#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hb7 s LYS 3 N 0.00 1.38 0.13 0.00 2.20 -1.26 -4.91 119.74 117.28 3hb7 s LYS 3 Ca 0.00 -0.76 0.05 0.00 -0.36 0.00 0.00 55.97 54.90 3hb7 s LYS 3 Cb 0.00 -1.39 -0.04 0.00 -1.51 0.00 0.00 37.83 34.89 3hb7 s LYS 3 CO 0.00 0.37 -0.11 -1.01 -0.36 0.00 0.00 175.35 174.24 3hb7 s HIS 4 N -0.59 1.26 -0.00 4.03 3.76 -0.94 -2.33 115.29 120.47 3hb7 s HIS 4 Ca 0.07 -0.69 0.02 0.00 -0.15 0.00 0.00 55.06 54.30 3hb7 s HIS 4 Cb -0.08 -0.65 -0.01 0.00 1.11 0.00 0.00 32.58 32.96 3hb7 s HIS 4 CO 0.00 0.09 -0.07 0.00 -0.85 0.00 0.00 174.74 173.91 3hb7 s ALA 5 N -2.90 0.55 -0.20 -1.40 0.00 -0.67 -2.34 121.76 114.80 3hb7 s ALA 5 Ca 0.13 -0.28 -0.06 0.00 0.00 0.00 0.00 51.96 51.74 3hb7 s ALA 5 Cb -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 3hb7 s ALA 5 CO 0.01 0.13 0.03 0.42 0.00 0.00 0.00 175.76 176.36 3hb7 s ILE 6 N -0.16 4.33 -0.28 0.00 1.09 0.36 -0.75 121.20 125.78 3hb7 s ILE 6 Ca 0.03 -0.19 -0.09 0.00 -1.10 0.00 0.00 60.65 59.29 3hb7 s ILE 6 Cb -0.03 -2.96 -0.03 0.00 -1.06 0.00 0.00 42.46 38.39 3hb7 s ILE 6 CO -0.00 0.43 0.14 -0.76 -0.10 0.00 0.00 174.94 174.64 3hb7 s LEU 7 N 0.81 3.88 -0.32 2.97 1.43 -0.62 -0.75 118.68 126.08 3hb7 s LEU 7 Ca 0.02 -0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 52.74 3hb7 s LEU 7 Cb -0.14 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 3hb7 s LEU 7 CO 0.02 -0.10 0.18 -0.69 0.23 0.00 0.00 176.35 175.99 3hb7 s VAL 8 N 1.66 4.86 -0.23 -1.59 1.01 -0.36 -1.99 120.40 123.76 3hb7 s VAL 8 Ca 0.06 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 3hb7 s VAL 8 Cb -0.16 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 3hb7 s VAL 8 CO 0.07 0.05 0.01 -0.63 0.00 0.00 0.00 175.10 174.60 3hb7 s ILE 9 N 1.66 3.81 0.21 2.22 1.01 -0.61 -0.32 121.20 129.18 3hb7 s ILE 9 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.36 3hb7 s ILE 9 Cb -0.17 -2.76 0.00 0.00 0.01 0.00 0.00 42.46 39.54 3hb7 s ILE 9 CO 0.08 0.38 0.00 0.47 0.00 0.00 0.00 174.94 175.87 3hb7 n ASP 10 N 4.85 -8.42 0.00 3.58 9.92 -0.48 -2.81 116.55 123.19 3hb7 n ASP 10 Ca -0.17 1.26 0.00 0.00 -0.53 0.00 0.00 54.79 55.35 3hb7 n ASP 10 Cb 0.51 -4.71 0.00 0.00 -0.64 0.00 0.00 41.12 36.28 3hb7 n ASP 10 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3hb7 n LEU 12 N 1.63 0.00 -0.14 0.64 4.77 -1.26 -4.76 117.00 117.88 3hb7 n LEU 12 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 3hb7 n LEU 12 Cb 0.00 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.42 3hb7 n LEU 12 CO 0.00 0.00 1.21 0.78 -1.33 0.00 0.00 177.39 178.05 3hb7 h ASN 13 N 0.00 0.69 -0.37 -1.43 2.35 -1.04 0.23 115.58 116.01 3hb7 h ASN 13 Ca 0.00 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.68 3hb7 h ASN 13 Cb 0.00 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 3hb7 h ASN 13 CO 0.00 0.48 0.03 0.44 -1.65 0.00 0.00 177.43 176.73 3hb7 h ASP 14 N 0.80 0.68 0.00 5.81 3.32 -1.57 -3.33 116.42 122.14 3hb7 h ASP 14 Ca 0.25 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3hb7 h ASP 14 Cb 0.00 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.37 3hb7 h ASP 14 CO -0.06 0.74 -1.24 0.49 -1.72 0.00 0.00 179.24 177.44 3hb7 n PHE 15 N -4.24 0.00 -4.74 4.55 3.72 0.59 -1.98 117.46 115.36 3hb7 n PHE 15 Ca 0.03 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.17 3hb7 n PHE 15 Cb 0.27 -0.18 -0.16 0.00 -0.94 0.00 0.00 39.48 38.46 3hb7 n PHE 15 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3hb7 s VAL 16 N -2.81 1.31 0.00 -4.37 1.01 0.07 -0.34 120.40 115.27 3hb7 s VAL 16 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.35 3hb7 s VAL 16 Cb 0.11 -1.14 0.00 0.00 0.00 0.00 0.00 36.38 35.35 3hb7 s VAL 16 CO 0.66 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.76 3hb7 n GLY 17 N 3.30 3.20 0.33 4.51 0.00 -1.26 -4.65 105.19 110.62 3hb7 n GLY 17 Ca -0.19 -1.90 -0.02 0.00 0.00 0.00 0.00 46.02 43.90 3hb7 n GLY 17 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hb7 h GLU 18 N 0.00 0.97 -0.58 1.61 3.07 -1.98 -2.89 114.58 114.79 3hb7 h GLU 18 Ca 0.00 -0.15 -0.12 0.00 -0.50 0.00 0.00 59.36 58.60 3hb7 h GLU 18 Cb 0.00 -0.17 -0.07 0.00 -0.84 0.00 0.00 28.75 27.67 3hb7 h GLU 18 CO 0.00 0.77 0.13 0.36 -1.40 0.00 0.00 179.01 178.87 3hb7 n LYS 19 N -4.32 3.72 -2.49 2.33 -0.00 -1.26 -4.98 118.16 111.16 3hb7 n LYS 19 Ca 0.06 -3.07 -0.42 0.00 -0.00 0.00 0.00 58.31 54.88 3hb7 n LYS 19 Cb 0.15 -2.13 -0.03 0.00 -0.00 0.00 0.00 35.03 33.02 3hb7 n LYS 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3hb7 s ALA 20 N -2.93 3.34 0.51 0.58 0.00 -1.09 -4.91 121.76 117.26 3hb7 s ALA 20 Ca 0.52 0.78 0.17 0.00 0.00 0.00 0.00 51.96 53.43 3hb7 s ALA 20 Cb 0.41 -3.42 1.27 0.00 0.00 0.00 0.00 23.12 21.38 3hb7 s ALA 20 CO 0.12 -0.37 2.11 -1.35 0.00 0.00 0.00 175.76 176.27 3hb7 h PRO 21 N 6.66 0.04 -2.09 0.00 0.11 -1.81 -1.19 132.00 133.71 3hb7 h PRO 21 Ca -0.42 -0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.13 3hb7 h PRO 21 Cb 1.22 -0.01 -0.40 0.00 0.11 0.00 0.00 31.00 31.91 3hb7 h PRO 21 CO 0.79 0.03 -0.91 1.28 -0.21 0.00 0.00 178.00 178.98 3hb7 n LEU 22 N -4.50 1.89 -4.77 2.35 4.77 -0.84 -5.09 117.00 110.81 3hb7 n LEU 22 Ca -0.00 -5.09 -0.40 0.00 -0.03 0.00 0.00 56.01 50.49 3hb7 n LEU 22 Cb 0.19 0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 3hb7 n LEU 22 CO 0.35 2.13 0.98 -0.60 -1.33 0.00 0.00 177.39 178.91 3hb7 s ARG 23 N -2.03 4.14 -0.32 3.23 3.52 -0.45 -4.00 118.95 123.03 3hb7 s ARG 23 Ca 0.39 2.20 -0.07 0.00 -0.13 0.00 0.00 55.73 58.12 3hb7 s ARG 23 Cb 0.20 -2.90 0.03 0.00 -1.56 0.00 0.00 34.95 30.72 3hb7 s ARG 23 CO -0.08 -0.36 0.10 0.00 -0.81 0.00 0.00 175.30 174.15 3hb7 h PRO 25 N 8.23 1.26 0.00 0.00 0.11 -1.79 1.85 132.00 141.67 3hb7 h PRO 25 Ca -0.27 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 65.75 3hb7 h PRO 25 Cb 1.10 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.94 3hb7 h PRO 25 CO 0.61 0.86 0.00 0.78 -0.21 0.00 0.00 178.00 180.04 3hb7 h GLY 26 N 1.29 0.00 0.96 -0.55 0.00 -1.77 -2.92 103.07 100.09 3hb7 h GLY 26 Ca 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.66 3hb7 h GLY 26 CO -0.07 0.00 0.19 -1.33 0.00 0.00 0.00 176.54 175.33 3hb7 h GLY 27 N 0.20 0.52 1.28 4.60 0.00 0.26 -2.12 103.07 107.82 3hb7 h GLY 27 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 3hb7 h GLY 27 CO 0.00 0.23 0.33 1.05 0.00 0.00 0.00 176.54 178.15 3hb7 h GLU 28 N 0.43 0.93 -0.18 4.80 4.11 -1.62 -3.15 114.58 119.90 3hb7 h GLU 28 Ca 0.12 -0.12 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 3hb7 h GLU 28 Cb 0.06 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3hb7 h GLU 28 CO -0.02 0.71 0.04 1.79 0.07 0.00 0.00 179.01 181.61 3hb7 h THR 29 N 0.93 1.09 -0.02 -1.06 1.35 -1.52 -2.59 112.91 111.10 3hb7 h THR 29 Ca 0.23 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 3hb7 h THR 29 Cb 0.08 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 67.41 3hb7 h THR 29 CO -0.03 0.11 -0.01 2.30 -0.25 0.00 0.00 175.52 177.65 3hb7 n ILE 30 N -4.43 0.00 -0.35 6.82 -5.35 -1.19 -4.33 119.36 110.53 3hb7 n ILE 30 Ca -0.00 -0.30 -0.02 0.00 -0.27 0.00 0.00 62.75 62.15 3hb7 n ILE 30 Cb 0.14 0.71 0.10 0.00 -1.74 0.00 0.00 39.64 38.85 3hb7 n ILE 30 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3hb7 h ILE 31 N 2.83 1.22 -0.26 7.28 2.04 -1.60 -2.03 117.51 126.99 3hb7 h ILE 31 Ca 0.00 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 3hb7 h ILE 31 Cb 0.61 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3hb7 h ILE 31 CO 0.00 0.23 0.05 -0.65 0.00 0.00 0.00 178.15 177.78 3hb7 h PRO 32 N 1.24 0.43 -0.49 2.37 0.11 -1.82 -2.39 132.00 131.45 3hb7 h PRO 32 Ca 0.35 -0.11 -0.05 0.00 0.11 0.00 0.00 66.00 66.30 3hb7 h PRO 32 Cb -0.12 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 30.92 3hb7 h PRO 32 CO -0.08 0.54 0.12 -0.44 -0.21 0.00 0.00 178.00 177.93 3hb7 h ASP 33 N 0.25 0.69 -0.34 -2.05 3.45 -1.80 -1.32 116.42 115.31 3hb7 h ASP 33 Ca 0.08 -0.12 -0.04 0.00 0.43 0.00 0.00 57.03 57.39 3hb7 h ASP 33 Cb 0.31 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.89 3hb7 h ASP 33 CO 0.00 0.69 0.06 -0.07 -1.57 0.00 0.00 179.24 178.35 3hb7 h LEU 34 N 0.72 0.53 -1.41 1.55 3.38 -1.31 -1.19 115.31 117.58 3hb7 h LEU 34 Ca 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3hb7 h LEU 34 Cb 0.27 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3hb7 h LEU 34 CO -0.00 0.64 0.26 1.56 0.09 0.00 0.00 178.44 180.99 3hb7 h GLN 35 N 0.39 0.66 -0.21 1.13 4.20 -1.18 0.79 115.11 120.88 3hb7 h GLN 35 Ca 0.10 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3hb7 h GLN 35 Cb 0.33 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 3hb7 h GLN 35 CO 0.00 0.49 0.10 -0.22 -0.67 0.00 0.00 178.83 178.53 3hb7 h LYS 36 N 0.67 0.30 -0.44 1.46 3.64 -0.73 0.15 116.57 121.61 3hb7 h LYS 36 Ca 0.17 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 3hb7 h LYS 36 Cb 0.02 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 3hb7 h LYS 36 CO -0.03 0.32 0.24 0.82 -2.27 0.00 0.00 179.45 178.53 3hb7 h ILE 37 N 0.21 1.16 -0.09 2.00 1.08 0.12 -0.42 117.51 121.57 3hb7 h ILE 37 Ca 0.07 -0.41 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 3hb7 h ILE 37 Cb 0.12 0.62 -0.00 0.00 -3.07 0.00 0.00 36.82 34.48 3hb7 h ILE 37 CO -0.01 0.17 0.06 -0.26 -0.69 0.00 0.00 178.15 177.42 3hb7 h PHE 38 N 0.58 0.11 -0.76 1.37 0.05 0.70 -0.57 116.94 118.42 3hb7 h PHE 38 Ca 0.16 0.00 -0.03 0.00 3.82 0.00 0.00 57.97 61.92 3hb7 h PHE 38 Cb 0.05 -0.04 -0.04 0.00 2.00 0.00 0.00 35.95 37.93 3hb7 h PHE 38 CO -0.02 0.08 0.37 0.93 -0.18 0.00 0.00 178.31 179.49 3hb7 h GLU 39 N 0.11 1.10 -0.01 1.51 4.39 -0.55 0.96 114.58 122.09 3hb7 h GLU 39 Ca 0.03 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 3hb7 h GLU 39 Cb -0.00 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.45 3hb7 h GLU 39 CO -0.01 0.85 0.00 2.35 -1.16 0.00 0.00 179.01 181.04 3hb7 h TRP 40 N 1.07 0.01 -0.21 4.33 7.01 -0.33 -2.21 115.95 125.63 3hb7 h TRP 40 Ca 0.26 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.24 3hb7 h TRP 40 Cb 0.11 -0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 3hb7 h TRP 40 CO 0.01 0.12 0.04 0.28 -2.79 0.00 0.00 178.44 176.10 3hb7 h VAL 41 N -0.10 1.21 -0.20 2.65 2.07 -0.76 -2.62 116.25 118.50 3hb7 h VAL 41 Ca 0.00 -0.69 0.06 0.00 0.82 0.00 0.00 66.70 66.89 3hb7 h VAL 41 Cb 0.11 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3hb7 h VAL 41 CO -0.00 0.22 0.31 0.03 0.02 0.00 0.00 177.57 178.14 3hb7 h ARG 42 N 0.15 0.00 -4.73 1.57 3.08 -0.75 -3.23 114.38 110.46 3hb7 h ARG 42 Ca 0.06 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.43 3hb7 h ARG 42 Cb 0.29 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 30.05 3hb7 h ARG 42 CO 0.00 0.00 -0.63 0.20 -1.07 0.00 0.00 179.97 178.47 3hb7 s GLY 43 N -3.91 1.80 0.00 0.04 0.00 -0.84 -5.07 107.32 99.34 3hb7 s GLY 43 Ca -0.04 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.01 3hb7 s GLY 43 CO 0.46 0.72 0.00 -2.13 0.00 0.00 0.00 173.10 172.15 3hb7 n ARG 44 N 4.78 0.00 -2.47 2.90 0.63 -1.22 -4.76 116.66 116.51 3hb7 n ARG 44 Ca -0.13 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.63 3hb7 n ARG 44 Cb 0.45 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.38 3hb7 n ARG 44 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3hb7 n ASP 47 N 0.00 3.43 -1.19 6.15 8.00 -1.26 -5.14 116.55 126.54 3hb7 n ASP 47 Ca 0.00 -3.19 0.11 0.00 0.71 0.00 0.00 54.79 52.43 3hb7 n ASP 47 Cb 0.00 -0.45 0.27 0.00 -0.02 0.00 0.00 41.12 40.92 3hb7 n ASP 47 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3hb7 n ASP 48 N -0.46 3.49 -3.94 -2.24 8.00 -1.26 -4.83 116.55 115.31 3hb7 n ASP 48 Ca 0.27 -1.98 -0.16 0.00 0.71 0.00 0.00 54.79 53.63 3hb7 n ASP 48 Cb 0.80 -0.35 -0.15 0.00 -0.02 0.00 0.00 41.12 41.40 3hb7 n ASP 48 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hb7 s ILE 49 N -1.30 0.39 0.09 0.53 1.01 -1.26 -2.21 121.20 118.44 3hb7 s ILE 49 Ca 0.42 -0.19 0.08 0.00 0.00 0.00 0.00 60.65 60.96 3hb7 s ILE 49 Cb 0.23 -0.34 -0.03 0.00 0.01 0.00 0.00 42.46 42.33 3hb7 s ILE 49 CO 0.31 0.12 -0.21 -1.00 0.00 0.00 0.00 174.94 174.17 3hb7 s HIS 50 N 0.01 1.79 -0.20 3.97 3.76 -0.99 -4.99 115.29 118.65 3hb7 s HIS 50 Ca 0.00 -0.40 -0.05 0.00 -0.15 0.00 0.00 55.06 54.46 3hb7 s HIS 50 Cb -0.03 -1.01 -0.03 0.00 1.11 0.00 0.00 32.58 32.62 3hb7 s HIS 50 CO -0.00 0.17 0.00 -0.51 -0.85 0.00 0.00 174.74 173.55 3hb7 s LEU 51 N -1.69 3.31 -0.13 0.89 1.43 -1.26 -0.49 118.68 120.73 3hb7 s LEU 51 Ca 0.07 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.01 3hb7 s LEU 51 Cb -0.10 -1.84 -0.00 0.00 0.03 0.00 0.00 46.19 44.29 3hb7 s LEU 51 CO 0.04 0.08 -0.19 -0.69 0.23 0.00 0.00 176.35 175.82 3hb7 s VAL 52 N 0.91 2.44 -0.21 -1.59 1.01 0.07 -3.37 120.40 119.65 3hb7 s VAL 52 Ca 0.01 -0.86 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 3hb7 s VAL 52 Cb -0.14 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 3hb7 s VAL 52 CO 0.02 0.54 0.09 -1.00 0.00 0.00 0.00 175.10 174.75 3hb7 s HIS 53 N 0.62 3.23 -0.16 5.22 0.09 0.59 -1.22 115.29 123.66 3hb7 s HIS 53 Ca -0.10 0.02 -0.02 0.00 -0.00 0.00 0.00 55.06 54.97 3hb7 s HIS 53 Cb -0.16 -2.17 -0.01 0.00 -0.00 0.00 0.00 32.58 30.24 3hb7 s HIS 53 CO 0.03 0.02 -0.10 0.42 -0.00 0.00 0.00 174.74 175.11 3hb7 s ILE 54 N 0.83 3.19 -0.09 0.60 1.01 0.57 -1.15 121.20 126.17 3hb7 s ILE 54 Ca 0.05 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.14 3hb7 s ILE 54 Cb -0.13 -2.38 0.01 0.00 0.01 0.00 0.00 42.46 39.96 3hb7 s ILE 54 CO 0.02 0.49 -0.19 0.00 0.00 0.00 0.00 174.94 175.26 3hb7 s GLN 55 N 0.74 2.52 0.18 2.79 -2.07 -0.41 -1.38 119.66 122.03 3hb7 s GLN 55 Ca -0.04 -0.70 -0.31 0.00 -1.82 0.00 0.00 55.36 52.49 3hb7 s GLN 55 Cb -0.15 -1.96 -0.09 0.00 -1.09 0.00 0.00 33.01 29.72 3hb7 s GLN 55 CO 0.02 0.11 1.44 -2.00 -1.32 0.00 0.00 175.29 173.53 3hb7 s GLU 56 N 0.49 4.29 -0.39 9.60 2.12 -1.26 -1.68 118.70 131.87 3hb7 s GLU 56 Ca -0.17 2.21 0.03 0.00 0.36 0.00 0.00 54.97 57.40 3hb7 s GLU 56 Cb -0.17 -3.18 0.16 0.00 0.26 0.00 0.00 34.13 31.20 3hb7 s GLU 56 CO 0.07 -0.45 0.37 0.00 -0.54 0.00 0.00 175.26 174.71 3hb7 s ALA 57 N 0.66 0.01 0.89 6.30 0.00 0.46 -4.78 121.76 125.29 3hb7 s ALA 57 Ca 0.63 -1.38 -0.13 0.00 0.00 0.00 0.00 51.96 51.09 3hb7 s ALA 57 Cb -0.40 -1.95 0.13 0.00 0.00 0.00 0.00 23.12 20.90 3hb7 s ALA 57 CO 0.35 -2.12 1.17 -1.01 0.00 0.00 0.00 175.76 174.15 3hb7 s HIS 58 N 1.04 2.54 0.68 0.00 3.76 -0.55 -4.35 115.29 118.42 3hb7 s HIS 58 Ca 0.21 0.76 -0.04 0.00 -0.15 0.00 0.00 55.06 55.84 3hb7 s HIS 58 Cb -0.12 -3.49 0.07 0.00 1.11 0.00 0.00 32.58 30.16 3hb7 s HIS 58 CO -0.05 -2.22 0.97 1.03 -0.85 0.00 0.00 174.74 173.62 3hb7 s ARG 59 N -5.44 2.10 -0.97 1.40 0.52 -1.26 -0.30 118.95 115.00 3hb7 s ARG 59 Ca 0.64 -0.54 -0.16 0.00 -0.52 0.00 0.00 55.73 55.15 3hb7 s ARG 59 Cb -0.12 -2.26 -0.29 0.00 0.52 0.00 0.00 34.95 32.80 3hb7 s ARG 59 CO 0.52 -1.21 2.31 0.36 0.02 0.00 0.00 175.30 177.30 3hb7 n LYS 60 N -2.81 0.07 0.00 3.54 2.85 -1.26 -4.81 118.16 115.73 3hb7 n LYS 60 Ca 0.10 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.30 3hb7 n LYS 60 Cb 0.60 -1.37 0.00 0.00 -0.65 0.00 0.00 35.03 33.61 3hb7 n LYS 60 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 3hb7 n LEU 70 N 7.94 0.00 -3.83 -5.58 -0.00 -1.26 -5.20 117.00 109.07 3hb7 n LEU 70 Ca 0.65 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 56.57 3hb7 n LEU 70 Cb 0.14 -0.23 -0.04 0.00 -0.00 0.00 0.00 43.42 43.29 3hb7 n LEU 70 CO 1.01 0.00 0.29 -1.38 -0.00 0.00 0.00 177.39 177.31 3hb7 s HIS 71 N -1.31 -0.01 0.31 1.47 0.00 -1.26 -5.12 115.29 109.36 3hb7 s HIS 71 Ca 0.00 -0.36 -0.29 0.00 -3.00 0.00 0.00 55.06 51.41 3hb7 s HIS 71 Cb 0.00 0.41 -0.10 0.00 -4.00 0.00 0.00 32.58 28.89 3hb7 s HIS 71 CO 0.00 -1.01 1.26 0.00 -1.00 0.00 0.00 174.74 173.99 3hb7 s ALA 72 N -3.92 3.48 -0.00 -1.38 0.00 -1.26 -4.96 121.76 113.72 3hb7 s ALA 72 Ca 0.13 1.17 0.02 0.00 0.00 0.00 0.00 51.96 53.29 3hb7 s ALA 72 Cb -0.02 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 3hb7 s ALA 72 CO 0.02 -0.53 -0.04 0.08 0.00 0.00 0.00 175.76 175.29 3hb7 s VAL 73 N -1.05 3.83 0.31 0.00 1.01 -1.26 -1.48 120.40 121.76 3hb7 s VAL 73 Ca 0.49 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 3hb7 s VAL 73 Cb -0.38 -2.67 -0.11 0.00 0.00 0.00 0.00 36.38 33.22 3hb7 s VAL 73 CO 0.49 0.40 1.51 -1.59 0.00 0.00 0.00 175.10 175.92 3hb7 s LYS 74 N -1.42 4.16 0.00 2.72 -2.85 0.59 -2.41 119.74 120.53 3hb7 s LYS 74 Ca 0.18 2.50 0.00 0.00 -1.00 0.00 0.00 55.97 57.64 3hb7 s LYS 74 Cb -0.11 -3.03 0.00 0.00 -2.06 0.00 0.00 37.83 32.63 3hb7 s LYS 74 CO 0.08 -0.53 0.00 0.41 0.10 0.00 0.00 175.35 175.41 3hb7 n GLY 75 N 1.58 1.67 3.89 0.59 0.00 -1.26 -4.98 105.19 106.69 3hb7 n GLY 75 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 3hb7 n GLY 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hb7 s THR 76 N -3.21 3.84 0.22 2.61 -4.23 -1.01 -4.99 115.64 108.87 3hb7 s THR 76 Ca 0.00 0.38 -0.06 0.00 -1.18 0.00 0.00 61.69 60.82 3hb7 s THR 76 Cb 0.00 -3.56 0.12 0.00 1.34 0.00 0.00 72.50 70.40 3hb7 s THR 76 CO 0.00 -0.68 1.74 4.11 -0.54 0.00 0.00 174.62 179.25 3hb7 h TRP 77 N -0.39 1.10 -0.63 3.99 5.08 -1.95 -2.89 115.95 120.27 3hb7 h TRP 77 Ca -0.45 -0.13 -0.02 0.00 1.08 0.00 0.00 58.89 59.37 3hb7 h TRP 77 Cb 1.24 -0.31 -0.03 0.00 -3.00 0.00 0.00 29.16 27.06 3hb7 h TRP 77 CO 0.52 0.91 0.32 0.78 -1.28 0.00 0.00 178.44 179.70 3hb7 h GLY 78 N 1.05 0.93 2.00 11.11 0.00 -1.92 -0.66 103.07 115.59 3hb7 h GLY 78 Ca 0.21 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 47.06 3hb7 h GLY 78 CO 0.01 0.40 -0.28 0.23 0.00 0.00 0.00 176.54 176.90 3hb7 h SER 79 N 0.88 0.00 -4.23 0.19 0.87 -1.71 -1.73 113.55 107.82 3hb7 h SER 79 Ca 0.22 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.28 3hb7 h SER 79 Cb 0.06 0.00 0.08 0.00 -0.44 0.00 0.00 62.40 62.09 3hb7 h SER 79 CO -0.03 0.28 0.37 -0.62 -0.53 0.00 0.00 176.83 176.30 3hb7 s ASP 80 N -6.61 5.53 0.54 6.23 -1.08 -0.25 -4.73 116.67 116.29 3hb7 s ASP 80 Ca -0.02 1.82 -0.20 0.00 -0.52 0.00 0.00 52.55 53.62 3hb7 s ASP 80 Cb 0.13 -2.53 -0.06 0.00 -1.46 0.00 0.00 42.92 39.01 3hb7 s ASP 80 CO 0.67 -1.34 1.17 -0.36 0.52 0.00 0.00 175.17 175.83 3hb7 s PHE 81 N -2.55 2.63 0.64 -5.34 0.08 -1.26 -1.26 117.98 110.92 3hb7 s PHE 81 Ca 0.63 1.53 -0.16 0.00 0.12 0.00 0.00 56.93 59.05 3hb7 s PHE 81 Cb -0.17 -3.38 -0.01 0.00 -0.57 0.00 0.00 43.02 38.89 3hb7 s PHE 81 CO 0.42 -1.78 1.13 0.96 -0.10 0.00 0.00 175.22 175.84 3hb7 s ILE 82 N -1.65 3.12 0.36 0.64 -4.36 -1.26 -4.63 121.20 113.41 3hb7 s ILE 82 Ca 0.72 0.56 0.04 0.00 -0.26 0.00 0.00 60.65 61.70 3hb7 s ILE 82 Cb -0.27 -3.10 0.22 0.00 1.25 0.00 0.00 42.46 40.56 3hb7 s ILE 82 CO 0.31 -0.28 1.96 -0.65 0.24 0.00 0.00 174.94 176.52 3hb7 h PRO 83 N 0.24 0.64 -0.43 0.37 0.11 -1.97 -2.04 132.00 128.92 3hb7 h PRO 83 Ca -0.48 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 65.54 3hb7 h PRO 83 Cb 1.26 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3hb7 h PRO 83 CO 0.54 0.51 0.20 0.93 -0.21 0.00 0.00 178.00 179.97 3hb7 h GLU 84 N 0.65 0.61 -0.56 1.05 3.07 -1.99 -3.03 114.58 114.37 3hb7 h GLU 84 Ca 0.16 -0.07 -0.38 0.00 -0.50 0.00 0.00 59.36 58.57 3hb7 h GLU 84 Cb 0.09 -0.12 -0.40 0.00 -0.84 0.00 0.00 28.75 27.48 3hb7 h GLU 84 CO -0.02 0.48 -0.96 1.28 -1.40 0.00 0.00 179.01 178.39 3hb7 n LEU 85 N -4.39 3.18 -4.76 1.33 4.32 -1.00 -4.89 117.00 110.78 3hb7 n LEU 85 Ca 0.03 -3.84 -0.35 0.00 -0.02 0.00 0.00 56.01 51.83 3hb7 n LEU 85 Cb 0.13 0.05 0.02 0.00 -1.62 0.00 0.00 43.42 42.01 3hb7 n LEU 85 CO 0.37 1.54 0.80 -0.47 -1.22 0.00 0.00 177.39 178.41 3hb7 s TYR 86 N -3.60 2.52 0.48 -1.77 6.14 -0.80 -4.82 117.35 115.50 3hb7 s TYR 86 Ca 0.39 1.54 -0.14 0.00 0.64 0.00 0.00 57.07 59.50 3hb7 s TYR 86 Cb 0.37 -3.36 -0.07 0.00 0.42 0.00 0.00 41.96 39.31 3hb7 s TYR 86 CO -0.01 -1.89 0.91 -2.14 0.64 0.00 0.00 175.55 173.06 3hb7 s PRO 87 N -3.43 3.87 0.01 4.97 0.02 -1.26 -5.07 135.00 134.11 3hb7 s PRO 87 Ca 0.74 0.76 0.01 0.00 0.02 0.00 0.00 61.00 62.53 3hb7 s PRO 87 Cb -0.26 -2.23 -0.01 0.00 0.02 0.00 0.00 34.50 32.02 3hb7 s PRO 87 CO 0.32 -0.20 -0.04 -0.65 -0.33 0.00 0.00 177.00 176.10 3hb7 s GLN 88 N -4.04 0.34 7.92 5.54 -0.21 -1.26 -5.05 119.66 122.91 3hb7 s GLN 88 Ca 0.56 -0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.57 3hb7 s GLN 88 Cb -0.10 -0.21 0.00 0.00 1.00 0.00 0.00 33.01 33.70 3hb7 s GLN 88 CO 0.32 0.05 0.00 -0.85 -2.12 0.00 0.00 175.29 172.69 3hb7 n GLU 89 N 2.37 0.00 -2.14 2.91 0.00 -1.26 -3.11 120.64 119.41 3hb7 n GLU 89 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 56.58 3hb7 n GLU 89 Cb 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 31.44 32.01 3hb7 n GLU 89 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 3hb7 n ASP 90 N 5.82 6.45 -4.16 -1.84 5.68 -1.26 -4.90 116.55 122.33 3hb7 n ASP 90 Ca 0.00 -3.10 -0.33 0.00 -0.50 0.00 0.00 54.79 50.86 3hb7 n ASP 90 Cb 0.00 -1.44 -0.16 0.00 -1.14 0.00 0.00 41.12 38.38 3hb7 n ASP 90 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3hb7 s GLU 91 N -0.14 3.04 0.20 0.11 2.02 -1.18 -4.96 118.70 117.79 3hb7 s GLU 91 Ca 0.47 -0.83 -0.31 0.00 0.02 0.00 0.00 54.97 54.32 3hb7 s GLU 91 Cb 0.14 -2.51 -0.10 0.00 0.10 0.00 0.00 34.13 31.76 3hb7 s GLU 91 CO -0.04 -0.09 1.45 -0.47 0.02 0.00 0.00 175.26 176.13 3hb7 s TYR 92 N 1.00 3.09 -0.09 1.61 5.04 -1.22 -4.85 117.35 121.93 3hb7 s TYR 92 Ca -0.02 0.94 0.01 0.00 -2.44 0.00 0.00 57.07 55.55 3hb7 s TYR 92 Cb -0.15 -3.80 -0.02 0.00 0.35 0.00 0.00 41.96 38.34 3hb7 s TYR 92 CO -0.06 -2.73 -0.12 0.42 -1.34 0.00 0.00 175.55 171.73 3hb7 s ILE 93 N 0.46 3.23 -0.08 3.14 1.01 -1.26 -0.30 121.20 127.40 3hb7 s ILE 93 Ca 0.62 -0.63 0.04 0.00 0.00 0.00 0.00 60.65 60.69 3hb7 s ILE 93 Cb -0.41 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 39.74 3hb7 s ILE 93 CO 0.38 0.56 -0.21 -0.69 0.00 0.00 0.00 174.94 174.97 3hb7 s VAL 94 N -0.20 1.81 -0.07 2.92 1.01 -0.30 -4.95 120.40 120.62 3hb7 s VAL 94 Ca 0.01 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 3hb7 s VAL 94 Cb -0.13 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 3hb7 s VAL 94 CO 0.03 0.51 -0.03 0.00 0.00 0.00 0.00 175.10 175.61 3hb7 s GLN 95 N 0.28 2.85 0.06 2.72 0.00 -1.26 -1.29 119.66 123.02 3hb7 s GLN 95 Ca -0.14 -0.50 0.04 0.00 -0.00 0.00 0.00 55.36 54.77 3hb7 s GLN 95 Cb -0.16 -2.69 -0.03 0.00 0.00 0.00 0.00 33.01 30.14 3hb7 s GLN 95 CO 0.06 0.68 -0.13 -1.59 0.00 0.00 0.00 175.29 174.31 3hb7 s LYS 96 N -0.95 0.75 0.00 9.60 -2.85 -0.68 -4.86 119.74 120.75 3hb7 s LYS 96 Ca 0.14 -0.90 0.01 0.00 -1.00 0.00 0.00 55.97 54.23 3hb7 s LYS 96 Cb -0.11 -0.71 0.01 0.00 -2.06 0.00 0.00 37.83 34.96 3hb7 s LYS 96 CO 0.03 0.15 0.54 0.54 0.10 0.00 0.00 175.35 176.72 3hb7 n ARG 97 N 1.36 -0.74 -4.50 1.78 1.74 -1.26 -0.41 116.66 114.63 3hb7 n ARG 97 Ca -0.21 -0.58 -0.26 0.00 -0.77 0.00 0.00 57.85 56.03 3hb7 n ARG 97 Cb 0.54 -1.02 -0.08 0.00 -1.02 0.00 0.00 32.46 30.88 3hb7 n ARG 97 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3hb7 s ARG 98 N -0.13 1.97 0.10 5.56 1.81 -1.26 -4.93 118.95 122.07 3hb7 s ARG 98 Ca 0.02 -2.21 -0.20 0.00 -1.72 0.00 0.00 55.73 51.62 3hb7 s ARG 98 Cb 0.01 -0.46 -0.08 0.00 -0.45 0.00 0.00 34.95 33.97 3hb7 s ARG 98 CO 0.02 -0.55 1.64 0.45 -0.68 0.00 0.00 175.30 176.18 3hb7 h HIS 99 N 1.77 0.32 -3.83 -0.53 3.86 -1.96 -3.44 115.15 111.34 3hb7 h HIS 99 Ca -0.33 -0.02 -0.48 0.00 -1.16 0.00 0.00 60.37 58.38 3hb7 h HIS 99 Cb 1.27 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.62 3hb7 h HIS 99 CO 1.71 0.36 0.32 0.45 0.86 0.00 0.00 177.93 181.62 3hb7 s SER 100 N -5.62 7.34 0.50 2.45 0.15 -1.26 -4.56 113.70 112.70 3hb7 s SER 100 Ca -0.14 1.80 0.19 0.00 0.70 0.00 0.00 55.95 58.51 3hb7 s SER 100 Cb 0.08 -2.56 1.25 0.00 -1.71 0.00 0.00 66.02 63.07 3hb7 s SER 100 CO 0.71 -0.03 2.08 1.23 1.20 0.00 0.00 173.24 178.43 3hb7 h GLY 101 N 3.32 0.00 2.00 9.45 0.00 -1.85 -2.40 103.07 113.59 3hb7 h GLY 101 Ca -0.47 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.76 3hb7 h GLY 101 CO 0.65 0.00 -0.49 0.74 0.00 0.00 0.00 176.54 177.44 3hb7 h PHE 102 N 0.00 0.00 -3.43 5.60 0.04 -1.92 -3.41 116.94 113.82 3hb7 h PHE 102 Ca -0.00 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.20 3hb7 h PHE 102 Cb 0.21 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.29 3hb7 h PHE 102 CO 0.00 0.49 0.86 0.00 -0.60 0.00 0.00 178.31 179.06 3hb7 s ALA 103 N -3.43 3.40 -1.54 2.45 0.00 -0.91 -2.59 121.76 119.14 3hb7 s ALA 103 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 51.78 3hb7 s ALA 103 Cb 0.11 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.49 3hb7 s ALA 103 CO 0.72 -1.71 0.00 0.72 0.00 0.00 0.00 175.76 175.49 3hb7 n HIS 104 N 7.14 -0.34 -4.55 0.00 8.25 -1.26 -4.69 115.22 119.77 3hb7 n HIS 104 Ca 0.12 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.27 3hb7 n HIS 104 Cb 0.48 -3.00 -0.06 0.00 1.12 0.00 0.00 29.99 28.53 3hb7 n HIS 104 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3hb7 s THR 105 N -2.68 1.31 -0.59 1.59 -4.23 -1.07 -5.02 115.64 104.96 3hb7 s THR 105 Ca 0.00 -1.88 0.16 0.00 -1.18 0.00 0.00 61.69 58.79 3hb7 s THR 105 Cb 0.00 -2.19 0.74 0.00 1.34 0.00 0.00 72.50 72.39 3hb7 s THR 105 CO 0.00 0.00 1.66 -0.90 -0.54 0.00 0.00 174.62 174.84 3hb7 n ASP 106 N -1.37 5.12 -0.15 3.99 3.85 -1.26 -4.65 116.55 122.07 3hb7 n ASP 106 Ca -0.15 -2.74 -0.08 0.00 -0.71 0.00 0.00 54.79 51.12 3hb7 n ASP 106 Cb 0.66 -0.62 0.01 0.00 -1.35 0.00 0.00 41.12 39.82 3hb7 n ASP 106 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 3hb7 h LEU 107 N 3.76 0.56 -1.03 -2.12 5.85 -1.86 -2.21 115.31 118.26 3hb7 h LEU 107 Ca 0.00 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 3hb7 h LEU 107 Cb 1.70 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.55 3hb7 h LEU 107 CO 0.35 0.47 0.31 -0.78 -0.34 0.00 0.00 178.44 178.45 3hb7 h ASP 108 N 0.60 0.91 -0.53 1.25 3.58 -1.88 -1.95 116.42 118.39 3hb7 h ASP 108 Ca 0.16 -0.11 -0.04 0.00 0.42 0.00 0.00 57.03 57.46 3hb7 h ASP 108 Cb 0.03 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.82 3hb7 h ASP 108 CO -0.03 0.79 0.16 0.25 -2.88 0.00 0.00 179.24 177.53 3hb7 h LEU 109 N 0.99 0.79 -0.71 2.28 5.85 -1.79 -2.11 115.31 120.60 3hb7 h LEU 109 Ca 0.24 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 3hb7 h LEU 109 Cb 0.14 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 3hb7 h LEU 109 CO -0.03 0.79 0.43 0.22 -0.34 0.00 0.00 178.44 179.52 3hb7 h TYR 110 N 0.74 0.92 -0.69 1.25 3.20 -0.98 -0.61 116.97 120.80 3hb7 h TYR 110 Ca 0.17 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 3hb7 h TYR 110 Cb 0.29 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 3hb7 h TYR 110 CO 0.02 0.62 0.34 -0.07 -1.64 0.00 0.00 178.16 177.43 3hb7 h LEU 111 N 0.96 0.89 -0.51 2.82 4.07 -1.14 -2.12 115.31 120.29 3hb7 h LEU 111 Ca 0.25 -0.13 -0.06 0.00 0.08 0.00 0.00 57.88 58.03 3hb7 h LEU 111 Cb -0.04 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.45 3hb7 h LEU 111 CO -0.05 0.77 0.09 0.11 -1.08 0.00 0.00 178.44 178.28 3hb7 h LYS 112 N 0.96 0.84 -0.87 1.13 1.57 -0.76 -1.47 116.57 117.98 3hb7 h LYS 112 Ca 0.24 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 3hb7 h LYS 112 Cb 0.10 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 3hb7 h LYS 112 CO -0.03 0.83 0.47 0.93 -0.57 0.00 0.00 179.45 181.08 3hb7 h GLU 113 N 0.72 1.21 -0.06 3.15 5.08 -0.70 -2.07 114.58 121.92 3hb7 h GLU 113 Ca 0.16 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3hb7 h GLU 113 Cb 0.39 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3hb7 h GLU 113 CO 0.01 0.89 0.00 0.39 -1.00 0.00 0.00 179.01 179.30 3hb7 n GLU 114 N -4.33 1.66 -2.03 2.33 -0.58 -0.84 -4.93 120.64 111.93 3hb7 n GLU 114 Ca 0.09 -0.97 -0.17 0.00 -0.42 0.00 0.00 57.16 55.70 3hb7 n GLU 114 Cb 0.10 -1.45 -0.03 0.00 -0.57 0.00 0.00 31.44 29.49 3hb7 n GLU 114 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hb7 n GLY 115 N 1.15 0.37 3.69 0.62 0.00 -0.78 -4.96 105.19 105.28 3hb7 n GLY 115 Ca 0.18 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3hb7 n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hb7 s ILE 116 N -2.76 4.67 -1.34 -0.61 1.01 -0.59 -4.63 121.20 116.94 3hb7 s ILE 116 Ca 0.00 1.95 0.17 0.00 0.00 0.00 0.00 60.65 62.76 3hb7 s ILE 116 Cb 0.00 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 38.17 3hb7 s ILE 116 CO 0.00 -0.00 0.83 -0.90 0.00 0.00 0.00 174.94 174.87 3hb7 n ASP 117 N 5.07 1.45 -3.87 3.58 3.85 -0.98 -4.73 116.55 120.92 3hb7 n ASP 117 Ca 0.09 -1.22 -0.12 0.00 -0.71 0.00 0.00 54.79 52.83 3hb7 n ASP 117 Cb 0.48 0.60 -0.14 0.00 -1.35 0.00 0.00 41.12 40.71 3hb7 n ASP 117 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3hb7 s THR 118 N -2.09 0.00 0.11 2.12 2.01 -1.10 -2.28 115.64 114.42 3hb7 s THR 118 Ca 0.12 -0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.19 3hb7 s THR 118 Cb 0.13 -0.04 -0.04 0.00 0.01 0.00 0.00 72.50 72.56 3hb7 s THR 118 CO 0.48 -0.01 -0.20 0.68 -0.69 0.00 0.00 174.62 174.87 3hb7 s VAL 119 N -0.02 2.70 -0.06 3.82 -7.23 0.22 -1.66 120.40 118.17 3hb7 s VAL 119 Ca -0.00 -1.53 0.02 0.00 -1.81 0.00 0.00 61.98 58.66 3hb7 s VAL 119 Cb -0.00 -2.22 0.01 0.00 0.56 0.00 0.00 36.38 34.73 3hb7 s VAL 119 CO 0.00 0.12 -0.12 0.54 -0.31 0.00 0.00 175.10 175.33 3hb7 s VAL 120 N -1.10 1.11 -0.15 1.32 0.11 0.07 -0.68 120.40 121.08 3hb7 s VAL 120 Ca 0.17 -0.48 -0.08 0.00 -2.93 0.00 0.00 61.98 58.66 3hb7 s VAL 120 Cb -0.10 -1.01 -0.04 0.00 -1.53 0.00 0.00 36.38 33.69 3hb7 s VAL 120 CO 0.09 0.35 0.12 -0.76 -3.33 0.00 0.00 175.10 171.57 3hb7 s LEU 121 N 0.56 4.26 -0.01 2.54 2.01 0.20 -1.58 118.68 126.66 3hb7 s LEU 121 Ca -0.12 0.36 -0.14 0.00 0.01 0.00 0.00 54.13 54.23 3hb7 s LEU 121 Cb -0.15 -2.06 0.02 0.00 0.01 0.00 0.00 46.19 44.02 3hb7 s LEU 121 CO 0.03 0.32 0.29 0.42 1.01 0.00 0.00 176.35 178.43 3hb7 s THR 122 N -0.52 0.06 -1.90 5.49 -4.23 -0.84 -2.74 115.64 110.96 3hb7 s THR 122 Ca 0.12 -0.51 0.00 0.00 -1.18 0.00 0.00 61.69 60.12 3hb7 s THR 122 Cb -0.12 -0.62 0.00 0.00 1.34 0.00 0.00 72.50 73.11 3hb7 s THR 122 CO 0.02 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.43 3hb7 n GLY 123 N 1.25 0.62 3.18 3.99 0.00 -0.93 -1.57 105.19 111.74 3hb7 n GLY 123 Ca -0.22 -2.14 -0.21 0.00 0.00 0.00 0.00 46.02 43.45 3hb7 n GLY 123 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hb7 s VAL 124 N -0.97 1.28 0.16 1.61 1.01 -1.12 -2.43 120.40 119.93 3hb7 s VAL 124 Ca 0.00 -1.12 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 3hb7 s VAL 124 Cb 0.00 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 3hb7 s VAL 124 CO 0.00 0.02 0.35 0.26 0.00 0.00 0.00 175.10 175.73 3hb7 s TRP 125 N -0.91 3.49 0.22 5.22 0.52 -1.26 -4.56 118.94 121.66 3hb7 s TRP 125 Ca 0.03 0.39 -0.09 0.00 0.02 0.00 0.00 56.10 56.45 3hb7 s TRP 125 Cb -0.08 -1.88 0.18 0.00 -1.15 0.00 0.00 33.47 30.53 3hb7 s TRP 125 CO 0.02 0.44 1.85 1.15 0.02 0.00 0.00 176.95 180.43 3hb7 h THR 126 N 1.80 1.23 -0.08 2.01 2.02 -1.24 -2.28 112.91 116.37 3hb7 h THR 126 Ca -0.47 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.17 3hb7 h THR 126 Cb 1.18 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 3hb7 h THR 126 CO 0.71 0.25 0.00 -0.46 0.37 0.00 0.00 175.52 176.39 3hb7 n ASN 127 N -4.43 2.20 0.00 4.18 2.04 -1.26 -2.67 115.26 115.31 3hb7 n ASN 127 Ca 0.08 -1.74 0.00 0.00 -0.44 0.00 0.00 54.58 52.48 3hb7 n ASN 127 Cb 0.07 -0.04 0.00 0.00 -2.53 0.00 0.00 39.78 37.28 3hb7 n ASN 127 CO 0.00 0.00 0.00 0.52 -0.44 0.00 0.00 177.26 177.34 3hb7 n VAL 128 N 0.70 0.00 -0.16 3.53 0.31 -0.96 -4.65 118.33 117.10 3hb7 n VAL 128 Ca 0.17 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.47 3hb7 n VAL 128 Cb 0.45 0.00 0.18 0.00 -0.91 0.00 0.00 33.84 33.56 3hb7 n VAL 128 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hb7 h VAL 130 N 0.88 1.20 -0.66 0.00 2.07 -1.64 -2.15 116.25 115.95 3hb7 h VAL 130 Ca 0.20 -0.63 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 3hb7 h VAL 130 Cb 0.24 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 3hb7 h VAL 130 CO -0.01 0.21 0.19 -0.09 0.02 0.00 0.00 177.57 177.89 3hb7 h ARG 131 N 0.30 1.03 -0.74 1.57 2.43 -1.15 -2.64 114.38 115.18 3hb7 h ARG 131 Ca 0.09 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 58.98 3hb7 h ARG 131 Cb 0.24 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 3hb7 h ARG 131 CO -0.00 0.91 0.27 0.77 -1.51 0.00 0.00 179.97 180.40 3hb7 h SER 132 N 0.96 1.04 -0.68 -3.80 0.02 -0.89 -1.45 113.55 108.75 3hb7 h SER 132 Ca 0.21 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3hb7 h SER 132 Cb 0.31 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 3hb7 h SER 132 CO -0.00 0.95 0.27 0.74 -1.14 0.00 0.00 176.83 177.65 3hb7 h THR 133 N 1.08 1.24 -0.37 -2.27 2.02 -1.32 -1.64 112.91 111.65 3hb7 h THR 133 Ca 0.24 -0.77 -0.05 0.00 0.77 0.00 0.00 66.41 66.60 3hb7 h THR 133 Cb 0.26 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 3hb7 h THR 133 CO -0.01 0.31 0.05 0.00 0.37 0.00 0.00 175.52 176.24 3hb7 h ALA 134 N 1.27 0.50 -0.84 6.16 0.00 -1.01 -1.40 119.26 123.94 3hb7 h ALA 134 Ca 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3hb7 h ALA 134 Cb 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3hb7 h ALA 134 CO -0.02 0.21 0.45 1.15 0.00 0.00 0.00 179.25 181.04 3hb7 h THR 135 N 0.46 1.25 -0.67 0.00 2.02 -1.12 0.27 112.91 115.12 3hb7 h THR 135 Ca 0.11 -0.63 -0.07 0.00 0.77 0.00 0.00 66.41 66.59 3hb7 h THR 135 Cb 0.38 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 3hb7 h THR 135 CO 0.01 0.28 0.16 0.44 0.37 0.00 0.00 175.52 176.78 3hb7 h ASP 136 N 1.17 1.03 -0.79 4.18 5.19 -1.21 -0.73 116.42 125.26 3hb7 h ASP 136 Ca 0.29 -0.24 -0.04 0.00 -0.62 0.00 0.00 57.03 56.42 3hb7 h ASP 136 Cb 0.05 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.25 3hb7 h ASP 136 CO -0.05 1.00 0.32 0.00 -3.12 0.00 0.00 179.24 177.40 3hb7 h ALA 137 N 1.07 1.02 -0.50 3.45 0.00 -0.64 -1.74 119.26 121.92 3hb7 h ALA 137 Ca 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3hb7 h ALA 137 Cb 0.38 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3hb7 h ALA 137 CO 0.00 0.64 0.16 1.25 0.00 0.00 0.00 179.25 181.30 3hb7 h LEU 138 N 1.14 0.73 -2.13 0.00 7.12 -0.75 -1.12 115.31 120.29 3hb7 h LEU 138 Ca 0.26 -0.20 -0.01 0.00 0.13 0.00 0.00 57.88 58.06 3hb7 h LEU 138 Cb 0.20 -0.19 -0.00 0.00 -0.53 0.00 0.00 40.66 40.14 3hb7 h LEU 138 CO -0.02 0.74 -0.07 0.00 -0.13 0.00 0.00 178.44 178.96 3hb7 h ALA 139 N 1.02 1.48 -0.54 1.25 0.00 -0.51 0.10 119.26 122.06 3hb7 h ALA 139 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3hb7 h ALA 139 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hb7 h ALA 139 CO -0.01 0.08 0.00 0.09 0.00 0.00 0.00 179.25 179.42 3hb7 n ASN 140 N -3.87 3.19 -0.41 0.00 3.02 -0.71 -4.93 115.26 111.54 3hb7 n ASN 140 Ca -0.02 -1.98 -0.04 0.00 -0.03 0.00 0.00 54.58 52.50 3hb7 n ASN 140 Cb 0.16 -0.36 -0.01 0.00 -0.61 0.00 0.00 39.78 38.96 3hb7 n ASN 140 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hb7 n ALA 141 N 1.25 -0.10 -2.81 5.41 0.00 0.35 -5.04 120.51 119.58 3hb7 n ALA 141 Ca 0.20 0.05 -0.34 0.00 0.00 0.00 0.00 53.44 53.35 3hb7 n ALA 141 Cb 0.52 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 19.09 3hb7 n ALA 141 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3hb7 s TYR 142 N -2.19 3.55 0.23 0.00 2.02 -0.44 -5.01 117.35 115.52 3hb7 s TYR 142 Ca 0.00 0.48 -0.30 0.00 -0.37 0.00 0.00 57.07 56.88 3hb7 s TYR 142 Cb 0.00 -1.93 -0.09 0.00 -0.40 0.00 0.00 41.96 39.55 3hb7 s TYR 142 CO 0.00 0.60 1.18 0.15 -1.57 0.00 0.00 175.55 175.91 3hb7 s LYS 143 N -1.98 4.52 -0.05 -0.62 1.02 -0.96 -4.11 119.74 117.56 3hb7 s LYS 143 Ca 0.30 1.90 0.04 0.00 0.02 0.00 0.00 55.97 58.23 3hb7 s LYS 143 Cb -0.13 -3.20 -0.02 0.00 -0.52 0.00 0.00 37.83 33.96 3hb7 s LYS 143 CO 0.19 -0.01 -0.18 0.08 -0.92 0.00 0.00 175.35 174.51 3hb7 s VAL 144 N -0.54 2.77 -0.06 3.17 1.01 -1.26 0.72 120.40 126.22 3hb7 s VAL 144 Ca 0.50 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.68 3hb7 s VAL 144 Cb -0.33 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 33.99 3hb7 s VAL 144 CO 0.40 0.58 -0.14 -0.63 0.00 0.00 0.00 175.10 175.31 3hb7 s ILE 145 N -0.57 1.25 -0.10 2.22 1.01 0.14 -2.65 121.20 122.51 3hb7 s ILE 145 Ca 0.08 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.13 3hb7 s ILE 145 Cb -0.11 -1.11 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 3hb7 s ILE 145 CO 0.01 0.38 0.03 -0.89 0.00 0.00 0.00 174.94 174.47 3hb7 s THR 146 N 0.45 4.59 -0.33 2.92 2.01 0.26 0.59 115.64 126.13 3hb7 s THR 146 Ca -0.11 -0.14 -0.06 0.00 0.31 0.00 0.00 61.69 61.69 3hb7 s THR 146 Cb -0.14 -2.96 0.04 0.00 0.01 0.00 0.00 72.50 69.45 3hb7 s THR 146 CO 0.04 0.60 0.09 -0.76 -0.69 0.00 0.00 174.62 173.90 3hb7 s LEU 147 N -0.84 4.27 0.19 4.42 1.02 -1.11 -4.04 118.68 122.59 3hb7 s LEU 147 Ca 0.13 -1.15 -0.11 0.00 0.02 0.00 0.00 54.13 53.01 3hb7 s LEU 147 Cb -0.12 -1.85 0.10 0.00 0.02 0.00 0.00 46.19 44.35 3hb7 s LEU 147 CO 0.03 -0.32 1.79 0.77 0.02 0.00 0.00 176.35 178.64 3hb7 h SER 148 N 8.20 0.82 0.31 2.29 4.64 -1.92 0.67 113.55 128.56 3hb7 h SER 148 Ca -0.23 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3hb7 h SER 148 Cb 1.08 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 3hb7 h SER 148 CO 0.59 0.69 -0.20 -0.90 -0.87 0.00 0.00 176.83 176.14 3hb7 n ASP 149 N -4.52 0.76 0.25 4.97 5.68 -1.26 -3.26 116.55 119.17 3hb7 n ASP 149 Ca 0.05 -0.71 0.09 0.00 -0.50 0.00 0.00 54.79 53.72 3hb7 n ASP 149 Cb 0.10 0.04 0.63 0.00 -1.14 0.00 0.00 41.12 40.76 3hb7 n ASP 149 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3hb7 h GLY 150 N 4.95 0.00 -3.00 6.12 0.00 -0.04 -3.46 103.07 107.64 3hb7 h GLY 150 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 3hb7 h GLY 150 CO 0.00 0.00 -0.71 -0.51 0.00 0.00 0.00 176.54 175.32 3hb7 s THR 151 N -4.50 0.97 0.13 4.70 -4.23 -0.62 -2.18 115.64 109.90 3hb7 s THR 151 Ca -0.04 -1.96 -0.03 0.00 -1.18 0.00 0.00 61.69 58.49 3hb7 s THR 151 Cb 0.15 -1.72 -0.03 0.00 1.34 0.00 0.00 72.50 72.23 3hb7 s THR 151 CO 0.64 -0.77 0.10 0.00 -0.54 0.00 0.00 174.62 174.05 3hb7 s ALA 152 N -3.32 0.67 0.08 3.99 0.00 -1.02 -4.96 121.76 117.21 3hb7 s ALA 152 Ca 0.13 -1.34 -0.01 0.00 0.00 0.00 0.00 51.96 50.74 3hb7 s ALA 152 Cb 0.03 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.99 3hb7 s ALA 152 CO -0.01 -0.51 0.12 0.45 0.00 0.00 0.00 175.76 175.80 3hb7 n SER 153 N -0.11 -0.34 -0.28 0.00 2.88 -1.26 -0.91 113.62 113.61 3hb7 n SER 153 Ca -0.06 -1.41 -0.06 0.00 -1.33 0.00 0.00 58.87 56.01 3hb7 n SER 153 Cb 0.63 0.61 0.06 0.00 -0.75 0.00 0.00 64.21 64.76 3hb7 n SER 153 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 3hb7 h LYS 154 N 0.00 1.10 -3.88 -1.46 3.64 -1.96 -3.07 116.57 110.94 3hb7 h LYS 154 Ca -0.06 -0.17 -0.15 0.00 -1.27 0.00 0.00 60.65 59.00 3hb7 h LYS 154 Cb 0.27 -0.19 -0.19 0.00 -0.41 0.00 0.00 32.23 31.70 3hb7 h LYS 154 CO 0.08 0.87 -0.61 0.95 -2.27 0.00 0.00 179.45 178.47 3hb7 s THR 155 N -5.67 0.13 0.36 1.00 -4.23 -1.26 -4.49 115.64 101.48 3hb7 s THR 155 Ca -0.13 -1.04 0.03 0.00 -1.18 0.00 0.00 61.69 59.38 3hb7 s THR 155 Cb 0.15 -0.62 0.26 0.00 1.34 0.00 0.00 72.50 73.63 3hb7 s THR 155 CO 0.82 -0.57 2.02 1.05 -0.54 0.00 0.00 174.62 177.39 3hb7 h GLU 156 N 4.13 0.76 -0.94 3.99 9.09 -2.03 -1.40 114.58 128.18 3hb7 h GLU 156 Ca -0.32 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.04 3hb7 h GLU 156 Cb 1.19 -0.17 0.00 0.00 -1.65 0.00 0.00 28.75 28.12 3hb7 h GLU 156 CO 0.47 0.51 0.00 -0.85 0.05 0.00 0.00 179.01 179.19 3hb7 n GLU 157 N -4.44 0.19 0.00 1.06 0.00 -1.26 -0.93 120.64 115.26 3hb7 n GLU 157 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.22 3hb7 n GLU 157 Cb 0.05 -1.24 0.00 0.00 0.00 0.00 0.00 31.44 30.25 3hb7 n GLU 157 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.13 178.71 3hb7 n HIS 159 N 0.64 0.00 -0.06 -1.84 -0.00 -0.53 -0.62 115.22 112.81 3hb7 n HIS 159 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.60 3hb7 n HIS 159 Cb 0.07 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.01 3hb7 n HIS 159 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 3hb7 h GLU 160 N 0.00 0.35 0.00 1.57 5.08 -1.27 -2.00 114.58 118.30 3hb7 h GLU 160 Ca 0.00 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 3hb7 h GLU 160 Cb 0.00 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3hb7 h GLU 160 CO 0.00 0.57 -0.38 0.10 -1.00 0.00 0.00 179.01 178.29 3hb7 h TYR 161 N 0.10 0.00 -0.68 4.33 -0.00 -1.13 -2.22 116.97 117.36 3hb7 h TYR 161 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 58.73 58.80 3hb7 h TYR 161 Cb 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.11 3hb7 h TYR 161 CO 0.04 0.38 0.45 0.78 -0.00 0.00 0.00 178.16 179.81 3hb7 h GLY 162 N 1.41 0.97 1.02 0.10 0.00 -1.75 -0.82 103.07 104.00 3hb7 h GLY 162 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 3hb7 h GLY 162 CO 0.05 0.33 0.33 1.41 0.00 0.00 0.00 176.54 178.66 3hb7 h LEU 163 N 0.91 0.98 -0.95 3.11 3.38 -1.01 0.15 115.31 121.88 3hb7 h LEU 163 Ca 0.26 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3hb7 h LEU 163 Cb -0.08 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 3hb7 h LEU 163 CO -0.07 0.86 0.29 -1.13 0.09 0.00 0.00 178.44 178.49 3hb7 h ASN 164 N 1.04 0.96 -0.08 -0.43 -0.00 -0.71 0.28 115.58 116.65 3hb7 h ASN 164 Ca 0.25 -0.13 -0.01 0.00 -0.00 0.00 0.00 56.30 56.41 3hb7 h ASN 164 Cb 0.16 -0.25 -0.00 0.00 -0.00 0.00 0.00 38.32 38.22 3hb7 h ASN 164 CO -0.03 0.85 0.02 0.44 -0.00 0.00 0.00 177.43 178.72 3hb7 h ASP 165 N 1.03 0.12 0.14 1.15 3.32 -0.52 -3.09 116.42 118.57 3hb7 h ASP 165 Ca 0.24 -0.20 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 3hb7 h ASP 165 Cb 0.18 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 3hb7 h ASP 165 CO -0.02 0.29 -0.13 -0.07 -1.72 0.00 0.00 179.24 177.59 3hb7 h LEU 166 N -0.06 0.00 -2.00 1.55 3.38 -0.26 -0.02 115.31 117.89 3hb7 h LEU 166 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3hb7 h LEU 166 Cb 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3hb7 h LEU 166 CO -0.00 0.13 -0.10 0.28 0.09 0.00 0.00 178.44 178.84 3hb7 h SER 167 N 0.00 0.00 -0.64 -0.43 0.02 -0.36 0.62 113.55 112.76 3hb7 h SER 167 Ca -0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 3hb7 h SER 167 Cb 0.24 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 3hb7 h SER 167 CO 0.02 0.10 0.18 0.40 -1.14 0.00 0.00 176.83 176.38 3hb7 h ILE 168 N 0.00 1.25 0.00 3.27 2.04 -0.98 -3.34 117.51 119.75 3hb7 h ILE 168 Ca -0.00 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 64.97 3hb7 h ILE 168 Cb 0.23 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 3hb7 h ILE 168 CO 0.01 0.34 0.00 2.22 0.00 0.00 0.00 178.15 180.72 3hb7 n PHE 169 N -4.34 0.00 -4.43 1.37 1.16 -1.11 -5.07 117.46 105.05 3hb7 n PHE 169 Ca 0.04 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.38 3hb7 n PHE 169 Cb 0.23 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.01 3hb7 n PHE 169 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 3hb7 s THR 170 N -0.03 2.66 -0.27 1.97 2.01 0.19 -4.81 115.64 117.36 3hb7 s THR 170 Ca 0.00 -2.21 -0.09 0.00 0.31 0.00 0.00 61.69 59.70 3hb7 s THR 170 Cb 0.00 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.94 3hb7 s THR 170 CO 0.00 -0.33 0.11 -1.59 -0.69 0.00 0.00 174.62 172.12 3hb7 s LYS 171 N -3.59 3.65 0.00 4.92 0.00 -1.08 -4.49 119.74 119.15 3hb7 s LYS 171 Ca 0.31 -0.49 -0.07 0.00 0.00 0.00 0.00 55.97 55.72 3hb7 s LYS 171 Cb -0.03 -3.45 -0.05 0.00 0.00 0.00 0.00 37.83 34.30 3hb7 s LYS 171 CO 0.17 -0.24 0.27 0.08 0.00 0.00 0.00 175.35 175.63 3hb7 s VAL 172 N 1.65 5.30 0.22 1.79 1.01 -1.26 0.90 120.40 130.01 3hb7 s VAL 172 Ca 0.06 0.18 0.08 0.00 0.00 0.00 0.00 61.98 62.31 3hb7 s VAL 172 Cb -0.16 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 3hb7 s VAL 172 CO 0.06 0.38 -0.14 0.28 0.00 0.00 0.00 175.10 175.67 3hb7 s THR 174 N -1.28 1.83 0.08 3.92 -1.32 -1.26 -4.94 115.64 112.66 3hb7 s THR 174 Ca 0.27 -2.23 -0.25 0.00 -1.21 0.00 0.00 61.69 58.27 3hb7 s THR 174 Cb -0.13 -2.12 -0.16 0.00 -1.51 0.00 0.00 72.50 68.58 3hb7 s THR 174 CO 0.16 -0.54 1.70 0.58 -2.21 0.00 0.00 174.62 174.30 3hb7 h VAL 175 N 2.49 0.92 -0.76 5.08 2.07 -1.93 0.14 116.25 124.27 3hb7 h VAL 175 Ca -0.38 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 3hb7 h VAL 175 Cb 1.23 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 3hb7 h VAL 175 CO 0.62 0.01 0.39 0.44 0.02 0.00 0.00 177.57 179.05 3hb7 h ASP 176 N -0.16 0.98 -0.70 0.57 3.32 -2.00 -2.10 116.42 116.34 3hb7 h ASP 176 Ca -0.01 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 3hb7 h ASP 176 Cb 0.12 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 3hb7 h ASP 176 CO 0.02 0.82 0.35 1.56 -1.72 0.00 0.00 179.24 180.28 3hb7 h GLN 177 N 1.06 1.02 -0.24 3.56 4.20 -1.80 -1.54 115.11 121.38 3hb7 h GLN 177 Ca 0.26 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.81 3hb7 h GLN 177 Cb 0.09 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3hb7 h GLN 177 CO -0.04 0.78 0.04 1.88 -0.67 0.00 0.00 178.83 180.82 3hb7 h TYR 178 N 1.02 0.43 -0.95 2.96 0.05 -0.39 -1.10 116.97 118.98 3hb7 h TYR 178 Ca 0.25 -0.06 -0.00 0.00 0.05 0.00 0.00 58.73 58.97 3hb7 h TYR 178 Cb 0.09 -0.12 -0.05 0.00 1.01 0.00 0.00 36.73 37.67 3hb7 h TYR 178 CO 0.01 0.53 0.59 0.82 -1.05 0.00 0.00 178.16 179.06 3hb7 h ILE 179 N 0.20 1.25 -0.68 -2.88 2.04 -0.94 -0.57 117.51 115.93 3hb7 h ILE 179 Ca 0.07 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 3hb7 h ILE 179 Cb 0.33 -0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 3hb7 h ILE 179 CO 0.01 0.26 0.28 1.56 0.00 0.00 0.00 178.15 180.25 3hb7 h GLN 180 N 1.30 1.02 -0.06 2.37 1.08 -1.17 -3.07 115.11 116.57 3hb7 h GLN 180 Ca 0.34 -0.18 0.02 0.00 -1.45 0.00 0.00 58.65 57.38 3hb7 h GLN 180 Cb -0.09 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 27.17 3hb7 h GLN 180 CO -0.07 0.84 0.43 0.00 -0.95 0.00 0.00 178.83 179.09 3hb7 h ALA 181 N 1.12 1.52 0.00 3.87 0.00 0.24 -0.75 119.26 125.27 3hb7 h ALA 181 Ca 0.23 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3hb7 h ALA 181 Cb 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3hb7 h ALA 181 CO -0.02 -0.47 -0.04 -1.49 0.00 0.00 0.00 179.25 177.23 3hb7 h TRP 182 N 0.00 0.00 -0.02 0.00 4.06 -1.56 -3.51 115.95 114.92 3hb7 h TRP 182 Ca 0.03 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.98 3hb7 h TRP 182 Cb 0.90 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.06 3hb7 h TRP 182 CO 0.00 0.04 0.00 0.39 -3.56 0.00 0.00 178.44 175.31