#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qb9 s VAL 2 N 0.00 3.71 0.20 1.12 0.11 -1.26 -0.49 120.40 123.79 2qb9 s VAL 2 Ca 0.00 0.82 0.03 0.00 -2.93 0.00 0.00 61.98 59.90 2qb9 s VAL 2 Cb 0.00 -3.66 -0.01 0.00 -1.53 0.00 0.00 36.38 31.18 2qb9 s VAL 2 CO 0.00 -0.21 0.11 0.35 -3.33 0.00 0.00 175.10 172.01 2qb9 n THR 3 N 6.08 0.00 -3.79 5.04 -2.24 -0.64 -1.32 114.28 117.41 2qb9 n THR 3 Ca 0.18 -1.28 -0.28 0.00 -2.27 0.00 0.00 64.05 60.41 2qb9 n THR 3 Cb 0.45 0.53 -0.16 0.00 -2.10 0.00 0.00 70.33 69.04 2qb9 n THR 3 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qb9 s ILE 4 N -2.51 0.76 0.24 2.28 1.01 -1.22 -0.97 121.20 120.80 2qb9 s ILE 4 Ca 0.15 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.19 2qb9 s ILE 4 Cb 0.01 -1.16 -0.01 0.00 0.01 0.00 0.00 42.46 41.31 2qb9 s ILE 4 CO 0.11 -0.11 0.09 -2.11 0.00 0.00 0.00 174.94 172.91 2qb9 n ARG 5 N 4.97 0.71 -4.13 2.79 0.00 -1.05 -1.69 116.66 118.26 2qb9 n ARG 5 Ca -0.10 -2.03 -0.31 0.00 -0.00 0.00 0.00 57.85 55.41 2qb9 n ARG 5 Cb 0.47 1.13 -0.07 0.00 -0.00 0.00 0.00 32.46 33.98 2qb9 n ARG 5 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2qb9 s LEU 6 N 0.00 3.70 -0.14 2.89 1.02 -1.26 -2.05 118.68 122.84 2qb9 s LEU 6 Ca 0.13 -0.00 0.01 0.00 0.02 0.00 0.00 54.13 54.28 2qb9 s LEU 6 Cb 0.01 -2.28 0.02 0.00 0.02 0.00 0.00 46.19 43.96 2qb9 s LEU 6 CO 0.09 0.22 -0.14 0.00 0.02 0.00 0.00 176.35 176.54 2qb9 s ALA 7 N -1.26 1.79 -0.56 4.21 0.00 -0.80 -4.82 121.76 120.31 2qb9 s ALA 7 Ca 0.25 -0.84 -0.27 0.00 0.00 0.00 0.00 51.96 51.10 2qb9 s ALA 7 Cb -0.12 -1.00 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 2qb9 s ALA 7 CO 0.17 -0.33 1.87 0.50 0.00 0.00 0.00 175.76 177.97 2qb9 s ARG 8 N 1.41 2.71 -0.46 0.00 3.52 -1.26 -0.66 118.95 124.21 2qb9 s ARG 8 Ca 0.03 0.76 0.04 0.00 -0.13 0.00 0.00 55.73 56.43 2qb9 s ARG 8 Cb -0.13 -4.36 0.42 0.00 -1.56 0.00 0.00 34.95 29.32 2qb9 s ARG 8 CO -0.09 -2.62 1.26 0.72 -0.81 0.00 0.00 175.30 173.76 2qb9 n HIS 9 N 12.50 3.23 -4.44 5.12 8.25 -1.14 -4.90 115.22 133.83 2qb9 n HIS 9 Ca 0.21 -2.84 -0.21 0.00 -0.26 0.00 0.00 57.72 54.62 2qb9 n HIS 9 Cb 0.51 -0.30 -0.10 0.00 1.12 0.00 0.00 29.99 31.22 2qb9 n HIS 9 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2qb9 s GLY 10 N -3.23 2.08 1.02 -1.41 0.00 -1.26 -4.59 107.32 99.93 2qb9 s GLY 10 Ca 0.50 -1.98 -0.12 0.00 0.00 0.00 0.00 44.72 43.11 2qb9 s GLY 10 CO -0.16 -1.80 1.08 0.00 0.00 0.00 0.00 173.10 172.22 2qb9 s ALA 11 N -3.34 0.73 0.35 3.20 0.00 -0.39 -4.73 121.76 117.59 2qb9 s ALA 11 Ca 0.36 -0.23 -0.28 0.00 0.00 0.00 0.00 51.96 51.80 2qb9 s ALA 11 Cb 0.08 -3.17 -0.12 0.00 0.00 0.00 0.00 23.12 19.92 2qb9 s ALA 11 CO 0.15 -2.99 1.45 1.17 0.00 0.00 0.00 175.76 175.54 2qb9 n LYS 12 N -4.30 2.50 0.00 0.00 4.81 -1.26 -1.36 118.16 118.54 2qb9 n LYS 12 Ca 0.05 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 2qb9 n LYS 12 Cb 0.56 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.04 2qb9 n LYS 12 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2qb9 n LYS 13 N 0.83 0.00 -3.78 1.64 5.02 -1.26 -4.81 118.16 115.80 2qb9 n LYS 13 Ca 0.04 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.05 2qb9 n LYS 13 Cb 0.37 -2.83 -0.12 0.00 -0.02 0.00 0.00 35.03 32.43 2qb9 n LYS 13 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2qb9 s ARG 14 N 0.00 1.98 1.16 1.97 0.52 -0.46 -5.10 118.95 119.01 2qb9 s ARG 14 Ca 0.00 -2.89 -0.19 0.00 -0.52 0.00 0.00 55.73 52.13 2qb9 s ARG 14 Cb 0.00 -2.89 0.27 0.00 0.52 0.00 0.00 34.95 32.85 2qb9 s ARG 14 CO 0.00 -1.28 1.17 -1.25 0.02 0.00 0.00 175.30 173.96 2qb9 s PRO 15 N -0.85 -0.86 -0.40 3.54 0.04 -1.23 -1.26 135.00 133.97 2qb9 s PRO 15 Ca 0.25 -0.19 0.02 0.00 0.04 0.00 0.00 61.00 61.12 2qb9 s PRO 15 Cb -0.07 -1.65 0.27 0.00 0.04 0.00 0.00 34.50 33.09 2qb9 s PRO 15 CO -0.14 -3.45 1.11 0.34 0.04 0.00 0.00 177.00 174.90 2qb9 n PHE 16 N -4.55 -1.78 -1.70 0.56 -0.00 -1.26 -4.68 117.46 104.05 2qb9 n PHE 16 Ca 0.14 -1.20 -0.44 0.00 -0.00 0.00 0.00 57.45 55.95 2qb9 n PHE 16 Cb 0.60 1.32 -0.03 0.00 -0.00 0.00 0.00 39.48 41.36 2qb9 n PHE 16 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 2qb9 n TYR 17 N 1.41 2.48 -4.10 -5.13 4.02 -1.22 -2.90 117.16 111.72 2qb9 n TYR 17 Ca 0.04 0.24 -0.34 0.00 -0.01 0.00 0.00 57.90 57.84 2qb9 n TYR 17 Cb 0.68 -2.57 -0.15 0.00 -0.02 0.00 0.00 39.34 37.28 2qb9 n TYR 17 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 2qb9 s GLN 18 N 0.41 3.22 0.33 -0.72 0.74 0.16 -1.87 119.66 121.93 2qb9 s GLN 18 Ca 0.73 -0.72 -0.28 0.00 0.05 0.00 0.00 55.36 55.14 2qb9 s GLN 18 Cb -0.59 -2.78 -0.10 0.00 1.10 0.00 0.00 33.01 30.64 2qb9 s GLN 18 CO 0.41 -0.16 1.20 0.08 -0.55 0.00 0.00 175.29 176.28 2qb9 s VAL 19 N 1.27 3.09 -0.20 1.34 1.01 -0.96 -1.90 120.40 124.05 2qb9 s VAL 19 Ca 0.03 1.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.78 2qb9 s VAL 19 Cb -0.14 -3.65 0.13 0.00 0.00 0.00 0.00 36.38 32.72 2qb9 s VAL 19 CO -0.06 0.21 1.04 0.54 0.00 0.00 0.00 175.10 176.83 2qb9 s VAL 20 N -1.22 0.00 -0.34 2.92 0.11 -0.87 -2.57 120.40 118.44 2qb9 s VAL 20 Ca 0.49 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 59.31 2qb9 s VAL 20 Cb -0.35 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.51 2qb9 s VAL 20 CO 0.45 0.00 0.79 -0.69 -3.33 0.00 0.00 175.10 172.32 2qb9 s VAL 21 N -0.71 4.76 0.09 2.04 1.01 0.72 -2.52 120.40 125.78 2qb9 s VAL 21 Ca 0.00 1.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.96 2qb9 s VAL 21 Cb -0.02 -4.18 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 2qb9 s VAL 21 CO -0.01 -0.35 0.10 0.00 0.00 0.00 0.00 175.10 174.83 2qb9 s ALA 22 N 3.05 0.24 -0.12 5.51 0.00 -0.14 0.29 121.76 130.59 2qb9 s ALA 22 Ca 0.32 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 2qb9 s ALA 22 Cb -0.14 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 2qb9 s ALA 22 CO 0.15 -0.47 1.50 0.34 0.00 0.00 0.00 175.76 177.28 2qb9 s ASP 23 N -2.93 6.74 0.25 0.00 -1.08 -1.26 -1.62 116.67 116.77 2qb9 s ASP 23 Ca 0.10 1.95 -0.08 0.00 -0.52 0.00 0.00 52.55 54.00 2qb9 s ASP 23 Cb 0.06 -2.53 0.39 0.00 -1.46 0.00 0.00 42.92 39.38 2qb9 s ASP 23 CO -0.07 -0.90 1.39 -1.54 0.52 0.00 0.00 175.17 174.57 2qb9 n SER 24 N 7.09 -0.35 -0.30 -0.34 3.41 0.36 0.33 113.62 123.82 2qb9 n SER 24 Ca 0.16 1.54 0.04 0.00 -0.26 0.00 0.00 58.87 60.35 2qb9 n SER 24 Cb 0.44 -0.45 0.18 0.00 -0.26 0.00 0.00 64.21 64.12 2qb9 n SER 24 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2qb9 h ARG 25 N 0.00 0.78 -6.34 4.33 -0.00 -1.91 -3.43 114.38 107.81 2qb9 h ARG 25 Ca 0.42 -0.05 -0.63 0.00 -0.50 0.00 0.00 59.98 59.22 2qb9 h ARG 25 Cb 0.64 -0.17 0.10 0.00 0.00 0.00 0.00 29.97 30.54 2qb9 h ARG 25 CO -0.92 0.51 0.01 0.09 0.00 0.00 0.00 179.97 179.67 2qb9 n ASN 26 N -4.74 0.74 -4.52 7.04 5.03 0.15 -4.90 115.26 114.07 2qb9 n ASN 26 Ca 0.15 1.16 -0.32 0.00 0.87 0.00 0.00 54.58 56.44 2qb9 n ASN 26 Cb 0.31 -1.20 0.14 0.00 -1.02 0.00 0.00 39.78 38.01 2qb9 n ASN 26 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qb9 n ALA 27 N 0.45 -1.91 -1.00 5.41 0.00 -1.26 -4.87 120.51 117.33 2qb9 n ALA 27 Ca 0.13 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.97 2qb9 n ALA 27 Cb 0.29 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.78 2qb9 n ALA 27 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qb9 n ARG 28 N -2.75 0.00 -0.39 0.00 -4.01 -1.26 -1.79 116.66 106.46 2qb9 n ARG 28 Ca 0.09 0.19 -0.01 0.00 -1.04 0.00 0.00 57.85 57.07 2qb9 n ARG 28 Cb 0.53 -0.70 0.01 0.00 -3.04 0.00 0.00 32.46 29.25 2qb9 n ARG 28 CO 0.00 0.00 0.00 0.09 -3.04 0.00 0.00 177.63 174.68 2qb9 n ASN 29 N -0.39 4.71 0.00 2.89 3.02 -1.26 -4.82 115.26 119.41 2qb9 n ASN 29 Ca 0.00 -2.35 0.00 0.00 -0.03 0.00 0.00 54.58 52.20 2qb9 n ASN 29 Cb 0.00 -0.94 0.00 0.00 -0.61 0.00 0.00 39.78 38.23 2qb9 n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qb9 n GLY 30 N 1.09 2.30 3.66 7.41 0.00 -0.74 -5.03 105.19 113.88 2qb9 n GLY 30 Ca 0.03 -1.95 -0.51 0.00 0.00 0.00 0.00 46.02 43.59 2qb9 n GLY 30 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2qb9 n ARG 31 N 0.00 1.62 -4.35 1.61 0.63 -1.26 -4.95 116.66 109.96 2qb9 n ARG 31 Ca 0.00 0.59 -0.19 0.00 -0.92 0.00 0.00 57.85 57.33 2qb9 n ARG 31 Cb 0.00 -2.31 -0.14 0.00 0.45 0.00 0.00 32.46 30.45 2qb9 n ARG 31 CO 0.00 0.00 0.00 -0.59 -2.51 0.00 0.00 177.63 174.53 2qb9 s PHE 32 N 1.95 0.91 0.00 -0.14 -0.71 -1.26 -4.44 117.98 114.29 2qb9 s PHE 32 Ca 0.87 -0.23 0.00 0.00 -1.04 0.00 0.00 56.93 56.53 2qb9 s PHE 32 Cb -0.85 -0.57 0.00 0.00 -1.21 0.00 0.00 43.02 40.39 2qb9 s PHE 32 CO 0.49 -0.01 0.98 -0.89 -1.34 0.00 0.00 175.22 174.46 2qb9 n ILE 33 N 2.51 0.00 -3.79 -4.49 5.41 0.15 -4.85 119.36 114.30 2qb9 n ILE 33 Ca -0.15 1.48 -0.13 0.00 1.00 0.00 0.00 62.75 64.95 2qb9 n ILE 33 Cb 0.56 -2.42 -0.12 0.00 -0.71 0.00 0.00 39.64 36.95 2qb9 n ILE 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 2qb9 s GLU 34 N -2.93 0.23 -0.11 0.38 -1.05 -0.80 -5.01 118.70 109.41 2qb9 s GLU 34 Ca 0.00 0.32 -0.28 0.00 -0.15 0.00 0.00 54.97 54.87 2qb9 s GLU 34 Cb 0.00 0.07 -0.02 0.00 -0.44 0.00 0.00 34.13 33.75 2qb9 s GLU 34 CO 0.00 -0.05 0.92 0.50 0.95 0.00 0.00 175.26 177.57 2qb9 s ARG 35 N 0.31 4.39 -0.31 -4.83 3.00 -1.26 -0.20 118.95 120.06 2qb9 s ARG 35 Ca -0.02 1.22 0.01 0.00 -1.00 0.00 0.00 55.73 55.95 2qb9 s ARG 35 Cb -0.03 -3.54 0.09 0.00 0.00 0.00 0.00 34.95 31.47 2qb9 s ARG 35 CO -0.01 -0.26 0.05 0.54 0.00 0.00 0.00 175.30 175.61 2qb9 s VAL 36 N 1.86 1.58 0.46 7.11 0.11 -1.06 -4.92 120.40 125.54 2qb9 s VAL 36 Ca 0.44 -1.75 0.00 0.00 -2.93 0.00 0.00 61.98 57.74 2qb9 s VAL 36 Cb -0.18 -2.11 0.00 0.00 -1.53 0.00 0.00 36.38 32.56 2qb9 s VAL 36 CO 0.17 -0.53 0.00 0.61 -3.33 0.00 0.00 175.10 172.02 2qb9 n GLY 37 N 4.57 -3.14 0.00 6.54 0.00 -1.26 -4.24 105.19 107.66 2qb9 n GLY 37 Ca -0.02 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2qb9 n GLY 37 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qb9 n PHE 38 N -3.75 0.00 -3.53 1.61 1.16 -1.26 -2.26 117.46 109.44 2qb9 n PHE 38 Ca -0.07 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.38 2qb9 n PHE 38 Cb 0.51 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.33 2qb9 n PHE 38 CO 0.00 0.00 0.00 0.12 -1.87 0.00 0.00 176.76 175.01 2qb9 s PHE 39 N -0.83 -0.49 -0.08 2.97 5.36 -0.78 -1.59 117.98 122.54 2qb9 s PHE 39 Ca 0.00 0.72 -0.02 0.00 -0.96 0.00 0.00 56.93 56.67 2qb9 s PHE 39 Cb 0.00 0.46 0.03 0.00 -0.34 0.00 0.00 43.02 43.17 2qb9 s PHE 39 CO 0.00 -0.53 0.04 1.21 -1.46 0.00 0.00 175.22 174.48 2qb9 s ASN 40 N -1.52 1.56 0.33 6.13 3.84 -0.01 -3.39 114.94 121.89 2qb9 s ASN 40 Ca -0.04 -0.12 0.19 0.00 0.21 0.00 0.00 52.86 53.10 2qb9 s ASN 40 Cb -0.00 -0.29 0.17 0.00 -0.55 0.00 0.00 41.25 40.57 2qb9 s ASN 40 CO 0.02 -0.24 1.46 1.55 -2.79 0.00 0.00 177.10 177.09 2qb9 h PRO 41 N 8.38 0.00 0.00 0.43 0.13 -1.85 -3.42 132.00 135.68 2qb9 h PRO 41 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2qb9 h PRO 41 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2qb9 h PRO 41 CO 0.22 0.26 0.00 -0.89 -0.23 0.00 0.00 178.00 177.35 2qb9 n ILE 42 N -3.13 0.00 -4.72 -3.56 2.08 -1.26 -5.08 119.36 103.70 2qb9 n ILE 42 Ca 0.02 0.22 0.00 0.00 0.56 0.00 0.00 62.75 63.55 2qb9 n ILE 42 Cb 0.64 -1.15 0.00 0.00 -0.75 0.00 0.00 39.64 38.38 2qb9 n ILE 42 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2qb9 n ALA 43 N -1.85 0.00 -2.54 -1.39 0.00 -1.26 -4.79 120.51 108.68 2qb9 n ALA 43 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2qb9 n ALA 43 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 2qb9 n ALA 43 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2qb9 n SER 44 N -3.06 -0.34 -3.52 0.00 3.41 -1.26 -4.90 113.62 103.95 2qb9 n SER 44 Ca 0.00 -1.24 -0.26 0.00 -0.26 0.00 0.00 58.87 57.11 2qb9 n SER 44 Cb 0.00 0.22 -0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2qb9 n SER 44 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2qb9 n GLU 45 N -0.27 -3.73 -0.38 4.33 0.00 -1.26 -4.72 120.64 114.61 2qb9 n GLU 45 Ca -0.06 0.50 -0.04 0.00 0.00 0.00 0.00 57.16 57.56 2qb9 n GLU 45 Cb 0.57 -5.25 -0.06 0.00 0.00 0.00 0.00 31.44 26.70 2qb9 n GLU 45 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 2qb9 n LYS 46 N -3.95 0.75 0.00 5.31 2.85 -1.26 -4.54 118.16 117.32 2qb9 n LYS 46 Ca -0.00 -0.33 0.00 0.00 -1.05 0.00 0.00 58.31 56.93 2qb9 n LYS 46 Cb 0.54 -1.62 0.00 0.00 -0.65 0.00 0.00 35.03 33.30 2qb9 n LYS 46 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2qb9 n GLU 47 N 2.58 0.00 -4.10 -1.58 -0.58 -1.26 -4.77 120.64 110.92 2qb9 n GLU 47 Ca 0.14 0.00 -0.18 0.00 -0.42 0.00 0.00 57.16 56.70 2qb9 n GLU 47 Cb 0.35 -2.24 -0.07 0.00 -0.57 0.00 0.00 31.44 28.91 2qb9 n GLU 47 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2qb9 n GLU 48 N -0.92 0.43 0.00 3.49 4.07 -1.26 -5.06 120.64 121.39 2qb9 n GLU 48 Ca 0.00 -3.12 0.00 0.00 -0.06 0.00 0.00 57.16 53.98 2qb9 n GLU 48 Cb 0.00 2.62 0.00 0.00 -0.06 0.00 0.00 31.44 34.00 2qb9 n GLU 48 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qb9 n GLY 49 N -0.60 0.00 3.45 8.31 0.00 -1.26 -4.57 105.19 110.52 2qb9 n GLY 49 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 2qb9 n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qb9 s THR 50 N 0.00 0.01 0.24 2.61 2.01 -1.26 -0.83 115.64 118.42 2qb9 s THR 50 Ca 0.00 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 2qb9 s THR 50 Cb 0.00 -1.17 0.01 0.00 0.01 0.00 0.00 72.50 71.34 2qb9 s THR 50 CO 0.00 -0.06 0.34 -1.14 -0.69 0.00 0.00 174.62 173.07 2qb9 n ARG 51 N -0.36 0.50 0.00 4.92 3.00 -0.62 -4.94 116.66 119.16 2qb9 n ARG 51 Ca -0.15 -1.85 0.00 0.00 -0.00 0.00 0.00 57.85 55.85 2qb9 n ARG 51 Cb 0.64 1.81 0.00 0.00 0.00 0.00 0.00 32.46 34.91 2qb9 n ARG 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2qb9 n LEU 52 N 0.00 0.00 -3.63 6.15 7.94 -1.26 -4.38 117.00 121.81 2qb9 n LEU 52 Ca -0.00 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 54.69 2qb9 n LEU 52 Cb 0.39 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.40 2qb9 n LEU 52 CO 0.19 0.00 0.02 -0.67 -1.11 0.00 0.00 177.39 175.83 2qb9 n ASP 53 N -0.72 -2.13 -0.22 1.96 2.03 -1.26 -4.19 116.55 112.02 2qb9 n ASP 53 Ca 0.00 -0.74 0.03 0.00 0.52 0.00 0.00 54.79 54.60 2qb9 n ASP 53 Cb 0.00 -4.43 0.08 0.00 -0.72 0.00 0.00 41.12 36.05 2qb9 n ASP 53 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2qb9 n LEU 54 N -4.32 -0.24 -0.36 -2.67 4.77 -1.26 -0.93 117.00 111.99 2qb9 n LEU 54 Ca -0.24 1.04 -0.05 0.00 -0.03 0.00 0.00 56.01 56.73 2qb9 n LEU 54 Cb 0.65 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.42 2qb9 n LEU 54 CO 0.67 -0.99 0.55 -0.78 -1.33 0.00 0.00 177.39 175.51 2qb9 h ASP 55 N 0.00 -1.65 -0.45 -1.43 3.58 -1.99 0.20 116.42 114.68 2qb9 h ASP 55 Ca 0.28 0.30 -0.14 0.00 0.42 0.00 0.00 57.03 57.90 2qb9 h ASP 55 Cb 0.43 0.80 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 2qb9 h ASP 55 CO -0.62 -0.28 -0.26 0.03 -2.88 0.00 0.00 179.24 175.23 2qb9 h ARG 56 N -0.04 0.98 -0.36 0.28 2.47 -1.37 -3.16 114.38 113.18 2qb9 h ARG 56 Ca 0.27 -0.44 0.08 0.00 -1.26 0.00 0.00 59.98 58.62 2qb9 h ARG 56 Cb 0.54 -0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 28.75 2qb9 h ARG 56 CO -0.92 1.12 -0.23 0.82 0.56 0.00 0.00 179.97 181.31 2qb9 h ILE 57 N 0.83 0.37 -0.43 2.04 1.08 -0.44 -1.99 117.51 118.97 2qb9 h ILE 57 Ca 0.10 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.65 2qb9 h ILE 57 Cb 0.84 0.37 -0.08 0.00 -3.07 0.00 0.00 36.82 34.89 2qb9 h ILE 57 CO 0.07 0.00 -0.05 0.00 -0.69 0.00 0.00 178.15 177.48 2qb9 h ALA 58 N 0.98 0.35 -0.46 1.87 0.00 -0.87 -2.15 119.26 118.97 2qb9 h ALA 58 Ca 0.18 0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.29 2qb9 h ALA 58 Cb 0.46 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.44 2qb9 h ALA 58 CO -0.47 -0.42 -0.51 1.25 0.00 0.00 0.00 179.25 179.10 2qb9 h HIS 59 N 0.05 -1.57 -0.17 0.00 -0.00 -1.34 -0.47 115.15 111.66 2qb9 h HIS 59 Ca 0.21 0.08 0.00 0.00 -0.00 0.00 0.00 60.37 60.66 2qb9 h HIS 59 Cb 0.32 0.75 -0.01 0.00 -0.00 0.00 0.00 27.41 28.47 2qb9 h HIS 59 CO -0.33 -0.42 0.11 -1.49 -0.00 0.00 0.00 177.93 175.79 2qb9 h TRP 60 N -0.30 0.21 -0.67 5.26 4.06 -1.42 -2.82 115.95 120.28 2qb9 h TRP 60 Ca 0.08 0.00 0.12 0.00 2.06 0.00 0.00 58.89 61.15 2qb9 h TRP 60 Cb 0.51 -0.07 -0.09 0.00 -1.00 0.00 0.00 29.16 28.51 2qb9 h TRP 60 CO -0.77 0.16 0.23 0.28 -3.56 0.00 0.00 178.44 174.77 2qb9 h VAL 61 N 0.21 0.68 0.00 1.49 2.07 -0.90 0.34 116.25 120.13 2qb9 h VAL 61 Ca 0.06 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2qb9 h VAL 61 Cb 0.00 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2qb9 h VAL 61 CO -0.01 0.07 0.00 0.61 0.02 0.00 0.00 177.57 178.26 2qb9 n GLY 62 N -1.32 -1.15 0.98 2.17 0.00 -0.23 -1.97 105.19 103.68 2qb9 n GLY 62 Ca 0.11 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2qb9 n GLY 62 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qb9 n GLN 63 N -1.92 2.32 0.00 1.61 6.02 0.11 -4.91 117.38 120.61 2qb9 n GLN 63 Ca 0.03 -1.95 0.00 0.00 -0.01 0.00 0.00 57.00 55.06 2qb9 n GLN 63 Cb 0.20 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.98 2qb9 n GLN 63 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qb9 n GLY 64 N 1.39 1.05 3.77 1.08 0.00 -0.83 -5.07 105.19 106.57 2qb9 n GLY 64 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2qb9 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qb9 s ALA 65 N -1.99 3.62 -0.75 4.61 0.00 -0.42 -4.74 121.76 122.09 2qb9 s ALA 65 Ca 0.00 1.57 -0.02 0.00 0.00 0.00 0.00 51.96 53.50 2qb9 s ALA 65 Cb 0.00 -3.62 0.19 0.00 0.00 0.00 0.00 23.12 19.69 2qb9 s ALA 65 CO 0.00 -1.03 0.59 0.99 0.00 0.00 0.00 175.76 176.31 2qb9 s THR 66 N -0.84 3.98 0.07 0.00 2.01 -0.43 -4.56 115.64 115.87 2qb9 s THR 66 Ca 0.55 -3.41 -0.36 0.00 0.31 0.00 0.00 61.69 58.79 2qb9 s THR 66 Cb -0.47 -3.54 -0.15 0.00 0.01 0.00 0.00 72.50 68.35 2qb9 s THR 66 CO 0.59 -0.98 1.49 0.00 -0.69 0.00 0.00 174.62 175.03 2qb9 n ILE 67 N 2.92 0.06 -0.53 1.82 0.13 -1.26 -3.39 119.36 119.12 2qb9 n ILE 67 Ca 0.14 -0.01 -0.14 0.00 -1.10 0.00 0.00 62.75 61.64 2qb9 n ILE 67 Cb 0.37 -1.15 0.13 0.00 -0.84 0.00 0.00 39.64 38.15 2qb9 n ILE 67 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 2qb9 n SER 68 N 3.32 -2.07 -0.00 9.51 3.41 -0.68 -4.82 113.62 122.28 2qb9 n SER 68 Ca 0.19 -0.68 -0.01 0.00 -0.26 0.00 0.00 58.87 58.12 2qb9 n SER 68 Cb 0.22 -0.48 -0.00 0.00 -0.26 0.00 0.00 64.21 63.69 2qb9 n SER 68 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2qb9 h ASP 69 N -2.17 -0.04 -0.80 4.04 3.32 -1.92 -2.89 116.42 115.95 2qb9 h ASP 69 Ca -0.19 0.00 0.18 0.00 0.02 0.00 0.00 57.03 57.03 2qb9 h ASP 69 Cb 0.61 0.01 -0.11 0.00 0.22 0.00 0.00 39.33 40.06 2qb9 h ASP 69 CO 0.12 0.18 0.28 -0.09 -1.72 0.00 0.00 179.24 178.01 2qb9 h ARG 70 N -0.47 0.34 -0.26 3.56 9.65 -1.96 -1.34 114.38 123.90 2qb9 h ARG 70 Ca -0.00 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.82 2qb9 h ARG 70 Cb 0.04 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 2qb9 h ARG 70 CO 0.01 0.23 0.02 -0.24 2.80 0.00 0.00 179.97 182.79 2qb9 h VAL 71 N 0.35 1.24 -0.89 0.20 3.04 -1.88 -2.95 116.25 115.36 2qb9 h VAL 71 Ca 0.46 -0.84 0.11 0.00 -1.01 0.00 0.00 66.70 65.42 2qb9 h VAL 71 Cb 0.81 1.29 -0.08 0.00 -2.01 0.00 0.00 31.29 31.30 2qb9 h VAL 71 CO -0.50 0.27 0.53 0.00 -1.01 0.00 0.00 177.57 176.86 2qb9 h ALA 72 N 0.84 1.31 -0.89 3.17 0.00 -1.06 -0.44 119.26 122.19 2qb9 h ALA 72 Ca 0.08 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.14 2qb9 h ALA 72 Cb 0.37 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 2qb9 h ALA 72 CO 0.01 0.12 0.52 0.00 0.00 0.00 0.00 179.25 179.90 2qb9 h ALA 73 N 1.50 1.32 -0.49 0.00 0.00 -1.14 -1.39 119.26 119.06 2qb9 h ALA 73 Ca 0.44 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.42 2qb9 h ALA 73 Cb 0.44 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2qb9 h ALA 73 CO -0.27 0.09 0.29 -0.07 0.00 0.00 0.00 179.25 179.30 2qb9 h LEU 74 N 0.82 0.47 -0.89 0.00 3.38 -1.02 -1.01 115.31 117.07 2qb9 h LEU 74 Ca 0.45 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.56 2qb9 h LEU 74 Cb 0.48 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.05 2qb9 h LEU 74 CO -0.28 0.34 0.51 0.40 0.09 0.00 0.00 178.44 179.49 2qb9 h ILE 75 N 0.58 0.81 -0.09 1.22 2.04 -1.06 -1.83 117.51 119.18 2qb9 h ILE 75 Ca 0.19 -0.26 -0.10 0.00 1.00 0.00 0.00 64.86 65.69 2qb9 h ILE 75 Cb 0.01 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 2qb9 h ILE 75 CO -0.09 0.14 -0.34 0.11 0.00 0.00 0.00 178.15 177.97 2qb9 h LYS 76 N 0.76 0.39 -0.63 2.37 1.79 -1.20 -3.28 116.57 116.77 2qb9 h LYS 76 Ca 0.47 -0.30 0.10 0.00 -2.18 0.00 0.00 60.65 58.74 2qb9 h LYS 76 Cb 0.58 0.06 -0.08 0.00 -1.58 0.00 0.00 32.23 31.20 2qb9 h LYS 76 CO -0.32 0.93 0.22 0.93 -1.08 0.00 0.00 179.45 180.13 2qb9 h GLU 77 N -0.06 0.37 -6.32 3.15 5.08 -0.62 -3.40 114.58 112.78 2qb9 h GLU 77 Ca -0.02 -0.02 -0.54 0.00 -1.00 0.00 0.00 59.36 57.78 2qb9 h GLU 77 Cb 0.97 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.10 2qb9 h GLU 77 CO 0.07 0.24 0.13 0.54 -1.00 0.00 0.00 179.01 179.00 2qb9 s VAL 78 N -6.09 4.66 -0.30 3.13 0.11 -0.74 -4.94 120.40 116.24 2qb9 s VAL 78 Ca -0.13 1.57 -0.35 0.00 -2.93 0.00 0.00 61.98 60.15 2qb9 s VAL 78 Cb 0.18 -4.08 -0.11 0.00 -1.53 0.00 0.00 36.38 30.83 2qb9 s VAL 78 CO 0.75 0.42 2.11 0.59 -3.33 0.00 0.00 175.10 175.64 2qb9 n ASN 79 N 2.42 2.38 0.06 3.54 3.02 -1.26 -4.79 115.26 120.62 2qb9 n ASN 79 Ca -0.04 0.53 -0.19 0.00 -0.03 0.00 0.00 54.58 54.84 2qb9 n ASN 79 Cb 0.50 -1.28 -0.14 0.00 -0.61 0.00 0.00 39.78 38.24 2qb9 n ASN 79 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2qb9 h LYS 80 N 11.71 0.29 0.00 3.52 3.11 -1.83 -3.26 116.57 130.11 2qb9 h LYS 80 Ca -0.32 -0.50 0.00 0.00 -2.81 0.00 0.00 60.65 57.02 2qb9 h LYS 80 Cb 1.31 0.19 0.00 0.00 -1.00 0.00 0.00 32.23 32.73 2qb9 h LYS 80 CO 1.00 1.17 0.00 0.00 -2.81 0.00 0.00 179.45 178.81 2qb9 n ALA 81 N -2.77 2.35 0.78 5.00 0.00 -1.26 -5.08 120.51 119.53 2qb9 n ALA 81 Ca -0.21 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.20 2qb9 n ALA 81 Cb 1.06 -1.32 0.08 0.00 0.00 0.00 0.00 19.45 19.27 2qb9 n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50