#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bh5 s GLY 3 N 0.00 1.39 -0.40 8.31 0.00 -1.26 -4.86 107.32 110.51 2bh5 s GLY 3 Ca 0.00 -0.80 -0.10 0.00 0.00 0.00 0.00 44.72 43.82 2bh5 s GLY 3 CO 0.00 -0.72 0.23 -0.35 0.00 0.00 0.00 173.10 172.27 2bh5 s ASP 4 N -4.03 5.66 0.50 1.64 -1.08 -1.26 -4.88 116.67 113.22 2bh5 s ASP 4 Ca 0.42 -1.29 0.16 0.00 -0.52 0.00 0.00 52.55 51.31 2bh5 s ASP 4 Cb -0.10 -2.00 1.21 0.00 -1.46 0.00 0.00 42.92 40.58 2bh5 s ASP 4 CO 0.38 -0.47 2.11 0.00 0.52 0.00 0.00 175.17 177.71 2bh5 h ALA 5 N 8.41 1.93 -0.43 3.66 0.00 -1.85 0.32 119.26 131.31 2bh5 h ALA 5 Ca -0.24 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 2bh5 h ALA 5 Cb 1.09 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2bh5 h ALA 5 CO 0.72 0.05 -0.19 0.00 0.00 0.00 0.00 179.25 179.83 2bh5 h ALA 6 N 1.96 0.60 -0.31 0.00 0.00 -1.94 0.23 119.26 119.80 2bh5 h ALA 6 Ca -0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2bh5 h ALA 6 Cb 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2bh5 h ALA 6 CO 0.01 0.56 -0.29 0.87 0.00 0.00 0.00 179.25 180.39 2bh5 h LYS 7 N 0.71 0.64 -0.46 0.00 1.57 -1.70 -3.10 116.57 114.23 2bh5 h LYS 7 Ca 0.10 -0.28 -0.06 0.00 -1.87 0.00 0.00 60.65 58.54 2bh5 h LYS 7 Cb 0.75 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 2bh5 h LYS 7 CO 0.06 0.86 0.03 0.78 -0.57 0.00 0.00 179.45 180.61 2bh5 h GLY 8 N 1.00 0.79 1.00 3.86 0.00 -0.67 -2.29 103.07 106.76 2bh5 h GLY 8 Ca 0.07 -0.50 0.06 0.00 0.00 0.00 0.00 47.33 46.96 2bh5 h GLY 8 CO 0.06 0.46 0.53 -2.09 0.00 0.00 0.00 176.54 175.50 2bh5 h GLU 9 N 0.70 0.88 -0.08 4.80 4.81 -0.87 -1.13 114.58 123.69 2bh5 h GLU 9 Ca 0.14 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.23 2bh5 h GLU 9 Cb 0.39 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2bh5 h GLU 9 CO 0.01 0.59 -0.32 0.87 -0.73 0.00 0.00 179.01 179.43 2bh5 h LYS 10 N 0.91 0.35 -0.05 1.92 1.57 -1.50 -3.06 116.57 116.71 2bh5 h LYS 10 Ca 0.34 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2bh5 h LYS 10 Cb 0.17 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 2bh5 h LYS 10 CO -0.11 0.91 0.05 0.93 -0.57 0.00 0.00 179.45 180.65 2bh5 h GLU 11 N -0.13 0.00 0.00 3.15 4.39 -1.21 -2.07 114.58 118.71 2bh5 h GLU 11 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2bh5 h GLU 11 Cb 0.96 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 2bh5 h GLU 11 CO 0.07 0.00 0.00 0.34 -1.16 0.00 0.00 179.01 178.26 2bh5 n PHE 12 N -4.22 0.57 0.25 4.33 7.35 -0.45 -1.23 117.46 124.06 2bh5 n PHE 12 Ca -0.02 0.25 0.17 0.00 -0.76 0.00 0.00 57.45 57.09 2bh5 n PHE 12 Cb 0.15 -0.90 0.89 0.00 0.35 0.00 0.00 39.48 39.96 2bh5 n PHE 12 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2bh5 h ASN 13 N 0.00 0.00 1.60 -2.13 2.35 -1.49 0.16 115.58 116.06 2bh5 h ASN 13 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2bh5 h ASN 13 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2bh5 h ASN 13 CO 0.00 0.00 0.00 0.11 -1.65 0.00 0.00 177.43 175.89 2bh5 h LYS 14 N 0.00 0.00 0.00 0.81 1.57 -1.39 -3.30 116.57 114.25 2bh5 h LYS 14 Ca 0.05 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.57 2bh5 h LYS 14 Cb 0.33 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.60 2bh5 h LYS 14 CO -0.00 0.00 -2.07 0.00 -0.57 0.00 0.00 179.45 176.81 2bh5 n LYS 16 N -2.72 0.15 -0.03 0.00 2.85 -0.46 -1.54 118.16 116.41 2bh5 n LYS 16 Ca -0.22 0.29 0.11 0.00 -1.05 0.00 0.00 58.31 57.44 2bh5 n LYS 16 Cb 0.98 -1.74 0.51 0.00 -0.65 0.00 0.00 35.03 34.13 2bh5 n LYS 16 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2bh5 h ALA 17 N 2.46 1.99 0.00 0.58 0.00 -1.80 -0.58 119.26 121.91 2bh5 h ALA 17 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bh5 h ALA 17 Cb 0.45 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2bh5 h ALA 17 CO 0.00 -0.09 -1.13 0.00 0.00 0.00 0.00 179.25 178.03 2bh5 s HIS 19 N -2.23 1.73 0.32 0.00 3.76 -0.59 -0.27 115.29 118.01 2bh5 s HIS 19 Ca -0.01 -0.47 0.07 0.00 -0.15 0.00 0.00 55.06 54.50 2bh5 s HIS 19 Cb 0.03 -1.16 -0.02 0.00 1.11 0.00 0.00 32.58 32.55 2bh5 s HIS 19 CO 0.18 -0.14 0.42 0.00 -0.85 0.00 0.00 174.74 174.34 2bh5 s MET 20 N -0.06 3.06 -0.29 1.40 0.00 -1.18 -4.00 119.30 118.23 2bh5 s MET 20 Ca -0.02 -1.05 0.03 0.00 0.00 0.00 0.00 55.69 54.65 2bh5 s MET 20 Cb -0.11 -2.75 0.08 0.00 0.00 0.00 0.00 34.83 32.05 2bh5 s MET 20 CO 0.02 0.11 -0.03 0.08 0.00 0.00 0.00 175.02 175.20 2bh5 s VAL 21 N -2.18 1.99 -0.08 5.16 1.01 -0.33 -1.30 120.40 124.68 2bh5 s VAL 21 Ca 0.43 -1.80 0.01 0.00 0.00 0.00 0.00 61.98 60.62 2bh5 s VAL 21 Cb -0.09 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 34.02 2bh5 s VAL 21 CO 0.30 -0.30 -0.10 -1.58 0.00 0.00 0.00 175.10 173.42 2bh5 s GLN 22 N 1.12 1.58 0.72 2.72 0.74 -1.26 -0.74 119.66 124.53 2bh5 s GLN 22 Ca 0.00 -0.34 -0.11 0.00 0.05 0.00 0.00 55.36 54.96 2bh5 s GLN 22 Cb -0.19 -1.41 0.02 0.00 1.10 0.00 0.00 33.01 32.53 2bh5 s GLN 22 CO -0.08 -0.07 1.07 0.00 -0.55 0.00 0.00 175.29 175.66 2bh5 s ALA 23 N 0.99 2.55 0.59 1.58 0.00 0.08 -4.62 121.76 122.92 2bh5 s ALA 23 Ca -0.09 0.08 0.36 0.00 0.00 0.00 0.00 51.96 52.32 2bh5 s ALA 23 Cb -0.15 -3.18 2.04 0.00 0.00 0.00 0.00 23.12 21.83 2bh5 s ALA 23 CO -0.00 -1.38 2.28 -1.35 0.00 0.00 0.00 175.76 175.31 2bh5 h PRO 24 N -0.84 0.00 -0.08 0.00 0.11 -1.98 0.11 132.00 129.33 2bh5 h PRO 24 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2bh5 h PRO 24 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2bh5 h PRO 24 CO 0.56 0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 2bh5 n ASP 25 N -3.47 0.56 0.00 -2.05 5.75 -1.26 -4.87 116.55 111.21 2bh5 n ASP 25 Ca -0.03 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.05 2bh5 n ASP 25 Cb 0.10 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 2bh5 n ASP 25 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bh5 n GLY 26 N 0.82 1.02 3.71 6.12 0.00 0.03 -5.03 105.19 111.85 2bh5 n GLY 26 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2bh5 n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bh5 s THR 27 N -2.56 3.08 -0.32 2.61 2.01 -1.25 -4.74 115.64 114.47 2bh5 s THR 27 Ca 0.00 0.74 -0.24 0.00 0.31 0.00 0.00 61.69 62.50 2bh5 s THR 27 Cb 0.00 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 69.04 2bh5 s THR 27 CO 0.00 0.05 0.84 -1.81 -0.69 0.00 0.00 174.62 173.01 2bh5 s ASP 28 N 1.30 6.69 -0.18 3.53 1.01 -1.26 -0.74 116.67 127.01 2bh5 s ASP 28 Ca 0.67 0.66 -0.21 0.00 0.71 0.00 0.00 52.55 54.39 2bh5 s ASP 28 Cb -0.39 -2.43 -0.18 0.00 1.01 0.00 0.00 42.92 40.93 2bh5 s ASP 28 CO 0.30 -0.70 0.29 0.40 0.21 0.00 0.00 175.17 175.68 2bh5 h ILE 29 N 5.67 0.97 -3.20 0.77 2.04 -1.31 -3.45 117.51 118.99 2bh5 h ILE 29 Ca -0.24 -2.00 -0.59 0.00 1.00 0.00 0.00 64.86 63.03 2bh5 h ILE 29 Cb 1.09 2.10 -0.36 0.00 -0.74 0.00 0.00 36.82 38.91 2bh5 h ILE 29 CO 0.92 0.33 -0.82 -0.69 0.00 0.00 0.00 178.15 177.89 2bh5 s VAL 30 N -2.26 1.50 0.03 1.67 1.01 -0.69 -4.98 120.40 116.68 2bh5 s VAL 30 Ca -0.23 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 60.77 2bh5 s VAL 30 Cb 0.03 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2bh5 s VAL 30 CO 0.53 0.36 1.11 -0.75 0.00 0.00 0.00 175.10 176.36 2bh5 s LYS 31 N 1.50 4.48 0.06 2.72 2.36 -1.26 -1.18 119.74 128.41 2bh5 s LYS 31 Ca 0.03 1.63 -0.02 0.00 -2.55 0.00 0.00 55.97 55.06 2bh5 s LYS 31 Cb -0.14 -3.40 0.01 0.00 -1.05 0.00 0.00 37.83 33.25 2bh5 s LYS 31 CO -0.10 -0.19 0.13 0.41 1.55 0.00 0.00 175.35 177.15 2bh5 n GLY 32 N 3.10 1.95 3.92 5.54 0.00 -1.26 -4.92 105.19 113.52 2bh5 n GLY 32 Ca 0.08 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2bh5 n GLY 32 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bh5 s GLY 33 N -1.34 1.81 0.00 -0.02 0.00 -0.23 -4.54 107.32 103.00 2bh5 s GLY 33 Ca 0.03 -1.31 0.01 0.00 0.00 0.00 0.00 44.72 43.44 2bh5 s GLY 33 CO 0.02 -0.47 0.93 0.28 0.00 0.00 0.00 173.10 173.86 2bh5 n LYS 34 N -3.93 2.36 0.02 2.90 5.02 -1.24 -3.11 118.16 120.19 2bh5 n LYS 34 Ca 0.17 -1.37 -0.01 0.00 -2.02 0.00 0.00 58.31 55.08 2bh5 n LYS 34 Cb 0.59 -1.01 0.28 0.00 -0.02 0.00 0.00 35.03 34.87 2bh5 n LYS 34 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2bh5 h THR 35 N 0.11 1.22 -1.82 -0.18 2.02 -1.82 -3.43 112.91 109.01 2bh5 h THR 35 Ca 0.00 -0.93 -0.59 0.00 0.77 0.00 0.00 66.41 65.66 2bh5 h THR 35 Cb 0.43 1.11 -0.11 0.00 -1.74 0.00 0.00 68.15 67.85 2bh5 h THR 35 CO 0.00 0.31 -0.59 -0.83 0.37 0.00 0.00 175.52 174.77 2bh5 s GLY 36 N -3.93 2.20 0.68 2.16 0.00 0.62 -5.05 107.32 104.01 2bh5 s GLY 36 Ca -0.07 -2.05 -0.15 0.00 0.00 0.00 0.00 44.72 42.45 2bh5 s GLY 36 CO 0.77 -1.94 1.14 2.56 0.00 0.00 0.00 173.10 175.63 2bh5 s PRO 37 N -3.75 2.58 0.11 2.90 0.04 -1.26 -4.60 135.00 131.02 2bh5 s PRO 37 Ca 0.36 1.52 -0.36 0.00 0.04 0.00 0.00 61.00 62.56 2bh5 s PRO 37 Cb 0.02 -1.91 -0.16 0.00 0.04 0.00 0.00 34.50 32.49 2bh5 s PRO 37 CO 0.20 -1.45 1.36 -1.71 0.04 0.00 0.00 177.00 175.44 2bh5 n ASN 38 N -2.50 1.87 -0.90 6.66 5.15 -1.26 -4.41 115.26 119.87 2bh5 n ASN 38 Ca 0.11 1.12 0.09 0.00 -0.60 0.00 0.00 54.58 55.30 2bh5 n ASN 38 Cb 0.51 -1.24 0.16 0.00 -0.53 0.00 0.00 39.78 38.68 2bh5 n ASN 38 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2bh5 n LEU 39 N 2.60 3.00 -4.73 1.20 4.77 -0.42 -4.89 117.00 118.55 2bh5 n LEU 39 Ca 0.18 -1.42 -0.42 0.00 -0.03 0.00 0.00 56.01 54.32 2bh5 n LEU 39 Cb 0.21 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 2bh5 n LEU 39 CO 0.62 0.64 1.33 -0.47 -1.33 0.00 0.00 177.39 178.18 2bh5 s TYR 40 N -1.34 2.88 -0.99 -1.77 6.14 -1.26 -2.36 117.35 118.65 2bh5 s TYR 40 Ca 0.29 0.46 0.00 0.00 0.64 0.00 0.00 57.07 58.47 2bh5 s TYR 40 Cb 0.18 -4.11 0.00 0.00 0.42 0.00 0.00 41.96 38.45 2bh5 s TYR 40 CO 0.25 -4.09 0.00 0.41 0.64 0.00 0.00 175.55 172.76 2bh5 n GLY 41 N 3.55 1.08 0.16 8.97 0.00 -0.19 -4.91 105.19 113.86 2bh5 n GLY 41 Ca 0.14 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2bh5 n GLY 41 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bh5 h VAL 42 N 0.00 1.37 -2.98 1.61 3.04 -1.73 -3.35 116.25 114.21 2bh5 h VAL 42 Ca -0.19 -1.75 -0.57 0.00 -1.01 0.00 0.00 66.70 63.18 2bh5 h VAL 42 Cb 0.62 1.94 -0.04 0.00 -2.01 0.00 0.00 31.29 31.80 2bh5 h VAL 42 CO 0.28 0.50 0.94 -0.69 -1.01 0.00 0.00 177.57 177.60 2bh5 s VAL 43 N -3.87 4.18 0.00 1.51 1.01 -1.26 -1.94 120.40 120.03 2bh5 s VAL 43 Ca -0.02 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.35 2bh5 s VAL 43 Cb 0.13 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2bh5 s VAL 43 CO 0.75 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2bh5 n GLY 44 N 3.93 0.72 3.80 4.51 0.00 0.67 -4.54 105.19 114.28 2bh5 n GLY 44 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2bh5 n GLY 44 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bh5 s ARG 45 N -0.60 4.27 0.27 1.61 3.52 -0.82 -4.67 118.95 122.54 2bh5 s ARG 45 Ca 0.00 0.82 -0.30 0.00 -0.13 0.00 0.00 55.73 56.12 2bh5 s ARG 45 Cb 0.00 -3.24 -0.14 0.00 -1.56 0.00 0.00 34.95 30.01 2bh5 s ARG 45 CO 0.00 0.63 1.21 1.17 -0.81 0.00 0.00 175.30 177.50 2bh5 n LYS 46 N 1.70 1.71 -1.66 5.12 4.81 -1.26 -0.84 118.16 127.74 2bh5 n LYS 46 Ca -0.09 0.60 -0.46 0.00 -0.87 0.00 0.00 58.31 57.49 2bh5 n LYS 46 Cb 0.50 -2.13 -0.04 0.00 0.02 0.00 0.00 35.03 33.39 2bh5 n LYS 46 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2bh5 n ILE 47 N 0.90 0.50 -3.69 3.15 2.08 -1.05 -3.35 119.36 117.90 2bh5 n ILE 47 Ca 0.10 -0.12 -0.23 0.00 0.56 0.00 0.00 62.75 63.05 2bh5 n ILE 47 Cb 0.32 -1.44 0.03 0.00 -0.75 0.00 0.00 39.64 37.80 2bh5 n ILE 47 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2bh5 n ALA 48 N 2.55 -2.15 -0.46 -1.39 0.00 -1.26 -4.80 120.51 113.00 2bh5 n ALA 48 Ca 0.14 -0.17 0.02 0.00 0.00 0.00 0.00 53.44 53.43 2bh5 n ALA 48 Cb 0.29 -2.58 0.02 0.00 0.00 0.00 0.00 19.45 17.19 2bh5 n ALA 48 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bh5 n SER 49 N -2.99 1.58 -4.67 0.00 3.41 -1.21 -4.99 113.62 104.75 2bh5 n SER 49 Ca -0.25 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 55.96 2bh5 n SER 49 Cb 0.66 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 2bh5 n SER 49 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2bh5 s VAL 50 N -1.06 3.78 0.21 -3.33 1.01 -1.26 -4.93 120.40 114.83 2bh5 s VAL 50 Ca 0.05 1.03 -0.31 0.00 0.00 0.00 0.00 61.98 62.75 2bh5 s VAL 50 Cb 0.04 -3.66 -0.11 0.00 0.00 0.00 0.00 36.38 32.66 2bh5 s VAL 50 CO 0.00 -0.06 1.57 -0.70 0.00 0.00 0.00 175.10 175.91 2bh5 s GLU 51 N 3.37 4.20 0.00 2.72 2.12 -1.26 -2.57 118.70 127.28 2bh5 s GLU 51 Ca 0.66 2.42 0.00 0.00 0.36 0.00 0.00 54.97 58.41 2bh5 s GLU 51 Cb -0.30 -3.11 0.00 0.00 0.26 0.00 0.00 34.13 30.98 2bh5 s GLU 51 CO 0.25 -0.59 0.00 0.41 -0.54 0.00 0.00 175.26 174.79 2bh5 n GLY 52 N 3.19 1.49 3.78 -1.50 0.00 -1.26 -5.04 105.19 105.86 2bh5 n GLY 52 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2bh5 n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bh5 s PHE 53 N -2.62 3.77 -0.85 1.61 5.36 -1.06 -5.02 117.98 119.17 2bh5 s PHE 53 Ca 0.00 1.30 -0.18 0.00 -0.96 0.00 0.00 56.93 57.09 2bh5 s PHE 53 Cb 0.00 -2.59 0.15 0.00 -0.34 0.00 0.00 43.02 40.24 2bh5 s PHE 53 CO 0.00 0.47 0.98 0.15 -1.46 0.00 0.00 175.22 175.35 2bh5 s LYS 54 N -0.68 3.52 0.69 10.12 1.02 -1.26 -4.95 119.74 128.19 2bh5 s LYS 54 Ca 0.31 -1.86 -0.11 0.00 0.02 0.00 0.00 55.97 54.33 2bh5 s LYS 54 Cb -0.19 -4.68 0.00 0.00 -0.52 0.00 0.00 37.83 32.43 2bh5 s LYS 54 CO 0.19 -1.62 1.06 0.71 -0.92 0.00 0.00 175.35 174.77 2bh5 s TYR 55 N 2.08 3.27 0.74 3.18 2.02 -1.26 -5.06 117.35 122.32 2bh5 s TYR 55 Ca 0.26 1.29 -0.11 0.00 -0.37 0.00 0.00 57.07 58.14 2bh5 s TYR 55 Cb -0.09 -2.89 0.04 0.00 -0.40 0.00 0.00 41.96 38.62 2bh5 s TYR 55 CO -0.07 -1.12 1.09 0.20 -1.57 0.00 0.00 175.55 174.08 2bh5 s GLY 56 N -4.01 1.63 0.28 0.71 0.00 -1.26 -4.94 107.32 99.73 2bh5 s GLY 56 Ca 0.57 -0.20 -0.03 0.00 0.00 0.00 0.00 44.72 45.06 2bh5 s GLY 56 CO 0.54 0.18 1.89 -0.55 0.00 0.00 0.00 173.10 175.16 2bh5 h ASP 57 N -0.85 0.92 0.06 1.64 3.32 -1.98 -2.76 116.42 116.77 2bh5 h ASP 57 Ca -0.46 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.50 2bh5 h ASP 57 Cb 1.25 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.57 2bh5 h ASP 57 CO 0.61 0.76 -0.03 1.23 -1.72 0.00 0.00 179.24 180.09 2bh5 h GLY 58 N 1.07 -0.09 1.99 2.75 0.00 -1.73 -0.85 103.07 106.21 2bh5 h GLY 58 Ca 0.25 0.03 -0.14 0.00 0.00 0.00 0.00 47.33 47.48 2bh5 h GLY 58 CO -0.04 -0.03 -0.64 1.19 0.00 0.00 0.00 176.54 177.02 2bh5 h ILE 59 N -0.16 1.46 -0.40 2.60 2.10 -1.72 -1.88 117.51 119.51 2bh5 h ILE 59 Ca -0.01 -2.19 -0.09 0.00 1.08 0.00 0.00 64.86 63.65 2bh5 h ILE 59 Cb 0.13 2.18 -0.02 0.00 -1.09 0.00 0.00 36.82 38.03 2bh5 h ILE 59 CO 0.01 0.63 -0.12 -0.07 -1.08 0.00 0.00 178.15 177.52 2bh5 h LEU 60 N 0.01 0.71 -0.54 2.19 3.38 -1.40 -1.69 115.31 117.96 2bh5 h LEU 60 Ca -0.01 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2bh5 h LEU 60 Cb 1.14 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2bh5 h LEU 60 CO 0.08 0.86 0.22 -0.08 0.09 0.00 0.00 178.44 179.61 2bh5 h GLU 61 N 0.66 0.81 -0.53 1.13 4.81 -0.77 0.42 114.58 121.10 2bh5 h GLU 61 Ca 0.11 -0.14 0.08 0.00 -0.13 0.00 0.00 59.36 59.28 2bh5 h GLU 61 Cb 0.58 -0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.76 2bh5 h GLU 61 CO 0.04 0.70 0.16 0.28 -0.73 0.00 0.00 179.01 179.46 2bh5 h VAL 62 N 0.74 0.77 -0.34 0.32 2.07 -0.99 0.12 116.25 118.93 2bh5 h VAL 62 Ca 0.18 -0.11 -0.13 0.00 0.82 0.00 0.00 66.70 67.47 2bh5 h VAL 62 Cb 0.19 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 2bh5 h VAL 62 CO -0.02 0.06 -0.30 0.00 0.02 0.00 0.00 177.57 177.33 2bh5 h ALA 63 N 1.38 0.84 -0.26 1.67 0.00 -0.69 -1.49 119.26 120.70 2bh5 h ALA 63 Ca 0.27 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 2bh5 h ALA 63 Cb 0.33 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2bh5 h ALA 63 CO -0.30 0.64 -0.06 1.49 0.00 0.00 0.00 179.25 181.02 2bh5 h GLU 64 N 0.61 0.51 0.00 0.00 4.81 0.41 -3.07 114.58 117.85 2bh5 h GLU 64 Ca 0.07 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.08 2bh5 h GLU 64 Cb 0.82 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.16 2bh5 h GLU 64 CO 0.07 0.72 -0.14 0.87 -0.73 0.00 0.00 179.01 179.80 2bh5 h LYS 65 N 0.26 0.00 -2.45 1.92 1.57 -0.74 -3.36 116.57 113.76 2bh5 h LYS 65 Ca 0.07 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.25 2bh5 h LYS 65 Cb 0.53 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.44 2bh5 h LYS 65 CO 0.03 0.14 -0.83 0.09 -0.57 0.00 0.00 179.45 178.30 2bh5 n ASN 66 N -3.18 1.27 0.31 0.86 3.02 -0.57 -4.98 115.26 112.00 2bh5 n ASN 66 Ca 0.02 -2.84 0.19 0.00 -0.03 0.00 0.00 54.58 51.93 2bh5 n ASN 66 Cb 0.51 -0.64 0.96 0.00 -0.61 0.00 0.00 39.78 39.99 2bh5 n ASN 66 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2bh5 h PRO 67 N 4.99 0.00 -0.20 3.52 0.11 -1.70 -1.03 132.00 137.70 2bh5 h PRO 67 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2bh5 h PRO 67 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2bh5 h PRO 67 CO 0.56 0.02 0.00 -0.40 -0.21 0.00 0.00 178.00 177.97 2bh5 n ASP 68 N -3.20 2.83 -4.72 -2.05 5.75 -1.26 -4.96 116.55 108.94 2bh5 n ASP 68 Ca -0.02 -1.90 -0.42 0.00 -0.01 0.00 0.00 54.79 52.45 2bh5 n ASP 68 Cb 0.18 -0.12 -0.03 0.00 -1.03 0.00 0.00 41.12 40.11 2bh5 n ASP 68 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 2bh5 s MET 69 N -1.76 4.59 0.26 0.11 1.75 -0.39 -5.04 119.30 118.81 2bh5 s MET 69 Ca 0.34 1.47 0.08 0.00 -1.25 0.00 0.00 55.69 56.33 2bh5 s MET 69 Cb 0.21 -3.42 -0.05 0.00 2.84 0.00 0.00 34.83 34.40 2bh5 s MET 69 CO 0.31 0.01 -0.11 0.14 -0.65 0.00 0.00 175.02 174.72 2bh5 s VAL 70 N 0.69 1.85 -0.27 10.11 -7.23 -1.26 -2.54 120.40 121.75 2bh5 s VAL 70 Ca 0.51 -2.20 -0.29 0.00 -1.81 0.00 0.00 61.98 58.19 2bh5 s VAL 70 Cb -0.23 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 2bh5 s VAL 70 CO 0.29 -0.39 1.35 0.26 -0.31 0.00 0.00 175.10 176.29 2bh5 s TRP 71 N -2.89 2.61 0.39 2.82 0.52 -0.02 -4.84 118.94 117.53 2bh5 s TRP 71 Ca 0.28 0.83 0.02 0.00 0.02 0.00 0.00 56.10 57.25 2bh5 s TRP 71 Cb 0.01 -3.87 -0.01 0.00 -1.15 0.00 0.00 33.47 28.45 2bh5 s TRP 71 CO 0.11 -1.91 0.57 -1.54 0.02 0.00 0.00 176.95 174.21 2bh5 s SER 72 N 2.91 5.98 0.26 2.95 1.04 -1.26 -0.24 113.70 125.34 2bh5 s SER 72 Ca 0.58 0.16 -0.05 0.00 0.48 0.00 0.00 55.95 57.13 2bh5 s SER 72 Cb -0.19 -1.55 0.32 0.00 0.10 0.00 0.00 66.02 64.70 2bh5 s SER 72 CO 0.23 -0.52 1.93 -0.33 0.98 0.00 0.00 173.24 175.54 2bh5 h GLU 73 N 0.65 1.24 -0.35 4.02 5.08 -1.98 -0.97 114.58 122.26 2bh5 h GLU 73 Ca -0.47 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 57.79 2bh5 h GLU 73 Cb 1.25 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 2bh5 h GLU 73 CO 0.57 0.83 0.16 0.00 -1.00 0.00 0.00 179.01 179.57 2bh5 h ALA 74 N 1.40 0.45 -0.59 3.43 0.00 -2.00 -1.60 119.26 120.35 2bh5 h ALA 74 Ca 0.34 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 2bh5 h ALA 74 Cb -0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2bh5 h ALA 74 CO -0.07 0.03 -0.01 -0.44 0.00 0.00 0.00 179.25 178.76 2bh5 h ASP 75 N 0.42 1.03 -0.80 0.00 3.32 -1.88 -2.38 116.42 116.14 2bh5 h ASP 75 Ca 0.12 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.87 2bh5 h ASP 75 Cb 0.14 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 2bh5 h ASP 75 CO -0.01 1.09 0.53 -0.07 -1.72 0.00 0.00 179.24 179.05 2bh5 h LEU 76 N 0.95 0.93 -0.21 1.55 3.38 -1.03 0.10 115.31 120.98 2bh5 h LEU 76 Ca 0.17 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2bh5 h LEU 76 Cb 0.57 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2bh5 h LEU 76 CO 0.03 0.68 0.08 0.40 0.09 0.00 0.00 178.44 179.72 2bh5 h ILE 77 N 1.09 0.96 -0.26 1.22 2.04 -1.00 -0.15 117.51 121.42 2bh5 h ILE 77 Ca 0.29 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 2bh5 h ILE 77 Cb -0.11 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 2bh5 h ILE 77 CO -0.06 0.03 0.11 -0.33 0.00 0.00 0.00 178.15 177.91 2bh5 h GLU 78 N 0.19 0.37 -0.55 2.37 5.08 -1.13 -2.15 114.58 118.77 2bh5 h GLU 78 Ca 0.09 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2bh5 h GLU 78 Cb 0.05 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2bh5 h GLU 78 CO -0.08 0.39 0.26 -0.92 -1.00 0.00 0.00 179.01 177.66 2bh5 h TYR 79 N 0.27 0.79 0.00 4.33 3.20 -0.76 -2.54 116.97 122.26 2bh5 h TYR 79 Ca 0.09 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2bh5 h TYR 79 Cb 0.14 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.17 2bh5 h TYR 79 CO -0.02 0.61 -0.03 -0.39 -1.64 0.00 0.00 178.16 176.70 2bh5 h VAL 80 N 0.74 0.06 -0.25 1.81 -1.51 -0.98 -2.22 116.25 113.90 2bh5 h VAL 80 Ca 0.19 -0.74 -0.14 0.00 -1.23 0.00 0.00 66.70 64.78 2bh5 h VAL 80 Cb 0.12 1.70 -0.00 0.00 -2.13 0.00 0.00 31.29 30.97 2bh5 h VAL 80 CO -0.02 0.03 -0.38 0.74 -1.23 0.00 0.00 177.57 176.70 2bh5 h THR 81 N 0.00 1.31 -0.78 7.19 2.02 -0.99 -1.38 112.91 120.29 2bh5 h THR 81 Ca -0.00 -1.58 0.02 0.00 0.77 0.00 0.00 66.41 65.62 2bh5 h THR 81 Cb 0.70 1.72 -0.19 0.00 -1.74 0.00 0.00 68.15 68.63 2bh5 h THR 81 CO 0.00 0.50 -0.33 -0.62 0.37 0.00 0.00 175.52 175.45 2bh5 s ASP 82 N -6.65 -1.22 0.18 4.18 -1.08 -1.02 -3.61 116.67 107.45 2bh5 s ASP 82 Ca -0.12 -0.39 -0.13 0.00 -0.52 0.00 0.00 52.55 51.39 2bh5 s ASP 82 Cb 0.08 1.61 0.10 0.00 -1.46 0.00 0.00 42.92 43.25 2bh5 s ASP 82 CO 0.84 -0.16 1.83 -0.65 0.52 0.00 0.00 175.17 177.55 2bh5 h PRO 83 N 6.91 0.67 0.42 4.34 0.11 -1.63 -3.09 132.00 139.73 2bh5 h PRO 83 Ca 0.01 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 2bh5 h PRO 83 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2bh5 h PRO 83 CO 0.06 0.45 -0.20 -0.22 -0.21 0.00 0.00 178.00 177.87 2bh5 h LYS 84 N 0.69 -0.55 -0.21 1.05 1.63 -1.89 -1.90 116.57 115.40 2bh5 h LYS 84 Ca 0.22 0.04 0.04 0.00 -0.85 0.00 0.00 60.65 60.09 2bh5 h LYS 84 Cb -0.02 0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.73 2bh5 h LYS 84 CO -0.08 -0.29 0.14 -1.35 -3.45 0.00 0.00 179.45 174.42 2bh5 h PRO 85 N -0.70 0.09 -0.26 1.90 0.10 -1.99 -0.65 132.00 130.49 2bh5 h PRO 85 Ca -0.06 -0.01 0.01 0.00 0.10 0.00 0.00 66.00 66.05 2bh5 h PRO 85 Cb 0.51 -0.02 -0.02 0.00 0.10 0.00 0.00 31.00 31.57 2bh5 h PRO 85 CO 0.10 0.06 0.14 2.35 0.10 0.00 0.00 178.00 180.75 2bh5 h TRP 86 N 0.09 0.26 -0.84 0.65 7.01 -1.39 0.26 115.95 122.00 2bh5 h TRP 86 Ca 0.09 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 2bh5 h TRP 86 Cb 0.25 -0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 27.19 2bh5 h TRP 86 CO -0.00 0.15 0.47 -0.07 -2.79 0.00 0.00 178.44 176.21 2bh5 h LEU 87 N 0.30 1.04 -0.50 0.65 3.38 -0.40 -1.31 115.31 118.47 2bh5 h LEU 87 Ca 0.10 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2bh5 h LEU 87 Cb 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2bh5 h LEU 87 CO -0.06 0.83 0.26 0.58 0.09 0.00 0.00 178.44 180.14 2bh5 h VAL 88 N 1.16 1.18 -0.63 1.22 2.07 -0.87 0.10 116.25 120.48 2bh5 h VAL 88 Ca 0.30 -0.47 0.05 0.00 0.82 0.00 0.00 66.70 67.39 2bh5 h VAL 88 Cb 0.01 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.31 2bh5 h VAL 88 CO -0.05 0.19 0.36 -0.08 0.02 0.00 0.00 177.57 178.01 2bh5 h GLU 89 N 0.66 0.66 0.08 1.57 4.81 -0.57 0.21 114.58 122.00 2bh5 h GLU 89 Ca 0.17 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 59.11 2bh5 h GLU 89 Cb 0.07 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2bh5 h GLU 89 CO -0.03 0.44 -1.19 0.87 -0.73 0.00 0.00 179.01 178.37 2bh5 h LYS 90 N 0.68 0.17 0.00 1.92 1.79 -0.92 -3.33 116.57 116.88 2bh5 h LYS 90 Ca 0.27 -0.29 -0.22 0.00 -2.18 0.00 0.00 60.65 58.23 2bh5 h LYS 90 Cb 0.12 0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.84 2bh5 h LYS 90 CO -0.15 1.12 -1.52 1.79 -1.08 0.00 0.00 179.45 179.61 2bh5 h THR 91 N 0.05 0.67 -0.22 -0.16 1.35 -0.96 -3.47 112.91 110.15 2bh5 h THR 91 Ca -0.10 -2.32 -0.10 0.00 -0.55 0.00 0.00 66.41 63.34 2bh5 h THR 91 Cb 1.91 2.21 -0.04 0.00 -1.73 0.00 0.00 68.15 70.50 2bh5 h THR 91 CO 0.17 0.38 -0.09 0.61 -0.25 0.00 0.00 175.52 176.35 2bh5 n GLY 92 N 1.46 0.74 3.11 5.82 0.00 0.72 -5.01 105.19 112.03 2bh5 n GLY 92 Ca -0.12 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 2bh5 n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bh5 s ASP 93 N -2.87 4.64 0.64 1.61 -1.08 -1.21 -4.97 116.67 113.43 2bh5 s ASP 93 Ca 0.00 -1.39 0.38 0.00 -0.52 0.00 0.00 52.55 51.02 2bh5 s ASP 93 Cb 0.00 -1.62 2.12 0.00 -1.46 0.00 0.00 42.92 41.96 2bh5 s ASP 93 CO 0.00 -0.23 2.27 0.77 0.52 0.00 0.00 175.17 178.50 2bh5 h SER 94 N 7.85 0.00 -0.63 -0.34 4.64 -1.95 -1.46 113.55 121.66 2bh5 h SER 94 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2bh5 h SER 94 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2bh5 h SER 94 CO 0.49 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.45 2bh5 n ALA 95 N -2.15 3.39 -1.63 5.18 0.00 -1.26 -5.00 120.51 119.05 2bh5 n ALA 95 Ca -0.02 -1.71 -0.49 0.00 0.00 0.00 0.00 53.44 51.22 2bh5 n ALA 95 Cb 0.14 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 2bh5 n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bh5 n ALA 96 N 0.98 0.18 -2.34 0.00 0.00 -0.55 -4.92 120.51 113.86 2bh5 n ALA 96 Ca 0.27 0.48 -0.39 0.00 0.00 0.00 0.00 53.44 53.80 2bh5 n ALA 96 Cb 1.01 -2.21 -0.06 0.00 0.00 0.00 0.00 19.45 18.19 2bh5 n ALA 96 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2bh5 s LYS 97 N 0.62 4.31 0.01 0.00 1.02 -1.26 -4.91 119.74 119.54 2bh5 s LYS 97 Ca 0.81 0.80 0.03 0.00 0.02 0.00 0.00 55.97 57.64 2bh5 s LYS 97 Cb -0.81 -3.29 -0.01 0.00 -0.52 0.00 0.00 37.83 33.19 2bh5 s LYS 97 CO 0.43 0.50 -0.10 -0.08 -0.92 0.00 0.00 175.35 175.17 2bh5 s THR 98 N -0.66 0.78 -2.00 2.17 -1.32 -1.26 -1.92 115.64 111.42 2bh5 s THR 98 Ca 0.31 -0.66 0.10 0.00 -1.21 0.00 0.00 61.69 60.23 2bh5 s THR 98 Cb -0.19 -0.70 0.27 0.00 -1.51 0.00 0.00 72.50 70.37 2bh5 s THR 98 CO 0.19 0.05 1.23 0.29 -2.21 0.00 0.00 174.62 174.18 2bh5 n LYS 99 N 2.38 1.70 -3.59 7.08 5.02 -1.26 -4.87 118.16 124.62 2bh5 n LYS 99 Ca -0.16 -1.09 -0.13 0.00 -2.02 0.00 0.00 58.31 54.90 2bh5 n LYS 99 Cb 0.56 -1.24 -0.06 0.00 -0.02 0.00 0.00 35.03 34.27 2bh5 n LYS 99 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2bh5 s LYS 100 N -1.60 0.78 0.00 1.97 -2.85 -1.26 -5.04 119.74 111.74 2bh5 s LYS 100 Ca 0.21 0.49 0.00 0.00 -1.00 0.00 0.00 55.97 55.67 2bh5 s LYS 100 Cb 0.11 0.37 0.00 0.00 -2.06 0.00 0.00 37.83 36.25 2bh5 s LYS 100 CO 0.14 -0.18 0.46 0.25 0.10 0.00 0.00 175.35 176.12 2bh5 n THR 101 N 1.59 0.14 -1.66 3.79 -2.24 -1.26 -4.60 114.28 110.04 2bh5 n THR 101 Ca -0.14 -0.44 -0.51 0.00 -2.27 0.00 0.00 64.05 60.68 2bh5 n THR 101 Cb 0.56 1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 69.88 2bh5 n THR 101 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2bh5 n PHE 102 N -0.07 2.01 -4.71 4.78 7.35 -1.26 -4.70 117.46 120.85 2bh5 n PHE 102 Ca 0.00 0.39 -0.33 0.00 -0.76 0.00 0.00 57.45 56.74 2bh5 n PHE 102 Cb 0.11 -2.49 -0.13 0.00 0.35 0.00 0.00 39.48 37.33 2bh5 n PHE 102 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2bh5 s LYS 103 N 2.19 2.91 -0.35 -4.13 1.02 -1.26 -4.51 119.74 115.62 2bh5 s LYS 103 Ca 0.89 -0.62 -0.06 0.00 0.02 0.00 0.00 55.97 56.19 2bh5 s LYS 103 Cb -0.87 -2.57 0.04 0.00 -0.52 0.00 0.00 37.83 33.92 2bh5 s LYS 103 CO 0.51 0.51 0.12 -1.17 -0.92 0.00 0.00 175.35 174.39 2bh5 s LEU 104 N -0.41 4.40 0.12 3.17 2.96 -0.52 -5.00 118.68 123.40 2bh5 s LEU 104 Ca 0.05 -1.19 0.05 0.00 -0.22 0.00 0.00 54.13 52.82 2bh5 s LEU 104 Cb -0.12 -1.87 -0.20 0.00 0.50 0.00 0.00 46.19 44.50 2bh5 s LEU 104 CO 0.02 -0.35 1.27 1.23 -1.32 0.00 0.00 176.35 177.20 2bh5 h GLY 105 N 8.22 0.08 -2.71 7.98 0.00 -1.86 -3.37 103.07 111.41 2bh5 h GLY 105 Ca -0.23 -0.19 -0.29 0.00 0.00 0.00 0.00 47.33 46.62 2bh5 h GLY 105 CO 0.61 0.16 -0.67 -1.59 0.00 0.00 0.00 176.54 175.06 2bh5 s LYS 106 N -2.75 1.11 -1.44 4.80 -2.85 -1.26 -4.87 119.74 112.47 2bh5 s LYS 106 Ca -0.00 -1.53 0.00 0.00 -1.00 0.00 0.00 55.97 53.44 2bh5 s LYS 106 Cb 0.09 -0.30 0.00 0.00 -2.06 0.00 0.00 37.83 35.56 2bh5 s LYS 106 CO 0.83 -0.11 0.00 0.09 0.10 0.00 0.00 175.35 176.26 2bh5 n ASN 107 N -0.24 -4.92 -0.12 0.03 5.03 -1.26 -4.92 115.26 108.86 2bh5 n ASN 107 Ca -0.07 0.01 -0.12 0.00 0.87 0.00 0.00 54.58 55.28 2bh5 n ASN 107 Cb 0.63 -4.01 -0.02 0.00 -1.02 0.00 0.00 39.78 35.35 2bh5 n ASN 107 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2bh5 h GLN 108 N 0.00 0.76 -0.18 3.52 7.50 -1.89 -2.32 115.11 122.49 2bh5 h GLN 108 Ca -0.39 -0.32 -0.02 0.00 0.50 0.00 0.00 58.65 58.42 2bh5 h GLN 108 Cb 1.28 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.77 2bh5 h GLN 108 CO 0.47 0.93 0.02 0.00 -1.50 0.00 0.00 178.83 178.75 2bh5 h ALA 109 N 0.81 1.71 -0.11 3.87 0.00 -1.94 -1.95 119.26 121.63 2bh5 h ALA 109 Ca 0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2bh5 h ALA 109 Cb 0.69 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2bh5 h ALA 109 CO 0.05 0.23 -0.05 -0.44 0.00 0.00 0.00 179.25 179.04 2bh5 h ASP 110 N 0.26 0.24 -1.01 0.00 3.32 -1.75 -0.18 116.42 117.30 2bh5 h ASP 110 Ca 0.06 -0.40 0.04 0.00 0.02 0.00 0.00 57.03 56.74 2bh5 h ASP 110 Cb 0.14 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.57 2bh5 h ASP 110 CO -0.00 0.59 0.66 0.58 -1.72 0.00 0.00 179.24 179.35 2bh5 h VAL 111 N -0.11 1.18 -0.31 -1.35 2.07 -1.22 -1.34 116.25 115.17 2bh5 h VAL 111 Ca 0.03 -0.44 -0.12 0.00 0.82 0.00 0.00 66.70 66.99 2bh5 h VAL 111 Cb 0.50 -0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 2bh5 h VAL 111 CO 0.02 0.23 -0.31 0.58 0.02 0.00 0.00 177.57 178.11 2bh5 h VAL 112 N 1.28 1.28 -0.85 2.57 2.07 -1.21 -1.25 116.25 120.14 2bh5 h VAL 112 Ca 0.40 -1.43 0.02 0.00 0.82 0.00 0.00 66.70 66.52 2bh5 h VAL 112 Cb -0.01 1.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 2bh5 h VAL 112 CO -0.12 0.46 0.55 0.00 0.02 0.00 0.00 177.57 178.48 2bh5 h ALA 113 N 1.11 1.11 -0.06 1.67 0.00 -0.41 0.53 119.26 123.21 2bh5 h ALA 113 Ca 0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bh5 h ALA 113 Cb 0.80 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2bh5 h ALA 113 CO 0.07 0.42 0.03 0.35 0.00 0.00 0.00 179.25 180.12 2bh5 h PHE 114 N 1.10 0.08 -0.73 0.00 3.57 -0.61 -1.85 116.94 118.50 2bh5 h PHE 114 Ca 0.33 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.82 2bh5 h PHE 114 Cb -0.05 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2bh5 h PHE 114 CO -0.02 0.16 0.45 -0.07 -2.23 0.00 0.00 178.31 176.60 2bh5 h LEU 115 N -0.02 0.86 -0.97 0.59 3.38 -0.99 -2.33 115.31 115.83 2bh5 h LEU 115 Ca 0.02 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2bh5 h LEU 115 Cb 0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2bh5 h LEU 115 CO -0.00 0.66 0.18 0.00 0.09 0.00 0.00 178.44 179.37 2bh5 h ALA 116 N 1.49 1.17 -0.90 1.53 0.00 -0.62 -2.14 119.26 119.80 2bh5 h ALA 116 Ca 0.26 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.06 2bh5 h ALA 116 Cb -0.05 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.43 2bh5 h ALA 116 CO -0.05 0.58 0.58 0.37 0.00 0.00 0.00 179.25 180.73 2bh5 h GLN 117 N 0.90 0.89 -0.89 0.00 4.15 -0.78 -1.30 115.11 118.08 2bh5 h GLN 117 Ca 0.20 -0.05 -0.48 0.00 0.77 0.00 0.00 58.65 59.09 2bh5 h GLN 117 Cb 0.27 -0.20 -0.28 0.00 0.21 0.00 0.00 27.48 27.48 2bh5 h GLN 117 CO -0.01 0.59 0.54 0.72 -1.93 0.00 0.00 178.83 178.74 2bh5 n HIS 118 N -4.53 2.76 -3.20 3.99 8.25 -0.85 -4.24 115.22 117.40 2bh5 n HIS 118 Ca 0.15 -1.90 -0.25 0.00 -0.26 0.00 0.00 57.72 55.47 2bh5 n HIS 118 Cb 0.29 -0.91 -0.06 0.00 1.12 0.00 0.00 29.99 30.44 2bh5 n HIS 118 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2bh5 n SER 119 N -1.13 2.55 0.26 0.41 7.64 -0.49 -1.02 113.62 121.84 2bh5 n SER 119 Ca 0.56 -3.25 0.13 0.00 1.01 0.00 0.00 58.87 57.32 2bh5 n SER 119 Cb 1.50 -0.63 0.65 0.00 -1.01 0.00 0.00 64.21 64.72 2bh5 n SER 119 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2bh5 h PRO 120 N 3.60 0.00 -0.67 1.43 0.13 -1.74 -2.70 132.00 132.05 2bh5 h PRO 120 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2bh5 h PRO 120 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2bh5 h PRO 120 CO 0.68 0.12 0.00 -0.25 -0.23 0.00 0.00 178.00 178.32 2bh5 n ASP 121 N -3.37 4.42 -4.68 1.44 8.00 -1.26 -4.95 116.55 116.15 2bh5 n ASP 121 Ca -0.01 -2.27 -0.47 0.00 0.71 0.00 0.00 54.79 52.76 2bh5 n ASP 121 Cb 0.32 -0.54 -0.04 0.00 -0.02 0.00 0.00 41.12 40.84 2bh5 n ASP 121 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bh5 n ALA 122 N 1.30 1.19 0.00 2.24 0.00 -1.02 -5.11 120.51 119.11 2bh5 n ALA 122 Ca 0.25 0.36 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2bh5 n ALA 122 Cb 0.78 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.79 2bh5 n ALA 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91