#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 1.02 -1.00 1.20 1.70 -1.26 -5.06 118.95 115.54 2jtf s ARG 8 Ca 0.00 -1.61 -0.21 0.00 -0.47 0.00 0.00 55.73 53.45 2jtf s ARG 8 Cb 0.00 -2.13 0.09 0.00 -0.57 0.00 0.00 34.95 32.33 2jtf s ARG 8 CO 0.00 -1.10 1.33 -1.25 -1.08 0.00 0.00 175.30 173.21 2jtf s PRO 9 N 0.89 3.63 0.00 3.89 0.05 -1.26 -4.31 135.00 137.88 2jtf s PRO 9 Ca 0.15 -1.46 0.00 0.00 0.05 0.00 0.00 61.00 59.73 2jtf s PRO 9 Cb -0.22 -5.18 0.00 0.00 0.05 0.00 0.00 34.50 29.15 2jtf s PRO 9 CO -0.09 -2.02 0.00 0.41 0.05 0.00 0.00 177.00 175.35 2jtf n GLY 10 N 6.18 3.41 3.56 0.56 0.00 0.20 -4.26 105.19 114.85 2jtf n GLY 10 Ca 0.30 -1.04 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.25 0.27 0.54 -0.61 5.41 -1.19 -4.09 119.36 118.45 2jtf n ILE 11 Ca 0.00 -0.44 0.10 0.00 1.00 0.00 0.00 62.75 63.41 2jtf n ILE 11 Cb 0.00 -2.37 0.27 0.00 -0.71 0.00 0.00 39.64 36.83 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 7.67 0.51 -1.19 1.39 -1.04 -1.26 -3.39 114.28 116.96 2jtf n THR 12 Ca 0.33 -0.63 -0.07 0.00 -2.04 0.00 0.00 64.05 61.65 2jtf n THR 12 Cb 0.40 0.57 -0.03 0.00 -1.82 0.00 0.00 70.33 69.45 2jtf n THR 12 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2jtf n PHE 13 N 1.02 0.00 -4.47 -1.42 7.35 -1.26 -4.97 117.46 113.71 2jtf n PHE 13 Ca 0.18 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.54 2jtf n PHE 13 Cb 0.47 -2.00 -0.10 0.00 0.35 0.00 0.00 39.48 38.20 2jtf n PHE 13 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2jtf s GLU 14 N -2.25 2.64 -0.26 -4.13 2.02 -1.26 -5.05 118.70 110.40 2jtf s GLU 14 Ca 0.00 -0.66 -0.29 0.00 0.02 0.00 0.00 54.97 54.04 2jtf s GLU 14 Cb 0.00 -2.55 -0.01 0.00 0.10 0.00 0.00 34.13 31.67 2jtf s GLU 14 CO 0.00 0.62 1.44 0.42 0.02 0.00 0.00 175.26 177.76 2jtf s ILE 15 N -0.97 3.94 0.00 -1.63 1.09 -1.26 -1.33 121.20 121.05 2jtf s ILE 15 Ca 0.16 1.06 0.00 0.00 -1.10 0.00 0.00 60.65 60.77 2jtf s ILE 15 Cb -0.11 -3.95 0.00 0.00 -1.06 0.00 0.00 42.46 37.33 2jtf s ILE 15 CO 0.06 -0.39 0.00 0.61 -0.10 0.00 0.00 174.94 175.12 2jtf n GLY 16 N 4.47 0.93 3.80 6.18 0.00 0.42 -4.99 105.19 115.99 2jtf n GLY 16 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 2.72 -0.43 4.61 0.00 -0.44 -4.64 121.76 121.58 2jtf s ALA 17 Ca 0.00 0.45 -0.13 0.00 0.00 0.00 0.00 51.96 52.28 2jtf s ALA 17 Cb 0.00 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 19.93 2jtf s ALA 17 CO 0.00 -0.81 0.31 1.03 0.00 0.00 0.00 175.76 176.29 2jtf s ARG 18 N -3.96 2.86 0.66 0.00 0.52 -1.26 -0.61 118.95 117.16 2jtf s ARG 18 Ca 0.65 -1.26 0.01 0.00 -0.52 0.00 0.00 55.73 54.61 2jtf s ARG 18 Cb -0.17 -3.94 0.10 0.00 0.52 0.00 0.00 34.95 31.46 2jtf s ARG 18 CO 0.35 -0.90 0.91 -0.48 0.02 0.00 0.00 175.30 175.21 2jtf s LEU 19 N 1.58 3.07 -0.23 2.53 0.05 0.23 -0.63 118.68 125.29 2jtf s LEU 19 Ca 0.03 -0.36 -0.08 0.00 0.05 0.00 0.00 54.13 53.77 2jtf s LEU 19 Cb -0.22 -2.13 -0.04 0.00 -2.05 0.00 0.00 46.19 41.75 2jtf s LEU 19 CO 0.06 -1.61 0.10 -1.61 -0.55 0.00 0.00 176.35 172.74 2jtf s GLU 20 N -4.97 3.85 0.01 1.48 2.02 -0.65 0.20 118.70 120.62 2jtf s GLU 20 Ca 0.63 -0.39 0.06 0.00 0.02 0.00 0.00 54.97 55.30 2jtf s GLU 20 Cb -0.07 -3.36 -0.03 0.00 0.10 0.00 0.00 34.13 30.77 2jtf s GLU 20 CO 0.42 -0.01 -0.18 0.00 0.02 0.00 0.00 175.26 175.51 2jtf s ALA 21 N 1.18 2.55 -0.10 5.21 0.00 -0.14 0.65 121.76 131.11 2jtf s ALA 21 Ca 0.05 -1.12 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 2jtf s ALA 21 Cb -0.14 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 2jtf s ALA 21 CO 0.04 0.56 0.09 -1.17 0.00 0.00 0.00 175.76 175.28 2jtf s LEU 22 N -1.11 4.07 0.00 0.00 0.20 0.22 -0.16 118.68 121.89 2jtf s LEU 22 Ca 0.13 0.33 0.00 0.00 0.69 0.00 0.00 54.13 55.28 2jtf s LEU 22 Cb -0.10 -2.00 0.00 0.00 -0.43 0.00 0.00 46.19 43.65 2jtf s LEU 22 CO 0.03 0.39 0.00 -0.67 -0.29 0.00 0.00 176.35 175.81 2jtf n ASP 23 N 1.97 0.00 0.00 3.68 -0.08 -0.72 -4.79 116.55 116.62 2jtf n ASP 23 Ca -0.19 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.09 2jtf n ASP 23 Cb 0.54 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.00 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 9.00 0.00 0.16 -0.67 9.36 -1.26 0.75 117.16 134.50 2jtf n TYR 24 Ca 0.00 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.24 2jtf n TYR 24 Cb 0.00 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 38.70 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 0.44 -1.57 2.98 7.99 -1.26 -4.94 117.00 120.64 2jtf n LEU 25 Ca 0.00 -0.62 -0.11 0.00 -0.01 0.00 0.00 56.01 55.27 2jtf n LEU 25 Cb 0.00 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.33 2jtf n LEU 25 CO 0.00 0.10 -0.01 0.00 -1.51 0.00 0.00 177.39 175.97 2jtf n GLN 26 N -0.77 -2.29 -4.09 3.23 3.00 0.23 -5.02 117.38 111.67 2jtf n GLN 26 Ca 0.01 0.45 -0.22 0.00 -0.01 0.00 0.00 57.00 57.23 2jtf n GLN 26 Cb 0.06 -4.36 -0.05 0.00 0.00 0.00 0.00 30.24 25.89 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 -5.05 2.74 -0.76 -1.09 1.02 -0.81 -4.72 119.74 111.06 2jtf s LYS 27 Ca 0.14 -1.19 -0.14 0.00 0.02 0.00 0.00 55.97 54.80 2jtf s LYS 27 Cb -0.06 -2.45 0.20 0.00 -0.52 0.00 0.00 37.83 35.00 2jtf s LYS 27 CO 0.17 0.32 0.69 -1.58 -0.92 0.00 0.00 175.35 174.04 2jtf s TRP 28 N -2.22 3.65 -0.11 3.18 0.52 -1.24 -1.75 118.94 120.97 2jtf s TRP 28 Ca 0.34 -1.91 -0.05 0.00 0.02 0.00 0.00 56.10 54.51 2jtf s TRP 28 Cb -0.07 -3.78 -0.04 0.00 -1.15 0.00 0.00 33.47 28.44 2jtf s TRP 28 CO 0.24 -0.99 0.08 1.52 0.02 0.00 0.00 176.95 177.82 2jtf s TYR 29 N 0.42 3.40 -0.19 -1.98 -0.85 0.77 -4.70 117.35 114.21 2jtf s TYR 29 Ca 0.15 0.37 -0.28 0.00 -0.52 0.00 0.00 57.07 56.79 2jtf s TYR 29 Cb -0.14 -1.88 -0.06 0.00 0.38 0.00 0.00 41.96 40.26 2jtf s TYR 29 CO -0.06 0.61 2.20 -2.30 -1.52 0.00 0.00 175.55 174.47 2jtf n PRO 30 N 2.09 2.04 -4.47 -3.49 -0.02 -1.25 -0.96 135.00 128.94 2jtf n PRO 30 Ca -0.19 0.58 -0.29 0.00 -2.02 0.00 0.00 63.50 61.58 2jtf n PRO 30 Cb 0.54 -3.20 -0.13 0.00 -0.02 0.00 0.00 33.50 30.69 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 7.92 3.40 -0.15 2.55 0.01 0.13 -4.70 113.70 122.85 2jtf s SER 31 Ca 1.00 -0.68 -0.07 0.00 1.31 0.00 0.00 55.95 57.50 2jtf s SER 31 Cb -0.36 -0.29 -0.04 0.00 0.21 0.00 0.00 66.02 65.54 2jtf s SER 31 CO 0.36 0.20 0.10 -0.13 0.41 0.00 0.00 173.24 174.18 2jtf s ARG 32 N -1.91 3.69 -0.09 12.44 0.52 -0.09 0.78 118.95 134.29 2jtf s ARG 32 Ca 0.14 -0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 54.82 2jtf s ARG 32 Cb -0.10 -3.20 -0.03 0.00 0.52 0.00 0.00 34.95 32.14 2jtf s ARG 32 CO 0.06 0.53 1.22 0.42 0.02 0.00 0.00 175.30 177.55 2jtf s ILE 33 N -0.34 4.26 -0.18 1.52 1.01 0.22 0.36 121.20 128.06 2jtf s ILE 33 Ca 0.10 1.57 0.18 0.00 0.00 0.00 0.00 60.65 62.50 2jtf s ILE 33 Cb -0.12 -4.01 -0.25 0.00 0.01 0.00 0.00 42.46 38.09 2jtf s ILE 33 CO 0.01 -0.05 0.11 1.21 0.00 0.00 0.00 174.94 176.23 2jtf n GLU 34 N 5.68 0.69 -3.52 2.79 4.07 0.14 -0.44 120.64 130.05 2jtf n GLU 34 Ca 0.12 -0.01 -0.16 0.00 -0.06 0.00 0.00 57.16 57.04 2jtf n GLU 34 Cb 0.46 -1.53 -0.06 0.00 -0.06 0.00 0.00 31.44 30.25 2jtf n GLU 34 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2jtf s LYS 35 N -2.56 1.01 -0.03 5.31 2.20 -1.10 -4.81 119.74 119.76 2jtf s LYS 35 Ca -0.10 0.19 0.05 0.00 -0.36 0.00 0.00 55.97 55.75 2jtf s LYS 35 Cb 0.07 0.48 -0.01 0.00 -1.51 0.00 0.00 37.83 36.85 2jtf s LYS 35 CO 0.83 -0.33 -0.20 0.42 -0.36 0.00 0.00 175.35 175.72 2jtf s ILE 36 N -1.39 1.58 -0.22 5.43 1.01 -1.26 -0.17 121.20 126.18 2jtf s ILE 36 Ca -0.09 -0.83 -0.05 0.00 0.00 0.00 0.00 60.65 59.68 2jtf s ILE 36 Cb -0.00 -1.33 -0.02 0.00 0.01 0.00 0.00 42.46 41.12 2jtf s ILE 36 CO 0.07 0.45 -0.00 -0.62 0.00 0.00 0.00 174.94 174.83 2jtf s ASP 37 N -0.25 4.65 -0.13 3.58 2.15 0.14 -4.98 116.67 121.83 2jtf s ASP 37 Ca 0.02 -0.29 0.19 0.00 0.43 0.00 0.00 52.55 52.90 2jtf s ASP 37 Cb -0.10 -1.81 -0.28 0.00 -0.30 0.00 0.00 42.92 40.44 2jtf s ASP 37 CO 0.01 0.00 0.22 -1.22 -0.17 0.00 0.00 175.17 174.01 2jtf n TYR 38 N 4.65 0.00 0.13 -5.34 4.01 -1.26 -0.12 117.16 119.23 2jtf n TYR 38 Ca -0.17 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.44 2jtf n TYR 38 Cb 0.51 -0.79 -0.08 0.00 -0.31 0.00 0.00 39.34 38.67 2jtf n TYR 38 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2jtf h GLU 39 N 0.00 -0.35 0.00 -0.72 4.57 -1.95 -3.24 114.58 112.90 2jtf h GLU 39 Ca -0.34 0.02 -0.22 0.00 -1.18 0.00 0.00 59.36 57.65 2jtf h GLU 39 Cb 1.75 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 30.39 2jtf h GLU 39 CO 0.02 0.00 -1.16 1.49 -1.18 0.00 0.00 179.01 178.18 2jtf h GLU 40 N -0.80 0.00 -2.91 1.92 4.57 -2.01 -3.48 114.58 111.87 2jtf h GLU 40 Ca -0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2jtf h GLU 40 Cb 0.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 2jtf h GLU 40 CO 0.06 0.78 0.00 0.41 -1.18 0.00 0.00 179.01 179.09 2jtf n GLY 41 N 1.39 0.00 3.23 1.92 0.00 -0.89 -5.03 105.19 105.81 2jtf n GLY 41 Ca -0.05 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.97 1.05 0.02 1.61 1.02 0.83 -3.71 119.74 117.58 2jtf s LYS 42 Ca 0.00 -1.48 0.01 0.00 0.02 0.00 0.00 55.97 54.51 2jtf s LYS 42 Cb 0.00 -0.29 -0.01 0.00 -0.52 0.00 0.00 37.83 37.01 2jtf s LYS 42 CO 0.00 -0.09 -0.04 0.00 -0.92 0.00 0.00 175.35 174.30 2jtf s MET 43 N -3.88 0.33 -0.64 1.68 0.23 0.63 0.28 119.30 117.94 2jtf s MET 43 Ca 0.21 -0.45 -0.24 0.00 -1.03 0.00 0.00 55.69 54.18 2jtf s MET 43 Cb 0.06 -0.13 0.06 0.00 -1.53 0.00 0.00 34.83 33.28 2jtf s MET 43 CO 0.02 0.02 1.01 -1.17 -2.03 0.00 0.00 175.02 172.87 2jtf s LEU 44 N -0.94 4.10 -0.14 0.18 1.98 0.76 -1.54 118.68 123.08 2jtf s LEU 44 Ca -0.08 -0.72 -0.08 0.00 -2.89 0.00 0.00 54.13 50.37 2jtf s LEU 44 Cb -0.06 -2.56 -0.04 0.00 0.66 0.00 0.00 46.19 44.18 2jtf s LEU 44 CO -0.00 -1.45 0.14 0.54 -1.89 0.00 0.00 176.35 173.69 2jtf s VAL 45 N 4.31 5.47 -0.21 1.68 0.11 0.29 0.29 120.40 132.34 2jtf s VAL 45 Ca 0.27 0.20 -0.05 0.00 -2.93 0.00 0.00 61.98 59.47 2jtf s VAL 45 Cb -0.14 -3.41 -0.02 0.00 -1.53 0.00 0.00 36.38 31.28 2jtf s VAL 45 CO 0.14 0.57 -0.00 -1.38 -3.33 0.00 0.00 175.10 171.09 2jtf s HIS 46 N -0.65 3.02 0.17 1.54 -3.43 0.16 -1.19 115.29 114.90 2jtf s HIS 46 Ca 0.13 -0.58 -0.01 0.00 -0.80 0.00 0.00 55.06 53.80 2jtf s HIS 46 Cb -0.12 -2.11 -0.04 0.00 -1.43 0.00 0.00 32.58 28.88 2jtf s HIS 46 CO 0.02 -0.34 0.36 -0.06 -2.00 0.00 0.00 174.74 172.73 2jtf s PHE 47 N 1.20 3.49 -0.16 0.38 0.40 0.29 -0.92 117.98 122.66 2jtf s PHE 47 Ca 0.03 0.36 -0.13 0.00 -0.60 0.00 0.00 56.93 56.59 2jtf s PHE 47 Cb -0.15 -1.86 -0.09 0.00 0.51 0.00 0.00 43.02 41.43 2jtf s PHE 47 CO 0.01 0.42 0.02 0.93 0.70 0.00 0.00 175.22 177.30 2jtf h GLU 48 N 2.32 0.00 -4.67 0.44 5.08 -1.87 -3.43 114.58 112.45 2jtf h GLU 48 Ca -0.47 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.18 2jtf h GLU 48 Cb 1.18 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.23 2jtf h GLU 48 CO 0.70 0.38 0.28 1.03 -1.00 0.00 0.00 179.01 180.40 2jtf s ARG 49 N -2.21 3.24 -0.30 2.33 1.81 -1.26 -4.92 118.95 117.65 2jtf s ARG 49 Ca -0.18 -1.56 -0.12 0.00 -1.72 0.00 0.00 55.73 52.15 2jtf s ARG 49 Cb 0.03 -4.42 0.16 0.00 -0.45 0.00 0.00 34.95 30.27 2jtf s ARG 49 CO 0.34 -1.57 0.87 -0.46 -0.68 0.00 0.00 175.30 173.80 2jtf s TRP 50 N 2.38 -0.93 -0.19 -0.53 -0.00 -1.26 -4.88 118.94 113.53 2jtf s TRP 50 Ca 0.17 1.48 -0.10 0.00 -0.00 0.00 0.00 56.10 57.66 2jtf s TRP 50 Cb -0.18 0.51 -0.21 0.00 -0.00 0.00 0.00 33.47 33.59 2jtf s TRP 50 CO 0.01 -0.47 0.13 0.43 -0.00 0.00 0.00 176.95 177.05 2jtf n SER 51 N 5.19 2.01 -4.60 5.86 7.64 -1.26 -4.70 113.62 123.76 2jtf n SER 51 Ca -0.09 0.22 -0.42 0.00 1.01 0.00 0.00 58.87 59.58 2jtf n SER 51 Cb 0.52 -0.80 -0.04 0.00 -1.01 0.00 0.00 64.21 62.87 2jtf n SER 51 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2jtf s HIS 52 N -2.49 3.10 0.19 1.43 5.65 -1.26 -4.84 115.29 117.06 2jtf s HIS 52 Ca -0.28 0.72 0.00 0.00 0.25 0.00 0.00 55.06 55.74 2jtf s HIS 52 Cb 0.08 -3.55 0.00 0.00 -1.18 0.00 0.00 32.58 27.93 2jtf s HIS 52 CO 0.66 -0.78 0.00 0.54 -0.65 0.00 0.00 174.74 174.50 2jtf n ARG 53 N 6.64 -1.65 0.00 2.88 5.12 -1.26 -4.84 116.66 123.54 2jtf n ARG 53 Ca 0.06 1.09 0.00 0.00 -1.93 0.00 0.00 57.85 57.06 2jtf n ARG 53 Cb 0.48 -2.01 0.00 0.00 -1.16 0.00 0.00 32.46 29.77 2jtf n ARG 53 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 2jtf n TYR 54 N -2.89 0.00 -4.19 -1.55 4.11 -1.26 -4.80 117.16 106.58 2jtf n TYR 54 Ca 0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.74 2jtf n TYR 54 Cb 0.37 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.59 2jtf n TYR 54 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.86 177.02 2jtf s ASP 55 N 0.00 1.25 -0.03 9.48 -4.77 -1.26 -0.55 116.67 120.79 2jtf s ASP 55 Ca 0.00 -0.48 -0.30 0.00 -3.30 0.00 0.00 52.55 48.47 2jtf s ASP 55 Cb 0.00 -0.04 0.07 0.00 -1.09 0.00 0.00 42.92 41.86 2jtf s ASP 55 CO 0.00 -0.07 0.69 -0.70 0.70 0.00 0.00 175.17 175.79 2jtf s GLU 56 N -1.30 1.06 -0.45 2.11 2.56 -0.33 -4.97 118.70 117.37 2jtf s GLU 56 Ca -0.03 0.18 -0.17 0.00 0.00 0.00 0.00 54.97 54.94 2jtf s GLU 56 Cb -0.08 0.50 0.04 0.00 2.00 0.00 0.00 34.13 36.59 2jtf s GLU 56 CO 0.01 -0.35 0.45 -1.58 -0.56 0.00 0.00 175.26 173.23 2jtf s TRP 57 N -1.46 3.17 0.26 5.30 0.52 -1.25 -0.55 118.94 124.93 2jtf s TRP 57 Ca -0.09 -0.60 0.06 0.00 0.02 0.00 0.00 56.10 55.49 2jtf s TRP 57 Cb -0.00 -3.08 -0.06 0.00 -1.15 0.00 0.00 33.47 29.19 2jtf s TRP 57 CO 0.07 -0.79 -0.04 0.42 0.02 0.00 0.00 176.95 176.63 2jtf s ILE 58 N 2.05 1.45 -0.05 2.03 1.01 -0.59 -4.89 121.20 122.20 2jtf s ILE 58 Ca 0.10 -2.10 -0.04 0.00 0.00 0.00 0.00 60.65 58.61 2jtf s ILE 58 Cb -0.20 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 2jtf s ILE 58 CO 0.11 -0.32 0.15 -0.31 0.00 0.00 0.00 174.94 174.56 2jtf s TYR 59 N -3.14 3.52 0.11 3.97 2.02 -1.26 -0.27 117.35 122.29 2jtf s TYR 59 Ca 0.29 0.39 -0.31 0.00 -0.37 0.00 0.00 57.07 57.07 2jtf s TYR 59 Cb 0.04 -1.86 -0.10 0.00 -0.40 0.00 0.00 41.96 39.64 2jtf s TYR 59 CO 0.11 0.66 1.87 -2.67 -1.57 0.00 0.00 175.55 173.94 2jtf n TRP 60 N 1.42 2.61 -2.36 2.71 2.14 -1.24 -2.69 117.44 120.02 2jtf n TRP 60 Ca -0.15 -0.19 -0.08 0.00 2.07 0.00 0.00 57.50 59.14 2jtf n TRP 60 Cb 0.54 -2.75 -0.01 0.00 -0.81 0.00 0.00 31.31 28.28 2jtf n TRP 60 CO 0.00 0.00 0.00 -0.40 2.07 0.00 0.00 177.69 179.36 2jtf n ASP 61 N 6.00 -2.91 0.13 -0.67 5.68 -0.24 -4.80 116.55 119.74 2jtf n ASP 61 Ca 0.18 0.29 0.03 0.00 -0.50 0.00 0.00 54.79 54.79 2jtf n ASP 61 Cb 0.38 -2.55 0.02 0.00 -1.14 0.00 0.00 41.12 37.83 2jtf n ASP 61 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 2jtf h SER 62 N 0.00 0.00 0.00 -1.12 0.87 -1.75 -3.46 113.55 108.09 2jtf h SER 62 Ca -0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2jtf h SER 62 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2jtf h SER 62 CO 0.24 0.44 0.00 -0.46 -0.53 0.00 0.00 176.83 176.52 2jtf n ASN 63 N -3.13 -0.40 -1.72 6.23 0.23 -1.26 -5.01 115.26 110.20 2jtf n ASN 63 Ca 0.00 0.09 -0.09 0.00 -0.53 0.00 0.00 54.58 54.05 2jtf n ASN 63 Cb 0.72 0.79 0.08 0.00 -2.08 0.00 0.00 39.78 39.29 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 -2.59 2.41 -4.29 -3.83 1.74 -1.26 -4.96 116.66 103.87 2jtf n ARG 64 Ca 0.00 -3.62 -0.26 0.00 -0.77 0.00 0.00 57.85 53.20 2jtf n ARG 64 Cb 0.00 -1.77 -0.17 0.00 -1.02 0.00 0.00 32.46 29.50 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 -3.19 1.48 -0.11 0.55 2.01 -1.26 0.68 118.68 118.85 2jtf s LEU 65 Ca 0.42 -0.32 0.03 0.00 0.01 0.00 0.00 54.13 54.27 2jtf s LEU 65 Cb 0.38 -0.87 0.00 0.00 0.01 0.00 0.00 46.19 45.72 2jtf s LEU 65 CO -0.02 -0.03 -0.22 -0.60 1.01 0.00 0.00 176.35 176.49 2jtf s ARG 66 N 1.12 2.89 0.00 1.70 3.52 0.21 -1.08 118.95 127.31 2jtf s ARG 66 Ca -0.06 -0.82 0.00 0.00 -0.13 0.00 0.00 55.73 54.72 2jtf s ARG 66 Cb -0.14 -2.23 0.00 0.00 -1.56 0.00 0.00 34.95 31.01 2jtf s ARG 66 CO -0.02 0.12 0.00 -2.30 -0.81 0.00 0.00 175.30 172.29 2jtf n PRO 67 N 3.69 -1.25 -1.08 5.12 -0.02 -1.26 -1.64 135.00 138.56 2jtf n PRO 67 Ca -0.20 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 60.99 2jtf n PRO 67 Cb 0.52 0.00 0.22 0.00 -0.02 0.00 0.00 33.50 34.22 2jtf n PRO 67 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2jtf s LEU 68 N 0.00 0.96 0.20 2.45 1.43 -1.22 -3.90 118.68 118.60 2jtf s LEU 68 Ca 0.00 0.86 -0.20 0.00 -1.03 0.00 0.00 54.13 53.76 2jtf s LEU 68 Cb 0.00 -2.75 0.16 0.00 0.03 0.00 0.00 46.19 43.63 2jtf s LEU 68 CO 0.00 -3.81 1.58 1.05 0.23 0.00 0.00 176.35 175.40 2jtf h GLU 69 N -2.37 -0.12 0.00 1.70 4.11 -1.95 -3.47 114.58 112.49 2jtf h GLU 69 Ca -0.49 0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2jtf h GLU 69 Cb 1.31 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.59 2jtf h GLU 69 CO 0.44 -0.08 0.00 -2.13 0.07 0.00 0.00 179.01 177.31