#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zga s GLN 2 N 0.00 3.77 -0.15 0.54 0.74 -1.26 -5.09 119.66 118.21 2zga s GLN 2 Ca 0.00 -0.12 -0.00 0.00 0.05 0.00 0.00 55.36 55.29 2zga s GLN 2 Cb 0.00 -3.28 0.03 0.00 1.10 0.00 0.00 33.01 30.86 2zga s GLN 2 CO 0.00 0.58 -0.08 0.42 -0.55 0.00 0.00 175.29 175.66 2zga s ILE 3 N -0.47 1.22 0.81 -2.34 1.01 -1.26 -5.13 121.20 115.05 2zga s ILE 3 Ca 0.13 -0.57 -0.11 0.00 0.00 0.00 0.00 60.65 60.10 2zga s ILE 3 Cb -0.12 -1.29 0.10 0.00 0.01 0.00 0.00 42.46 41.16 2zga s ILE 3 CO 0.02 0.26 1.17 0.42 0.00 0.00 0.00 174.94 176.81 2zga s THR 4 N 1.61 2.06 -0.15 2.92 -4.23 -1.26 -5.02 115.64 111.57 2zga s THR 4 Ca 0.02 -0.08 0.17 0.00 -1.18 0.00 0.00 61.69 60.62 2zga s THR 4 Cb -0.14 -2.99 0.33 0.00 1.34 0.00 0.00 72.50 71.04 2zga s THR 4 CO -0.08 0.00 1.18 0.18 -0.54 0.00 0.00 174.62 175.35 2zga n LEU 5 N -3.30 2.48 0.26 4.79 4.77 -1.26 -4.53 117.00 120.21 2zga n LEU 5 Ca 0.10 -3.33 0.12 0.00 -0.03 0.00 0.00 56.01 52.87 2zga n LEU 5 Cb 0.61 -0.46 0.67 0.00 -2.33 0.00 0.00 43.42 41.91 2zga n LEU 5 CO 0.53 0.91 0.94 -0.50 -1.33 0.00 0.00 177.39 177.94 2zga h TRP 6 N 0.31 0.00 -1.95 -1.77 4.06 -2.07 -3.43 115.95 111.11 2zga h TRP 6 Ca 0.00 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.34 2zga h TRP 6 Cb 1.01 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 29.04 2zga h TRP 6 CO 0.23 0.14 -0.68 -0.65 -3.56 0.00 0.00 178.44 173.92 2zga s GLN 7 N -4.04 1.85 0.36 0.49 -1.52 -1.26 -5.11 119.66 110.43 2zga s GLN 7 Ca -0.02 -1.90 -0.28 0.00 -1.95 0.00 0.00 55.36 51.21 2zga s GLN 7 Cb 0.12 -1.74 -0.11 0.00 -0.22 0.00 0.00 33.01 31.06 2zga s GLN 7 CO 0.59 0.15 1.51 0.54 -0.25 0.00 0.00 175.29 177.83 2zga n ARG 8 N -0.81 2.68 -2.15 2.91 1.74 -1.26 -4.87 116.66 114.90 2zga n ARG 8 Ca -0.05 0.94 -0.43 0.00 -0.77 0.00 0.00 57.85 57.55 2zga n ARG 8 Cb 0.63 -2.68 0.00 0.00 -1.02 0.00 0.00 32.46 29.39 2zga n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2zga n PRO 9 N 0.72 3.08 -3.31 5.56 -0.04 -1.26 -4.94 135.00 134.81 2zga n PRO 9 Ca 0.02 -3.00 -0.38 0.00 -0.04 0.00 0.00 63.50 60.11 2zga n PRO 9 Cb 0.38 -3.31 -0.06 0.00 -0.04 0.00 0.00 33.50 30.47 2zga n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2zga s LEU 10 N 2.63 4.26 0.19 1.53 1.43 -1.26 -0.67 118.68 126.80 2zga s LEU 10 Ca 0.48 0.80 0.08 0.00 -1.03 0.00 0.00 54.13 54.46 2zga s LEU 10 Cb 0.09 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.57 2zga s LEU 10 CO -0.02 -0.02 -0.15 0.68 0.23 0.00 0.00 176.35 177.07 2zga s VAL 11 N 0.74 1.72 0.17 -1.59 -7.23 0.12 -4.93 120.40 109.41 2zga s VAL 11 Ca 0.26 -2.10 -0.24 0.00 -1.81 0.00 0.00 61.98 58.09 2zga s VAL 11 Cb -0.15 -1.95 -0.08 0.00 0.56 0.00 0.00 36.38 34.76 2zga s VAL 11 CO 0.10 -0.52 0.76 0.42 -0.31 0.00 0.00 175.10 175.55 2zga s THR 12 N -2.68 4.42 0.13 5.32 -4.23 -1.26 -0.74 115.64 116.59 2zga s THR 12 Ca 0.20 1.62 0.06 0.00 -1.18 0.00 0.00 61.69 62.38 2zga s THR 12 Cb -0.02 -4.08 -0.04 0.00 1.34 0.00 0.00 72.50 69.70 2zga s THR 12 CO 0.06 0.48 -0.13 0.27 -0.54 0.00 0.00 174.62 174.77 2zga s ILE 13 N -1.20 1.29 -0.12 2.99 -4.36 0.84 -0.76 121.20 119.87 2zga s ILE 13 Ca 0.36 -1.81 0.01 0.00 -0.26 0.00 0.00 60.65 58.96 2zga s ILE 13 Cb -0.22 -1.61 0.02 0.00 1.25 0.00 0.00 42.46 41.90 2zga s ILE 13 CO 0.25 -0.51 -0.15 -0.75 0.24 0.00 0.00 174.94 174.02 2zga s LYS 14 N -2.95 2.29 -0.12 0.37 2.20 -0.11 -1.49 119.74 119.92 2zga s LYS 14 Ca 0.11 -0.58 -0.10 0.00 -0.36 0.00 0.00 55.97 55.04 2zga s LYS 14 Cb -0.03 -1.97 0.03 0.00 -1.51 0.00 0.00 37.83 34.35 2zga s LYS 14 CO 0.03 -0.10 0.31 -1.50 -0.36 0.00 0.00 175.35 173.72 2zga s ILE 15 N 1.10 -0.01 -1.41 5.43 2.07 -0.43 -0.50 121.20 127.45 2zga s ILE 15 Ca -0.04 0.03 -0.04 0.00 -1.41 0.00 0.00 60.65 59.18 2zga s ILE 15 Cb -0.14 -0.44 0.02 0.00 0.13 0.00 0.00 42.46 42.03 2zga s ILE 15 CO -0.04 0.01 0.37 0.61 -1.91 0.00 0.00 174.94 173.99 2zga n GLY 16 N 3.19 -0.50 2.32 1.50 0.00 -1.26 -1.22 105.19 109.22 2zga n GLY 16 Ca -0.15 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2zga n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zga n GLY 17 N -1.21 0.37 3.38 -0.02 0.00 -1.26 -4.96 105.19 101.49 2zga n GLY 17 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 2zga n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2zga s GLN 18 N -0.55 1.70 -0.12 1.61 -0.21 -0.36 -5.13 119.66 116.60 2zga s GLN 18 Ca 0.00 -1.18 -0.18 0.00 0.02 0.00 0.00 55.36 54.02 2zga s GLN 18 Cb 0.00 -1.98 -0.04 0.00 1.00 0.00 0.00 33.01 31.98 2zga s GLN 18 CO 0.00 0.49 0.49 -0.51 -2.12 0.00 0.00 175.29 173.64 2zga s LEU 19 N -1.59 4.27 0.15 2.90 1.02 -1.26 -1.31 118.68 122.85 2zga s LEU 19 Ca 0.13 0.81 -0.05 0.00 0.02 0.00 0.00 54.13 55.05 2zga s LEU 19 Cb -0.10 -2.70 -0.02 0.00 0.02 0.00 0.00 46.19 43.38 2zga s LEU 19 CO 0.04 -0.02 0.17 -0.54 0.02 0.00 0.00 176.35 176.02 2zga s LYS 20 N 0.71 1.05 -0.05 1.70 1.02 -0.56 -5.00 119.74 118.60 2zga s LYS 20 Ca 0.26 -1.32 -0.02 0.00 0.02 0.00 0.00 55.97 54.92 2zga s LYS 20 Cb -0.15 0.31 -0.04 0.00 -0.52 0.00 0.00 37.83 37.43 2zga s LYS 20 CO 0.10 -0.34 0.04 -2.00 -0.92 0.00 0.00 175.35 172.23 2zga s GLU 21 N -4.01 3.04 0.07 1.68 2.12 -1.26 -0.11 118.70 120.23 2zga s GLU 21 Ca 0.21 -0.42 -0.10 0.00 0.36 0.00 0.00 54.97 55.02 2zga s GLU 21 Cb 0.05 -2.85 0.01 0.00 0.26 0.00 0.00 34.13 31.60 2zga s GLU 21 CO 0.01 0.69 0.23 0.00 -0.54 0.00 0.00 175.26 175.65 2zga s ALA 22 N -1.02 -0.40 -0.23 6.30 0.00 0.08 -4.55 121.76 121.94 2zga s ALA 22 Ca 0.17 -0.37 -0.12 0.00 0.00 0.00 0.00 51.96 51.64 2zga s ALA 22 Cb -0.12 0.41 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 2zga s ALA 22 CO 0.07 -0.46 0.24 -1.17 0.00 0.00 0.00 175.76 174.44 2zga s LEU 23 N -2.50 4.13 -0.29 0.00 2.96 0.01 -0.70 118.68 122.28 2zga s LEU 23 Ca 0.00 0.24 -0.29 0.00 -0.22 0.00 0.00 54.13 53.86 2zga s LEU 23 Cb 0.02 -2.23 -0.00 0.00 0.50 0.00 0.00 46.19 44.47 2zga s LEU 23 CO -0.08 0.02 1.40 -0.76 -1.32 0.00 0.00 176.35 175.61 2zga s LEU 24 N 1.15 3.85 -0.39 -0.68 1.43 0.16 -1.42 118.68 122.78 2zga s LEU 24 Ca 0.11 1.26 0.03 0.00 -1.03 0.00 0.00 54.13 54.50 2zga s LEU 24 Cb -0.14 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.66 2zga s LEU 24 CO 0.06 -1.17 0.14 -0.62 0.23 0.00 0.00 176.35 174.98 2zga s ASP 25 N 3.31 4.32 0.05 2.29 -1.08 -0.61 -4.79 116.67 120.16 2zga s ASP 25 Ca 0.61 -2.29 0.18 0.00 -0.52 0.00 0.00 52.55 50.53 2zga s ASP 25 Cb -0.18 -1.36 0.77 0.00 -1.46 0.00 0.00 42.92 40.69 2zga s ASP 25 CO 0.26 -0.34 1.58 0.35 0.52 0.00 0.00 175.17 177.54 2zga n THR 26 N 4.03 0.81 1.34 1.71 -2.24 -1.26 -2.32 114.28 116.36 2zga n THR 26 Ca 0.04 0.19 0.13 0.00 -2.27 0.00 0.00 64.05 62.14 2zga n THR 26 Cb 0.39 -0.94 0.43 0.00 -2.10 0.00 0.00 70.33 68.11 2zga n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2zga n GLY 27 N 0.27 0.24 3.45 3.38 0.00 -1.26 -4.81 105.19 106.45 2zga n GLY 27 Ca 0.04 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 2zga n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zga s ALA 28 N -1.94 2.98 0.19 4.61 0.00 -0.98 -4.99 121.76 121.63 2zga s ALA 28 Ca 0.36 -0.95 -0.05 0.00 0.00 0.00 0.00 51.96 51.31 2zga s ALA 28 Cb 0.20 -1.67 0.13 0.00 0.00 0.00 0.00 23.12 21.77 2zga s ALA 28 CO 0.32 -0.05 1.57 -0.44 0.00 0.00 0.00 175.76 177.16 2zga h ASP 29 N 7.27 0.78 -1.78 0.00 3.32 -1.87 0.68 116.42 124.83 2zga h ASP 29 Ca -0.34 -0.33 -0.60 0.00 0.02 0.00 0.00 57.03 55.78 2zga h ASP 29 Cb 1.18 -0.22 -0.11 0.00 0.22 0.00 0.00 39.33 40.40 2zga h ASP 29 CO 0.61 1.05 -0.59 -1.81 -1.72 0.00 0.00 179.24 176.78 2zga s ASP 30 N -6.82 4.11 -0.20 6.45 1.01 -1.26 -2.07 116.67 117.89 2zga s ASP 30 Ca -0.09 -1.13 -0.06 0.00 0.71 0.00 0.00 52.55 51.98 2zga s ASP 30 Cb 0.12 -0.46 -0.03 0.00 1.01 0.00 0.00 42.92 43.56 2zga s ASP 30 CO 0.85 -0.36 0.03 -0.89 0.21 0.00 0.00 175.17 175.00 2zga s THR 31 N -2.60 4.28 -0.08 -1.27 2.01 -1.26 -3.08 115.64 113.64 2zga s THR 31 Ca 0.36 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.16 2zga s THR 31 Cb 0.04 -2.93 0.02 0.00 0.01 0.00 0.00 72.50 69.64 2zga s THR 31 CO 0.19 0.43 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.80 2zga s VAL 32 N 0.81 0.81 0.03 3.82 1.01 -0.28 -0.68 120.40 125.92 2zga s VAL 32 Ca 0.02 -0.20 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2zga s VAL 32 Cb -0.14 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 2zga s VAL 32 CO 0.02 0.32 -0.24 -0.76 0.00 0.00 0.00 175.10 174.44 2zga s LEU 33 N 1.43 2.13 0.95 3.92 1.43 -0.34 0.37 118.68 128.57 2zga s LEU 33 Ca -0.01 -0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 52.45 2zga s LEU 33 Cb -0.13 -1.17 0.09 0.00 0.03 0.00 0.00 46.19 45.00 2zga s LEU 33 CO -0.04 0.24 0.71 -1.84 0.23 0.00 0.00 176.35 175.64 2zga n GLU 34 N 2.00 -0.42 -1.61 1.70 -0.00 -1.25 -1.17 120.64 119.90 2zga n GLU 34 Ca -0.17 -0.07 -0.47 0.00 -0.00 0.00 0.00 57.16 56.45 2zga n GLU 34 Cb 0.52 -2.07 -0.03 0.00 -0.00 0.00 0.00 31.44 29.86 2zga n GLU 34 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2zga n GLU 35 N -2.79 1.43 -3.62 3.44 4.07 -1.22 -4.53 120.64 117.42 2zga n GLU 35 Ca 0.09 0.51 -0.08 0.00 -0.06 0.00 0.00 57.16 57.61 2zga n GLU 35 Cb 0.53 -2.03 -0.02 0.00 -0.06 0.00 0.00 31.44 29.86 2zga n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2zga s MET 36 N -0.55 1.33 -0.33 5.31 0.23 -1.26 -5.04 119.30 118.98 2zga s MET 36 Ca 0.70 -0.62 -0.19 0.00 -1.03 0.00 0.00 55.69 54.55 2zga s MET 36 Cb -0.78 0.53 -0.01 0.00 -1.53 0.00 0.00 34.83 33.04 2zga s MET 36 CO 0.53 -0.59 0.57 0.45 -2.03 0.00 0.00 175.02 173.94 2zga s SER 37 N -2.78 6.39 -0.03 -1.18 0.15 -1.26 -5.03 113.70 109.95 2zga s SER 37 Ca 0.06 0.16 0.05 0.00 0.70 0.00 0.00 55.95 56.92 2zga s SER 37 Cb -0.02 -2.30 -0.01 0.00 -1.71 0.00 0.00 66.02 61.98 2zga s SER 37 CO -0.04 -0.49 -0.18 -0.76 1.20 0.00 0.00 173.24 172.97 2zga s LEU 38 N 2.51 1.96 0.47 3.45 1.43 -1.26 -4.88 118.68 122.36 2zga s LEU 38 Ca 0.22 -0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 52.76 2zga s LEU 38 Cb -0.15 -0.98 -0.09 0.00 0.03 0.00 0.00 46.19 45.00 2zga s LEU 38 CO 0.13 0.18 1.02 -2.16 0.23 0.00 0.00 176.35 175.75 2zga s PRO 39 N -0.13 3.90 0.00 1.29 0.04 -1.26 -4.95 135.00 133.89 2zga s PRO 39 Ca 0.00 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.36 2zga s PRO 39 Cb -0.10 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2zga s PRO 39 CO 0.01 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.12 2zga n GLY 40 N -0.30 -2.35 3.77 0.56 0.00 -1.26 -5.00 105.19 100.62 2zga n GLY 40 Ca 0.09 -2.12 -0.39 0.00 0.00 0.00 0.00 46.02 43.60 2zga n GLY 40 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2zga s ARG 41 N -0.41 4.29 0.14 1.61 1.04 -1.26 -5.06 118.95 119.29 2zga s ARG 41 Ca 0.00 1.85 -0.07 0.00 -1.04 0.00 0.00 55.73 56.47 2zga s ARG 41 Cb 0.00 -2.88 -0.01 0.00 -2.04 0.00 0.00 34.95 30.02 2zga s ARG 41 CO 0.00 -0.12 0.22 1.67 -0.04 0.00 0.00 175.30 177.03 2zga s TRP 42 N -1.32 0.42 -0.06 5.89 1.48 -1.26 -4.52 118.94 119.57 2zga s TRP 42 Ca 0.52 -0.81 0.04 0.00 -1.06 0.00 0.00 56.10 54.79 2zga s TRP 42 Cb -0.31 -0.13 0.00 0.00 -1.16 0.00 0.00 33.47 31.86 2zga s TRP 42 CO 0.40 -0.64 -0.16 0.15 -4.06 0.00 0.00 176.95 172.64 2zga s LYS 43 N -3.96 1.86 0.32 3.25 1.02 -0.83 -4.89 119.74 116.52 2zga s LYS 43 Ca 0.15 -0.57 -0.29 0.00 0.02 0.00 0.00 55.97 55.29 2zga s LYS 43 Cb 0.04 -1.56 -0.10 0.00 -0.52 0.00 0.00 37.83 35.69 2zga s LYS 43 CO -0.02 0.17 1.26 -2.14 -0.92 0.00 0.00 175.35 173.70 2zga s PRO 44 N 0.27 4.41 -0.05 -1.68 0.02 -1.26 0.27 135.00 136.97 2zga s PRO 44 Ca -0.09 2.13 -0.21 0.00 0.02 0.00 0.00 61.00 62.85 2zga s PRO 44 Cb -0.13 -3.09 0.04 0.00 0.02 0.00 0.00 34.50 31.34 2zga s PRO 44 CO 0.03 -0.11 0.47 0.21 -0.33 0.00 0.00 177.00 177.28 2zga s LYS 45 N -1.73 0.80 -0.15 5.54 2.20 -0.06 -4.88 119.74 121.46 2zga s LYS 45 Ca 0.48 0.11 0.01 0.00 -0.36 0.00 0.00 55.97 56.21 2zga s LYS 45 Cb -0.38 0.37 0.01 0.00 -1.51 0.00 0.00 37.83 36.31 2zga s LYS 45 CO 0.50 -0.22 -0.18 -1.64 -0.36 0.00 0.00 175.35 173.45 2zga s MET 46 N -1.04 3.11 0.04 4.03 -1.94 -1.26 0.20 119.30 122.45 2zga s MET 46 Ca -0.11 -0.80 0.09 0.00 -1.71 0.00 0.00 55.69 53.16 2zga s MET 46 Cb -0.03 -2.56 -0.03 0.00 2.01 0.00 0.00 34.83 34.22 2zga s MET 46 CO 0.06 -0.03 -0.25 0.96 -0.01 0.00 0.00 175.02 175.74 2zga s ILE 47 N 0.90 2.23 0.39 2.53 -4.36 -0.17 -4.95 121.20 117.78 2zga s ILE 47 Ca -0.04 -1.33 0.08 0.00 -0.26 0.00 0.00 60.65 59.10 2zga s ILE 47 Cb -0.15 -1.87 -0.07 0.00 1.25 0.00 0.00 42.46 41.62 2zga s ILE 47 CO -0.03 0.39 -0.02 -0.83 0.24 0.00 0.00 174.94 174.69 2zga s GLY 48 N -1.20 2.39 0.00 6.27 0.00 -1.26 -0.04 107.32 113.48 2zga s GLY 48 Ca 0.12 -2.22 0.00 0.00 0.00 0.00 0.00 44.72 42.62 2zga s GLY 48 CO 0.02 -2.07 0.00 0.61 0.00 0.00 0.00 173.10 171.67 2zga n GLY 49 N -0.92 1.09 3.54 0.20 0.00 -0.83 -5.00 105.19 103.27 2zga n GLY 49 Ca -0.05 -0.73 -0.51 0.00 0.00 0.00 0.00 46.02 44.73 2zga n GLY 49 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2zga n ILE 50 N 0.00 0.88 0.00 -0.61 5.41 -1.26 -2.22 119.36 121.56 2zga n ILE 50 Ca 0.00 -0.22 0.00 0.00 1.00 0.00 0.00 62.75 63.53 2zga n ILE 50 Cb 0.00 -0.56 0.00 0.00 -0.71 0.00 0.00 39.64 38.37 2zga n ILE 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2zga n GLY 51 N 1.92 3.24 0.00 7.39 0.00 -1.26 -4.92 105.19 111.56 2zga n GLY 51 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2zga n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zga n GLY 52 N -1.00 0.69 3.25 -0.02 0.00 -0.94 -5.12 105.19 102.04 2zga n GLY 52 Ca 0.00 -1.56 -0.15 0.00 0.00 0.00 0.00 46.02 44.31 2zga n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2zga s PHE 53 N -4.00 1.31 0.19 1.61 0.08 -1.26 -1.96 117.98 113.95 2zga s PHE 53 Ca 0.00 -0.71 0.11 0.00 0.12 0.00 0.00 56.93 56.45 2zga s PHE 53 Cb 0.00 -0.66 -0.04 0.00 -0.57 0.00 0.00 43.02 41.74 2zga s PHE 53 CO 0.00 0.11 -0.22 0.96 -0.10 0.00 0.00 175.22 175.97 2zga s ILE 54 N -3.11 2.22 -0.01 0.64 -4.36 0.94 -4.96 121.20 112.56 2zga s ILE 54 Ca 0.16 -2.01 -0.23 0.00 -0.26 0.00 0.00 60.65 58.30 2zga s ILE 54 Cb 0.01 -2.06 -0.05 0.00 1.25 0.00 0.00 42.46 41.62 2zga s ILE 54 CO 0.01 -0.17 0.68 -1.59 0.24 0.00 0.00 174.94 174.11 2zga s LYS 55 N -2.72 4.42 0.33 0.37 0.00 -1.26 -1.00 119.74 119.88 2zga s LYS 55 Ca 0.20 0.88 0.08 0.00 0.00 0.00 0.00 55.97 57.13 2zga s LYS 55 Cb -0.07 -3.39 -0.06 0.00 0.00 0.00 0.00 37.83 34.30 2zga s LYS 55 CO 0.09 0.23 -0.07 0.14 0.00 0.00 0.00 175.35 175.74 2zga s VAL 56 N 0.23 1.99 -0.20 1.79 -7.23 0.54 -4.44 120.40 113.09 2zga s VAL 56 Ca 0.36 -2.16 -0.06 0.00 -1.81 0.00 0.00 61.98 58.31 2zga s VAL 56 Cb -0.19 -2.61 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 2zga s VAL 56 CO 0.19 -0.21 0.02 -0.13 -0.31 0.00 0.00 175.10 174.66 2zga s ARG 57 N -3.67 3.70 -0.39 4.82 0.52 -0.03 -0.88 118.95 123.03 2zga s ARG 57 Ca 0.32 -0.48 -0.17 0.00 -0.52 0.00 0.00 55.73 54.88 2zga s ARG 57 Cb 0.04 -3.12 0.01 0.00 0.52 0.00 0.00 34.95 32.39 2zga s ARG 57 CO 0.15 0.06 0.43 -1.14 0.02 0.00 0.00 175.30 174.82 2zga s GLN 58 N 0.89 3.28 -0.15 3.54 0.74 0.14 -0.71 119.66 127.39 2zga s GLN 58 Ca 0.02 -0.60 -0.03 0.00 0.05 0.00 0.00 55.36 54.80 2zga s GLN 58 Cb -0.14 -3.91 -0.03 0.00 1.10 0.00 0.00 33.01 30.04 2zga s GLN 58 CO 0.02 -0.74 -0.05 0.71 -0.55 0.00 0.00 175.29 174.68 2zga s TYR 59 N 2.14 2.99 0.32 1.67 1.51 -0.57 -1.96 117.35 123.45 2zga s TYR 59 Ca 0.13 -0.35 0.07 0.00 -1.01 0.00 0.00 57.07 55.91 2zga s TYR 59 Cb -0.17 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.72 2zga s TYR 59 CO 0.13 -0.06 0.27 -0.51 -1.11 0.00 0.00 175.55 174.27 2zga s ASP 60 N 0.34 5.29 -1.35 2.29 1.01 -1.26 -0.72 116.67 122.27 2zga s ASP 60 Ca -0.05 -0.47 -0.06 0.00 0.71 0.00 0.00 52.55 52.67 2zga s ASP 60 Cb -0.14 -1.03 0.00 0.00 1.01 0.00 0.00 42.92 42.76 2zga s ASP 60 CO 0.03 -0.29 0.48 0.00 0.21 0.00 0.00 175.17 175.60 2zga n GLN 61 N -1.32 -2.53 -3.72 8.23 3.00 -1.22 -4.92 117.38 114.89 2zga n GLN 61 Ca -0.03 0.37 -0.36 0.00 -0.01 0.00 0.00 57.00 56.97 2zga n GLN 61 Cb 0.59 -4.25 -0.07 0.00 0.00 0.00 0.00 30.24 26.51 2zga n GLN 61 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2zga s ILE 62 N -3.87 5.40 0.06 5.09 -1.09 0.10 -4.76 121.20 122.13 2zga s ILE 62 Ca 0.12 0.27 -0.30 0.00 -2.23 0.00 0.00 60.65 58.52 2zga s ILE 62 Cb -0.05 -3.49 -0.04 0.00 -1.58 0.00 0.00 42.46 37.30 2zga s ILE 62 CO 0.90 0.48 0.97 -0.22 -1.23 0.00 0.00 174.94 175.84 2zga s LEU 63 N 0.03 4.44 -0.01 2.97 2.96 -1.26 -1.56 118.68 126.24 2zga s LEU 63 Ca 0.11 1.73 0.01 0.00 -0.22 0.00 0.00 54.13 55.77 2zga s LEU 63 Cb -0.12 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.99 2zga s LEU 63 CO 0.01 -0.17 -0.05 -0.51 -1.32 0.00 0.00 176.35 174.31 2zga s ILE 64 N 0.50 0.41 -0.24 6.68 2.07 0.31 -4.41 121.20 126.52 2zga s ILE 64 Ca 0.50 -0.19 -0.06 0.00 -1.41 0.00 0.00 60.65 59.48 2zga s ILE 64 Cb -0.22 -0.37 -0.02 0.00 0.13 0.00 0.00 42.46 41.98 2zga s ILE 64 CO 0.29 0.13 0.04 -0.70 -1.91 0.00 0.00 174.94 172.79 2zga s GLU 65 N 0.07 3.57 -0.25 3.50 2.12 0.35 -1.03 118.70 127.03 2zga s GLU 65 Ca -0.00 -0.52 -0.06 0.00 0.36 0.00 0.00 54.97 54.75 2zga s GLU 65 Cb -0.04 -3.25 -0.01 0.00 0.26 0.00 0.00 34.13 31.09 2zga s GLU 65 CO -0.00 -0.20 0.03 0.42 -0.54 0.00 0.00 175.26 174.96 2zga s ILE 66 N 1.58 3.85 -0.74 -3.70 1.01 0.11 -0.94 121.20 122.36 2zga s ILE 66 Ca 0.06 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.24 2zga s ILE 66 Cb -0.15 -2.82 0.06 0.00 0.01 0.00 0.00 42.46 39.56 2zga s ILE 66 CO 0.02 0.32 0.20 0.00 0.00 0.00 0.00 174.94 175.48 2zga n GLY 68 N -0.77 0.38 3.71 0.00 0.00 -1.26 -5.05 105.19 102.20 2zga n GLY 68 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2zga n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2zga s HIS 69 N -2.13 3.41 0.23 1.61 4.02 0.22 -5.07 115.29 117.57 2zga s HIS 69 Ca 0.00 0.42 -0.24 0.00 1.02 0.00 0.00 55.06 56.26 2zga s HIS 69 Cb 0.00 -2.26 -0.09 0.00 -1.02 0.00 0.00 32.58 29.21 2zga s HIS 69 CO 0.00 0.21 0.82 0.15 1.02 0.00 0.00 174.74 176.94 2zga s LYS 70 N 0.58 4.50 0.05 1.40 1.02 -1.26 0.04 119.74 126.07 2zga s LYS 70 Ca 0.11 1.14 -0.08 0.00 0.02 0.00 0.00 55.97 57.16 2zga s LYS 70 Cb -0.12 -3.03 -0.00 0.00 -0.52 0.00 0.00 37.83 34.15 2zga s LYS 70 CO 0.02 0.44 0.17 0.00 -0.92 0.00 0.00 175.35 175.06 2zga s ALA 71 N -1.38 -0.24 -0.03 5.17 0.00 -0.20 -4.81 121.76 120.28 2zga s ALA 71 Ca 0.42 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.95 2zga s ALA 71 Cb -0.20 0.34 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 2zga s ALA 71 CO 0.25 -0.40 -0.12 0.42 0.00 0.00 0.00 175.76 175.90 2zga s ILE 72 N -3.03 1.00 -1.42 0.00 1.01 -1.26 -0.53 121.20 116.98 2zga s ILE 72 Ca -0.01 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.14 2zga s ILE 72 Cb 0.01 -0.87 0.00 0.00 0.01 0.00 0.00 42.46 41.62 2zga s ILE 72 CO -0.06 0.30 0.00 0.61 0.00 0.00 0.00 174.94 175.78 2zga n GLY 73 N 3.11 -1.27 3.74 6.18 0.00 -0.60 -4.87 105.19 111.49 2zga n GLY 73 Ca -0.17 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 2zga n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zga s THR 74 N -3.00 3.95 -0.07 2.61 2.01 -1.26 -0.72 115.64 119.16 2zga s THR 74 Ca 0.00 1.78 0.00 0.00 0.31 0.00 0.00 61.69 63.78 2zga s THR 74 Cb 0.00 -4.13 0.02 0.00 0.01 0.00 0.00 72.50 68.40 2zga s THR 74 CO 0.00 0.35 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.53 2zga s VAL 75 N -0.57 0.76 0.09 3.82 1.01 0.10 -4.50 120.40 121.11 2zga s VAL 75 Ca 0.46 -0.19 -0.15 0.00 0.00 0.00 0.00 61.98 62.10 2zga s VAL 75 Cb -0.28 -0.78 -0.06 0.00 0.00 0.00 0.00 36.38 35.25 2zga s VAL 75 CO 0.34 0.30 0.51 -0.76 0.00 0.00 0.00 175.10 175.49 2zga s LEU 76 N 1.29 4.41 -0.14 3.92 1.43 0.14 -1.52 118.68 128.21 2zga s LEU 76 Ca -0.04 1.06 0.00 0.00 -1.03 0.00 0.00 54.13 54.12 2zga s LEU 76 Cb -0.14 -3.01 0.02 0.00 0.03 0.00 0.00 46.19 43.10 2zga s LEU 76 CO -0.02 0.20 -0.13 -0.69 0.23 0.00 0.00 176.35 175.93 2zga s VAL 77 N -1.30 1.49 -0.83 -1.59 1.01 0.11 -1.19 120.40 118.09 2zga s VAL 77 Ca 0.32 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2zga s VAL 77 Cb -0.16 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.81 2zga s VAL 77 CO 0.18 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.33 2zga n GLY 78 N 4.75 -0.90 1.53 4.51 0.00 -0.32 -0.85 105.19 113.92 2zga n GLY 78 Ca -0.16 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2zga n GLY 78 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2zga n PRO 79 N 0.00 0.66 -1.88 1.61 -0.02 -1.26 -3.45 135.00 130.66 2zga n PRO 79 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.14 2zga n PRO 79 Cb 0.00 -1.17 0.04 0.00 -0.02 0.00 0.00 33.50 32.35 2zga n PRO 79 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2zga s THR 80 N 0.61 2.91 0.32 3.45 -1.32 -1.26 -4.92 115.64 115.44 2zga s THR 80 Ca 0.00 0.49 0.11 0.00 -1.21 0.00 0.00 61.69 61.09 2zga s THR 80 Cb 0.00 -3.09 0.04 0.00 -1.51 0.00 0.00 72.50 67.94 2zga s THR 80 CO 0.00 -0.19 1.72 1.55 -2.21 0.00 0.00 174.62 175.49 2zga h PRO 81 N 0.46 0.02 -3.76 7.08 0.13 -1.98 -3.44 132.00 130.51 2zga h PRO 81 Ca -0.49 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.52 2zga h PRO 81 Cb 1.27 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.23 2zga h PRO 81 CO 0.54 0.50 -0.47 0.54 -0.23 0.00 0.00 178.00 178.88 2zga s VAL 82 N -3.93 0.13 0.04 1.56 0.11 -1.26 -5.06 120.40 112.00 2zga s VAL 82 Ca -0.02 -1.10 -0.31 0.00 -2.93 0.00 0.00 61.98 57.62 2zga s VAL 82 Cb 0.14 -1.03 -0.07 0.00 -1.53 0.00 0.00 36.38 33.89 2zga s VAL 82 CO 0.75 -0.61 1.46 0.20 -3.33 0.00 0.00 175.10 173.56 2zga s ASN 83 N -2.31 6.78 -0.13 3.54 0.01 -1.26 -4.64 114.94 116.94 2zga s ASN 83 Ca -0.02 2.25 0.02 0.00 -0.71 0.00 0.00 52.86 54.40 2zga s ASN 83 Cb 0.01 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.10 2zga s ASN 83 CO -0.06 -0.74 -0.20 -0.63 -1.51 0.00 0.00 177.10 173.96 2zga s ILE 84 N 2.16 2.34 -0.41 0.60 1.01 0.16 -0.81 121.20 126.24 2zga s ILE 84 Ca 0.66 -0.90 -0.17 0.00 0.00 0.00 0.00 60.65 60.24 2zga s ILE 84 Cb -0.35 -1.94 0.02 0.00 0.01 0.00 0.00 42.46 40.20 2zga s ILE 84 CO 0.29 0.54 0.44 -0.63 0.00 0.00 0.00 174.94 175.58 2zga s ILE 85 N 0.57 5.08 0.62 2.92 -1.09 -0.51 -1.12 121.20 127.67 2zga s ILE 85 Ca -0.12 -0.25 0.05 0.00 -2.23 0.00 0.00 60.65 58.10 2zga s ILE 85 Cb -0.16 -4.02 0.11 0.00 -1.58 0.00 0.00 42.46 36.81 2zga s ILE 85 CO 0.04 -0.38 0.86 0.61 -1.23 0.00 0.00 174.94 174.83 2zga n GLY 86 N 5.08 1.39 0.26 6.18 0.00 -1.18 -1.57 105.19 115.36 2zga n GLY 86 Ca -0.07 -2.14 0.09 0.00 0.00 0.00 0.00 46.02 43.90 2zga n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2zga h ARG 87 N 0.00 0.00 -0.31 1.61 3.08 -0.79 -0.64 114.38 117.32 2zga h ARG 87 Ca -0.29 0.00 0.09 0.00 0.07 0.00 0.00 59.98 59.85 2zga h ARG 87 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.23 2zga h ARG 87 CO 0.36 0.03 0.24 -2.95 -1.07 0.00 0.00 179.97 176.58 2zga h ASN 88 N 0.00 0.00 0.00 7.04 -1.07 -1.68 -2.12 115.58 117.75 2zga h ASN 88 Ca -0.00 0.00 -0.30 0.00 0.07 0.00 0.00 56.30 56.07 2zga h ASN 88 Cb 0.06 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 36.25 2zga h ASN 88 CO 0.00 0.00 -2.12 0.18 0.07 0.00 0.00 177.43 175.57 2zga n LEU 89 N -4.33 0.22 -0.08 6.14 4.77 -0.37 -4.37 117.00 118.97 2zga n LEU 89 Ca 0.05 -0.01 0.04 0.00 -0.03 0.00 0.00 56.01 56.06 2zga n LEU 89 Cb 0.40 0.32 0.38 0.00 -2.33 0.00 0.00 43.42 42.19 2zga n LEU 89 CO 0.34 0.43 1.19 -0.07 -1.33 0.00 0.00 177.39 177.96 2zga h LEU 90 N 0.00 0.58 -1.01 2.23 3.38 -0.96 -1.01 115.31 118.53 2zga h LEU 90 Ca -0.44 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 2zga h LEU 90 Cb 1.98 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.56 2zga h LEU 90 CO 0.02 0.41 0.19 0.71 0.09 0.00 0.00 178.44 179.86 2zga h THR 91 N 0.68 1.23 0.00 0.22 1.35 -1.60 -2.11 112.91 112.67 2zga h THR 91 Ca 0.21 -0.78 -0.06 0.00 -0.55 0.00 0.00 66.41 65.23 2zga h THR 91 Cb 0.02 0.56 -0.01 0.00 -1.73 0.00 0.00 68.15 66.99 2zga h THR 91 CO -0.05 0.30 -0.29 1.56 -0.25 0.00 0.00 175.52 176.79 2zga h GLN 92 N 0.88 0.00 -0.66 4.72 4.20 -1.39 -2.41 115.11 120.46 2zga h GLN 92 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 2zga h GLN 92 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2zga h GLN 92 CO -0.01 0.29 0.00 0.44 -0.67 0.00 0.00 178.83 178.88 2zga n ILE 93 N -3.87 1.05 -1.91 2.54 -5.35 -1.08 -4.94 119.36 105.80 2zga n ILE 93 Ca -0.02 -0.92 -0.06 0.00 -0.27 0.00 0.00 62.75 61.48 2zga n ILE 93 Cb 0.37 0.36 -0.01 0.00 -1.74 0.00 0.00 39.64 38.62 2zga n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2zga n GLY 94 N 1.44 0.28 3.72 3.28 0.00 -0.91 -5.00 105.19 108.01 2zga n GLY 94 Ca 0.22 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 2zga n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zga s THR 96 N 0.48 1.60 -0.07 0.00 -4.23 -1.26 -4.69 115.64 107.47 2zga s THR 96 Ca 0.46 -2.16 -0.05 0.00 -1.18 0.00 0.00 61.69 58.75 2zga s THR 96 Cb -0.21 -2.15 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 2zga s THR 96 CO 0.26 -0.52 0.15 -0.76 -0.54 0.00 0.00 174.62 173.21 2zga s LEU 97 N -3.33 4.35 -0.02 4.79 1.43 -1.26 -5.09 118.68 119.54 2zga s LEU 97 Ca 0.24 0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 2zga s LEU 97 Cb 0.01 -2.28 0.02 0.00 0.03 0.00 0.00 46.19 43.98 2zga s LEU 97 CO 0.08 0.35 0.01 0.20 0.23 0.00 0.00 176.35 177.21 2zga s ASN 98 N -1.39 0.25 0.00 2.29 0.01 -1.26 -5.29 114.94 109.54 2zga s ASN 98 Ca 0.20 -0.00 0.00 0.00 -0.71 0.00 0.00 52.86 52.35 2zga s ASN 98 Cb -0.12 -0.13 0.00 0.00 0.41 0.00 0.00 41.25 41.41 2zga s ASN 98 CO 0.10 -0.09 0.00 2.22 -1.51 0.00 0.00 177.10 177.82