0.00 60.65 59.66 1oq3 h LYS 63 Cb 0.54 0.04 -0.08 0.00 -0.57 0.00 0.00 32.23 32.16 1oq3 h LYS 63 CO -0.73 0.96 0.21 0.82 -2.06 0.00 0.00 179.45 178.65 1oq3 h ILE 64 N 0.24 0.69 -0.67 1.86 1.08 0.56 0.40 117.51 121.68 1oq3 h ILE 64 Ca 0.01 -0.12 0.14 0.00 -0.39 0.00 0.00 64.86 64.50 1oq3 h ILE 64 Cb 0.92 0.29 -0.11 0.00 -3.07 0.00 0.00 36.82 34.86 1oq3 h ILE 64 CO 0.08 0.07 0.09 -0.33 -0.69 0.00 0.00 178.15 177.36 1oq3 h GLU 65 N 0.36 0.19 -0.23 2.37 4.39 -0.59 -1.82 114.58 119.25 1oq3 h GLU 65 Ca 0.34 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.88 1oq3 h GLU 65 Cb 0.48 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1oq3 h GLU 65 CO -0.37 0.12 -0.47 -0.22 -1.16 0.00 0.00 179.01 176.91 1oq3 h LYS 66 N 0.19 0.61 -0.15 2.33 1.63 -0.31 -1.03 116.57 119.84 1oq3 h LYS 66 Ca 0.36 -0.35 0.04 0.00 -0.85 0.00 0.00 60.65 59.86 1oq3 h LYS 66 Cb 0.60 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.25 1oq3 h LYS 66 CO -0.51 0.95 0.31 -0.07 -3.45 0.00 0.00 179.45 176.68 1oq3 h LEU 67 N 0.48 0.00 0.00 5.20 -0.00 0.21 -3.45 115.31 117.76 1oq3 h LEU 67 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 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 0.09 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.14 1oq3 n GLY 68 N -1.32 1.88 3.34 0.83 0.00 -0.39 -5.01 105.19 104.52 1oq3 n GLY 68 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 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 0.80 -0.06 1.61 2.02 -1.02 -5.03 117.35 113.67 1oq3 s TYR 69 Ca 0.00 -1.09 0.06 0.00 -0.37 0.00 0.00 57.07 55.66 1oq3 s TYR 69 Cb 0.00 -0.26 -0.01 0.00 -0.40 0.00 0.00 41.96 41.29 1oq3 s TYR 69 CO 0.00 -0.75 -0.23 -3.38 -1.57 0.00 0.00 175.55 169.61 1oq3 s HIS 70 N -4.09 2.48 0.05 2.71 -3.43 -1.26 -2.75 115.29 109.01 1oq3 s HIS 70 Ca 0.30 -0.66 -0.03 0.00 -0.80 0.00 0.00 55.06 53.87 1oq3 s HIS 70 Cb 0.04 -1.61 -0.05 0.00 -1.43 0.00 0.00 32.58 29.53 1oq3 s HIS 70 CO 0.09 -0.18 0.26 0.54 -2.00 0.00 0.00 174.74 173.45 1oq3 s VAL 71 N -0.20 5.33 0.26 -5.38 0.11 -1.26 -0.72 120.40 118.54 1oq3 s VAL 71 Ca -0.02 -0.10 0.06 0.00 -2.93 0.00 0.00 61.98 58.99 1oq3 s VAL 71 Cb -0.13 -3.59 -0.03 0.00 -1.53 0.00 0.00 36.38 31.09 1oq3 s VAL 71 CO 0.03 0.22 0.33 0.68 -3.33 0.00 0.00 175.10 173.04 1oq3 s VAL 72 N -1.44 4.84 -0.69 2.04 -7.23 -0.39 -4.97 120.40 112.57 1oq3 s VAL 72 Ca 0.33 -1.10 0.05 0.00 -1.81 0.00 0.00 61.98 59.44 1oq3 s VAL 72 Cb -0.13 -3.67 0.17 0.00 0.56 0.00 0.00 36.38 33.32 1oq3 s VAL 72 CO 0.22 -0.30 0.49 -0.38 -0.31 0.00 0.00 175.10 174.82 1oq3 n ILE 73 N -1.39 1.48 -3.65 -0.62 2.08 -1.26 -4.01 119.36 111.99 1oq3 n ILE 73 Ca -0.07 -4.79 -0.37 0.00 0.56 0.00 0.00 62.75 58.07 1oq3 n ILE 73 Cb 0.57 -2.15 -0.11 0.00 -0.75 0.00 0.00 39.64 37.20 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 -1.40 3.85 0.00 0.38 2.12 -1.26 -4.74 118.70 117.64 1oq3 s GLU 74 Ca 0.26 -0.37 0.00 0.00 0.36 0.00 0.00 54.97 55.21 1oq3 s GLU 74 Cb -0.03 -3.54 0.00 0.00 0.26 0.00 0.00 34.13 30.82 1oq3 s GLU 74 CO -0.17 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 174.79 1oq3 n GLY 75 N 4.98 0.24 0.85 -1.50 0.00 -1.26 -4.89 105.19 103.62 1oq3 n GLY 75 Ca -0.15 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1oq3 n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19