#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zho s VAL 7 N 0.00 5.29 -0.43 0.00 1.01 -1.26 -2.17 120.40 122.84 2zho s VAL 7 Ca 0.00 0.43 0.11 0.00 0.00 0.00 0.00 61.98 62.52 2zho s VAL 7 Cb 0.00 -3.60 -0.13 0.00 0.00 0.00 0.00 36.38 32.65 2zho s VAL 7 CO 0.00 0.31 0.43 0.35 0.00 0.00 0.00 175.10 176.20 2zho n THR 8 N 4.21 0.00 -3.55 3.92 -2.24 0.18 -4.95 114.28 111.86 2zho n THR 8 Ca -0.12 -0.24 -0.07 0.00 -2.27 0.00 0.00 64.05 61.35 2zho n THR 8 Cb 0.52 0.86 -0.02 0.00 -2.10 0.00 0.00 70.33 69.59 2zho n THR 8 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2zho s GLY 9 N -2.28 -0.42 0.07 3.38 0.00 -1.20 -4.98 107.32 101.88 2zho s GLY 9 Ca 0.03 0.96 0.07 0.00 0.00 0.00 0.00 44.72 45.78 2zho s GLY 9 CO 0.46 0.31 -0.18 -1.34 0.00 0.00 0.00 173.10 172.35 2zho s VAL 10 N -3.05 1.43 -0.11 1.40 -7.23 -1.26 -1.01 120.40 110.57 2zho s VAL 10 Ca 0.07 -1.28 -0.05 0.00 -1.81 0.00 0.00 61.98 58.90 2zho s VAL 10 Cb -0.01 -1.30 0.05 0.00 0.56 0.00 0.00 36.38 35.69 2zho s VAL 10 CO -0.07 -0.01 0.26 0.00 -0.31 0.00 0.00 175.10 174.96 2zho s ALA 11 N -1.02 -0.59 0.03 1.32 0.00 -0.65 -5.03 121.76 115.83 2zho s ALA 11 Ca 0.04 1.02 -0.09 0.00 0.00 0.00 0.00 51.96 52.93 2zho s ALA 11 Cb -0.09 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.28 2zho s ALA 11 CO 0.02 -0.26 0.33 -1.17 0.00 0.00 0.00 175.76 174.69 2zho s LEU 12 N 1.42 4.38 -0.07 0.00 0.20 -1.26 -2.22 118.68 121.13 2zho s LEU 12 Ca -0.08 0.70 -0.01 0.00 0.69 0.00 0.00 54.13 55.43 2zho s LEU 12 Cb -0.10 -2.75 0.03 0.00 -0.43 0.00 0.00 46.19 42.93 2zho s LEU 12 CO -0.09 0.24 -0.01 -0.62 -0.29 0.00 0.00 176.35 175.59 2zho s ASP 13 N -1.61 1.54 -0.06 3.68 2.15 -0.45 -4.98 116.67 116.94 2zho s ASP 13 Ca 0.29 -0.10 0.09 0.00 0.43 0.00 0.00 52.55 53.26 2zho s ASP 13 Cb -0.14 -0.45 0.14 0.00 -0.30 0.00 0.00 42.92 42.17 2zho s ASP 13 CO 0.16 -0.18 1.04 0.18 -0.17 0.00 0.00 175.17 176.20 2zho n LEU 14 N 5.03 1.86 -0.96 -1.34 4.77 -1.26 -1.17 117.00 123.93 2zho n LEU 14 Ca -0.09 -2.31 0.11 0.00 -0.03 0.00 0.00 56.01 53.70 2zho n LEU 14 Cb 0.50 -0.21 0.25 0.00 -2.33 0.00 0.00 43.42 41.64 2zho n LEU 14 CO 0.12 0.55 0.72 0.47 -1.33 0.00 0.00 177.39 177.92 2zho n ASP 15 N -0.88 2.89 -4.63 -1.43 9.92 -1.26 -4.96 116.55 116.20 2zho n ASP 15 Ca 0.08 -1.91 -0.26 0.00 -0.53 0.00 0.00 54.79 52.17 2zho n ASP 15 Cb 0.49 -0.19 -0.08 0.00 -0.64 0.00 0.00 41.12 40.70 2zho n ASP 15 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2zho s HIS 16 N -1.63 2.75 -0.03 1.24 3.76 -1.26 0.46 115.29 120.58 2zho s HIS 16 Ca 0.36 -0.18 0.00 0.00 -0.15 0.00 0.00 55.06 55.09 2zho s HIS 16 Cb 0.21 -1.31 0.03 0.00 1.11 0.00 0.00 32.58 32.61 2zho s HIS 16 CO 0.30 0.53 0.01 0.00 -0.85 0.00 0.00 174.74 174.74 2zho s ALA 17 N -1.83 0.23 0.19 -1.40 0.00 0.62 -4.59 121.76 114.98 2zho s ALA 17 Ca 0.27 0.21 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 2zho s ALA 17 Cb -0.09 -0.31 -0.08 0.00 0.00 0.00 0.00 23.12 22.64 2zho s ALA 17 CO 0.18 -0.11 1.00 -1.14 0.00 0.00 0.00 175.76 175.69 2zho s GLN 18 N 1.11 4.72 -0.32 0.00 0.74 -0.18 -2.01 119.66 123.72 2zho s GLN 18 Ca -0.09 1.57 0.04 0.00 0.05 0.00 0.00 55.36 56.93 2zho s GLN 18 Cb -0.13 -3.30 0.09 0.00 1.10 0.00 0.00 33.01 30.77 2zho s GLN 18 CO -0.02 0.28 0.01 0.42 -0.55 0.00 0.00 175.29 175.42 2zho s ILE 19 N -0.57 2.26 0.58 -2.34 1.01 0.46 -0.21 121.20 122.39 2zho s ILE 19 Ca 0.45 -2.17 -0.15 0.00 0.00 0.00 0.00 60.65 58.78 2zho s ILE 19 Cb -0.27 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.56 2zho s ILE 19 CO 0.33 -0.46 1.03 -0.83 0.00 0.00 0.00 174.94 175.01 2zho s GLY 20 N 0.95 1.99 -0.36 6.18 0.00 0.13 -2.24 107.32 113.97 2zho s GLY 20 Ca 0.06 0.21 0.01 0.00 0.00 0.00 0.00 44.72 45.01 2zho s GLY 20 CO -0.07 0.50 0.29 1.08 0.00 0.00 0.00 173.10 174.91 2zho s LEU 21 N -4.54 0.39 0.16 0.66 1.02 0.24 -1.37 118.68 115.25 2zho s LEU 21 Ca 0.60 -1.80 -0.01 0.00 0.02 0.00 0.00 54.13 52.94 2zho s LEU 21 Cb -0.13 0.12 -0.04 0.00 0.02 0.00 0.00 46.19 46.16 2zho s LEU 21 CO 0.39 -0.29 0.35 0.27 0.02 0.00 0.00 176.35 177.09 2zho s ILE 22 N 1.33 5.24 0.00 -0.59 -4.36 0.23 -1.55 121.20 121.50 2zho s ILE 22 Ca 0.17 -0.31 0.00 0.00 -0.26 0.00 0.00 60.65 60.25 2zho s ILE 22 Cb -0.19 -3.69 0.00 0.00 1.25 0.00 0.00 42.46 39.83 2zho s ILE 22 CO -0.04 -0.07 0.00 0.61 0.24 0.00 0.00 174.94 175.68 2zho n GLY 23 N -0.34 0.75 3.87 6.27 0.00 -1.18 0.13 105.19 114.69 2zho n GLY 23 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 2zho n GLY 23 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2zho s ILE 24 N -2.01 4.74 0.45 -0.61 -4.36 -0.60 -3.46 121.20 115.35 2zho s ILE 24 Ca 0.00 0.73 -0.20 0.00 -0.26 0.00 0.00 60.65 60.92 2zho s ILE 24 Cb 0.00 -3.73 -0.10 0.00 1.25 0.00 0.00 42.46 39.88 2zho s ILE 24 CO 0.00 -0.57 0.98 -2.16 0.24 0.00 0.00 174.94 173.44 2zho s PRO 25 N -3.92 4.06 -1.14 0.37 0.04 -1.26 0.75 135.00 133.90 2zho s PRO 25 Ca 0.53 1.20 -0.17 0.00 0.04 0.00 0.00 61.00 62.60 2zho s PRO 25 Cb -0.10 -2.15 0.13 0.00 0.04 0.00 0.00 34.50 32.42 2zho s PRO 25 CO 0.32 -0.19 1.42 0.34 0.04 0.00 0.00 177.00 178.93 2zho s ASP 26 N -2.15 6.86 -0.05 6.66 2.15 -1.26 -4.55 116.67 124.32 2zho s ASP 26 Ca 0.64 -2.49 -0.06 0.00 0.43 0.00 0.00 52.55 51.08 2zho s ASP 26 Cb -0.12 -2.45 0.01 0.00 -0.30 0.00 0.00 42.92 40.06 2zho s ASP 26 CO 0.16 -0.99 0.15 -1.58 -0.17 0.00 0.00 175.17 172.74 2zho s GLN 27 N 2.75 0.21 0.06 4.34 2.00 -1.26 -4.98 119.66 122.78 2zho s GLN 27 Ca 0.43 0.15 -0.21 0.00 -2.00 0.00 0.00 55.36 53.73 2zho s GLN 27 Cb -0.02 0.10 -0.12 0.00 0.80 0.00 0.00 33.01 33.78 2zho s GLN 27 CO -0.02 -0.03 0.51 -2.30 -0.50 0.00 0.00 175.29 172.95 2zho n PRO 28 N 2.84 0.00 -2.06 1.67 -0.02 -1.26 -3.01 135.00 133.16 2zho n PRO 28 Ca -0.13 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.24 2zho n PRO 28 Cb 0.59 -0.79 -0.01 0.00 -0.02 0.00 0.00 33.50 33.27 2zho n PRO 28 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2zho n GLY 29 N 1.08 0.13 0.13 -1.23 0.00 -1.26 -4.93 105.19 99.11 2zho n GLY 29 Ca 0.12 -0.46 -0.19 0.00 0.00 0.00 0.00 46.02 45.49 2zho n GLY 29 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2zho h ILE 30 N 0.00 0.82 -0.82 -0.61 2.04 -1.91 -3.16 117.51 113.86 2zho h ILE 30 Ca -0.25 -2.51 0.01 0.00 1.00 0.00 0.00 64.86 63.11 2zho h ILE 30 Cb 1.11 2.60 -0.04 0.00 -0.74 0.00 0.00 36.82 39.74 2zho h ILE 30 CO 0.30 0.82 0.54 0.00 0.00 0.00 0.00 178.15 179.81 2zho h ALA 31 N 0.29 1.05 -0.14 1.87 0.00 -1.91 -2.79 119.26 117.63 2zho h ALA 31 Ca -0.35 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.55 2zho h ALA 31 Cb 2.04 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.45 2zho h ALA 31 CO 0.12 0.44 -0.28 0.00 0.00 0.00 0.00 179.25 179.53 2zho h ALA 32 N 1.31 -0.29 -0.94 0.00 0.00 -1.97 0.83 119.26 118.20 2zho h ALA 32 Ca 0.31 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.27 2zho h ALA 32 Cb -0.11 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2zho h ALA 32 CO -0.07 -0.75 0.62 0.87 0.00 0.00 0.00 179.25 179.92 2zho h LYS 33 N -0.35 1.19 -0.13 0.00 1.57 -1.50 0.34 116.57 117.70 2zho h LYS 33 Ca 0.10 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2zho h LYS 33 Cb 0.50 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2zho h LYS 33 CO -0.34 0.79 0.05 0.28 -0.57 0.00 0.00 179.45 179.66 2zho h VAL 34 N 1.23 1.15 0.00 0.50 2.07 -1.18 -2.21 116.25 117.82 2zho h VAL 34 Ca 0.36 -0.46 -0.15 0.00 0.82 0.00 0.00 66.70 67.27 2zho h VAL 34 Cb -0.06 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2zho h VAL 34 CO -0.10 0.14 -0.69 -0.26 0.02 0.00 0.00 177.57 176.68 2zho h PHE 35 N 0.05 0.00 -0.49 1.57 -1.00 -0.42 -2.65 116.94 114.00 2zho h PHE 35 Ca 0.04 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.79 2zho h PHE 35 Cb 0.18 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.71 2zho h PHE 35 CO -0.01 0.69 0.17 0.37 -1.61 0.00 0.00 178.31 177.92 2zho h GLN 36 N 0.00 0.75 -0.69 1.51 4.15 -0.31 -2.37 115.11 118.15 2zho h GLN 36 Ca -0.01 -0.16 0.06 0.00 0.77 0.00 0.00 58.65 59.31 2zho h GLN 36 Cb 1.26 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.80 2zho h GLN 36 CO 0.09 0.70 0.45 0.00 -1.93 0.00 0.00 178.83 178.14 2zho h ALA 37 N 1.02 1.71 0.00 3.38 0.00 -1.24 -1.67 119.26 122.45 2zho h ALA 37 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2zho h ALA 37 Cb 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2zho h ALA 37 CO -0.01 0.19 0.00 1.28 0.00 0.00 0.00 179.25 180.71 2zho n LEU 38 N -4.47 0.70 0.01 0.00 4.77 -1.00 -3.84 117.00 113.16 2zho n LEU 38 Ca 0.10 0.58 -0.22 0.00 -0.03 0.00 0.00 56.01 56.44 2zho n LEU 38 Cb 0.21 -0.38 -0.14 0.00 -2.33 0.00 0.00 43.42 40.77 2zho n LEU 38 CO 0.34 -0.23 -0.77 0.00 -1.33 0.00 0.00 177.39 175.40 2zho h ALA 39 N 2.53 0.40 0.00 -1.18 0.00 -0.81 0.43 119.26 120.62 2zho h ALA 39 Ca 0.00 -1.36 -0.01 0.00 0.00 0.00 0.00 54.91 53.54 2zho h ALA 39 Cb 0.64 0.68 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2zho h ALA 39 CO 0.00 1.27 -0.04 0.93 0.00 0.00 0.00 179.25 181.41 2zho h GLU 40 N 0.06 0.00 0.00 0.00 5.08 -1.57 0.91 114.58 119.06 2zho h GLU 40 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2zho h GLU 40 Cb 2.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.28 2zho h GLU 40 CO 0.10 0.04 -1.11 0.54 -1.00 0.00 0.00 179.01 177.57 2zho n ARG 41 N -3.60 0.15 -3.01 2.33 5.12 -1.25 -5.02 116.66 111.38 2zho n ARG 41 Ca -0.02 -0.03 -0.12 0.00 -1.93 0.00 0.00 57.85 55.74 2zho n ARG 41 Cb 0.14 -1.52 0.05 0.00 -1.16 0.00 0.00 32.46 29.97 2zho n ARG 41 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2zho n GLY 42 N 1.44 0.07 3.82 -0.13 0.00 0.31 -5.05 105.19 105.66 2zho n GLY 42 Ca 0.03 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 2zho n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2zho s ILE 43 N -3.19 4.98 -0.23 -0.61 1.01 0.15 -4.99 121.20 118.32 2zho s ILE 43 Ca 0.22 -0.27 -0.02 0.00 0.00 0.00 0.00 60.65 60.58 2zho s ILE 43 Cb -0.10 -3.28 0.02 0.00 0.01 0.00 0.00 42.46 39.11 2zho s ILE 43 CO 0.41 0.38 -0.09 0.00 0.00 0.00 0.00 174.94 175.64 2zho s ALA 44 N -1.20 2.65 -0.07 9.38 0.00 -1.26 -4.62 121.76 126.63 2zho s ALA 44 Ca 0.23 -1.34 -0.19 0.00 0.00 0.00 0.00 51.96 50.67 2zho s ALA 44 Cb -0.12 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.37 2zho s ALA 44 CO 0.14 -0.62 0.52 0.54 0.00 0.00 0.00 175.76 176.34 2zho s VAL 45 N 1.36 5.09 -0.17 0.00 0.11 -1.26 -4.61 120.40 120.91 2zho s VAL 45 Ca 0.03 1.06 0.05 0.00 -2.93 0.00 0.00 61.98 60.19 2zho s VAL 45 Cb -0.15 -3.85 -0.14 0.00 -1.53 0.00 0.00 36.38 30.70 2zho s VAL 45 CO -0.06 0.37 -0.09 -0.90 -3.33 0.00 0.00 175.10 171.09 2zho n ASP 46 N 3.23 2.18 -4.03 3.54 3.85 -1.24 -4.99 116.55 119.08 2zho n ASP 46 Ca -0.07 -0.06 -0.26 0.00 -0.71 0.00 0.00 54.79 53.68 2zho n ASP 46 Cb 0.51 0.11 -0.17 0.00 -1.35 0.00 0.00 41.12 40.23 2zho n ASP 46 CO 0.00 0.00 0.00 -0.04 -1.01 0.00 0.00 177.20 176.15 2zho s MET 47 N -2.36 1.91 -0.02 0.11 -1.94 -1.26 -5.02 119.30 110.72 2zho s MET 47 Ca -0.19 -0.47 0.03 0.00 -1.71 0.00 0.00 55.69 53.36 2zho s MET 47 Cb 0.06 -1.61 -0.00 0.00 2.01 0.00 0.00 34.83 35.28 2zho s MET 47 CO 0.48 -0.02 -0.09 -1.50 -0.01 0.00 0.00 175.02 173.88 2zho s ILE 48 N 0.84 0.78 0.12 2.53 1.10 -1.26 -1.19 121.20 124.12 2zho s ILE 48 Ca -0.11 -0.39 0.01 0.00 -0.51 0.00 0.00 60.65 59.65 2zho s ILE 48 Cb -0.15 -0.68 -0.04 0.00 0.15 0.00 0.00 42.46 41.73 2zho s ILE 48 CO 0.01 0.24 -0.01 0.27 -2.11 0.00 0.00 174.94 173.34 2zho s ILE 49 N 0.02 0.49 0.15 2.00 -4.36 0.17 -4.99 121.20 114.69 2zho s ILE 49 Ca -0.00 -1.92 -0.05 0.00 -0.26 0.00 0.00 60.65 58.41 2zho s ILE 49 Cb -0.07 -1.86 -0.02 0.00 1.25 0.00 0.00 42.46 41.76 2zho s ILE 49 CO 0.00 -0.69 0.18 -1.10 0.24 0.00 0.00 174.94 173.57 2zho s GLN 50 N -3.92 1.06 0.73 0.37 -0.21 -1.26 -0.77 119.66 115.66 2zho s GLN 50 Ca 0.17 -1.32 -0.11 0.00 0.02 0.00 0.00 55.36 54.13 2zho s GLN 50 Cb 0.06 0.31 0.03 0.00 1.00 0.00 0.00 33.01 34.42 2zho s GLN 50 CO -0.02 -0.35 1.08 0.20 -2.12 0.00 0.00 175.29 174.08 2zho s GLY 51 N -3.02 1.69 -0.20 3.09 0.00 -0.05 -4.97 107.32 103.86 2zho s GLY 51 Ca 0.22 0.19 -0.12 0.00 0.00 0.00 0.00 44.72 45.00 2zho s GLY 51 CO 0.02 0.52 0.08 -0.62 0.00 0.00 0.00 173.10 173.10 2zho n VAL 52 N -3.30 1.60 0.00 1.40 0.31 -1.26 -4.95 118.33 112.13 2zho n VAL 52 Ca 0.08 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2zho n VAL 52 Cb 0.53 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 2zho n VAL 52 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2zho n PRO 57 N -3.96 0.00 0.00 5.55 -0.05 -1.26 -5.10 135.00 130.18 2zho n PRO 57 Ca -0.39 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.06 2zho n PRO 57 Cb 0.87 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 34.32 2zho n PRO 57 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 175.50 175.88 2zho n SER 58 N 0.00 -2.03 0.00 3.54 7.64 -1.26 -4.92 113.62 116.59 2zho n SER 58 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2zho n SER 58 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2zho n SER 58 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2zho n ARG 59 N -0.17 0.00 -3.02 1.43 -4.01 -1.26 -4.78 116.66 104.86 2zho n ARG 59 Ca 0.00 0.00 -0.19 0.00 -1.04 0.00 0.00 57.85 56.62 2zho n ARG 59 Cb 0.00 0.00 0.04 0.00 -3.04 0.00 0.00 32.46 29.46 2zho n ARG 59 CO 0.00 0.00 0.00 -1.14 -3.04 0.00 0.00 177.63 173.45 2zho s GLN 60 N 0.00 2.52 -0.13 2.89 2.00 0.23 -4.85 119.66 122.32 2zho s GLN 60 Ca 0.00 -1.46 -0.10 0.00 -2.00 0.00 0.00 55.36 51.80 2zho s GLN 60 Cb 0.00 -2.69 0.04 0.00 0.80 0.00 0.00 33.01 31.16 2zho s GLN 60 CO 0.00 -0.62 0.33 1.14 -0.50 0.00 0.00 175.29 175.63 2zho s GLN 61 N -4.54 0.35 0.07 1.67 1.03 -1.26 -1.56 119.66 115.42 2zho s GLN 61 Ca 0.59 0.51 0.05 0.00 0.04 0.00 0.00 55.36 56.55 2zho s GLN 61 Cb -0.08 0.11 -0.03 0.00 0.03 0.00 0.00 33.01 33.04 2zho s GLN 61 CO 0.37 -0.08 -0.13 0.00 -2.54 0.00 0.00 175.29 172.91 2zho s MET 62 N 0.52 0.77 -0.01 9.60 0.23 -0.60 -0.87 119.30 128.94 2zho s MET 62 Ca -0.03 -0.93 0.02 0.00 -1.03 0.00 0.00 55.69 53.72 2zho s MET 62 Cb -0.04 -0.73 0.00 0.00 -1.53 0.00 0.00 34.83 32.53 2zho s MET 62 CO -0.03 0.16 -0.05 0.00 -2.03 0.00 0.00 175.02 173.07 2zho s ALA 63 N -1.33 0.50 0.27 3.16 0.00 0.05 -0.60 121.76 123.81 2zho s ALA 63 Ca -0.03 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 51.77 2zho s ALA 63 Cb -0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2zho s ALA 63 CO 0.02 0.08 0.15 -0.59 0.00 0.00 0.00 175.76 175.42 2zho s PHE 64 N 0.14 1.50 0.23 0.00 -0.12 -0.95 0.45 117.98 119.23 2zho s PHE 64 Ca -0.01 -1.35 0.11 0.00 -0.05 0.00 0.00 56.93 55.63 2zho s PHE 64 Cb -0.05 -0.80 -0.05 0.00 -0.63 0.00 0.00 43.02 41.50 2zho s PHE 64 CO -0.00 -0.53 -0.17 0.95 -0.05 0.00 0.00 175.22 175.42 2zho s THR 65 N -3.75 2.69 -0.05 -4.49 -4.23 -0.34 -0.40 115.64 105.08 2zho s THR 65 Ca 0.37 -2.09 -0.28 0.00 -1.18 0.00 0.00 61.69 58.52 2zho s THR 65 Cb 0.06 -2.36 0.06 0.00 1.34 0.00 0.00 72.50 71.60 2zho s THR 65 CO 0.16 -0.25 0.61 0.54 -0.54 0.00 0.00 174.62 175.14 2zho s VAL 66 N -2.06 0.01 0.19 2.29 0.11 -0.85 -3.60 120.40 116.49 2zho s VAL 66 Ca 0.26 -0.09 -0.33 0.00 -2.93 0.00 0.00 61.98 58.90 2zho s VAL 66 Cb -0.07 -0.93 -0.14 0.00 -1.53 0.00 0.00 36.38 33.71 2zho s VAL 66 CO 0.14 -0.05 1.39 0.29 -3.33 0.00 0.00 175.10 173.54 2zho n LYS 67 N 1.03 1.77 -0.25 1.54 5.02 -1.26 -0.27 118.16 125.73 2zho n LYS 67 Ca -0.19 0.63 0.04 0.00 -2.02 0.00 0.00 58.31 56.77 2zho n LYS 67 Cb 0.57 -2.28 0.13 0.00 -0.02 0.00 0.00 35.03 33.43 2zho n LYS 67 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2zho h LYS 68 N 4.51 0.08 -0.75 1.97 1.57 -0.27 -1.20 116.57 122.48 2zho h LYS 68 Ca -0.45 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.33 2zho h LYS 68 Cb 1.29 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.55 2zho h LYS 68 CO 0.78 0.05 0.49 -0.44 -0.57 0.00 0.00 179.45 179.76 2zho h ASP 69 N 0.08 0.87 -0.03 0.86 3.32 -1.89 -2.47 116.42 117.16 2zho h ASP 69 Ca 0.39 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.41 2zho h ASP 69 Cb 0.66 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2zho h ASP 69 CO -0.66 0.64 0.00 0.49 -1.72 0.00 0.00 179.24 177.98 2zho n PHE 70 N -4.55 0.04 -0.12 4.55 3.01 -0.50 -4.23 117.46 115.66 2zho n PHE 70 Ca 0.07 -0.02 -0.12 0.00 1.01 0.00 0.00 57.45 58.40 2zho n PHE 70 Cb 0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.46 2zho n PHE 70 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2zho h ALA 71 N 3.86 0.49 -0.35 4.37 0.00 -0.95 -2.74 119.26 123.94 2zho h ALA 71 Ca 0.00 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 2zho h ALA 71 Cb 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2zho h ALA 71 CO 0.00 0.41 -0.16 0.37 0.00 0.00 0.00 179.25 179.86 2zho h GLN 72 N 0.51 0.73 -0.55 0.00 5.75 -1.77 0.11 115.11 119.88 2zho h GLN 72 Ca 0.08 -0.32 -0.03 0.00 -0.15 0.00 0.00 58.65 58.24 2zho h GLN 72 Cb 0.70 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.20 2zho h GLN 72 CO 0.05 0.92 0.24 1.49 -2.65 0.00 0.00 178.83 178.88 2zho h GLU 73 N 0.51 0.79 -0.27 1.69 4.81 -1.84 0.22 114.58 120.48 2zho h GLU 73 Ca 0.08 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2zho h GLU 73 Cb 0.70 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2zho h GLU 73 CO 0.05 0.63 0.13 0.00 -0.73 0.00 0.00 179.01 179.09 2zho h ALA 74 N 1.48 0.35 -0.22 2.92 0.00 -1.12 0.51 119.26 123.18 2zho h ALA 74 Ca 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2zho h ALA 74 Cb 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2zho h ALA 74 CO -0.02 -0.09 0.13 1.25 0.00 0.00 0.00 179.25 180.51 2zho h LEU 75 N 0.30 0.27 -0.78 0.00 5.85 -0.35 -2.30 115.31 118.29 2zho h LEU 75 Ca 0.09 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2zho h LEU 75 Cb 0.12 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 2zho h LEU 75 CO -0.01 0.25 0.51 -0.08 -0.34 0.00 0.00 178.44 178.77 2zho h GLU 76 N 0.26 1.01 -0.03 1.25 4.81 -0.46 -3.11 114.58 118.31 2zho h GLU 76 Ca 0.08 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2zho h GLU 76 Cb 0.04 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 2zho h GLU 76 CO -0.01 0.67 -0.26 0.00 -0.73 0.00 0.00 179.01 178.68 2zho h ALA 77 N 1.29 1.51 0.00 2.92 0.00 0.54 -2.89 119.26 122.64 2zho h ALA 77 Ca 0.29 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2zho h ALA 77 Cb -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2zho h ALA 77 CO -0.07 0.36 -0.58 -0.07 0.00 0.00 0.00 179.25 178.89 2zho h LEU 78 N 0.05 0.00 -0.74 0.00 3.38 -1.40 -3.38 115.31 113.23 2zho h LEU 78 Ca 0.01 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.11 2zho h LEU 78 Cb 0.49 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.14 2zho h LEU 78 CO 0.03 0.00 0.28 -0.08 0.09 0.00 0.00 178.44 178.77 2zho h GLU 79 N 0.00 0.41 -0.21 1.13 4.81 -1.44 0.24 114.58 119.52 2zho h GLU 79 Ca 0.00 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.13 2zho h GLU 79 Cb 0.98 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 2zho h GLU 79 CO 0.00 0.27 -0.22 -1.00 -0.73 0.00 0.00 179.01 177.34 2zho h PRO 80 N 0.42 0.37 -0.11 0.92 0.13 -1.75 -1.77 132.00 130.22 2zho h PRO 80 Ca 0.41 -0.12 -0.08 0.00 -0.87 0.00 0.00 66.00 65.34 2zho h PRO 80 Cb 0.62 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.72 2zho h PRO 80 CO -0.41 0.58 -0.23 0.28 -0.23 0.00 0.00 178.00 177.99 2zho h VAL 81 N 0.34 1.39 -0.84 1.56 2.07 -1.41 -2.71 116.25 116.65 2zho h VAL 81 Ca 0.06 -1.52 0.07 0.00 0.82 0.00 0.00 66.70 66.12 2zho h VAL 81 Cb 0.57 2.11 -0.05 0.00 -1.52 0.00 0.00 31.29 32.40 2zho h VAL 81 CO 0.04 0.44 0.55 0.25 0.02 0.00 0.00 177.57 178.87 2zho h LEU 82 N -0.09 0.80 -0.49 2.57 5.85 -0.60 -0.48 115.31 122.88 2zho h LEU 82 Ca 0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2zho h LEU 82 Cb 0.82 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 2zho h LEU 82 CO 0.05 0.51 0.29 0.00 -0.34 0.00 0.00 178.44 178.95 2zho h ALA 83 N 1.55 0.62 0.37 1.25 0.00 -1.19 -0.46 119.26 121.39 2zho h ALA 83 Ca 0.36 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2zho h ALA 83 Cb 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2zho h ALA 83 CO -0.13 -0.01 -0.18 1.49 0.00 0.00 0.00 179.25 180.42 2zho h GLU 84 N 0.58 -0.47 0.00 0.00 4.81 -1.04 -3.36 114.58 115.09 2zho h GLU 84 Ca 0.19 0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.34 2zho h GLU 84 Cb 0.01 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2zho h GLU 84 CO -0.08 -0.15 -0.53 -0.84 -0.73 0.00 0.00 179.01 176.67 2zho h ILE 85 N -0.91 0.93 -0.45 2.32 -0.00 -1.15 -3.50 117.51 114.75 2zho h ILE 85 Ca -0.05 -2.25 0.00 0.00 -0.00 0.00 0.00 64.86 62.56 2zho h ILE 85 Cb 0.54 2.41 0.00 0.00 -0.00 0.00 0.00 36.82 39.77 2zho h ILE 85 CO 0.08 0.52 0.00 0.61 -0.00 0.00 0.00 178.15 179.36 2zho n GLY 86 N 1.15 -1.68 0.00 0.16 0.00 -0.18 -4.44 105.19 100.19 2zho n GLY 86 Ca 0.02 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2zho n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zho n GLY 87 N 1.04 3.15 3.24 -0.02 0.00 -1.22 -3.38 105.19 108.00 2zho n GLY 87 Ca 0.00 -1.23 -0.28 0.00 0.00 0.00 0.00 46.02 44.52 2zho n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zho s GLU 88 N -2.22 1.72 0.24 1.61 8.01 0.34 -4.84 118.70 123.57 2zho s GLU 88 Ca 0.00 -0.80 -0.00 0.00 0.01 0.00 0.00 54.97 54.17 2zho s GLU 88 Cb 0.00 -1.69 -0.04 0.00 -4.31 0.00 0.00 34.13 28.09 2zho s GLU 88 CO 0.00 0.46 0.44 0.00 0.01 0.00 0.00 175.26 176.17 2zho s ALA 89 N -0.55 3.79 -0.02 5.21 0.00 -1.26 -0.60 121.76 128.33 2zho s ALA 89 Ca 0.08 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.21 2zho s ALA 89 Cb -0.08 -2.02 0.01 0.00 0.00 0.00 0.00 23.12 21.02 2zho s ALA 89 CO -0.00 0.31 -0.06 0.42 0.00 0.00 0.00 175.76 176.42 2zho s ILE 90 N -1.99 0.56 -0.25 0.00 -1.09 -0.47 -4.95 121.20 113.02 2zho s ILE 90 Ca 0.39 -0.22 0.02 0.00 -2.23 0.00 0.00 60.65 58.60 2zho s ILE 90 Cb -0.10 -0.53 0.05 0.00 -1.58 0.00 0.00 42.46 40.30 2zho s ILE 90 CO 0.30 0.19 -0.12 -0.22 -1.23 0.00 0.00 174.94 173.87 2zho s LEU 91 N 0.35 3.22 -0.57 2.97 1.98 -1.26 0.18 118.68 125.55 2zho s LEU 91 Ca -0.04 -1.22 0.04 0.00 -2.89 0.00 0.00 54.13 50.01 2zho s LEU 91 Cb -0.09 -1.56 0.15 0.00 0.66 0.00 0.00 46.19 45.36 2zho s LEU 91 CO 0.00 -0.16 0.35 -0.60 -1.89 0.00 0.00 176.35 174.06 2zho s ARG 92 N 1.16 1.95 0.48 1.98 3.52 0.70 -4.96 118.95 123.79 2zho s ARG 92 Ca -0.06 -2.74 0.27 0.00 -0.13 0.00 0.00 55.73 53.07 2zho s ARG 92 Cb -0.18 -3.03 1.16 0.00 -1.56 0.00 0.00 34.95 31.34 2zho s ARG 92 CO -0.06 -1.21 1.93 -1.00 -0.81 0.00 0.00 175.30 174.15 2zho h PRO 93 N 6.06 0.00 -3.90 5.12 0.13 -1.89 -0.45 132.00 137.06 2zho h PRO 93 Ca 0.05 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.48 2zho h PRO 93 Cb 0.85 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 2zho h PRO 93 CO 0.64 0.16 3.15 -3.47 -0.23 0.00 0.00 178.00 178.24 2zho n ASP 94 N -3.40 4.41 -3.88 1.44 -0.08 -1.26 -4.71 116.55 109.07 2zho n ASP 94 Ca -0.00 -2.78 -0.14 0.00 -1.51 0.00 0.00 54.79 50.36 2zho n ASP 94 Cb 0.35 -1.58 -0.15 0.00 2.34 0.00 0.00 41.12 42.09 2zho n ASP 94 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 2zho s ILE 95 N 3.24 0.13 -0.02 5.18 -5.25 -1.26 -2.10 121.20 121.12 2zho s ILE 95 Ca 0.51 -0.03 0.05 0.00 -0.99 0.00 0.00 60.65 60.18 2zho s ILE 95 Cb 0.15 -0.14 -0.03 0.00 2.95 0.00 0.00 42.46 45.39 2zho s ILE 95 CO -0.06 0.06 -0.14 0.00 -1.79 0.00 0.00 174.94 173.00 2zho s ALA 96 N 0.17 2.68 -0.24 2.27 0.00 -0.08 -4.67 121.76 121.90 2zho s ALA 96 Ca -0.01 -1.04 -0.10 0.00 0.00 0.00 0.00 51.96 50.80 2zho s ALA 96 Cb -0.03 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 2zho s ALA 96 CO -0.00 0.57 0.14 0.21 0.00 0.00 0.00 175.76 176.68 2zho s LYS 97 N -1.01 3.97 -0.23 0.00 2.20 -0.32 -1.37 119.74 122.98 2zho s LYS 97 Ca 0.13 -0.32 -0.06 0.00 -0.36 0.00 0.00 55.97 55.37 2zho s LYS 97 Cb -0.11 -3.51 -0.02 0.00 -1.51 0.00 0.00 37.83 32.69 2zho s LYS 97 CO 0.03 -0.01 0.01 0.08 -0.36 0.00 0.00 175.35 175.10 2zho s VAL 98 N 1.24 3.87 -0.05 4.02 1.01 0.15 -1.33 120.40 129.30 2zho s VAL 98 Ca 0.07 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 61.77 2zho s VAL 98 Cb -0.14 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.45 2zho s VAL 98 CO 0.06 0.39 -0.20 -0.44 0.00 0.00 0.00 175.10 174.90 2zho s SER 99 N 1.46 2.50 0.21 3.32 0.01 -0.94 0.26 113.70 120.52 2zho s SER 99 Ca 0.05 -0.42 0.06 0.00 1.31 0.00 0.00 55.95 56.96 2zho s SER 99 Cb -0.15 -0.75 -0.04 0.00 0.21 0.00 0.00 66.02 65.29 2zho s SER 99 CO 0.01 0.18 0.17 0.27 0.41 0.00 0.00 173.24 174.27 2zho s ILE 100 N 0.03 4.50 0.14 1.44 -4.36 -0.45 -1.63 121.20 120.87 2zho s ILE 100 Ca -0.06 -1.23 0.05 0.00 -0.26 0.00 0.00 60.65 59.15 2zho s ILE 100 Cb -0.13 -3.37 -0.04 0.00 1.25 0.00 0.00 42.46 40.17 2zho s ILE 100 CO 0.03 -0.23 -0.10 -0.69 0.24 0.00 0.00 174.94 174.19 2zho s VAL 101 N -1.94 1.17 -4.01 8.37 1.01 -0.18 -2.80 120.40 122.02 2zho s VAL 101 Ca 0.32 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.30 2zho s VAL 101 Cb -0.09 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2zho s VAL 101 CO 0.24 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.25 2zho n GLY 102 N -0.07 -0.34 3.07 4.51 0.00 -1.19 0.50 105.19 111.66 2zho n GLY 102 Ca -0.11 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 2zho n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zho s VAL 103 N -4.00 -0.02 -0.34 1.61 0.11 -0.92 -4.43 120.40 112.41 2zho s VAL 103 Ca 0.00 0.08 -0.00 0.00 -2.93 0.00 0.00 61.98 59.13 2zho s VAL 103 Cb 0.00 -0.34 -0.00 0.00 -1.53 0.00 0.00 36.38 34.51 2zho s VAL 103 CO 0.00 0.03 0.29 0.61 -3.33 0.00 0.00 175.10 172.70 2zho n GLY 104 N 3.64 0.22 0.13 6.54 0.00 -0.85 -4.77 105.19 110.10 2zho n GLY 104 Ca -0.20 -0.27 -0.25 0.00 0.00 0.00 0.00 46.02 45.30 2zho n GLY 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2zho n LEU 105 N -1.92 2.05 -0.32 0.99 4.77 -0.97 -3.02 117.00 118.57 2zho n LEU 105 Ca -0.08 0.32 0.03 0.00 -0.03 0.00 0.00 56.01 56.25 2zho n LEU 105 Cb 0.55 -0.90 0.17 0.00 -2.33 0.00 0.00 43.42 40.91 2zho n LEU 105 CO 0.18 0.52 1.20 0.00 -1.33 0.00 0.00 177.39 177.95 2zho h ALA 106 N -0.66 1.27 -0.01 -1.18 0.00 -1.77 -2.91 119.26 113.99 2zho h ALA 106 Ca -0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2zho h ALA 106 Cb 1.55 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2zho h ALA 106 CO -0.29 0.25 -0.01 -1.13 0.00 0.00 0.00 179.25 178.07 2zho n SER 107 N -4.63 1.31 -4.19 0.00 3.41 -1.26 -4.08 113.62 104.18 2zho n SER 107 Ca 0.14 -1.41 -0.40 0.00 -0.26 0.00 0.00 58.87 56.94 2zho n SER 107 Cb 0.23 0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.13 2zho n SER 107 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2zho s THR 108 N -2.03 4.69 0.50 6.66 2.01 -1.10 -4.96 115.64 121.40 2zho s THR 108 Ca 0.38 -3.16 0.35 0.00 0.31 0.00 0.00 61.69 59.58 2zho s THR 108 Cb 0.21 -3.93 0.35 0.00 0.01 0.00 0.00 72.50 69.15 2zho s THR 108 CO 0.35 -1.02 2.08 -0.65 -0.69 0.00 0.00 174.62 174.69 2zho h PRO 109 N 6.88 0.00 0.00 4.92 0.11 -1.79 0.11 132.00 142.24 2zho h PRO 109 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2zho h PRO 109 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2zho h PRO 109 CO 0.80 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.52 2zho h GLU 110 N 0.00 0.00 0.56 1.05 4.39 -1.93 -3.28 114.58 115.37 2zho h GLU 110 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2zho h GLU 110 Cb 0.21 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2zho h GLU 110 CO 0.00 0.00 -0.27 0.28 -1.16 0.00 0.00 179.01 177.86 2zho h VAL 111 N 0.00 0.17 0.00 3.13 2.07 -1.06 -2.65 116.25 117.92 2zho h VAL 111 Ca 0.00 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2zho h VAL 111 Cb 0.83 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 2zho h VAL 111 CO 0.00 0.03 -0.07 1.55 0.02 0.00 0.00 177.57 179.10 2zho h PRO 112 N -1.12 0.00 -0.47 1.57 0.13 -1.72 -2.65 132.00 127.74 2zho h PRO 112 Ca -0.08 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.95 2zho h PRO 112 Cb 0.62 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 2zho h PRO 112 CO 0.13 0.07 -0.10 0.00 -0.23 0.00 0.00 178.00 177.87 2zho h ALA 113 N 1.93 0.64 -0.34 -0.56 0.00 -1.62 -1.89 119.26 117.43 2zho h ALA 113 Ca -0.00 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 2zho h ALA 113 Cb 0.46 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2zho h ALA 113 CO 0.01 0.54 -0.29 0.87 0.00 0.00 0.00 179.25 180.37 2zho h LYS 114 N 0.74 0.71 -0.02 0.00 1.57 -1.19 -1.70 116.57 116.68 2zho h LYS 114 Ca 0.12 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2zho h LYS 114 Cb 0.65 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 2zho h LYS 114 CO 0.04 0.92 0.01 1.98 -0.57 0.00 0.00 179.45 181.83 2zho h MET 115 N 0.61 0.04 -0.57 3.15 4.05 -1.32 -0.47 114.93 120.42 2zho h MET 115 Ca 0.07 -0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.38 2zho h MET 115 Cb 0.80 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.58 2zho h MET 115 CO 0.07 0.26 -0.05 0.74 0.23 0.00 0.00 176.91 178.15 2zho h PHE 116 N -0.19 1.13 0.00 1.39 0.04 -1.38 0.28 116.94 118.21 2zho h PHE 116 Ca 0.01 -0.21 -0.01 0.00 2.80 0.00 0.00 57.97 60.56 2zho h PHE 116 Cb 0.24 -0.29 -0.00 0.00 2.20 0.00 0.00 35.95 38.10 2zho h PHE 116 CO 0.01 1.02 -0.04 0.37 -0.60 0.00 0.00 178.31 179.06 2zho h GLN 117 N 0.93 0.00 0.04 1.51 5.75 -1.17 0.36 115.11 122.52 2zho h GLN 117 Ca 0.16 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 58.43 2zho h GLN 117 Cb 0.61 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.14 2zho h GLN 117 CO 0.04 0.04 -1.22 0.00 -2.65 0.00 0.00 178.83 175.04 2zho h ALA 118 N 1.96 0.23 -1.00 3.38 0.00 -0.50 -3.03 119.26 120.31 2zho h ALA 118 Ca -0.00 -1.12 0.10 0.00 0.00 0.00 0.00 54.91 53.89 2zho h ALA 118 Cb 0.11 0.60 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 2zho h ALA 118 CO 0.01 0.71 0.64 0.28 0.00 0.00 0.00 179.25 180.88 2zho h VAL 119 N -0.74 0.99 0.00 0.00 2.07 -0.80 -2.39 116.25 115.38 2zho h VAL 119 Ca -0.31 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 66.74 2zho h VAL 119 Cb 1.44 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2zho h VAL 119 CO -0.10 0.19 -0.53 0.00 0.02 0.00 0.00 177.57 177.16 2zho h ALA 120 N 1.51 0.98 0.00 1.67 0.00 -0.41 -3.02 119.26 119.99 2zho h ALA 120 Ca 0.47 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2zho h ALA 120 Cb 0.36 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2zho h ALA 120 CO -0.22 0.66 -0.02 0.66 0.00 0.00 0.00 179.25 180.33 2zho h SER 121 N 0.00 0.00 0.75 0.00 4.64 -1.29 0.12 113.55 117.77 2zho h SER 121 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2zho h SER 121 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2zho h SER 121 CO 0.07 0.02 -0.19 0.35 -0.87 0.00 0.00 176.83 176.21 2zho n THR 122 N -3.14 0.00 -2.32 2.95 -2.24 -1.14 -4.92 114.28 103.46 2zho n THR 122 Ca -0.01 -0.01 -0.04 0.00 -2.27 0.00 0.00 64.05 61.73 2zho n THR 122 Cb 0.22 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 2zho n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2zho n GLY 123 N 1.47 0.42 3.87 3.38 0.00 0.43 -5.05 105.19 109.71 2zho n GLY 123 Ca 0.07 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 2zho n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zho s ALA 124 N -2.53 3.69 -0.44 4.61 0.00 -1.21 -5.06 121.76 120.82 2zho s ALA 124 Ca 0.04 -0.38 -0.14 0.00 0.00 0.00 0.00 51.96 51.48 2zho s ALA 124 Cb -0.02 -2.29 0.05 0.00 0.00 0.00 0.00 23.12 20.86 2zho s ALA 124 CO 0.05 0.57 0.33 1.21 0.00 0.00 0.00 175.76 177.92 2zho s ASN 125 N -2.03 6.06 0.12 0.00 2.47 -1.26 -4.53 114.94 115.76 2zho s ASN 125 Ca 0.38 -1.15 -0.32 0.00 0.42 0.00 0.00 52.86 52.20 2zho s ASN 125 Cb -0.13 -2.15 -0.11 0.00 -1.45 0.00 0.00 41.25 37.41 2zho s ASN 125 CO 0.20 -0.54 1.81 -0.38 -3.72 0.00 0.00 177.10 174.47 2zho n ILE 126 N 5.15 0.32 -0.05 -5.21 5.41 -1.26 -4.31 119.36 119.41 2zho n ILE 126 Ca -0.12 -0.06 -0.04 0.00 1.00 0.00 0.00 62.75 63.53 2zho n ILE 126 Cb 0.45 -2.04 -0.10 0.00 -0.71 0.00 0.00 39.64 37.24 2zho n ILE 126 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2zho n GLU 127 N 5.39 1.76 -3.96 0.38 1.02 -0.80 -5.02 120.64 119.41 2zho n GLU 127 Ca 0.18 -0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.20 2zho n GLU 127 Cb 0.36 -1.31 -0.12 0.00 -0.02 0.00 0.00 31.44 30.34 2zho n GLU 127 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2zho s MET 128 N -2.39 0.24 0.02 3.49 -1.94 -1.25 -5.00 119.30 112.46 2zho s MET 128 Ca -0.06 -0.45 0.03 0.00 -1.71 0.00 0.00 55.69 53.51 2zho s MET 128 Cb 0.04 0.06 -0.01 0.00 2.01 0.00 0.00 34.83 36.93 2zho s MET 128 CO 0.51 -0.03 -0.11 0.42 -0.01 0.00 0.00 175.02 175.80 2zho s ILE 129 N -1.05 0.83 -0.03 2.53 1.01 -1.26 -2.35 121.20 120.88 2zho s ILE 129 Ca -0.11 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.84 2zho s ILE 129 Cb -0.07 -0.75 0.03 0.00 0.01 0.00 0.00 42.46 41.68 2zho s ILE 129 CO -0.01 0.05 -0.00 0.00 0.00 0.00 0.00 174.94 174.98 2zho s ALA 130 N -0.60 0.39 -0.10 9.38 0.00 -0.85 -4.94 121.76 125.05 2zho s ALA 130 Ca 0.01 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.08 2zho s ALA 130 Cb -0.06 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.71 2zho s ALA 130 CO 0.00 -0.10 -0.08 0.95 0.00 0.00 0.00 175.76 176.53 2zho s THR 131 N 1.10 0.99 0.07 0.00 -4.23 -1.26 -1.41 115.64 110.91 2zho s THR 131 Ca -0.09 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 2zho s THR 131 Cb -0.14 -1.00 -0.00 0.00 1.34 0.00 0.00 72.50 72.71 2zho s THR 131 CO -0.02 0.35 0.00 -1.54 -0.54 0.00 0.00 174.62 172.88 2zho n SER 132 N 4.71 2.09 0.20 3.99 3.41 0.20 -4.96 113.62 123.25 2zho n SER 132 Ca -0.15 -1.33 0.09 0.00 -0.26 0.00 0.00 58.87 57.22 2zho n SER 132 Cb 0.50 0.06 0.15 0.00 -0.26 0.00 0.00 64.21 64.67 2zho n SER 132 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2zho h GLU 133 N 0.00 0.00 0.00 4.33 4.39 -1.96 -3.05 114.58 118.29 2zho h GLU 133 Ca -0.06 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.45 2zho h GLU 133 Cb 0.19 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 2zho h GLU 133 CO 0.10 0.17 -1.78 1.55 -1.16 0.00 0.00 179.01 177.89 2zho n VAL 134 N -3.15 0.70 -4.20 3.13 3.14 -1.26 -2.01 118.33 114.68 2zho n VAL 134 Ca 0.03 -0.47 -0.32 0.00 -2.96 0.00 0.00 64.34 60.61 2zho n VAL 134 Cb 0.58 -0.57 -0.16 0.00 -1.06 0.00 0.00 33.84 32.64 2zho n VAL 134 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 2zho s ARG 135 N -2.36 2.89 -0.31 1.45 6.06 -1.26 -3.19 118.95 122.23 2zho s ARG 135 Ca -0.06 -0.79 0.02 0.00 -2.50 0.00 0.00 55.73 52.40 2zho s ARG 135 Cb 0.04 -2.47 0.08 0.00 0.06 0.00 0.00 34.95 32.66 2zho s ARG 135 CO 0.49 -0.18 -0.01 0.42 -2.50 0.00 0.00 175.30 173.52 2zho s ILE 136 N 1.23 2.42 -0.07 4.11 1.01 -1.12 0.60 121.20 129.38 2zho s ILE 136 Ca 0.03 -1.90 0.02 0.00 0.00 0.00 0.00 60.65 58.80 2zho s ILE 136 Cb -0.13 -2.58 0.01 0.00 0.01 0.00 0.00 42.46 39.78 2zho s ILE 136 CO -0.11 -0.31 -0.12 -0.94 0.00 0.00 0.00 174.94 173.47 2zho s SER 137 N 1.11 1.86 0.06 3.58 1.04 -0.50 -1.34 113.70 119.51 2zho s SER 137 Ca 0.00 -0.30 0.05 0.00 0.48 0.00 0.00 55.95 56.18 2zho s SER 137 Cb -0.20 -0.84 -0.04 0.00 0.10 0.00 0.00 66.02 65.05 2zho s SER 137 CO -0.05 0.01 -0.06 0.68 0.98 0.00 0.00 173.24 174.80 2zho s VAL 138 N 0.83 3.66 0.08 5.02 -7.23 0.14 -2.01 120.40 120.90 2zho s VAL 138 Ca -0.11 -0.98 0.03 0.00 -1.81 0.00 0.00 61.98 59.11 2zho s VAL 138 Cb -0.15 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 2zho s VAL 138 CO 0.02 0.24 0.10 0.27 -0.31 0.00 0.00 175.10 175.41 2zho s ILE 139 N -1.14 4.62 0.05 -0.62 -5.25 -0.99 0.34 121.20 118.19 2zho s ILE 139 Ca 0.21 -0.75 -0.16 0.00 -0.99 0.00 0.00 60.65 58.96 2zho s ILE 139 Cb -0.11 -3.24 0.03 0.00 2.95 0.00 0.00 42.46 42.09 2zho s ILE 139 CO 0.12 0.11 0.37 0.27 -1.79 0.00 0.00 174.94 174.03 2zho s ILE 140 N -1.42 0.07 -0.01 8.37 -5.25 -0.47 -1.91 121.20 120.58 2zho s ILE 140 Ca 0.30 -0.54 -0.33 0.00 -0.99 0.00 0.00 60.65 59.08 2zho s ILE 140 Cb -0.12 -0.95 -0.12 0.00 2.95 0.00 0.00 42.46 44.22 2zho s ILE 140 CO 0.23 -0.30 1.84 -0.81 -1.79 0.00 0.00 174.94 174.11 2zho n PRO 141 N 0.51 2.34 -0.30 0.37 -0.04 -1.26 -0.90 135.00 135.72 2zho n PRO 141 Ca -0.18 0.86 0.04 0.00 -0.04 0.00 0.00 63.50 64.17 2zho n PRO 141 Cb 0.60 -2.71 0.10 0.00 -0.04 0.00 0.00 33.50 31.44 2zho n PRO 141 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2zho n ALA 142 N 6.13 0.13 -0.28 0.55 0.00 -0.89 -2.07 120.51 124.08 2zho n ALA 142 Ca 0.21 0.90 0.02 0.00 0.00 0.00 0.00 53.44 54.56 2zho n ALA 142 Cb 0.32 -0.51 0.07 0.00 0.00 0.00 0.00 19.45 19.33 2zho n ALA 142 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2zho n GLU 143 N -5.33 -0.12 0.00 0.00 0.00 -1.26 0.13 120.64 114.07 2zho n GLU 143 Ca 0.12 1.17 0.03 0.00 0.00 0.00 0.00 57.16 58.49 2zho n GLU 143 Cb 0.40 -1.74 0.20 0.00 0.00 0.00 0.00 31.44 30.30 2zho n GLU 143 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2zho n TYR 144 N -5.17 0.00 0.00 -1.84 4.01 -0.88 -4.35 117.16 108.93 2zho n TYR 144 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 2zho n TYR 144 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 2zho n TYR 144 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2zho n ALA 145 N -0.71 -0.16 -0.27 -0.72 0.00 0.35 -0.79 120.51 118.22 2zho n ALA 145 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.51 2zho n ALA 145 Cb 0.02 0.25 0.15 0.00 0.00 0.00 0.00 19.45 19.88 2zho n ALA 145 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2zho h GLU 146 N 0.00 0.65 0.00 0.00 4.39 -1.82 -2.07 114.58 115.73 2zho h GLU 146 Ca 0.00 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.57 2zho h GLU 146 Cb 0.00 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 2zho h GLU 146 CO 0.00 0.43 -0.42 0.00 -1.16 0.00 0.00 179.01 177.86 2zho h ALA 147 N 1.45 1.11 0.38 3.43 0.00 -1.83 -1.28 119.26 122.52 2zho h ALA 147 Ca 0.38 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2zho h ALA 147 Cb 0.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2zho h ALA 147 CO -0.27 0.53 -0.18 0.00 0.00 0.00 0.00 179.25 179.33 2zho h ALA 148 N 1.58 -0.51 -0.63 0.00 0.00 -0.33 -2.40 119.26 116.97 2zho h ALA 148 Ca -0.00 -0.14 0.18 0.00 0.00 0.00 0.00 54.91 54.95 2zho h ALA 148 Cb 0.85 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2zho h ALA 148 CO 0.05 -0.49 0.45 1.25 0.00 0.00 0.00 179.25 180.52 2zho h LEU 149 N -1.10 0.03 -0.32 0.00 6.46 -1.41 0.20 115.31 119.16 2zho h LEU 149 Ca -0.05 0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 57.55 2zho h LEU 149 Cb 0.44 -0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.36 2zho h LEU 149 CO 0.08 0.01 -0.41 0.03 -0.62 0.00 0.00 178.44 177.53 2zho h ARG 150 N 0.03 0.85 -0.03 1.25 3.08 -1.28 -2.80 114.38 115.48 2zho h ARG 150 Ca 0.30 -0.48 -0.16 0.00 0.07 0.00 0.00 59.98 59.70 2zho h ARG 150 Cb 1.17 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 2zho h ARG 150 CO -0.01 1.12 -0.71 0.00 -1.07 0.00 0.00 179.97 179.30 2zho h ALA 151 N 0.72 0.73 0.73 0.04 0.00 -0.30 -2.85 119.26 118.33 2zho h ALA 151 Ca 0.04 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 2zho h ALA 151 Cb 1.01 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.72 2zho h ALA 151 CO 0.10 0.82 -0.35 0.28 0.00 0.00 0.00 179.25 180.09 2zho h VAL 152 N 0.12 0.00 -0.87 0.00 2.07 -0.81 -2.89 116.25 113.87 2zho h VAL 152 Ca -0.02 -0.06 0.15 0.00 0.82 0.00 0.00 66.70 67.60 2zho h VAL 152 Cb 1.27 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.89 2zho h VAL 152 CO 0.11 0.00 -0.29 1.57 0.02 0.00 0.00 177.57 178.98 2zho n HIS 153 N -4.81 0.15 1.00 1.57 -0.00 -1.06 0.22 115.22 112.30 2zho n HIS 153 Ca -0.12 1.07 0.10 0.00 0.46 0.00 0.00 57.72 59.23 2zho n HIS 153 Cb 0.39 -0.90 0.53 0.00 -0.12 0.00 0.00 29.99 29.89 2zho n HIS 153 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2zho n GLN 154 N -5.34 0.31 0.00 1.57 3.00 -1.08 -1.91 117.38 113.93 2zho n GLN 154 Ca 0.11 0.08 0.09 0.00 -0.01 0.00 0.00 57.00 57.27 2zho n GLN 154 Cb 0.39 -1.50 0.01 0.00 0.00 0.00 0.00 30.24 29.14 2zho n GLN 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2zho n ALA 155 N -1.28 3.16 -0.01 -1.58 0.00 0.13 -4.63 120.51 116.29 2zho n ALA 155 Ca 0.10 -0.58 -0.02 0.00 0.00 0.00 0.00 53.44 52.94 2zho n ALA 155 Cb 0.17 -0.63 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 2zho n ALA 155 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2zho n PHE 156 N 0.10 0.00 1.75 0.00 3.01 -0.97 -5.04 117.46 116.31 2zho n PHE 156 Ca 0.08 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.69 2zho n PHE 156 Cb 0.39 -0.12 0.73 0.00 -0.01 0.00 0.00 39.48 40.48 2zho n PHE 156 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16