#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f0m s LEU 7 N 0.00 3.98 0.03 3.14 1.43 -1.26 -5.03 118.68 120.97 2f0m s LEU 7 Ca 0.00 2.28 0.01 0.00 -1.03 0.00 0.00 54.13 55.39 2f0m s LEU 7 Cb 0.00 -4.29 -0.02 0.00 0.03 0.00 0.00 46.19 41.91 2f0m s LEU 7 CO 0.00 -0.94 -0.06 -1.38 0.23 0.00 0.00 176.35 174.20 2f0m s HIS 8 N -1.58 0.48 0.19 0.29 -3.43 -1.26 -5.12 115.29 104.85 2f0m s HIS 8 Ca 0.65 -0.47 -0.25 0.00 -0.80 0.00 0.00 55.06 54.19 2f0m s HIS 8 Cb -0.28 -0.30 -0.08 0.00 -1.43 0.00 0.00 32.58 30.49 2f0m s HIS 8 CO 0.33 -0.12 0.78 0.15 -2.00 0.00 0.00 174.74 173.89 2f0m s LYS 9 N -1.39 4.53 0.03 -0.38 1.02 -1.26 -4.42 119.74 117.87 2f0m s LYS 9 Ca -0.11 1.13 0.05 0.00 0.02 0.00 0.00 55.97 57.06 2f0m s LYS 9 Cb -0.09 -3.18 -0.02 0.00 -0.52 0.00 0.00 37.83 34.02 2f0m s LYS 9 CO -0.00 0.53 -0.15 -1.21 -0.92 0.00 0.00 175.35 173.59 2f0m s GLU 10 N -1.33 1.05 0.73 1.68 2.02 -0.49 -4.95 118.70 117.42 2f0m s GLU 10 Ca 0.38 -0.76 -0.11 0.00 0.02 0.00 0.00 54.97 54.50 2f0m s GLU 10 Cb -0.22 -1.07 0.03 0.00 0.10 0.00 0.00 34.13 32.97 2f0m s GLU 10 CO 0.25 0.27 1.07 -1.25 0.02 0.00 0.00 175.26 175.63 2f0m s PRO 11 N -1.04 2.66 0.15 0.39 0.04 -1.26 0.53 135.00 136.47 2f0m s PRO 11 Ca 0.03 1.01 -0.19 0.00 0.04 0.00 0.00 61.00 61.89 2f0m s PRO 11 Cb -0.08 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.56 2f0m s PRO 11 CO 0.01 -1.31 0.50 0.00 0.04 0.00 0.00 177.00 176.23 2f0m s ALA 12 N -3.00 -1.20 -0.09 8.56 0.00 -0.70 -4.67 121.76 120.65 2f0m s ALA 12 Ca 0.59 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.72 2f0m s ALA 12 Cb -0.15 0.79 0.01 0.00 0.00 0.00 0.00 23.12 23.77 2f0m s ALA 12 CO 0.55 -0.71 -0.18 0.99 0.00 0.00 0.00 175.76 176.41 2f0m s THR 13 N -3.79 1.63 0.18 0.00 2.01 -0.65 -4.34 115.64 110.68 2f0m s THR 13 Ca 0.03 -0.75 -0.31 0.00 0.31 0.00 0.00 61.69 60.97 2f0m s THR 13 Cb 0.00 -1.45 -0.10 0.00 0.01 0.00 0.00 72.50 70.97 2f0m s THR 13 CO -0.11 0.47 1.51 -0.22 -0.69 0.00 0.00 174.62 175.57 2f0m s LEU 14 N 0.64 4.37 -0.21 4.42 2.96 -1.26 -0.30 118.68 129.30 2f0m s LEU 14 Ca -0.14 2.58 -0.17 0.00 -0.22 0.00 0.00 54.13 56.19 2f0m s LEU 14 Cb -0.16 -3.60 -0.08 0.00 0.50 0.00 0.00 46.19 42.85 2f0m s LEU 14 CO 0.04 -0.77 -0.35 -0.38 -1.32 0.00 0.00 176.35 173.57 2f0m n ILE 15 N 3.56 1.51 -3.69 6.68 5.41 0.65 -4.83 119.36 128.65 2f0m n ILE 15 Ca 0.12 -0.04 -0.12 0.00 1.00 0.00 0.00 62.75 63.71 2f0m n ILE 15 Cb 0.39 -2.19 -0.09 0.00 -0.71 0.00 0.00 39.64 37.04 2f0m n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2f0m s LYS 16 N -2.77 0.57 -0.08 0.38 2.20 -0.37 -5.01 119.74 114.67 2f0m s LYS 16 Ca -0.32 0.82 -0.27 0.00 -0.36 0.00 0.00 55.97 55.84 2f0m s LYS 16 Cb 0.08 0.19 -0.02 0.00 -1.51 0.00 0.00 37.83 36.57 2f0m s LYS 16 CO 0.45 -0.11 0.88 0.00 -0.36 0.00 0.00 175.35 176.21 2f0m s ALA 17 N 0.77 3.34 -0.23 3.13 0.00 -1.26 -0.07 121.76 127.44 2f0m s ALA 17 Ca -0.04 0.28 -0.04 0.00 0.00 0.00 0.00 51.96 52.17 2f0m s ALA 17 Cb -0.05 -3.24 -0.13 0.00 0.00 0.00 0.00 23.12 19.70 2f0m s ALA 17 CO -0.06 -0.38 -0.24 -0.89 0.00 0.00 0.00 175.76 174.19 2f0m n ILE 18 N 4.21 1.29 -3.75 0.00 5.41 -0.24 -4.94 119.36 121.35 2f0m n ILE 18 Ca 0.04 -0.43 -0.08 0.00 1.00 0.00 0.00 62.75 63.29 2f0m n ILE 18 Cb 0.50 -1.49 -0.01 0.00 -0.71 0.00 0.00 39.64 37.93 2f0m n ILE 18 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2f0m n ASP 19 N -3.50 -0.97 -0.07 4.38 4.64 -0.45 -4.95 116.55 115.63 2f0m n ASP 19 Ca -0.42 -2.08 0.13 0.00 -1.38 0.00 0.00 54.79 51.03 2f0m n ASP 19 Cb 0.89 1.73 0.52 0.00 -1.04 0.00 0.00 41.12 43.22 2f0m n ASP 19 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 2f0m h GLY 20 N 1.18 0.52 0.00 0.27 0.00 -1.83 -3.07 103.07 100.14 2f0m h GLY 20 Ca -0.17 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2f0m h GLY 20 CO 0.23 0.09 0.00 2.09 0.00 0.00 0.00 176.54 178.95 2f0m n ASP 21 N -4.46 1.68 -3.84 0.19 5.75 -1.26 -4.76 116.55 109.85 2f0m n ASP 21 Ca 0.10 -1.80 -0.17 0.00 -0.01 0.00 0.00 54.79 52.91 2f0m n ASP 21 Cb 0.39 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.32 2f0m n ASP 21 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2f0m s THR 22 N -0.80 0.24 0.04 2.12 2.01 -1.16 -0.82 115.64 117.27 2f0m s THR 22 Ca 0.00 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.06 2f0m s THR 22 Cb 0.00 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 2f0m s THR 22 CO 0.00 0.15 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.23 2f0m s LEU 23 N 0.92 2.20 -0.24 4.42 1.43 -0.64 -1.07 118.68 125.70 2f0m s LEU 23 Ca -0.10 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.42 2f0m s LEU 23 Cb -0.13 -0.29 -0.05 0.00 0.03 0.00 0.00 46.19 45.76 2f0m s LEU 23 CO -0.01 -0.11 0.22 -0.54 0.23 0.00 0.00 176.35 176.14 2f0m s LYS 24 N -1.29 4.07 0.12 1.70 -0.14 0.90 0.10 119.74 125.21 2f0m s LYS 24 Ca -0.05 -0.17 0.08 0.00 -1.36 0.00 0.00 55.97 54.47 2f0m s LYS 24 Cb -0.08 -3.56 -0.04 0.00 -1.68 0.00 0.00 37.83 32.47 2f0m s LYS 24 CO 0.01 -0.01 -0.20 -0.51 -0.76 0.00 0.00 175.35 173.88 2f0m s LEU 25 N 1.26 2.34 -0.40 3.17 1.43 -0.46 -0.25 118.68 125.76 2f0m s LEU 25 Ca 0.10 -0.73 -0.22 0.00 -1.03 0.00 0.00 54.13 52.24 2f0m s LEU 25 Cb -0.14 -0.84 0.01 0.00 0.03 0.00 0.00 46.19 45.25 2f0m s LEU 25 CO 0.06 0.02 0.73 -0.32 0.23 0.00 0.00 176.35 177.08 2f0m s MET 26 N -2.16 3.57 -0.16 1.70 -2.45 0.60 -0.27 119.30 120.11 2f0m s MET 26 Ca 0.09 0.04 0.00 0.00 -1.25 0.00 0.00 55.69 54.57 2f0m s MET 26 Cb -0.09 -3.87 0.03 0.00 1.25 0.00 0.00 34.83 32.16 2f0m s MET 26 CO 0.05 -0.93 -0.10 -0.47 1.05 0.00 0.00 175.02 174.61 2f0m s TYR 27 N 3.04 2.08 -1.36 4.11 5.04 0.72 -1.63 117.35 129.36 2f0m s TYR 27 Ca 0.28 -1.26 -0.03 0.00 -2.44 0.00 0.00 57.07 53.62 2f0m s TYR 27 Cb -0.13 -1.51 -0.00 0.00 0.35 0.00 0.00 41.96 40.66 2f0m s TYR 27 CO 0.19 -0.67 0.50 1.63 -1.34 0.00 0.00 175.55 175.86 2f0m n LYS 28 N 4.78 -3.19 -0.77 4.97 5.02 -1.26 -1.56 118.16 126.15 2f0m n LYS 28 Ca -0.15 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 2f0m n LYS 28 Cb 0.48 -4.53 0.00 0.00 -0.02 0.00 0.00 35.03 30.96 2f0m n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f0m n GLY 29 N -1.89 0.73 3.46 0.72 0.00 -1.26 -5.00 105.19 101.94 2f0m n GLY 29 Ca -0.28 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 2f0m n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2f0m s GLN 30 N -0.33 3.50 0.14 1.61 -1.52 -0.60 -5.09 119.66 117.37 2f0m s GLN 30 Ca 0.00 -0.58 -0.30 0.00 -1.95 0.00 0.00 55.36 52.52 2f0m s GLN 30 Cb 0.00 -2.78 -0.08 0.00 -0.22 0.00 0.00 33.01 29.93 2f0m s GLN 30 CO 0.00 0.26 1.26 -1.25 -0.25 0.00 0.00 175.29 175.31 2f0m s PRO 31 N 0.27 4.42 0.01 2.91 0.04 -1.26 -0.20 135.00 141.19 2f0m s PRO 31 Ca -0.06 1.92 -0.15 0.00 0.04 0.00 0.00 61.00 62.76 2f0m s PRO 31 Cb -0.15 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.16 2f0m s PRO 31 CO 0.04 -0.23 0.32 1.41 0.04 0.00 0.00 177.00 178.57 2f0m s MET 32 N 0.39 0.74 -0.07 4.56 1.75 0.62 -4.95 119.30 122.35 2f0m s MET 32 Ca 0.57 -0.31 -0.16 0.00 -1.25 0.00 0.00 55.69 54.54 2f0m s MET 32 Cb -0.33 0.33 -0.05 0.00 2.84 0.00 0.00 34.83 37.61 2f0m s MET 32 CO 0.34 -0.22 0.42 0.99 -0.65 0.00 0.00 175.02 175.90 2f0m s THR 33 N -1.84 5.13 -0.01 10.11 2.01 -1.26 -1.36 115.64 128.42 2f0m s THR 33 Ca -0.10 0.85 0.06 0.00 0.31 0.00 0.00 61.69 62.82 2f0m s THR 33 Cb -0.03 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 2f0m s THR 33 CO 0.01 0.44 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.83 2f0m s PHE 34 N -0.11 2.53 -0.14 4.92 0.40 0.12 -0.29 117.98 125.40 2f0m s PHE 34 Ca 0.24 -0.28 -0.01 0.00 -0.60 0.00 0.00 56.93 56.27 2f0m s PHE 34 Cb -0.15 -1.52 -0.02 0.00 0.51 0.00 0.00 43.02 41.83 2f0m s PHE 34 CO 0.11 0.15 -0.10 0.50 0.70 0.00 0.00 175.22 176.57 2f0m s ARG 35 N -0.97 3.45 0.01 0.44 6.06 0.41 -1.63 118.95 126.73 2f0m s ARG 35 Ca 0.12 -0.64 -0.30 0.00 -2.50 0.00 0.00 55.73 52.41 2f0m s ARG 35 Cb -0.10 -2.73 -0.07 0.00 0.06 0.00 0.00 34.95 32.11 2f0m s ARG 35 CO 0.02 0.18 1.66 -0.51 -2.50 0.00 0.00 175.30 174.14 2f0m s LEU 36 N 0.46 4.35 0.29 -0.88 1.43 -0.00 -2.69 118.68 121.65 2f0m s LEU 36 Ca -0.08 2.37 -0.30 0.00 -1.03 0.00 0.00 54.13 55.10 2f0m s LEU 36 Cb -0.15 -3.55 -0.12 0.00 0.03 0.00 0.00 46.19 42.40 2f0m s LEU 36 CO 0.04 -0.90 1.57 0.18 0.23 0.00 0.00 176.35 177.47 2f0m n LEU 37 N 6.31 4.25 0.00 1.79 4.77 -0.14 -3.87 117.00 130.11 2f0m n LEU 37 Ca 0.16 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.30 2f0m n LEU 37 Cb 0.42 -1.58 0.00 0.00 -2.33 0.00 0.00 43.42 39.93 2f0m n LEU 37 CO 0.63 0.08 0.00 0.18 -1.33 0.00 0.00 177.39 176.95 2f0m n LEU 38 N 2.04 0.31 -4.18 2.23 4.77 -1.26 -4.90 117.00 116.01 2f0m n LEU 38 Ca 0.08 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.84 2f0m n LEU 38 Cb 0.36 -0.87 -0.14 0.00 -2.33 0.00 0.00 43.42 40.45 2f0m n LEU 38 CO 0.64 -0.25 -0.49 0.68 -1.33 0.00 0.00 177.39 176.64 2f0m s VAL 39 N -2.23 1.34 -0.21 4.08 -7.23 -1.25 -0.35 120.40 114.55 2f0m s VAL 39 Ca 0.00 -1.05 -0.01 0.00 -1.81 0.00 0.00 61.98 59.11 2f0m s VAL 39 Cb 0.00 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.77 2f0m s VAL 39 CO 0.00 0.11 -0.11 -1.81 -0.31 0.00 0.00 175.10 172.98 2f0m s ASP 40 N -1.09 3.83 0.20 4.85 1.01 -0.34 -4.76 116.67 120.38 2f0m s ASP 40 Ca 0.04 -0.60 0.04 0.00 0.71 0.00 0.00 52.55 52.74 2f0m s ASP 40 Cb -0.08 -1.62 -0.03 0.00 1.01 0.00 0.00 42.92 42.20 2f0m s ASP 40 CO 0.01 -0.03 0.30 0.42 0.21 0.00 0.00 175.17 176.08 2f0m s THR 41 N 1.37 5.16 0.55 -1.27 -4.23 -1.26 -1.19 115.64 114.76 2f0m s THR 41 Ca 0.04 -0.92 -0.20 0.00 -1.18 0.00 0.00 61.69 59.43 2f0m s THR 41 Cb -0.14 -3.74 -0.05 0.00 1.34 0.00 0.00 72.50 69.91 2f0m s THR 41 CO -0.07 -0.23 1.19 -2.84 -0.54 0.00 0.00 174.62 172.12 2f0m s PRO 42 N -3.63 3.23 0.08 3.99 0.02 -1.26 -4.97 135.00 132.46 2f0m s PRO 42 Ca 0.34 1.78 0.05 0.00 0.02 0.00 0.00 61.00 63.19 2f0m s PRO 42 Cb -0.10 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 32.33 2f0m s PRO 42 CO 0.28 -0.99 -0.02 -1.21 -0.33 0.00 0.00 177.00 174.74 2f0m s GLU 43 N -3.18 2.51 -0.27 5.54 2.02 -1.26 -4.28 118.70 119.78 2f0m s GLU 43 Ca 0.73 -0.84 -0.07 0.00 0.02 0.00 0.00 54.97 54.81 2f0m s GLU 43 Cb -0.29 -2.51 -0.14 0.00 0.10 0.00 0.00 34.13 31.28 2f0m s GLU 43 CO 0.32 0.55 -0.28 0.25 0.02 0.00 0.00 175.26 176.12 2f0m n THR 44 N 0.72 1.52 -2.59 3.63 -2.24 -1.25 0.71 114.28 114.77 2f0m n THR 44 Ca -0.12 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.78 2f0m n THR 44 Cb 0.52 -1.69 0.01 0.00 -2.10 0.00 0.00 70.33 67.07 2f0m n THR 44 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2f0m n LYS 45 N -3.83 4.61 -3.73 -0.78 5.02 -1.26 -4.17 118.16 114.03 2f0m n LYS 45 Ca -0.50 -4.20 -0.36 0.00 -2.02 0.00 0.00 58.31 51.23 2f0m n LYS 45 Cb 0.93 -2.60 -0.07 0.00 -0.02 0.00 0.00 35.03 33.27 2f0m n LYS 45 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2f0m s HIS 46 N -2.33 3.46 0.19 2.13 2.46 -1.16 -5.00 115.29 115.03 2f0m s HIS 46 Ca 0.39 0.43 -0.23 0.00 0.47 0.00 0.00 55.06 56.11 2f0m s HIS 46 Cb 0.12 -2.15 0.09 0.00 -0.13 0.00 0.00 32.58 30.52 2f0m s HIS 46 CO -0.01 0.38 1.57 -1.35 -2.47 0.00 0.00 174.74 172.85 2f0m h PRO 47 N 6.28 -0.14 0.00 2.88 0.11 -1.93 -3.11 132.00 136.08 2f0m h PRO 47 Ca -0.44 0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.48 2f0m h PRO 47 Cb 1.17 0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 2f0m h PRO 47 CO 0.72 -0.09 -1.73 0.36 -0.21 0.00 0.00 178.00 177.04 2f0m n LYS 48 N -5.41 1.55 0.00 1.05 0.00 -1.26 -4.72 118.16 109.36 2f0m n LYS 48 Ca 0.04 0.03 0.10 0.00 -0.00 0.00 0.00 58.31 58.48 2f0m n LYS 48 Cb 0.35 -1.27 -0.05 0.00 -0.00 0.00 0.00 35.03 34.06 2f0m n LYS 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2f0m n LYS 49 N -2.58 0.03 0.00 -1.58 3.00 -1.26 -5.04 118.16 110.73 2f0m n LYS 49 Ca -0.20 -0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.09 2f0m n LYS 49 Cb 0.81 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 34.34 2f0m n LYS 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2f0m n GLY 50 N 1.50 1.47 3.45 3.14 0.00 -1.18 -4.72 105.19 108.86 2f0m n GLY 50 Ca 0.04 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 2f0m n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f0m s VAL 51 N 0.00 5.11 0.53 1.61 1.01 -1.26 -3.00 120.40 124.40 2f0m s VAL 51 Ca 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.27 2f0m s VAL 51 Cb 0.00 -4.09 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 2f0m s VAL 51 CO 0.00 -0.51 0.95 -1.61 0.00 0.00 0.00 175.10 173.93 2f0m s GLU 52 N 2.05 3.78 0.24 2.72 2.02 0.22 -4.96 118.70 124.76 2f0m s GLU 52 Ca 0.10 0.76 -0.31 0.00 0.02 0.00 0.00 54.97 55.53 2f0m s GLU 52 Cb -0.19 -2.17 -0.12 0.00 0.10 0.00 0.00 34.13 31.74 2f0m s GLU 52 CO 0.11 -0.33 1.61 1.17 0.02 0.00 0.00 175.26 177.84 2f0m n LYS 53 N -1.98 2.56 -0.36 1.61 4.81 -1.26 -0.64 118.16 122.90 2f0m n LYS 53 Ca 0.05 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.41 2f0m n LYS 53 Cb 0.54 -2.70 0.00 0.00 0.02 0.00 0.00 35.03 32.89 2f0m n LYS 53 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2f0m n TYR 54 N 2.92 0.00 0.12 5.64 4.01 -1.26 -4.81 117.16 123.78 2f0m n TYR 54 Ca 0.13 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.72 2f0m n TYR 54 Cb 0.34 -0.12 -0.08 0.00 -0.31 0.00 0.00 39.34 39.17 2f0m n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2f0m h GLY 55 N 0.00 -0.92 0.73 2.72 0.00 -1.06 0.35 103.07 104.89 2f0m h GLY 55 Ca 0.00 0.54 0.06 0.00 0.00 0.00 0.00 47.33 47.93 2f0m h GLY 55 CO 0.00 -0.27 0.60 -2.55 0.00 0.00 0.00 176.54 174.32 2f0m h PRO 56 N -0.68 1.06 -0.39 4.80 0.11 -1.87 -0.87 132.00 134.15 2f0m h PRO 56 Ca 0.01 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.00 2f0m h PRO 56 Cb 0.70 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 2f0m h PRO 56 CO -0.25 0.70 -0.01 0.93 -0.21 0.00 0.00 178.00 179.16 2f0m h GLU 57 N 1.09 0.70 -0.79 1.05 3.07 -1.83 -0.62 114.58 117.24 2f0m h GLU 57 Ca 0.41 -0.23 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2f0m h GLU 57 Cb 0.17 -0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 27.98 2f0m h GLU 57 CO -0.17 0.80 0.51 0.00 -1.40 0.00 0.00 179.01 178.74 2f0m h ALA 58 N 0.87 1.00 -0.62 3.43 0.00 0.10 -1.09 119.26 122.95 2f0m h ALA 58 Ca 0.11 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2f0m h ALA 58 Cb 0.49 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2f0m h ALA 58 CO 0.02 0.44 0.03 1.03 0.00 0.00 0.00 179.25 180.78 2f0m h SER 59 N 1.08 1.04 0.30 0.00 0.87 -1.00 -2.25 113.55 113.58 2f0m h SER 59 Ca 0.29 -0.28 -0.10 0.00 -1.23 0.00 0.00 61.79 60.47 2f0m h SER 59 Cb -0.09 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.58 2f0m h SER 59 CO -0.06 1.07 -0.41 0.00 -0.53 0.00 0.00 176.83 176.90 2f0m h ALA 60 N 1.04 1.19 0.07 6.23 0.00 -0.57 -2.17 119.26 125.05 2f0m h ALA 60 Ca 0.18 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2f0m h ALA 60 Cb 0.52 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2f0m h ALA 60 CO 0.02 0.56 -0.03 0.35 0.00 0.00 0.00 179.25 180.16 2f0m h PHE 61 N 0.13 -0.08 -0.54 0.00 3.04 -0.82 -0.93 116.94 117.73 2f0m h PHE 61 Ca 0.01 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 61.98 2f0m h PHE 61 Cb 0.78 0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.28 2f0m h PHE 61 CO 0.01 0.30 0.33 1.15 -2.02 0.00 0.00 178.31 178.08 2f0m h THR 62 N -0.49 1.07 -0.27 4.41 2.02 -1.41 -0.13 112.91 118.11 2f0m h THR 62 Ca -0.01 -0.23 0.04 0.00 0.77 0.00 0.00 66.41 66.98 2f0m h THR 62 Cb 0.42 0.36 -0.04 0.00 -1.74 0.00 0.00 68.15 67.15 2f0m h THR 62 CO 0.01 0.12 0.05 0.50 0.37 0.00 0.00 175.52 176.58 2f0m h LYS 63 N 0.66 0.15 -0.37 6.66 3.64 -1.34 -1.76 116.57 124.21 2f0m h LYS 63 Ca 0.21 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.54 2f0m h LYS 63 Cb 0.01 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2f0m h LYS 63 CO -0.09 0.10 0.04 0.87 -2.27 0.00 0.00 179.45 178.11 2f0m h LYS 64 N 0.16 0.62 -0.07 1.90 1.57 -0.83 0.92 116.57 120.84 2f0m h LYS 64 Ca 0.13 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2f0m h LYS 64 Cb 0.13 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2f0m h LYS 64 CO -0.17 0.70 -0.04 1.98 -0.57 0.00 0.00 179.45 181.35 2f0m h MET 65 N 0.46 -0.04 0.02 3.15 4.05 -0.78 -1.41 114.93 120.37 2f0m h MET 65 Ca 0.11 0.00 -0.22 0.00 -0.28 0.00 0.00 59.70 59.32 2f0m h MET 65 Cb 0.39 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.20 2f0m h MET 65 CO 0.01 -0.03 -0.95 -0.39 0.23 0.00 0.00 176.91 175.79 2f0m h VAL 66 N -0.04 1.47 -0.04 -5.77 -1.51 -1.29 -3.20 116.25 105.86 2f0m h VAL 66 Ca 0.04 -2.64 -0.10 0.00 -1.23 0.00 0.00 66.70 62.77 2f0m h VAL 66 Cb 0.10 2.52 -0.01 0.00 -2.13 0.00 0.00 31.29 31.77 2f0m h VAL 66 CO -0.10 0.77 -0.45 -0.33 -1.23 0.00 0.00 177.57 176.24 2f0m h GLU 67 N 0.14 0.09 -0.08 5.19 5.08 -0.65 -3.05 114.58 121.30 2f0m h GLU 67 Ca -0.07 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2f0m h GLU 67 Cb 1.59 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.84 2f0m h GLU 67 CO 0.15 0.52 0.00 0.09 -1.00 0.00 0.00 179.01 178.78 2f0m n ASN 68 N -4.00 1.44 -4.78 1.42 3.02 -0.55 -4.95 115.26 106.87 2f0m n ASN 68 Ca -0.02 -1.56 -0.38 0.00 -0.03 0.00 0.00 54.58 52.60 2f0m n ASN 68 Cb 0.49 -0.04 -0.06 0.00 -0.61 0.00 0.00 39.78 39.55 2f0m n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2f0m s ALA 69 N -1.91 3.25 0.12 5.41 0.00 -1.16 -4.98 121.76 122.49 2f0m s ALA 69 Ca 0.36 0.53 -0.07 0.00 0.00 0.00 0.00 51.96 52.78 2f0m s ALA 69 Cb 0.19 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 20.04 2f0m s ALA 69 CO 0.30 0.19 1.31 0.87 0.00 0.00 0.00 175.76 178.43 2f0m h LYS 70 N 3.39 0.53 -4.06 0.00 1.57 -1.92 -3.45 116.57 112.63 2f0m h LYS 70 Ca -0.46 -0.52 -0.41 0.00 -1.87 0.00 0.00 60.65 57.39 2f0m h LYS 70 Cb 1.19 0.13 -0.33 0.00 0.08 0.00 0.00 32.23 33.30 2f0m h LYS 70 CO 0.66 1.15 -0.77 0.15 -0.57 0.00 0.00 179.45 180.06 2f0m s LYS 71 N -3.43 0.82 -0.14 3.15 1.02 -1.26 -5.03 119.74 114.88 2f0m s LYS 71 Ca -0.07 -0.12 -0.00 0.00 0.02 0.00 0.00 55.97 55.79 2f0m s LYS 71 Cb 0.09 -0.82 -0.01 0.00 -0.52 0.00 0.00 37.83 36.57 2f0m s LYS 71 CO 0.88 -0.06 -0.13 0.08 -0.92 0.00 0.00 175.35 175.20 2f0m s VAL 72 N 0.81 2.99 0.08 3.17 1.01 -1.26 0.30 120.40 127.50 2f0m s VAL 72 Ca -0.11 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.25 2f0m s VAL 72 Cb -0.14 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 2f0m s VAL 72 CO 0.00 0.52 -0.16 -1.61 0.00 0.00 0.00 175.10 173.85 2f0m s GLU 73 N 0.45 0.93 -0.04 2.72 2.02 -0.10 -1.73 118.70 122.96 2f0m s GLU 73 Ca -0.10 -1.02 0.02 0.00 0.02 0.00 0.00 54.97 53.90 2f0m s GLU 73 Cb -0.16 -1.02 -0.03 0.00 0.10 0.00 0.00 34.13 33.02 2f0m s GLU 73 CO 0.05 0.23 -0.08 0.14 0.02 0.00 0.00 175.26 175.62 2f0m s VAL 74 N -1.22 3.61 -0.24 2.63 -7.23 0.19 -0.19 120.40 117.95 2f0m s VAL 74 Ca 0.01 -0.63 0.01 0.00 -1.81 0.00 0.00 61.98 59.56 2f0m s VAL 74 Cb -0.10 -2.51 0.06 0.00 0.56 0.00 0.00 36.38 34.40 2f0m s VAL 74 CO 0.03 0.51 -0.04 -0.70 -0.31 0.00 0.00 175.10 174.59 2f0m s GLU 75 N -1.05 1.56 0.39 4.82 2.12 0.68 -1.39 118.70 125.83 2f0m s GLU 75 Ca 0.14 -1.02 -0.25 0.00 0.36 0.00 0.00 54.97 54.20 2f0m s GLU 75 Cb -0.11 -2.58 -0.09 0.00 0.26 0.00 0.00 34.13 31.61 2f0m s GLU 75 CO 0.04 -0.63 1.13 -0.06 -0.54 0.00 0.00 175.26 175.20 2f0m s PHE 76 N 1.39 3.16 0.00 5.30 0.08 -1.26 -0.47 117.98 126.18 2f0m s PHE 76 Ca -0.04 1.59 0.00 0.00 0.12 0.00 0.00 56.93 58.59 2f0m s PHE 76 Cb -0.19 -3.32 0.00 0.00 -0.57 0.00 0.00 43.02 38.94 2f0m s PHE 76 CO -0.07 -1.09 0.00 -3.47 -0.10 0.00 0.00 175.22 170.49 2f0m n ASP 77 N 0.14 0.00 -1.20 1.36 -0.08 -1.26 -4.71 116.55 110.80 2f0m n ASP 77 Ca 0.04 -0.68 0.11 0.00 -1.51 0.00 0.00 54.79 52.75 2f0m n ASP 77 Cb 0.47 0.00 0.28 0.00 2.34 0.00 0.00 41.12 44.22 2f0m n ASP 77 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2f0m n LYS 78 N -0.68 2.52 0.00 -0.67 2.85 -1.26 -4.91 118.16 116.01 2f0m n LYS 78 Ca 0.00 -2.35 0.00 0.00 -1.05 0.00 0.00 58.31 54.91 2f0m n LYS 78 Cb 0.00 -1.52 0.00 0.00 -0.65 0.00 0.00 35.03 32.86 2f0m n LYS 78 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2f0m n GLY 79 N 1.55 1.98 3.77 2.58 0.00 -1.26 -4.94 105.19 108.87 2f0m n GLY 79 Ca 0.22 -1.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.02 2f0m n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2f0m s GLN 80 N 4.57 3.84 -0.00 1.61 -0.21 -1.26 -4.95 119.66 123.25 2f0m s GLN 80 Ca 0.00 2.50 0.18 0.00 0.02 0.00 0.00 55.36 58.06 2f0m s GLN 80 Cb 0.00 -2.78 -0.20 0.00 1.00 0.00 0.00 33.01 31.03 2f0m s GLN 80 CO 0.00 -0.72 0.70 0.54 -2.12 0.00 0.00 175.29 173.69 2f0m n ARG 81 N 0.05 1.09 -4.19 2.91 1.74 -1.26 -4.80 116.66 112.21 2f0m n ARG 81 Ca 0.03 -0.02 -0.16 0.00 -0.77 0.00 0.00 57.85 56.94 2f0m n ARG 81 Cb 0.41 -1.35 -0.11 0.00 -1.02 0.00 0.00 32.46 30.39 2f0m n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2f0m s THR 82 N -2.74 1.04 0.14 0.55 -4.23 -1.26 -0.19 115.64 108.96 2f0m s THR 82 Ca 0.05 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2f0m s THR 82 Cb 0.13 -1.33 0.03 0.00 1.34 0.00 0.00 72.50 72.66 2f0m s THR 82 CO 0.73 -0.47 0.20 -0.90 -0.54 0.00 0.00 174.62 173.63 2f0m n ASP 83 N 0.68 0.31 0.12 3.99 5.68 0.34 -4.90 116.55 122.77 2f0m n ASP 83 Ca -0.17 -1.25 0.11 0.00 -0.50 0.00 0.00 54.79 52.97 2f0m n ASP 83 Cb 0.57 -0.12 0.47 0.00 -1.14 0.00 0.00 41.12 40.90 2f0m n ASP 83 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2f0m n LYS 84 N -1.35 0.15 -0.16 0.11 2.85 -1.26 -1.59 118.16 116.91 2f0m n LYS 84 Ca 0.03 0.45 0.11 0.00 -1.05 0.00 0.00 58.31 57.86 2f0m n LYS 84 Cb 0.12 -1.83 0.26 0.00 -0.65 0.00 0.00 35.03 32.93 2f0m n LYS 84 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2f0m n TYR 85 N -2.13 0.42 -0.89 5.58 4.01 -1.26 -4.92 117.16 117.96 2f0m n TYR 85 Ca 0.01 -0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 2f0m n TYR 85 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 2f0m n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2f0m n GLY 86 N 1.39 0.51 3.85 2.72 0.00 -0.62 -5.04 105.19 108.01 2f0m n GLY 86 Ca 0.18 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 2f0m n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f0m s ARG 87 N -0.78 3.96 0.35 1.61 0.52 -1.26 -4.71 118.95 118.64 2f0m s ARG 87 Ca 0.00 0.48 -0.28 0.00 -0.52 0.00 0.00 55.73 55.41 2f0m s ARG 87 Cb 0.00 -2.85 -0.10 0.00 0.52 0.00 0.00 34.95 32.52 2f0m s ARG 87 CO 0.00 0.43 1.30 0.20 0.02 0.00 0.00 175.30 177.24 2f0m s GLY 88 N -1.87 2.98 -0.36 -3.53 0.00 0.60 -0.50 107.32 104.64 2f0m s GLY 88 Ca 0.41 1.24 -0.06 0.00 0.00 0.00 0.00 44.72 46.30 2f0m s GLY 88 CO 0.20 1.86 0.14 1.08 0.00 0.00 0.00 173.10 176.38 2f0m s LEU 89 N -1.96 4.57 0.30 0.66 1.43 0.73 -0.44 118.68 123.97 2f0m s LEU 89 Ca 0.51 -1.37 -0.16 0.00 -1.03 0.00 0.00 54.13 52.08 2f0m s LEU 89 Cb -0.39 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 43.98 2f0m s LEU 89 CO 0.51 -0.39 0.65 0.00 0.23 0.00 0.00 176.35 177.34 2f0m s ALA 90 N 1.35 -0.69 -0.13 4.21 0.00 -1.09 -4.34 121.76 121.05 2f0m s ALA 90 Ca 0.00 -0.65 -0.16 0.00 0.00 0.00 0.00 51.96 51.14 2f0m s ALA 90 Cb -0.21 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 2f0m s ALA 90 CO 0.01 -0.96 0.41 0.71 0.00 0.00 0.00 175.76 175.93 2f0m s TYR 91 N -3.56 3.49 -0.12 0.00 2.02 0.38 -0.97 117.35 118.59 2f0m s TYR 91 Ca 0.17 0.78 -0.02 0.00 -0.37 0.00 0.00 57.07 57.63 2f0m s TYR 91 Cb -0.04 -2.47 -0.03 0.00 -0.40 0.00 0.00 41.96 39.02 2f0m s TYR 91 CO 0.09 0.20 -0.05 0.42 -1.57 0.00 0.00 175.55 174.64 2f0m s ILE 92 N 0.55 3.78 -0.12 2.71 -1.09 -1.26 -0.23 121.20 125.54 2f0m s ILE 92 Ca 0.22 -0.42 0.01 0.00 -2.23 0.00 0.00 60.65 58.24 2f0m s ILE 92 Cb -0.14 -2.61 -0.01 0.00 -1.58 0.00 0.00 42.46 38.12 2f0m s ILE 92 CO 0.08 0.54 -0.17 -0.31 -1.23 0.00 0.00 174.94 173.85 2f0m s TYR 93 N -0.09 2.72 -0.35 3.97 1.51 0.74 -0.47 117.35 125.38 2f0m s TYR 93 Ca 0.01 -0.77 -0.05 0.00 -1.01 0.00 0.00 57.07 55.25 2f0m s TYR 93 Cb -0.13 -1.79 0.05 0.00 -0.11 0.00 0.00 41.96 39.98 2f0m s TYR 93 CO 0.03 -0.27 0.11 0.00 -1.11 0.00 0.00 175.55 174.30 2f0m s ALA 94 N 0.32 3.04 -1.46 3.71 0.00 0.32 -0.92 121.76 126.76 2f0m s ALA 94 Ca -0.13 -1.88 -0.08 0.00 0.00 0.00 0.00 51.96 49.87 2f0m s ALA 94 Cb -0.17 -2.26 0.05 0.00 0.00 0.00 0.00 23.12 20.75 2f0m s ALA 94 CO 0.07 -1.41 0.79 -0.25 0.00 0.00 0.00 175.76 174.96 2f0m n ASP 95 N 4.76 -2.80 0.00 0.00 8.00 0.15 -1.62 116.55 125.03 2f0m n ASP 95 Ca -0.11 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.54 2f0m n ASP 95 Cb 0.44 -3.70 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 2f0m n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2f0m n GLY 96 N -1.67 1.41 3.52 0.44 0.00 -1.26 -5.01 105.19 102.62 2f0m n GLY 96 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2f0m n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f0m s LYS 97 N -0.29 3.74 -0.28 1.61 1.02 -0.64 -5.05 119.74 119.84 2f0m s LYS 97 Ca 0.00 -0.47 -0.29 0.00 0.02 0.00 0.00 55.97 55.23 2f0m s LYS 97 Cb 0.00 -3.03 -0.01 0.00 -0.52 0.00 0.00 37.83 34.27 2f0m s LYS 97 CO 0.00 0.20 1.39 1.41 -0.92 0.00 0.00 175.35 177.43 2f0m s MET 98 N 0.52 3.87 0.22 1.68 -2.45 -1.26 -0.52 119.30 121.35 2f0m s MET 98 Ca -0.01 1.35 -0.08 0.00 -1.25 0.00 0.00 55.69 55.70 2f0m s MET 98 Cb -0.14 -3.93 0.30 0.00 1.25 0.00 0.00 34.83 32.31 2f0m s MET 98 CO 0.02 -1.18 1.77 0.28 1.05 0.00 0.00 175.02 176.96 2f0m h VAL 99 N 6.02 0.82 -0.90 10.11 2.07 -1.14 -1.53 116.25 131.71 2f0m h VAL 99 Ca -0.28 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.10 2f0m h VAL 99 Cb 1.11 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 2f0m h VAL 99 CO 1.03 0.09 0.58 0.78 0.02 0.00 0.00 177.57 180.07 2f0m h ASN 100 N 0.52 0.96 -0.01 0.57 4.21 -1.91 -1.98 115.58 117.95 2f0m h ASN 100 Ca 0.32 -0.01 -0.22 0.00 1.21 0.00 0.00 56.30 57.61 2f0m h ASN 100 Cb 0.36 -0.21 0.01 0.00 -1.12 0.00 0.00 38.32 37.35 2f0m h ASN 100 CO -0.27 0.65 -0.82 -0.08 -1.29 0.00 0.00 177.43 175.62 2f0m h GLU 101 N 1.12 0.67 -0.82 0.81 4.22 -1.82 -2.91 114.58 115.85 2f0m h GLU 101 Ca 0.36 -0.58 0.06 0.00 0.08 0.00 0.00 59.36 59.28 2f0m h GLU 101 Cb 0.02 0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 2f0m h GLU 101 CO -0.12 1.20 0.51 0.00 -2.18 0.00 0.00 179.01 178.41 2f0m h ALA 102 N 0.63 1.13 -0.73 2.92 0.00 -0.85 0.33 119.26 122.68 2f0m h ALA 102 Ca -0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2f0m h ALA 102 Cb 1.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2f0m h ALA 102 CO 0.16 0.24 0.37 -0.07 0.00 0.00 0.00 179.25 179.95 2f0m h LEU 103 N 0.92 0.94 -0.19 0.00 -0.00 -1.33 -1.15 115.31 114.51 2f0m h LEU 103 Ca 0.36 -0.12 -0.06 0.00 -0.00 0.00 0.00 57.88 58.06 2f0m h LEU 103 Cb 0.17 -0.24 -0.00 0.00 -0.00 0.00 0.00 40.66 40.58 2f0m h LEU 103 CO -0.17 0.80 -0.12 0.58 -0.00 0.00 0.00 178.44 179.52 2f0m h VAL 104 N 1.02 1.32 -0.36 1.22 2.07 -1.19 0.14 116.25 120.46 2f0m h VAL 104 Ca 0.25 -1.22 0.01 0.00 0.82 0.00 0.00 66.70 66.57 2f0m h VAL 104 Cb 0.09 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 2f0m h VAL 104 CO -0.04 0.37 0.24 -0.09 0.02 0.00 0.00 177.57 178.07 2f0m h ARG 105 N 0.10 0.44 -0.09 1.57 9.65 -0.09 -0.70 114.38 125.26 2f0m h ARG 105 Ca 0.04 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2f0m h ARG 105 Cb 0.63 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 2f0m h ARG 105 CO 0.03 0.29 0.00 1.04 2.80 0.00 0.00 179.97 184.14 2f0m n GLN 106 N -4.48 1.46 -1.17 0.20 1.13 -0.46 -4.42 117.38 109.64 2f0m n GLN 106 Ca 0.03 -0.70 -0.06 0.00 -1.94 0.00 0.00 57.00 54.33 2f0m n GLN 106 Cb 0.09 -1.38 -0.02 0.00 0.11 0.00 0.00 30.24 29.04 2f0m n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2f0m n GLY 107 N 1.02 0.82 1.09 1.08 0.00 -0.27 -4.52 105.19 104.41 2f0m n GLY 107 Ca 0.16 -0.73 0.09 0.00 0.00 0.00 0.00 46.02 45.54 2f0m n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f0m n LEU 108 N -0.66 3.70 -3.46 0.99 4.77 0.01 -2.00 117.00 120.36 2f0m n LEU 108 Ca -0.06 -2.14 -0.14 0.00 -0.03 0.00 0.00 56.01 53.64 2f0m n LEU 108 Cb 0.20 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 2f0m n LEU 108 CO 0.09 0.84 0.42 0.00 -1.33 0.00 0.00 177.39 177.41 2f0m s ALA 109 N -1.26 -1.66 0.13 -1.18 0.00 -1.14 -4.35 121.76 112.30 2f0m s ALA 109 Ca 0.39 0.78 0.06 0.00 0.00 0.00 0.00 51.96 53.19 2f0m s ALA 109 Cb 0.22 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 2f0m s ALA 109 CO 0.24 -0.64 0.01 0.15 0.00 0.00 0.00 175.76 175.52 2f0m s LYS 110 N -2.89 2.49 0.07 0.00 1.02 -0.34 -4.53 119.74 115.56 2f0m s LYS 110 Ca -0.03 -0.96 -0.31 0.00 0.02 0.00 0.00 55.97 54.69 2f0m s LYS 110 Cb -0.01 -2.46 -0.07 0.00 -0.52 0.00 0.00 37.83 34.77 2f0m s LYS 110 CO -0.05 0.50 1.39 0.08 -0.92 0.00 0.00 175.35 176.34 2f0m s VAL 111 N -1.51 3.49 0.93 3.17 1.01 -1.26 -1.20 120.40 125.02 2f0m s VAL 111 Ca 0.27 1.01 -0.12 0.00 0.00 0.00 0.00 61.98 63.14 2f0m s VAL 111 Cb -0.11 -3.65 0.15 0.00 0.00 0.00 0.00 36.38 32.78 2f0m s VAL 111 CO 0.19 0.05 1.09 0.00 0.00 0.00 0.00 175.10 176.42 2f0m s ALA 112 N 1.60 1.31 0.15 5.51 0.00 0.53 -4.82 121.76 126.04 2f0m s ALA 112 Ca 0.64 -0.07 -0.31 0.00 0.00 0.00 0.00 51.96 52.22 2f0m s ALA 112 Cb -0.35 -3.20 -0.11 0.00 0.00 0.00 0.00 23.12 19.47 2f0m s ALA 112 CO 0.29 -2.55 1.76 -0.47 0.00 0.00 0.00 175.76 174.79 2f0m s TYR 113 N -2.89 2.48 -0.11 0.00 6.14 -1.26 -4.93 117.35 116.78 2f0m s TYR 113 Ca 0.64 0.18 -0.09 0.00 0.64 0.00 0.00 57.07 58.44 2f0m s TYR 113 Cb -0.19 -4.12 -0.04 0.00 0.42 0.00 0.00 41.96 38.03 2f0m s TYR 113 CO 0.58 -4.46 0.19 0.08 0.64 0.00 0.00 175.55 172.57 2f0m s VAL 114 N 2.13 5.41 -0.30 3.14 1.01 -1.26 -4.95 120.40 125.57 2f0m s VAL 114 Ca 0.77 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 63.06 2f0m s VAL 114 Cb -0.46 -3.47 0.05 0.00 0.00 0.00 0.00 36.38 32.50 2f0m s VAL 114 CO 0.34 0.58 0.01 -0.31 0.00 0.00 0.00 175.10 175.71 2f0m s TYR 115 N -0.77 3.29 0.42 5.22 2.02 -1.26 -5.06 117.35 121.21 2f0m s TYR 115 Ca 0.15 -1.94 -0.26 0.00 -0.37 0.00 0.00 57.07 54.66 2f0m s TYR 115 Cb -0.13 -2.17 -0.09 0.00 -0.40 0.00 0.00 41.96 39.17 2f0m s TYR 115 CO 0.05 -0.82 1.36 1.63 -1.57 0.00 0.00 175.55 176.19 2f0m n LYS 116 N 4.61 2.14 -0.53 -0.62 5.02 -1.26 0.42 118.16 127.94 2f0m n LYS 116 Ca -0.12 0.76 0.06 0.00 -2.02 0.00 0.00 58.31 56.98 2f0m n LYS 116 Cb 0.43 -2.50 0.27 0.00 -0.02 0.00 0.00 35.03 33.20 2f0m n LYS 116 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2f0m n PRO 117 N 0.02 3.30 -2.56 1.97 -0.04 -1.26 -5.01 135.00 131.41 2f0m n PRO 117 Ca 0.05 -2.10 -0.43 0.00 -0.04 0.00 0.00 63.50 60.98 2f0m n PRO 117 Cb 0.40 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 2f0m n PRO 117 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2f0m n ASN 118 N 0.60 5.10 -0.67 3.54 3.02 0.17 -4.30 115.26 122.71 2f0m n ASN 118 Ca 0.19 -3.05 -0.00 0.00 -0.03 0.00 0.00 54.58 51.69 2f0m n ASN 118 Cb 0.78 -1.53 -0.00 0.00 -0.61 0.00 0.00 39.78 38.42 2f0m n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2f0m n ASN 119 N 4.74 0.05 -0.18 6.41 0.23 -1.26 -4.32 115.26 120.92 2f0m n ASN 119 Ca 0.39 -1.69 -0.02 0.00 -0.53 0.00 0.00 54.58 52.73 2f0m n ASN 119 Cb 0.39 -0.11 0.08 0.00 -2.08 0.00 0.00 39.78 38.06 2f0m n ASN 119 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2f0m h THR 120 N 6.21 0.87 -0.54 5.53 2.02 -1.97 -2.16 112.91 122.88 2f0m h THR 120 Ca -0.08 -0.16 -0.10 0.00 0.77 0.00 0.00 66.41 66.85 2f0m h THR 120 Cb 1.34 0.37 -0.06 0.00 -1.74 0.00 0.00 68.15 68.06 2f0m h THR 120 CO -0.01 0.08 0.12 1.41 0.37 0.00 0.00 175.52 177.50 2f0m n HIS 121 N -4.93 1.85 -0.32 3.16 8.25 -1.26 -4.53 115.22 117.43 2f0m n HIS 121 Ca 0.06 -0.81 -0.03 0.00 -0.26 0.00 0.00 57.72 56.68 2f0m n HIS 121 Cb 0.20 -0.52 0.09 0.00 1.12 0.00 0.00 29.99 30.88 2f0m n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2f0m h GLU 122 N 2.63 1.13 -0.29 -0.41 4.81 -1.77 -2.22 114.58 118.45 2f0m h GLU 122 Ca 0.12 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.16 2f0m h GLU 122 Cb 1.88 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 2f0m h GLU 122 CO 0.51 0.75 -0.30 1.96 -0.73 0.00 0.00 179.01 181.20 2f0m h GLN 123 N 1.16 0.72 -0.23 1.92 1.08 -1.82 0.31 115.11 118.26 2f0m h GLN 123 Ca 0.32 -0.38 0.06 0.00 -1.45 0.00 0.00 58.65 57.20 2f0m h GLN 123 Cb -0.11 0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 27.26 2f0m h GLN 123 CO -0.08 1.00 -0.30 1.25 -0.95 0.00 0.00 178.83 179.75 2f0m h HIS 124 N 0.46 -0.83 -0.89 2.96 2.76 -1.85 0.11 115.15 117.87 2f0m h HIS 124 Ca 0.05 0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 2f0m h HIS 124 Cb 0.87 0.40 -0.04 0.00 1.55 0.00 0.00 27.41 30.19 2f0m h HIS 124 CO 0.07 -0.38 0.49 -0.07 -1.30 0.00 0.00 177.93 176.75 2f0m h LEU 125 N -0.32 1.12 -0.97 0.26 3.38 -1.30 -0.14 115.31 117.34 2f0m h LEU 125 Ca 0.13 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2f0m h LEU 125 Cb 0.52 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2f0m h LEU 125 CO -0.41 0.90 0.08 0.03 0.09 0.00 0.00 178.44 179.13 2f0m h ARG 126 N 1.25 0.83 -0.52 1.13 3.08 -0.16 0.78 114.38 120.77 2f0m h ARG 126 Ca 0.31 -0.19 -0.10 0.00 0.07 0.00 0.00 59.98 60.07 2f0m h ARG 126 Cb 0.03 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 2f0m h ARG 126 CO -0.05 0.78 -0.08 0.87 -1.07 0.00 0.00 179.97 180.42 2f0m h LYS 127 N 0.79 0.96 0.00 0.04 1.57 -0.12 -1.48 116.57 118.34 2f0m h LYS 127 Ca 0.17 -0.33 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 2f0m h LYS 127 Cb 0.36 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2f0m h LYS 127 CO 0.01 1.00 -0.39 0.77 -0.57 0.00 0.00 179.45 180.27 2f0m h SER 128 N 0.86 0.00 -0.16 0.86 0.02 -0.09 -2.98 113.55 112.06 2f0m h SER 128 Ca 0.14 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.02 2f0m h SER 128 Cb 0.62 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 2f0m h SER 128 CO 0.04 0.39 -0.17 -0.08 -1.14 0.00 0.00 176.83 175.86 2f0m h GLU 129 N 0.00 0.40 -0.67 3.45 4.81 -0.13 -2.15 114.58 120.28 2f0m h GLU 129 Ca -0.00 -0.22 0.14 0.00 -0.13 0.00 0.00 59.36 59.15 2f0m h GLU 129 Cb 0.69 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.98 2f0m h GLU 129 CO 0.05 0.78 0.10 0.00 -0.73 0.00 0.00 179.01 179.21 2f0m h ALA 130 N 0.61 0.78 0.10 2.92 0.00 -1.29 -1.75 119.26 120.62 2f0m h ALA 130 Ca 0.02 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2f0m h ALA 130 Cb 0.72 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2f0m h ALA 130 CO 0.04 -0.36 -0.11 0.37 0.00 0.00 0.00 179.25 179.20 2f0m h GLN 131 N 0.20 -0.22 -0.76 0.00 5.75 -1.44 -0.68 115.11 117.96 2f0m h GLN 131 Ca 0.37 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.88 2f0m h GLN 131 Cb 0.61 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.17 2f0m h GLN 131 CO -0.51 -0.15 0.48 0.00 -2.65 0.00 0.00 178.83 176.00 2f0m h ALA 132 N 0.65 1.41 0.02 3.38 0.00 -1.05 0.18 119.26 123.84 2f0m h ALA 132 Ca 0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2f0m h ALA 132 Cb 0.23 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2f0m h ALA 132 CO -0.03 0.53 -0.01 -0.22 0.00 0.00 0.00 179.25 179.52 2f0m h LYS 133 N 1.04 -0.02 -0.84 0.00 3.64 -1.24 0.98 116.57 120.12 2f0m h LYS 133 Ca 0.28 0.00 0.15 0.00 -1.27 0.00 0.00 60.65 59.81 2f0m h LYS 133 Cb -0.07 0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 31.65 2f0m h LYS 133 CO -0.05 0.22 0.42 -0.22 -2.27 0.00 0.00 179.45 177.54 2f0m h LYS 134 N -0.26 0.56 -0.00 1.90 3.64 -0.70 0.16 116.57 121.87 2f0m h LYS 134 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2f0m h LYS 134 Cb 0.25 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2f0m h LYS 134 CO 0.00 0.37 0.00 0.39 -2.27 0.00 0.00 179.45 177.95 2f0m n GLU 135 N -4.90 1.09 -3.82 1.90 1.02 0.61 -4.91 120.64 111.63 2f0m n GLU 135 Ca 0.17 -0.13 -0.28 0.00 -0.02 0.00 0.00 57.16 56.91 2f0m n GLU 135 Cb 0.46 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.42 2f0m n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2f0m n LYS 136 N -0.84 -6.03 -3.07 3.49 5.02 0.56 -4.93 118.16 112.36 2f0m n LYS 136 Ca 0.23 0.65 -0.39 0.00 -2.02 0.00 0.00 58.31 56.78 2f0m n LYS 136 Cb 0.14 -5.55 -0.05 0.00 -0.02 0.00 0.00 35.03 29.55 2f0m n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2f0m s LEU 137 N -7.22 4.43 0.00 -0.35 1.43 -0.64 -3.13 118.68 113.20 2f0m s LEU 137 Ca 0.57 1.33 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 2f0m s LEU 137 Cb -0.28 -3.11 0.00 0.00 0.03 0.00 0.00 46.19 42.83 2f0m s LEU 137 CO 0.81 0.04 0.00 0.59 0.23 0.00 0.00 176.35 178.01 2f0m n ASN 138 N 2.84 0.00 -0.42 2.29 3.02 -1.26 -0.71 115.26 121.02 2f0m n ASN 138 Ca -0.04 0.00 0.36 0.00 -0.03 0.00 0.00 54.58 54.87 2f0m n ASN 138 Cb 0.51 0.00 0.68 0.00 -0.61 0.00 0.00 39.78 40.36 2f0m n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2f0m h ILE 139 N 0.00 0.30 -0.02 2.41 2.04 -1.72 0.05 117.51 120.58 2f0m h ILE 139 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.82 2f0m h ILE 139 Cb 0.00 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 2f0m h ILE 139 CO 0.00 0.02 -0.06 0.79 0.00 0.00 0.00 178.15 178.90 2f0m n TRP 140 N -4.37 0.00 1.57 1.37 5.03 0.11 -5.14 117.44 116.01 2f0m n TRP 140 Ca 0.31 0.00 0.14 0.00 3.03 0.00 0.00 57.50 60.99 2f0m n TRP 140 Cb 1.33 -0.02 0.58 0.00 -1.03 0.00 0.00 31.31 32.18 2f0m n TRP 140 CO 0.00 0.00 0.00 -1.13 -0.03 0.00 0.00 177.69 176.53