#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtf n ARG 8 N 0.00 1.49 -2.58 -3.83 1.74 -1.26 -4.79 116.66 107.43 2jtf n ARG 8 Ca 0.00 0.50 -0.41 0.00 -0.77 0.00 0.00 57.85 57.17 2jtf n ARG 8 Cb 0.00 -2.45 -0.03 0.00 -1.02 0.00 0.00 32.46 28.96 2jtf n ARG 8 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2jtf s PRO 9 N 4.79 3.23 0.00 5.56 0.05 -1.26 -3.11 135.00 144.27 2jtf s PRO 9 Ca 1.01 -0.21 0.00 0.00 0.05 0.00 0.00 61.00 61.85 2jtf s PRO 9 Cb -0.85 -4.16 0.00 0.00 0.05 0.00 0.00 34.50 29.54 2jtf s PRO 9 CO 0.54 -2.06 0.00 0.41 0.05 0.00 0.00 177.00 175.94 2jtf n GLY 10 N 5.33 3.25 3.56 0.56 0.00 0.21 -2.50 105.19 115.60 2jtf n GLY 10 Ca 0.03 -1.61 -0.37 0.00 0.00 0.00 0.00 46.02 44.07 2jtf n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jtf s ILE 11 N -2.00 3.01 0.03 -0.61 1.01 -1.20 -3.63 121.20 117.81 2jtf s ILE 11 Ca 0.00 0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.71 2jtf s ILE 11 Cb 0.00 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 2jtf s ILE 11 CO 0.00 -0.02 -0.14 -0.89 0.00 0.00 0.00 174.94 173.89 2jtf s THR 12 N 11.76 3.10 0.00 2.92 2.01 -1.26 -3.46 115.64 130.71 2jtf s THR 12 Ca 0.98 -1.05 -0.03 0.00 0.31 0.00 0.00 61.69 61.90 2jtf s THR 12 Cb -0.19 -2.33 -0.11 0.00 0.01 0.00 0.00 72.50 69.88 2jtf s THR 12 CO 0.27 0.34 2.34 0.49 -0.69 0.00 0.00 174.62 177.37 2jtf n PHE 13 N 1.50 0.00 -4.38 4.92 3.01 -1.26 -4.72 117.46 116.54 2jtf n PHE 13 Ca -0.16 -1.01 -0.23 0.00 1.01 0.00 0.00 57.45 57.06 2jtf n PHE 13 Cb 0.52 -0.93 -0.17 0.00 -0.01 0.00 0.00 39.48 38.90 2jtf n PHE 13 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2jtf s GLU 14 N 0.94 1.37 -0.28 -1.08 0.41 -1.26 -5.09 118.70 113.70 2jtf s GLU 14 Ca 0.28 -0.29 -0.29 0.00 -0.41 0.00 0.00 54.97 54.27 2jtf s GLU 14 Cb 0.14 -1.21 -0.01 0.00 -1.78 0.00 0.00 34.13 31.26 2jtf s GLU 14 CO 0.00 -0.04 1.42 0.42 -0.49 0.00 0.00 175.26 176.57 2jtf s ILE 15 N 0.85 3.97 0.00 -1.63 1.09 -1.26 -1.50 121.20 122.72 2jtf s ILE 15 Ca -0.12 1.09 0.00 0.00 -1.10 0.00 0.00 60.65 60.52 2jtf s ILE 15 Cb -0.15 -4.00 0.00 0.00 -1.06 0.00 0.00 42.46 37.25 2jtf s ILE 15 CO 0.01 -0.42 0.00 0.61 -0.10 0.00 0.00 174.94 175.04 2jtf n GLY 16 N 4.48 1.59 3.77 6.18 0.00 -0.04 -5.02 105.19 116.15 2jtf n GLY 16 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.02 2.17 -0.31 4.61 0.00 -0.56 -4.67 121.76 120.97 2jtf s ALA 17 Ca 0.00 0.15 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 2jtf s ALA 17 Cb 0.00 -3.24 0.05 0.00 0.00 0.00 0.00 23.12 19.93 2jtf s ALA 17 CO 0.00 -1.81 0.03 -0.98 0.00 0.00 0.00 175.76 173.00 2jtf s ARG 18 N -4.94 2.47 0.60 0.00 1.70 -1.18 -0.46 118.95 117.13 2jtf s ARG 18 Ca 0.61 -1.26 -0.06 0.00 -0.47 0.00 0.00 55.73 54.55 2jtf s ARG 18 Cb -0.17 -3.26 0.01 0.00 -0.57 0.00 0.00 34.95 30.96 2jtf s ARG 18 CO 0.56 -0.64 0.92 -0.48 -1.08 0.00 0.00 175.30 174.57 2jtf s LEU 19 N 1.29 3.18 -0.26 -1.89 -0.00 0.16 0.67 118.68 121.83 2jtf s LEU 19 Ca -0.04 0.69 -0.08 0.00 -0.00 0.00 0.00 54.13 54.70 2jtf s LEU 19 Cb -0.20 -3.50 -0.03 0.00 -0.00 0.00 0.00 46.19 42.46 2jtf s LEU 19 CO -0.00 -1.13 0.10 -1.61 -0.00 0.00 0.00 176.35 173.71 2jtf s GLU 20 N -5.02 3.74 -0.02 1.48 2.02 -0.68 0.02 118.70 120.23 2jtf s GLU 20 Ca 0.55 -0.43 0.04 0.00 0.02 0.00 0.00 54.97 55.14 2jtf s GLU 20 Cb -0.11 -3.41 -0.03 0.00 0.10 0.00 0.00 34.13 30.69 2jtf s GLU 20 CO 0.45 -0.17 -0.12 0.00 0.02 0.00 0.00 175.26 175.44 2jtf s ALA 21 N 1.62 2.81 -0.19 5.21 0.00 -0.40 0.57 121.76 131.37 2jtf s ALA 21 Ca 0.06 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.92 2jtf s ALA 21 Cb -0.15 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 2jtf s ALA 21 CO 0.05 0.58 0.08 -1.17 0.00 0.00 0.00 175.76 175.31 2jtf s LEU 22 N -1.09 3.90 0.00 0.00 1.98 -0.07 -0.29 118.68 123.11 2jtf s LEU 22 Ca 0.14 0.10 0.00 0.00 -2.89 0.00 0.00 54.13 51.48 2jtf s LEU 22 Cb -0.11 -2.00 0.00 0.00 0.66 0.00 0.00 46.19 44.74 2jtf s LEU 22 CO 0.04 0.16 0.00 -0.67 -1.89 0.00 0.00 176.35 173.98 2jtf n ASP 23 N 3.65 0.00 0.00 3.68 -0.08 -0.69 -4.79 116.55 118.32 2jtf n ASP 23 Ca -0.16 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.12 2jtf n ASP 23 Cb 0.52 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.98 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 5.26 0.00 0.69 -0.67 9.36 -1.26 0.91 117.16 131.45 2jtf n TYR 24 Ca 0.00 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.30 2jtf n TYR 24 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 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 1.64 -3.09 2.98 7.99 -1.26 -4.93 117.00 120.32 2jtf n LEU 25 Ca 0.00 -0.78 -0.16 0.00 -0.01 0.00 0.00 56.01 55.06 2jtf n LEU 25 Cb 0.00 0.00 0.08 0.00 -0.11 0.00 0.00 43.42 43.39 2jtf n LEU 25 CO 0.00 0.31 0.12 0.00 -1.51 0.00 0.00 177.39 176.31 2jtf n GLN 26 N -0.06 -5.93 -4.39 3.23 3.00 0.26 -5.01 117.38 108.49 2jtf n GLN 26 Ca 0.07 0.72 -0.24 0.00 -0.01 0.00 0.00 57.00 57.54 2jtf n GLN 26 Cb 0.33 -5.39 -0.11 0.00 0.00 0.00 0.00 30.24 25.07 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 -5.37 1.43 -0.88 -1.09 1.02 -0.88 -4.80 119.74 109.17 2jtf s LYS 27 Ca 0.11 -1.51 -0.14 0.00 0.02 0.00 0.00 55.97 54.45 2jtf s LYS 27 Cb -0.05 -1.59 0.21 0.00 -0.52 0.00 0.00 37.83 35.87 2jtf s LYS 27 CO 0.62 0.33 0.88 -1.58 -0.92 0.00 0.00 175.35 174.69 2jtf s TRP 28 N -1.97 3.68 -0.01 3.18 0.52 -1.23 -1.70 118.94 121.41 2jtf s TRP 28 Ca 0.20 -1.94 -0.01 0.00 0.02 0.00 0.00 56.10 54.37 2jtf s TRP 28 Cb -0.06 -3.92 -0.04 0.00 -1.15 0.00 0.00 33.47 28.29 2jtf s TRP 28 CO 0.09 -1.09 0.08 1.52 0.02 0.00 0.00 176.95 177.56 2jtf s TYR 29 N 0.56 3.28 -0.32 -1.98 -0.85 0.60 -4.70 117.35 113.95 2jtf s TYR 29 Ca 0.23 0.21 -0.28 0.00 -0.52 0.00 0.00 57.07 56.71 2jtf s TYR 29 Cb -0.09 -1.74 -0.04 0.00 0.38 0.00 0.00 41.96 40.47 2jtf s TYR 29 CO -0.09 0.55 2.04 -1.25 -1.52 0.00 0.00 175.55 175.28 2jtf s PRO 30 N -1.67 3.07 0.17 -3.49 0.04 -1.26 -1.28 135.00 130.59 2jtf s PRO 30 Ca 0.22 1.63 0.07 0.00 0.04 0.00 0.00 61.00 62.96 2jtf s PRO 30 Cb -0.12 -4.32 -0.04 0.00 0.04 0.00 0.00 34.50 30.06 2jtf s PRO 30 CO 0.13 -2.17 -0.00 -1.12 0.04 0.00 0.00 177.00 173.88 2jtf s SER 31 N 7.78 4.76 0.09 6.66 0.01 0.10 -4.38 113.70 128.72 2jtf s SER 31 Ca 0.90 -0.39 -0.03 0.00 1.31 0.00 0.00 55.95 57.73 2jtf s SER 31 Cb -0.26 -1.01 -0.05 0.00 0.21 0.00 0.00 66.02 64.91 2jtf s SER 31 CO 0.33 0.09 0.29 -0.13 0.41 0.00 0.00 173.24 174.23 2jtf s ARG 32 N -2.92 3.54 -0.32 12.44 0.52 0.16 0.36 118.95 132.73 2jtf s ARG 32 Ca 0.27 -0.24 -0.20 0.00 -0.52 0.00 0.00 55.73 55.05 2jtf s ARG 32 Cb -0.09 -2.96 -0.01 0.00 0.52 0.00 0.00 34.95 32.40 2jtf s ARG 32 CO 0.18 0.55 0.59 0.42 0.02 0.00 0.00 175.30 177.07 2jtf s ILE 33 N -1.54 4.96 -0.21 1.52 1.01 0.39 -0.31 121.20 127.02 2jtf s ILE 33 Ca 0.36 0.72 -0.15 0.00 0.00 0.00 0.00 60.65 61.58 2jtf s ILE 33 Cb -0.13 -3.98 -0.19 0.00 0.01 0.00 0.00 42.46 38.17 2jtf s ILE 33 CO 0.25 -0.15 0.08 1.21 0.00 0.00 0.00 174.94 176.33 2jtf n GLU 34 N 5.84 0.61 -3.90 2.79 4.07 0.87 -0.86 120.64 130.07 2jtf n GLU 34 Ca -0.02 0.42 -0.11 0.00 -0.06 0.00 0.00 57.16 57.38 2jtf n GLU 34 Cb 0.49 -1.67 -0.13 0.00 -0.06 0.00 0.00 31.44 30.07 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 -2.44 0.10 -0.13 5.31 2.47 -1.25 -4.82 119.74 118.99 2jtf s LYS 35 Ca -0.30 -0.15 0.01 0.00 -1.56 0.00 0.00 55.97 53.97 2jtf s LYS 35 Cb 0.08 0.04 -0.01 0.00 -1.46 0.00 0.00 37.83 36.49 2jtf s LYS 35 CO 0.60 -0.02 -0.17 0.42 0.16 0.00 0.00 175.35 176.34 2jtf s ILE 36 N -0.41 2.63 -0.16 5.43 1.01 -1.26 -0.04 121.20 128.41 2jtf s ILE 36 Ca -0.05 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.80 2jtf s ILE 36 Cb -0.03 -2.08 0.02 0.00 0.01 0.00 0.00 42.46 40.39 2jtf s ILE 36 CO -0.00 0.53 -0.16 -0.62 0.00 0.00 0.00 174.94 174.69 2jtf s ASP 37 N 0.45 2.80 0.00 3.58 -1.08 0.88 -4.96 116.67 118.34 2jtf s ASP 37 Ca -0.12 -0.53 0.07 0.00 -0.52 0.00 0.00 52.55 51.45 2jtf s ASP 37 Cb -0.16 -1.26 0.18 0.00 -1.46 0.00 0.00 42.92 40.22 2jtf s ASP 37 CO 0.05 -0.04 1.09 0.00 0.52 0.00 0.00 175.17 176.79 2jtf n TYR 38 N 4.73 0.26 -0.09 -5.34 0.18 -1.26 0.19 117.16 115.82 2jtf n TYR 38 Ca -0.18 -0.40 -0.23 0.00 1.88 0.00 0.00 57.90 58.98 2jtf n TYR 38 Cb 0.50 -0.03 -0.12 0.00 -0.38 0.00 0.00 39.34 39.32 2jtf n TYR 38 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 2jtf n GLU 39 N 0.25 0.60 0.02 -3.48 2.13 -1.26 -4.19 120.64 114.71 2jtf n GLU 39 Ca 0.07 0.49 -0.13 0.00 0.66 0.00 0.00 57.16 58.26 2jtf n GLU 39 Cb 0.34 -1.71 -0.14 0.00 0.27 0.00 0.00 31.44 30.19 2jtf n GLU 39 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2jtf h GLU 40 N -0.82 0.12 -2.27 5.31 4.57 -2.01 -3.49 114.58 115.99 2jtf h GLU 40 Ca -0.40 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 57.58 2jtf h GLU 40 Cb 1.46 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 30.12 2jtf h GLU 40 CO -0.19 0.86 0.00 0.41 -1.18 0.00 0.00 179.01 178.92 2jtf n GLY 41 N 1.62 0.44 3.10 1.92 0.00 -0.96 -5.02 105.19 106.29 2jtf n GLY 41 Ca -0.16 -0.37 -0.08 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 -2.76 0.59 0.07 1.61 1.02 0.13 -3.51 119.74 116.89 2jtf s LYS 42 Ca 0.00 -0.94 0.04 0.00 0.02 0.00 0.00 55.97 55.09 2jtf s LYS 42 Cb 0.00 0.22 -0.03 0.00 -0.52 0.00 0.00 37.83 37.50 2jtf s LYS 42 CO 0.00 -0.13 -0.11 0.00 -0.92 0.00 0.00 175.35 174.19 2jtf s MET 43 N -3.11 0.72 -0.62 1.68 0.23 0.90 -0.09 119.30 119.02 2jtf s MET 43 Ca -0.01 -0.92 -0.25 0.00 -1.03 0.00 0.00 55.69 53.48 2jtf s MET 43 Cb 0.02 -0.57 0.04 0.00 -1.53 0.00 0.00 34.83 32.79 2jtf s MET 43 CO -0.07 0.11 1.07 -1.17 -2.03 0.00 0.00 175.02 172.93 2jtf s LEU 44 N -1.82 3.84 -0.28 0.18 0.20 0.95 -1.56 118.68 120.19 2jtf s LEU 44 Ca -0.03 -0.43 -0.14 0.00 0.69 0.00 0.00 54.13 54.22 2jtf s LEU 44 Cb -0.09 -2.74 -0.04 0.00 -0.43 0.00 0.00 46.19 42.89 2jtf s LEU 44 CO 0.01 -1.45 0.31 0.54 -0.29 0.00 0.00 176.35 175.47 2jtf s VAL 45 N 4.54 5.22 -0.49 1.68 0.11 0.84 -0.09 120.40 132.20 2jtf s VAL 45 Ca 0.32 0.39 -0.13 0.00 -2.93 0.00 0.00 61.98 59.63 2jtf s VAL 45 Cb -0.12 -3.66 0.11 0.00 -1.53 0.00 0.00 36.38 31.19 2jtf s VAL 45 CO 0.17 0.16 0.40 -1.38 -3.33 0.00 0.00 175.10 171.13 2jtf s HIS 46 N 1.97 3.32 0.34 1.54 -3.43 0.58 -1.28 115.29 118.33 2jtf s HIS 46 Ca 0.12 -1.48 -0.27 0.00 -0.80 0.00 0.00 55.06 52.63 2jtf s HIS 46 Cb -0.16 -3.52 -0.09 0.00 -1.43 0.00 0.00 32.58 27.38 2jtf s HIS 46 CO 0.10 -0.96 1.14 -0.06 -2.00 0.00 0.00 174.74 172.96 2jtf s PHE 47 N 1.50 3.31 -2.05 0.38 0.40 -0.80 -0.66 117.98 120.05 2jtf s PHE 47 Ca 0.04 1.61 0.11 0.00 -0.60 0.00 0.00 56.93 58.09 2jtf s PHE 47 Cb -0.27 -3.35 0.49 0.00 0.51 0.00 0.00 43.02 40.40 2jtf s PHE 47 CO 0.02 -0.97 1.34 0.39 0.70 0.00 0.00 175.22 176.70 2jtf n GLU 48 N 0.61 1.36 -1.26 0.44 -0.58 -1.26 -3.45 120.64 116.49 2jtf n GLU 48 Ca 0.02 -0.54 -0.03 0.00 -0.42 0.00 0.00 57.16 56.18 2jtf n GLU 48 Cb 0.46 -1.22 -0.03 0.00 -0.57 0.00 0.00 31.44 30.08 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 -0.14 0.07 -3.11 3.49 0.63 -1.26 -5.04 116.66 111.29 2jtf n ARG 49 Ca 0.09 -1.42 -0.45 0.00 -0.92 0.00 0.00 57.85 55.16 2jtf n ARG 49 Cb 0.16 0.28 -0.02 0.00 0.45 0.00 0.00 32.46 33.33 2jtf n ARG 49 CO 0.00 0.00 0.00 -0.46 -2.51 0.00 0.00 177.63 174.66 2jtf s TRP 50 N -0.06 3.53 -1.02 -0.14 -0.11 -1.22 -4.85 118.94 115.07 2jtf s TRP 50 Ca 0.13 -1.85 0.05 0.00 1.22 0.00 0.00 56.10 55.65 2jtf s TRP 50 Cb 0.16 -4.08 0.22 0.00 -1.50 0.00 0.00 33.47 28.27 2jtf s TRP 50 CO -0.07 -1.24 1.15 0.43 -4.62 0.00 0.00 176.95 172.60 2jtf n SER 51 N 5.10 0.00 0.00 5.86 7.64 -1.26 -2.38 113.62 128.58 2jtf n SER 51 Ca 0.22 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.59 2jtf n SER 51 Cb 0.46 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 2jtf n SER 51 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2jtf n HIS 52 N -1.49 0.00 0.00 1.43 8.25 -1.26 -4.81 115.22 117.33 2jtf n HIS 52 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2jtf n HIS 52 Cb 0.06 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 30.98 2jtf n HIS 52 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2jtf n ARG 53 N -1.06 2.96 0.00 -0.41 1.74 -1.24 -5.02 116.66 113.63 2jtf n ARG 53 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2jtf n ARG 53 Cb 0.00 -0.23 0.00 0.00 -1.02 0.00 0.00 32.46 31.21 2jtf n ARG 53 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2jtf n TYR 54 N -0.43 0.00 -3.46 -1.55 4.02 -1.00 -4.85 117.16 109.89 2jtf n TYR 54 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 2jtf n TYR 54 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.22 2jtf n TYR 54 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2jtf s ASP 55 N 0.00 6.19 0.04 7.72 1.01 -1.26 -1.91 116.67 128.45 2jtf s ASP 55 Ca 0.00 0.20 -0.03 0.00 0.71 0.00 0.00 52.55 53.43 2jtf s ASP 55 Cb 0.00 -2.18 -0.02 0.00 1.01 0.00 0.00 42.92 41.73 2jtf s ASP 55 CO 0.00 -0.12 0.03 -0.70 0.21 0.00 0.00 175.17 174.58 2jtf s GLU 56 N 1.88 0.52 -0.20 8.23 2.56 -0.40 -4.99 118.70 126.30 2jtf s GLU 56 Ca 0.12 -0.83 -0.05 0.00 0.00 0.00 0.00 54.97 54.21 2jtf s GLU 56 Cb -0.16 0.19 -0.02 0.00 2.00 0.00 0.00 34.13 36.14 2jtf s GLU 56 CO 0.10 -0.11 -0.00 -1.58 -0.56 0.00 0.00 175.26 173.10 2jtf s TRP 57 N -2.62 3.04 0.10 5.30 0.52 -1.26 -0.11 118.94 123.90 2jtf s TRP 57 Ca -0.05 -0.46 0.04 0.00 0.02 0.00 0.00 56.10 55.65 2jtf s TRP 57 Cb -0.01 -2.08 -0.04 0.00 -1.15 0.00 0.00 33.47 30.20 2jtf s TRP 57 CO -0.05 -0.23 -0.10 0.42 0.02 0.00 0.00 176.95 177.01 2jtf s ILE 58 N 0.96 0.92 0.95 2.03 1.01 -0.60 -4.91 121.20 121.55 2jtf s ILE 58 Ca 0.01 -1.66 -0.15 0.00 0.00 0.00 0.00 60.65 58.85 2jtf s ILE 58 Cb -0.14 -1.38 0.20 0.00 0.01 0.00 0.00 42.46 41.14 2jtf s ILE 58 CO 0.02 -0.58 1.30 -0.31 0.00 0.00 0.00 174.94 175.37 2jtf s TYR 59 N -2.53 1.60 -0.63 3.97 2.02 -1.26 -0.07 117.35 120.45 2jtf s TYR 59 Ca 0.06 0.28 -0.26 0.00 -0.37 0.00 0.00 57.07 56.78 2jtf s TYR 59 Cb -0.02 -4.05 -0.02 0.00 -0.40 0.00 0.00 41.96 37.46 2jtf s TYR 59 CO -0.00 -2.59 1.89 -1.58 -1.57 0.00 0.00 175.55 171.69 2jtf s TRP 60 N -3.84 1.65 -0.98 2.71 0.52 -1.23 -3.51 118.94 114.26 2jtf s TRP 60 Ca 0.73 0.81 -0.13 0.00 0.02 0.00 0.00 56.10 57.53 2jtf s TRP 60 Cb -0.04 -4.07 0.02 0.00 -1.15 0.00 0.00 33.47 28.23 2jtf s TRP 60 CO 0.52 -2.28 0.65 -0.40 0.02 0.00 0.00 176.95 175.47 2jtf n ASP 61 N 12.98 -4.79 0.12 2.95 5.75 -1.26 -4.93 116.55 127.37 2jtf n ASP 61 Ca 0.22 -1.04 -0.05 0.00 -0.01 0.00 0.00 54.79 53.91 2jtf n ASP 61 Cb 0.52 -1.97 -0.02 0.00 -1.03 0.00 0.00 41.12 38.61 2jtf n ASP 61 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2jtf h SER 62 N -1.17 -0.27 0.00 -1.12 4.64 -1.79 -3.45 113.55 110.39 2jtf h SER 62 Ca -0.63 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 2jtf h SER 62 Cb 1.38 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 2jtf h SER 62 CO 0.42 -0.15 0.00 -0.46 -0.87 0.00 0.00 176.83 175.77 2jtf n ASN 63 N -3.09 0.00 -0.98 4.97 0.23 -1.26 -4.92 115.26 110.21 2jtf n ASN 63 Ca -0.04 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.06 2jtf n ASN 63 Cb 0.13 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 37.96 2jtf n ASN 63 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 2jtf n ARG 64 N -0.91 1.09 -4.21 -3.83 0.63 -1.26 -5.03 116.66 103.14 2jtf n ARG 64 Ca 0.00 -2.88 -0.17 0.00 -0.92 0.00 0.00 57.85 53.88 2jtf n ARG 64 Cb 0.00 -1.08 -0.11 0.00 0.45 0.00 0.00 32.46 31.72 2jtf n ARG 64 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2jtf s LEU 65 N -2.14 2.37 -0.04 6.15 2.96 -1.26 -0.89 118.68 125.83 2jtf s LEU 65 Ca 0.37 -0.76 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 2jtf s LEU 65 Cb 0.38 -0.49 0.02 0.00 0.50 0.00 0.00 46.19 46.60 2jtf s LEU 65 CO -0.10 -0.15 -0.04 -0.60 -1.32 0.00 0.00 176.35 174.14 2jtf s ARG 66 N -2.46 0.67 0.78 1.98 3.52 0.19 -4.42 118.95 119.23 2jtf s ARG 66 Ca 0.05 -0.08 -0.13 0.00 -0.13 0.00 0.00 55.73 55.44 2jtf s ARG 66 Cb -0.06 -0.71 0.18 0.00 -1.56 0.00 0.00 34.95 32.80 2jtf s ARG 66 CO 0.02 -0.07 0.99 -0.35 -0.81 0.00 0.00 175.30 175.08 2jtf n PRO 67 N 3.94 -1.29 -1.64 5.12 -0.04 -1.26 -1.69 135.00 138.14 2jtf n PRO 67 Ca -0.25 -1.54 -0.33 0.00 -0.04 0.00 0.00 63.50 61.34 2jtf n PRO 67 Cb 0.51 -1.09 0.06 0.00 -0.04 0.00 0.00 33.50 32.95 2jtf n PRO 67 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2jtf s LEU 68 N 0.00 3.37 -1.22 1.53 2.96 -1.22 -3.99 118.68 120.11 2jtf s LEU 68 Ca 0.57 2.14 -0.22 0.00 -0.22 0.00 0.00 54.13 56.40 2jtf s LEU 68 Cb -0.02 -4.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.05 2jtf s LEU 68 CO 0.41 -1.87 1.89 -1.84 -1.32 0.00 0.00 176.35 173.62 2jtf n GLU 69 N -2.51 1.97 0.00 1.98 0.28 -1.04 -4.87 120.64 116.44 2jtf n GLU 69 Ca 0.11 -2.66 0.09 0.00 -0.16 0.00 0.00 57.16 54.55 2jtf n GLU 69 Cb 0.51 -3.68 0.55 0.00 1.43 0.00 0.00 31.44 30.26 2jtf n GLU 69 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51