#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtf s ARG 8 N 0.00 3.65 -1.17 1.20 1.70 -1.26 -4.93 118.95 118.14 2jtf s ARG 8 Ca 0.00 1.06 -0.21 0.00 -0.47 0.00 0.00 55.73 56.12 2jtf s ARG 8 Cb 0.00 -4.00 0.02 0.00 -0.57 0.00 0.00 34.95 30.40 2jtf s ARG 8 CO 0.00 -1.47 1.72 -2.14 -1.08 0.00 0.00 175.30 172.33 2jtf s PRO 9 N 4.80 3.47 0.75 3.89 0.02 -1.26 -4.81 135.00 141.85 2jtf s PRO 9 Ca 0.62 -1.45 -0.06 0.00 0.02 0.00 0.00 61.00 60.13 2jtf s PRO 9 Cb -0.15 -5.39 0.11 0.00 0.02 0.00 0.00 34.50 29.08 2jtf s PRO 9 CO 0.30 -2.67 1.05 0.20 -0.33 0.00 0.00 177.00 175.56 2jtf s GLY 10 N 5.21 1.74 -0.58 0.52 0.00 -1.26 -2.71 107.32 110.24 2jtf s GLY 10 Ca 0.56 -1.26 -0.34 0.00 0.00 0.00 0.00 44.72 43.67 2jtf s GLY 10 CO 0.03 -0.75 2.35 1.39 0.00 0.00 0.00 173.10 176.13 2jtf n ILE 11 N -3.01 0.06 1.51 0.90 5.41 -0.83 -4.09 119.36 119.31 2jtf n ILE 11 Ca 0.12 -0.22 0.14 0.00 1.00 0.00 0.00 62.75 63.78 2jtf n ILE 11 Cb 0.60 -1.29 0.54 0.00 -0.71 0.00 0.00 39.64 38.78 2jtf n ILE 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2jtf n THR 12 N 7.27 0.00 -1.91 1.39 -1.04 -0.91 -1.87 114.28 117.22 2jtf n THR 12 Ca 0.50 -0.24 -0.16 0.00 -2.04 0.00 0.00 64.05 62.11 2jtf n THR 12 Cb 0.17 0.47 -0.04 0.00 -1.82 0.00 0.00 70.33 69.12 2jtf n THR 12 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2jtf n PHE 13 N 0.15 -0.40 -4.84 -1.42 3.72 -1.26 -5.00 117.46 108.41 2jtf n PHE 13 Ca 0.19 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.34 2jtf n PHE 13 Cb 0.35 -3.02 -0.15 0.00 -0.94 0.00 0.00 39.48 35.72 2jtf n PHE 13 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2jtf s GLU 14 N -4.11 1.48 -0.04 -1.08 2.02 -1.26 -5.08 118.70 110.63 2jtf s GLU 14 Ca 0.00 -0.62 -0.30 0.00 0.02 0.00 0.00 54.97 54.07 2jtf s GLU 14 Cb 0.00 -1.40 -0.05 0.00 0.10 0.00 0.00 34.13 32.78 2jtf s GLU 14 CO 0.00 0.35 1.48 0.42 0.02 0.00 0.00 175.26 177.54 2jtf s ILE 15 N -0.33 3.72 0.00 -1.63 1.01 -1.26 -1.27 121.20 121.43 2jtf s ILE 15 Ca 0.05 1.00 0.00 0.00 0.00 0.00 0.00 60.65 61.70 2jtf s ILE 15 Cb -0.08 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.75 2jtf s ILE 15 CO -0.00 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.50 2jtf n GLY 16 N 3.83 2.17 3.94 6.18 0.00 0.83 -5.03 105.19 117.11 2jtf n GLY 16 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 2jtf n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jtf s ALA 17 N -2.49 3.16 0.39 4.61 0.00 -0.40 -4.73 121.76 122.29 2jtf s ALA 17 Ca 0.00 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.95 2jtf s ALA 17 Cb 0.00 -2.53 -0.01 0.00 0.00 0.00 0.00 23.12 20.58 2jtf s ALA 17 CO 0.00 -1.40 0.56 1.03 0.00 0.00 0.00 175.76 175.95 2jtf s ARG 18 N -5.28 3.07 0.07 0.00 0.52 -1.26 0.11 118.95 116.18 2jtf s ARG 18 Ca 0.62 -0.80 -0.01 0.00 -0.52 0.00 0.00 55.73 55.03 2jtf s ARG 18 Cb -0.10 -2.71 -0.04 0.00 0.52 0.00 0.00 34.95 32.63 2jtf s ARG 18 CO 0.45 -0.10 -0.02 -0.48 0.02 0.00 0.00 175.30 175.17 2jtf s LEU 19 N -4.35 2.40 -0.32 2.53 -0.00 0.15 -2.14 118.68 116.95 2jtf s LEU 19 Ca 0.47 -1.03 -0.11 0.00 -0.00 0.00 0.00 54.13 53.46 2jtf s LEU 19 Cb -0.10 0.18 -0.01 0.00 -0.00 0.00 0.00 46.19 46.26 2jtf s LEU 19 CO 0.34 -0.60 0.19 -0.70 -0.00 0.00 0.00 176.35 175.58 2jtf s GLU 20 N -3.93 3.44 -0.14 1.48 2.12 -0.66 0.04 118.70 121.05 2jtf s GLU 20 Ca 0.10 -0.66 -0.00 0.00 0.36 0.00 0.00 54.97 54.76 2jtf s GLU 20 Cb 0.08 -3.66 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 2jtf s GLU 20 CO -0.08 -0.41 -0.13 0.00 -0.54 0.00 0.00 175.26 174.10 2jtf s ALA 21 N 1.66 2.62 -0.93 6.30 0.00 -0.52 0.22 121.76 131.10 2jtf s ALA 21 Ca 0.05 -0.92 -0.19 0.00 0.00 0.00 0.00 51.96 50.90 2jtf s ALA 21 Cb -0.17 -1.24 0.12 0.00 0.00 0.00 0.00 23.12 21.83 2jtf s ALA 21 CO 0.08 0.18 1.16 -1.17 0.00 0.00 0.00 175.76 176.01 2jtf s LEU 22 N 0.46 4.88 0.00 0.00 0.20 0.17 -0.74 118.68 123.65 2jtf s LEU 22 Ca -0.09 -1.96 -0.09 0.00 0.69 0.00 0.00 54.13 52.68 2jtf s LEU 22 Cb -0.16 -2.42 0.04 0.00 -0.43 0.00 0.00 46.19 43.22 2jtf s LEU 22 CO 0.05 -1.12 0.62 -0.67 -0.29 0.00 0.00 176.35 174.94 2jtf n ASP 23 N 6.82 -1.78 0.00 3.68 -0.08 -0.34 -4.75 116.55 120.10 2jtf n ASP 23 Ca 0.24 -2.56 0.00 0.00 -1.51 0.00 0.00 54.79 50.97 2jtf n ASP 23 Cb 0.49 3.06 0.00 0.00 2.34 0.00 0.00 41.12 47.01 2jtf n ASP 23 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jtf n TYR 24 N -0.50 0.00 0.77 -0.67 9.36 -1.26 0.81 117.16 125.67 2jtf n TYR 24 Ca -0.05 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.25 2jtf n TYR 24 Cb 0.54 0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 39.17 2jtf n TYR 24 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2jtf n LEU 25 N 0.00 0.95 -1.37 2.98 7.99 -1.26 -4.94 117.00 121.35 2jtf n LEU 25 Ca 0.00 -0.55 -0.09 0.00 -0.01 0.00 0.00 56.01 55.36 2jtf n LEU 25 Cb 0.00 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 43.32 2jtf n LEU 25 CO 0.00 0.22 0.00 0.00 -1.51 0.00 0.00 177.39 176.10 2jtf n GLN 26 N -1.15 -2.00 -4.05 3.23 3.00 0.24 -5.02 117.38 111.63 2jtf n GLN 26 Ca 0.04 0.37 -0.29 0.00 -0.01 0.00 0.00 57.00 57.11 2jtf n GLN 26 Cb 0.28 -4.10 -0.06 0.00 0.00 0.00 0.00 30.24 26.35 2jtf n GLN 26 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2jtf s LYS 27 N -5.00 2.94 -1.09 -1.09 1.02 -0.84 -4.67 119.74 111.00 2jtf s LYS 27 Ca 0.12 -0.74 -0.14 0.00 0.02 0.00 0.00 55.97 55.23 2jtf s LYS 27 Cb -0.05 -2.72 0.18 0.00 -0.52 0.00 0.00 37.83 34.72 2jtf s LYS 27 CO 0.15 0.53 1.25 -1.58 -0.92 0.00 0.00 175.35 174.78 2jtf s TRP 28 N -1.55 3.56 -0.15 3.18 0.52 -1.25 -1.19 118.94 122.06 2jtf s TRP 28 Ca 0.30 -2.03 -0.07 0.00 0.02 0.00 0.00 56.10 54.32 2jtf s TRP 28 Cb -0.11 -4.19 -0.04 0.00 -1.15 0.00 0.00 33.47 27.98 2jtf s TRP 28 CO 0.23 -1.31 0.11 1.52 0.02 0.00 0.00 176.95 177.52 2jtf s TYR 29 N 1.27 3.44 -0.09 -1.98 -0.85 0.08 -4.72 117.35 114.50 2jtf s TYR 29 Ca 0.36 0.36 -0.31 0.00 -0.52 0.00 0.00 57.07 56.96 2jtf s TYR 29 Cb -0.05 -2.01 -0.09 0.00 0.38 0.00 0.00 41.96 40.19 2jtf s TYR 29 CO -0.04 0.49 2.02 -2.30 -1.52 0.00 0.00 175.55 174.20 2jtf n PRO 30 N 2.68 2.30 -4.34 -3.49 -0.02 -1.26 -1.44 135.00 129.43 2jtf n PRO 30 Ca -0.18 0.79 -0.25 0.00 -2.02 0.00 0.00 63.50 61.85 2jtf n PRO 30 Cb 0.54 -2.90 -0.09 0.00 -0.02 0.00 0.00 33.50 31.03 2jtf n PRO 30 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2jtf s SER 31 N 5.46 4.17 0.13 2.55 0.01 0.11 -4.19 113.70 121.94 2jtf s SER 31 Ca 0.95 -0.98 0.05 0.00 1.31 0.00 0.00 55.95 57.27 2jtf s SER 31 Cb -0.53 -0.53 -0.04 0.00 0.21 0.00 0.00 66.02 65.13 2jtf s SER 31 CO 0.44 -0.22 0.05 -0.13 0.41 0.00 0.00 173.24 173.79 2jtf s ARG 32 N -3.71 2.67 -0.36 12.44 0.52 0.89 0.31 118.95 131.72 2jtf s ARG 32 Ca 0.34 -0.89 -0.17 0.00 -0.52 0.00 0.00 55.73 54.50 2jtf s ARG 32 Cb -0.00 -2.56 -0.00 0.00 0.52 0.00 0.00 34.95 32.90 2jtf s ARG 32 CO 0.19 0.51 0.46 0.42 0.02 0.00 0.00 175.30 176.90 2jtf s ILE 33 N -1.55 5.07 -0.12 1.52 1.01 0.12 0.55 121.20 127.80 2jtf s ILE 33 Ca 0.28 0.16 0.16 0.00 0.00 0.00 0.00 60.65 61.25 2jtf s ILE 33 Cb -0.11 -3.93 -0.24 0.00 0.01 0.00 0.00 42.46 38.20 2jtf s ILE 33 CO 0.20 -0.20 0.40 1.21 0.00 0.00 0.00 174.94 176.55 2jtf n GLU 34 N 5.62 0.66 -3.81 2.79 4.07 -0.25 -0.12 120.64 129.59 2jtf n GLU 34 Ca -0.06 0.14 -0.09 0.00 -0.06 0.00 0.00 57.16 57.08 2jtf n GLU 34 Cb 0.49 -1.66 -0.06 0.00 -0.06 0.00 0.00 31.44 30.14 2jtf n GLU 34 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2jtf s LYS 35 N -2.60 0.99 -0.01 5.31 -0.14 -1.24 -4.76 119.74 117.29 2jtf s LYS 35 Ca -0.07 -0.93 -0.01 0.00 -1.36 0.00 0.00 55.97 53.60 2jtf s LYS 35 Cb 0.07 0.39 0.01 0.00 -1.68 0.00 0.00 37.83 36.62 2jtf s LYS 35 CO 0.83 -0.36 0.03 0.42 -0.76 0.00 0.00 175.35 175.51 2jtf s ILE 36 N -3.87 -0.02 -0.18 2.17 1.01 -1.26 0.21 121.20 119.26 2jtf s ILE 36 Ca 0.07 0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.79 2jtf s ILE 36 Cb 0.03 -0.05 0.02 0.00 0.01 0.00 0.00 42.46 42.47 2jtf s ILE 36 CO -0.09 0.02 -0.19 -0.62 0.00 0.00 0.00 174.94 174.07 2jtf s ASP 37 N 0.29 3.18 -0.08 3.58 -1.08 0.41 -4.97 116.67 118.00 2jtf s ASP 37 Ca -0.02 -0.68 0.20 0.00 -0.52 0.00 0.00 52.55 51.52 2jtf s ASP 37 Cb -0.03 -1.46 -0.28 0.00 -1.46 0.00 0.00 42.92 39.68 2jtf s ASP 37 CO -0.01 -0.02 0.37 -1.22 0.52 0.00 0.00 175.17 174.81 2jtf n TYR 38 N 4.62 0.09 0.27 -5.34 4.02 -1.26 0.48 117.16 120.04 2jtf n TYR 38 Ca -0.20 0.03 -0.17 0.00 -0.01 0.00 0.00 57.90 57.55 2jtf n TYR 38 Cb 0.50 -0.73 -0.08 0.00 -0.02 0.00 0.00 39.34 39.00 2jtf n TYR 38 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 2jtf h GLU 39 N 0.00 -0.83 0.08 -0.72 4.81 -1.94 -2.96 114.58 113.02 2jtf h GLU 39 Ca -0.21 0.06 -0.28 0.00 -0.13 0.00 0.00 59.36 58.79 2jtf h GLU 39 Cb 1.49 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 31.05 2jtf h GLU 39 CO 0.01 -0.55 -1.41 1.49 -0.73 0.00 0.00 179.01 177.82 2jtf h GLU 40 N -0.86 0.17 -2.24 1.92 4.57 -2.01 -3.48 114.58 112.65 2jtf h GLU 40 Ca -0.05 -0.29 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 2jtf h GLU 40 Cb 0.74 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 2jtf h GLU 40 CO -0.03 1.03 0.00 0.41 -1.18 0.00 0.00 179.01 179.24 2jtf n GLY 41 N 1.57 0.30 3.24 1.92 0.00 -0.74 -5.00 105.19 106.47 2jtf n GLY 41 Ca -0.12 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 2jtf n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jtf s LYS 42 N -2.75 1.16 0.06 1.61 1.02 0.18 -3.09 119.74 117.94 2jtf s LYS 42 Ca 0.00 -1.59 0.02 0.00 0.02 0.00 0.00 55.97 54.42 2jtf s LYS 42 Cb 0.00 -0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.21 2jtf s LYS 42 CO 0.00 -0.24 -0.07 0.00 -0.92 0.00 0.00 175.35 174.11 2jtf s MET 43 N -4.01 0.64 -0.74 1.68 0.23 0.98 -0.45 119.30 117.62 2jtf s MET 43 Ca 0.30 -0.97 -0.22 0.00 -1.03 0.00 0.00 55.69 53.77 2jtf s MET 43 Cb 0.07 -0.26 0.08 0.00 -1.53 0.00 0.00 34.83 33.19 2jtf s MET 43 CO 0.07 0.03 1.03 -1.17 -2.03 0.00 0.00 175.02 172.95 2jtf s LEU 44 N -2.12 4.48 -0.32 0.18 1.98 0.13 -1.38 118.68 121.63 2jtf s LEU 44 Ca -0.02 -1.25 -0.28 0.00 -2.89 0.00 0.00 54.13 49.69 2jtf s LEU 44 Cb -0.04 -2.42 0.01 0.00 0.66 0.00 0.00 46.19 44.40 2jtf s LEU 44 CO -0.02 -1.36 1.00 0.54 -1.89 0.00 0.00 176.35 174.62 2jtf s VAL 45 N 3.81 4.59 -0.84 1.68 0.11 0.12 -1.09 120.40 128.77 2jtf s VAL 45 Ca 0.26 1.59 -0.10 0.00 -2.93 0.00 0.00 61.98 60.80 2jtf s VAL 45 Cb -0.13 -4.35 0.22 0.00 -1.53 0.00 0.00 36.38 30.59 2jtf s VAL 45 CO 0.05 -0.42 0.77 -2.28 -3.33 0.00 0.00 175.10 169.88 2jtf s HIS 46 N 3.46 3.79 0.44 1.54 2.46 0.19 -1.37 115.29 125.80 2jtf s HIS 46 Ca 0.42 -2.31 -0.26 0.00 0.47 0.00 0.00 55.06 53.38 2jtf s HIS 46 Cb -0.13 -3.67 -0.09 0.00 -0.13 0.00 0.00 32.58 28.57 2jtf s HIS 46 CO 0.14 -0.94 1.44 -0.06 -2.47 0.00 0.00 174.74 172.86 2jtf s PHE 47 N -0.22 2.46 -2.20 3.88 0.40 -1.26 -0.08 117.98 120.96 2jtf s PHE 47 Ca 0.21 1.24 0.20 0.00 -0.60 0.00 0.00 56.93 57.98 2jtf s PHE 47 Cb -0.12 -3.95 0.83 0.00 0.51 0.00 0.00 43.02 40.30 2jtf s PHE 47 CO -0.08 -2.99 1.58 0.39 0.70 0.00 0.00 175.22 174.83 2jtf n GLU 48 N -0.12 1.53 0.00 0.44 -0.58 -1.26 -4.59 120.64 116.06 2jtf n GLU 48 Ca 0.05 -0.80 0.00 0.00 -0.42 0.00 0.00 57.16 55.99 2jtf n GLU 48 Cb 0.41 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 2jtf n GLU 48 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2jtf n ARG 49 N 0.02 0.00 0.00 3.49 3.00 -1.26 -5.10 116.66 116.81 2jtf n ARG 49 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 2jtf n ARG 49 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.72 2jtf n ARG 49 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50 2jtf n TRP 50 N -0.80 -0.86 -3.72 -0.14 -0.00 -1.26 -4.88 117.44 105.78 2jtf n TRP 50 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.38 2jtf n TRP 50 Cb 0.00 0.14 -0.13 0.00 -0.00 0.00 0.00 31.31 31.32 2jtf n TRP 50 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 2jtf s SER 51 N -4.00 -0.22 0.00 5.87 0.15 -1.26 -5.03 113.70 109.21 2jtf s SER 51 Ca 0.00 0.57 0.00 0.00 0.70 0.00 0.00 55.95 57.22 2jtf s SER 51 Cb 0.00 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 2jtf s SER 51 CO 0.00 -0.18 0.00 1.57 1.20 0.00 0.00 173.24 175.83 2jtf n HIS 52 N 4.37 0.00 -5.22 3.44 -0.00 -1.26 -4.60 115.22 111.95 2jtf n HIS 52 Ca -0.23 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.17 2jtf n HIS 52 Cb 0.53 0.00 -0.17 0.00 -0.00 0.00 0.00 29.99 30.35 2jtf n HIS 52 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2jtf s ARG 53 N 0.00 3.02 0.00 1.57 3.52 -1.26 -5.12 118.95 120.67 2jtf s ARG 53 Ca 0.00 -0.88 0.00 0.00 -0.13 0.00 0.00 55.73 54.72 2jtf s ARG 53 Cb 0.00 -2.29 0.00 0.00 -1.56 0.00 0.00 34.95 31.10 2jtf s ARG 53 CO 0.00 0.19 0.00 0.66 -0.81 0.00 0.00 175.30 175.34 2jtf n TYR 54 N 3.50 -3.41 -2.16 5.12 4.01 -1.26 -4.96 117.16 118.01 2jtf n TYR 54 Ca -0.19 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.52 2jtf n TYR 54 Cb 0.53 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 2jtf n TYR 54 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2jtf n ASP 55 N -2.71 -2.42 -4.01 7.72 8.00 -1.22 -5.04 116.55 116.88 2jtf n ASP 55 Ca 0.00 1.01 -0.11 0.00 0.71 0.00 0.00 54.79 56.39 2jtf n ASP 55 Cb 0.00 -3.90 -0.12 0.00 -0.02 0.00 0.00 41.12 37.09 2jtf n ASP 55 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2jtf s GLU 56 N -0.85 0.39 -0.41 -1.24 2.56 -0.47 -4.96 118.70 113.73 2jtf s GLU 56 Ca -0.15 -0.61 -0.15 0.00 0.00 0.00 0.00 54.97 54.06 2jtf s GLU 56 Cb 0.01 -0.11 0.02 0.00 2.00 0.00 0.00 34.13 36.05 2jtf s GLU 56 CO 0.40 0.01 0.33 -1.58 -0.56 0.00 0.00 175.26 173.86 2jtf s TRP 57 N -1.24 3.22 0.20 5.30 0.52 -1.26 0.11 118.94 125.80 2jtf s TRP 57 Ca -0.11 -0.49 0.05 0.00 0.02 0.00 0.00 56.10 55.57 2jtf s TRP 57 Cb -0.09 -2.66 -0.05 0.00 -1.15 0.00 0.00 33.47 29.53 2jtf s TRP 57 CO -0.00 -0.59 -0.08 0.42 0.02 0.00 0.00 176.95 176.71 2jtf s ILE 58 N 1.81 1.34 0.48 2.03 1.01 -0.48 -4.90 121.20 122.49 2jtf s ILE 58 Ca 0.07 -2.10 -0.08 0.00 0.00 0.00 0.00 60.65 58.54 2jtf s ILE 58 Cb -0.18 -2.10 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 2jtf s ILE 58 CO 0.11 -0.55 0.82 -0.31 0.00 0.00 0.00 174.94 175.02 2jtf s TYR 59 N -3.22 3.55 -0.03 3.97 1.51 -1.26 -0.02 117.35 121.84 2jtf s TYR 59 Ca 0.23 0.97 -0.30 0.00 -1.01 0.00 0.00 57.07 56.95 2jtf s TYR 59 Cb 0.03 -2.42 -0.05 0.00 -0.11 0.00 0.00 41.96 39.41 2jtf s TYR 59 CO 0.06 -0.30 1.41 1.67 -1.11 0.00 0.00 175.55 177.27 2jtf s TRP 60 N -2.71 2.75 -1.36 2.71 -2.14 -1.18 -3.77 118.94 113.25 2jtf s TRP 60 Ca 0.50 0.78 -0.18 0.00 2.66 0.00 0.00 56.10 59.86 2jtf s TRP 60 Cb -0.10 -3.66 0.02 0.00 -3.10 0.00 0.00 33.47 26.62 2jtf s TRP 60 CO 0.42 -2.48 0.41 -0.40 -2.66 0.00 0.00 176.95 172.24 2jtf n ASP 61 N 5.76 -1.93 -0.08 -2.66 5.75 -1.19 -4.90 116.55 117.30 2jtf n ASP 61 Ca 0.14 -1.26 -0.10 0.00 -0.01 0.00 0.00 54.79 53.56 2jtf n ASP 61 Cb 0.44 -1.84 -0.04 0.00 -1.03 0.00 0.00 41.12 38.64 2jtf n ASP 61 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2jtf n SER 62 N -2.53 1.83 0.00 -1.12 3.41 -1.25 -4.92 113.62 109.05 2jtf n SER 62 Ca -0.21 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 2jtf n SER 62 Cb 0.63 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 2jtf n SER 62 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2jtf n ASN 63 N -4.55 0.00 -0.52 4.04 0.23 -1.26 -4.94 115.26 108.27 2jtf n ASN 63 Ca -0.15 0.01 0.04 0.00 -0.53 0.00 0.00 54.58 53.95 2jtf n ASN 63 Cb 0.41 0.01 0.06 0.00 -2.08 0.00 0.00 39.78 38.17 2jtf n ASN 63 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 2jtf n ARG 64 N -2.64 0.48 -4.71 -3.83 0.00 -1.26 -5.03 116.66 99.66 2jtf n ARG 64 Ca 0.00 -1.75 -0.30 0.00 -0.00 0.00 0.00 57.85 55.80 2jtf n ARG 64 Cb 0.12 -0.80 -0.13 0.00 -0.00 0.00 0.00 32.46 31.64 2jtf n ARG 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2jtf s LEU 65 N -1.06 2.45 -0.03 2.89 2.01 -1.26 0.42 118.68 124.10 2jtf s LEU 65 Ca 0.16 -0.50 0.02 0.00 0.01 0.00 0.00 54.13 53.82 2jtf s LEU 65 Cb 0.16 -1.42 0.01 0.00 0.01 0.00 0.00 46.19 44.94 2jtf s LEU 65 CO -0.02 0.25 -0.09 -0.13 1.01 0.00 0.00 176.35 177.37 2jtf s ARG 66 N -1.43 1.07 0.45 1.70 0.52 0.13 -3.15 118.95 118.25 2jtf s ARG 66 Ca 0.14 -0.32 -0.06 0.00 -0.52 0.00 0.00 55.73 54.97 2jtf s ARG 66 Cb -0.10 -0.98 0.10 0.00 0.52 0.00 0.00 34.95 34.49 2jtf s ARG 66 CO 0.04 0.10 0.62 -0.35 0.02 0.00 0.00 175.30 175.73 2jtf n PRO 67 N 3.38 -0.35 -1.44 3.54 -0.04 -1.26 -1.66 135.00 137.17 2jtf n PRO 67 Ca -0.19 -1.16 -0.36 0.00 -0.04 0.00 0.00 63.50 61.76 2jtf n PRO 67 Cb 0.54 -0.57 0.09 0.00 -0.04 0.00 0.00 33.50 33.52 2jtf n PRO 67 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jtf n LEU 68 N 0.00 4.93 -4.51 1.53 4.77 -0.78 -3.87 117.00 119.06 2jtf n LEU 68 Ca 0.08 0.72 -0.33 0.00 -0.03 0.00 0.00 56.01 56.45 2jtf n LEU 68 Cb 0.29 -1.51 -0.14 0.00 -2.33 0.00 0.00 43.42 39.74 2jtf n LEU 68 CO 0.21 -1.47 2.08 -1.84 -1.33 0.00 0.00 177.39 175.04 2jtf n GLU 69 N -2.32 0.22 0.00 3.23 0.28 -1.26 -4.89 120.64 115.90 2jtf n GLU 69 Ca 0.15 -0.07 0.13 0.00 -0.16 0.00 0.00 57.16 57.20 2jtf n GLU 69 Cb 0.49 -1.89 0.75 0.00 1.43 0.00 0.00 31.44 32.22 2jtf n GLU 69 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84