#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 1.51 0.10 -3.83 0.52 -1.26 -5.11 118.95 110.88 2jtf s ARG 8 Ca 0.00 -1.84 -0.31 0.00 -0.52 0.00 0.00 55.73 53.06 2jtf s ARG 8 Cb 0.00 -0.28 -0.10 0.00 0.52 0.00 0.00 34.95 35.09 2jtf s ARG 8 CO 0.00 -0.34 1.78 -2.14 0.02 0.00 0.00 175.30 174.62 2jtf s PRO 9 N -3.95 4.16 0.00 3.54 0.02 -1.26 -4.79 135.00 132.72 2jtf s PRO 9 Ca 0.36 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.89 2jtf s PRO 9 Cb 0.07 -3.64 0.00 0.00 0.02 0.00 0.00 34.50 30.95 2jtf s PRO 9 CO 0.15 -0.82 0.00 0.41 -0.33 0.00 0.00 177.00 176.41 2jtf n GLY 10 N 4.18 0.60 3.50 0.52 0.00 -1.26 -4.15 105.19 108.57 2jtf n GLY 10 Ca 0.17 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 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 0.00 -0.00 1.32 -0.61 5.41 -0.96 -3.85 119.36 120.66 2jtf n ILE 11 Ca 0.00 -0.30 0.14 0.00 1.00 0.00 0.00 62.75 63.59 2jtf n ILE 11 Cb 0.00 -1.40 0.51 0.00 -0.71 0.00 0.00 39.64 38.03 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 7.57 0.00 -1.74 1.39 -1.04 -0.77 -2.85 114.28 116.84 2jtf n THR 12 Ca 0.53 -0.08 -0.18 0.00 -2.04 0.00 0.00 64.05 62.27 2jtf n THR 12 Cb 0.22 0.10 -0.06 0.00 -1.82 0.00 0.00 70.33 68.77 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 -0.87 -0.23 -4.98 -1.42 3.72 -1.26 -4.98 117.46 107.44 2jtf n PHE 13 Ca 0.13 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.25 2jtf n PHE 13 Cb 0.31 -3.24 -0.16 0.00 -0.94 0.00 0.00 39.48 35.44 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 -3.90 2.25 0.14 -1.08 0.41 -1.26 -5.09 118.70 110.16 2jtf s GLU 14 Ca 0.00 -0.71 -0.31 0.00 -0.41 0.00 0.00 54.97 53.54 2jtf s GLU 14 Cb 0.00 -1.85 -0.09 0.00 -1.78 0.00 0.00 34.13 30.41 2jtf s GLU 14 CO 0.00 0.22 1.48 0.42 -0.49 0.00 0.00 175.26 176.89 2jtf s ILE 15 N 0.17 2.99 0.00 -1.63 1.01 -1.26 -1.32 121.20 121.16 2jtf s ILE 15 Ca -0.09 0.70 0.00 0.00 0.00 0.00 0.00 60.65 61.26 2jtf s ILE 15 Cb -0.14 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.88 2jtf s ILE 15 CO 0.04 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.65 2jtf n GLY 16 N 3.62 1.42 3.98 6.18 0.00 0.12 -5.00 105.19 115.52 2jtf n GLY 16 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.33 3.29 0.32 4.61 0.00 -0.43 -4.77 121.76 122.44 2jtf s ALA 17 Ca 0.00 -1.60 -0.00 0.00 0.00 0.00 0.00 51.96 50.35 2jtf s ALA 17 Cb 0.00 -2.21 -0.04 0.00 0.00 0.00 0.00 23.12 20.87 2jtf s ALA 17 CO 0.00 -1.76 0.53 1.03 0.00 0.00 0.00 175.76 175.56 2jtf s ARG 18 N -5.36 3.51 0.00 0.00 0.52 -1.26 -1.04 118.95 115.32 2jtf s ARG 18 Ca 0.69 -0.29 -0.16 0.00 -0.52 0.00 0.00 55.73 55.45 2jtf s ARG 18 Cb -0.05 -2.68 0.03 0.00 0.52 0.00 0.00 34.95 32.77 2jtf s ARG 18 CO 0.47 0.19 0.35 -0.48 0.02 0.00 0.00 175.30 175.85 2jtf s LEU 19 N -4.09 0.67 -0.31 2.53 2.34 -0.07 -1.84 118.68 117.90 2jtf s LEU 19 Ca 0.40 0.07 -0.20 0.00 0.06 0.00 0.00 54.13 54.46 2jtf s LEU 19 Cb -0.10 1.46 -0.01 0.00 -0.56 0.00 0.00 46.19 46.98 2jtf s LEU 19 CO 0.34 -0.53 0.61 -1.61 -1.06 0.00 0.00 176.35 174.10 2jtf s GLU 20 N -1.74 3.86 0.24 1.48 2.02 -0.60 0.69 118.70 124.66 2jtf s GLU 20 Ca -0.10 0.23 0.09 0.00 0.02 0.00 0.00 54.97 55.21 2jtf s GLU 20 Cb -0.03 -3.74 -0.04 0.00 0.10 0.00 0.00 34.13 30.42 2jtf s GLU 20 CO 0.02 -0.58 -0.02 0.00 0.02 0.00 0.00 175.26 174.70 2jtf s ALA 21 N 2.57 3.12 -0.19 5.21 0.00 0.19 0.75 121.76 133.41 2jtf s ALA 21 Ca 0.24 -1.60 -0.04 0.00 0.00 0.00 0.00 51.96 50.55 2jtf s ALA 21 Cb -0.15 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 2jtf s ALA 21 CO 0.12 0.32 -0.02 -1.17 0.00 0.00 0.00 175.76 175.01 2jtf s LEU 22 N -3.47 3.19 0.43 0.00 1.98 0.72 0.11 118.68 121.65 2jtf s LEU 22 Ca 0.30 -0.22 0.07 0.00 -2.89 0.00 0.00 54.13 51.39 2jtf s LEU 22 Cb -0.07 -1.80 -0.05 0.00 0.66 0.00 0.00 46.19 44.93 2jtf s LEU 22 CO 0.19 0.08 0.15 1.51 -1.89 0.00 0.00 176.35 176.38 2jtf s ASP 23 N 0.93 4.31 0.56 3.68 -4.77 -0.48 -4.79 116.67 116.12 2jtf s ASP 23 Ca 0.01 -1.20 0.37 0.00 -3.30 0.00 0.00 52.55 48.43 2jtf s ASP 23 Cb -0.14 -0.31 1.49 0.00 -1.09 0.00 0.00 42.92 42.86 2jtf s ASP 23 CO 0.02 -0.60 1.71 0.22 0.70 0.00 0.00 175.17 177.22 2jtf h TYR 24 N 1.43 0.00 0.00 2.11 3.20 -1.95 1.20 116.97 122.95 2jtf h TYR 24 Ca -0.43 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.44 2jtf h TYR 24 Cb 1.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.53 2jtf h TYR 24 CO 0.75 0.00 0.00 1.28 -1.64 0.00 0.00 178.16 178.55 2jtf n LEU 25 N -3.93 0.00 -2.31 2.82 7.99 -1.26 -4.84 117.00 115.47 2jtf n LEU 25 Ca 0.26 0.09 -0.11 0.00 -0.01 0.00 0.00 56.01 56.25 2jtf n LEU 25 Cb 1.34 -0.09 0.05 0.00 -0.11 0.00 0.00 43.42 44.61 2jtf n LEU 25 CO 0.37 -0.01 0.08 0.00 -1.51 0.00 0.00 177.39 176.32 2jtf n GLN 26 N -1.09 -3.91 -4.36 3.23 3.00 0.41 -5.01 117.38 109.65 2jtf n GLN 26 Ca 0.18 0.47 -0.33 0.00 -0.01 0.00 0.00 57.00 57.31 2jtf n GLN 26 Cb 0.13 -4.37 -0.15 0.00 0.00 0.00 0.00 30.24 25.84 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 -5.04 3.15 -0.95 -1.09 1.02 -0.93 -4.90 119.74 111.00 2jtf s LYS 27 Ca 0.10 -0.77 -0.19 0.00 0.02 0.00 0.00 55.97 55.12 2jtf s LYS 27 Cb -0.04 -2.63 0.12 0.00 -0.52 0.00 0.00 37.83 34.76 2jtf s LYS 27 CO 0.41 -0.08 1.19 -1.58 -0.92 0.00 0.00 175.35 174.36 2jtf s TRP 28 N 1.03 3.03 0.03 3.18 0.52 -1.24 -1.39 118.94 124.11 2jtf s TRP 28 Ca -0.01 -1.32 0.07 0.00 0.02 0.00 0.00 56.10 54.86 2jtf s TRP 28 Cb -0.15 -4.35 -0.02 0.00 -1.15 0.00 0.00 33.47 27.80 2jtf s TRP 28 CO -0.04 -1.56 -0.22 1.52 0.02 0.00 0.00 176.95 176.67 2jtf s TYR 29 N 3.03 1.91 -0.50 -1.98 1.13 0.12 -4.82 117.35 116.23 2jtf s TYR 29 Ca 0.35 -0.38 -0.27 0.00 -1.41 0.00 0.00 57.07 55.36 2jtf s TYR 29 Cb -0.04 -1.15 -0.03 0.00 -1.10 0.00 0.00 41.96 39.64 2jtf s TYR 29 CO -0.09 0.08 1.92 -2.14 -2.51 0.00 0.00 175.55 172.81 2jtf s PRO 30 N -1.08 2.77 0.00 -3.49 0.02 -1.26 -0.64 135.00 131.33 2jtf s PRO 30 Ca 0.08 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.09 2jtf s PRO 30 Cb -0.09 -4.36 0.00 0.00 0.02 0.00 0.00 34.50 30.07 2jtf s PRO 30 CO 0.01 -2.54 0.00 0.43 -0.33 0.00 0.00 177.00 174.58 2jtf n SER 31 N 12.45 0.00 -4.34 2.53 7.64 0.22 -4.80 113.62 127.31 2jtf n SER 31 Ca 0.24 -0.60 -0.24 0.00 1.01 0.00 0.00 58.87 59.27 2jtf n SER 31 Cb 0.51 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.59 2jtf n SER 31 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2jtf s ARG 32 N -0.00 1.30 -0.30 1.43 1.81 -0.50 -0.89 118.95 121.79 2jtf s ARG 32 Ca 0.00 -1.36 -0.14 0.00 -1.72 0.00 0.00 55.73 52.51 2jtf s ARG 32 Cb 0.00 -1.51 -0.03 0.00 -0.45 0.00 0.00 34.95 32.96 2jtf s ARG 32 CO 0.00 0.33 0.30 0.42 -0.68 0.00 0.00 175.30 175.67 2jtf s ILE 33 N -1.63 5.23 -0.13 1.52 1.01 -0.21 0.10 121.20 127.09 2jtf s ILE 33 Ca 0.14 0.24 0.19 0.00 0.00 0.00 0.00 60.65 61.21 2jtf s ILE 33 Cb -0.08 -3.68 -0.23 0.00 0.01 0.00 0.00 42.46 38.48 2jtf s ILE 33 CO 0.07 0.11 0.44 1.21 0.00 0.00 0.00 174.94 176.77 2jtf n GLU 34 N 5.24 0.66 -3.52 2.79 4.07 0.15 0.16 120.64 130.18 2jtf n GLU 34 Ca -0.11 0.03 -0.17 0.00 -0.06 0.00 0.00 57.16 56.85 2jtf n GLU 34 Cb 0.51 -1.62 -0.05 0.00 -0.06 0.00 0.00 31.44 30.21 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 -2.91 1.07 0.02 5.31 2.47 -1.25 -4.80 119.74 119.65 2jtf s LYS 35 Ca -0.07 0.09 0.02 0.00 -1.56 0.00 0.00 55.97 54.44 2jtf s LYS 35 Cb 0.09 0.50 -0.01 0.00 -1.46 0.00 0.00 37.83 36.95 2jtf s LYS 35 CO 0.84 -0.36 -0.06 0.42 0.16 0.00 0.00 175.35 176.36 2jtf s ILE 36 N -1.68 0.41 -0.25 5.43 1.01 -1.26 0.29 121.20 125.14 2jtf s ILE 36 Ca -0.09 -0.67 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 2jtf s ILE 36 Cb -0.00 -0.43 0.09 0.00 0.01 0.00 0.00 42.46 42.13 2jtf s ILE 36 CO 0.05 -0.19 0.15 -0.62 0.00 0.00 0.00 174.94 174.33 2jtf s ASP 37 N -0.93 2.80 0.23 3.58 -1.08 -0.26 -4.99 116.67 116.02 2jtf s ASP 37 Ca -0.06 -0.94 0.24 0.00 -0.52 0.00 0.00 52.55 51.27 2jtf s ASP 37 Cb -0.06 -0.16 0.35 0.00 -1.46 0.00 0.00 42.92 41.59 2jtf s ASP 37 CO 0.00 -0.40 1.40 1.88 0.52 0.00 0.00 175.17 178.58 2jtf h TYR 38 N 8.39 0.00 -0.05 -5.34 0.05 -1.93 0.56 116.97 118.64 2jtf h TYR 38 Ca -0.18 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.59 2jtf h TYR 38 Cb 1.07 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.81 2jtf h TYR 38 CO 0.24 0.00 -0.03 0.93 -1.05 0.00 0.00 178.16 178.25 2jtf h GLU 39 N 0.00 0.11 0.07 4.88 5.08 -1.94 -2.84 114.58 119.93 2jtf h GLU 39 Ca 0.00 -0.05 -0.25 0.00 -1.00 0.00 0.00 59.36 58.06 2jtf h GLU 39 Cb 0.87 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.12 2jtf h GLU 39 CO 0.00 0.50 -1.10 1.49 -1.00 0.00 0.00 179.01 178.90 2jtf h GLU 40 N -0.29 0.36 -1.90 2.33 4.57 -2.01 -3.48 114.58 114.17 2jtf h GLU 40 Ca 0.01 -0.48 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2jtf h GLU 40 Cb 0.47 0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 2jtf h GLU 40 CO 0.01 1.17 0.00 0.41 -1.18 0.00 0.00 179.01 179.42 2jtf n GLY 41 N 1.23 0.83 3.30 1.92 0.00 0.31 -5.02 105.19 107.76 2jtf n GLY 41 Ca -0.08 -0.43 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.62 1.37 0.04 1.61 1.02 0.17 -3.28 119.74 118.05 2jtf s LYS 42 Ca 0.00 -1.73 -0.07 0.00 0.02 0.00 0.00 55.97 54.19 2jtf s LYS 42 Cb 0.00 -0.24 -0.01 0.00 -0.52 0.00 0.00 37.83 37.06 2jtf s LYS 42 CO 0.00 -0.28 0.14 0.00 -0.92 0.00 0.00 175.35 174.29 2jtf s MET 43 N -4.02 0.65 -0.59 1.68 0.23 0.09 -1.10 119.30 116.23 2jtf s MET 43 Ca 0.36 -0.73 -0.22 0.00 -1.03 0.00 0.00 55.69 54.08 2jtf s MET 43 Cb 0.08 0.26 0.07 0.00 -1.53 0.00 0.00 34.83 33.70 2jtf s MET 43 CO 0.12 -0.18 0.85 -1.17 -2.03 0.00 0.00 175.02 172.62 2jtf s LEU 44 N -2.18 4.58 -0.25 0.18 2.96 0.14 -1.50 118.68 122.62 2jtf s LEU 44 Ca -0.04 -0.88 -0.15 0.00 -0.22 0.00 0.00 54.13 52.84 2jtf s LEU 44 Cb -0.00 -2.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 2jtf s LEU 44 CO -0.05 -1.23 0.36 0.54 -1.32 0.00 0.00 176.35 174.65 2jtf s VAL 45 N 3.54 5.20 -0.35 1.68 0.11 0.25 0.33 120.40 131.16 2jtf s VAL 45 Ca 0.21 0.57 -0.10 0.00 -2.93 0.00 0.00 61.98 59.73 2jtf s VAL 45 Cb -0.17 -3.69 0.02 0.00 -1.53 0.00 0.00 36.38 31.01 2jtf s VAL 45 CO 0.12 0.20 0.17 -1.38 -3.33 0.00 0.00 175.10 170.88 2jtf s HIS 46 N 1.80 3.22 0.00 1.54 -3.43 0.11 -1.40 115.29 117.13 2jtf s HIS 46 Ca 0.15 -0.90 0.00 0.00 -0.80 0.00 0.00 55.06 53.51 2jtf s HIS 46 Cb -0.15 -2.38 0.00 0.00 -1.43 0.00 0.00 32.58 28.61 2jtf s HIS 46 CO 0.09 -0.60 0.29 1.19 -2.00 0.00 0.00 174.74 173.72 2jtf n PHE 47 N 4.96 0.00 0.00 0.38 3.01 -1.13 -1.41 117.46 123.27 2jtf n PHE 47 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.33 2jtf n PHE 47 Cb 0.47 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 2jtf n PHE 47 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2jtf n GLU 48 N -1.87 0.00 -3.40 -1.08 2.13 -1.26 -4.75 120.64 110.42 2jtf n GLU 48 Ca 0.00 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.84 2jtf n GLU 48 Cb 0.00 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.67 2jtf n GLU 48 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2jtf s ARG 49 N 0.00 0.30 0.22 5.31 1.70 -1.26 -4.65 118.95 120.57 2jtf s ARG 49 Ca 0.00 0.74 0.00 0.00 -0.47 0.00 0.00 55.73 56.00 2jtf s ARG 49 Cb 0.00 0.45 0.00 0.00 -0.57 0.00 0.00 34.95 34.83 2jtf s ARG 49 CO 0.00 -0.11 0.00 -2.67 -1.08 0.00 0.00 175.30 171.44 2jtf n TRP 50 N 5.01 -1.81 -2.77 5.89 4.27 -1.26 -4.97 117.44 121.80 2jtf n TRP 50 Ca -0.09 0.32 -0.10 0.00 -3.89 0.00 0.00 57.50 53.74 2jtf n TRP 50 Cb 0.52 0.49 0.08 0.00 -1.36 0.00 0.00 31.31 31.05 2jtf n TRP 50 CO 0.00 0.00 0.00 0.43 -2.29 0.00 0.00 177.69 175.83 2jtf n SER 51 N -3.31 -1.91 -0.51 -0.67 7.64 -1.26 -5.02 113.62 108.58 2jtf n SER 51 Ca 0.00 -3.45 0.05 0.00 1.01 0.00 0.00 58.87 56.48 2jtf n SER 51 Cb 0.01 1.52 -0.01 0.00 -1.01 0.00 0.00 64.21 64.72 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 0.21 -2.22 -3.05 1.43 8.25 -1.26 -5.01 115.22 113.57 2jtf n HIS 52 Ca 0.07 0.47 -0.02 0.00 -0.26 0.00 0.00 57.72 57.98 2jtf n HIS 52 Cb 0.72 -0.82 0.00 0.00 1.12 0.00 0.00 29.99 31.01 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 -1.77 -1.46 0.18 -0.41 1.74 -1.26 -4.90 116.66 108.78 2jtf n ARG 53 Ca 0.00 1.56 0.03 0.00 -0.77 0.00 0.00 57.85 58.68 2jtf n ARG 53 Cb 0.17 -5.68 0.32 0.00 -1.02 0.00 0.00 32.46 26.25 2jtf n ARG 53 CO 0.00 0.00 0.00 0.10 -1.52 0.00 0.00 177.63 176.21 2jtf h TYR 54 N 0.64 0.00 -3.32 -1.55 -0.00 -1.95 -3.38 116.97 107.40 2jtf h TYR 54 Ca -0.01 0.00 -0.65 0.00 -0.00 0.00 0.00 58.73 58.06 2jtf h TYR 54 Cb 1.01 0.00 -0.36 0.00 -0.00 0.00 0.00 36.73 37.38 2jtf h TYR 54 CO 0.19 0.43 -0.83 -0.51 -0.00 0.00 0.00 178.16 177.43 2jtf s ASP 55 N -6.65 3.43 0.02 0.10 1.01 -1.26 -2.85 116.67 110.47 2jtf s ASP 55 Ca -0.01 -0.85 0.01 0.00 0.71 0.00 0.00 52.55 52.42 2jtf s ASP 55 Cb 0.12 -1.41 -0.01 0.00 1.01 0.00 0.00 42.92 42.63 2jtf s ASP 55 CO 0.71 -0.08 -0.05 -0.70 0.21 0.00 0.00 175.17 175.26 2jtf s GLU 56 N 1.29 0.40 -0.01 8.23 2.12 -0.49 -4.96 118.70 125.28 2jtf s GLU 56 Ca 0.01 -0.42 -0.21 0.00 0.36 0.00 0.00 54.97 54.71 2jtf s GLU 56 Cb -0.15 -0.26 -0.05 0.00 0.26 0.00 0.00 34.13 33.93 2jtf s GLU 56 CO -0.10 0.06 0.61 -1.58 -0.54 0.00 0.00 175.26 173.71 2jtf s TRP 57 N -0.70 3.66 0.16 5.30 0.52 -1.26 -0.59 118.94 126.03 2jtf s TRP 57 Ca -0.04 1.21 -0.01 0.00 0.02 0.00 0.00 56.10 57.28 2jtf s TRP 57 Cb -0.05 -2.64 -0.04 0.00 -1.15 0.00 0.00 33.47 29.58 2jtf s TRP 57 CO -0.00 0.30 0.07 0.42 0.02 0.00 0.00 176.95 177.77 2jtf s ILE 58 N -0.02 0.13 0.49 2.03 1.01 -0.56 -4.95 121.20 119.33 2jtf s ILE 58 Ca 0.32 -1.94 0.08 0.00 0.00 0.00 0.00 60.65 59.11 2jtf s ILE 58 Cb -0.18 -2.19 0.08 0.00 0.01 0.00 0.00 42.46 40.18 2jtf s ILE 58 CO 0.17 -0.32 0.67 -1.22 0.00 0.00 0.00 174.94 174.24 2jtf n TYR 59 N -0.17 -2.39 -2.00 3.97 4.02 -1.26 -0.73 117.16 118.60 2jtf n TYR 59 Ca -0.03 -1.78 -0.40 0.00 -0.01 0.00 0.00 57.90 55.67 2jtf n TYR 59 Cb 0.64 -0.46 -0.03 0.00 -0.02 0.00 0.00 39.34 39.47 2jtf n TYR 59 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 2jtf s TRP 60 N -2.03 1.68 -1.60 -0.72 0.52 -1.20 -3.31 118.94 112.27 2jtf s TRP 60 Ca 0.51 0.80 0.00 0.00 0.02 0.00 0.00 56.10 57.43 2jtf s TRP 60 Cb -0.04 -4.07 0.00 0.00 -1.15 0.00 0.00 33.47 28.21 2jtf s TRP 60 CO 0.32 -2.51 0.00 -0.25 0.02 0.00 0.00 176.95 174.54 2jtf n ASP 61 N 12.15 -4.30 0.17 2.95 9.92 -1.24 -4.82 116.55 131.37 2jtf n ASP 61 Ca 0.22 0.33 0.10 0.00 -0.53 0.00 0.00 54.79 54.90 2jtf n ASP 61 Cb 0.51 -3.84 0.61 0.00 -0.64 0.00 0.00 41.12 37.75 2jtf n ASP 61 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 2jtf h SER 62 N 0.00 0.08 0.00 -2.24 4.64 -1.80 -3.41 113.55 110.82 2jtf h SER 62 Ca -0.34 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2jtf h SER 62 Cb 1.09 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2jtf h SER 62 CO 0.47 0.06 0.00 -0.46 -0.87 0.00 0.00 176.83 176.02 2jtf n ASN 63 N -4.50 0.00 -1.31 4.97 0.23 -1.26 -5.00 115.26 108.39 2jtf n ASN 63 Ca 0.00 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.10 2jtf n ASN 63 Cb 0.18 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 37.94 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 -0.45 0.28 -4.23 -3.83 1.74 -1.26 -4.90 116.66 104.01 2jtf n ARG 64 Ca 0.00 -2.19 -0.17 0.00 -0.77 0.00 0.00 57.85 54.72 2jtf n ARG 64 Cb 0.00 -0.30 -0.13 0.00 -1.02 0.00 0.00 32.46 31.01 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 -0.56 2.19 -0.08 0.55 2.01 -1.26 -0.20 118.68 121.33 2jtf s LEU 65 Ca 0.34 -0.46 -0.03 0.00 0.01 0.00 0.00 54.13 53.98 2jtf s LEU 65 Cb 0.37 -0.43 0.04 0.00 0.01 0.00 0.00 46.19 46.18 2jtf s LEU 65 CO -0.15 -0.04 0.17 -0.60 1.01 0.00 0.00 176.35 176.75 2jtf s ARG 66 N -1.20 0.12 0.50 1.70 3.52 0.23 -3.66 118.95 120.15 2jtf s ARG 66 Ca -0.02 0.42 -0.08 0.00 -0.13 0.00 0.00 55.73 55.92 2jtf s ARG 66 Cb -0.08 -0.17 0.11 0.00 -1.56 0.00 0.00 34.95 33.26 2jtf s ARG 66 CO 0.01 -0.17 0.68 -0.35 -0.81 0.00 0.00 175.30 174.66 2jtf n PRO 67 N 4.26 -0.58 -1.28 5.12 -0.04 -1.26 -1.56 135.00 139.65 2jtf n PRO 67 Ca -0.26 -1.11 -0.35 0.00 -0.04 0.00 0.00 63.50 61.74 2jtf n PRO 67 Cb 0.52 -0.68 0.10 0.00 -0.04 0.00 0.00 33.50 33.40 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 3.96 -0.23 1.53 4.77 -1.13 -3.84 117.00 122.06 2jtf n LEU 68 Ca 0.09 0.64 0.03 0.00 -0.03 0.00 0.00 56.01 56.74 2jtf n LEU 68 Cb 0.30 -1.45 0.15 0.00 -2.33 0.00 0.00 43.42 40.09 2jtf n LEU 68 CO 0.22 -1.87 0.98 1.05 -1.33 0.00 0.00 177.39 176.44 2jtf h GLU 69 N -0.47 0.37 0.00 3.23 4.11 -1.92 -3.46 114.58 116.44 2jtf h GLU 69 Ca -0.47 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2jtf h GLU 69 Cb 1.32 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2jtf h GLU 69 CO 0.47 0.25 0.00 0.54 0.07 0.00 0.00 179.01 180.33