#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f2z s LEU 7 N 0.00 3.61 0.02 -0.35 1.43 -1.26 -5.09 118.68 117.04 1f2z s LEU 7 Ca 0.00 1.42 -0.10 0.00 -1.03 0.00 0.00 54.13 54.43 1f2z s LEU 7 Cb 0.00 -4.37 0.01 0.00 0.03 0.00 0.00 46.19 41.86 1f2z s LEU 7 CO 0.00 -0.58 0.20 -1.38 0.23 0.00 0.00 176.35 174.81 1f2z s HIS 8 N -2.65 0.00 0.21 0.29 -3.43 -1.26 -5.12 115.29 103.33 1f2z s HIS 8 Ca 0.56 -0.12 -0.14 0.00 -0.80 0.00 0.00 55.06 54.56 1f2z s HIS 8 Cb -0.10 -0.01 -0.08 0.00 -1.43 0.00 0.00 32.58 30.96 1f2z s HIS 8 CO 0.35 -0.38 0.61 0.15 -2.00 0.00 0.00 174.74 173.47 1f2z s LYS 9 N -1.94 3.98 0.03 -0.38 1.02 -1.26 -4.42 119.74 116.77 1f2z s LYS 9 Ca -0.10 0.52 0.03 0.00 0.02 0.00 0.00 55.97 56.45 1f2z s LYS 9 Cb -0.04 -2.76 -0.02 0.00 -0.52 0.00 0.00 37.83 34.49 1f2z s LYS 9 CO -0.00 0.37 -0.10 -1.21 -0.92 0.00 0.00 175.35 173.48 1f2z s GLU 10 N -2.37 0.66 0.61 1.68 2.02 -0.26 -4.95 118.70 116.10 1f2z s GLU 10 Ca 0.44 -0.65 -0.15 0.00 0.02 0.00 0.00 54.97 54.62 1f2z s GLU 10 Cb -0.13 -0.56 -0.03 0.00 0.10 0.00 0.00 34.13 33.51 1f2z s GLU 10 CO 0.20 0.13 1.07 -1.25 0.02 0.00 0.00 175.26 175.43 1f2z s PRO 11 N -1.15 3.18 0.22 0.39 0.04 -1.26 -0.42 135.00 136.00 1f2z s PRO 11 Ca -0.03 1.24 -0.16 0.00 0.04 0.00 0.00 61.00 62.09 1f2z s PRO 11 Cb -0.08 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.47 1f2z s PRO 11 CO 0.01 -0.93 0.52 0.00 0.04 0.00 0.00 177.00 176.64 1f2z s ALA 12 N -2.44 -0.70 -0.04 8.56 0.00 -0.96 -4.66 121.76 121.52 1f2z s ALA 12 Ca 0.64 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 52.15 1f2z s ALA 12 Cb -0.17 0.92 -0.00 0.00 0.00 0.00 0.00 23.12 23.87 1f2z s ALA 12 CO 0.39 -0.85 -0.16 0.99 0.00 0.00 0.00 175.76 176.12 1f2z s THR 13 N -3.93 1.37 0.21 0.00 2.01 -0.82 -4.28 115.64 110.20 1f2z s THR 13 Ca 0.14 -0.69 -0.30 0.00 0.31 0.00 0.00 61.69 61.16 1f2z s THR 13 Cb -0.01 -1.17 -0.09 0.00 0.01 0.00 0.00 72.50 71.24 1f2z s THR 13 CO 0.03 0.39 1.22 -0.22 -0.69 0.00 0.00 174.62 175.36 1f2z s LEU 14 N 0.00 4.45 -0.11 4.42 2.96 -1.26 -0.36 118.68 128.79 1f2z s LEU 14 Ca -0.03 2.32 -0.10 0.00 -0.22 0.00 0.00 54.13 56.11 1f2z s LEU 14 Cb -0.11 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 42.92 1f2z s LEU 14 CO 0.02 -0.40 -0.21 -0.38 -1.32 0.00 0.00 176.35 174.06 1f2z n ILE 15 N 2.21 1.18 -3.64 6.68 5.41 -0.42 -4.84 119.36 125.95 1f2z n ILE 15 Ca 0.04 0.04 -0.10 0.00 1.00 0.00 0.00 62.75 63.73 1f2z n ILE 15 Cb 0.44 -1.90 -0.07 0.00 -0.71 0.00 0.00 39.64 37.40 1f2z n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1f2z s LYS 16 N -2.43 0.56 0.04 0.38 2.20 -0.92 -5.02 119.74 114.55 1f2z s LYS 16 Ca -0.20 0.66 -0.23 0.00 -0.36 0.00 0.00 55.97 55.84 1f2z s LYS 16 Cb 0.05 0.27 -0.06 0.00 -1.51 0.00 0.00 37.83 36.59 1f2z s LYS 16 CO 0.27 -0.07 0.70 0.00 -0.36 0.00 0.00 175.35 175.89 1f2z s ALA 17 N 0.23 3.43 -0.20 3.13 0.00 -1.26 -0.07 121.76 127.02 1f2z s ALA 17 Ca 0.03 0.19 -0.05 0.00 0.00 0.00 0.00 51.96 52.13 1f2z s ALA 17 Cb -0.05 -2.89 -0.10 0.00 0.00 0.00 0.00 23.12 20.08 1f2z s ALA 17 CO -0.05 0.13 -0.22 -0.89 0.00 0.00 0.00 175.76 174.74 1f2z n ILE 18 N 2.64 1.10 -3.88 0.00 5.41 -0.61 -4.92 119.36 119.11 1f2z n ILE 18 Ca -0.05 -0.35 -0.11 0.00 1.00 0.00 0.00 62.75 63.25 1f2z n ILE 18 Cb 0.50 -1.49 -0.01 0.00 -0.71 0.00 0.00 39.64 37.94 1f2z n ILE 18 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1f2z n ASP 19 N -3.50 -1.55 0.25 4.38 4.64 -0.75 -4.98 116.55 115.04 1f2z n ASP 19 Ca -0.37 -2.57 0.08 0.00 -1.38 0.00 0.00 54.79 50.55 1f2z n ASP 19 Cb 0.82 2.72 0.62 0.00 -1.04 0.00 0.00 41.12 44.24 1f2z n ASP 19 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 1f2z h GLY 20 N 1.75 0.00 -1.15 0.27 0.00 -1.82 -3.05 103.07 99.07 1f2z h GLY 20 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1f2z h GLY 20 CO 0.35 0.00 0.00 2.09 0.00 0.00 0.00 176.54 178.98 1f2z n ASP 21 N -4.30 2.36 -3.84 0.19 3.85 -1.26 -4.81 116.55 108.74 1f2z n ASP 21 Ca -0.03 -1.67 -0.15 0.00 -0.71 0.00 0.00 54.79 52.23 1f2z n ASP 21 Cb 0.17 -0.08 -0.15 0.00 -1.35 0.00 0.00 41.12 39.71 1f2z n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1f2z s THR 22 N -1.04 0.11 -0.00 2.12 2.01 -1.15 -1.21 115.64 116.47 1f2z s THR 22 Ca 0.18 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.23 1f2z s THR 22 Cb 0.12 -0.17 -0.00 0.00 0.01 0.00 0.00 72.50 72.45 1f2z s THR 22 CO 0.17 0.09 0.01 0.68 -0.69 0.00 0.00 174.62 174.88 1f2z s VAL 23 N 0.61 0.02 -0.20 3.82 -7.23 -0.71 -1.57 120.40 115.15 1f2z s VAL 23 Ca -0.06 -0.18 -0.13 0.00 -1.81 0.00 0.00 61.98 59.81 1f2z s VAL 23 Cb -0.08 -0.08 -0.05 0.00 0.56 0.00 0.00 36.38 36.73 1f2z s VAL 23 CO -0.01 -0.10 0.26 -0.75 -0.31 0.00 0.00 175.10 174.19 1f2z s LYS 24 N -0.28 4.18 0.17 4.82 2.20 0.90 -0.50 119.74 131.23 1f2z s LYS 24 Ca -0.03 -0.02 0.03 0.00 -0.36 0.00 0.00 55.97 55.59 1f2z s LYS 24 Cb -0.02 -3.48 -0.05 0.00 -1.51 0.00 0.00 37.83 32.77 1f2z s LYS 24 CO -0.00 0.13 -0.04 -0.51 -0.36 0.00 0.00 175.35 174.57 1f2z s LEU 25 N 0.83 2.30 -0.42 5.43 1.43 0.47 -1.30 118.68 127.41 1f2z s LEU 25 Ca 0.13 -1.12 -0.13 0.00 -1.03 0.00 0.00 54.13 51.98 1f2z s LEU 25 Cb -0.13 -0.20 0.04 0.00 0.03 0.00 0.00 46.19 45.93 1f2z s LEU 25 CO 0.04 -0.47 0.29 -0.32 0.23 0.00 0.00 176.35 176.12 1f2z s MET 26 N -3.84 2.88 -0.17 1.70 -2.45 0.52 -0.24 119.30 117.69 1f2z s MET 26 Ca 0.22 -1.19 0.00 0.00 -1.25 0.00 0.00 55.69 53.47 1f2z s MET 26 Cb 0.05 -3.92 0.01 0.00 1.25 0.00 0.00 34.83 32.21 1f2z s MET 26 CO 0.03 -0.84 -0.16 -0.47 1.05 0.00 0.00 175.02 174.63 1f2z s TYR 27 N 1.60 2.79 -1.50 4.11 5.04 -0.35 -1.94 117.35 127.10 1f2z s TYR 27 Ca 0.04 -1.29 -0.13 0.00 -2.44 0.00 0.00 57.07 53.24 1f2z s TYR 27 Cb -0.21 -1.93 0.07 0.00 0.35 0.00 0.00 41.96 40.25 1f2z s TYR 27 CO 0.07 -0.63 1.03 1.63 -1.34 0.00 0.00 175.55 176.31 1f2z n LYS 28 N 4.39 -6.03 -1.03 4.97 5.02 -1.26 -1.94 118.16 122.28 1f2z n LYS 28 Ca -0.20 0.64 -0.01 0.00 -2.02 0.00 0.00 58.31 56.73 1f2z n LYS 28 Cb 0.51 -5.57 -0.00 0.00 -0.02 0.00 0.00 35.03 29.94 1f2z n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f2z n GLY 29 N -1.76 0.49 2.84 0.72 0.00 -1.26 -5.04 105.19 101.19 1f2z n GLY 29 Ca 0.04 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 1f2z n GLY 29 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1f2z s GLN 30 N -1.13 0.04 0.15 1.61 -2.07 -0.82 -5.13 119.66 112.32 1f2z s GLN 30 Ca 0.00 0.04 -0.31 0.00 -1.82 0.00 0.00 55.36 53.27 1f2z s GLN 30 Cb 0.00 -0.14 -0.09 0.00 -1.09 0.00 0.00 33.01 31.69 1f2z s GLN 30 CO 0.00 -0.05 1.46 -2.14 -1.32 0.00 0.00 175.29 173.24 1f2z s PRO 31 N 0.37 4.28 0.01 9.60 0.02 -1.26 -1.21 135.00 146.81 1f2z s PRO 31 Ca -0.03 2.21 -0.08 0.00 0.02 0.00 0.00 61.00 63.12 1f2z s PRO 31 Cb -0.05 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.28 1f2z s PRO 31 CO -0.01 -0.49 0.16 -1.64 -0.33 0.00 0.00 177.00 174.69 1f2z s MET 32 N 0.89 0.54 -0.19 5.54 -1.94 0.67 -4.95 119.30 119.86 1f2z s MET 32 Ca 0.66 -0.43 -0.11 0.00 -1.71 0.00 0.00 55.69 54.09 1f2z s MET 32 Cb -0.40 0.22 -0.05 0.00 2.01 0.00 0.00 34.83 36.62 1f2z s MET 32 CO 0.32 -0.14 0.18 0.99 -0.01 0.00 0.00 175.02 176.37 1f2z s THR 33 N -1.61 5.37 -0.08 2.05 2.01 -1.26 -0.40 115.64 121.72 1f2z s THR 33 Ca -0.13 0.29 0.02 0.00 0.31 0.00 0.00 61.69 62.18 1f2z s THR 33 Cb -0.06 -3.52 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 1f2z s THR 33 CO 0.01 0.41 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.87 1f2z s PHE 34 N 0.49 2.80 -0.20 4.92 0.40 0.34 -1.14 117.98 125.59 1f2z s PHE 34 Ca 0.10 -0.23 -0.05 0.00 -0.60 0.00 0.00 56.93 56.15 1f2z s PHE 34 Cb -0.12 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.67 1f2z s PHE 34 CO 0.00 0.12 0.00 0.50 0.70 0.00 0.00 175.22 176.55 1f2z s ARG 35 N -0.45 3.62 0.03 0.44 6.06 -0.03 -1.74 118.95 126.87 1f2z s ARG 35 Ca 0.06 -0.52 -0.30 0.00 -2.50 0.00 0.00 55.73 52.47 1f2z s ARG 35 Cb -0.12 -3.08 -0.07 0.00 0.06 0.00 0.00 34.95 31.73 1f2z s ARG 35 CO 0.02 0.01 1.68 -0.51 -2.50 0.00 0.00 175.30 174.00 1f2z s LEU 36 N 1.01 4.36 0.42 -0.88 1.43 -0.35 -3.38 118.68 121.28 1f2z s LEU 36 Ca 0.02 2.42 -0.26 0.00 -1.03 0.00 0.00 54.13 55.29 1f2z s LEU 36 Cb -0.14 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.44 1f2z s LEU 36 CO 0.02 -0.91 1.32 -0.76 0.23 0.00 0.00 176.35 176.25 1f2z s LEU 37 N 3.24 4.17 0.00 1.79 1.43 -0.78 -3.89 118.68 124.65 1f2z s LEU 37 Ca 0.75 2.70 0.00 0.00 -1.03 0.00 0.00 54.13 56.55 1f2z s LEU 37 Cb -0.38 -3.93 0.00 0.00 0.03 0.00 0.00 46.19 41.91 1f2z s LEU 37 CO 0.32 -0.94 0.00 0.18 0.23 0.00 0.00 176.35 176.14 1f2z n LEU 38 N 0.00 0.75 -4.31 1.79 4.77 -1.26 -4.94 117.00 113.80 1f2z n LEU 38 Ca 0.04 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.79 1f2z n LEU 38 Cb 0.43 -1.69 -0.12 0.00 -2.33 0.00 0.00 43.42 39.71 1f2z n LEU 38 CO 0.56 -0.62 -0.50 0.68 -1.33 0.00 0.00 177.39 176.18 1f2z s VAL 39 N -1.43 1.80 -0.18 4.08 -7.23 -1.25 -0.93 120.40 115.26 1f2z s VAL 39 Ca 0.00 -1.72 0.01 0.00 -1.81 0.00 0.00 61.98 58.45 1f2z s VAL 39 Cb 0.00 -1.71 0.04 0.00 0.56 0.00 0.00 36.38 35.27 1f2z s VAL 39 CO 0.00 -0.16 -0.11 -1.81 -0.31 0.00 0.00 175.10 172.71 1f2z s ASP 40 N -2.25 3.10 0.16 4.85 1.01 0.40 -4.68 116.67 119.26 1f2z s ASP 40 Ca 0.11 -0.73 0.07 0.00 0.71 0.00 0.00 52.55 52.71 1f2z s ASP 40 Cb -0.08 -1.17 -0.04 0.00 1.01 0.00 0.00 42.92 42.64 1f2z s ASP 40 CO 0.05 -0.12 -0.02 0.42 0.21 0.00 0.00 175.17 175.71 1f2z s THR 41 N 1.46 3.63 0.59 -1.27 -4.23 -1.26 -1.31 115.64 113.24 1f2z s THR 41 Ca 0.01 -1.42 -0.18 0.00 -1.18 0.00 0.00 61.69 58.92 1f2z s THR 41 Cb -0.15 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.85 1f2z s THR 41 CO -0.09 -0.07 1.17 -2.84 -0.54 0.00 0.00 174.62 172.25 1f2z s PRO 42 N -2.82 3.01 0.24 3.99 0.02 -1.26 -4.97 135.00 133.21 1f2z s PRO 42 Ca 0.26 1.71 0.10 0.00 0.02 0.00 0.00 61.00 63.09 1f2z s PRO 42 Cb -0.10 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 1f2z s PRO 42 CO 0.18 -1.14 -0.11 -1.21 -0.33 0.00 0.00 177.00 174.38 1f2z s GLU 43 N -3.44 1.97 -0.14 5.54 2.02 -1.26 -4.43 118.70 118.96 1f2z s GLU 43 Ca 0.75 -1.48 0.18 0.00 0.02 0.00 0.00 54.97 54.44 1f2z s GLU 43 Cb -0.27 -2.02 -0.25 0.00 0.10 0.00 0.00 34.13 31.69 1f2z s GLU 43 CO 0.33 0.38 0.25 0.25 0.02 0.00 0.00 175.26 176.49 1f2z n THR 44 N -0.42 1.16 -3.25 3.63 -2.24 -1.26 -0.69 114.28 111.22 1f2z n THR 44 Ca -0.08 -0.78 -0.26 0.00 -2.27 0.00 0.00 64.05 60.65 1f2z n THR 44 Cb 0.58 -0.46 -0.07 0.00 -2.10 0.00 0.00 70.33 68.29 1f2z n THR 44 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1f2z n LYS 45 N -2.71 2.58 -3.23 -0.78 2.85 -1.23 -3.85 118.16 111.80 1f2z n LYS 45 Ca -0.25 -4.59 -0.40 0.00 -1.05 0.00 0.00 58.31 52.02 1f2z n LYS 45 Cb 1.03 -2.16 -0.07 0.00 -0.65 0.00 0.00 35.03 33.17 1f2z n LYS 45 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1f2z s HIS 46 N -2.70 3.33 0.27 5.58 2.46 -0.22 -4.96 115.29 119.06 1f2z s HIS 46 Ca 0.42 0.73 -0.07 0.00 0.47 0.00 0.00 55.06 56.61 1f2z s HIS 46 Cb 0.20 -2.70 0.48 0.00 -0.13 0.00 0.00 32.58 30.42 1f2z s HIS 46 CO -0.06 -0.18 1.57 -1.35 -2.47 0.00 0.00 174.74 172.25 1f2z h PRO 47 N 7.69 0.00 0.00 2.88 0.11 -1.97 0.24 132.00 140.96 1f2z h PRO 47 Ca -0.31 -0.00 -0.41 0.00 0.11 0.00 0.00 66.00 65.39 1f2z h PRO 47 Cb 1.15 -0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 1f2z h PRO 47 CO 0.73 0.00 -2.22 1.63 -0.21 0.00 0.00 178.00 177.94 1f2z n LYS 48 N -5.57 0.59 0.19 1.05 5.02 -1.26 -4.66 118.16 113.52 1f2z n LYS 48 Ca 0.16 0.34 0.13 0.00 -2.02 0.00 0.00 58.31 56.92 1f2z n LYS 48 Cb 0.52 -1.56 0.28 0.00 -0.02 0.00 0.00 35.03 34.24 1f2z n LYS 48 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1f2z h LYS 49 N -0.97 0.00 0.00 1.97 1.57 -1.98 -3.49 116.57 113.67 1f2z h LYS 49 Ca -0.61 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.17 1f2z h LYS 49 Cb 1.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.86 1f2z h LYS 49 CO -0.36 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 178.93 1f2z n GLY 50 N 1.04 1.61 3.27 3.86 0.00 0.84 -4.54 105.19 111.27 1f2z n GLY 50 Ca 0.04 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1f2z n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f2z s VAL 51 N 0.00 4.20 0.75 1.61 1.01 -1.25 -1.06 120.40 125.67 1f2z s VAL 51 Ca 0.00 -1.36 -0.12 0.00 0.00 0.00 0.00 61.98 60.50 1f2z s VAL 51 Cb 0.00 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.87 1f2z s VAL 51 CO 0.00 -0.47 1.13 -1.61 0.00 0.00 0.00 175.10 174.14 1f2z s GLU 52 N 1.42 2.46 0.15 2.72 2.02 0.14 -4.98 118.70 122.63 1f2z s GLU 52 Ca 0.03 0.34 -0.30 0.00 0.02 0.00 0.00 54.97 55.05 1f2z s GLU 52 Cb -0.23 -1.99 -0.08 0.00 0.10 0.00 0.00 34.13 31.94 1f2z s GLU 52 CO 0.02 -1.29 1.27 0.21 0.02 0.00 0.00 175.26 175.50 1f2z s LYS 53 N -5.43 4.41 0.00 1.61 2.20 -1.26 -2.02 119.74 119.25 1f2z s LYS 53 Ca 0.60 1.95 0.00 0.00 -0.36 0.00 0.00 55.97 58.16 1f2z s LYS 53 Cb -0.11 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 32.96 1f2z s LYS 53 CO 0.51 -0.25 0.00 0.66 -0.36 0.00 0.00 175.35 175.91 1f2z n TYR 54 N 3.17 0.00 0.13 4.03 4.01 -1.26 -4.78 117.16 122.46 1f2z n TYR 54 Ca 0.07 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.68 1f2z n TYR 54 Cb 0.44 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.39 1f2z n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1f2z h GLY 55 N 0.00 -0.28 1.56 2.72 0.00 -1.62 -0.97 103.07 104.48 1f2z h GLY 55 Ca 0.00 0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 1f2z h GLY 55 CO 0.00 -0.10 0.26 -2.55 0.00 0.00 0.00 176.54 174.15 1f2z h PRO 56 N -0.35 0.59 0.00 4.80 0.11 -1.87 -1.46 132.00 133.81 1f2z h PRO 56 Ca -0.03 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 1f2z h PRO 56 Cb 0.27 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.26 1f2z h PRO 56 CO 0.05 0.42 -0.00 0.93 -0.21 0.00 0.00 178.00 179.18 1f2z h GLU 57 N 0.60 -0.00 -0.74 1.05 3.07 -1.87 -0.86 114.58 115.82 1f2z h GLU 57 Ca 0.16 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.97 1f2z h GLU 57 Cb -0.01 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 1f2z h GLU 57 CO -0.03 0.29 0.27 0.00 -1.40 0.00 0.00 179.01 178.15 1f2z h ALA 58 N 0.69 1.08 -0.53 3.43 0.00 -0.99 -1.52 119.26 121.42 1f2z h ALA 58 Ca -0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1f2z h ALA 58 Cb 0.30 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1f2z h ALA 58 CO 0.00 0.64 0.20 1.03 0.00 0.00 0.00 179.25 181.13 1f2z h SER 59 N 1.08 0.73 -0.26 0.00 0.87 -1.20 -2.10 113.55 112.68 1f2z h SER 59 Ca 0.25 -0.17 -0.11 0.00 -1.23 0.00 0.00 61.79 60.52 1f2z h SER 59 Cb 0.24 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 1f2z h SER 59 CO -0.02 0.71 -0.22 0.00 -0.53 0.00 0.00 176.83 176.77 1f2z h ALA 60 N 1.05 0.92 0.31 6.23 0.00 -0.86 -2.25 119.26 124.66 1f2z h ALA 60 Ca 0.17 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1f2z h ALA 60 Cb 0.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1f2z h ALA 60 CO -0.01 0.62 -0.15 0.35 0.00 0.00 0.00 179.25 180.05 1f2z h PHE 61 N 0.64 -0.38 -0.55 0.00 3.57 -1.05 -1.47 116.94 117.69 1f2z h PHE 61 Ca 0.09 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.61 1f2z h PHE 61 Cb 0.71 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 1f2z h PHE 61 CO 0.03 -0.18 0.33 1.15 -2.23 0.00 0.00 178.31 177.41 1f2z h THR 62 N -0.50 1.05 -0.05 4.41 2.02 -1.36 -1.65 112.91 116.83 1f2z h THR 62 Ca -0.04 -0.22 0.02 0.00 0.77 0.00 0.00 66.41 66.93 1f2z h THR 62 Cb 0.37 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1f2z h THR 62 CO 0.07 0.12 -0.05 0.50 0.37 0.00 0.00 175.52 176.53 1f2z h LYS 63 N 0.65 -0.06 -0.70 6.66 3.64 -1.33 -2.00 116.57 123.41 1f2z h LYS 63 Ca 0.23 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1f2z h LYS 63 Cb 0.04 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1f2z h LYS 63 CO -0.10 -0.04 0.40 -0.22 -2.27 0.00 0.00 179.45 177.21 1f2z h LYS 64 N -0.06 0.98 -0.39 1.90 3.11 -1.07 -0.55 116.57 120.48 1f2z h LYS 64 Ca 0.04 -0.11 -0.02 0.00 -2.81 0.00 0.00 60.65 57.75 1f2z h LYS 64 Cb 0.12 -0.19 -0.02 0.00 -1.00 0.00 0.00 32.23 31.14 1f2z h LYS 64 CO -0.09 0.72 0.18 1.98 -2.81 0.00 0.00 179.45 179.43 1f2z h MET 65 N 0.97 0.57 0.09 1.90 4.05 -1.01 -2.43 114.93 119.06 1f2z h MET 65 Ca 0.25 -0.09 -0.26 0.00 -0.28 0.00 0.00 59.70 59.32 1f2z h MET 65 Cb 0.02 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.72 1f2z h MET 65 CO -0.04 0.51 -1.15 -0.39 0.23 0.00 0.00 176.91 176.07 1f2z h VAL 66 N 0.49 1.49 -0.07 -5.77 -1.51 -1.24 -3.22 116.25 106.41 1f2z h VAL 66 Ca 0.13 -2.92 -0.10 0.00 -1.23 0.00 0.00 66.70 62.58 1f2z h VAL 66 Cb 0.14 2.81 -0.01 0.00 -2.13 0.00 0.00 31.29 32.09 1f2z h VAL 66 CO -0.02 0.86 -0.40 -0.33 -1.23 0.00 0.00 177.57 176.45 1f2z h GLU 67 N 0.10 0.16 -0.17 5.19 5.08 -1.08 -3.08 114.58 120.78 1f2z h GLU 67 Ca -0.11 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1f2z h GLU 67 Cb 1.86 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.10 1f2z h GLU 67 CO 0.19 0.54 0.00 0.09 -1.00 0.00 0.00 179.01 178.83 1f2z n ASN 68 N -4.04 2.20 -4.82 1.42 5.03 -0.92 -4.96 115.26 109.17 1f2z n ASN 68 Ca -0.02 -1.77 -0.33 0.00 0.87 0.00 0.00 54.58 53.33 1f2z n ASN 68 Cb 0.46 -0.11 -0.07 0.00 -1.02 0.00 0.00 39.78 39.05 1f2z n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1f2z s ALA 69 N -1.79 3.08 -0.03 5.41 0.00 -1.17 -4.99 121.76 122.28 1f2z s ALA 69 Ca 0.34 0.39 -0.05 0.00 0.00 0.00 0.00 51.96 52.64 1f2z s ALA 69 Cb 0.20 -3.12 -0.28 0.00 0.00 0.00 0.00 23.12 19.91 1f2z s ALA 69 CO 0.29 0.15 0.73 0.87 0.00 0.00 0.00 175.76 177.80 1f2z h LYS 70 N 2.10 0.29 -3.88 0.00 1.57 -1.93 -3.46 116.57 111.26 1f2z h LYS 70 Ca -0.49 -0.49 -0.39 0.00 -1.87 0.00 0.00 60.65 57.42 1f2z h LYS 70 Cb 1.18 0.18 -0.34 0.00 0.08 0.00 0.00 32.23 33.33 1f2z h LYS 70 CO 0.62 1.16 -0.76 0.15 -0.57 0.00 0.00 179.45 180.04 1f2z s LYS 71 N -2.60 0.60 -0.11 3.15 1.02 -1.26 -5.04 119.74 115.50 1f2z s LYS 71 Ca -0.13 -0.02 -0.01 0.00 0.02 0.00 0.00 55.97 55.84 1f2z s LYS 71 Cb 0.06 -0.71 -0.03 0.00 -0.52 0.00 0.00 37.83 36.64 1f2z s LYS 71 CO 0.84 -0.12 -0.06 0.42 -0.92 0.00 0.00 175.35 175.51 1f2z s ILE 72 N 1.04 3.70 0.04 2.17 1.01 -1.26 -1.35 121.20 126.55 1f2z s ILE 72 Ca -0.09 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.14 1f2z s ILE 72 Cb -0.14 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.75 1f2z s ILE 72 CO -0.01 0.55 -0.10 -1.61 0.00 0.00 0.00 174.94 173.77 1f2z s GLU 73 N -0.21 0.67 -0.00 2.79 2.02 -0.53 -2.27 118.70 121.16 1f2z s GLU 73 Ca 0.03 -0.69 0.06 0.00 0.02 0.00 0.00 54.97 54.39 1f2z s GLU 73 Cb -0.13 -0.57 -0.03 0.00 0.10 0.00 0.00 34.13 33.50 1f2z s GLU 73 CO 0.03 0.13 -0.19 0.14 0.02 0.00 0.00 175.26 175.38 1f2z s VAL 74 N -1.01 2.66 -0.25 2.63 -7.23 0.44 -0.76 120.40 116.87 1f2z s VAL 74 Ca -0.04 -1.03 -0.00 0.00 -1.81 0.00 0.00 61.98 59.10 1f2z s VAL 74 Cb -0.08 -2.05 0.07 0.00 0.56 0.00 0.00 36.38 34.88 1f2z s VAL 74 CO 0.01 0.48 0.01 -0.70 -0.31 0.00 0.00 175.10 174.59 1f2z s GLU 75 N -1.01 1.16 0.62 4.82 2.12 -0.15 -1.10 118.70 125.17 1f2z s GLU 75 Ca 0.12 -0.96 -0.14 0.00 0.36 0.00 0.00 54.97 54.35 1f2z s GLU 75 Cb -0.10 -2.39 -0.02 0.00 0.26 0.00 0.00 34.13 31.87 1f2z s GLU 75 CO 0.02 -0.74 1.05 -0.06 -0.54 0.00 0.00 175.26 175.00 1f2z s PHE 76 N 1.51 3.08 0.00 5.30 0.40 -1.26 -1.10 117.98 125.91 1f2z s PHE 76 Ca 0.01 1.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.81 1f2z s PHE 76 Cb -0.18 -2.94 0.00 0.00 0.51 0.00 0.00 43.02 40.41 1f2z s PHE 76 CO -0.12 -1.09 0.00 -3.47 0.70 0.00 0.00 175.22 171.25 1f2z n ASP 77 N -2.40 0.00 0.13 1.36 4.64 -1.26 -4.71 116.55 114.30 1f2z n ASP 77 Ca 0.08 -0.40 0.12 0.00 -1.38 0.00 0.00 54.79 53.21 1f2z n ASP 77 Cb 0.53 0.00 0.21 0.00 -1.04 0.00 0.00 41.12 40.82 1f2z n ASP 77 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 1f2z h LYS 78 N 0.00 0.00 0.00 -0.67 1.57 -1.97 -3.47 116.57 112.03 1f2z h LYS 78 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1f2z h LYS 78 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1f2z h LYS 78 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 1f2z n GLY 79 N 1.23 1.81 3.75 3.86 0.00 -1.26 -4.96 105.19 109.61 1f2z n GLY 79 Ca 0.04 -1.83 -0.38 0.00 0.00 0.00 0.00 46.02 43.84 1f2z n GLY 79 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1f2z s GLN 80 N 3.78 3.12 0.00 1.61 -2.07 -1.26 -4.96 119.66 119.89 1f2z s GLN 80 Ca 0.00 2.25 0.22 0.00 -1.82 0.00 0.00 55.36 56.01 1f2z s GLN 80 Cb 0.00 -2.25 -0.07 0.00 -1.09 0.00 0.00 33.01 29.60 1f2z s GLN 80 CO 0.00 -1.21 1.03 0.54 -1.32 0.00 0.00 175.29 174.33 1f2z n ARG 81 N -1.04 0.66 -3.99 9.60 1.74 -1.26 -4.82 116.66 117.55 1f2z n ARG 81 Ca 0.10 -0.54 -0.10 0.00 -0.77 0.00 0.00 57.85 56.55 1f2z n ARG 81 Cb 0.45 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.29 1f2z n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1f2z s THR 82 N -2.71 0.17 0.34 0.55 -4.23 -1.26 -0.54 115.64 107.96 1f2z s THR 82 Ca 0.14 -0.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.77 1f2z s THR 82 Cb 0.17 -0.30 0.07 0.00 1.34 0.00 0.00 72.50 73.77 1f2z s THR 82 CO 0.70 -0.45 0.47 -0.90 -0.54 0.00 0.00 174.62 173.89 1f2z n ASP 83 N 1.66 0.71 0.31 3.99 5.68 -0.04 -4.89 116.55 123.96 1f2z n ASP 83 Ca -0.23 -1.58 0.20 0.00 -0.50 0.00 0.00 54.79 52.68 1f2z n ASP 83 Cb 0.55 -0.29 1.00 0.00 -1.14 0.00 0.00 41.12 41.24 1f2z n ASP 83 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1f2z h LYS 84 N 0.00 0.00 -0.21 0.11 2.10 -2.03 -1.36 116.57 115.19 1f2z h LYS 84 Ca -0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.50 1f2z h LYS 84 Cb 0.59 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 1f2z h LYS 84 CO 0.17 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.28 1f2z n TYR 85 N -3.05 0.26 -0.88 0.07 4.02 -1.26 -4.92 117.16 111.40 1f2z n TYR 85 Ca -0.02 -0.13 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 1f2z n TYR 85 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 1f2z n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1f2z n GLY 86 N 1.21 0.53 3.77 2.72 0.00 -0.51 -5.04 105.19 107.87 1f2z n GLY 86 Ca 0.17 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1f2z n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f2z s ARG 87 N -0.52 4.37 0.39 1.61 0.52 -1.26 -4.75 118.95 119.32 1f2z s ARG 87 Ca 0.00 0.87 -0.26 0.00 -0.52 0.00 0.00 55.73 55.82 1f2z s ARG 87 Cb 0.00 -3.31 -0.09 0.00 0.52 0.00 0.00 34.95 32.07 1f2z s ARG 87 CO 0.00 0.43 1.23 0.20 0.02 0.00 0.00 175.30 177.18 1f2z s GLY 88 N -0.48 2.91 -0.30 -3.53 0.00 -0.29 -0.86 107.32 104.76 1f2z s GLY 88 Ca 0.33 1.09 -0.05 0.00 0.00 0.00 0.00 44.72 46.08 1f2z s GLY 88 CO 0.20 1.64 0.06 1.08 0.00 0.00 0.00 173.10 176.08 1f2z s LEU 89 N -2.38 3.89 0.29 0.66 1.43 0.29 -0.85 118.68 122.01 1f2z s LEU 89 Ca 0.56 -0.92 -0.18 0.00 -1.03 0.00 0.00 54.13 52.56 1f2z s LEU 89 Cb -0.34 -1.83 0.02 0.00 0.03 0.00 0.00 46.19 44.07 1f2z s LEU 89 CO 0.44 -0.23 0.68 0.00 0.23 0.00 0.00 176.35 177.46 1f2z s ALA 90 N 1.42 -0.91 -0.22 4.21 0.00 -1.22 -4.40 121.76 120.64 1f2z s ALA 90 Ca 0.00 -0.52 -0.13 0.00 0.00 0.00 0.00 51.96 51.31 1f2z s ALA 90 Cb -0.18 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 1f2z s ALA 90 CO 0.01 -0.99 0.28 0.71 0.00 0.00 0.00 175.76 175.78 1f2z s TYR 91 N -3.69 3.34 -0.17 0.00 2.02 -0.26 -1.87 117.35 116.73 1f2z s TYR 91 Ca 0.14 0.42 -0.07 0.00 -0.37 0.00 0.00 57.07 57.19 1f2z s TYR 91 Cb -0.05 -2.41 -0.04 0.00 -0.40 0.00 0.00 41.96 39.06 1f2z s TYR 91 CO 0.08 0.02 0.08 0.42 -1.57 0.00 0.00 175.55 174.58 1f2z s ILE 92 N 1.23 4.92 -0.10 2.71 -1.09 -1.26 -0.98 121.20 126.63 1f2z s ILE 92 Ca 0.13 0.01 0.01 0.00 -2.23 0.00 0.00 60.65 58.58 1f2z s ILE 92 Cb -0.14 -3.21 -0.02 0.00 -1.58 0.00 0.00 42.46 37.51 1f2z s ILE 92 CO 0.06 0.48 -0.13 -0.31 -1.23 0.00 0.00 174.94 173.81 1f2z s TYR 93 N 0.14 2.78 -0.27 3.97 2.02 0.06 -0.20 117.35 125.85 1f2z s TYR 93 Ca 0.06 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.31 1f2z s TYR 93 Cb -0.12 -1.77 0.06 0.00 -0.40 0.00 0.00 41.96 39.73 1f2z s TYR 93 CO 0.00 -0.06 -0.07 0.00 -1.57 0.00 0.00 175.55 173.85 1f2z s ALA 94 N -0.05 2.65 -1.45 3.71 0.00 0.11 -1.46 121.76 125.28 1f2z s ALA 94 Ca -0.03 -1.79 -0.08 0.00 0.00 0.00 0.00 51.96 50.06 1f2z s ALA 94 Cb -0.14 -1.71 0.05 0.00 0.00 0.00 0.00 23.12 21.33 1f2z s ALA 94 CO 0.04 -1.24 0.84 -0.25 0.00 0.00 0.00 175.76 175.15 1f2z n ASP 95 N 4.48 -3.18 0.00 0.00 10.43 -0.46 -1.57 116.55 126.26 1f2z n ASP 95 Ca -0.13 -0.81 0.00 0.00 2.57 0.00 0.00 54.79 56.41 1f2z n ASP 95 Cb 0.42 -3.87 0.00 0.00 1.84 0.00 0.00 41.12 39.51 1f2z n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1f2z n GLY 96 N -1.67 2.44 3.72 0.44 0.00 -1.26 -5.03 105.19 103.83 1f2z n GLY 96 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1f2z n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f2z s LYS 97 N -0.32 4.23 -0.15 1.61 1.02 -0.61 -5.03 119.74 120.50 1f2z s LYS 97 Ca 0.00 0.02 -0.29 0.00 0.02 0.00 0.00 55.97 55.72 1f2z s LYS 97 Cb 0.00 -3.44 -0.02 0.00 -0.52 0.00 0.00 37.83 33.85 1f2z s LYS 97 CO 0.00 0.22 1.31 1.41 -0.92 0.00 0.00 175.35 177.37 1f2z s MET 98 N 0.54 4.23 0.22 1.68 -2.45 -1.26 -0.71 119.30 121.55 1f2z s MET 98 Ca 0.15 1.72 -0.07 0.00 -1.25 0.00 0.00 55.69 56.24 1f2z s MET 98 Cb -0.13 -3.78 0.19 0.00 1.25 0.00 0.00 34.83 32.36 1f2z s MET 98 CO 0.03 -0.71 1.80 0.28 1.05 0.00 0.00 175.02 177.47 1f2z h VAL 99 N 5.49 1.26 -0.42 10.11 2.07 -0.95 -2.20 116.25 131.60 1f2z h VAL 99 Ca -0.28 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 66.52 1f2z h VAL 99 Cb 1.11 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 1f2z h VAL 99 CO 0.97 0.33 0.09 0.78 0.02 0.00 0.00 177.57 179.75 1f2z h ASN 100 N 1.16 0.03 -0.35 0.57 4.21 -1.91 -2.20 115.58 117.08 1f2z h ASN 100 Ca 0.27 0.07 -0.14 0.00 1.21 0.00 0.00 56.30 57.71 1f2z h ASN 100 Cb 0.18 0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 37.46 1f2z h ASN 100 CO -0.03 0.05 -0.31 -0.08 -1.29 0.00 0.00 177.43 175.77 1f2z h GLU 101 N 0.23 0.84 -0.77 0.81 4.22 -1.89 -3.12 114.58 114.89 1f2z h GLU 101 Ca 0.20 -0.43 0.09 0.00 0.08 0.00 0.00 59.36 59.30 1f2z h GLU 101 Cb 0.24 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.43 1f2z h GLU 101 CO -0.26 1.06 0.43 0.00 -2.18 0.00 0.00 179.01 178.07 1f2z h ALA 102 N 0.76 1.09 -0.43 2.92 0.00 -1.02 0.68 119.26 123.26 1f2z h ALA 102 Ca 0.06 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1f2z h ALA 102 Cb 0.89 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1f2z h ALA 102 CO 0.08 0.06 0.15 -0.07 0.00 0.00 0.00 179.25 179.47 1f2z h LEU 103 N 0.73 0.61 -0.42 0.00 3.38 -1.39 -2.51 115.31 115.71 1f2z h LEU 103 Ca 0.37 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 1f2z h LEU 103 Cb 0.33 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1f2z h LEU 103 CO -0.24 0.63 0.09 0.58 0.09 0.00 0.00 178.44 179.59 1f2z h VAL 104 N 0.55 1.24 0.00 1.22 2.07 -1.37 -1.17 116.25 118.78 1f2z h VAL 104 Ca 0.14 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1f2z h VAL 104 Cb 0.23 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1f2z h VAL 104 CO -0.01 0.29 -0.02 -0.09 0.02 0.00 0.00 177.57 177.76 1f2z h ARG 105 N 0.54 0.00 -0.09 1.57 9.65 -0.75 -1.84 114.38 123.45 1f2z h ARG 105 Ca 0.13 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.01 1f2z h ARG 105 Cb 0.34 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 1f2z h ARG 105 CO 0.00 0.02 0.00 1.04 2.80 0.00 0.00 179.97 183.83 1f2z n GLN 106 N -4.44 1.75 -2.19 0.20 1.13 -0.96 -4.52 117.38 108.35 1f2z n GLN 106 Ca -0.03 -1.10 -0.11 0.00 -1.94 0.00 0.00 57.00 53.82 1f2z n GLN 106 Cb 0.11 -1.44 -0.01 0.00 0.11 0.00 0.00 30.24 29.01 1f2z n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1f2z n GLY 107 N 1.17 -0.06 0.70 1.08 0.00 -0.69 -4.41 105.19 102.98 1f2z n GLY 107 Ca 0.18 -0.43 0.06 0.00 0.00 0.00 0.00 46.02 45.83 1f2z n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1f2z n LEU 108 N -1.56 3.14 -3.54 0.99 4.77 -0.46 -1.46 117.00 118.88 1f2z n LEU 108 Ca -0.13 -2.21 -0.12 0.00 -0.03 0.00 0.00 56.01 53.52 1f2z n LEU 108 Cb 0.59 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.34 1f2z n LEU 108 CO 0.15 0.72 0.64 0.00 -1.33 0.00 0.00 177.39 177.57 1f2z s ALA 109 N -1.38 -1.85 0.15 -1.18 0.00 -1.20 -4.42 121.76 111.89 1f2z s ALA 109 Ca 0.27 1.34 0.08 0.00 0.00 0.00 0.00 51.96 53.66 1f2z s ALA 109 Cb 0.17 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.04 1f2z s ALA 109 CO 0.14 -0.42 -0.10 0.15 0.00 0.00 0.00 175.76 175.53 1f2z s LYS 110 N -1.67 2.08 -0.01 0.00 1.02 -0.43 -4.47 119.74 116.26 1f2z s LYS 110 Ca -0.03 -1.18 -0.30 0.00 0.02 0.00 0.00 55.97 54.48 1f2z s LYS 110 Cb -0.00 -2.21 -0.05 0.00 -0.52 0.00 0.00 37.83 35.05 1f2z s LYS 110 CO 0.01 0.46 1.28 0.08 -0.92 0.00 0.00 175.35 176.26 1f2z s VAL 111 N -1.52 3.99 0.88 3.17 1.01 -1.26 -0.45 120.40 126.22 1f2z s VAL 111 Ca 0.23 1.36 -0.12 0.00 0.00 0.00 0.00 61.98 63.46 1f2z s VAL 111 Cb -0.10 -3.87 0.12 0.00 0.00 0.00 0.00 36.38 32.53 1f2z s VAL 111 CO 0.15 0.02 1.10 0.00 0.00 0.00 0.00 175.10 176.37 1f2z s ALA 112 N 2.03 1.70 -0.62 5.51 0.00 -0.10 -4.83 121.76 125.45 1f2z s ALA 112 Ca 0.59 -0.21 -0.26 0.00 0.00 0.00 0.00 51.96 52.08 1f2z s ALA 112 Cb -0.28 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 1f2z s ALA 112 CO 0.25 -2.23 2.03 -0.47 0.00 0.00 0.00 175.76 175.34 1f2z s TYR 113 N -3.05 1.51 0.59 0.00 6.14 -1.26 -4.93 117.35 116.35 1f2z s TYR 113 Ca 0.63 1.02 -0.17 0.00 0.64 0.00 0.00 57.07 59.19 1f2z s TYR 113 Cb -0.17 -3.93 -0.04 0.00 0.42 0.00 0.00 41.96 38.25 1f2z s TYR 113 CO 0.56 -2.26 1.10 0.08 0.64 0.00 0.00 175.55 175.67 1f2z s VAL 114 N 10.25 3.34 -0.19 3.14 1.01 -1.26 -5.07 120.40 131.61 1f2z s VAL 114 Ca 0.76 0.72 -0.07 0.00 0.00 0.00 0.00 61.98 63.39 1f2z s VAL 114 Cb -0.13 -3.25 0.09 0.00 0.00 0.00 0.00 36.38 33.09 1f2z s VAL 114 CO 0.19 -0.29 0.41 0.00 0.00 0.00 0.00 175.10 175.41 1f2z s ALA 115 N -2.09 -1.12 0.90 5.51 0.00 -1.26 -5.12 121.76 118.56 1f2z s ALA 115 Ca 0.69 1.48 -0.11 0.00 0.00 0.00 0.00 51.96 54.02 1f2z s ALA 115 Cb -0.21 -1.29 0.12 0.00 0.00 0.00 0.00 23.12 21.74 1f2z s ALA 115 CO 0.33 -0.73 1.08 0.00 0.00 0.00 0.00 175.76 176.44 1f2z n ALA 116 N 5.33 -0.85 1.73 0.00 0.00 -1.26 -3.13 120.51 122.32 1f2z n ALA 116 Ca -0.09 -0.51 0.15 0.00 0.00 0.00 0.00 53.44 52.99 1f2z n ALA 116 Cb 0.50 -2.16 0.78 0.00 0.00 0.00 0.00 19.45 18.57 1f2z n ALA 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1f2z n PRO 117 N -3.76 1.00 -1.74 0.00 -0.04 -1.26 -4.95 135.00 124.26 1f2z n PRO 117 Ca 0.12 -0.23 -0.40 0.00 -0.04 0.00 0.00 63.50 62.94 1f2z n PRO 117 Cb 0.52 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.47 1f2z n PRO 117 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1f2z n ASN 118 N -0.80 7.09 -0.86 3.54 3.02 -1.18 -4.29 115.26 121.78 1f2z n ASN 118 Ca 0.20 -2.87 0.01 0.00 -0.03 0.00 0.00 54.58 51.89 1f2z n ASN 118 Cb 0.20 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 37.86 1f2z n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1f2z n ASN 119 N 3.57 0.23 -0.25 6.41 2.04 -1.26 -4.62 115.26 121.37 1f2z n ASN 119 Ca 0.63 -1.87 0.04 0.00 -0.44 0.00 0.00 54.58 52.95 1f2z n ASN 119 Cb 0.28 -0.16 0.18 0.00 -2.53 0.00 0.00 39.78 37.55 1f2z n ASN 119 CO 0.00 0.00 0.00 0.74 -0.44 0.00 0.00 177.26 177.56 1f2z h THR 120 N 6.57 0.68 -0.51 5.53 2.02 -1.98 -2.02 112.91 123.20 1f2z h THR 120 Ca -0.12 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 1f2z h THR 120 Cb 1.51 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1f2z h THR 120 CO 0.01 0.08 0.02 1.41 0.37 0.00 0.00 175.52 177.41 1f2z n HIS 121 N -4.99 1.83 0.08 3.16 8.25 -1.26 -4.61 115.22 117.68 1f2z n HIS 121 Ca 0.14 -0.66 -0.12 0.00 -0.26 0.00 0.00 57.72 56.81 1f2z n HIS 121 Cb 0.39 -0.47 -0.06 0.00 1.12 0.00 0.00 29.99 30.97 1f2z n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1f2z h GLU 122 N 3.33 -0.18 -0.73 -0.41 4.81 -1.75 -1.98 114.58 117.67 1f2z h GLU 122 Ca 0.02 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1f2z h GLU 122 Cb 1.81 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 31.19 1f2z h GLU 122 CO 0.45 -0.12 0.47 1.96 -0.73 0.00 0.00 179.01 181.03 1f2z h GLN 123 N -0.19 0.90 -0.53 1.92 1.08 -1.82 -0.54 115.11 115.94 1f2z h GLN 123 Ca 0.01 -0.05 0.03 0.00 -1.45 0.00 0.00 58.65 57.19 1f2z h GLN 123 Cb 0.20 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.38 1f2z h GLN 123 CO -0.05 0.60 0.30 1.25 -0.95 0.00 0.00 178.83 179.98 1f2z h HIS 124 N 0.93 0.56 -0.12 2.96 2.76 -1.84 -2.01 115.15 118.39 1f2z h HIS 124 Ca 0.28 0.02 -0.16 0.00 -2.20 0.00 0.00 60.37 58.31 1f2z h HIS 124 Cb -0.04 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.74 1f2z h HIS 124 CO -0.03 0.30 -0.62 -0.07 -1.30 0.00 0.00 177.93 176.22 1f2z h LEU 125 N 0.59 0.47 -0.95 0.26 3.38 -0.90 -2.82 115.31 115.35 1f2z h LEU 125 Ca 0.22 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1f2z h LEU 125 Cb 0.07 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1f2z h LEU 125 CO -0.12 0.97 0.11 0.03 0.09 0.00 0.00 178.44 179.52 1f2z h ARG 126 N 0.30 0.88 -0.54 1.13 3.08 -0.85 -1.21 114.38 117.18 1f2z h ARG 126 Ca -0.01 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 1f2z h ARG 126 Cb 1.15 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 31.06 1f2z h ARG 126 CO 0.11 0.81 0.16 0.87 -1.07 0.00 0.00 179.97 180.85 1f2z h LYS 127 N 0.84 0.84 -0.43 0.04 1.57 -1.26 -0.84 116.57 117.34 1f2z h LYS 127 Ca 0.18 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1f2z h LYS 127 Cb 0.34 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1f2z h LYS 127 CO 0.00 0.78 -0.05 0.77 -0.57 0.00 0.00 179.45 180.38 1f2z h SER 128 N 0.75 0.71 -0.55 0.86 0.02 -1.22 -2.29 113.55 111.82 1f2z h SER 128 Ca 0.17 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 60.84 1f2z h SER 128 Cb 0.29 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1f2z h SER 128 CO -0.00 0.81 -0.05 -0.08 -1.14 0.00 0.00 176.83 176.36 1f2z h GLU 129 N 0.68 1.03 -0.82 3.45 4.81 -0.88 -1.31 114.58 121.54 1f2z h GLU 129 Ca 0.13 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 58.99 1f2z h GLU 129 Cb 0.49 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.75 1f2z h GLU 129 CO 0.03 1.03 0.43 0.00 -0.73 0.00 0.00 179.01 179.76 1f2z h ALA 130 N 1.00 1.21 -0.38 2.92 0.00 -0.86 -0.71 119.26 122.45 1f2z h ALA 130 Ca 0.16 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1f2z h ALA 130 Cb 0.60 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1f2z h ALA 130 CO 0.04 0.62 -0.09 0.37 0.00 0.00 0.00 179.25 180.19 1f2z h GLN 131 N 1.15 0.73 -0.67 0.00 5.75 -1.04 -1.48 115.11 119.55 1f2z h GLN 131 Ca 0.29 -0.28 -0.03 0.00 -0.15 0.00 0.00 58.65 58.47 1f2z h GLN 131 Cb 0.06 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 1f2z h GLN 131 CO -0.04 0.88 0.29 0.00 -2.65 0.00 0.00 178.83 177.30 1f2z h ALA 132 N 0.83 1.24 -0.01 3.38 0.00 -0.86 -0.98 119.26 122.86 1f2z h ALA 132 Ca 0.10 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1f2z h ALA 132 Cb 0.60 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1f2z h ALA 132 CO 0.04 0.56 0.00 0.87 0.00 0.00 0.00 179.25 180.72 1f2z h LYS 133 N 0.96 0.02 -0.95 0.00 1.57 -1.00 -1.95 116.57 115.23 1f2z h LYS 133 Ca 0.23 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 59.14 1f2z h LYS 133 Cb 0.15 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.38 1f2z h LYS 133 CO -0.02 0.24 0.60 -0.22 -0.57 0.00 0.00 179.45 179.48 1f2z h LYS 134 N -0.20 0.79 -0.01 3.15 3.64 -0.90 -0.39 116.57 122.65 1f2z h LYS 134 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1f2z h LYS 134 Cb 0.23 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1f2z h LYS 134 CO 0.00 0.52 -0.13 0.39 -2.27 0.00 0.00 179.45 177.96 1f2z n GLU 135 N -4.60 0.88 -3.66 1.90 1.02 -0.41 -4.96 120.64 110.81 1f2z n GLU 135 Ca 0.19 -0.40 -0.22 0.00 -0.02 0.00 0.00 57.16 56.71 1f2z n GLU 135 Cb 0.44 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.42 1f2z n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1f2z n LYS 136 N -0.71 -5.74 -3.15 3.49 5.02 -0.16 -4.97 118.16 111.95 1f2z n LYS 136 Ca 0.15 0.69 -0.39 0.00 -2.02 0.00 0.00 58.31 56.74 1f2z n LYS 136 Cb 0.30 -5.47 -0.05 0.00 -0.02 0.00 0.00 35.03 29.79 1f2z n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1f2z s LEU 137 N -6.76 4.43 0.00 -0.35 1.43 -0.94 -3.44 118.68 113.05 1f2z s LEU 137 Ca 0.17 1.25 0.00 0.00 -1.03 0.00 0.00 54.13 54.51 1f2z s LEU 137 Cb -0.08 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 43.13 1f2z s LEU 137 CO 0.79 0.09 0.00 0.59 0.23 0.00 0.00 176.35 178.05 1f2z n ASN 138 N 2.67 0.00 -0.32 2.29 3.02 -1.26 -0.66 115.26 121.00 1f2z n ASN 138 Ca -0.06 0.00 0.15 0.00 -0.03 0.00 0.00 54.58 54.64 1f2z n ASN 138 Cb 0.51 0.00 0.38 0.00 -0.61 0.00 0.00 39.78 40.06 1f2z n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1f2z h ILE 139 N 0.00 0.69 -0.45 2.41 2.04 -1.56 -0.81 117.51 119.83 1f2z h ILE 139 Ca 0.00 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1f2z h ILE 139 Cb 0.00 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.06 1f2z h ILE 139 CO 0.00 0.12 0.00 0.79 0.00 0.00 0.00 178.15 179.06 1f2z n TRP 140 N -4.68 0.74 1.97 1.37 7.02 0.17 -5.14 117.44 118.88 1f2z n TRP 140 Ca 0.22 -0.34 0.16 0.00 -1.02 0.00 0.00 57.50 56.53 1f2z n TRP 140 Cb 0.62 -0.06 0.92 0.00 -2.42 0.00 0.00 31.31 30.37 1f2z n TRP 140 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54