#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 3.05 -0.67 1.20 0.52 -1.26 -4.84 118.95 116.95 2jtf s ARG 8 Ca 0.00 0.17 -0.26 0.00 -0.52 0.00 0.00 55.73 55.12 2jtf s ARG 8 Cb 0.00 -2.23 -0.05 0.00 0.52 0.00 0.00 34.95 33.19 2jtf s ARG 8 CO 0.00 -0.68 2.08 -1.25 0.02 0.00 0.00 175.30 175.47 2jtf s PRO 9 N -5.04 2.35 0.00 3.54 0.04 -1.26 -4.50 135.00 130.13 2jtf s PRO 9 Ca 0.54 0.57 0.00 0.00 0.04 0.00 0.00 61.00 62.15 2jtf s PRO 9 Cb -0.11 -4.64 0.00 0.00 0.04 0.00 0.00 34.50 29.79 2jtf s PRO 9 CO 0.47 -3.23 0.00 0.41 0.04 0.00 0.00 177.00 174.69 2jtf n GLY 10 N 6.18 3.98 3.48 0.56 0.00 -0.56 -2.95 105.19 115.88 2jtf n GLY 10 Ca 0.32 -1.67 -0.44 0.00 0.00 0.00 0.00 46.02 44.23 2jtf n GLY 10 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jtf n ILE 11 N -1.62 0.03 1.21 -0.61 5.41 -0.63 -3.60 119.36 119.56 2jtf n ILE 11 Ca 0.00 -0.30 0.13 0.00 1.00 0.00 0.00 62.75 63.58 2jtf n ILE 11 Cb 0.00 -1.48 0.46 0.00 -0.71 0.00 0.00 39.64 37.91 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 7.48 0.00 -1.17 1.39 -1.04 -1.26 -1.27 114.28 118.41 2jtf n THR 12 Ca 0.50 -0.06 -0.06 0.00 -2.04 0.00 0.00 64.05 62.39 2jtf n THR 12 Cb 0.23 0.07 -0.03 0.00 -1.82 0.00 0.00 70.33 68.78 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 -1.08 0.00 -4.86 -1.42 3.72 -1.26 -5.03 117.46 107.54 2jtf n PHE 13 Ca 0.11 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.19 2jtf n PHE 13 Cb 0.32 -1.35 -0.13 0.00 -0.94 0.00 0.00 39.48 37.37 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 -2.37 2.36 -0.17 -1.08 2.02 -1.26 -5.07 118.70 113.13 2jtf s GLU 14 Ca 0.00 -0.79 -0.29 0.00 0.02 0.00 0.00 54.97 53.91 2jtf s GLU 14 Cb 0.00 -2.30 -0.03 0.00 0.10 0.00 0.00 34.13 31.90 2jtf s GLU 14 CO 0.00 0.60 1.47 0.42 0.02 0.00 0.00 175.26 177.77 2jtf s ILE 15 N -0.78 3.91 0.00 -1.63 1.01 -1.26 -1.31 121.20 121.14 2jtf s ILE 15 Ca 0.12 1.08 0.00 0.00 0.00 0.00 0.00 60.65 61.85 2jtf s ILE 15 Cb -0.11 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.57 2jtf s ILE 15 CO 0.02 -0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.37 2jtf n GLY 16 N 4.13 0.73 3.85 6.18 0.00 0.71 -5.02 105.19 115.77 2jtf n GLY 16 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 3.10 -0.63 4.61 0.00 -0.43 -4.71 121.76 121.69 2jtf s ALA 17 Ca 0.00 0.07 -0.22 0.00 0.00 0.00 0.00 51.96 51.80 2jtf s ALA 17 Cb 0.00 -3.08 0.07 0.00 0.00 0.00 0.00 23.12 20.11 2jtf s ALA 17 CO 0.00 -0.38 0.91 1.03 0.00 0.00 0.00 175.76 177.32 2jtf s ARG 18 N -4.43 3.13 0.48 0.00 0.52 -1.25 -0.10 118.95 117.29 2jtf s ARG 18 Ca 0.57 -0.83 -0.06 0.00 -0.52 0.00 0.00 55.73 54.89 2jtf s ARG 18 Cb -0.10 -4.21 -0.04 0.00 0.52 0.00 0.00 34.95 31.12 2jtf s ARG 18 CO 0.39 -1.71 0.79 -0.48 0.02 0.00 0.00 175.30 174.31 2jtf s LEU 19 N 3.80 3.62 -0.26 2.53 -0.00 0.92 -1.49 118.68 127.80 2jtf s LEU 19 Ca 0.21 0.95 -0.11 0.00 -0.00 0.00 0.00 54.13 55.18 2jtf s LEU 19 Cb -0.17 -3.91 -0.05 0.00 -0.00 0.00 0.00 46.19 42.06 2jtf s LEU 19 CO 0.11 -0.58 0.21 -0.70 -0.00 0.00 0.00 176.35 175.38 2jtf s GLU 20 N -4.72 4.00 0.07 1.48 2.56 -0.64 -0.37 118.70 121.08 2jtf s GLU 20 Ca 0.48 -0.25 0.08 0.00 0.00 0.00 0.00 54.97 55.28 2jtf s GLU 20 Cb -0.10 -3.62 -0.03 0.00 2.00 0.00 0.00 34.13 32.37 2jtf s GLU 20 CO 0.45 -0.11 -0.19 0.00 -0.56 0.00 0.00 175.26 174.84 2jtf s ALA 21 N 1.56 2.59 -0.28 6.30 0.00 -0.46 0.43 121.76 131.90 2jtf s ALA 21 Ca 0.08 -1.26 -0.06 0.00 0.00 0.00 0.00 51.96 50.72 2jtf s ALA 21 Cb -0.15 -0.67 0.01 0.00 0.00 0.00 0.00 23.12 22.30 2jtf s ALA 21 CO 0.09 0.57 0.05 -1.17 0.00 0.00 0.00 175.76 175.31 2jtf s LEU 22 N -1.69 3.65 0.35 0.00 0.20 0.57 0.05 118.68 121.82 2jtf s LEU 22 Ca 0.15 -0.65 0.03 0.00 0.69 0.00 0.00 54.13 54.35 2jtf s LEU 22 Cb -0.10 -1.85 -0.05 0.00 -0.43 0.00 0.00 46.19 43.76 2jtf s LEU 22 CO 0.07 -0.15 0.09 -1.81 -0.29 0.00 0.00 176.35 174.26 2jtf s ASP 23 N 1.49 2.33 0.16 3.68 1.11 -0.59 -4.81 116.67 120.04 2jtf s ASP 23 Ca 0.03 -1.50 0.02 0.00 0.18 0.00 0.00 52.55 51.28 2jtf s ASP 23 Cb -0.17 0.20 0.06 0.00 1.07 0.00 0.00 42.92 44.08 2jtf s ASP 23 CO 0.01 -0.76 0.27 0.00 1.18 0.00 0.00 175.17 175.87 2jtf n TYR 24 N -0.74 0.00 0.36 4.23 4.11 -1.26 0.17 117.16 124.03 2jtf n TYR 24 Ca -0.03 0.00 0.13 0.00 -0.00 0.00 0.00 57.90 58.00 2jtf n TYR 24 Cb 0.66 -0.02 0.35 0.00 -0.00 0.00 0.00 39.34 40.33 2jtf n TYR 24 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.86 176.79 2jtf h LEU 25 N 0.00 0.00 -0.24 -3.48 -0.00 -1.98 -3.45 115.31 106.16 2jtf h LEU 25 Ca 0.03 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.80 2jtf h LEU 25 Cb 0.55 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 41.24 2jtf h LEU 25 CO -0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 178.44 178.26 2jtf n GLN 26 N -2.79 -1.57 -4.30 1.13 3.00 0.45 -5.01 117.38 108.28 2jtf n GLN 26 Ca 0.04 0.26 -0.34 0.00 -0.01 0.00 0.00 57.00 56.94 2jtf n GLN 26 Cb 0.44 -3.73 -0.10 0.00 0.00 0.00 0.00 30.24 26.84 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 -4.95 3.48 -0.82 -1.09 1.02 -0.80 -4.89 119.74 111.68 2jtf s LYS 27 Ca 0.10 -0.43 -0.18 0.00 0.02 0.00 0.00 55.97 55.48 2jtf s LYS 27 Cb -0.04 -2.94 0.14 0.00 -0.52 0.00 0.00 37.83 34.47 2jtf s LYS 27 CO 0.13 0.43 0.95 -1.58 -0.92 0.00 0.00 175.35 174.36 2jtf s TRP 28 N -0.13 3.19 0.08 3.18 0.52 -1.23 -1.54 118.94 123.01 2jtf s TRP 28 Ca 0.04 -1.36 0.05 0.00 0.02 0.00 0.00 56.10 54.85 2jtf s TRP 28 Cb -0.13 -4.13 -0.04 0.00 -1.15 0.00 0.00 33.47 28.02 2jtf s TRP 28 CO 0.02 -1.36 -0.01 1.52 0.02 0.00 0.00 176.95 177.14 2jtf s TYR 29 N 2.27 2.99 -0.58 -1.98 -0.85 0.11 -4.75 117.35 114.56 2jtf s TYR 29 Ca 0.24 -0.02 -0.26 0.00 -0.52 0.00 0.00 57.07 56.51 2jtf s TYR 29 Cb -0.11 -1.55 -0.03 0.00 0.38 0.00 0.00 41.96 40.65 2jtf s TYR 29 CO -0.05 0.47 1.98 -2.14 -1.52 0.00 0.00 175.55 174.30 2jtf s PRO 30 N -2.21 2.52 0.31 -3.49 0.02 -1.26 -1.35 135.00 129.54 2jtf s PRO 30 Ca 0.25 0.80 0.07 0.00 0.02 0.00 0.00 61.00 62.13 2jtf s PRO 30 Cb -0.12 -4.43 -0.02 0.00 0.02 0.00 0.00 34.50 29.95 2jtf s PRO 30 CO 0.17 -2.84 0.36 -1.12 -0.33 0.00 0.00 177.00 173.24 2jtf s SER 31 N 8.97 5.75 -0.12 2.53 0.01 0.50 -4.65 113.70 126.70 2jtf s SER 31 Ca 0.74 -0.25 -0.03 0.00 1.31 0.00 0.00 55.95 57.72 2jtf s SER 31 Cb -0.14 -1.27 -0.03 0.00 0.21 0.00 0.00 66.02 64.79 2jtf s SER 31 CO 0.22 -0.30 0.01 -0.13 0.41 0.00 0.00 173.24 173.45 2jtf s ARG 32 N -4.04 3.29 -0.56 12.44 0.52 0.23 -0.05 118.95 130.78 2jtf s ARG 32 Ca 0.40 -0.40 -0.28 0.00 -0.52 0.00 0.00 55.73 54.93 2jtf s ARG 32 Cb -0.08 -2.90 0.03 0.00 0.52 0.00 0.00 34.95 32.52 2jtf s ARG 32 CO 0.29 0.56 1.19 0.42 0.02 0.00 0.00 175.30 177.77 2jtf s ILE 33 N -0.47 4.05 -0.08 1.52 1.01 0.85 -0.25 121.20 127.84 2jtf s ILE 33 Ca 0.09 0.97 -0.22 0.00 0.00 0.00 0.00 60.65 61.49 2jtf s ILE 33 Cb -0.12 -4.70 -0.29 0.00 0.01 0.00 0.00 42.46 37.36 2jtf s ILE 33 CO 0.02 -1.27 0.78 -0.33 0.00 0.00 0.00 174.94 174.14 2jtf h GLU 34 N 9.50 0.22 -3.63 2.79 4.39 -0.65 0.20 114.58 127.41 2jtf h GLU 34 Ca -0.25 -0.38 -0.06 0.00 0.34 0.00 0.00 59.36 59.01 2jtf h GLU 34 Cb 1.06 0.14 -0.11 0.00 -0.10 0.00 0.00 28.75 29.74 2jtf h GLU 34 CO 1.18 1.18 -0.16 0.15 -1.16 0.00 0.00 179.01 180.20 2jtf s LYS 35 N -2.40 1.30 -0.01 2.33 1.02 -1.23 -4.74 119.74 116.02 2jtf s LYS 35 Ca -0.16 -1.07 0.00 0.00 0.02 0.00 0.00 55.97 54.76 2jtf s LYS 35 Cb 0.01 0.45 0.01 0.00 -0.52 0.00 0.00 37.83 37.78 2jtf s LYS 35 CO 0.78 -0.52 0.01 0.42 -0.92 0.00 0.00 175.35 175.12 2jtf s ILE 36 N -3.94 -0.01 -0.19 2.17 1.01 -1.26 0.14 121.20 119.13 2jtf s ILE 36 Ca 0.15 0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.86 2jtf s ILE 36 Cb 0.01 -0.06 -0.02 0.00 0.01 0.00 0.00 42.46 42.41 2jtf s ILE 36 CO 0.00 0.05 -0.06 -0.62 0.00 0.00 0.00 174.94 174.31 2jtf s ASP 37 N 0.48 4.39 -0.12 3.58 -1.08 0.10 -4.98 116.67 119.03 2jtf s ASP 37 Ca -0.04 -0.30 0.19 0.00 -0.52 0.00 0.00 52.55 51.87 2jtf s ASP 37 Cb -0.06 -1.73 -0.27 0.00 -1.46 0.00 0.00 42.92 39.40 2jtf s ASP 37 CO -0.01 0.07 0.23 -1.22 0.52 0.00 0.00 175.17 174.75 2jtf n TYR 38 N 4.20 0.00 0.07 -5.34 4.02 -1.26 -0.75 117.16 118.10 2jtf n TYR 38 Ca -0.18 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.59 2jtf n TYR 38 Cb 0.52 -0.75 -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 0.93 -1.01 0.00 0.00 176.86 176.78 2jtf h GLU 39 N 0.00 -0.21 0.02 -0.72 4.39 -1.95 -3.15 114.58 112.96 2jtf h GLU 39 Ca -0.30 0.01 -0.21 0.00 0.34 0.00 0.00 59.36 59.20 2jtf h GLU 39 Cb 1.67 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 30.35 2jtf h GLU 39 CO 0.02 0.21 -0.94 1.49 -1.16 0.00 0.00 179.01 178.62 2jtf h GLU 40 N -0.75 0.15 -3.08 2.33 4.57 -2.01 -3.48 114.58 112.31 2jtf h GLU 40 Ca -0.02 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 57.96 2jtf h GLU 40 Cb 0.52 0.06 0.01 0.00 -0.16 0.00 0.00 28.75 29.18 2jtf h GLU 40 CO 0.04 0.98 -0.02 0.41 -1.18 0.00 0.00 179.01 179.24 2jtf n GLY 41 N 1.04 0.58 3.14 1.92 0.00 -0.98 -4.94 105.19 105.95 2jtf n GLY 41 Ca -0.03 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 2jtf n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtf s LYS 42 N -3.04 0.34 0.25 1.61 -2.85 0.07 -1.86 119.74 114.27 2jtf s LYS 42 Ca 0.01 0.21 0.10 0.00 -1.00 0.00 0.00 55.97 55.29 2jtf s LYS 42 Cb -0.00 0.16 -0.04 0.00 -2.06 0.00 0.00 37.83 35.88 2jtf s LYS 42 CO 0.03 -0.06 -0.06 0.00 0.10 0.00 0.00 175.35 175.36 2jtf s MET 43 N -0.16 2.13 -0.51 1.78 0.23 0.92 0.02 119.30 123.71 2jtf s MET 43 Ca -0.03 -1.45 -0.23 0.00 -1.03 0.00 0.00 55.69 52.96 2jtf s MET 43 Cb -0.03 -2.09 0.04 0.00 -1.53 0.00 0.00 34.83 31.22 2jtf s MET 43 CO 0.01 0.37 0.82 -1.17 -2.03 0.00 0.00 175.02 173.02 2jtf s LEU 44 N -3.46 4.36 -0.25 0.18 0.20 0.12 -1.10 118.68 118.73 2jtf s LEU 44 Ca 0.30 -0.42 -0.10 0.00 0.69 0.00 0.00 54.13 54.60 2jtf s LEU 44 Cb -0.07 -2.77 -0.04 0.00 -0.43 0.00 0.00 46.19 42.88 2jtf s LEU 44 CO 0.18 -1.05 0.14 0.54 -0.29 0.00 0.00 176.35 175.87 2jtf s VAL 45 N 3.43 5.07 -0.44 1.68 0.11 0.10 0.12 120.40 130.47 2jtf s VAL 45 Ca 0.26 0.08 -0.13 0.00 -2.93 0.00 0.00 61.98 59.26 2jtf s VAL 45 Cb -0.14 -3.37 0.06 0.00 -1.53 0.00 0.00 36.38 31.40 2jtf s VAL 45 CO 0.18 0.33 0.32 -2.28 -3.33 0.00 0.00 175.10 170.33 2jtf s HIS 46 N 1.30 3.27 0.81 1.54 2.46 0.66 -0.78 115.29 124.55 2jtf s HIS 46 Ca 0.06 -1.04 -0.12 0.00 0.47 0.00 0.00 55.06 54.43 2jtf s HIS 46 Cb -0.14 -2.94 0.08 0.00 -0.13 0.00 0.00 32.58 29.44 2jtf s HIS 46 CO 0.06 -0.76 1.17 -0.06 -2.47 0.00 0.00 174.74 172.67 2jtf s PHE 47 N 1.58 2.93 -0.09 3.88 0.40 0.10 -0.60 117.98 126.18 2jtf s PHE 47 Ca 0.04 0.79 -0.00 0.00 -0.60 0.00 0.00 56.93 57.15 2jtf s PHE 47 Cb -0.23 -3.45 -0.00 0.00 0.51 0.00 0.00 43.02 39.85 2jtf s PHE 47 CO 0.06 -1.80 -0.00 0.93 0.70 0.00 0.00 175.22 175.10 2jtf h GLU 48 N -1.08 0.00 -3.99 0.44 5.08 -1.86 -3.43 114.58 109.73 2jtf h GLU 48 Ca -0.46 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.22 2jtf h GLU 48 Cb 1.32 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.20 2jtf h GLU 48 CO 0.65 0.00 -0.56 0.50 -1.00 0.00 0.00 179.01 178.61 2jtf s ARG 49 N -1.48 2.04 -0.04 2.33 3.52 -1.26 -5.05 118.95 119.00 2jtf s ARG 49 Ca -0.00 -2.24 0.03 0.00 -0.13 0.00 0.00 55.73 53.39 2jtf s ARG 49 Cb 0.00 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.92 2jtf s ARG 49 CO 0.00 -1.08 -0.13 -0.46 -0.81 0.00 0.00 175.30 172.83 2jtf s TRP 50 N 0.38 1.33 -0.73 5.12 -0.11 -1.26 -5.03 118.94 118.64 2jtf s TRP 50 Ca 0.14 -0.40 -0.16 0.00 1.22 0.00 0.00 56.10 56.90 2jtf s TRP 50 Cb -0.22 -0.94 0.17 0.00 -1.50 0.00 0.00 33.47 30.98 2jtf s TRP 50 CO -0.04 -0.17 0.73 -1.12 -4.62 0.00 0.00 176.95 171.73 2jtf s SER 51 N 0.27 6.52 0.00 5.86 0.01 -1.26 -4.20 113.70 120.91 2jtf s SER 51 Ca -0.06 -2.22 0.00 0.00 1.31 0.00 0.00 55.95 54.97 2jtf s SER 51 Cb -0.12 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2jtf s SER 51 CO 0.02 -0.77 0.00 1.41 0.41 0.00 0.00 173.24 174.31 2jtf n HIS 52 N 4.88 0.00 -1.28 2.43 -0.00 -1.26 -4.93 115.22 115.06 2jtf n HIS 52 Ca 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.77 2jtf n HIS 52 Cb 0.45 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.45 2jtf n HIS 52 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.34 174.21 2jtf n ARG 53 N 0.00 0.44 0.00 -0.41 0.63 -1.26 -5.00 116.66 111.06 2jtf n ARG 53 Ca 0.00 -0.99 0.00 0.00 -0.92 0.00 0.00 57.85 55.94 2jtf n ARG 53 Cb 0.00 -0.65 0.00 0.00 0.45 0.00 0.00 32.46 32.26 2jtf n ARG 53 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2jtf n TYR 54 N -0.19 0.00 -5.21 -0.14 4.01 -1.26 -4.92 117.16 109.45 2jtf n TYR 54 Ca 0.02 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.44 2jtf n TYR 54 Cb 0.56 -0.08 -0.17 0.00 -0.31 0.00 0.00 39.34 39.35 2jtf n TYR 54 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 2jtf s ASP 55 N -0.52 2.99 0.05 7.72 -4.77 -1.26 0.02 116.67 120.91 2jtf s ASP 55 Ca 0.00 -0.52 -0.18 0.00 -3.30 0.00 0.00 52.55 48.56 2jtf s ASP 55 Cb 0.00 -1.04 0.03 0.00 -1.09 0.00 0.00 42.92 40.82 2jtf s ASP 55 CO 0.00 0.20 0.40 -0.70 0.70 0.00 0.00 175.17 175.77 2jtf s GLU 56 N 0.06 0.92 -0.19 2.11 2.12 0.04 -4.96 118.70 118.79 2jtf s GLU 56 Ca -0.10 -0.39 -0.17 0.00 0.36 0.00 0.00 54.97 54.67 2jtf s GLU 56 Cb -0.15 0.41 -0.04 0.00 0.26 0.00 0.00 34.13 34.61 2jtf s GLU 56 CO 0.06 -0.32 0.44 -1.58 -0.54 0.00 0.00 175.26 173.32 2jtf s TRP 57 N -2.56 3.39 0.05 5.30 0.52 -1.26 0.02 118.94 124.40 2jtf s TRP 57 Ca -0.05 0.69 -0.01 0.00 0.02 0.00 0.00 56.10 56.76 2jtf s TRP 57 Cb -0.01 -2.56 -0.04 0.00 -1.15 0.00 0.00 33.47 29.72 2jtf s TRP 57 CO -0.03 -0.00 -0.03 0.42 0.02 0.00 0.00 176.95 177.33 2jtf s ILE 58 N 1.28 0.22 0.81 2.03 1.01 -0.26 -4.94 121.20 121.35 2jtf s ILE 58 Ca 0.21 -1.64 -0.12 0.00 0.00 0.00 0.00 60.65 59.11 2jtf s ILE 58 Cb -0.15 -1.28 0.08 0.00 0.01 0.00 0.00 42.46 41.13 2jtf s ILE 58 CO 0.09 -0.89 1.18 -0.31 0.00 0.00 0.00 174.94 175.00 2jtf s TYR 59 N -3.42 2.94 0.03 3.97 2.02 -1.26 -0.06 117.35 121.57 2jtf s TYR 59 Ca 0.03 0.76 -0.06 0.00 -0.37 0.00 0.00 57.07 57.43 2jtf s TYR 59 Cb 0.04 -3.49 -0.01 0.00 -0.40 0.00 0.00 41.96 38.10 2jtf s TYR 59 CO -0.08 -1.80 0.99 0.91 -1.57 0.00 0.00 175.55 174.01 2jtf n TRP 60 N -3.34 -0.08 -1.90 2.71 5.03 -0.77 -3.60 117.44 115.49 2jtf n TRP 60 Ca 0.08 0.23 0.01 0.00 3.03 0.00 0.00 57.50 60.85 2jtf n TRP 60 Cb 0.61 -0.47 0.01 0.00 -1.03 0.00 0.00 31.31 30.43 2jtf n TRP 60 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 177.69 177.41 2jtf n ASP 61 N -3.35 0.18 0.33 -0.99 9.92 -1.25 -4.33 116.55 117.05 2jtf n ASP 61 Ca 0.00 -2.06 0.21 0.00 -0.53 0.00 0.00 54.79 52.41 2jtf n ASP 61 Cb 0.05 -0.21 1.11 0.00 -0.64 0.00 0.00 41.12 41.42 2jtf n ASP 61 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2jtf h SER 62 N 0.00 0.00 0.00 -2.24 0.02 -1.79 -3.39 113.55 106.15 2jtf h SER 62 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jtf h SER 62 Cb 1.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.90 2jtf h SER 62 CO 0.00 0.00 0.00 -0.46 -1.14 0.00 0.00 176.83 175.23 2jtf n ASN 63 N -2.98 0.00 -0.98 3.07 0.23 -1.26 -5.00 115.26 108.34 2jtf n ASN 63 Ca -0.03 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 54.00 2jtf n ASN 63 Cb 0.12 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.79 2jtf n ASN 63 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2jtf n ARG 64 N -1.34 0.00 -3.97 -3.83 1.74 -1.26 -4.93 116.66 103.07 2jtf n ARG 64 Ca 0.00 -1.05 -0.29 0.00 -0.77 0.00 0.00 57.85 55.74 2jtf n ARG 64 Cb 0.00 0.21 -0.17 0.00 -1.02 0.00 0.00 32.46 31.48 2jtf n ARG 64 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2jtf s LEU 65 N 0.00 1.55 -0.11 0.55 2.01 -1.26 -0.31 118.68 121.11 2jtf s LEU 65 Ca 0.08 -0.46 0.02 0.00 0.01 0.00 0.00 54.13 53.79 2jtf s LEU 65 Cb 0.09 -1.05 -0.01 0.00 0.01 0.00 0.00 46.19 45.23 2jtf s LEU 65 CO -0.04 -0.09 -0.19 -0.60 1.01 0.00 0.00 176.35 176.44 2jtf s ARG 66 N 1.56 3.13 0.99 1.70 3.52 0.17 -3.87 118.95 126.15 2jtf s ARG 66 Ca 0.04 -0.79 -0.15 0.00 -0.13 0.00 0.00 55.73 54.71 2jtf s ARG 66 Cb -0.13 -2.43 0.19 0.00 -1.56 0.00 0.00 34.95 31.01 2jtf s ARG 66 CO -0.10 0.23 1.17 -1.25 -0.81 0.00 0.00 175.30 174.54 2jtf s PRO 67 N 0.26 0.47 0.61 5.12 0.04 -1.26 -1.60 135.00 138.63 2jtf s PRO 67 Ca -0.13 0.06 -0.18 0.00 0.04 0.00 0.00 61.00 60.79 2jtf s PRO 67 Cb -0.16 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 2jtf s PRO 67 CO 0.07 -2.61 1.17 -1.17 0.04 0.00 0.00 177.00 174.50 2jtf s LEU 68 N -6.22 3.60 0.54 -3.56 2.96 -0.40 -3.95 118.68 111.65 2jtf s LEU 68 Ca 0.68 2.25 0.26 0.00 -0.22 0.00 0.00 54.13 57.10 2jtf s LEU 68 Cb -0.11 -4.58 1.44 0.00 0.50 0.00 0.00 46.19 43.43 2jtf s LEU 68 CO 0.54 -1.57 1.99 1.05 -1.32 0.00 0.00 176.35 177.04 2jtf h GLU 69 N 0.69 0.00 0.00 1.98 4.11 -1.86 -3.46 114.58 116.03 2jtf h GLU 69 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2jtf h GLU 69 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2jtf h GLU 69 CO 0.55 0.00 0.00 -2.13 0.07 0.00 0.00 179.01 177.50