#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 -0.04 -1.94 -3.83 1.74 -1.26 -4.67 116.66 106.67 2jtf n ARG 8 Ca 0.00 0.53 -0.39 0.00 -0.77 0.00 0.00 57.85 57.21 2jtf n ARG 8 Cb 0.00 -1.04 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 2jtf n ARG 8 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2jtf s PRO 9 N -0.41 2.73 0.00 5.56 0.02 -1.25 -4.49 135.00 137.16 2jtf s PRO 9 Ca -0.00 1.00 0.00 0.00 0.02 0.00 0.00 61.00 62.02 2jtf s PRO 9 Cb 0.00 -4.37 0.00 0.00 0.02 0.00 0.00 34.50 30.15 2jtf s PRO 9 CO 0.01 -2.58 0.00 0.41 -0.33 0.00 0.00 177.00 174.51 2jtf n GLY 10 N 5.68 1.36 3.55 0.52 0.00 0.11 -4.63 105.19 111.78 2jtf n GLY 10 Ca 0.24 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.98 3.36 -0.17 -0.61 1.01 -1.23 -3.56 121.20 118.01 2jtf s ILE 11 Ca 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 60.67 2jtf s ILE 11 Cb 0.00 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 2jtf s ILE 11 CO 0.00 -0.90 0.14 -0.89 0.00 0.00 0.00 174.94 173.29 2jtf s THR 12 N 9.29 5.43 -1.37 2.92 2.01 -1.26 -4.27 115.64 128.39 2jtf s THR 12 Ca 0.68 0.22 -0.16 0.00 0.31 0.00 0.00 61.69 62.73 2jtf s THR 12 Cb -0.12 -3.46 0.05 0.00 0.01 0.00 0.00 72.50 68.99 2jtf s THR 12 CO 0.18 0.49 1.98 0.33 -0.69 0.00 0.00 174.62 176.91 2jtf n PHE 13 N 3.05 4.10 -3.71 4.92 -0.00 -1.26 -4.74 117.46 119.83 2jtf n PHE 13 Ca -0.17 -2.90 -0.12 0.00 -0.00 0.00 0.00 57.45 54.26 2jtf n PHE 13 Cb 0.53 -2.60 -0.10 0.00 -0.00 0.00 0.00 39.48 37.31 2jtf n PHE 13 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 2jtf s GLU 14 N 3.74 0.51 -0.02 -4.13 0.41 -1.26 -5.09 118.70 112.86 2jtf s GLU 14 Ca 0.51 0.70 -0.30 0.00 -0.41 0.00 0.00 54.97 55.46 2jtf s GLU 14 Cb 0.09 0.19 -0.05 0.00 -1.78 0.00 0.00 34.13 32.58 2jtf s GLU 14 CO -0.00 -0.09 1.32 0.42 -0.49 0.00 0.00 175.26 176.42 2jtf s ILE 15 N 0.59 3.93 0.00 -1.63 1.09 -1.26 -1.48 121.20 122.44 2jtf s ILE 15 Ca -0.03 1.29 0.00 0.00 -1.10 0.00 0.00 60.65 60.81 2jtf s ILE 15 Cb -0.05 -3.83 0.00 0.00 -1.06 0.00 0.00 42.46 37.52 2jtf s ILE 15 CO -0.04 -0.00 0.00 0.61 -0.10 0.00 0.00 174.94 175.41 2jtf n GLY 16 N 3.53 0.46 3.77 6.18 0.00 0.15 -5.01 105.19 114.26 2jtf n GLY 16 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 2.31 -0.33 4.61 0.00 -0.55 -4.72 121.76 121.08 2jtf s ALA 17 Ca 0.00 0.31 -0.05 0.00 0.00 0.00 0.00 51.96 52.22 2jtf s ALA 17 Cb 0.00 -3.28 0.04 0.00 0.00 0.00 0.00 23.12 19.88 2jtf s ALA 17 CO 0.00 -1.65 0.08 1.03 0.00 0.00 0.00 175.76 175.22 2jtf s ARG 18 N -4.75 2.61 0.38 0.00 0.52 -1.25 -0.51 118.95 115.95 2jtf s ARG 18 Ca 0.62 -1.18 0.08 0.00 -0.52 0.00 0.00 55.73 54.73 2jtf s ARG 18 Cb -0.18 -3.39 -0.03 0.00 0.52 0.00 0.00 34.95 31.87 2jtf s ARG 18 CO 0.53 -0.64 0.29 -0.48 0.02 0.00 0.00 175.30 175.02 2jtf s LEU 19 N 1.38 3.42 -0.07 2.53 2.34 -0.08 0.10 118.68 128.30 2jtf s LEU 19 Ca -0.02 -0.69 -0.19 0.00 0.06 0.00 0.00 54.13 53.29 2jtf s LEU 19 Cb -0.19 -2.01 -0.05 0.00 -0.56 0.00 0.00 46.19 43.38 2jtf s LEU 19 CO 0.02 -0.48 0.52 -1.61 -1.06 0.00 0.00 176.35 173.74 2jtf s GLU 20 N -4.02 4.30 -0.05 1.48 2.02 -0.68 0.32 118.70 122.06 2jtf s GLU 20 Ca 0.43 0.56 -0.08 0.00 0.02 0.00 0.00 54.97 55.90 2jtf s GLU 20 Cb -0.03 -3.39 0.02 0.00 0.10 0.00 0.00 34.13 30.82 2jtf s GLU 20 CO 0.26 0.27 0.20 0.00 0.02 0.00 0.00 175.26 176.01 2jtf s ALA 21 N 0.23 -0.50 -0.73 5.21 0.00 -0.22 -0.00 121.76 125.75 2jtf s ALA 21 Ca 0.28 0.39 -0.17 0.00 0.00 0.00 0.00 51.96 52.46 2jtf s ALA 21 Cb -0.16 -0.19 0.15 0.00 0.00 0.00 0.00 23.12 22.91 2jtf s ALA 21 CO 0.13 -0.14 0.78 -1.17 0.00 0.00 0.00 175.76 175.36 2jtf s LEU 22 N -0.40 5.88 0.75 0.00 0.20 0.15 -0.93 118.68 124.35 2jtf s LEU 22 Ca -0.05 -2.02 -0.09 0.00 0.69 0.00 0.00 54.13 52.66 2jtf s LEU 22 Cb -0.03 -2.28 0.07 0.00 -0.43 0.00 0.00 46.19 43.52 2jtf s LEU 22 CO 0.01 -0.89 1.09 1.51 -0.29 0.00 0.00 176.35 177.78 2jtf s ASP 23 N 3.14 4.68 0.58 3.68 -4.77 -0.11 -4.78 116.67 119.09 2jtf s ASP 23 Ca 0.17 0.61 0.30 0.00 -3.30 0.00 0.00 52.55 50.32 2jtf s ASP 23 Cb -0.17 -1.19 1.45 0.00 -1.09 0.00 0.00 42.92 41.92 2jtf s ASP 23 CO -0.02 -1.74 1.85 0.22 0.70 0.00 0.00 175.17 176.18 2jtf h TYR 24 N -0.81 0.00 -0.00 2.11 3.20 -1.90 0.95 116.97 120.52 2jtf h TYR 24 Ca -0.45 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.42 2jtf h TYR 24 Cb 1.32 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.59 2jtf h TYR 24 CO 0.32 0.00 -0.01 1.28 -1.64 0.00 0.00 178.16 178.12 2jtf n LEU 25 N -3.82 0.08 -2.16 2.82 7.99 -1.26 -4.86 117.00 115.78 2jtf n LEU 25 Ca 0.12 0.11 -0.06 0.00 -0.01 0.00 0.00 56.01 56.18 2jtf n LEU 25 Cb 0.81 -0.14 0.03 0.00 -0.11 0.00 0.00 43.42 44.00 2jtf n LEU 25 CO 0.30 0.01 0.02 0.00 -1.51 0.00 0.00 177.39 176.21 2jtf n GLN 26 N -1.09 -1.07 -4.60 3.23 3.00 0.32 -5.05 117.38 112.12 2jtf n GLN 26 Ca 0.19 0.34 -0.22 0.00 -0.01 0.00 0.00 57.00 57.30 2jtf n GLN 26 Cb 0.19 -3.27 -0.15 0.00 0.00 0.00 0.00 30.24 27.00 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 -3.65 1.19 -1.09 -1.09 1.02 -0.91 -4.92 119.74 110.29 2jtf s LYS 27 Ca 0.16 -0.46 -0.13 0.00 0.02 0.00 0.00 55.97 55.56 2jtf s LYS 27 Cb -0.02 -1.11 0.20 0.00 -0.52 0.00 0.00 37.83 36.38 2jtf s LYS 27 CO 0.29 0.23 1.22 -1.58 -0.92 0.00 0.00 175.35 174.59 2jtf s TRP 28 N -0.11 3.70 0.34 3.18 0.52 -1.25 -0.93 118.94 124.39 2jtf s TRP 28 Ca 0.01 -2.16 0.08 0.00 0.02 0.00 0.00 56.10 54.05 2jtf s TRP 28 Cb -0.07 -4.12 -0.04 0.00 -1.15 0.00 0.00 33.47 28.09 2jtf s TRP 28 CO 0.00 -1.24 0.16 1.52 0.02 0.00 0.00 176.95 177.42 2jtf s TYR 29 N 0.77 2.74 -0.29 -1.98 -0.85 -0.10 -4.77 117.35 112.87 2jtf s TYR 29 Ca 0.35 -0.36 -0.29 0.00 -0.52 0.00 0.00 57.07 56.25 2jtf s TYR 29 Cb -0.06 -1.65 -0.01 0.00 0.38 0.00 0.00 41.96 40.63 2jtf s TYR 29 CO -0.05 0.33 1.41 -2.14 -1.52 0.00 0.00 175.55 173.58 2jtf s PRO 30 N -3.86 3.83 0.22 -3.49 0.02 -1.25 -1.06 135.00 129.41 2jtf s PRO 30 Ca 0.38 1.34 0.03 0.00 0.02 0.00 0.00 61.00 62.77 2jtf s PRO 30 Cb -0.03 -3.95 0.03 0.00 0.02 0.00 0.00 34.50 30.58 2jtf s PRO 30 CO 0.23 -1.23 0.28 -1.13 -0.33 0.00 0.00 177.00 174.81 2jtf n SER 31 N 8.04 0.94 -4.22 2.53 3.41 0.15 -4.80 113.62 119.67 2jtf n SER 31 Ca 0.16 -1.60 -0.26 0.00 -0.26 0.00 0.00 58.87 56.91 2jtf n SER 31 Cb 0.46 -0.14 -0.15 0.00 -0.26 0.00 0.00 64.21 64.13 2jtf n SER 31 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2jtf s ARG 32 N -2.96 1.50 -0.28 4.33 0.52 -0.51 -0.90 118.95 120.65 2jtf s ARG 32 Ca 0.21 -0.79 -0.23 0.00 -0.52 0.00 0.00 55.73 54.40 2jtf s ARG 32 Cb -0.02 -1.51 -0.00 0.00 0.52 0.00 0.00 34.95 33.94 2jtf s ARG 32 CO 0.13 0.40 0.77 0.42 0.02 0.00 0.00 175.30 177.05 2jtf s ILE 33 N -0.59 4.83 -0.21 1.52 1.01 0.34 -0.65 121.20 127.45 2jtf s ILE 33 Ca 0.07 1.26 -0.11 0.00 0.00 0.00 0.00 60.65 61.87 2jtf s ILE 33 Cb -0.08 -4.11 -0.09 0.00 0.01 0.00 0.00 42.46 38.20 2jtf s ILE 33 CO 0.00 -0.16 -0.28 1.21 0.00 0.00 0.00 174.94 175.71 2jtf n GLU 34 N 6.08 0.46 -4.29 2.79 4.07 0.49 0.32 120.64 130.55 2jtf n GLU 34 Ca 0.03 0.20 -0.19 0.00 -0.06 0.00 0.00 57.16 57.14 2jtf n GLU 34 Cb 0.48 -1.27 -0.16 0.00 -0.06 0.00 0.00 31.44 30.43 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 -2.43 0.84 -0.32 5.31 2.20 -1.23 -4.73 119.74 119.39 2jtf s LYS 35 Ca -0.30 -0.23 -0.07 0.00 -0.36 0.00 0.00 55.97 55.01 2jtf s LYS 35 Cb 0.11 -0.80 0.02 0.00 -1.51 0.00 0.00 37.83 35.64 2jtf s LYS 35 CO 0.38 0.06 0.11 0.42 -0.36 0.00 0.00 175.35 175.96 2jtf s ILE 36 N 0.34 4.05 -1.02 5.43 1.01 -1.26 0.34 121.20 130.10 2jtf s ILE 36 Ca -0.05 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 59.77 2jtf s ILE 36 Cb -0.09 -3.17 0.31 0.00 0.01 0.00 0.00 42.46 39.52 2jtf s ILE 36 CO 0.00 -0.04 1.62 -0.67 0.00 0.00 0.00 174.94 175.85 2jtf n ASP 37 N 4.88 6.74 0.19 3.58 2.03 0.12 -4.78 116.55 129.31 2jtf n ASP 37 Ca -0.14 -3.57 0.14 0.00 0.52 0.00 0.00 54.79 51.74 2jtf n ASP 37 Cb 0.47 -1.16 0.61 0.00 -0.72 0.00 0.00 41.12 40.32 2jtf n ASP 37 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 2jtf h TYR 38 N 4.63 0.00 -0.74 -0.67 -0.00 -1.90 0.83 116.97 119.13 2jtf h TYR 38 Ca 0.37 0.00 0.08 0.00 -0.00 0.00 0.00 58.73 59.18 2jtf h TYR 38 Cb 0.46 0.00 -0.06 0.00 -0.00 0.00 0.00 36.73 37.12 2jtf h TYR 38 CO 1.17 0.00 0.41 1.49 -0.00 0.00 0.00 178.16 181.22 2jtf h GLU 39 N 0.00 0.69 0.08 0.10 4.81 -1.92 -2.92 114.58 115.42 2jtf h GLU 39 Ca 0.00 -0.04 -0.35 0.00 -0.13 0.00 0.00 59.36 58.84 2jtf h GLU 39 Cb 0.30 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2jtf h GLU 39 CO 0.00 0.46 -1.96 -1.91 -0.73 0.00 0.00 179.01 174.87 2jtf n GLU 40 N -4.78 0.70 0.00 1.92 4.07 -0.75 -5.00 120.64 116.79 2jtf n GLU 40 Ca 0.11 0.31 0.00 0.00 -0.06 0.00 0.00 57.16 57.51 2jtf n GLU 40 Cb 0.23 -1.68 0.00 0.00 -0.06 0.00 0.00 31.44 29.93 2jtf n GLU 40 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jtf n GLY 41 N 1.89 1.99 3.47 8.31 0.00 0.27 -5.02 105.19 116.11 2jtf n GLY 41 Ca -0.35 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.67 2.60 0.15 1.61 -2.85 -0.34 -2.36 119.74 117.89 2jtf s LYS 42 Ca 0.00 -0.69 0.11 0.00 -1.00 0.00 0.00 55.97 54.38 2jtf s LYS 42 Cb 0.00 -2.41 -0.04 0.00 -2.06 0.00 0.00 37.83 33.32 2jtf s LYS 42 CO 0.00 0.58 -0.23 0.00 0.10 0.00 0.00 175.35 175.81 2jtf s MET 43 N -0.62 1.58 -0.88 1.78 0.23 0.25 0.14 119.30 121.77 2jtf s MET 43 Ca 0.09 -1.37 -0.25 0.00 -1.03 0.00 0.00 55.69 53.13 2jtf s MET 43 Cb -0.11 -1.95 0.03 0.00 -1.53 0.00 0.00 34.83 31.28 2jtf s MET 43 CO 0.01 0.44 1.42 -1.17 -2.03 0.00 0.00 175.02 173.69 2jtf s LEU 44 N -2.36 3.33 -0.29 0.18 1.98 0.15 -1.45 118.68 120.23 2jtf s LEU 44 Ca 0.18 -0.92 -0.16 0.00 -2.89 0.00 0.00 54.13 50.33 2jtf s LEU 44 Cb -0.09 -2.56 -0.03 0.00 0.66 0.00 0.00 46.19 44.17 2jtf s LEU 44 CO 0.09 -1.74 0.43 0.54 -1.89 0.00 0.00 176.35 173.78 2jtf s VAL 45 N 5.72 5.12 -0.33 1.68 0.11 -0.13 -0.38 120.40 132.20 2jtf s VAL 45 Ca 0.44 0.58 -0.15 0.00 -2.93 0.00 0.00 61.98 59.92 2jtf s VAL 45 Cb -0.04 -3.79 -0.02 0.00 -1.53 0.00 0.00 36.38 31.01 2jtf s VAL 45 CO 0.02 0.06 0.34 -1.38 -3.33 0.00 0.00 175.10 170.81 2jtf s HIS 46 N 2.19 3.22 0.43 1.54 -3.43 0.18 -1.29 115.29 118.12 2jtf s HIS 46 Ca 0.17 0.01 -0.21 0.00 -0.80 0.00 0.00 55.06 54.23 2jtf s HIS 46 Cb -0.16 -2.62 -0.10 0.00 -1.43 0.00 0.00 32.58 28.27 2jtf s HIS 46 CO 0.10 -0.39 0.97 -0.06 -2.00 0.00 0.00 174.74 173.37 2jtf s PHE 47 N 1.97 3.27 -0.05 0.38 0.40 -0.55 -1.42 117.98 121.98 2jtf s PHE 47 Ca 0.11 1.61 -0.23 0.00 -0.60 0.00 0.00 56.93 57.83 2jtf s PHE 47 Cb -0.17 -2.90 -0.28 0.00 0.51 0.00 0.00 43.02 40.19 2jtf s PHE 47 CO 0.11 -0.24 0.94 1.49 0.70 0.00 0.00 175.22 178.22 2jtf h GLU 48 N 1.93 0.26 -3.13 0.44 4.81 -1.87 -3.44 114.58 113.58 2jtf h GLU 48 Ca -0.49 -0.37 -0.56 0.00 -0.13 0.00 0.00 59.36 57.82 2jtf h GLU 48 Cb 1.19 0.13 -0.40 0.00 0.63 0.00 0.00 28.75 30.30 2jtf h GLU 48 CO 0.61 1.12 -0.77 1.03 -0.73 0.00 0.00 179.01 180.27 2jtf s ARG 49 N -2.68 0.47 -0.22 1.92 0.52 -1.26 -5.06 118.95 112.64 2jtf s ARG 49 Ca -0.15 -0.85 -0.30 0.00 -0.52 0.00 0.00 55.73 53.91 2jtf s ARG 49 Cb 0.01 -1.57 0.16 0.00 0.52 0.00 0.00 34.95 34.07 2jtf s ARG 49 CO 0.79 -1.02 1.19 1.67 0.02 0.00 0.00 175.30 177.95 2jtf s TRP 50 N 1.79 -0.19 0.00 -0.53 -2.14 -1.26 -4.52 118.94 112.09 2jtf s TRP 50 Ca 0.10 0.30 0.00 0.00 2.66 0.00 0.00 56.10 59.16 2jtf s TRP 50 Cb -0.17 0.48 0.00 0.00 -3.10 0.00 0.00 33.47 30.68 2jtf s TRP 50 CO -0.29 -0.19 0.00 0.43 -2.66 0.00 0.00 176.95 174.24 2jtf n SER 51 N 0.52 0.00 0.00 -2.66 7.64 -1.26 -4.05 113.62 113.81 2jtf n SER 51 Ca -0.04 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.16 2jtf n SER 51 Cb 0.58 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 2jtf n SER 51 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2jtf n HIS 52 N -0.85 0.00 -0.06 1.43 -0.00 -1.26 -3.37 115.22 111.11 2jtf n HIS 52 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 2jtf n HIS 52 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 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 0.65 0.00 1.57 3.00 -1.26 -5.01 116.66 115.61 2jtf n ARG 53 Ca 0.00 0.06 0.00 0.00 -0.00 0.00 0.00 57.85 57.91 2jtf n ARG 53 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 32.46 31.22 2jtf n ARG 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2jtf n TYR 54 N -2.77 0.00 -3.51 -0.14 4.02 -1.22 -4.61 117.16 108.93 2jtf n TYR 54 Ca -0.20 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.28 2jtf n TYR 54 Cb 0.74 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.96 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 -0.39 6.08 0.01 7.72 1.11 -1.26 -1.49 116.67 128.45 2jtf s ASP 55 Ca 0.00 -0.50 0.01 0.00 0.18 0.00 0.00 52.55 52.24 2jtf s ASP 55 Cb 0.00 -2.15 -0.01 0.00 1.07 0.00 0.00 42.92 41.83 2jtf s ASP 55 CO 0.00 -0.28 -0.04 -0.70 1.18 0.00 0.00 175.17 175.33 2jtf s GLU 56 N 1.74 0.32 -0.32 8.23 2.12 -0.41 -4.97 118.70 125.40 2jtf s GLU 56 Ca 0.06 -0.39 -0.27 0.00 0.36 0.00 0.00 54.97 54.73 2jtf s GLU 56 Cb -0.18 -0.15 0.01 0.00 0.26 0.00 0.00 34.13 34.07 2jtf s GLU 56 CO 0.11 0.03 0.98 -1.58 -0.54 0.00 0.00 175.26 174.25 2jtf s TRP 57 N -0.75 3.15 0.03 5.30 0.52 -1.26 -0.95 118.94 124.99 2jtf s TRP 57 Ca -0.06 1.03 0.02 0.00 0.02 0.00 0.00 56.10 57.11 2jtf s TRP 57 Cb -0.06 -3.56 -0.02 0.00 -1.15 0.00 0.00 33.47 28.69 2jtf s TRP 57 CO -0.00 -0.72 -0.07 0.42 0.02 0.00 0.00 176.95 176.60 2jtf s ILE 58 N 3.44 0.49 0.94 2.03 1.01 -0.53 -4.91 121.20 123.67 2jtf s ILE 58 Ca 0.41 -0.83 -0.14 0.00 0.00 0.00 0.00 60.65 60.09 2jtf s ILE 58 Cb -0.13 -0.52 0.16 0.00 0.01 0.00 0.00 42.46 41.98 2jtf s ILE 58 CO 0.15 -0.25 1.17 -0.31 0.00 0.00 0.00 174.94 175.70 2jtf s TYR 59 N -1.03 2.18 0.27 3.97 2.02 -1.26 -0.59 117.35 122.91 2jtf s TYR 59 Ca -0.07 0.71 -0.05 0.00 -0.37 0.00 0.00 57.07 57.29 2jtf s TYR 59 Cb -0.08 -3.53 0.52 0.00 -0.40 0.00 0.00 41.96 38.48 2jtf s TYR 59 CO 0.00 -2.52 1.60 -1.49 -1.57 0.00 0.00 175.55 171.58 2jtf h TRP 60 N -1.59 -0.16 0.00 2.71 4.06 -1.86 -3.11 115.95 116.00 2jtf h TRP 60 Ca -0.48 0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.53 2jtf h TRP 60 Cb 1.31 0.21 0.00 0.00 -1.00 0.00 0.00 29.16 29.68 2jtf h TRP 60 CO -0.23 -0.34 -0.25 -0.40 -3.56 0.00 0.00 178.44 173.67 2jtf n ASP 61 N -5.45 0.00 -4.76 -3.49 5.68 -1.26 -2.99 116.55 104.29 2jtf n ASP 61 Ca 0.17 -1.50 -0.40 0.00 -0.50 0.00 0.00 54.79 52.55 2jtf n ASP 61 Cb 0.56 -0.10 -0.04 0.00 -1.14 0.00 0.00 41.12 40.40 2jtf n ASP 61 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2jtf s SER 62 N -0.50 7.20 0.00 -1.12 0.01 -1.17 -3.81 113.70 114.30 2jtf s SER 62 Ca 0.00 2.30 0.00 0.00 1.31 0.00 0.00 55.95 59.56 2jtf s SER 62 Cb 0.00 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2jtf s SER 62 CO 0.00 -0.21 0.00 0.59 0.41 0.00 0.00 173.24 174.03 2jtf n ASN 63 N 1.38 0.00 -0.25 2.44 3.02 -1.26 -2.79 115.26 117.80 2jtf n ASN 63 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2jtf n ASN 63 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 2jtf n ASN 63 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2jtf n ARG 64 N 0.00 0.00 -3.73 3.52 0.00 -1.26 -4.98 116.66 110.22 2jtf n ARG 64 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.85 57.63 2jtf n ARG 64 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 32.46 32.44 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 0.00 4.20 -0.24 2.89 2.01 -1.12 0.35 118.68 126.76 2jtf s LEU 65 Ca 0.00 0.23 -0.16 0.00 0.01 0.00 0.00 54.13 54.22 2jtf s LEU 65 Cb 0.00 -3.05 0.07 0.00 0.01 0.00 0.00 46.19 43.22 2jtf s LEU 65 CO 0.00 -0.15 0.60 -0.60 1.01 0.00 0.00 176.35 177.21 2jtf s ARG 66 N -4.07 0.63 1.11 1.70 3.52 1.00 -4.14 118.95 118.69 2jtf s ARG 66 Ca 0.37 1.02 -0.15 0.00 -0.13 0.00 0.00 55.73 56.83 2jtf s ARG 66 Cb -0.09 0.16 0.24 0.00 -1.56 0.00 0.00 34.95 33.70 2jtf s ARG 66 CO 0.32 -0.13 1.09 -2.14 -0.81 0.00 0.00 175.30 173.63 2jtf s PRO 67 N 1.22 -0.46 -0.02 5.12 0.02 -1.26 -1.69 135.00 137.94 2jtf s PRO 67 Ca -0.07 0.26 -0.02 0.00 0.02 0.00 0.00 61.00 61.19 2jtf s PRO 67 Cb -0.06 -1.66 -0.01 0.00 0.02 0.00 0.00 34.50 32.80 2jtf s PRO 67 CO -0.13 -3.27 0.23 1.25 -0.33 0.00 0.00 177.00 174.76 2jtf h LEU 68 N -2.27 -0.06 -0.07 -5.54 6.46 -1.81 -3.39 115.31 108.62 2jtf h LEU 68 Ca -0.51 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.25 2jtf h LEU 68 Cb 1.32 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.26 2jtf h LEU 68 CO 0.47 0.05 0.00 -1.84 -0.62 0.00 0.00 178.44 176.51 2jtf n GLU 69 N -2.71 0.00 -0.40 1.25 0.28 -1.26 -4.95 120.64 112.85 2jtf n GLU 69 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 2jtf n GLU 69 Cb 0.03 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.90 2jtf n GLU 69 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84