#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 0.00 4.03 4.32 -1.26 -5.05 117.00 119.04 1oq3 n LEU 2 Ca 0.00 0.54 0.00 0.00 -0.02 0.00 0.00 56.01 56.53 1oq3 n LEU 2 Cb 0.00 -1.53 0.00 0.00 -1.62 0.00 0.00 43.42 40.27 1oq3 n LEU 2 CO 0.00 -1.54 0.00 -1.20 -1.22 0.00 0.00 177.39 173.43 1oq3 n SER 3 N -2.56 -3.37 -1.04 -1.43 7.64 -1.26 -5.07 113.62 106.53 1oq3 n SER 3 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1oq3 n SER 3 Cb 0.23 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 1oq3 n SER 3 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1oq3 n GLU 4 N -0.77 -2.93 -2.54 1.43 1.02 -1.26 -4.87 120.64 110.72 1oq3 n GLU 4 Ca 0.00 2.14 -0.31 0.00 -0.02 0.00 0.00 57.16 58.97 1oq3 n GLU 4 Cb 0.00 -2.38 -0.03 0.00 -0.02 0.00 0.00 31.44 29.02 1oq3 n GLU 4 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1oq3 s GLN 5 N -3.56 3.81 0.06 3.49 -2.07 -1.26 -4.36 119.66 115.76 1oq3 s GLN 5 Ca 0.00 0.68 -0.11 0.00 -1.82 0.00 0.00 55.36 54.11 1oq3 s GLN 5 Cb 0.00 -2.25 0.01 0.00 -1.09 0.00 0.00 33.01 29.68 1oq3 s GLN 5 CO 0.00 -0.21 0.23 0.21 -1.32 0.00 0.00 175.29 174.20 1oq3 s LYS 6 N -4.17 0.78 -0.44 9.60 2.36 -0.33 -4.97 119.74 122.58 1oq3 s LYS 6 Ca 0.54 -0.70 -0.27 0.00 -2.55 0.00 0.00 55.97 52.99 1oq3 s LYS 6 Cb -0.10 0.33 0.03 0.00 -1.05 0.00 0.00 37.83 37.03 1oq3 s LYS 6 CO 0.35 -0.24 1.03 -1.83 1.55 0.00 0.00 175.35 176.21 1oq3 s GLU 7 N -2.99 3.70 0.28 4.03 -1.05 -1.26 -1.84 118.70 119.57 1oq3 s GLU 7 Ca -0.02 0.47 -0.09 0.00 -0.15 0.00 0.00 54.97 55.18 1oq3 s GLU 7 Cb 0.01 -3.89 -0.07 0.00 -0.44 0.00 0.00 34.13 29.74 1oq3 s GLU 7 CO -0.06 -1.23 0.60 0.42 0.95 0.00 0.00 175.26 175.94 1oq3 s ILE 8 N 4.02 4.91 -0.05 1.83 1.09 0.12 -4.93 121.20 128.19 1oq3 s ILE 8 Ca 0.43 0.43 -0.02 0.00 -1.10 0.00 0.00 60.65 60.39 1oq3 s ILE 8 Cb -0.09 -3.66 0.04 0.00 -1.06 0.00 0.00 42.46 37.68 1oq3 s ILE 8 CO 0.27 -0.21 0.10 0.00 -0.10 0.00 0.00 174.94 175.00 1oq3 s ALA 9 N -1.98 -0.09 0.20 9.38 0.00 -1.26 -0.78 121.76 127.22 1oq3 s ALA 9 Ca 0.48 0.50 -0.19 0.00 0.00 0.00 0.00 51.96 52.75 1oq3 s ALA 9 Cb -0.11 -0.45 0.03 0.00 0.00 0.00 0.00 23.12 22.60 1oq3 s ALA 9 CO 0.24 -0.22 0.56 0.00 0.00 0.00 0.00 175.76 176.34 1oq3 s MET 10 N 1.38 1.42 -0.01 0.00 0.23 -0.21 -4.99 119.30 117.12 1oq3 s MET 10 Ca -0.06 -0.81 -0.03 0.00 -1.03 0.00 0.00 55.69 53.76 1oq3 s MET 10 Cb -0.12 0.55 -0.04 0.00 -1.53 0.00 0.00 34.83 33.68 1oq3 s MET 10 CO -0.05 -0.61 0.17 -0.65 -2.03 0.00 0.00 175.02 171.86 1oq3 s GLN 11 N -3.86 3.41 0.27 3.16 1.11 -1.24 -0.87 119.66 121.64 1oq3 s GLN 11 Ca 0.08 -0.33 0.11 0.00 0.01 0.00 0.00 55.36 55.24 1oq3 s GLN 11 Cb -0.02 -3.08 -0.05 0.00 -1.01 0.00 0.00 33.01 28.85 1oq3 s GLN 11 CO -0.03 0.68 -0.17 0.08 0.01 0.00 0.00 175.29 175.85 1oq3 s VAL 12 N -1.31 2.65 -0.13 1.09 1.01 -1.20 -0.86 120.40 121.65 1oq3 s VAL 12 Ca 0.27 -2.27 0.02 0.00 0.00 0.00 0.00 61.98 60.00 1oq3 s VAL 12 Cb -0.13 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.89 1oq3 s VAL 12 CO 0.18 -0.36 -0.20 -0.55 0.00 0.00 0.00 175.10 174.17 1oq3 s SER 13 N -3.43 2.94 0.00 3.32 0.15 0.67 -4.76 113.70 112.59 1oq3 s SER 13 Ca 0.29 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.38 1oq3 s SER 13 Cb -0.06 -1.36 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 1oq3 s SER 13 CO 0.15 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.27 1oq3 n GLY 14 N 4.11 1.62 3.69 9.45 0.00 -1.26 -3.04 105.19 119.76 1oq3 n GLY 14 Ca -0.20 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.10 2.19 -0.75 1.61 0.00 -1.26 -4.91 117.12 113.89 1oq3 n MET 15 Ca 0.00 0.78 -0.03 0.00 0.00 0.00 0.00 57.70 58.45 1oq3 n MET 15 Cb 0.00 -2.44 0.22 0.00 0.00 0.00 0.00 33.22 31.00 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 1.52 2.56 -1.69 3.17 -2.24 -1.26 -4.99 114.28 111.35 1oq3 n THR 16 Ca 0.09 -2.39 0.01 0.00 -2.27 0.00 0.00 64.05 59.48 1oq3 n THR 16 Cb 0.34 -0.32 -0.00 0.00 -2.10 0.00 0.00 70.33 68.25 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 -0.63 0.00 1.39 0.00 0.00 -1.26 -2.29 120.51 117.72 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 0.02 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.48 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 5.67 2.52 0.16 0.00 0.00 -1.26 -4.14 120.51 123.47 1oq3 n ALA 19 Ca 0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 53.44 53.32 1oq3 n ALA 19 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.15 1.42 -1.00 0.00 0.00 -1.74 0.12 119.26 116.91 1oq3 h ALA 21 Ca -0.05 0.12 0.21 0.00 0.00 0.00 0.00 54.91 55.19 1oq3 h ALA 21 Cb 0.38 0.06 -0.11 0.00 0.00 0.00 0.00 17.79 18.11 1oq3 h ALA 21 CO 0.08 -0.22 0.59 0.00 0.00 0.00 0.00 179.25 179.71 1oq3 h ALA 22 N 1.65 1.69 -0.70 0.00 0.00 -1.77 0.60 119.26 120.73 1oq3 h ALA 22 Ca 0.53 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.58 1oq3 h ALA 22 Cb 0.91 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 1oq3 h ALA 22 CO -0.45 -0.14 0.42 0.00 0.00 0.00 0.00 179.25 179.09 1oq3 h ARG 23 N 0.69 0.79 0.32 0.00 2.47 -0.84 0.14 114.38 117.95 1oq3 h ARG 23 Ca 0.60 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 59.27 1oq3 h ARG 23 Cb 1.01 -0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 29.12 1oq3 h ARG 23 CO -0.42 0.52 -0.50 0.82 0.56 0.00 0.00 179.97 180.95 1oq3 h ILE 24 N 0.81 0.04 -0.30 2.04 2.04 -0.89 -1.27 117.51 119.98 1oq3 h ILE 24 Ca 0.29 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 66.00 1oq3 h ILE 24 Cb 0.08 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.19 1oq3 h ILE 24 CO -0.13 0.00 -0.42 -0.08 0.00 0.00 0.00 178.15 177.52 1oq3 h GLU 25 N -0.87 0.81 -1.01 2.37 4.22 -1.39 -3.03 114.58 115.68 1oq3 h GLU 25 Ca -0.03 -0.47 0.23 0.00 0.08 0.00 0.00 59.36 59.17 1oq3 h GLU 25 Cb 0.81 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.99 1oq3 h GLU 25 CO -0.16 1.10 0.62 0.87 -2.18 0.00 0.00 179.01 179.27 1oq3 h LYS 26 N 0.58 0.55 -0.27 1.92 1.79 -0.45 0.72 116.57 121.41 1oq3 h LYS 26 Ca 0.03 -0.03 0.06 0.00 -2.18 0.00 0.00 60.65 58.53 1oq3 h LYS 26 Cb 1.01 -0.12 -0.07 0.00 -1.58 0.00 0.00 32.23 31.47 1oq3 h LYS 26 CO 0.10 0.36 -0.17 0.78 -1.08 0.00 0.00 179.45 179.44 1oq3 h GLY 27 N 0.56 0.01 2.00 3.86 0.00 -1.11 -2.28 103.07 106.12 1oq3 h GLY 27 Ca 0.60 0.22 -0.06 0.00 0.00 0.00 0.00 47.33 48.09 1oq3 h GLY 27 CO -0.37 -0.17 -0.27 1.41 0.00 0.00 0.00 176.54 177.13 1oq3 h LEU 28 N -0.15 0.00 -1.56 3.11 3.38 0.22 -1.08 115.31 119.22 1oq3 h LEU 28 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1oq3 h LEU 28 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1oq3 h LEU 28 CO -0.36 0.27 0.00 0.50 0.09 0.00 0.00 178.44 178.94 1oq3 h LYS 29 N 0.00 0.00 -0.33 1.13 3.64 0.09 0.13 116.57 121.23 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 0.57 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1oq3 h LYS 29 CO 0.04 0.00 0.00 0.54 -2.27 0.00 0.00 179.45 177.76 1oq3 n ARG 30 N -2.42 2.29 -2.92 1.90 1.74 -0.41 -4.88 116.66 111.96 1oq3 n ARG 30 Ca -0.01 -1.95 -0.40 0.00 -0.77 0.00 0.00 57.85 54.72 1oq3 n ARG 30 Cb 0.08 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 29.99 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 -1.58 4.62 -0.78 5.56 -1.94 0.44 -4.97 119.30 120.65 1oq3 s MET 31 Ca 0.37 1.23 -0.25 0.00 -1.71 0.00 0.00 55.69 55.32 1oq3 s MET 31 Cb 0.21 -3.29 -0.04 0.00 2.01 0.00 0.00 34.83 33.73 1oq3 s MET 31 CO 0.30 0.49 1.92 -1.25 -0.01 0.00 0.00 175.02 176.47 1oq3 s PRO 32 N -0.91 2.58 0.00 2.03 0.04 -1.26 -2.05 135.00 135.42 1oq3 s PRO 32 Ca 0.38 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.52 1oq3 s PRO 32 Cb -0.23 -4.78 0.00 0.00 0.04 0.00 0.00 34.50 29.53 1oq3 s PRO 32 CO 0.27 -3.11 0.00 0.41 0.04 0.00 0.00 177.00 174.61 1oq3 n GLY 33 N 6.36 0.66 3.76 0.56 0.00 -1.26 -4.55 105.19 110.72 1oq3 n GLY 33 Ca 0.32 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 3.18 0.08 1.61 0.11 -0.87 -0.50 120.40 124.00 1oq3 s VAL 34 Ca 0.00 0.38 0.00 0.00 -2.93 0.00 0.00 61.98 59.43 1oq3 s VAL 34 Cb 0.00 -2.84 0.00 0.00 -1.53 0.00 0.00 36.38 32.01 1oq3 s VAL 34 CO 0.00 -0.50 0.00 0.41 -3.33 0.00 0.00 175.10 171.68 1oq3 n THR 35 N -3.61 0.70 -3.91 5.04 -1.04 0.73 -4.89 114.28 107.31 1oq3 n THR 35 Ca 0.09 0.23 -0.09 0.00 -2.04 0.00 0.00 64.05 62.24 1oq3 n THR 35 Cb 0.53 -1.44 -0.08 0.00 -1.82 0.00 0.00 70.33 67.52 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 -5.57 0.17 -0.02 8.00 2.15 -1.10 -5.01 116.67 115.29 1oq3 s ASP 36 Ca 0.00 -0.61 0.01 0.00 0.43 0.00 0.00 52.55 52.38 1oq3 s ASP 36 Cb 0.00 0.28 0.01 0.00 -0.30 0.00 0.00 42.92 42.91 1oq3 s ASP 36 CO 0.00 -0.62 -0.04 0.00 -0.17 0.00 0.00 175.17 174.35 1oq3 s ALA 37 N -3.27 0.43 -0.12 3.66 0.00 -1.26 -0.36 121.76 120.85 1oq3 s ALA 37 Ca 0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 51.96 51.83 1oq3 s ALA 37 Cb 0.02 -0.20 0.05 0.00 0.00 0.00 0.00 23.12 23.00 1oq3 s ALA 37 CO -0.08 0.05 0.12 -0.80 0.00 0.00 0.00 175.76 175.05 1oq3 s ASN 38 N 0.29 1.48 0.23 0.00 0.01 0.13 -4.99 114.94 112.09 1oq3 s ASN 38 Ca -0.03 -0.13 -0.22 0.00 -0.71 0.00 0.00 52.86 51.77 1oq3 s ASN 38 Cb -0.07 0.00 -0.08 0.00 0.41 0.00 0.00 41.25 41.51 1oq3 s ASN 38 CO -0.00 -0.29 0.77 0.54 -1.51 0.00 0.00 177.10 176.60 1oq3 s VAL 39 N 2.21 4.48 -0.47 1.60 0.11 -1.26 -0.86 120.40 126.22 1oq3 s VAL 39 Ca 0.04 1.44 0.08 0.00 -2.93 0.00 0.00 61.98 60.61 1oq3 s VAL 39 Cb -0.14 -3.93 0.27 0.00 -1.53 0.00 0.00 36.38 31.05 1oq3 s VAL 39 CO -0.07 0.26 0.65 -3.20 -3.33 0.00 0.00 175.10 169.41 1oq3 n ASN 40 N 0.87 1.56 0.20 3.54 5.15 0.97 -4.93 115.26 122.63 1oq3 n ASN 40 Ca -0.02 -3.02 0.15 0.00 -0.60 0.00 0.00 54.58 51.09 1oq3 n ASN 40 Cb 0.50 -0.64 0.65 0.00 -0.53 0.00 0.00 39.78 39.76 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 3.82 0.00 -2.18 1.20 3.38 -1.93 -0.07 115.31 119.53 1oq3 h LEU 41 Ca 0.11 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.11 1oq3 h LEU 41 Cb 0.81 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1oq3 h LEU 41 CO 0.59 0.00 0.28 0.00 0.09 0.00 0.00 178.44 179.41 1oq3 h ALA 42 N 2.11 1.51 0.00 1.53 0.00 -1.92 -0.86 119.26 121.64 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 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1oq3 h ALA 42 CO 0.00 -0.34 -0.15 2.41 0.00 0.00 0.00 179.25 181.17 1oq3 n THR 43 N -3.23 1.03 -4.32 0.00 -1.04 -0.14 -5.00 114.28 101.59 1oq3 n THR 43 Ca 0.00 -1.21 -0.38 0.00 -2.04 0.00 0.00 64.05 60.42 1oq3 n THR 43 Cb 0.37 0.19 -0.04 0.00 -1.82 0.00 0.00 70.33 69.03 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 -0.75 -2.41 -4.15 -2.82 1.02 -0.33 -4.92 120.64 106.28 1oq3 n GLU 44 Ca 0.08 0.30 -0.13 0.00 -0.02 0.00 0.00 57.16 57.39 1oq3 n GLU 44 Cb 0.59 -4.95 -0.11 0.00 -0.02 0.00 0.00 31.44 26.96 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 -3.31 0.76 0.04 2.62 2.01 -0.63 -3.23 115.64 113.90 1oq3 s THR 45 Ca 0.74 -1.61 0.03 0.00 0.31 0.00 0.00 61.69 61.16 1oq3 s THR 45 Cb -0.41 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 70.78 1oq3 s THR 45 CO 0.96 -0.63 -0.09 0.54 -0.69 0.00 0.00 174.62 174.71 1oq3 s VAL 46 N -2.60 0.65 0.17 3.82 0.11 -0.05 -0.02 120.40 122.49 1oq3 s VAL 46 Ca 0.04 -1.04 0.11 0.00 -2.93 0.00 0.00 61.98 58.16 1oq3 s VAL 46 Cb -0.02 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 1oq3 s VAL 46 CO -0.02 -0.29 -0.25 0.54 -3.33 0.00 0.00 175.10 171.76 1oq3 s ASN 47 N -1.46 3.37 -0.18 3.54 4.22 -0.04 -1.04 114.94 123.35 1oq3 s ASN 47 Ca -0.07 -0.83 -0.13 0.00 -2.14 0.00 0.00 52.86 49.69 1oq3 s ASN 47 Cb -0.09 -0.24 0.06 0.00 1.28 0.00 0.00 41.25 42.25 1oq3 s ASN 47 CO 0.01 0.13 0.46 0.54 -2.04 0.00 0.00 177.10 176.20 1oq3 s VAL 48 N -1.52 -0.01 -0.38 3.54 0.11 0.04 -0.69 120.40 121.48 1oq3 s VAL 48 Ca 0.19 0.05 -0.14 0.00 -2.93 0.00 0.00 61.98 59.14 1oq3 s VAL 48 Cb -0.08 -0.67 0.01 0.00 -1.53 0.00 0.00 36.38 34.10 1oq3 s VAL 48 CO 0.09 0.02 0.28 -0.63 -3.33 0.00 0.00 175.10 171.52 1oq3 s ILE 49 N 1.01 5.27 0.21 7.04 1.01 0.51 -0.71 121.20 135.54 1oq3 s ILE 49 Ca -0.06 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1oq3 s ILE 49 Cb -0.06 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.51 1oq3 s ILE 49 CO -0.09 -0.20 0.06 -0.72 0.00 0.00 0.00 174.94 174.00 1oq3 s TYR 50 N 1.70 1.30 -0.27 3.97 -0.85 -0.76 -0.19 117.35 122.24 1oq3 s TYR 50 Ca 0.05 -1.15 -0.09 0.00 -0.52 0.00 0.00 57.07 55.36 1oq3 s TYR 50 Cb -0.18 -0.74 -0.04 0.00 0.38 0.00 0.00 41.96 41.38 1oq3 s TYR 50 CO 0.10 -0.35 0.13 0.34 -1.52 0.00 0.00 175.55 174.26 1oq3 s ASP 51 N -3.21 5.60 0.00 -0.18 -1.08 0.34 -1.19 116.67 116.96 1oq3 s ASP 51 Ca 0.31 -0.12 0.02 0.00 -0.52 0.00 0.00 52.55 52.25 1oq3 s ASP 51 Cb 0.07 -2.03 0.15 0.00 -1.46 0.00 0.00 42.92 39.65 1oq3 s ASP 51 CO 0.09 -0.05 0.77 -0.81 0.52 0.00 0.00 175.17 175.69 1oq3 n PRO 52 N 5.00 0.66 -0.06 4.34 -0.04 -1.15 -0.22 135.00 143.52 1oq3 n PRO 52 Ca -0.15 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.21 1oq3 n PRO 52 Cb 0.52 -1.06 -0.09 0.00 -0.04 0.00 0.00 33.50 32.83 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 2.43 0.01 0.15 0.55 0.00 -1.93 -3.39 119.26 117.08 1oq3 h ALA 53 Ca 0.00 -0.36 -0.31 0.00 0.00 0.00 0.00 54.91 54.23 1oq3 h ALA 53 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1oq3 h ALA 53 CO 0.00 0.03 -1.56 0.93 0.00 0.00 0.00 179.25 178.64 1oq3 h GLU 54 N -1.00 0.32 -3.62 0.00 4.39 -1.84 -3.49 114.58 109.34 1oq3 h GLU 54 Ca -0.01 -0.55 -0.36 0.00 0.34 0.00 0.00 59.36 58.78 1oq3 h GLU 54 Cb 0.69 0.21 -0.36 0.00 -0.10 0.00 0.00 28.75 29.19 1oq3 h GLU 54 CO -0.01 1.27 -0.75 0.99 -1.16 0.00 0.00 179.01 179.35 1oq3 s THR 55 N -2.53 0.12 0.00 1.13 2.01 0.70 -4.97 115.64 112.11 1oq3 s THR 55 Ca -0.18 0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1oq3 s THR 55 Cb 0.05 -0.26 0.00 0.00 0.01 0.00 0.00 72.50 72.30 1oq3 s THR 55 CO 0.81 0.16 0.00 0.61 -0.69 0.00 0.00 174.62 175.51 1oq3 n GLY 56 N 4.50 2.19 0.19 4.40 0.00 -1.26 -2.96 105.19 112.26 1oq3 n GLY 56 Ca -0.20 -0.87 0.14 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.24 -0.05 2.61 5.66 -1.26 -0.35 114.28 120.65 1oq3 n THR 57 Ca 0.00 1.22 -0.11 0.00 -3.05 0.00 0.00 64.05 62.10 1oq3 n THR 57 Cb 0.00 -1.87 -0.05 0.00 -1.55 0.00 0.00 70.33 66.85 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 1.15 -0.52 -0.10 1.79 0.00 -2.00 0.15 119.26 119.73 1oq3 h ALA 58 Ca 0.42 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 55.15 1oq3 h ALA 58 Cb 1.01 0.82 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1oq3 h ALA 58 CO -0.49 -0.90 -0.76 0.00 0.00 0.00 0.00 179.25 177.10 1oq3 h ALA 59 N 0.25 0.47 0.36 0.00 0.00 -1.07 -3.29 119.26 115.97 1oq3 h ALA 59 Ca 0.10 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1oq3 h ALA 59 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1oq3 h ALA 59 CO -0.46 0.73 -0.17 0.82 0.00 0.00 0.00 179.25 180.17 1oq3 h ILE 60 N 0.38 0.64 -0.55 0.00 2.04 -0.73 -1.68 117.51 117.61 1oq3 h ILE 60 Ca -0.04 -0.41 0.11 0.00 1.00 0.00 0.00 64.86 65.51 1oq3 h ILE 60 Cb 1.36 0.84 -0.11 0.00 -0.74 0.00 0.00 36.82 38.17 1oq3 h ILE 60 CO 0.14 0.08 -0.21 1.56 0.00 0.00 0.00 178.15 179.72 1oq3 h GLN 61 N -0.72 -0.08 -0.76 2.37 7.50 -0.85 0.23 115.11 122.80 1oq3 h GLN 61 Ca -0.05 0.01 0.13 0.00 0.50 0.00 0.00 58.65 59.23 1oq3 h GLN 61 Cb 0.50 0.02 -0.13 0.00 0.05 0.00 0.00 27.48 27.91 1oq3 h GLN 61 CO 0.08 -0.05 -0.35 1.49 -1.50 0.00 0.00 178.83 178.50 1oq3 h GLU 62 N -0.08 -0.09 -0.16 1.46 4.22 -1.58 0.83 114.58 119.18 1oq3 h GLU 62 Ca 0.26 0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.63 1oq3 h GLU 62 Cb 0.48 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1oq3 h GLU 62 CO -0.61 -0.06 -0.19 0.87 -2.18 0.00 0.00 179.01 176.84 1oq3 h LYS 63 N -0.09 0.41 -0.62 1.92 6.56 -0.16 -3.06 116.57 121.53 1oq3 h LYS 63 Ca 0.29 -0.23 0.13 0.00 -1.06 0.00 0.00 60.65 59.78 1oq3 h LYS 63 Cb 0.57 0.01 -0.10 0.00 -0.57 0.00 0.00 32.23 32.15 1oq3 h LYS 63 CO -0.81 0.80 0.06 0.82 -2.06 0.00 0.00 179.45 178.26 1oq3 h ILE 64 N 0.05 0.54 -0.58 1.86 1.08 0.16 0.36 117.51 120.98 1oq3 h ILE 64 Ca 0.02 -0.06 0.11 0.00 -0.39 0.00 0.00 64.86 64.55 1oq3 h ILE 64 Cb 0.74 0.35 -0.09 0.00 -3.07 0.00 0.00 36.82 34.75 1oq3 h ILE 64 CO 0.05 0.03 0.07 -0.33 -0.69 0.00 0.00 178.15 177.28 1oq3 h GLU 65 N 0.17 0.18 -0.08 2.37 4.39 -0.75 -2.17 114.58 118.70 1oq3 h GLU 65 Ca 0.33 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.87 1oq3 h GLU 65 Cb 0.53 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1oq3 h GLU 65 CO -0.49 0.12 -0.60 -0.22 -1.16 0.00 0.00 179.01 176.66 1oq3 h LYS 66 N 0.19 0.26 -0.11 2.33 1.63 -0.37 0.26 116.57 120.76 1oq3 h LYS 66 Ca 0.30 -0.18 0.03 0.00 -0.85 0.00 0.00 60.65 59.95 1oq3 h LYS 66 Cb 0.46 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1oq3 h LYS 66 CO -0.43 0.79 0.24 -0.07 -3.45 0.00 0.00 179.45 176.53 1oq3 h LEU 67 N 0.20 0.00 -0.02 5.20 -0.00 0.04 -3.46 115.31 117.28 1oq3 h LEU 67 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1oq3 h LEU 67 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.77 1oq3 h LEU 67 CO 0.10 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.15 1oq3 n GLY 68 N -1.29 1.63 3.18 0.83 0.00 0.08 -5.01 105.19 104.61 1oq3 n GLY 68 Ca 0.00 -0.17 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.02 0.97 -0.10 1.61 1.51 -0.88 -5.02 117.35 113.42 1oq3 s TYR 69 Ca 0.00 -1.08 0.03 0.00 -1.01 0.00 0.00 57.07 55.01 1oq3 s TYR 69 Cb 0.00 -0.56 -0.01 0.00 -0.11 0.00 0.00 41.96 41.28 1oq3 s TYR 69 CO 0.00 -0.33 -0.21 -1.58 -1.11 0.00 0.00 175.55 172.32 1oq3 s HIS 70 N -3.82 2.62 0.01 2.71 5.65 -1.17 -2.95 115.29 118.34 1oq3 s HIS 70 Ca 0.20 -0.88 -0.03 0.00 0.25 0.00 0.00 55.06 54.61 1oq3 s HIS 70 Cb 0.07 -1.73 -0.04 0.00 -1.18 0.00 0.00 32.58 29.69 1oq3 s HIS 70 CO 0.00 -0.32 0.21 0.54 -0.65 0.00 0.00 174.74 174.52 1oq3 s VAL 71 N 0.25 5.39 0.07 0.89 0.11 -1.26 -0.24 120.40 125.62 1oq3 s VAL 71 Ca -0.14 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 1oq3 s VAL 71 Cb -0.17 -3.56 -0.04 0.00 -1.53 0.00 0.00 36.38 31.08 1oq3 s VAL 71 CO 0.07 0.29 0.14 0.68 -3.33 0.00 0.00 175.10 172.95 1oq3 s VAL 72 N -1.37 4.96 -0.39 2.04 -7.23 -0.04 -4.96 120.40 113.40 1oq3 s VAL 72 Ca 0.29 -0.57 0.03 0.00 -1.81 0.00 0.00 61.98 59.91 1oq3 s VAL 72 Cb -0.13 -3.40 0.11 0.00 0.56 0.00 0.00 36.38 33.52 1oq3 s VAL 72 CO 0.20 0.14 0.13 -0.63 -0.31 0.00 0.00 175.10 174.62 1oq3 s ILE 73 N -1.44 2.55 0.24 -0.62 -1.09 -1.26 -3.64 121.20 115.93 1oq3 s ILE 73 Ca 0.32 -2.50 0.11 0.00 -2.23 0.00 0.00 60.65 56.35 1oq3 s ILE 73 Cb -0.13 -2.83 -0.05 0.00 -1.58 0.00 0.00 42.46 37.88 1oq3 s ILE 73 CO 0.25 -0.66 -0.14 -0.70 -1.23 0.00 0.00 174.94 172.46 1oq3 s GLU 74 N 0.69 1.87 0.00 2.79 -6.30 -1.26 -4.97 118.70 111.52 1oq3 s GLU 74 Ca 0.12 -1.52 0.00 0.00 -2.50 0.00 0.00 54.97 51.07 1oq3 s GLU 74 Cb -0.21 -1.97 0.00 0.00 0.00 0.00 0.00 34.13 31.96 1oq3 s GLU 74 CO -0.06 0.38 0.00 0.41 0.02 0.00 0.00 175.26 176.01 1oq3 n GLY 75 N -0.34 0.78 0.00 -1.50 0.00 -1.26 -5.03 105.19 97.84 1oq3 n GLY 75 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1oq3 n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19