#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 2.60 -0.39 3.17 1.43 -1.26 -5.11 118.68 119.12 1oq3 s LEU 2 Ca 0.00 -1.47 0.08 0.00 -1.03 0.00 0.00 54.13 51.71 1oq3 s LEU 2 Cb 0.00 -0.77 0.24 0.00 0.03 0.00 0.00 46.19 45.69 1oq3 s LEU 2 CO 0.00 -0.60 0.51 -1.54 0.23 0.00 0.00 176.35 174.94 1oq3 n SER 3 N -1.05 0.12 -3.81 2.29 3.41 -1.26 -4.88 113.62 108.44 1oq3 n SER 3 Ca -0.09 -2.66 -0.23 0.00 -0.26 0.00 0.00 58.87 55.63 1oq3 n SER 3 Cb 0.67 -0.63 -0.17 0.00 -0.26 0.00 0.00 64.21 63.81 1oq3 n SER 3 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1oq3 s GLU 4 N -1.08 0.79 0.67 4.33 -1.05 -1.26 -5.14 118.70 115.96 1oq3 s GLU 4 Ca 0.35 0.01 -0.07 0.00 -0.15 0.00 0.00 54.97 55.11 1oq3 s GLU 4 Cb 0.16 -1.04 0.04 0.00 -0.44 0.00 0.00 34.13 32.84 1oq3 s GLU 4 CO -0.12 -0.26 0.99 1.14 0.95 0.00 0.00 175.26 177.97 1oq3 s GLN 5 N 1.74 2.55 0.03 -4.83 -2.07 -1.26 -4.52 119.66 111.29 1oq3 s GLN 5 Ca 0.02 -0.03 -0.00 0.00 -1.82 0.00 0.00 55.36 53.53 1oq3 s GLN 5 Cb -0.13 -2.17 -0.03 0.00 -1.09 0.00 0.00 33.01 29.60 1oq3 s GLN 5 CO -0.05 -1.03 -0.03 0.15 -1.32 0.00 0.00 175.29 173.01 1oq3 s LYS 6 N -5.19 0.41 -0.17 9.60 -0.14 -0.27 -5.00 119.74 118.99 1oq3 s LYS 6 Ca 0.58 -0.79 -0.20 0.00 -1.36 0.00 0.00 55.97 54.20 1oq3 s LYS 6 Cb -0.11 0.11 -0.03 0.00 -1.68 0.00 0.00 37.83 36.12 1oq3 s LYS 6 CO 0.46 -0.06 0.57 -1.83 -0.76 0.00 0.00 175.35 173.73 1oq3 s GLU 7 N -2.16 4.26 0.11 1.68 -1.05 -1.26 -1.30 118.70 118.97 1oq3 s GLU 7 Ca -0.09 0.54 0.05 0.00 -0.15 0.00 0.00 54.97 55.32 1oq3 s GLU 7 Cb -0.05 -3.53 -0.04 0.00 -0.44 0.00 0.00 34.13 30.08 1oq3 s GLU 7 CO -0.03 -0.08 0.00 -1.50 0.95 0.00 0.00 175.26 174.60 1oq3 s ILE 8 N 1.40 3.95 -0.02 1.83 1.10 0.12 -4.99 121.20 124.59 1oq3 s ILE 8 Ca 0.27 -1.10 0.01 0.00 -0.51 0.00 0.00 60.65 59.32 1oq3 s ILE 8 Cb -0.16 -2.91 0.01 0.00 0.15 0.00 0.00 42.46 39.55 1oq3 s ILE 8 CO 0.11 0.06 -0.03 0.00 -2.11 0.00 0.00 174.94 172.97 1oq3 s ALA 9 N -1.42 0.42 0.28 1.50 0.00 -1.26 -0.87 121.76 120.40 1oq3 s ALA 9 Ca 0.26 -0.02 -0.17 0.00 0.00 0.00 0.00 51.96 52.03 1oq3 s ALA 9 Cb -0.11 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1oq3 s ALA 9 CO 0.18 0.01 0.63 0.00 0.00 0.00 0.00 175.76 176.59 1oq3 s MET 10 N 0.54 1.74 0.25 0.00 0.23 -0.36 -4.87 119.30 116.82 1oq3 s MET 10 Ca -0.06 -1.14 -0.06 0.00 -1.03 0.00 0.00 55.69 53.40 1oq3 s MET 10 Cb -0.09 0.56 -0.06 0.00 -1.53 0.00 0.00 34.83 33.71 1oq3 s MET 10 CO -0.01 -0.77 0.52 -0.65 -2.03 0.00 0.00 175.02 172.08 1oq3 s GLN 11 N -3.81 3.67 0.43 3.16 1.11 -1.26 -0.80 119.66 122.16 1oq3 s GLN 11 Ca 0.16 0.04 0.06 0.00 0.01 0.00 0.00 55.36 55.63 1oq3 s GLN 11 Cb -0.04 -2.69 -0.05 0.00 -1.01 0.00 0.00 33.01 29.23 1oq3 s GLN 11 CO 0.08 0.29 0.14 0.08 0.01 0.00 0.00 175.29 175.89 1oq3 s VAL 12 N -1.94 2.07 -0.05 1.09 1.01 -1.11 -0.88 120.40 120.59 1oq3 s VAL 12 Ca 0.44 -1.78 0.02 0.00 0.00 0.00 0.00 61.98 60.66 1oq3 s VAL 12 Cb -0.11 -2.84 0.01 0.00 0.00 0.00 0.00 36.38 33.44 1oq3 s VAL 12 CO 0.27 0.00 -0.10 -0.55 0.00 0.00 0.00 175.10 174.72 1oq3 s SER 13 N -3.89 1.50 0.00 3.32 0.15 0.15 -4.88 113.70 110.05 1oq3 s SER 13 Ca 0.35 -0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.76 1oq3 s SER 13 Cb 0.05 -0.61 0.00 0.00 -1.71 0.00 0.00 66.02 63.75 1oq3 s SER 13 CO 0.19 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.28 1oq3 n GLY 14 N 3.67 1.16 3.32 9.45 0.00 -1.26 -3.85 105.19 117.69 1oq3 n GLY 14 Ca -0.22 -0.42 -0.47 0.00 0.00 0.00 0.00 46.02 44.91 1oq3 n GLY 14 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1oq3 s MET 15 N -2.48 3.50 0.00 1.61 0.23 -1.26 -4.94 119.30 115.97 1oq3 s MET 15 Ca 0.00 -2.36 -0.03 0.00 -1.03 0.00 0.00 55.69 52.27 1oq3 s MET 15 Cb 0.00 -4.40 -0.14 0.00 -1.53 0.00 0.00 34.83 28.76 1oq3 s MET 15 CO 0.00 -1.29 2.81 2.41 -2.03 0.00 0.00 175.02 176.92 1oq3 n THR 16 N 4.14 2.48 -0.00 3.16 -1.04 -1.26 -4.89 114.28 116.86 1oq3 n THR 16 Ca 0.10 -1.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.10 1oq3 n THR 16 Cb 0.46 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 1oq3 n THR 16 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1oq3 n ALA 18 N 8.81 -1.72 -1.46 0.00 0.00 -1.26 -0.10 120.51 124.79 1oq3 n ALA 18 Ca 0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 53.44 52.94 1oq3 n ALA 18 Cb 0.00 -1.30 -0.07 0.00 0.00 0.00 0.00 19.45 18.08 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 -4.31 -0.24 0.20 0.00 0.00 -1.26 -4.90 120.51 109.99 1oq3 n ALA 19 Ca -0.18 0.26 -0.09 0.00 0.00 0.00 0.00 53.44 53.43 1oq3 n ALA 19 Cb 0.60 -1.85 -0.04 0.00 0.00 0.00 0.00 19.45 18.16 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 -1.23 1.16 -0.19 0.00 0.00 -1.91 0.11 119.26 117.21 1oq3 h ALA 21 Ca -0.06 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1oq3 h ALA 21 Cb 0.43 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1oq3 h ALA 21 CO 0.09 -0.20 -0.09 0.00 0.00 0.00 0.00 179.25 179.05 1oq3 h ALA 22 N 1.57 0.07 -0.62 0.00 0.00 -1.91 -0.85 119.26 117.53 1oq3 h ALA 22 Ca 0.44 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.52 1oq3 h ALA 22 Cb 0.69 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 1oq3 h ALA 22 CO -0.41 -0.52 0.27 0.00 0.00 0.00 0.00 179.25 178.59 1oq3 h ARG 23 N -0.07 0.46 0.24 0.00 2.47 0.11 0.12 114.38 117.71 1oq3 h ARG 23 Ca 0.10 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1oq3 h ARG 23 Cb 0.22 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.40 1oq3 h ARG 23 CO -0.24 0.31 -0.48 0.82 0.56 0.00 0.00 179.97 180.94 1oq3 h ILE 24 N 0.48 0.00 -0.16 2.04 2.04 -0.14 -0.77 117.51 121.01 1oq3 h ILE 24 Ca 0.30 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 66.04 1oq3 h ILE 24 Cb 0.33 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1oq3 h ILE 24 CO -0.27 0.00 -0.44 -0.08 0.00 0.00 0.00 178.15 177.36 1oq3 h GLU 25 N -0.78 0.38 -0.80 2.37 4.57 -0.88 0.03 114.58 119.46 1oq3 h GLU 25 Ca -0.02 -0.20 0.09 0.00 -1.18 0.00 0.00 59.36 58.05 1oq3 h GLU 25 Cb 0.74 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.28 1oq3 h GLU 25 CO -0.19 0.75 0.52 0.87 -1.18 0.00 0.00 179.01 179.78 1oq3 h LYS 26 N 0.31 0.73 -0.63 1.92 1.79 -0.64 0.24 116.57 120.29 1oq3 h LYS 26 Ca 0.02 -0.04 0.06 0.00 -2.18 0.00 0.00 60.65 58.51 1oq3 h LYS 26 Cb 0.90 -0.16 -0.05 0.00 -1.58 0.00 0.00 32.23 31.33 1oq3 h LYS 26 CO 0.07 0.48 0.34 0.78 -1.08 0.00 0.00 179.45 180.04 1oq3 h GLY 27 N 0.75 0.92 1.94 3.86 0.00 0.55 -1.96 103.07 109.13 1oq3 h GLY 27 Ca 0.37 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.41 1oq3 h GLY 27 CO -0.14 0.13 -0.26 1.41 0.00 0.00 0.00 176.54 177.68 1oq3 h LEU 28 N 0.62 0.07 -2.10 3.11 3.38 -0.32 -0.47 115.31 119.60 1oq3 h LEU 28 Ca 0.29 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1oq3 h LEU 28 Cb 0.20 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1oq3 h LEU 28 CO -0.19 0.33 0.16 0.50 0.09 0.00 0.00 178.44 179.33 1oq3 h LYS 29 N 0.07 0.00 -0.01 1.13 3.64 -0.06 0.12 116.57 121.46 1oq3 h LYS 29 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1oq3 h LYS 29 Cb 0.50 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1oq3 h LYS 29 CO 0.04 0.00 -0.21 0.54 -2.27 0.00 0.00 179.45 177.55 1oq3 n ARG 30 N -2.73 0.72 -2.89 1.90 1.74 -0.19 -4.90 116.66 110.31 1oq3 n ARG 30 Ca -0.02 -0.36 -0.40 0.00 -0.77 0.00 0.00 57.85 56.30 1oq3 n ARG 30 Cb 0.20 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.10 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 -2.53 4.61 -0.59 5.56 -1.94 0.43 -4.98 119.30 119.86 1oq3 s MET 31 Ca 0.25 1.24 -0.27 0.00 -1.71 0.00 0.00 55.69 55.21 1oq3 s MET 31 Cb 0.19 -3.33 -0.02 0.00 2.01 0.00 0.00 34.83 33.68 1oq3 s MET 31 CO 0.51 0.37 1.85 -1.25 -0.01 0.00 0.00 175.02 176.49 1oq3 s PRO 32 N -0.46 2.68 0.00 2.03 0.04 -1.26 -2.50 135.00 135.53 1oq3 s PRO 32 Ca 0.40 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.10 1oq3 s PRO 32 Cb -0.23 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 29.94 1oq3 s PRO 32 CO 0.27 -2.67 0.00 0.41 0.04 0.00 0.00 177.00 175.05 1oq3 n GLY 33 N 5.67 0.79 3.76 0.56 0.00 -1.26 -4.46 105.19 110.26 1oq3 n GLY 33 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.26 2.98 0.00 1.61 0.11 -1.04 -0.58 120.40 123.22 1oq3 s VAL 34 Ca 0.00 0.52 -0.06 0.00 -2.93 0.00 0.00 61.98 59.51 1oq3 s VAL 34 Cb 0.00 -3.09 -0.02 0.00 -1.53 0.00 0.00 36.38 31.74 1oq3 s VAL 34 CO 0.00 -0.22 -0.11 0.41 -3.33 0.00 0.00 175.10 171.84 1oq3 n THR 35 N -2.08 1.26 -3.77 5.04 -1.04 0.30 -4.91 114.28 109.08 1oq3 n THR 35 Ca 0.12 0.31 -0.13 0.00 -2.04 0.00 0.00 64.05 62.31 1oq3 n THR 35 Cb 0.51 -1.82 -0.11 0.00 -1.82 0.00 0.00 70.33 67.10 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 -5.90 -0.30 -0.06 8.00 1.01 -1.16 -5.00 116.67 113.27 1oq3 s ASP 36 Ca -0.09 0.53 0.05 0.00 0.71 0.00 0.00 52.55 53.75 1oq3 s ASP 36 Cb 0.01 0.58 -0.02 0.00 1.01 0.00 0.00 42.92 44.51 1oq3 s ASP 36 CO 0.14 -0.16 -0.21 0.00 0.21 0.00 0.00 175.17 175.15 1oq3 s ALA 37 N -0.08 2.36 -0.20 5.23 0.00 -1.26 -0.18 121.76 127.64 1oq3 s ALA 37 Ca -0.02 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 50.87 1oq3 s ALA 37 Cb -0.03 -0.80 0.08 0.00 0.00 0.00 0.00 23.12 22.37 1oq3 s ALA 37 CO 0.01 0.45 0.15 -0.80 0.00 0.00 0.00 175.76 175.57 1oq3 s ASN 38 N -0.33 2.07 0.11 0.00 0.01 0.47 -5.00 114.94 112.28 1oq3 s ASN 38 Ca 0.02 -0.53 -0.16 0.00 -0.71 0.00 0.00 52.86 51.47 1oq3 s ASN 38 Cb -0.13 -0.01 -0.07 0.00 0.41 0.00 0.00 41.25 41.46 1oq3 s ASN 38 CO 0.02 -0.35 0.55 0.54 -1.51 0.00 0.00 177.10 176.36 1oq3 s VAL 39 N 2.21 4.81 -0.42 1.60 0.11 -1.26 -0.62 120.40 126.83 1oq3 s VAL 39 Ca 0.05 1.00 0.08 0.00 -2.93 0.00 0.00 61.98 60.17 1oq3 s VAL 39 Cb -0.16 -3.80 0.26 0.00 -1.53 0.00 0.00 36.38 31.15 1oq3 s VAL 39 CO -0.13 0.38 0.57 -3.20 -3.33 0.00 0.00 175.10 169.39 1oq3 n ASN 40 N 1.22 0.65 0.15 3.54 5.15 0.99 -4.94 115.26 122.01 1oq3 n ASN 40 Ca -0.08 -2.81 0.12 0.00 -0.60 0.00 0.00 54.58 51.21 1oq3 n ASN 40 Cb 0.51 -0.64 0.54 0.00 -0.53 0.00 0.00 39.78 39.66 1oq3 n ASN 40 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1oq3 n LEU 41 N 1.23 0.66 0.11 1.20 4.77 -1.24 -0.82 117.00 122.92 1oq3 n LEU 41 Ca 0.22 0.71 0.07 0.00 -0.03 0.00 0.00 56.01 56.98 1oq3 n LEU 41 Cb 0.53 -0.67 0.38 0.00 -2.33 0.00 0.00 43.42 41.33 1oq3 n LEU 41 CO 0.21 -0.71 0.73 0.00 -1.33 0.00 0.00 177.39 176.29 1oq3 n ALA 42 N -1.79 0.95 -1.77 -1.18 0.00 -1.26 -1.80 120.51 113.66 1oq3 n ALA 42 Ca 0.01 0.13 0.01 0.00 0.00 0.00 0.00 53.44 53.59 1oq3 n ALA 42 Cb 0.17 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.50 1oq3 n ALA 42 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1oq3 n THR 43 N -1.99 0.14 -2.56 0.00 -1.04 0.00 -5.01 114.28 103.83 1oq3 n THR 43 Ca -0.01 -0.17 -0.14 0.00 -2.04 0.00 0.00 64.05 61.69 1oq3 n THR 43 Cb 0.07 0.52 -0.00 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 -0.11 -2.43 -4.22 -2.82 4.71 -0.75 -4.92 120.64 110.10 1oq3 n GLU 44 Ca 0.01 0.60 -0.18 0.00 -0.01 0.00 0.00 57.16 57.58 1oq3 n GLU 44 Cb 0.66 -5.22 -0.11 0.00 -1.01 0.00 0.00 31.44 25.76 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 -2.67 1.28 0.02 2.62 2.01 -0.63 -2.74 115.64 115.53 1oq3 s THR 45 Ca 0.05 -1.61 0.02 0.00 0.31 0.00 0.00 61.69 60.46 1oq3 s THR 45 Cb -0.03 -1.42 -0.01 0.00 0.01 0.00 0.00 72.50 71.05 1oq3 s THR 45 CO 0.06 -0.36 -0.07 0.54 -0.69 0.00 0.00 174.62 174.10 1oq3 s VAL 46 N -1.92 0.53 -0.06 3.82 0.11 0.02 -0.01 120.40 122.90 1oq3 s VAL 46 Ca 0.06 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.50 1oq3 s VAL 46 Cb -0.06 -0.52 -0.03 0.00 -1.53 0.00 0.00 36.38 34.25 1oq3 s VAL 46 CO 0.03 -0.09 -0.12 0.21 -3.33 0.00 0.00 175.10 171.80 1oq3 s ASN 47 N -0.79 4.26 -0.03 3.54 2.47 0.21 -1.23 114.94 123.37 1oq3 s ASN 47 Ca -0.03 -0.13 -0.03 0.00 0.42 0.00 0.00 52.86 53.09 1oq3 s ASN 47 Cb -0.06 -0.97 0.01 0.00 -1.45 0.00 0.00 41.25 38.78 1oq3 s ASN 47 CO 0.00 0.35 0.08 0.54 -3.72 0.00 0.00 177.10 174.36 1oq3 s VAL 48 N -0.76 0.01 -0.20 -5.21 0.11 -0.05 -0.39 120.40 113.91 1oq3 s VAL 48 Ca 0.12 -0.10 -0.07 0.00 -2.93 0.00 0.00 61.98 59.00 1oq3 s VAL 48 Cb -0.11 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 1oq3 s VAL 48 CO 0.01 -0.05 0.06 -0.63 -3.33 0.00 0.00 175.10 171.15 1oq3 s ILE 49 N -0.13 4.60 0.27 7.04 1.01 0.75 -0.71 121.20 134.03 1oq3 s ILE 49 Ca -0.02 -0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.42 1oq3 s ILE 49 Cb -0.02 -3.09 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1oq3 s ILE 49 CO 0.00 0.43 0.51 -0.72 0.00 0.00 0.00 174.94 175.16 1oq3 s TYR 50 N 0.70 0.41 -0.22 3.97 -0.85 -0.42 -0.54 117.35 120.40 1oq3 s TYR 50 Ca 0.03 -0.78 -0.04 0.00 -0.52 0.00 0.00 57.07 55.75 1oq3 s TYR 50 Cb -0.13 0.23 -0.01 0.00 0.38 0.00 0.00 41.96 42.42 1oq3 s TYR 50 CO 0.02 -1.07 -0.03 0.34 -1.52 0.00 0.00 175.55 173.29 1oq3 s ASP 51 N -3.05 4.42 0.00 -0.18 -1.08 0.26 -1.12 116.67 115.93 1oq3 s ASP 51 Ca 0.22 -0.36 0.00 0.00 -0.52 0.00 0.00 52.55 51.90 1oq3 s ASP 51 Cb -0.01 -1.76 0.00 0.00 -1.46 0.00 0.00 42.92 39.68 1oq3 s ASP 51 CO 0.11 -0.01 0.32 -0.81 0.52 0.00 0.00 175.17 175.30 1oq3 n PRO 52 N 4.75 0.61 -0.08 4.34 -0.04 -1.11 -0.20 135.00 143.27 1oq3 n PRO 52 Ca -0.18 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.12 1oq3 n PRO 52 Cb 0.51 -1.28 -0.12 0.00 -0.04 0.00 0.00 33.50 32.57 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 1.64 0.09 0.05 0.55 0.00 -1.91 -3.41 119.26 116.27 1oq3 h ALA 53 Ca 0.00 -0.72 -0.38 0.00 0.00 0.00 0.00 54.91 53.81 1oq3 h ALA 53 Cb 0.28 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1oq3 h ALA 53 CO 0.00 0.25 -2.30 0.39 0.00 0.00 0.00 179.25 177.60 1oq3 n GLU 54 N -4.56 0.69 -4.31 0.00 4.71 -1.04 -5.05 120.64 111.08 1oq3 n GLU 54 Ca -0.17 0.19 -0.21 0.00 -0.01 0.00 0.00 57.16 56.96 1oq3 n GLU 54 Cb 0.52 -1.59 -0.16 0.00 -1.01 0.00 0.00 31.44 29.19 1oq3 n GLU 54 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1oq3 s THR 55 N -2.53 0.74 0.08 2.62 2.01 0.72 -4.96 115.64 114.32 1oq3 s THR 55 Ca -0.30 -0.25 -0.02 0.00 0.31 0.00 0.00 61.69 61.43 1oq3 s THR 55 Cb 0.08 -0.73 0.01 0.00 0.01 0.00 0.00 72.50 71.87 1oq3 s THR 55 CO 0.67 0.27 0.14 0.61 -0.69 0.00 0.00 174.62 175.62 1oq3 n GLY 56 N 3.95 2.20 0.15 4.40 0.00 -1.26 -2.75 105.19 111.89 1oq3 n GLY 56 Ca -0.24 -1.20 0.11 0.00 0.00 0.00 0.00 46.02 44.69 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 -0.12 -0.20 -0.02 2.61 5.66 -1.26 -0.50 114.28 120.45 1oq3 n THR 57 Ca -0.01 0.98 -0.10 0.00 -3.05 0.00 0.00 64.05 61.87 1oq3 n THR 57 Cb 0.13 -1.52 -0.04 0.00 -1.55 0.00 0.00 70.33 67.35 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 0.93 -0.38 -0.11 1.79 0.00 -2.00 0.14 119.26 119.62 1oq3 h ALA 58 Ca 0.34 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.09 1oq3 h ALA 58 Cb 0.83 0.66 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 1oq3 h ALA 58 CO -0.40 -0.81 -0.71 0.00 0.00 0.00 0.00 179.25 177.33 1oq3 h ALA 59 N 0.42 0.55 0.49 0.00 0.00 -1.17 -3.26 119.26 116.29 1oq3 h ALA 59 Ca 0.10 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1oq3 h ALA 59 Cb 0.56 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1oq3 h ALA 59 CO -0.39 0.73 -0.23 0.82 0.00 0.00 0.00 179.25 180.18 1oq3 h ILE 60 N 0.36 0.42 -0.53 0.00 2.04 -0.92 -2.08 117.51 116.80 1oq3 h ILE 60 Ca -0.03 -0.40 0.11 0.00 1.00 0.00 0.00 64.86 65.54 1oq3 h ILE 60 Cb 1.29 0.57 -0.10 0.00 -0.74 0.00 0.00 36.82 37.84 1oq3 h ILE 60 CO 0.13 0.06 -0.10 1.56 0.00 0.00 0.00 178.15 179.80 1oq3 h GLN 61 N -0.93 0.03 -0.77 2.37 7.50 -0.86 0.18 115.11 122.63 1oq3 h GLN 61 Ca -0.07 -0.00 0.09 0.00 0.50 0.00 0.00 58.65 59.17 1oq3 h GLN 61 Cb 0.59 -0.01 -0.11 0.00 0.05 0.00 0.00 27.48 28.01 1oq3 h GLN 61 CO 0.11 0.02 -0.52 1.49 -1.50 0.00 0.00 178.83 178.43 1oq3 h GLU 62 N 0.03 -0.14 -0.29 1.46 4.22 -1.57 0.96 114.58 119.25 1oq3 h GLU 62 Ca 0.26 0.01 -0.13 0.00 0.08 0.00 0.00 59.36 59.58 1oq3 h GLU 62 Cb 0.40 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1oq3 h GLU 62 CO -0.52 -0.09 -0.31 0.87 -2.18 0.00 0.00 179.01 176.78 1oq3 h LYS 63 N -0.14 0.72 -0.58 1.92 6.56 -0.47 -2.86 116.57 121.73 1oq3 h LYS 63 Ca 0.17 -0.39 0.11 0.00 -1.06 0.00 0.00 60.65 59.49 1oq3 h LYS 63 Cb 0.51 0.02 -0.09 0.00 -0.57 0.00 0.00 32.23 32.10 1oq3 h LYS 63 CO -0.81 1.01 0.06 0.82 -2.06 0.00 0.00 179.45 178.47 1oq3 h ILE 64 N 0.47 0.60 -0.28 1.86 1.08 -0.13 0.36 117.51 121.46 1oq3 h ILE 64 Ca 0.04 -0.06 0.07 0.00 -0.39 0.00 0.00 64.86 64.52 1oq3 h ILE 64 Cb 0.88 0.40 -0.08 0.00 -3.07 0.00 0.00 36.82 34.95 1oq3 h ILE 64 CO 0.08 0.03 -0.26 -0.33 -0.69 0.00 0.00 178.15 176.98 1oq3 h GLU 65 N 0.18 -0.24 0.00 2.37 4.39 -0.62 -1.30 114.58 119.36 1oq3 h GLU 65 Ca 0.30 0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.97 1oq3 h GLU 65 Cb 0.46 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1oq3 h GLU 65 CO -0.44 -0.16 -0.24 -0.22 -1.16 0.00 0.00 179.01 176.79 1oq3 h LYS 66 N -0.25 0.00 0.00 2.33 3.11 -0.85 0.10 116.57 121.01 1oq3 h LYS 66 Ca 0.15 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.99 1oq3 h LYS 66 Cb 0.48 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.71 1oq3 h LYS 66 CO -0.43 0.24 -0.00 -0.07 -2.81 0.00 0.00 179.45 176.39 1oq3 h LEU 67 N 0.00 0.00 0.00 5.20 3.38 0.78 -3.46 115.31 121.21 1oq3 h LEU 67 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1oq3 h LEU 67 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1oq3 h LEU 67 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1oq3 n GLY 68 N -0.66 1.88 3.30 0.83 0.00 0.36 -5.00 105.19 105.90 1oq3 n GLY 68 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 0.81 -0.05 1.61 1.51 -0.97 -5.03 117.35 113.23 1oq3 s TYR 69 Ca 0.00 -1.11 0.06 0.00 -1.01 0.00 0.00 57.07 55.01 1oq3 s TYR 69 Cb 0.00 -0.30 -0.01 0.00 -0.11 0.00 0.00 41.96 41.54 1oq3 s TYR 69 CO 0.00 -0.71 -0.25 -1.58 -1.11 0.00 0.00 175.55 171.90 1oq3 s HIS 70 N -4.08 2.43 -0.06 2.71 5.65 -1.25 -2.72 115.29 117.97 1oq3 s HIS 70 Ca 0.29 -0.68 -0.05 0.00 0.25 0.00 0.00 55.06 54.88 1oq3 s HIS 70 Cb 0.05 -1.59 -0.04 0.00 -1.18 0.00 0.00 32.58 29.82 1oq3 s HIS 70 CO 0.08 -0.19 0.15 0.54 -0.65 0.00 0.00 174.74 174.67 1oq3 s VAL 71 N -0.23 5.37 0.50 0.89 0.11 -1.26 -0.67 120.40 125.11 1oq3 s VAL 71 Ca -0.02 -0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.05 1oq3 s VAL 71 Cb -0.13 -3.41 0.02 0.00 -1.53 0.00 0.00 36.38 31.32 1oq3 s VAL 71 CO 0.03 0.48 0.71 0.68 -3.33 0.00 0.00 175.10 173.67 1oq3 s VAL 72 N -1.16 3.03 -0.39 2.04 -7.23 -0.06 -4.99 120.40 111.64 1oq3 s VAL 72 Ca 0.21 -0.70 0.02 0.00 -1.81 0.00 0.00 61.98 59.69 1oq3 s VAL 72 Cb -0.12 -3.11 0.12 0.00 0.56 0.00 0.00 36.38 33.83 1oq3 s VAL 72 CO 0.11 -0.07 0.16 -0.63 -0.31 0.00 0.00 175.10 174.36 1oq3 s ILE 73 N -2.63 1.51 -0.69 -0.62 -1.09 -1.26 -4.22 121.20 112.19 1oq3 s ILE 73 Ca 0.55 -2.22 -0.32 0.00 -2.23 0.00 0.00 60.65 56.43 1oq3 s ILE 73 Cb -0.10 -2.09 -0.16 0.00 -1.58 0.00 0.00 42.46 38.53 1oq3 s ILE 73 CO 0.37 -0.76 2.47 -1.84 -1.23 0.00 0.00 174.94 173.95 1oq3 n GLU 74 N 4.04 0.50 0.00 2.79 0.28 -1.26 -4.48 120.64 122.51 1oq3 n GLU 74 Ca 0.04 0.05 0.00 0.00 -0.16 0.00 0.00 57.16 57.09 1oq3 n GLU 74 Cb 0.38 -2.23 0.00 0.00 1.43 0.00 0.00 31.44 31.02 1oq3 n GLU 74 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1oq3 n GLY 75 N 6.46 1.40 0.00 -1.84 0.00 -1.26 -5.14 105.19 104.81 1oq3 n GLY 75 Ca 0.52 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.68 1oq3 n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86