#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbi h ASN 2 N 0.00 0.00 0.12 -3.46 -1.24 -2.07 -1.79 115.58 107.15 2qbi h ASN 2 Ca 0.00 0.00 -0.22 0.00 0.71 0.00 0.00 56.30 56.79 2qbi h ASN 2 Cb 0.00 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.06 2qbi h ASN 2 CO 0.00 0.22 -1.06 -0.29 -1.29 0.00 0.00 177.43 175.01 2qbi h ILE 3 N 0.00 1.30 -0.82 2.57 -0.00 -2.08 -3.44 117.51 115.04 2qbi h ILE 3 Ca -0.00 -2.47 0.00 0.00 -0.00 0.00 0.00 64.86 62.39 2qbi h ILE 3 Cb 0.44 2.97 0.00 0.00 -0.00 0.00 0.00 36.82 40.24 2qbi h ILE 3 CO 0.03 0.70 0.00 -0.38 -0.00 0.00 0.00 178.15 178.50 2qbi n ILE 4 N -4.06 0.00 0.00 2.19 5.41 -0.68 -3.71 119.36 118.51 2qbi n ILE 4 Ca -0.19 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.56 2qbi n ILE 4 Cb 0.85 -1.51 0.00 0.00 -0.71 0.00 0.00 39.64 38.27 2qbi n ILE 4 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2qbi n LYS 5 N -0.09 0.00 -0.07 0.38 0.00 -1.19 -4.37 118.16 112.82 2qbi n LYS 5 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 58.31 58.25 2qbi n LYS 5 Cb 0.00 -2.16 -0.02 0.00 0.00 0.00 0.00 35.03 32.84 2qbi n LYS 5 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 2qbi h GLN 6 N 0.20 0.00 0.00 1.64 -0.00 -1.81 -2.43 115.11 112.71 2qbi h GLN 6 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2qbi h GLN 6 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 2qbi h GLN 6 CO 0.00 0.10 0.16 -0.07 0.00 0.00 0.00 178.83 179.02 2qbi h LEU 7 N -1.00 0.00 0.04 -2.39 4.07 -1.76 1.43 115.31 115.70 2qbi h LEU 7 Ca -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.92 2qbi h LEU 7 Cb 0.55 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.29 2qbi h LEU 7 CO -0.02 0.00 -0.02 -0.33 -1.08 0.00 0.00 178.44 176.99 2qbi h GLU 8 N 0.00 -0.05 -0.03 1.13 5.08 -1.88 -3.21 114.58 115.62 2qbi h GLU 8 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2qbi h GLU 8 Cb 0.32 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 2qbi h GLU 8 CO 0.00 -0.04 0.10 -0.56 -1.00 0.00 0.00 179.01 177.51 2qbi h GLN 9 N -0.38 0.00 0.00 2.33 3.07 -0.85 0.36 115.11 119.64 2qbi h GLN 9 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.71 2qbi h GLN 9 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.60 2qbi h GLN 9 CO 0.01 0.00 -0.13 1.49 0.09 0.00 0.00 178.83 180.29 2qbi h GLU 10 N 0.00 0.00 0.00 0.06 4.81 0.19 -3.04 114.58 116.59 2qbi h GLU 10 Ca 0.02 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 2qbi h GLU 10 Cb 0.21 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2qbi h GLU 10 CO -0.00 0.13 -1.55 1.04 -0.73 0.00 0.00 179.01 177.89 2qbi n GLN 11 N -3.55 0.90 -1.63 1.92 6.02 0.11 -5.02 117.38 116.13 2qbi n GLN 11 Ca -0.01 -0.07 -0.50 0.00 -0.01 0.00 0.00 57.00 56.40 2qbi n GLN 11 Cb 0.26 -1.26 -0.05 0.00 1.02 0.00 0.00 30.24 30.21 2qbi n GLN 11 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2qbi n MET 12 N -2.02 1.55 -2.45 -1.09 2.81 -0.02 -4.98 117.12 110.92 2qbi n MET 12 Ca -0.06 0.56 -0.24 0.00 -1.81 0.00 0.00 57.70 56.15 2qbi n MET 12 Cb 0.44 -2.26 0.05 0.00 -0.71 0.00 0.00 33.22 30.74 2qbi n MET 12 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 2qbi s LYS 13 N 1.00 2.45 -0.05 0.03 -2.85 -1.26 -4.98 119.74 114.09 2qbi s LYS 13 Ca 0.84 -0.48 0.16 0.00 -1.00 0.00 0.00 55.97 55.49 2qbi s LYS 13 Cb -0.85 -2.34 0.31 0.00 -2.06 0.00 0.00 37.83 32.89 2qbi s LYS 13 CO 0.45 -0.92 1.13 1.04 0.10 0.00 0.00 175.35 177.16 2qbi n GLN 14 N -2.60 0.39 -0.30 1.78 6.02 -1.26 -4.77 117.38 116.65 2qbi n GLN 14 Ca 0.07 -2.03 0.10 0.00 -0.01 0.00 0.00 57.00 55.13 2qbi n GLN 14 Cb 0.60 -0.54 0.27 0.00 1.02 0.00 0.00 30.24 31.58 2qbi n GLN 14 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2qbi n ASP 15 N -0.08 3.25 -4.61 1.08 2.03 -1.26 -4.87 116.55 112.09 2qbi n ASP 15 Ca 0.08 -1.99 -0.38 0.00 0.52 0.00 0.00 54.79 53.02 2qbi n ASP 15 Cb 0.91 -0.39 -0.10 0.00 -0.72 0.00 0.00 41.12 40.82 2qbi n ASP 15 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2qbi s VAL 16 N -1.22 5.30 0.00 5.18 -7.23 -1.26 -4.81 120.40 116.36 2qbi s VAL 16 Ca 0.41 0.25 0.00 0.00 -1.81 0.00 0.00 61.98 60.83 2qbi s VAL 16 Cb 0.21 -3.55 0.00 0.00 0.56 0.00 0.00 36.38 33.60 2qbi s VAL 16 CO 0.28 0.26 0.00 -0.81 -0.31 0.00 0.00 175.10 174.52 2qbi n PRO 17 N 4.88 0.89 -2.13 4.82 -0.04 -1.26 -5.01 135.00 137.15 2qbi n PRO 17 Ca -0.13 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.92 2qbi n PRO 17 Cb 0.52 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.95 2qbi n PRO 17 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qbi s SER 18 N -1.00 6.79 0.49 3.54 0.15 -1.26 -5.04 113.70 117.38 2qbi s SER 18 Ca 0.00 2.58 0.01 0.00 0.70 0.00 0.00 55.95 59.24 2qbi s SER 18 Cb 0.00 -2.63 -0.00 0.00 -1.71 0.00 0.00 66.02 61.68 2qbi s SER 18 CO 0.00 -0.57 0.03 0.49 1.20 0.00 0.00 173.24 174.39 2qbi n PHE 19 N 1.85 0.96 0.00 3.44 0.99 -1.26 -5.03 117.46 118.42 2qbi n PHE 19 Ca 0.04 -2.55 0.00 0.00 -0.00 0.00 0.00 57.45 54.94 2qbi n PHE 19 Cb 0.42 -0.27 0.00 0.00 -1.00 0.00 0.00 39.48 38.63 2qbi n PHE 19 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2qbi n ARG 20 N -1.20 0.00 0.00 -1.08 3.00 -1.26 -5.00 116.66 111.12 2qbi n ARG 20 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.67 2qbi n ARG 20 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.10 2qbi n ARG 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2qbi n PRO 21 N -0.13 0.58 0.00 -0.14 -0.04 -1.26 -2.98 135.00 131.03 2qbi n PRO 21 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2qbi n PRO 21 Cb 0.00 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 2qbi n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qbi n GLY 22 N 0.18 0.00 3.42 0.55 0.00 -1.25 -4.48 105.19 103.62 2qbi n GLY 22 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2qbi n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qbi n ASP 23 N -1.65 -1.73 -0.10 1.61 10.43 -1.16 -4.17 116.55 119.77 2qbi n ASP 23 Ca 0.00 0.49 -0.22 0.00 2.57 0.00 0.00 54.79 57.64 2qbi n ASP 23 Cb 0.30 -1.19 -0.12 0.00 1.84 0.00 0.00 41.12 41.96 2qbi n ASP 23 CO 0.00 0.00 0.00 0.74 -1.07 0.00 0.00 177.20 176.87 2qbi h THR 24 N -0.77 0.94 -2.88 -3.53 2.02 0.19 -2.99 112.91 105.89 2qbi h THR 24 Ca -0.45 -2.18 0.29 0.00 0.77 0.00 0.00 66.41 64.84 2qbi h THR 24 Cb 1.33 2.25 -0.12 0.00 -1.74 0.00 0.00 68.15 69.87 2qbi h THR 24 CO 0.39 0.32 -0.76 1.33 0.37 0.00 0.00 175.52 177.17 2qbi n VAL 25 N -4.44 -0.13 -3.48 3.16 0.24 -0.70 -3.72 118.33 109.26 2qbi n VAL 25 Ca -0.31 0.44 -0.18 0.00 -2.04 0.00 0.00 64.34 62.25 2qbi n VAL 25 Cb 0.67 -0.82 -0.13 0.00 -1.47 0.00 0.00 33.84 32.09 2qbi n VAL 25 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2qbi s GLU 26 N -3.45 0.20 -0.05 7.34 2.12 -1.24 -3.73 118.70 119.90 2qbi s GLU 26 Ca 0.00 0.21 -0.17 0.00 0.36 0.00 0.00 54.97 55.37 2qbi s GLU 26 Cb 0.00 -1.16 -0.05 0.00 0.26 0.00 0.00 34.13 33.18 2qbi s GLU 26 CO 0.00 -0.67 0.45 0.08 -0.54 0.00 0.00 175.26 174.58 2qbi s VAL 27 N 2.34 5.07 -0.33 3.70 1.01 -0.32 0.19 120.40 132.05 2qbi s VAL 27 Ca 0.07 0.92 0.02 0.00 0.00 0.00 0.00 61.98 62.99 2qbi s VAL 27 Cb -0.16 -3.77 0.10 0.00 0.00 0.00 0.00 36.38 32.55 2qbi s VAL 27 CO -0.13 0.47 0.06 -0.54 0.00 0.00 0.00 175.10 174.96 2qbi s LYS 28 N -0.33 1.23 0.49 2.72 1.02 -1.17 0.17 119.74 123.88 2qbi s LYS 28 Ca 0.25 -1.57 0.07 0.00 0.02 0.00 0.00 55.97 54.75 2qbi s LYS 28 Cb -0.16 -2.76 0.02 0.00 -0.52 0.00 0.00 37.83 34.40 2qbi s LYS 28 CO 0.12 -0.94 0.47 0.14 -0.92 0.00 0.00 175.35 174.22 2qbi s VAL 29 N 1.17 2.23 0.00 3.17 -7.23 0.13 -3.49 120.40 116.37 2qbi s VAL 29 Ca 0.10 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 2qbi s VAL 29 Cb -0.18 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.20 2qbi s VAL 29 CO -0.14 0.00 0.00 0.79 -0.31 0.00 0.00 175.10 175.44 2qbi n TRP 30 N -1.76 -1.40 0.00 2.82 8.01 -0.89 0.16 117.44 124.38 2qbi n TRP 30 Ca 0.04 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.23 2qbi n TRP 30 Cb 0.62 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.92 2qbi n TRP 30 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.69 178.23 2qbi n VAL 31 N -1.46 0.00 0.00 -0.99 3.14 -1.06 -3.44 118.33 114.52 2qbi n VAL 31 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2qbi n VAL 31 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2qbi n VAL 31 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2qbi n VAL 32 N -1.46 0.00 0.00 1.55 0.31 -1.26 -4.94 118.33 112.53 2qbi n VAL 32 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2qbi n VAL 32 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2qbi n VAL 32 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qbi n GLU 33 N 0.00 0.00 0.00 5.55 4.07 -1.26 -3.09 120.64 125.91 2qbi n GLU 33 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2qbi n GLU 33 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 2qbi n GLU 33 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qbi n GLY 34 N 0.00 0.06 0.61 8.31 0.00 -1.26 -4.79 105.19 108.11 2qbi n GLY 34 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2qbi n GLY 34 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qbi n SER 35 N 0.00 1.71 -1.12 1.61 7.64 -1.26 -4.85 113.62 117.35 2qbi n SER 35 Ca 0.00 -2.08 0.00 0.00 1.01 0.00 0.00 58.87 57.80 2qbi n SER 35 Cb 0.00 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 2qbi n SER 35 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2qbi n LYS 36 N 0.26 2.10 -1.77 1.43 4.76 -1.19 -5.08 118.16 118.67 2qbi n LYS 36 Ca 0.09 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.52 2qbi n LYS 36 Cb 0.31 0.00 0.04 0.00 -1.84 0.00 0.00 35.03 33.54 2qbi n LYS 36 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2qbi n LYS 37 N -0.43 0.43 -0.43 1.97 0.00 -1.18 -4.46 118.16 114.06 2qbi n LYS 37 Ca 0.00 -0.42 -0.18 0.00 -0.00 0.00 0.00 58.31 57.71 2qbi n LYS 37 Cb 0.00 0.19 0.17 0.00 -0.00 0.00 0.00 35.03 35.39 2qbi n LYS 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2qbi n ARG 38 N -0.49 -2.03 -4.01 -1.58 1.74 -1.26 -4.54 116.66 104.49 2qbi n ARG 38 Ca -0.07 -0.84 -0.31 0.00 -0.77 0.00 0.00 57.85 55.86 2qbi n ARG 38 Cb 0.61 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.40 2qbi n ARG 38 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qbi s LEU 39 N 0.00 4.71 0.08 0.55 1.02 -1.26 -2.55 118.68 121.23 2qbi s LEU 39 Ca 0.39 -2.23 -0.30 0.00 0.02 0.00 0.00 54.13 52.01 2qbi s LEU 39 Cb -0.07 -1.62 -0.06 0.00 0.02 0.00 0.00 46.19 44.46 2qbi s LEU 39 CO 0.32 -0.37 1.14 -1.58 0.02 0.00 0.00 176.35 175.89 2qbi s GLN 40 N 0.81 4.49 0.55 1.70 0.74 0.42 -4.76 119.66 123.61 2qbi s GLN 40 Ca 0.11 1.71 -0.04 0.00 0.05 0.00 0.00 55.36 57.19 2qbi s GLN 40 Cb -0.20 -3.35 0.01 0.00 1.10 0.00 0.00 33.01 30.57 2qbi s GLN 40 CO -0.08 -0.14 0.83 0.00 -0.55 0.00 0.00 175.29 175.35 2qbi s ALA 41 N 0.73 3.45 -0.29 1.58 0.00 -1.26 0.17 121.76 126.13 2qbi s ALA 41 Ca 0.55 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.74 2qbi s ALA 41 Cb -0.28 -2.45 0.19 0.00 0.00 0.00 0.00 23.12 20.58 2qbi s ALA 41 CO 0.30 -0.68 0.55 0.12 0.00 0.00 0.00 175.76 176.05 2qbi s PHE 42 N -2.86 -1.66 -0.90 0.00 2.19 0.46 -4.89 117.98 110.32 2qbi s PHE 42 Ca 0.52 0.88 -0.21 0.00 0.33 0.00 0.00 56.93 58.46 2qbi s PHE 42 Cb -0.10 0.21 0.09 0.00 -1.31 0.00 0.00 43.02 41.91 2qbi s PHE 42 CO 0.43 -1.07 1.20 -1.21 1.83 0.00 0.00 175.22 176.40 2qbi s GLU 43 N 2.73 3.50 0.00 10.12 0.41 -1.26 -1.18 118.70 133.03 2qbi s GLU 43 Ca 0.10 -1.37 0.00 0.00 -0.41 0.00 0.00 54.97 53.29 2qbi s GLU 43 Cb -0.10 -4.90 0.00 0.00 -1.78 0.00 0.00 34.13 27.34 2qbi s GLU 43 CO -0.26 -1.92 0.00 0.41 -0.49 0.00 0.00 175.26 173.00 2qbi n GLY 44 N 5.85 3.72 2.77 -1.39 0.00 -1.24 -4.73 105.19 110.16 2qbi n GLY 44 Ca 0.21 -2.03 -0.17 0.00 0.00 0.00 0.00 46.02 44.03 2qbi n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbi s VAL 45 N 1.72 -0.38 -0.42 1.61 1.01 -0.22 -4.42 120.40 119.30 2qbi s VAL 45 Ca 0.00 -0.68 -0.40 0.00 0.00 0.00 0.00 61.98 60.91 2qbi s VAL 45 Cb 0.00 -0.88 -0.15 0.00 0.00 0.00 0.00 36.38 35.35 2qbi s VAL 45 CO 0.00 -0.51 2.15 0.52 0.00 0.00 0.00 175.10 177.27 2qbi n VAL 46 N 4.91 0.10 -0.10 2.92 0.31 -1.13 -2.88 118.33 122.46 2qbi n VAL 46 Ca 0.03 -0.13 -0.12 0.00 -0.01 0.00 0.00 64.34 64.11 2qbi n VAL 46 Cb 0.46 -1.09 -0.12 0.00 -0.91 0.00 0.00 33.84 32.18 2qbi n VAL 46 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 2qbi n ILE 47 N 6.81 1.21 -4.56 2.52 -5.35 -0.84 -3.75 119.36 115.40 2qbi n ILE 47 Ca 0.47 -0.61 -0.26 0.00 -0.27 0.00 0.00 62.75 62.09 2qbi n ILE 47 Cb 0.10 -0.89 -0.06 0.00 -1.74 0.00 0.00 39.64 37.05 2qbi n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qbi n ALA 48 N -2.87 0.45 -3.12 -1.28 0.00 -1.24 0.29 120.51 112.74 2qbi n ALA 48 Ca -0.33 -1.93 -0.11 0.00 0.00 0.00 0.00 53.44 51.07 2qbi n ALA 48 Cb 0.99 1.17 -0.04 0.00 0.00 0.00 0.00 19.45 21.57 2qbi n ALA 48 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2qbi s ILE 49 N -2.77 0.05 0.00 0.00 2.07 -1.25 -4.61 121.20 114.69 2qbi s ILE 49 Ca 0.09 -0.41 0.00 0.00 -1.41 0.00 0.00 60.65 58.93 2qbi s ILE 49 Cb 0.00 -1.11 0.00 0.00 0.13 0.00 0.00 42.46 41.48 2qbi s ILE 49 CO 0.07 -0.23 0.00 -2.11 -1.91 0.00 0.00 174.94 170.76 2qbi n ARG 50 N -0.24 0.00 -2.48 3.50 1.85 -0.40 -4.84 116.66 114.05 2qbi n ARG 50 Ca -0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 57.85 56.67 2qbi n ARG 50 Cb 0.64 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.05 2qbi n ARG 50 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2qbi n ASN 51 N 0.00 -5.83 -0.75 2.89 3.02 -1.26 -4.84 115.26 108.49 2qbi n ASN 51 Ca 0.00 0.07 -0.04 0.00 -0.03 0.00 0.00 54.58 54.58 2qbi n ASN 51 Cb 0.00 -3.84 -0.04 0.00 -0.61 0.00 0.00 39.78 35.29 2qbi n ASN 51 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2qbi n ARG 52 N -1.18 0.00 0.00 3.52 5.12 -1.21 -5.05 116.66 117.85 2qbi n ARG 52 Ca 0.02 -0.54 0.00 0.00 -1.93 0.00 0.00 57.85 55.40 2qbi n ARG 52 Cb 0.44 0.30 0.00 0.00 -1.16 0.00 0.00 32.46 32.05 2qbi n ARG 52 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qbi n GLY 53 N 0.00 1.25 0.29 -0.13 0.00 -1.26 -3.33 105.19 102.01 2qbi n GLY 53 Ca -0.15 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.25 2qbi n GLY 53 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qbi h LEU 54 N 0.00 -0.14 -8.77 0.99 5.85 -2.00 -3.33 115.31 107.91 2qbi h LEU 54 Ca 0.00 0.18 -0.56 0.00 0.84 0.00 0.00 57.88 58.34 2qbi h LEU 54 Cb 0.00 0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 2qbi h LEU 54 CO 0.00 -0.14 0.93 -1.00 -0.34 0.00 0.00 178.44 177.90 2qbi s HIS 55 N -6.04 2.82 -0.28 1.25 0.09 -1.21 -4.34 115.29 107.58 2qbi s HIS 55 Ca -0.13 0.79 -0.17 0.00 -0.00 0.00 0.00 55.06 55.55 2qbi s HIS 55 Cb 0.23 -4.29 0.11 0.00 -0.00 0.00 0.00 32.58 28.63 2qbi s HIS 55 CO 0.76 -1.28 0.82 -1.12 -0.00 0.00 0.00 174.74 173.92 2qbi s SER 56 N 2.49 -0.74 0.50 1.40 0.01 -1.25 -3.35 113.70 112.76 2qbi s SER 56 Ca 0.49 1.22 0.02 0.00 1.31 0.00 0.00 55.95 58.99 2qbi s SER 56 Cb -0.09 1.30 -0.01 0.00 0.21 0.00 0.00 66.02 67.42 2qbi s SER 56 CO 0.29 -0.20 0.06 0.00 0.41 0.00 0.00 173.24 173.80 2qbi s ALA 57 N 1.33 4.07 0.00 1.44 0.00 -1.26 -0.96 121.76 126.39 2qbi s ALA 57 Ca -0.08 -0.67 -0.06 0.00 0.00 0.00 0.00 51.96 51.16 2qbi s ALA 57 Cb -0.05 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2qbi s ALA 57 CO -0.16 -0.08 -0.11 1.19 0.00 0.00 0.00 175.76 176.60 2qbi n PHE 58 N -1.30 0.00 -2.02 0.00 0.99 -1.26 -1.28 117.46 112.60 2qbi n PHE 58 Ca -0.16 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.29 2qbi n PHE 58 Cb 0.67 -0.15 -0.00 0.00 -1.00 0.00 0.00 39.48 38.99 2qbi n PHE 58 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 2qbi n THR 59 N -3.69 -6.49 -4.69 4.37 -1.04 -0.59 -3.90 114.28 98.26 2qbi n THR 59 Ca -0.04 0.86 -0.26 0.00 -2.04 0.00 0.00 64.05 62.57 2qbi n THR 59 Cb 0.16 -5.21 -0.17 0.00 -1.82 0.00 0.00 70.33 63.30 2qbi n THR 59 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2qbi s VAL 60 N -0.64 1.27 0.38 12.58 -7.23 0.22 -1.99 120.40 124.99 2qbi s VAL 60 Ca -0.02 -0.57 -0.17 0.00 -1.81 0.00 0.00 61.98 59.42 2qbi s VAL 60 Cb 0.00 -1.14 -0.09 0.00 0.56 0.00 0.00 36.38 35.71 2qbi s VAL 60 CO 0.34 0.38 0.83 -0.13 -0.31 0.00 0.00 175.10 176.21 2qbi s ARG 61 N 0.54 4.05 0.08 4.82 1.81 -1.14 -1.67 118.95 127.44 2qbi s ARG 61 Ca -0.14 0.82 0.00 0.00 -1.72 0.00 0.00 55.73 54.69 2qbi s ARG 61 Cb -0.15 -2.32 0.00 0.00 -0.45 0.00 0.00 34.95 32.03 2qbi s ARG 61 CO 0.04 0.04 0.00 1.17 -0.68 0.00 0.00 175.30 175.87 2qbi n LYS 62 N -0.65 0.00 -2.10 3.54 4.81 -0.77 -1.06 118.16 121.93 2qbi n LYS 62 Ca 0.05 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.44 2qbi n LYS 62 Cb 0.54 -0.15 0.02 0.00 0.02 0.00 0.00 35.03 35.46 2qbi n LYS 62 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2qbi n ILE 63 N -2.92 -3.73 0.00 3.15 5.41 -1.26 -4.90 119.36 115.11 2qbi n ILE 63 Ca 0.00 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.30 2qbi n ILE 63 Cb 0.10 -4.18 0.00 0.00 -0.71 0.00 0.00 39.64 34.86 2qbi n ILE 63 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2qbi n SER 64 N -2.07 0.00 -2.98 4.38 7.64 -1.12 -4.24 113.62 115.23 2qbi n SER 64 Ca -0.03 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.78 2qbi n SER 64 Cb 0.54 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.73 2qbi n SER 64 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2qbi n ASN 65 N 0.00 1.73 0.00 6.43 4.13 -1.26 -4.34 115.26 121.95 2qbi n ASN 65 Ca 0.00 -2.07 0.00 0.00 1.68 0.00 0.00 54.58 54.19 2qbi n ASN 65 Cb 0.00 -0.67 0.00 0.00 -1.54 0.00 0.00 39.78 37.57 2qbi n ASN 65 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qbi n GLY 66 N 3.78 1.88 3.74 7.41 0.00 -1.26 -4.98 105.19 115.77 2qbi n GLY 66 Ca 0.15 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2qbi n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qbi s GLU 67 N 0.00 4.23 0.61 1.61 2.12 -1.26 -5.00 118.70 121.01 2qbi s GLU 67 Ca 0.00 0.25 -0.18 0.00 0.36 0.00 0.00 54.97 55.40 2qbi s GLU 67 Cb 0.00 -3.40 -0.03 0.00 0.26 0.00 0.00 34.13 30.96 2qbi s GLU 67 CO 0.00 0.27 1.19 0.20 -0.54 0.00 0.00 175.26 176.38 2qbi s GLY 68 N 0.32 2.64 0.03 -1.50 0.00 -1.26 -2.78 107.32 104.77 2qbi s GLY 68 Ca 0.21 0.94 -0.04 0.00 0.00 0.00 0.00 44.72 45.83 2qbi s GLY 68 CO 0.07 1.33 0.05 -1.34 0.00 0.00 0.00 173.10 173.21 2qbi s VAL 69 N -1.72 0.14 -0.04 1.40 -7.23 -1.26 -4.81 120.40 106.88 2qbi s VAL 69 Ca 0.76 -1.12 0.01 0.00 -1.81 0.00 0.00 61.98 59.81 2qbi s VAL 69 Cb -0.29 -0.80 0.02 0.00 0.56 0.00 0.00 36.38 35.88 2qbi s VAL 69 CO 0.34 -0.62 -0.04 -0.70 -0.31 0.00 0.00 175.10 173.78 2qbi s GLU 70 N -2.43 0.76 -0.16 4.82 2.12 -1.26 -1.85 118.70 120.69 2qbi s GLU 70 Ca -0.07 -0.08 0.02 0.00 0.36 0.00 0.00 54.97 55.20 2qbi s GLU 70 Cb -0.02 -0.79 0.02 0.00 0.26 0.00 0.00 34.13 33.59 2qbi s GLU 70 CO -0.04 -0.09 -0.21 0.50 -0.54 0.00 0.00 175.26 174.89 2qbi s ARG 71 N 0.92 3.01 -0.78 4.30 3.52 -0.67 -4.88 118.95 124.38 2qbi s ARG 71 Ca -0.11 -0.84 -0.08 0.00 -0.13 0.00 0.00 55.73 54.57 2qbi s ARG 71 Cb -0.14 -2.52 0.20 0.00 -1.56 0.00 0.00 34.95 30.93 2qbi s ARG 71 CO -0.00 -0.13 0.67 0.14 -0.81 0.00 0.00 175.30 175.17 2qbi s VAL 72 N 1.09 4.80 0.00 7.11 -7.23 -1.26 -0.61 120.40 124.31 2qbi s VAL 72 Ca 0.00 -2.85 0.00 0.00 -1.81 0.00 0.00 61.98 57.32 2qbi s VAL 72 Cb -0.14 -4.01 0.00 0.00 0.56 0.00 0.00 36.38 32.79 2qbi s VAL 72 CO -0.08 -0.99 0.00 0.49 -0.31 0.00 0.00 175.10 174.21 2qbi n PHE 73 N 3.55 -1.96 -2.70 2.82 3.72 -1.26 -4.74 117.46 116.89 2qbi n PHE 73 Ca 0.13 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.46 2qbi n PHE 73 Cb 0.42 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.01 2qbi n PHE 73 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2qbi n GLN 74 N -1.45 1.27 0.00 -1.08 1.13 -1.25 -4.02 117.38 111.99 2qbi n GLN 74 Ca 0.00 -3.00 0.00 0.00 -1.94 0.00 0.00 57.00 52.06 2qbi n GLN 74 Cb 0.00 -1.06 0.00 0.00 0.11 0.00 0.00 30.24 29.29 2qbi n GLN 74 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 2qbi n THR 75 N -0.31 0.00 0.79 5.09 5.66 -0.13 -0.17 114.28 125.21 2qbi n THR 75 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 2qbi n THR 75 Cb 0.82 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.60 2qbi n THR 75 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2qbi n HIS 76 N 0.00 0.00 -3.80 1.09 8.25 -1.26 -4.77 115.22 114.74 2qbi n HIS 76 Ca 0.00 -0.29 -0.35 0.00 -0.26 0.00 0.00 57.72 56.81 2qbi n HIS 76 Cb 0.00 -0.18 -0.09 0.00 1.12 0.00 0.00 29.99 30.84 2qbi n HIS 76 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2qbi s SER 77 N 0.69 5.98 0.41 0.41 0.15 0.76 -4.91 113.70 117.18 2qbi s SER 77 Ca 0.00 0.14 0.21 0.00 0.70 0.00 0.00 55.95 57.00 2qbi s SER 77 Cb 0.00 -2.05 1.16 0.00 -1.71 0.00 0.00 66.02 63.42 2qbi s SER 77 CO 0.00 0.14 1.76 -0.65 1.20 0.00 0.00 173.24 175.69 2qbi h PRO 78 N 6.93 0.33 -0.09 5.44 0.11 -1.90 0.33 132.00 143.16 2qbi h PRO 78 Ca -0.39 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.73 2qbi h PRO 78 Cb 1.16 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qbi h PRO 78 CO 0.71 0.22 0.08 -0.39 -0.21 0.00 0.00 178.00 178.41 2qbi h VAL 79 N 0.34 0.72 -0.40 3.15 -1.51 -1.94 -1.43 116.25 115.18 2qbi h VAL 79 Ca 0.62 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 66.01 2qbi h VAL 79 Cb 1.65 0.94 -0.02 0.00 -2.13 0.00 0.00 31.29 31.74 2qbi h VAL 79 CO -0.30 0.00 -0.08 1.62 -1.23 0.00 0.00 177.57 177.58 2qbi h VAL 80 N 0.00 1.24 0.00 7.19 3.04 -0.63 -2.37 116.25 124.73 2qbi h VAL 80 Ca 0.04 -1.07 0.00 0.00 -1.01 0.00 0.00 66.70 64.66 2qbi h VAL 80 Cb 0.19 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2qbi h VAL 80 CO -0.00 0.36 0.00 -0.67 -1.01 0.00 0.00 177.57 176.25 2qbi n ASP 81 N -4.19 0.00 -4.95 3.17 2.03 -0.54 -4.15 116.55 107.92 2qbi n ASP 81 Ca 0.01 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.09 2qbi n ASP 81 Cb 0.33 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.76 2qbi n ASP 81 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2qbi s SER 82 N -4.00 5.49 -0.30 1.67 1.04 -1.23 -5.02 113.70 111.36 2qbi s SER 82 Ca 0.00 0.27 -0.03 0.00 0.48 0.00 0.00 55.95 56.67 2qbi s SER 82 Cb 0.00 -1.29 0.19 0.00 0.10 0.00 0.00 66.02 65.01 2qbi s SER 82 CO 0.00 -1.01 0.66 -0.51 0.98 0.00 0.00 173.24 173.37 2qbi s ILE 83 N -2.77 -0.91 0.00 -1.02 -1.16 -1.26 -3.02 121.20 111.06 2qbi s ILE 83 Ca 0.54 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.68 2qbi s ILE 83 Cb -0.10 -1.00 0.00 0.00 0.61 0.00 0.00 42.46 41.97 2qbi s ILE 83 CO 0.40 0.00 0.00 -0.24 -2.81 0.00 0.00 174.94 172.29 2qbi n SER 84 N 5.43 -0.28 0.00 4.50 2.88 0.49 -4.81 113.62 121.83 2qbi n SER 84 Ca -0.02 -0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.29 2qbi n SER 84 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 2qbi n SER 84 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2qbi n VAL 85 N -1.11 0.00 0.00 2.46 3.14 -1.26 -3.68 118.33 117.87 2qbi n VAL 85 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2qbi n VAL 85 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2qbi n VAL 85 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2qbi n LYS 86 N 0.00 0.00 -4.08 1.45 4.01 -1.26 -1.71 118.16 116.56 2qbi n LYS 86 Ca 0.00 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.45 2qbi n LYS 86 Cb 0.00 0.00 -0.07 0.00 -0.51 0.00 0.00 35.03 34.45 2qbi n LYS 86 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 2qbi s ARG 87 N 0.00 3.22 0.06 1.97 3.52 -1.26 -4.87 118.95 121.59 2qbi s ARG 87 Ca 0.00 -0.30 0.09 0.00 -0.13 0.00 0.00 55.73 55.38 2qbi s ARG 87 Cb 0.00 -2.99 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 2qbi s ARG 87 CO 0.00 0.72 -0.23 -0.98 -0.81 0.00 0.00 175.30 174.01 2qbi s ARG 88 N -1.19 1.86 0.03 5.12 1.70 -1.26 0.19 118.95 125.40 2qbi s ARG 88 Ca 0.17 -1.09 -0.13 0.00 -0.47 0.00 0.00 55.73 54.21 2qbi s ARG 88 Cb -0.12 -2.06 0.02 0.00 -0.57 0.00 0.00 34.95 32.22 2qbi s ARG 88 CO 0.06 0.51 0.27 0.20 -1.08 0.00 0.00 175.30 175.27 2qbi s GLY 89 N -1.48 -0.08 0.28 3.88 0.00 -1.26 -1.10 107.32 107.56 2qbi s GLY 89 Ca 0.14 -0.03 -0.29 0.00 0.00 0.00 0.00 44.72 44.53 2qbi s GLY 89 CO 0.04 -0.23 1.16 0.00 0.00 0.00 0.00 173.10 174.07 2qbi s ALA 90 N -2.35 3.43 0.01 3.20 0.00 0.22 -4.15 121.76 122.12 2qbi s ALA 90 Ca -0.06 1.00 0.00 0.00 0.00 0.00 0.00 51.96 52.89 2qbi s ALA 90 Cb -0.02 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2qbi s ALA 90 CO -0.02 -0.30 0.00 0.28 0.00 0.00 0.00 175.76 175.72 2qbi n VAL 91 N 1.21 0.02 -2.59 0.00 0.31 -1.26 -4.22 118.33 111.80 2qbi n VAL 91 Ca -0.00 0.01 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 2qbi n VAL 91 Cb 0.44 -0.88 0.04 0.00 -0.91 0.00 0.00 33.84 32.53 2qbi n VAL 91 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2qbi n ARG 92 N -2.72 -1.83 -3.62 5.55 0.63 -1.26 -5.04 116.66 108.36 2qbi n ARG 92 Ca 0.00 0.51 -0.05 0.00 -0.92 0.00 0.00 57.85 57.39 2qbi n ARG 92 Cb 0.18 -4.14 -0.05 0.00 0.45 0.00 0.00 32.46 28.90 2qbi n ARG 92 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2qbi s LYS 93 N -4.01 0.26 -0.12 -0.14 2.47 -1.26 -5.06 119.74 111.88 2qbi s LYS 93 Ca 0.22 0.09 -0.09 0.00 -1.56 0.00 0.00 55.97 54.64 2qbi s LYS 93 Cb -0.03 0.12 -0.26 0.00 -1.46 0.00 0.00 37.83 36.20 2qbi s LYS 93 CO 0.43 -0.08 0.40 0.00 0.16 0.00 0.00 175.35 176.27 2qbi h ALA 94 N 2.44 0.38 -3.17 3.13 0.00 -1.95 -3.45 119.26 116.64 2qbi h ALA 94 Ca -0.14 -1.34 -0.64 0.00 0.00 0.00 0.00 54.91 52.79 2qbi h ALA 94 Cb 1.18 0.68 -0.35 0.00 0.00 0.00 0.00 17.79 19.30 2qbi h ALA 94 CO 0.24 1.22 -0.85 0.15 0.00 0.00 0.00 179.25 180.01 2qbi s LYS 95 N -2.55 2.68 -0.71 0.00 3.01 -1.26 -4.58 119.74 116.34 2qbi s LYS 95 Ca -0.22 -0.72 -0.01 0.00 -1.01 0.00 0.00 55.97 54.01 2qbi s LYS 95 Cb 0.06 -2.26 0.40 0.00 -1.01 0.00 0.00 37.83 35.02 2qbi s LYS 95 CO 0.77 -0.11 1.88 1.28 0.51 0.00 0.00 175.35 179.68 2qbi n LEU 96 N 4.34 7.13 0.25 3.17 4.32 0.15 -4.60 117.00 131.76 2qbi n LEU 96 Ca -0.19 -4.69 0.11 0.00 -0.02 0.00 0.00 56.01 51.21 2qbi n LEU 96 Cb 0.51 -0.93 0.64 0.00 -1.62 0.00 0.00 43.42 42.02 2qbi n LEU 96 CO 0.25 1.74 0.93 1.88 -1.22 0.00 0.00 177.39 180.96 2qbi h TYR 97 N 2.57 0.00 0.00 -1.77 0.99 -1.96 0.21 116.97 117.00 2qbi h TYR 97 Ca 0.54 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.27 2qbi h TYR 97 Cb 0.48 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.21 2qbi h TYR 97 CO 1.21 0.16 0.00 2.48 -0.00 0.00 0.00 178.16 182.01 2qbi n TYR 98 N -3.74 0.69 1.89 4.88 4.11 -1.26 -0.49 117.16 123.25 2qbi n TYR 98 Ca -0.02 0.33 0.11 0.00 -0.00 0.00 0.00 57.90 58.32 2qbi n TYR 98 Cb 0.27 -1.03 0.59 0.00 -0.00 0.00 0.00 39.34 39.17 2qbi n TYR 98 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.86 176.75 2qbi n LEU 99 N -2.18 0.25 0.00 -3.48 -0.00 0.06 -4.40 117.00 107.24 2qbi n LEU 99 Ca -0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 56.01 55.91 2qbi n LEU 99 Cb 0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.50 2qbi n LEU 99 CO 0.12 0.05 0.00 0.54 -0.00 0.00 0.00 177.39 178.10 2qbi n ARG 100 N -0.66 0.00 -1.61 1.96 3.00 0.36 -4.31 116.66 115.40 2qbi n ARG 100 Ca 0.16 0.00 -0.15 0.00 -0.01 0.00 0.00 57.85 57.85 2qbi n ARG 100 Cb 0.11 -0.10 -0.09 0.00 0.00 0.00 0.00 32.46 32.38 2qbi n ARG 100 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.63 175.80 2qbi s GLU 101 N 0.00 1.48 0.17 5.56 4.04 -1.26 -4.30 118.70 124.39 2qbi s GLU 101 Ca 0.00 0.06 0.00 0.00 0.04 0.00 0.00 54.97 55.07 2qbi s GLU 101 Cb 0.00 -4.88 0.00 0.00 0.02 0.00 0.00 34.13 29.27 2qbi s GLU 101 CO 0.00 -4.83 0.00 0.54 -1.84 0.00 0.00 175.26 169.13 2qbi n ARG 102 N 8.55 0.00 -0.83 -4.83 5.12 -1.26 -5.04 116.66 118.38 2qbi n ARG 102 Ca 0.44 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 56.47 2qbi n ARG 102 Cb 0.45 -0.13 -0.04 0.00 -1.16 0.00 0.00 32.46 31.58 2qbi n ARG 102 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 2qbi n THR 103 N -3.24 -0.04 -1.13 0.55 -1.04 -1.26 -4.23 114.28 103.90 2qbi n THR 103 Ca 0.00 0.30 -0.37 0.00 -2.04 0.00 0.00 64.05 61.94 2qbi n THR 103 Cb 0.04 -0.58 0.03 0.00 -1.82 0.00 0.00 70.33 68.00 2qbi n THR 103 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qbi n GLY 104 N -3.52 -3.80 5.00 3.41 0.00 -1.26 -0.20 105.19 104.82 2qbi n GLY 104 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2qbi n GLY 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qbi n LYS 105 N 1.81 0.00 0.27 1.61 4.76 -1.26 -3.90 118.16 121.45 2qbi n LYS 105 Ca 0.03 0.00 0.15 0.00 -2.87 0.00 0.00 58.31 55.62 2qbi n LYS 105 Cb 0.51 0.00 0.70 0.00 -1.84 0.00 0.00 35.03 34.41 2qbi n LYS 105 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qbi h ALA 106 N 0.00 1.09 0.00 7.82 0.00 -1.72 -1.75 119.26 124.69 2qbi h ALA 106 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2qbi h ALA 106 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2qbi h ALA 106 CO 0.00 0.12 -0.52 0.00 0.00 0.00 0.00 179.25 178.85 2qbi n ALA 107 N -2.18 3.06 -1.67 0.00 0.00 0.72 -4.87 120.51 115.58 2qbi n ALA 107 Ca -0.01 -0.26 -0.51 0.00 0.00 0.00 0.00 53.44 52.66 2qbi n ALA 107 Cb 0.29 -1.19 -0.06 0.00 0.00 0.00 0.00 19.45 18.50 2qbi n ALA 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qbi n ARG 108 N -1.87 1.65 -4.28 0.00 1.74 -0.66 -4.96 116.66 108.28 2qbi n ARG 108 Ca 0.04 0.60 -0.34 0.00 -0.77 0.00 0.00 57.85 57.39 2qbi n ARG 108 Cb 0.40 -2.34 -0.14 0.00 -1.02 0.00 0.00 32.46 29.35 2qbi n ARG 108 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2qbi s ILE 109 N 2.46 3.07 0.23 0.55 -4.36 -1.26 -5.04 121.20 116.85 2qbi s ILE 109 Ca 0.90 -0.62 -0.32 0.00 -0.26 0.00 0.00 60.65 60.35 2qbi s ILE 109 Cb -0.86 -2.34 -0.13 0.00 1.25 0.00 0.00 42.46 40.38 2qbi s ILE 109 CO 0.52 0.48 1.52 0.29 0.24 0.00 0.00 174.94 177.99 2qbi n LYS 110 N 4.27 2.27 -0.19 0.37 4.01 -1.26 -4.90 118.16 122.73 2qbi n LYS 110 Ca -0.19 0.81 -0.14 0.00 -0.51 0.00 0.00 58.31 58.29 2qbi n LYS 110 Cb 0.51 -2.54 0.14 0.00 -0.51 0.00 0.00 35.03 32.63 2qbi n LYS 110 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 2qbi n GLU 111 N 2.59 -2.50 -0.02 1.97 -0.00 -1.26 -0.65 120.64 120.77 2qbi n GLU 111 Ca 0.13 -0.67 -0.01 0.00 -0.00 0.00 0.00 57.16 56.61 2qbi n GLU 111 Cb 0.32 -0.99 -0.00 0.00 -0.00 0.00 0.00 31.44 30.77 2qbi n GLU 111 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2qbi h ARG 112 N 0.00 0.00 -5.18 3.44 9.65 -1.36 0.63 114.38 121.56 2qbi h ARG 112 Ca -0.18 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.70 2qbi h ARG 112 Cb 0.61 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.19 2qbi h ARG 112 CO 0.11 0.00 -0.99 -0.11 2.80 0.00 0.00 179.97 181.78 2qbi n LEU 113 N -3.11 -7.94 -0.32 3.80 7.94 -1.26 -4.57 117.00 111.53 2qbi n LEU 113 Ca -0.02 1.41 0.04 0.00 -1.11 0.00 0.00 56.01 56.32 2qbi n LEU 113 Cb 0.08 -3.32 0.03 0.00 0.53 0.00 0.00 43.42 40.74 2qbi n LEU 113 CO 0.03 -3.18 0.38 0.59 -1.11 0.00 0.00 177.39 174.10