#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qb9 s GLN 4 N 0.00 4.55 0.09 1.20 0.74 -1.26 -4.60 119.66 120.38 2qb9 s GLN 4 Ca 0.00 1.16 0.07 0.00 0.05 0.00 0.00 55.36 56.64 2qb9 s GLN 4 Cb 0.00 -3.17 -0.03 0.00 1.10 0.00 0.00 33.01 30.91 2qb9 s GLN 4 CO 0.00 0.52 -0.18 0.71 -0.55 0.00 0.00 175.29 175.79 2qb9 s TYR 5 N -1.24 1.58 -0.08 1.67 4.12 0.52 -5.00 117.35 118.92 2qb9 s TYR 5 Ca 0.38 -0.44 0.02 0.00 0.02 0.00 0.00 57.07 57.06 2qb9 s TYR 5 Cb -0.22 -0.87 0.01 0.00 -1.52 0.00 0.00 41.96 39.37 2qb9 s TYR 5 CO 0.26 0.15 -0.13 -0.47 0.02 0.00 0.00 175.55 175.38 2qb9 s TYR 6 N -1.24 1.62 -0.17 2.71 6.14 -1.26 -0.26 117.35 124.88 2qb9 s TYR 6 Ca 0.04 -0.66 0.00 0.00 0.64 0.00 0.00 57.07 57.09 2qb9 s TYR 6 Cb -0.10 -1.19 0.01 0.00 0.42 0.00 0.00 41.96 41.10 2qb9 s TYR 6 CO 0.04 -0.35 -0.17 0.20 0.64 0.00 0.00 175.55 175.90 2qb9 s GLY 7 N 0.84 1.43 0.00 8.97 0.00 0.13 -4.58 107.32 114.10 2qb9 s GLY 7 Ca -0.11 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.45 2qb9 s GLY 7 CO 0.01 0.21 0.00 -1.30 0.00 0.00 0.00 173.10 172.02 2qb9 n THR 8 N 4.46 0.00 -0.51 0.90 -2.24 -1.26 -1.33 114.28 114.30 2qb9 n THR 8 Ca -0.20 0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 2qb9 n THR 8 Cb 0.51 -1.25 0.00 0.00 -2.10 0.00 0.00 70.33 67.49 2qb9 n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qb9 n GLY 9 N 0.20 -3.79 3.60 3.38 0.00 -1.26 -3.58 105.19 103.73 2qb9 n GLY 9 Ca 0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 46.02 45.14 2qb9 n GLY 9 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qb9 s ARG 10 N -3.51 0.34 -0.27 1.61 1.70 -1.25 -1.05 118.95 116.52 2qb9 s ARG 10 Ca 0.00 -0.01 -0.26 0.00 -0.47 0.00 0.00 55.73 54.99 2qb9 s ARG 10 Cb 0.00 0.16 0.14 0.00 -0.57 0.00 0.00 34.95 34.68 2qb9 s ARG 10 CO 0.00 -0.13 1.14 -0.98 -1.08 0.00 0.00 175.30 174.26 2qb9 s ARG 11 N -1.66 0.39 -0.91 3.89 1.70 -0.52 -4.74 118.95 117.09 2qb9 s ARG 11 Ca 0.06 0.38 -0.05 0.00 -0.47 0.00 0.00 55.73 55.65 2qb9 s ARG 11 Cb -0.01 0.19 -0.02 0.00 -0.57 0.00 0.00 34.95 34.54 2qb9 s ARG 11 CO -0.04 -0.06 0.78 1.63 -1.08 0.00 0.00 175.30 176.52 2qb9 n LYS 12 N 1.78 -1.62 -2.76 3.89 5.02 -1.25 -2.32 118.16 120.90 2qb9 n LYS 12 Ca -0.11 1.07 -0.11 0.00 -2.02 0.00 0.00 58.31 57.14 2qb9 n LYS 12 Cb 0.56 -5.22 -0.01 0.00 -0.02 0.00 0.00 35.03 30.34 2qb9 n LYS 12 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2qb9 n SER 13 N -2.45 -2.58 -3.91 4.39 3.41 -1.26 -4.48 113.62 106.73 2qb9 n SER 13 Ca -0.07 0.12 -0.30 0.00 -0.26 0.00 0.00 58.87 58.36 2qb9 n SER 13 Cb 0.57 -2.24 -0.15 0.00 -0.26 0.00 0.00 64.21 62.13 2qb9 n SER 13 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2qb9 s SER 14 N -2.22 4.04 -0.25 4.04 0.15 -0.98 -2.34 113.70 116.14 2qb9 s SER 14 Ca 0.12 -1.44 -0.10 0.00 0.70 0.00 0.00 55.95 55.23 2qb9 s SER 14 Cb -0.07 -1.20 -0.05 0.00 -1.71 0.00 0.00 66.02 63.00 2qb9 s SER 14 CO 0.15 -0.30 0.16 0.00 1.20 0.00 0.00 173.24 174.46 2qb9 s ALA 15 N 1.35 3.55 0.24 5.45 0.00 -1.00 -1.44 121.76 129.91 2qb9 s ALA 15 Ca 0.00 -0.97 0.08 0.00 0.00 0.00 0.00 51.96 51.08 2qb9 s ALA 15 Cb -0.19 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2qb9 s ALA 15 CO -0.10 -0.32 0.06 0.00 0.00 0.00 0.00 175.76 175.40 2qb9 s ALA 16 N 1.31 3.31 -0.26 0.00 0.00 -0.21 -1.84 121.76 124.05 2qb9 s ALA 16 Ca 0.07 -1.52 -0.04 0.00 0.00 0.00 0.00 51.96 50.47 2qb9 s ALA 16 Cb -0.14 -0.99 0.09 0.00 0.00 0.00 0.00 23.12 22.08 2qb9 s ALA 16 CO 0.07 0.31 0.12 1.03 0.00 0.00 0.00 175.76 177.29 2qb9 s ARG 17 N -3.57 0.17 0.08 0.00 0.52 0.15 -4.18 118.95 112.12 2qb9 s ARG 17 Ca 0.31 -0.44 0.03 0.00 -0.52 0.00 0.00 55.73 55.11 2qb9 s ARG 17 Cb -0.07 -1.32 -0.04 0.00 0.52 0.00 0.00 34.95 34.04 2qb9 s ARG 17 CO 0.21 -0.94 0.10 0.08 0.02 0.00 0.00 175.30 174.77 2qb9 s VAL 18 N 2.10 4.62 -0.59 3.52 1.01 -0.44 0.28 120.40 130.89 2qb9 s VAL 18 Ca 0.07 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2qb9 s VAL 18 Cb -0.16 -3.24 0.16 0.00 0.00 0.00 0.00 36.38 33.14 2qb9 s VAL 18 CO -0.31 0.12 0.41 -0.36 0.00 0.00 0.00 175.10 174.96 2qb9 s PHE 19 N -1.42 2.81 -0.04 5.22 0.08 0.81 0.19 117.98 125.63 2qb9 s PHE 19 Ca 0.30 -3.00 -0.31 0.00 0.12 0.00 0.00 56.93 54.05 2qb9 s PHE 19 Cb -0.12 -2.23 -0.09 0.00 -0.57 0.00 0.00 43.02 40.00 2qb9 s PHE 19 CO 0.23 -0.65 2.01 -0.89 -0.10 0.00 0.00 175.22 175.81 2qb9 n ILE 20 N 2.46 0.65 -4.05 0.64 -0.00 0.64 -1.29 119.36 118.41 2qb9 n ILE 20 Ca 0.19 -0.19 -0.11 0.00 -0.00 0.00 0.00 62.75 62.64 2qb9 n ILE 20 Cb 0.37 -2.26 -0.11 0.00 -0.00 0.00 0.00 39.64 37.64 2qb9 n ILE 20 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 2qb9 s LYS 21 N 4.76 0.49 -0.79 0.38 2.20 0.99 -0.35 119.74 127.42 2qb9 s LYS 21 Ca 0.92 -0.79 -0.06 0.00 -0.36 0.00 0.00 55.97 55.68 2qb9 s LYS 21 Cb -0.48 -0.11 -0.05 0.00 -1.51 0.00 0.00 37.83 35.68 2qb9 s LYS 21 CO 0.43 -0.00 1.96 -0.35 -0.36 0.00 0.00 175.35 177.03 2qb9 n PRO 22 N 1.27 1.78 -2.40 4.03 -0.04 -1.26 0.16 135.00 138.54 2qb9 n PRO 22 Ca -0.22 -1.37 -0.33 0.00 -0.04 0.00 0.00 63.50 61.55 2qb9 n PRO 22 Cb 0.56 -2.43 0.01 0.00 -0.04 0.00 0.00 33.50 31.60 2qb9 n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qb9 n GLY 23 N 3.85 5.81 5.00 0.55 0.00 -1.26 -4.69 105.19 114.45 2qb9 n GLY 23 Ca 0.39 -2.66 0.00 0.00 0.00 0.00 0.00 46.02 43.76 2qb9 n GLY 23 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qb9 n ASN 24 N -0.40 0.00 0.00 1.61 6.94 -1.26 -2.66 115.26 119.49 2qb9 n ASN 24 Ca 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.99 2qb9 n ASN 24 Cb 0.42 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.84 2qb9 n ASN 24 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qb9 n GLY 25 N 0.00 0.00 3.85 4.83 0.00 -0.59 0.15 105.19 113.43 2qb9 n GLY 25 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qb9 n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qb9 s LYS 26 N 0.00 3.97 -0.18 1.61 2.20 -1.09 -4.52 119.74 121.73 2qb9 s LYS 26 Ca 0.00 0.73 -0.02 0.00 -0.36 0.00 0.00 55.97 56.32 2qb9 s LYS 26 Cb 0.00 -2.34 0.05 0.00 -1.51 0.00 0.00 37.83 34.04 2qb9 s LYS 26 CO 0.00 0.01 -0.00 0.42 -0.36 0.00 0.00 175.35 175.42 2qb9 s ILE 27 N -2.22 0.80 -0.49 5.43 1.09 -1.26 -2.75 121.20 121.80 2qb9 s ILE 27 Ca 0.55 -0.62 0.03 0.00 -1.10 0.00 0.00 60.65 59.52 2qb9 s ILE 27 Cb -0.10 -1.16 0.14 0.00 -1.06 0.00 0.00 42.46 40.28 2qb9 s ILE 27 CO 0.23 -0.07 0.28 -0.69 -0.10 0.00 0.00 174.94 174.59 2qb9 s VAL 28 N 1.74 1.83 -0.11 2.92 1.01 -1.25 -2.38 120.40 124.17 2qb9 s VAL 28 Ca -0.01 -2.99 -0.23 0.00 0.00 0.00 0.00 61.98 58.75 2qb9 s VAL 28 Cb -0.16 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 2qb9 s VAL 28 CO -0.07 -0.91 0.72 -0.63 0.00 0.00 0.00 175.10 174.21 2qb9 s ILE 29 N -0.07 5.01 -1.68 2.22 1.01 -0.57 -2.22 121.20 124.90 2qb9 s ILE 29 Ca 0.19 1.45 -0.13 0.00 0.00 0.00 0.00 60.65 62.16 2qb9 s ILE 29 Cb -0.20 -4.05 0.12 0.00 0.01 0.00 0.00 42.46 38.34 2qb9 s ILE 29 CO -0.03 0.18 0.52 0.59 0.00 0.00 0.00 174.94 176.20 2qb9 n ASN 30 N 4.29 -1.55 -1.93 3.58 5.03 -0.07 0.35 115.26 124.95 2qb9 n ASN 30 Ca 0.00 -1.13 -0.15 0.00 0.87 0.00 0.00 54.58 54.17 2qb9 n ASN 30 Cb 0.51 -2.25 0.01 0.00 -1.02 0.00 0.00 39.78 37.02 2qb9 n ASN 30 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qb9 n GLN 31 N -4.34 -2.28 -4.37 3.52 6.02 -1.26 -5.01 117.38 109.66 2qb9 n GLN 31 Ca -0.06 0.68 -0.20 0.00 -0.01 0.00 0.00 57.00 57.42 2qb9 n GLN 31 Cb 0.55 -5.00 -0.10 0.00 1.02 0.00 0.00 30.24 26.72 2qb9 n GLN 31 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2qb9 s ARG 32 N -5.03 1.60 0.65 -1.09 0.52 0.16 -5.11 118.95 110.64 2qb9 s ARG 32 Ca 0.10 -1.91 -0.10 0.00 -0.52 0.00 0.00 55.73 53.30 2qb9 s ARG 32 Cb -0.05 -0.33 -0.01 0.00 0.52 0.00 0.00 34.95 35.09 2qb9 s ARG 32 CO 0.13 -0.37 1.03 0.45 0.02 0.00 0.00 175.30 176.55 2qb9 s SER 33 N -3.41 5.76 0.02 0.23 0.15 -1.26 -1.51 113.70 113.68 2qb9 s SER 33 Ca 0.35 1.15 -0.08 0.00 0.70 0.00 0.00 55.95 58.07 2qb9 s SER 33 Cb 0.06 -2.09 -0.04 0.00 -1.71 0.00 0.00 66.02 62.24 2qb9 s SER 33 CO 0.16 -1.11 1.12 0.25 1.20 0.00 0.00 173.24 174.86 2qb9 h LEU 34 N -0.43 -0.29 -2.40 3.45 5.85 -1.86 -2.19 115.31 117.43 2qb9 h LEU 34 Ca -0.45 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2qb9 h LEU 34 Cb 1.23 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.35 2qb9 h LEU 34 CO 0.63 -0.15 0.00 -0.62 -0.34 0.00 0.00 178.44 177.95 2qb9 n GLU 35 N -2.92 0.82 -0.03 1.25 4.71 -1.26 -3.04 120.64 120.17 2qb9 n GLU 35 Ca -0.03 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.04 2qb9 n GLU 35 Cb 0.11 -1.09 -0.03 0.00 -1.01 0.00 0.00 31.44 29.42 2qb9 n GLU 35 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 2qb9 n GLN 36 N 0.93 0.21 0.18 3.49 -0.06 -0.84 -3.03 117.38 118.26 2qb9 n GLN 36 Ca 0.00 0.09 0.07 0.00 -2.00 0.00 0.00 57.00 55.16 2qb9 n GLN 36 Cb 0.41 -0.86 0.09 0.00 -4.06 0.00 0.00 30.24 25.82 2qb9 n GLN 36 CO 0.00 0.00 0.00 -0.92 -0.20 0.00 0.00 177.06 175.94 2qb9 h TYR 37 N -0.37 0.00 0.00 3.69 3.20 -1.52 -3.31 116.97 118.66 2qb9 h TYR 37 Ca -0.14 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.73 2qb9 h TYR 37 Cb 0.84 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.11 2qb9 h TYR 37 CO -0.09 0.25 -0.01 1.19 -1.64 0.00 0.00 178.16 177.86 2qb9 n PHE 38 N -3.15 0.00 -1.48 -3.82 0.99 -1.17 -5.05 117.46 103.78 2qb9 n PHE 38 Ca 0.03 -0.19 -0.41 0.00 -0.00 0.00 0.00 57.45 56.88 2qb9 n PHE 38 Cb 0.64 -0.02 0.01 0.00 -1.00 0.00 0.00 39.48 39.11 2qb9 n PHE 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2qb9 n GLY 39 N -0.20 -1.29 4.35 1.37 0.00 -1.17 -2.38 105.19 105.88 2qb9 n GLY 39 Ca 0.00 0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 2qb9 n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2qb9 n ARG 40 N 0.39 -1.60 -3.80 1.61 0.63 -1.26 -4.90 116.66 107.72 2qb9 n ARG 40 Ca 0.11 0.21 -0.12 0.00 -0.92 0.00 0.00 57.85 57.12 2qb9 n ARG 40 Cb 0.41 -4.49 -0.12 0.00 0.45 0.00 0.00 32.46 28.71 2qb9 n ARG 40 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2qb9 s GLU 41 N -7.14 0.29 0.00 -0.14 2.02 -1.00 -5.01 118.70 107.71 2qb9 s GLU 41 Ca 0.51 0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.73 2qb9 s GLU 41 Cb -0.29 0.14 0.00 0.00 0.10 0.00 0.00 34.13 34.07 2qb9 s GLU 41 CO 0.98 -0.04 0.08 -2.37 0.02 0.00 0.00 175.26 173.93 2qb9 n THR 42 N 2.77 0.00 -0.08 3.63 5.66 -1.26 -3.01 114.28 121.99 2qb9 n THR 42 Ca -0.14 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.77 2qb9 n THR 42 Cb 0.58 -0.30 -0.05 0.00 -1.55 0.00 0.00 70.33 69.01 2qb9 n THR 42 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qb9 h ALA 43 N 1.15 0.07 0.00 1.79 0.00 -1.95 -3.37 119.26 116.95 2qb9 h ALA 43 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2qb9 h ALA 43 Cb 0.02 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2qb9 h ALA 43 CO 0.00 0.39 0.08 2.89 0.00 0.00 0.00 179.25 182.62 2qb9 n ARG 44 N -4.60 0.00 0.08 0.00 1.85 -1.17 -1.04 116.66 111.78 2qb9 n ARG 44 Ca -0.13 0.27 -0.23 0.00 -1.00 0.00 0.00 57.85 56.76 2qb9 n ARG 44 Cb 0.35 -1.58 -0.15 0.00 -1.05 0.00 0.00 32.46 30.02 2qb9 n ARG 44 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qb9 h MET 45 N 0.00 0.41 0.00 2.89 -0.00 -1.78 -3.25 114.93 113.20 2qb9 h MET 45 Ca 0.00 -0.70 -0.04 0.00 -0.00 0.00 0.00 59.70 58.97 2qb9 h MET 45 Cb 0.16 0.26 -0.01 0.00 -0.00 0.00 0.00 31.60 32.02 2qb9 h MET 45 CO 0.00 1.33 -0.18 -0.39 -0.00 0.00 0.00 176.91 177.67 2qb9 h VAL 46 N 0.07 1.12 0.00 -0.10 -1.51 -1.27 -1.05 116.25 113.51 2qb9 h VAL 46 Ca -0.33 -0.63 -0.07 0.00 -1.23 0.00 0.00 66.70 64.44 2qb9 h VAL 46 Cb 2.08 1.34 -0.01 0.00 -2.13 0.00 0.00 31.29 32.57 2qb9 h VAL 46 CO 0.18 0.18 -0.34 -0.37 -1.23 0.00 0.00 177.57 176.00 2qb9 h VAL 47 N 0.00 0.75 0.00 7.19 -1.51 -1.65 -2.99 116.25 118.03 2qb9 h VAL 47 Ca -0.00 -1.49 -0.00 0.00 -1.23 0.00 0.00 66.70 63.97 2qb9 h VAL 47 Cb 0.33 1.96 -0.00 0.00 -2.13 0.00 0.00 31.29 31.44 2qb9 h VAL 47 CO 0.02 0.33 -0.69 0.03 -1.23 0.00 0.00 177.57 176.03 2qb9 h ARG 48 N 0.00 0.00 -0.49 5.19 3.08 -1.26 -3.37 114.38 117.53 2qb9 h ARG 48 Ca -0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.15 2qb9 h ARG 48 Cb 0.93 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.89 2qb9 h ARG 48 CO 0.04 0.01 -0.11 1.96 -1.07 0.00 0.00 179.97 180.80 2qb9 h GLN 49 N 0.00 0.01 0.00 0.04 4.20 -1.19 1.29 115.11 119.46 2qb9 h GLN 49 Ca -0.00 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2qb9 h GLN 49 Cb 1.02 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.79 2qb9 h GLN 49 CO 0.00 0.01 0.00 -0.35 -0.67 0.00 0.00 178.83 177.82 2qb9 n PRO 50 N -5.35 0.26 -0.01 1.46 -0.04 -1.26 -2.21 135.00 127.85 2qb9 n PRO 50 Ca 0.04 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.49 2qb9 n PRO 50 Cb 0.26 -1.29 -0.01 0.00 -0.04 0.00 0.00 33.50 32.43 2qb9 n PRO 50 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2qb9 n LEU 51 N -0.79 0.89 0.00 1.53 4.77 0.22 -4.36 117.00 119.27 2qb9 n LEU 51 Ca 0.04 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2qb9 n LEU 51 Cb 0.02 -0.06 0.01 0.00 -2.33 0.00 0.00 43.42 41.06 2qb9 n LEU 51 CO 0.03 0.17 0.50 -0.62 -1.33 0.00 0.00 177.39 176.14 2qb9 n GLU 52 N -2.94 0.00 -0.07 3.23 -0.58 0.38 0.13 120.64 120.79 2qb9 n GLU 52 Ca -0.04 0.44 -0.06 0.00 -0.42 0.00 0.00 57.16 57.09 2qb9 n GLU 52 Cb 0.53 -1.56 -0.12 0.00 -0.57 0.00 0.00 31.44 29.71 2qb9 n GLU 52 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2qb9 n LEU 53 N -1.45 0.00 -0.57 -4.62 -0.00 -1.04 -4.53 117.00 104.79 2qb9 n LEU 53 Ca -0.00 0.00 0.06 0.00 -0.00 0.00 0.00 56.01 56.07 2qb9 n LEU 53 Cb 0.06 0.33 0.10 0.00 -0.00 0.00 0.00 43.42 43.91 2qb9 n LEU 53 CO 0.00 0.33 0.52 1.33 -0.00 0.00 0.00 177.39 179.58 2qb9 n VAL 54 N -2.51 0.42 -1.06 1.96 0.24 -0.15 -5.09 118.33 112.15 2qb9 n VAL 54 Ca -0.22 -0.71 0.00 0.00 -2.04 0.00 0.00 64.34 61.37 2qb9 n VAL 54 Cb 0.93 0.93 0.00 0.00 -1.47 0.00 0.00 33.84 34.24 2qb9 n VAL 54 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2qb9 n ASP 55 N 0.64 -6.04 -0.03 -1.34 8.00 0.34 -5.03 116.55 113.08 2qb9 n ASP 55 Ca 0.09 0.74 0.00 0.00 0.71 0.00 0.00 54.79 56.33 2qb9 n ASP 55 Cb 0.36 -2.41 0.00 0.00 -0.02 0.00 0.00 41.12 39.04 2qb9 n ASP 55 CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 2qb9 n MET 56 N 0.18 0.00 0.00 -1.24 0.00 -1.25 -4.70 117.12 110.10 2qb9 n MET 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2qb9 n MET 56 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2qb9 n MET 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2qb9 n VAL 57 N 0.00 0.00 -1.61 3.17 0.31 -0.16 -4.05 118.33 116.00 2qb9 n VAL 57 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 2qb9 n VAL 57 Cb 0.00 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 32.96 2qb9 n VAL 57 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2qb9 n GLU 58 N -0.58 0.41 0.00 5.55 0.00 -0.06 -3.42 120.64 122.53 2qb9 n GLU 58 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 57.16 55.83 2qb9 n GLU 58 Cb 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 31.44 30.69 2qb9 n GLU 58 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2qb9 n LYS 59 N -0.35 0.30 -3.58 3.44 5.02 0.94 -4.90 118.16 119.04 2qb9 n LYS 59 Ca 0.04 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.35 2qb9 n LYS 59 Cb 0.65 -0.75 -0.00 0.00 -0.02 0.00 0.00 35.03 34.91 2qb9 n LYS 59 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2qb9 s LEU 60 N -3.77 -0.02 0.00 -0.35 2.34 0.41 -4.23 118.68 113.06 2qb9 s LEU 60 Ca 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 54.13 54.14 2qb9 s LEU 60 Cb 0.00 1.15 0.00 0.00 -0.56 0.00 0.00 46.19 46.78 2qb9 s LEU 60 CO 0.00 -0.12 0.00 -0.90 -1.06 0.00 0.00 176.35 174.27 2qb9 n ASP 61 N -0.47 1.73 -3.59 1.48 5.75 0.43 -1.55 116.55 120.32 2qb9 n ASP 61 Ca -0.09 -0.41 -0.06 0.00 -0.01 0.00 0.00 54.79 54.22 2qb9 n ASP 61 Cb 0.63 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.70 2qb9 n ASP 61 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 2qb9 s LEU 62 N 0.00 -0.28 -0.34 -2.12 -0.00 -1.11 -0.01 118.68 114.82 2qb9 s LEU 62 Ca 0.00 -0.14 0.02 0.00 -0.00 0.00 0.00 54.13 54.01 2qb9 s LEU 62 Cb 0.00 2.03 0.09 0.00 -0.00 0.00 0.00 46.19 48.31 2qb9 s LEU 62 CO 0.00 -0.69 0.05 -0.47 -0.00 0.00 0.00 176.35 175.24 2qb9 s TYR 63 N -3.13 3.61 0.19 3.48 5.04 -0.42 -3.80 117.35 122.31 2qb9 s TYR 63 Ca 0.08 -2.68 -0.12 0.00 -2.44 0.00 0.00 57.07 51.91 2qb9 s TYR 63 Cb -0.01 -2.75 -0.07 0.00 0.35 0.00 0.00 41.96 39.48 2qb9 s TYR 63 CO -0.05 -0.93 0.55 0.42 -1.34 0.00 0.00 175.55 174.20 2qb9 s ILE 64 N 1.01 4.89 -0.30 3.14 1.09 -0.94 -0.14 121.20 129.95 2qb9 s ILE 64 Ca 0.06 0.67 0.01 0.00 -1.10 0.00 0.00 60.65 60.28 2qb9 s ILE 64 Cb -0.20 -3.68 0.19 0.00 -1.06 0.00 0.00 42.46 37.72 2qb9 s ILE 64 CO -0.06 0.10 0.60 -0.89 -0.10 0.00 0.00 174.94 174.58 2qb9 s THR 65 N -1.63 -1.00 0.13 2.92 2.01 0.14 -0.89 115.64 117.32 2qb9 s THR 65 Ca 0.42 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.48 2qb9 s THR 65 Cb -0.13 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 2qb9 s THR 65 CO 0.20 0.00 -0.14 0.54 -0.69 0.00 0.00 174.62 174.52 2qb9 s VAL 66 N 2.85 1.38 0.07 3.82 0.11 -1.26 0.31 120.40 127.68 2qb9 s VAL 66 Ca 0.18 -1.73 -0.09 0.00 -2.93 0.00 0.00 61.98 57.40 2qb9 s VAL 66 Cb -0.14 -1.56 0.00 0.00 -1.53 0.00 0.00 36.38 33.16 2qb9 s VAL 66 CO -0.22 -0.40 0.20 -0.54 -3.33 0.00 0.00 175.10 170.81 2qb9 s LYS 67 N -2.67 0.80 0.19 1.54 3.01 -0.77 -4.92 119.74 116.92 2qb9 s LYS 67 Ca 0.09 -0.83 0.00 0.00 -1.01 0.00 0.00 55.97 54.23 2qb9 s LYS 67 Cb -0.05 0.33 0.00 0.00 -1.01 0.00 0.00 37.83 37.10 2qb9 s LYS 67 CO 0.03 -0.25 0.00 0.41 0.51 0.00 0.00 175.35 176.06 2qb9 n GLY 68 N 0.21 -3.71 0.00 -3.33 0.00 -1.26 -2.39 105.19 94.71 2qb9 n GLY 68 Ca -0.16 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2qb9 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qb9 n GLY 69 N -0.74 0.11 0.00 -0.02 0.00 -0.99 -3.88 105.19 99.67 2qb9 n GLY 69 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2qb9 n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qb9 n GLY 70 N 0.00 4.16 0.21 -0.02 0.00 -1.26 -4.93 105.19 103.34 2qb9 n GLY 70 Ca 0.00 -1.73 -0.08 0.00 0.00 0.00 0.00 46.02 44.22 2qb9 n GLY 70 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qb9 h ILE 71 N 0.93 0.00 -0.54 -0.61 5.03 -1.98 1.01 117.51 121.34 2qb9 h ILE 71 Ca 0.00 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.81 2qb9 h ILE 71 Cb 0.00 0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 33.76 2qb9 h ILE 71 CO 0.00 0.00 0.36 0.77 -0.68 0.00 0.00 178.15 178.60 2qb9 h SER 72 N -0.42 0.40 0.39 1.72 4.64 -1.98 -0.43 113.55 117.88 2qb9 h SER 72 Ca -0.03 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 2qb9 h SER 72 Cb 0.36 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2qb9 h SER 72 CO -0.02 0.26 -0.19 1.23 -0.87 0.00 0.00 176.83 177.24 2qb9 h GLY 73 N 0.46 -0.55 0.35 -0.77 0.00 -1.75 -0.07 103.07 100.74 2qb9 h GLY 73 Ca 0.24 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2qb9 h GLY 73 CO -0.06 -0.20 -0.48 1.46 0.00 0.00 0.00 176.54 177.26 2qb9 h GLN 74 N -0.73 -0.80 -0.20 4.80 7.50 0.17 0.50 115.11 126.35 2qb9 h GLN 74 Ca -0.05 0.05 0.04 0.00 0.50 0.00 0.00 58.65 59.19 2qb9 h GLN 74 Cb 0.51 0.18 -0.07 0.00 0.05 0.00 0.00 27.48 28.15 2qb9 h GLN 74 CO 0.09 -0.53 -0.48 0.00 -1.50 0.00 0.00 178.83 176.41 2qb9 h ALA 75 N -0.55 -0.70 -0.68 3.87 0.00 -1.12 0.20 119.26 120.29 2qb9 h ALA 75 Ca -0.02 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.96 2qb9 h ALA 75 Cb 0.78 0.92 -0.07 0.00 0.00 0.00 0.00 17.79 19.42 2qb9 h ALA 75 CO -0.18 -0.99 0.35 0.78 0.00 0.00 0.00 179.25 179.21 2qb9 h GLY 76 N -0.49 1.01 0.82 0.00 0.00 -0.85 -2.03 103.07 101.53 2qb9 h GLY 76 Ca 0.07 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.20 2qb9 h GLY 76 CO -0.46 0.08 0.19 0.00 0.00 0.00 0.00 176.54 176.35 2qb9 h ALA 77 N 1.40 0.47 -0.58 3.60 0.00 -0.05 -2.52 119.26 121.57 2qb9 h ALA 77 Ca 0.33 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.31 2qb9 h ALA 77 Cb 0.31 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2qb9 h ALA 77 CO -0.24 -0.17 0.29 0.82 0.00 0.00 0.00 179.25 179.94 2qb9 h ILE 78 N 0.39 0.92 -0.41 0.00 2.04 -0.31 0.18 117.51 120.31 2qb9 h ILE 78 Ca 0.16 -0.18 0.12 0.00 1.00 0.00 0.00 64.86 65.95 2qb9 h ILE 78 Cb 0.06 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 2qb9 h ILE 78 CO -0.11 0.10 0.36 -0.09 0.00 0.00 0.00 178.15 178.41 2qb9 h ARG 79 N 0.54 0.00 0.08 2.37 2.43 -0.96 0.76 114.38 119.60 2qb9 h ARG 79 Ca 0.27 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2qb9 h ARG 79 Cb 0.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2qb9 h ARG 79 CO -0.20 0.00 -0.04 1.25 -1.51 0.00 0.00 179.97 179.48 2qb9 h HIS 80 N 0.00 -0.09 -0.96 2.20 2.76 -0.83 -2.74 115.15 115.48 2qb9 h HIS 80 Ca 0.20 -0.00 0.12 0.00 -2.20 0.00 0.00 60.37 58.49 2qb9 h HIS 80 Cb 0.92 0.03 -0.08 0.00 1.55 0.00 0.00 27.41 29.83 2qb9 h HIS 80 CO 0.00 0.32 0.59 0.78 -1.30 0.00 0.00 177.93 178.32 2qb9 h GLY 81 N -0.97 1.58 0.36 5.26 0.00 -0.68 0.15 103.07 108.77 2qb9 h GLY 81 Ca -0.01 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 2qb9 h GLY 81 CO 0.02 0.13 -0.17 -2.22 0.00 0.00 0.00 176.54 174.29 2qb9 h ILE 82 N 0.92 0.00 -0.73 2.60 2.04 -0.98 0.11 117.51 121.47 2qb9 h ILE 82 Ca 0.48 -0.01 0.20 0.00 1.00 0.00 0.00 64.86 66.53 2qb9 h ILE 82 Cb 0.50 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.55 2qb9 h ILE 82 CO -0.28 0.00 0.52 0.00 0.00 0.00 0.00 178.15 178.39 2qb9 h THR 83 N -0.50 0.67 -0.23 -0.27 1.03 -1.29 0.62 112.91 112.94 2qb9 h THR 83 Ca -0.05 -0.03 -0.13 0.00 -0.01 0.00 0.00 66.41 66.18 2qb9 h THR 83 Cb 0.37 0.57 -0.00 0.00 -1.07 0.00 0.00 68.15 68.02 2qb9 h THR 83 CO 0.08 0.02 -0.38 0.03 -0.01 0.00 0.00 175.52 175.26 2qb9 h ARG 84 N 0.09 0.66 -0.29 0.00 2.47 -0.51 -3.14 114.38 113.67 2qb9 h ARG 84 Ca 0.35 -0.41 -0.06 0.00 -1.26 0.00 0.00 59.98 58.61 2qb9 h ARG 84 Cb 1.27 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.61 2qb9 h ARG 84 CO -0.04 1.02 -0.09 0.00 0.56 0.00 0.00 179.97 181.43 2qb9 h ALA 85 N 0.63 1.31 -0.29 0.04 0.00 0.14 -2.30 119.26 118.80 2qb9 h ALA 85 Ca 0.02 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.77 2qb9 h ALA 85 Cb 0.98 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2qb9 h ALA 85 CO 0.09 0.46 0.49 -0.07 0.00 0.00 0.00 179.25 180.21 2qb9 h LEU 86 N 0.44 0.00 -1.03 0.00 4.07 -1.18 0.53 115.31 118.15 2qb9 h LEU 86 Ca 0.09 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.95 2qb9 h LEU 86 Cb 0.43 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 2qb9 h LEU 86 CO 0.02 0.00 -0.44 -0.03 -1.08 0.00 0.00 178.44 176.91 2qb9 h MET 87 N 0.00 0.00 0.00 1.13 1.85 -1.53 0.20 114.93 116.58 2qb9 h MET 87 Ca 0.14 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.23 2qb9 h MET 87 Cb 1.11 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.14 2qb9 h MET 87 CO -0.00 0.44 0.00 0.93 -0.40 0.00 0.00 176.91 177.88 2qb9 h GLU 88 N 0.00 0.00 0.00 0.39 5.08 -0.08 -3.00 114.58 116.97 2qb9 h GLU 88 Ca -0.00 0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 57.96 2qb9 h GLU 88 Cb 0.86 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.04 2qb9 h GLU 88 CO 0.06 0.00 -2.46 0.98 -1.00 0.00 0.00 179.01 176.59 2qb9 n TYR 89 N -2.49 0.00 -3.30 4.33 9.36 -0.84 -4.92 117.16 119.30 2qb9 n TYR 89 Ca 0.03 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.16 2qb9 n TYR 89 Cb 0.31 -0.97 -0.05 0.00 -0.63 0.00 0.00 39.34 38.00 2qb9 n TYR 89 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2qb9 s ASP 90 N -6.70 0.24 0.00 2.98 3.68 0.64 -5.01 116.67 112.50 2qb9 s ASP 90 Ca -0.35 -0.66 0.17 0.00 2.13 0.00 0.00 52.55 53.83 2qb9 s ASP 90 Cb 0.10 1.13 0.99 0.00 -1.45 0.00 0.00 42.92 43.69 2qb9 s ASP 90 CO 0.56 -0.31 1.41 -0.62 0.13 0.00 0.00 175.17 176.34 2qb9 n GLU 91 N 5.01 0.61 -0.16 4.34 -0.58 -1.14 -2.98 120.64 125.75 2qb9 n GLU 91 Ca 0.04 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.87 2qb9 n GLU 91 Cb 0.50 -1.42 0.16 0.00 -0.57 0.00 0.00 31.44 30.10 2qb9 n GLU 91 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2qb9 n SER 92 N -0.92 2.97 -0.00 1.62 7.64 -1.26 -4.45 113.62 119.22 2qb9 n SER 92 Ca 0.12 -1.87 0.04 0.00 1.01 0.00 0.00 58.87 58.17 2qb9 n SER 92 Cb 0.06 -0.20 -0.04 0.00 -1.01 0.00 0.00 64.21 63.01 2qb9 n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qb9 n LEU 93 N 0.98 0.36 0.29 -3.43 -0.00 -1.16 -4.53 117.00 109.51 2qb9 n LEU 93 Ca 0.14 -0.50 0.15 0.00 -0.00 0.00 0.00 56.01 55.81 2qb9 n LEU 93 Cb 0.47 0.00 0.89 0.00 -0.00 0.00 0.00 43.42 44.79 2qb9 n LEU 93 CO 0.11 0.09 1.08 0.03 -0.00 0.00 0.00 177.39 178.70 2qb9 h ARG 94 N 0.00 0.00 -0.69 1.47 3.08 -1.78 -2.80 114.38 113.66 2qb9 h ARG 94 Ca 0.00 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.20 2qb9 h ARG 94 Cb 0.18 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.12 2qb9 h ARG 94 CO 0.00 0.04 0.07 1.03 -1.07 0.00 0.00 179.97 180.04 2qb9 h SER 95 N 0.00 -0.17 0.58 7.04 0.87 -1.88 0.43 113.55 120.41 2qb9 h SER 95 Ca -0.00 0.16 -0.16 0.00 -1.23 0.00 0.00 61.79 60.56 2qb9 h SER 95 Cb 0.12 0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 2qb9 h SER 95 CO 0.01 -0.10 -0.73 -0.33 -0.53 0.00 0.00 176.83 175.15 2qb9 h GLU 96 N 0.18 0.12 -0.36 2.24 4.39 -1.84 -2.85 114.58 116.45 2qb9 h GLU 96 Ca 0.38 -0.11 -0.10 0.00 0.34 0.00 0.00 59.36 59.87 2qb9 h GLU 96 Cb 0.64 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 2qb9 h GLU 96 CO -0.55 0.80 -0.17 -0.07 -1.16 0.00 0.00 179.01 177.86 2qb9 h LEU 97 N 0.08 0.77 0.46 1.33 3.38 -1.05 -1.69 115.31 118.59 2qb9 h LEU 97 Ca -0.02 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 2qb9 h LEU 97 Cb 1.29 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 2qb9 h LEU 97 CO 0.11 1.00 -0.27 -0.09 0.09 0.00 0.00 178.44 179.28 2qb9 h ARG 98 N 0.54 -0.65 -0.84 1.13 2.43 -0.23 -2.45 114.38 114.31 2qb9 h ARG 98 Ca 0.08 0.04 0.24 0.00 -0.81 0.00 0.00 59.98 59.53 2qb9 h ARG 98 Cb 0.71 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.37 2qb9 h ARG 98 CO 0.05 -0.43 0.60 1.57 -1.51 0.00 0.00 179.97 180.24 2qb9 h LYS 99 N -0.68 0.04 -0.47 0.20 2.10 -1.57 0.49 116.57 116.68 2qb9 h LYS 99 Ca -0.06 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 2qb9 h LYS 99 Cb 0.54 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 2qb9 h LYS 99 CO 0.07 0.03 0.00 0.00 -2.00 0.00 0.00 179.45 177.55 2qb9 n ALA 100 N -2.68 2.63 -2.57 0.07 0.00 -0.64 -4.93 120.51 112.39 2qb9 n ALA 100 Ca 0.17 -0.40 -0.06 0.00 0.00 0.00 0.00 53.44 53.14 2qb9 n ALA 100 Cb 0.88 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.33 2qb9 n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qb9 n GLY 101 N 0.55 -1.19 2.10 0.00 0.00 0.17 -5.00 105.19 101.82 2qb9 n GLY 101 Ca 0.07 0.97 0.00 0.00 0.00 0.00 0.00 46.02 47.06 2qb9 n GLY 101 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qb9 n PHE 102 N -0.35 -3.15 -0.02 1.61 3.01 -0.96 -4.92 117.46 112.68 2qb9 n PHE 102 Ca 0.09 0.81 0.17 0.00 1.01 0.00 0.00 57.45 59.54 2qb9 n PHE 102 Cb 0.36 2.01 0.62 0.00 -0.01 0.00 0.00 39.48 42.46 2qb9 n PHE 102 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 2qb9 h VAL 103 N 0.00 0.80 -4.00 -4.37 -1.51 -1.81 -3.43 116.25 101.94 2qb9 h VAL 103 Ca 0.00 -0.05 -0.53 0.00 -1.23 0.00 0.00 66.70 64.89 2qb9 h VAL 103 Cb 0.00 0.64 0.10 0.00 -2.13 0.00 0.00 31.29 29.90 2qb9 h VAL 103 CO 0.00 0.03 0.58 0.42 -1.23 0.00 0.00 177.57 177.37 2qb9 s THR 104 N -5.16 2.53 -0.37 7.19 -4.23 -1.26 -4.99 115.64 109.34 2qb9 s THR 104 Ca -0.06 0.42 -0.10 0.00 -1.18 0.00 0.00 61.69 60.78 2qb9 s THR 104 Cb 0.20 -3.23 0.04 0.00 1.34 0.00 0.00 72.50 70.85 2qb9 s THR 104 CO 0.73 0.02 0.19 -0.60 -0.54 0.00 0.00 174.62 174.42 2qb9 s ARG 105 N -2.61 2.73 -0.82 3.99 3.00 -1.26 -5.01 118.95 118.97 2qb9 s ARG 105 Ca 0.64 -1.16 -0.22 0.00 -1.00 0.00 0.00 55.73 53.99 2qb9 s ARG 105 Cb -0.37 -3.67 -0.18 0.00 0.00 0.00 0.00 34.95 30.73 2qb9 s ARG 105 CO 0.45 -0.73 2.36 -3.47 0.00 0.00 0.00 175.30 173.91 2qb9 n ASP 106 N 4.94 1.05 -3.24 -2.12 4.64 -1.26 -4.77 116.55 115.79 2qb9 n ASP 106 Ca -0.12 -1.18 -0.26 0.00 -1.38 0.00 0.00 54.79 51.86 2qb9 n ASP 106 Cb 0.45 -1.38 -0.02 0.00 -1.04 0.00 0.00 41.12 39.13 2qb9 n ASP 106 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2qb9 n ALA 107 N 15.36 4.72 -2.57 -1.67 0.00 -1.26 -4.65 120.51 130.43 2qb9 n ALA 107 Ca 0.52 -2.26 -0.22 0.00 0.00 0.00 0.00 53.44 51.48 2qb9 n ALA 107 Cb 0.36 -3.10 -0.15 0.00 0.00 0.00 0.00 19.45 16.56 2qb9 n ALA 107 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qb9 s ARG 108 N 3.52 1.12 -0.07 0.00 0.52 -1.26 -5.14 118.95 117.65 2qb9 s ARG 108 Ca 0.43 -0.56 -0.23 0.00 -0.52 0.00 0.00 55.73 54.85 2qb9 s ARG 108 Cb 0.11 -1.10 0.05 0.00 0.52 0.00 0.00 34.95 34.53 2qb9 s ARG 108 CO -0.02 0.30 0.53 -1.14 0.02 0.00 0.00 175.30 174.99 2qb9 s GLN 109 N -0.48 0.85 0.36 3.54 -0.44 -1.26 -3.79 119.66 118.44 2qb9 s GLN 109 Ca 0.05 0.21 -0.21 0.00 -2.50 0.00 0.00 55.36 52.91 2qb9 s GLN 109 Cb -0.06 0.40 -0.15 0.00 -1.64 0.00 0.00 33.01 31.56 2qb9 s GLN 109 CO -0.00 -0.23 0.15 0.28 0.50 0.00 0.00 175.29 175.99 2qb9 n VAL 110 N 1.40 0.83 -3.17 1.34 0.31 -1.26 -4.90 118.33 112.88 2qb9 n VAL 110 Ca -0.19 -0.48 -0.39 0.00 -0.01 0.00 0.00 64.34 63.27 2qb9 n VAL 110 Cb 0.56 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.44 2qb9 n VAL 110 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2qb9 s GLU 111 N -0.96 4.39 0.25 5.55 2.56 -1.26 -5.04 118.70 124.19 2qb9 s GLU 111 Ca 0.58 0.69 -0.30 0.00 0.00 0.00 0.00 54.97 55.94 2qb9 s GLU 111 Cb -0.66 -3.43 -0.09 0.00 2.00 0.00 0.00 34.13 31.95 2qb9 s GLU 111 CO 0.59 0.13 1.21 -0.98 -0.56 0.00 0.00 175.26 175.65 2qb9 s ARG 112 N 0.65 4.49 0.20 4.30 1.70 -1.26 -4.81 118.95 124.21 2qb9 s ARG 112 Ca 0.32 1.97 -0.30 0.00 -0.47 0.00 0.00 55.73 57.25 2qb9 s ARG 112 Cb -0.17 -3.17 -0.09 0.00 -0.57 0.00 0.00 34.95 30.95 2qb9 s ARG 112 CO 0.15 -0.05 1.38 0.21 -1.08 0.00 0.00 175.30 175.91 2qb9 s LYS 113 N -0.97 4.33 0.03 3.89 2.20 -1.26 -4.47 119.74 123.49 2qb9 s LYS 113 Ca 0.50 2.15 -0.00 0.00 -0.36 0.00 0.00 55.97 58.26 2qb9 s LYS 113 Cb -0.35 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.76 2qb9 s LYS 113 CO 0.42 -0.35 0.13 0.15 -0.36 0.00 0.00 175.35 175.34 2qb9 s LYS 114 N 0.06 3.19 0.59 4.03 3.01 -1.26 -4.84 119.74 124.52 2qb9 s LYS 114 Ca 0.59 -0.48 -0.20 0.00 -1.01 0.00 0.00 55.97 54.87 2qb9 s LYS 114 Cb -0.39 -2.92 -0.03 0.00 -1.01 0.00 0.00 37.83 33.48 2qb9 s LYS 114 CO 0.38 0.63 1.31 1.55 0.51 0.00 0.00 175.35 179.73 2qb9 n VAL 115 N 0.76 4.30 0.00 3.17 3.14 -1.26 -2.70 118.33 125.74 2qb9 n VAL 115 Ca -0.10 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.78 2qb9 n VAL 115 Cb 0.52 -1.57 0.00 0.00 -1.06 0.00 0.00 33.84 31.73 2qb9 n VAL 115 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2qb9 n GLY 116 N 0.85 2.41 0.66 7.55 0.00 -1.26 -4.98 105.19 110.42 2qb9 n GLY 116 Ca 0.13 -0.51 -0.05 0.00 0.00 0.00 0.00 46.02 45.59 2qb9 n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qb9 n LEU 117 N 0.00 0.00 0.00 0.99 4.77 -1.10 -4.78 117.00 116.88 2qb9 n LEU 117 Ca 0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 2qb9 n LEU 117 Cb 0.00 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2qb9 n LEU 117 CO 0.00 -0.77 -0.10 -1.14 -1.33 0.00 0.00 177.39 174.05 2qb9 n ARG 118 N -1.61 5.10 -2.70 3.23 0.63 0.89 -4.90 116.66 117.30 2qb9 n ARG 118 Ca 0.03 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.90 2qb9 n ARG 118 Cb 0.10 -0.56 0.10 0.00 0.45 0.00 0.00 32.46 32.55 2qb9 n ARG 118 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2qb9 n LYS 119 N -1.00 0.66 0.00 -0.14 4.81 -1.23 -4.91 118.16 116.35 2qb9 n LYS 119 Ca 0.00 -1.39 0.00 0.00 -0.87 0.00 0.00 58.31 56.05 2qb9 n LYS 119 Cb 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 35.03 34.49 2qb9 n LYS 119 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2qb9 n ALA 120 N 0.27 0.00 0.00 3.14 0.00 -1.26 -3.42 120.51 119.24 2qb9 n ALA 120 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2qb9 n ALA 120 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.18 2qb9 n ALA 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qb9 n ARG 121 N -1.15 0.00 -1.53 0.00 5.12 -1.26 -4.71 116.66 113.13 2qb9 n ARG 121 Ca 0.00 0.00 -0.37 0.00 -1.93 0.00 0.00 57.85 55.55 2qb9 n ARG 121 Cb 0.00 -0.12 -0.09 0.00 -1.16 0.00 0.00 32.46 31.10 2qb9 n ARG 121 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2qb9 n ARG 122 N -2.06 0.57 -3.23 5.56 0.63 -1.22 -4.81 116.66 112.10 2qb9 n ARG 122 Ca 0.00 -0.03 -0.39 0.00 -0.92 0.00 0.00 57.85 56.51 2qb9 n ARG 122 Cb 0.00 -2.59 -0.07 0.00 0.45 0.00 0.00 32.46 30.26 2qb9 n ARG 122 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2qb9 s ARG 123 N 8.59 4.16 0.25 -0.14 0.52 -1.26 -0.08 118.95 130.99 2qb9 s ARG 123 Ca 1.15 0.42 -0.31 0.00 -0.52 0.00 0.00 55.73 56.46 2qb9 s ARG 123 Cb -0.64 -3.59 -0.13 0.00 0.52 0.00 0.00 34.95 31.10 2qb9 s ARG 123 CO 0.36 -0.21 1.38 -0.35 0.02 0.00 0.00 175.30 176.49 2qb9 n PRO 124 N 5.02 2.00 -2.03 3.54 -0.04 -1.26 -4.92 135.00 137.31 2qb9 n PRO 124 Ca -0.04 0.71 -0.40 0.00 -0.04 0.00 0.00 63.50 63.73 2qb9 n PRO 124 Cb 0.50 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.60 2qb9 n PRO 124 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2qb9 s GLN 125 N -0.60 4.13 0.00 0.54 -2.07 -1.26 -4.92 119.66 115.49 2qb9 s GLN 125 Ca 0.67 2.25 0.12 0.00 -1.82 0.00 0.00 55.36 56.57 2qb9 s GLN 125 Cb -0.65 -2.91 -0.09 0.00 -1.09 0.00 0.00 33.01 28.28 2qb9 s GLN 125 CO 0.51 -0.39 0.56 1.97 -1.32 0.00 0.00 175.29 176.62 2qb9 n PHE 126 N 0.43 0.00 0.00 9.60 1.16 -1.26 -4.99 117.46 122.40 2qb9 n PHE 126 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.60 2qb9 n PHE 126 Cb 0.42 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.29 2qb9 n PHE 126 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2qb9 n SER 127 N -0.93 0.00 -4.68 5.98 3.41 -1.26 -4.48 113.62 111.67 2qb9 n SER 127 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.22 2qb9 n SER 127 Cb 0.20 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 2qb9 n SER 127 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2qb9 s LYS 128 N 0.00 4.15 0.00 4.33 2.47 -1.26 -5.35 119.74 124.09 2qb9 s LYS 128 Ca 0.00 2.52 0.24 0.00 -1.56 0.00 0.00 55.97 57.17 2qb9 s LYS 128 Cb 0.00 -3.85 0.19 0.00 -1.46 0.00 0.00 37.83 32.71 2qb9 s LYS 128 CO 0.00 -0.87 1.26 -2.13 0.16 0.00 0.00 175.35 173.77