#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 1.95 0.00 1.20 1.81 -1.26 -4.53 118.95 118.12 2jtf s ARG 8 Ca 0.00 -2.55 0.00 0.00 -1.72 0.00 0.00 55.73 51.46 2jtf s ARG 8 Cb 0.00 -3.33 0.00 0.00 -0.45 0.00 0.00 34.95 31.17 2jtf s ARG 8 CO 0.00 -1.10 0.00 -0.35 -0.68 0.00 0.00 175.30 173.17 2jtf n PRO 9 N 3.24 3.25 -3.67 3.54 -0.04 -1.26 -5.03 135.00 135.02 2jtf n PRO 9 Ca 0.05 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.51 2jtf n PRO 9 Cb 0.33 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.79 2jtf n PRO 9 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2jtf s GLY 10 N -0.75 -0.35 -0.52 0.55 0.00 -1.26 -4.42 107.32 100.57 2jtf s GLY 10 Ca 0.00 0.48 -0.29 0.00 0.00 0.00 0.00 44.72 44.91 2jtf s GLY 10 CO 0.00 0.12 2.40 1.39 0.00 0.00 0.00 173.10 177.01 2jtf n ILE 11 N -0.49 0.04 1.29 0.90 5.41 -0.98 -3.74 119.36 121.80 2jtf n ILE 11 Ca -0.08 -0.49 0.14 0.00 1.00 0.00 0.00 62.75 63.32 2jtf n ILE 11 Cb 0.62 -2.08 0.61 0.00 -0.71 0.00 0.00 39.64 38.08 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 7.70 0.00 -1.10 1.39 -1.04 -0.84 -3.75 114.28 116.65 2jtf n THR 12 Ca 0.43 -0.03 -0.03 0.00 -2.04 0.00 0.00 64.05 62.38 2jtf n THR 12 Cb 0.37 -0.24 -0.01 0.00 -1.82 0.00 0.00 70.33 68.63 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 -1.20 0.00 -4.86 -1.42 7.35 -1.26 -4.99 117.46 111.08 2jtf n PHE 13 Ca 0.12 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.48 2jtf n PHE 13 Cb 0.29 -1.28 -0.14 0.00 0.35 0.00 0.00 39.48 38.70 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 -1.58 2.96 -0.42 -4.13 0.41 -1.26 -5.06 118.70 109.63 2jtf s GLU 14 Ca 0.00 -0.70 -0.29 0.00 -0.41 0.00 0.00 54.97 53.57 2jtf s GLU 14 Cb 0.00 -2.49 0.01 0.00 -1.78 0.00 0.00 34.13 29.86 2jtf s GLU 14 CO 0.00 0.40 1.47 0.42 -0.49 0.00 0.00 175.26 177.06 2jtf s ILE 15 N -0.14 3.82 0.00 -1.63 1.01 -1.26 -1.25 121.20 121.75 2jtf s ILE 15 Ca -0.01 0.83 0.00 0.00 0.00 0.00 0.00 60.65 61.46 2jtf s ILE 15 Cb -0.14 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.20 2jtf s ILE 15 CO 0.03 -0.74 0.00 0.61 0.00 0.00 0.00 174.94 174.84 2jtf n GLY 16 N 5.16 1.67 4.01 6.18 0.00 -0.40 -5.01 105.19 116.79 2jtf n GLY 16 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.99 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 4.35 0.52 4.61 0.00 -0.38 -4.89 121.76 123.97 2jtf s ALA 17 Ca 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 51.96 50.16 2jtf s ALA 17 Cb 0.00 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.44 2jtf s ALA 17 CO 0.00 -0.79 0.75 1.03 0.00 0.00 0.00 175.76 176.75 2jtf s ARG 18 N -4.68 2.70 0.13 0.00 3.00 -1.26 -0.94 118.95 117.90 2jtf s ARG 18 Ca 0.60 -0.68 -0.07 0.00 0.00 0.00 0.00 55.73 55.59 2jtf s ARG 18 Cb -0.08 -2.50 -0.02 0.00 0.00 0.00 0.00 34.95 32.36 2jtf s ARG 18 CO 0.38 -0.59 0.19 -0.48 0.00 0.00 0.00 175.30 174.81 2jtf s LEU 19 N -4.71 1.35 -0.23 2.53 0.05 0.87 -1.99 118.68 116.55 2jtf s LEU 19 Ca 0.55 -0.89 -0.14 0.00 0.05 0.00 0.00 54.13 53.70 2jtf s LEU 19 Cb -0.10 0.91 -0.04 0.00 -2.05 0.00 0.00 46.19 44.90 2jtf s LEU 19 CO 0.38 -0.80 0.31 -0.70 -0.55 0.00 0.00 176.35 175.00 2jtf s GLU 20 N -3.95 4.09 0.16 1.48 2.56 -0.73 -0.71 118.70 121.59 2jtf s GLU 20 Ca 0.15 -0.00 0.06 0.00 0.00 0.00 0.00 54.97 55.18 2jtf s GLU 20 Cb 0.05 -3.57 -0.04 0.00 2.00 0.00 0.00 34.13 32.56 2jtf s GLU 20 CO -0.03 -0.08 -0.13 0.00 -0.56 0.00 0.00 175.26 174.46 2jtf s ALA 21 N 1.46 1.67 -0.34 6.30 0.00 -0.49 0.27 121.76 130.63 2jtf s ALA 21 Ca 0.14 -1.49 -0.05 0.00 0.00 0.00 0.00 51.96 50.56 2jtf s ALA 21 Cb -0.15 -0.04 0.05 0.00 0.00 0.00 0.00 23.12 22.98 2jtf s ALA 21 CO 0.08 0.03 0.09 -1.17 0.00 0.00 0.00 175.76 174.78 2jtf s LEU 22 N -2.99 4.31 0.50 0.00 0.20 0.16 -0.21 118.68 120.65 2jtf s LEU 22 Ca 0.16 -1.27 0.05 0.00 0.69 0.00 0.00 54.13 53.76 2jtf s LEU 22 Cb -0.01 -1.83 0.03 0.00 -0.43 0.00 0.00 46.19 43.95 2jtf s LEU 22 CO 0.04 -0.34 0.69 1.51 -0.29 0.00 0.00 176.35 177.96 2jtf s ASP 23 N 1.43 5.42 0.55 3.68 -4.77 -0.26 -4.79 116.67 117.92 2jtf s ASP 23 Ca -0.02 -0.24 0.42 0.00 -3.30 0.00 0.00 52.55 49.41 2jtf s ASP 23 Cb -0.20 -0.71 1.62 0.00 -1.09 0.00 0.00 42.92 42.54 2jtf s ASP 23 CO 0.01 -0.99 1.71 0.22 0.70 0.00 0.00 175.17 176.82 2jtf h TYR 24 N 0.32 0.02 0.00 2.11 3.20 -1.90 1.16 116.97 121.88 2jtf h TYR 24 Ca -0.41 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.47 2jtf h TYR 24 Cb 1.29 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.55 2jtf h TYR 24 CO 0.37 -0.00 0.00 1.28 -1.64 0.00 0.00 178.16 178.17 2jtf n LEU 25 N -4.10 0.00 -1.97 2.82 7.99 -1.26 -4.84 117.00 115.64 2jtf n LEU 25 Ca 0.33 0.22 -0.07 0.00 -0.01 0.00 0.00 56.01 56.49 2jtf n LEU 25 Cb 1.55 -0.22 0.04 0.00 -0.11 0.00 0.00 43.42 44.68 2jtf n LEU 25 CO 0.42 -0.06 0.04 0.00 -1.51 0.00 0.00 177.39 176.28 2jtf n GLN 26 N -1.22 -2.61 -4.35 3.23 3.00 0.40 -5.03 117.38 110.79 2jtf n GLN 26 Ca 0.12 0.34 -0.31 0.00 -0.01 0.00 0.00 57.00 57.14 2jtf n GLN 26 Cb 0.15 -3.83 -0.16 0.00 0.00 0.00 0.00 30.24 26.39 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 -4.52 2.61 -0.65 -1.09 1.02 -0.88 -4.90 119.74 111.32 2jtf s LYS 27 Ca 0.00 -0.69 -0.26 0.00 0.02 0.00 0.00 55.97 55.04 2jtf s LYS 27 Cb -0.00 -2.22 0.04 0.00 -0.52 0.00 0.00 37.83 35.13 2jtf s LYS 27 CO 0.29 -0.12 1.14 -1.58 -0.92 0.00 0.00 175.35 174.16 2jtf s TRP 28 N 1.11 2.53 0.04 3.18 0.52 -1.23 -1.11 118.94 123.99 2jtf s TRP 28 Ca -0.02 -0.01 -0.03 0.00 0.02 0.00 0.00 56.10 56.07 2jtf s TRP 28 Cb -0.14 -4.43 -0.02 0.00 -1.15 0.00 0.00 33.47 27.72 2jtf s TRP 28 CO -0.06 -1.73 0.02 1.52 0.02 0.00 0.00 176.95 176.72 2jtf s TYR 29 N 4.89 0.32 -0.31 -1.98 1.13 0.71 -4.88 117.35 117.23 2jtf s TYR 29 Ca 0.34 -0.70 -0.27 0.00 -1.41 0.00 0.00 57.07 55.03 2jtf s TYR 29 Cb -0.10 -0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.47 2jtf s TYR 29 CO 0.18 -0.33 2.25 -2.14 -2.51 0.00 0.00 175.55 173.00 2jtf s PRO 30 N -2.76 2.81 0.50 -3.49 0.02 -1.26 -1.39 135.00 129.42 2jtf s PRO 30 Ca -0.04 1.79 0.06 0.00 0.02 0.00 0.00 61.00 62.83 2jtf s PRO 30 Cb -0.00 -4.43 0.01 0.00 0.02 0.00 0.00 34.50 30.09 2jtf s PRO 30 CO -0.06 -2.47 0.32 -1.12 -0.33 0.00 0.00 177.00 173.34 2jtf s SER 31 N 9.39 4.59 0.15 2.53 0.01 0.11 -4.70 113.70 125.78 2jtf s SER 31 Ca 0.98 -1.19 0.09 0.00 1.31 0.00 0.00 55.95 57.15 2jtf s SER 31 Cb -0.27 0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.03 2jtf s SER 31 CO 0.32 -0.91 -0.15 -0.13 0.41 0.00 0.00 173.24 172.78 2jtf s ARG 32 N -4.15 1.88 -0.38 12.44 0.52 -0.30 -0.09 118.95 128.87 2jtf s ARG 32 Ca 0.35 -1.23 -0.21 0.00 -0.52 0.00 0.00 55.73 54.11 2jtf s ARG 32 Cb -0.01 -2.12 0.01 0.00 0.52 0.00 0.00 34.95 33.36 2jtf s ARG 32 CO 0.21 0.46 0.68 0.42 0.02 0.00 0.00 175.30 177.09 2jtf s ILE 33 N -1.40 4.82 -0.16 1.52 1.01 -0.12 -0.52 121.20 126.35 2jtf s ILE 33 Ca 0.21 0.53 0.12 0.00 0.00 0.00 0.00 60.65 61.51 2jtf s ILE 33 Cb -0.10 -4.16 -0.23 0.00 0.01 0.00 0.00 42.46 37.98 2jtf s ILE 33 CO 0.12 -0.44 0.21 -0.62 0.00 0.00 0.00 174.94 174.21 2jtf n GLU 34 N 6.24 0.67 -3.92 2.79 -0.58 -0.05 -1.28 120.64 124.52 2jtf n GLU 34 Ca -0.00 0.12 -0.08 0.00 -0.42 0.00 0.00 57.16 56.78 2jtf n GLU 34 Cb 0.48 -1.61 -0.03 0.00 -0.57 0.00 0.00 31.44 29.71 2jtf n GLU 34 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2jtf s LYS 35 N -2.53 1.71 0.04 3.49 1.02 -1.24 -4.86 119.74 117.37 2jtf s LYS 35 Ca -0.14 -1.13 0.01 0.00 0.02 0.00 0.00 55.97 54.74 2jtf s LYS 35 Cb 0.07 0.55 -0.02 0.00 -0.52 0.00 0.00 37.83 37.91 2jtf s LYS 35 CO 0.79 -0.76 -0.06 0.42 -0.92 0.00 0.00 175.35 174.82 2jtf s ILE 36 N -3.89 0.37 -0.36 2.17 1.01 -1.26 0.07 121.20 119.30 2jtf s ILE 36 Ca 0.16 -1.06 0.13 0.00 0.00 0.00 0.00 60.65 59.89 2jtf s ILE 36 Cb -0.04 -0.53 0.45 0.00 0.01 0.00 0.00 42.46 42.35 2jtf s ILE 36 CO 0.08 -0.46 1.01 -0.67 0.00 0.00 0.00 174.94 174.90 2jtf n ASP 37 N 1.44 2.60 0.29 3.58 2.03 0.15 -4.89 116.55 121.76 2jtf n ASP 37 Ca -0.23 -3.07 0.15 0.00 0.52 0.00 0.00 54.79 52.16 2jtf n ASP 37 Cb 0.55 -0.50 0.73 0.00 -0.72 0.00 0.00 41.12 41.17 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 2.85 0.00 -0.06 -0.67 -0.00 -1.88 0.83 116.97 118.04 2jtf h TYR 38 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 58.73 58.62 2jtf h TYR 38 Cb 1.09 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.81 2jtf h TYR 38 CO 0.61 0.00 -0.63 1.05 -0.00 0.00 0.00 178.16 179.19 2jtf h GLU 39 N 0.00 0.23 0.00 0.10 9.09 -1.92 -3.04 114.58 119.04 2jtf h GLU 39 Ca 0.03 -0.17 -0.33 0.00 0.05 0.00 0.00 59.36 58.94 2jtf h GLU 39 Cb 0.88 0.03 -0.06 0.00 -1.65 0.00 0.00 28.75 27.95 2jtf h GLU 39 CO -0.00 0.79 -2.06 -1.91 0.05 0.00 0.00 179.01 175.88 2jtf n GLU 40 N -3.85 0.66 -0.40 1.06 4.07 -0.30 -4.99 120.64 116.90 2jtf n GLU 40 Ca -0.02 0.15 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 2jtf n GLU 40 Cb 0.64 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 30.36 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 1.68 1.37 3.98 8.31 0.00 0.28 -4.98 105.19 115.82 2jtf n GLY 41 Ca -0.26 -0.14 -0.19 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.23 2.67 0.07 1.61 1.02 -0.32 -1.98 119.74 121.59 2jtf s LYS 42 Ca 0.00 -1.39 -0.14 0.00 0.02 0.00 0.00 55.97 54.47 2jtf s LYS 42 Cb 0.00 -2.63 0.02 0.00 -0.52 0.00 0.00 37.83 34.70 2jtf s LYS 42 CO 0.00 -0.34 0.32 0.00 -0.92 0.00 0.00 175.35 174.40 2jtf s MET 43 N -4.34 0.89 -0.59 1.68 0.23 0.76 0.31 119.30 118.24 2jtf s MET 43 Ca 0.54 -0.64 -0.22 0.00 -1.03 0.00 0.00 55.69 54.34 2jtf s MET 43 Cb -0.08 0.39 0.06 0.00 -1.53 0.00 0.00 34.83 33.67 2jtf s MET 43 CO 0.32 -0.31 0.86 -1.17 -2.03 0.00 0.00 175.02 172.70 2jtf s LEU 44 N -2.42 4.54 -0.16 0.18 0.20 0.11 -1.51 118.68 119.64 2jtf s LEU 44 Ca -0.01 -0.87 -0.23 0.00 0.69 0.00 0.00 54.13 53.71 2jtf s LEU 44 Cb 0.01 -2.51 -0.02 0.00 -0.43 0.00 0.00 46.19 43.23 2jtf s LEU 44 CO -0.07 -1.25 0.73 0.54 -0.29 0.00 0.00 176.35 176.02 2jtf s VAL 45 N 3.60 4.97 -0.55 1.68 0.11 0.18 -0.87 120.40 129.52 2jtf s VAL 45 Ca 0.22 1.44 -0.10 0.00 -2.93 0.00 0.00 61.98 60.61 2jtf s VAL 45 Cb -0.17 -4.05 0.14 0.00 -1.53 0.00 0.00 36.38 30.77 2jtf s VAL 45 CO 0.12 0.11 0.44 -2.28 -3.33 0.00 0.00 175.10 170.16 2jtf s HIS 46 N 1.76 3.45 0.58 1.54 2.46 0.32 -1.67 115.29 123.73 2jtf s HIS 46 Ca 0.35 -1.93 -0.19 0.00 0.47 0.00 0.00 55.06 53.75 2jtf s HIS 46 Cb -0.17 -3.54 -0.04 0.00 -0.13 0.00 0.00 32.58 28.70 2jtf s HIS 46 CO 0.13 -0.98 1.20 -0.06 -2.47 0.00 0.00 174.74 172.57 2jtf s PHE 47 N 1.03 2.42 -1.23 3.88 0.40 -1.26 -1.15 117.98 122.08 2jtf s PHE 47 Ca 0.09 1.51 -0.19 0.00 -0.60 0.00 0.00 56.93 57.74 2jtf s PHE 47 Cb -0.24 -3.47 0.06 0.00 0.51 0.00 0.00 43.02 39.89 2jtf s PHE 47 CO -0.02 -2.16 1.67 -2.00 0.70 0.00 0.00 175.22 173.41 2jtf s GLU 48 N -3.29 3.88 -0.39 0.44 2.12 -1.26 -4.41 118.70 115.79 2jtf s GLU 48 Ca 0.77 -1.77 -0.19 0.00 0.36 0.00 0.00 54.97 54.13 2jtf s GLU 48 Cb -0.30 -5.49 0.03 0.00 0.26 0.00 0.00 34.13 28.62 2jtf s GLU 48 CO 0.33 -2.25 0.49 -2.13 -0.54 0.00 0.00 175.26 171.16 2jtf n ARG 49 N 8.52 -2.25 -0.07 4.30 0.63 -1.26 -4.95 116.66 121.58 2jtf n ARG 49 Ca 0.45 1.92 0.07 0.00 -0.92 0.00 0.00 57.85 59.36 2jtf n ARG 49 Cb 0.47 -4.23 0.10 0.00 0.45 0.00 0.00 32.46 29.26 2jtf n ARG 49 CO 0.00 0.00 0.00 -2.67 -2.51 0.00 0.00 177.63 172.45 2jtf n TRP 50 N -0.00 0.06 -4.78 -0.14 4.27 -1.26 -5.09 117.44 110.50 2jtf n TRP 50 Ca 0.03 -0.83 0.00 0.00 -3.89 0.00 0.00 57.50 52.81 2jtf n TRP 50 Cb 0.47 -0.13 0.00 0.00 -1.36 0.00 0.00 31.31 30.29 2jtf n TRP 50 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 2jtf n SER 51 N -1.05 -2.31 0.00 -0.67 2.88 -1.26 -4.85 113.62 106.36 2jtf n SER 51 Ca 0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 2jtf n SER 51 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 2jtf n SER 51 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2jtf n HIS 52 N 0.00 0.00 -3.61 0.66 8.25 -1.26 -4.44 115.22 114.82 2jtf n HIS 52 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 2jtf n HIS 52 Cb 0.00 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 2jtf n HIS 52 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2jtf s ARG 53 N 0.00 0.55 0.00 -0.41 1.70 -1.26 -5.05 118.95 114.48 2jtf s ARG 53 Ca 0.00 0.43 0.24 0.00 -0.47 0.00 0.00 55.73 55.94 2jtf s ARG 53 Cb 0.00 0.26 0.28 0.00 -0.57 0.00 0.00 34.95 34.92 2jtf s ARG 53 CO 0.00 -0.11 1.29 0.66 -1.08 0.00 0.00 175.30 176.06 2jtf n TYR 54 N 1.67 0.00 -3.87 5.89 4.01 -1.26 -4.57 117.16 119.03 2jtf n TYR 54 Ca -0.12 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.28 2jtf n TYR 54 Cb 0.57 -0.01 -0.13 0.00 -0.31 0.00 0.00 39.34 39.46 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 -2.20 5.00 0.09 7.72 -4.77 -1.26 -4.08 116.67 117.17 2jtf s ASP 55 Ca 0.26 -2.25 0.08 0.00 -3.30 0.00 0.00 52.55 47.34 2jtf s ASP 55 Cb 0.19 -1.75 -0.03 0.00 -1.09 0.00 0.00 42.92 40.25 2jtf s ASP 55 CO 0.41 -0.44 -0.21 -0.70 0.70 0.00 0.00 175.17 174.93 2jtf s GLU 56 N 0.80 1.20 -0.17 2.11 2.56 -0.67 -4.99 118.70 119.54 2jtf s GLU 56 Ca 0.11 -1.12 -0.00 0.00 0.00 0.00 0.00 54.97 53.95 2jtf s GLU 56 Cb -0.21 -1.44 -0.00 0.00 2.00 0.00 0.00 34.13 34.47 2jtf s GLU 56 CO -0.05 0.34 -0.14 -1.58 -0.56 0.00 0.00 175.26 173.27 2jtf s TRP 57 N -1.08 2.81 0.17 5.30 0.52 -1.26 0.52 118.94 125.92 2jtf s TRP 57 Ca 0.07 -1.09 0.02 0.00 0.02 0.00 0.00 56.10 55.11 2jtf s TRP 57 Cb -0.10 -1.92 -0.05 0.00 -1.15 0.00 0.00 33.47 30.25 2jtf s TRP 57 CO 0.04 -0.52 0.01 0.42 0.02 0.00 0.00 176.95 176.92 2jtf s ILE 58 N 0.96 0.63 0.53 2.03 1.01 -0.57 -4.91 121.20 120.88 2jtf s ILE 58 Ca -0.02 -1.98 0.02 0.00 0.00 0.00 0.00 60.65 58.67 2jtf s ILE 58 Cb -0.15 -2.13 0.03 0.00 0.01 0.00 0.00 42.46 40.22 2jtf s ILE 58 CO -0.02 -0.45 0.75 -0.31 0.00 0.00 0.00 174.94 174.90 2jtf s TYR 59 N -3.69 2.89 -0.41 3.97 1.51 -1.26 -0.17 117.35 120.19 2jtf s TYR 59 Ca 0.24 -0.02 -0.33 0.00 -1.01 0.00 0.00 57.07 55.95 2jtf s TYR 59 Cb 0.06 -2.68 -0.11 0.00 -0.11 0.00 0.00 41.96 39.12 2jtf s TYR 59 CO 0.04 -0.79 2.26 0.91 -1.11 0.00 0.00 175.55 176.86 2jtf n TRP 60 N -2.28 1.52 -2.03 2.71 7.02 -0.84 -2.19 117.44 121.37 2jtf n TRP 60 Ca 0.07 0.23 -0.11 0.00 -1.02 0.00 0.00 57.50 56.67 2jtf n TRP 60 Cb 0.59 -2.55 -0.02 0.00 -2.42 0.00 0.00 31.31 26.91 2jtf n TRP 60 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2jtf n ASP 61 N 10.83 -3.40 -4.52 -0.99 5.75 -1.25 -4.90 116.55 118.06 2jtf n ASP 61 Ca 0.42 0.24 -0.42 0.00 -0.01 0.00 0.00 54.79 55.02 2jtf n ASP 61 Cb 0.27 -3.02 -0.03 0.00 -1.03 0.00 0.00 41.12 37.31 2jtf n ASP 61 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2jtf s SER 62 N -2.00 6.20 0.00 -1.12 0.01 -0.93 -4.48 113.70 111.37 2jtf s SER 62 Ca 0.00 -0.70 0.00 0.00 1.31 0.00 0.00 55.95 56.56 2jtf s SER 62 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2jtf s SER 62 CO 0.00 -1.69 0.00 -0.46 0.41 0.00 0.00 173.24 171.50 2jtf n ASN 63 N 8.82 0.00 -0.12 2.44 0.23 -1.26 -3.89 115.26 121.48 2jtf n ASN 63 Ca 0.03 0.00 0.02 0.00 -0.53 0.00 0.00 54.58 54.11 2jtf n ASN 63 Cb 0.48 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.21 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 0.00 1.16 -4.35 -3.83 1.74 -1.26 -4.81 116.66 105.31 2jtf n ARG 64 Ca 0.00 -1.34 -0.18 0.00 -0.77 0.00 0.00 57.85 55.56 2jtf n ARG 64 Cb 0.00 -0.86 -0.10 0.00 -1.02 0.00 0.00 32.46 30.48 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 -0.90 2.55 -0.22 0.55 2.01 -1.25 -0.66 118.68 120.76 2jtf s LEU 65 Ca 0.07 -1.03 -0.10 0.00 0.01 0.00 0.00 54.13 53.08 2jtf s LEU 65 Cb 0.06 -0.66 0.08 0.00 0.01 0.00 0.00 46.19 45.68 2jtf s LEU 65 CO 0.01 -0.18 0.50 -0.60 1.01 0.00 0.00 176.35 177.08 2jtf s ARG 66 N -3.65 0.47 0.43 1.70 3.00 0.14 -3.92 118.95 117.12 2jtf s ARG 66 Ca 0.23 1.02 -0.07 0.00 -1.00 0.00 0.00 55.73 55.90 2jtf s ARG 66 Cb -0.00 0.20 0.10 0.00 0.00 0.00 0.00 34.95 35.24 2jtf s ARG 66 CO 0.07 -0.18 0.56 -0.35 0.00 0.00 0.00 175.30 175.40 2jtf n PRO 67 N 4.68 -0.73 -1.78 5.12 -0.04 -1.26 -1.77 135.00 139.22 2jtf n PRO 67 Ca -0.18 -0.87 -0.30 0.00 -0.04 0.00 0.00 63.50 62.12 2jtf n PRO 67 Cb 0.54 -0.60 0.08 0.00 -0.04 0.00 0.00 33.50 33.47 2jtf n PRO 67 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jtf s LEU 68 N 0.00 2.62 -0.26 1.53 1.43 -1.25 -3.98 118.68 118.78 2jtf s LEU 68 Ca 0.32 1.05 -0.02 0.00 -1.03 0.00 0.00 54.13 54.46 2jtf s LEU 68 Cb -0.01 -3.67 0.12 0.00 0.03 0.00 0.00 46.19 42.66 2jtf s LEU 68 CO 0.23 -1.77 2.23 -1.84 0.23 0.00 0.00 176.35 175.43 2jtf n GLU 69 N -3.27 1.75 0.00 1.70 0.28 -1.26 -4.94 120.64 114.89 2jtf n GLU 69 Ca 0.07 -1.34 0.04 0.00 -0.16 0.00 0.00 57.16 55.77 2jtf n GLU 69 Cb 0.58 -1.60 0.23 0.00 1.43 0.00 0.00 31.44 32.08 2jtf n GLU 69 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86