#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 -1.94 -2.47 -3.83 1.74 -1.26 -4.88 116.66 104.02 2jtf n ARG 8 Ca 0.00 1.61 -0.25 0.00 -0.77 0.00 0.00 57.85 58.44 2jtf n ARG 8 Cb 0.00 -4.12 0.13 0.00 -1.02 0.00 0.00 32.46 27.45 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 -2.96 1.35 1.06 5.56 0.05 -1.26 -4.26 135.00 134.52 2jtf s PRO 9 Ca 0.21 -1.05 0.00 0.00 0.05 0.00 0.00 61.00 60.22 2jtf s PRO 9 Cb -0.04 -2.22 0.00 0.00 0.05 0.00 0.00 34.50 32.29 2jtf s PRO 9 CO 0.82 -1.73 0.00 0.41 0.05 0.00 0.00 177.00 176.54 2jtf n GLY 10 N -3.07 -1.76 3.58 0.56 0.00 0.21 -4.29 105.19 100.42 2jtf n GLY 10 Ca 0.16 -1.29 -0.40 0.00 0.00 0.00 0.00 46.02 44.50 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 -0.41 3.97 0.23 -0.61 1.01 -1.26 -3.32 121.20 120.81 2jtf s ILE 11 Ca 0.00 -1.54 -0.11 0.00 0.00 0.00 0.00 60.65 59.00 2jtf s ILE 11 Cb 0.00 -5.03 -0.07 0.00 0.01 0.00 0.00 42.46 37.36 2jtf s ILE 11 CO 0.00 -1.80 0.57 -0.89 0.00 0.00 0.00 174.94 172.82 2jtf s THR 12 N 5.70 4.90 -1.40 2.92 2.01 -1.26 -4.85 115.64 123.66 2jtf s THR 12 Ca 0.56 0.56 -0.15 0.00 0.31 0.00 0.00 61.69 62.97 2jtf s THR 12 Cb 0.02 -3.63 0.06 0.00 0.01 0.00 0.00 72.50 68.96 2jtf s THR 12 CO 0.06 -0.05 2.06 0.49 -0.69 0.00 0.00 174.62 176.49 2jtf n PHE 13 N -0.06 3.86 -3.70 4.92 3.72 -1.26 -4.77 117.46 120.16 2jtf n PHE 13 Ca 0.00 -2.94 -0.11 0.00 -0.05 0.00 0.00 57.45 54.35 2jtf n PHE 13 Cb 0.52 -2.54 -0.12 0.00 -0.94 0.00 0.00 39.48 36.40 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 3.32 0.30 -0.26 -1.08 2.02 -1.26 -5.08 118.70 116.66 2jtf s GLU 14 Ca 0.49 0.74 -0.29 0.00 0.02 0.00 0.00 54.97 55.93 2jtf s GLU 14 Cb 0.11 -0.01 -0.02 0.00 0.10 0.00 0.00 34.13 34.31 2jtf s GLU 14 CO -0.04 -0.19 1.55 0.42 0.02 0.00 0.00 175.26 177.03 2jtf s ILE 15 N 1.63 3.79 0.00 -1.63 1.01 -1.26 -1.48 121.20 123.26 2jtf s ILE 15 Ca -0.07 0.88 0.00 0.00 0.00 0.00 0.00 60.65 61.45 2jtf s ILE 15 Cb -0.10 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.54 2jtf s ILE 15 CO -0.11 -0.38 0.00 0.61 0.00 0.00 0.00 174.94 175.06 2jtf n GLY 16 N 4.68 1.93 3.73 6.18 0.00 0.71 -4.97 105.19 117.44 2jtf n GLY 16 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2jtf n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jtf n ALA 17 N 0.00 1.39 -3.46 4.61 0.00 -0.55 -4.48 120.51 118.02 2jtf n ALA 17 Ca 0.00 0.11 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 2jtf n ALA 17 Cb 0.00 -2.32 -0.08 0.00 0.00 0.00 0.00 19.45 17.05 2jtf n ALA 17 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jtf s ARG 18 N -2.87 2.59 0.72 0.00 0.52 -1.26 -0.93 118.95 117.72 2jtf s ARG 18 Ca 0.72 -1.71 -0.03 0.00 -0.52 0.00 0.00 55.73 54.20 2jtf s ARG 18 Cb -0.42 -3.98 0.12 0.00 0.52 0.00 0.00 34.95 31.18 2jtf s ARG 18 CO 0.49 -1.19 1.00 -0.48 0.02 0.00 0.00 175.30 175.14 2jtf s LEU 19 N 1.42 2.98 -0.27 2.53 -0.00 0.15 -0.61 118.68 124.87 2jtf s LEU 19 Ca 0.05 -0.18 -0.09 0.00 -0.00 0.00 0.00 54.13 53.91 2jtf s LEU 19 Cb -0.26 -2.24 -0.04 0.00 -0.00 0.00 0.00 46.19 43.65 2jtf s LEU 19 CO 0.00 -1.83 0.13 -1.61 -0.00 0.00 0.00 176.35 173.05 2jtf s GLU 20 N -5.17 3.77 0.03 1.48 8.01 -0.68 -0.83 118.70 125.30 2jtf s GLU 20 Ca 0.65 -0.42 0.05 0.00 0.01 0.00 0.00 54.97 55.27 2jtf s GLU 20 Cb -0.06 -3.50 -0.02 0.00 -4.31 0.00 0.00 34.13 26.24 2jtf s GLU 20 CO 0.44 -0.20 -0.16 0.00 0.01 0.00 0.00 175.26 175.35 2jtf s ALA 21 N 1.68 1.33 -0.81 5.21 0.00 -0.58 0.28 121.76 128.87 2jtf s ALA 21 Ca 0.07 -0.86 -0.15 0.00 0.00 0.00 0.00 51.96 51.01 2jtf s ALA 21 Cb -0.16 -0.24 0.19 0.00 0.00 0.00 0.00 23.12 22.92 2jtf s ALA 21 CO 0.07 0.28 0.80 -1.17 0.00 0.00 0.00 175.76 175.74 2jtf s LEU 22 N -1.05 6.37 0.74 0.00 0.20 0.21 -0.48 118.68 124.66 2jtf s LEU 22 Ca 0.04 -2.44 -0.11 0.00 0.69 0.00 0.00 54.13 52.30 2jtf s LEU 22 Cb -0.08 -2.25 0.03 0.00 -0.43 0.00 0.00 46.19 43.47 2jtf s LEU 22 CO 0.01 -0.70 1.08 1.51 -0.29 0.00 0.00 176.35 177.95 2jtf s ASP 23 N 2.60 5.06 0.62 3.68 -4.77 -0.07 -4.74 116.67 119.06 2jtf s ASP 23 Ca 0.19 1.41 0.33 0.00 -3.30 0.00 0.00 52.55 51.17 2jtf s ASP 23 Cb -0.12 -2.23 1.78 0.00 -1.09 0.00 0.00 42.92 41.26 2jtf s ASP 23 CO -0.07 -1.62 1.99 0.22 0.70 0.00 0.00 175.17 176.39 2jtf h TYR 24 N -0.84 0.00 0.00 2.11 3.20 -1.96 1.00 116.97 120.47 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 1.24 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.51 2jtf h TYR 24 CO 0.54 0.00 0.00 1.28 -1.64 0.00 0.00 178.16 178.34 2jtf n LEU 25 N -2.85 0.00 -1.98 2.82 4.32 -1.26 -4.88 117.00 113.17 2jtf n LEU 25 Ca -0.02 0.15 -0.04 0.00 -0.02 0.00 0.00 56.01 56.08 2jtf n LEU 25 Cb 0.27 -0.15 0.02 0.00 -1.62 0.00 0.00 43.42 41.93 2jtf n LEU 25 CO 0.14 -0.01 0.01 0.00 -1.22 0.00 0.00 177.39 176.32 2jtf n GLN 26 N -1.15 -0.61 -3.72 3.23 3.00 0.34 -5.07 117.38 113.41 2jtf n GLN 26 Ca 0.17 0.27 -0.15 0.00 -0.01 0.00 0.00 57.00 57.28 2jtf n GLN 26 Cb 0.17 -2.70 -0.15 0.00 0.00 0.00 0.00 30.24 27.56 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 -3.37 0.06 -0.86 -1.09 -0.14 -0.86 -4.93 119.74 108.55 2jtf s LYS 27 Ca 0.12 0.44 -0.25 0.00 -1.36 0.00 0.00 55.97 54.92 2jtf s LYS 27 Cb -0.02 -0.23 0.05 0.00 -1.68 0.00 0.00 37.83 35.95 2jtf s LYS 27 CO 0.20 -0.22 1.31 -1.58 -0.76 0.00 0.00 175.35 174.30 2jtf s TRP 28 N 1.63 2.46 0.17 3.18 0.52 -1.24 -0.89 118.94 124.76 2jtf s TRP 28 Ca -0.04 -0.49 0.05 0.00 0.02 0.00 0.00 56.10 55.64 2jtf s TRP 28 Cb -0.12 -4.61 -0.05 0.00 -1.15 0.00 0.00 33.47 27.55 2jtf s TRP 28 CO -0.06 -1.95 -0.09 1.52 0.02 0.00 0.00 176.95 176.39 2jtf s TYR 29 N 5.11 1.37 0.06 -1.98 1.13 0.37 -4.84 117.35 118.56 2jtf s TYR 29 Ca 0.38 -0.76 -0.30 0.00 -1.41 0.00 0.00 57.07 54.98 2jtf s TYR 29 Cb -0.05 -0.70 -0.09 0.00 -1.10 0.00 0.00 41.96 40.01 2jtf s TYR 29 CO 0.03 0.10 1.95 -2.14 -2.51 0.00 0.00 175.55 172.98 2jtf s PRO 30 N -3.75 4.14 0.15 -3.49 0.02 -1.25 -1.53 135.00 129.28 2jtf s PRO 30 Ca 0.19 2.62 0.06 0.00 0.02 0.00 0.00 61.00 63.90 2jtf s PRO 30 Cb 0.03 -4.05 -0.04 0.00 0.02 0.00 0.00 34.50 30.46 2jtf s PRO 30 CO 0.03 -0.94 -0.14 -1.12 -0.33 0.00 0.00 177.00 174.50 2jtf s SER 31 N 4.10 2.19 0.19 2.53 0.01 -0.01 -4.70 113.70 118.01 2jtf s SER 31 Ca 0.87 -0.89 0.09 0.00 1.31 0.00 0.00 55.95 57.34 2jtf s SER 31 Cb -0.44 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.66 2jtf s SER 31 CO 0.41 -0.16 -0.10 -0.13 0.41 0.00 0.00 173.24 173.67 2jtf s ARG 32 N -3.03 2.05 -0.05 12.44 0.52 -0.00 0.30 118.95 131.18 2jtf s ARG 32 Ca 0.14 -1.30 -0.19 0.00 -0.52 0.00 0.00 55.73 53.86 2jtf s ARG 32 Cb -0.03 -2.14 -0.05 0.00 0.52 0.00 0.00 34.95 33.25 2jtf s ARG 32 CO 0.04 0.43 0.53 0.42 0.02 0.00 0.00 175.30 176.73 2jtf s ILE 33 N -1.76 5.03 -0.09 1.52 1.01 -0.11 0.69 121.20 127.50 2jtf s ILE 33 Ca 0.25 1.08 0.03 0.00 0.00 0.00 0.00 60.65 62.02 2jtf s ILE 33 Cb -0.09 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.45 2jtf s ILE 33 CO 0.15 0.41 -0.05 1.21 0.00 0.00 0.00 174.94 176.66 2jtf n GLU 34 N 2.94 1.18 -3.82 2.79 2.13 0.99 -0.21 120.64 126.65 2jtf n GLU 34 Ca -0.08 0.04 -0.12 0.00 0.66 0.00 0.00 57.16 57.66 2jtf n GLU 34 Cb 0.51 -1.20 -0.09 0.00 0.27 0.00 0.00 31.44 30.93 2jtf n GLU 34 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2jtf s LYS 35 N -2.20 0.64 0.01 5.31 -0.14 -1.20 -4.86 119.74 117.30 2jtf s LYS 35 Ca -0.10 -0.41 0.05 0.00 -1.36 0.00 0.00 55.97 54.15 2jtf s LYS 35 Cb 0.03 0.27 -0.02 0.00 -1.68 0.00 0.00 37.83 36.44 2jtf s LYS 35 CO 0.27 -0.18 -0.16 0.42 -0.76 0.00 0.00 175.35 174.94 2jtf s ILE 36 N -1.84 1.26 -0.38 2.17 1.01 -1.26 0.16 121.20 122.32 2jtf s ILE 36 Ca -0.11 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.74 2jtf s ILE 36 Cb -0.04 -1.08 0.11 0.00 0.01 0.00 0.00 42.46 41.46 2jtf s ILE 36 CO 0.00 0.24 0.14 -0.62 0.00 0.00 0.00 174.94 174.71 2jtf s ASP 37 N -0.67 4.15 0.30 3.58 -1.08 0.88 -4.96 116.67 118.88 2jtf s ASP 37 Ca 0.05 -2.19 0.16 0.00 -0.52 0.00 0.00 52.55 50.05 2jtf s ASP 37 Cb -0.07 -1.20 0.14 0.00 -1.46 0.00 0.00 42.92 40.33 2jtf s ASP 37 CO 0.00 -0.35 1.48 1.88 0.52 0.00 0.00 175.17 178.71 2jtf h TYR 38 N 7.42 0.00 0.06 -5.34 -1.99 -1.93 0.67 116.97 115.86 2jtf h TYR 38 Ca -0.07 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.68 2jtf h TYR 38 Cb 0.98 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.68 2jtf h TYR 38 CO 0.44 0.46 -0.18 1.49 -0.00 0.00 0.00 178.16 180.37 2jtf h GLU 39 N 0.00 -0.31 0.06 4.88 4.81 -1.92 -2.61 114.58 119.48 2jtf h GLU 39 Ca -0.00 0.02 -0.29 0.00 -0.13 0.00 0.00 59.36 58.95 2jtf h GLU 39 Cb 1.32 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.74 2jtf h GLU 39 CO 0.06 -0.21 -1.56 1.49 -0.73 0.00 0.00 179.01 178.06 2jtf h GLU 40 N -0.32 0.12 -1.44 1.92 4.57 -2.00 -3.48 114.58 113.95 2jtf h GLU 40 Ca 0.04 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 2jtf h GLU 40 Cb 0.36 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 2jtf h GLU 40 CO -0.12 0.89 0.00 0.41 -1.18 0.00 0.00 179.01 179.00 2jtf n GLY 41 N 1.61 0.74 3.31 1.92 0.00 0.11 -4.98 105.19 107.91 2jtf n GLY 41 Ca -0.16 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.25 1.22 0.02 1.61 1.02 0.19 -2.40 119.74 119.15 2jtf s LYS 42 Ca 0.00 -1.52 0.02 0.00 0.02 0.00 0.00 55.97 54.48 2jtf s LYS 42 Cb 0.00 -0.95 -0.01 0.00 -0.52 0.00 0.00 37.83 36.34 2jtf s LYS 42 CO 0.00 0.15 -0.06 0.00 -0.92 0.00 0.00 175.35 174.52 2jtf s MET 43 N -3.60 0.42 -0.74 1.68 0.23 0.12 -0.08 119.30 117.32 2jtf s MET 43 Ca 0.20 -0.47 -0.24 0.00 -1.03 0.00 0.00 55.69 54.15 2jtf s MET 43 Cb -0.00 -0.26 0.06 0.00 -1.53 0.00 0.00 34.83 33.09 2jtf s MET 43 CO 0.05 0.06 1.15 -1.17 -2.03 0.00 0.00 175.02 173.07 2jtf s LEU 44 N -0.89 3.85 -0.12 0.18 1.98 0.12 -1.45 118.68 122.35 2jtf s LEU 44 Ca -0.05 -0.89 -0.13 0.00 -2.89 0.00 0.00 54.13 50.17 2jtf s LEU 44 Cb -0.06 -2.49 -0.05 0.00 0.66 0.00 0.00 46.19 44.25 2jtf s LEU 44 CO -0.00 -1.58 0.29 0.54 -1.89 0.00 0.00 176.35 173.70 2jtf s VAL 45 N 4.73 5.28 -0.36 1.68 0.11 0.55 -0.01 120.40 132.39 2jtf s VAL 45 Ca 0.30 0.54 -0.07 0.00 -2.93 0.00 0.00 61.98 59.83 2jtf s VAL 45 Cb -0.11 -3.60 0.05 0.00 -1.53 0.00 0.00 36.38 31.19 2jtf s VAL 45 CO 0.09 0.47 0.13 -1.38 -3.33 0.00 0.00 175.10 171.09 2jtf s HIS 46 N -0.15 3.29 0.49 1.54 -3.43 0.22 -0.74 115.29 116.50 2jtf s HIS 46 Ca 0.18 -1.50 -0.18 0.00 -0.80 0.00 0.00 55.06 52.75 2jtf s HIS 46 Cb -0.14 -2.44 -0.09 0.00 -1.43 0.00 0.00 32.58 28.49 2jtf s HIS 46 CO 0.06 -0.76 0.99 -0.06 -2.00 0.00 0.00 174.74 172.96 2jtf s PHE 47 N 1.39 3.29 0.55 0.38 0.40 0.74 -0.82 117.98 123.90 2jtf s PHE 47 Ca -0.00 1.54 0.23 0.00 -0.60 0.00 0.00 56.93 58.09 2jtf s PHE 47 Cb -0.20 -2.87 1.45 0.00 0.51 0.00 0.00 43.02 41.91 2jtf s PHE 47 CO 0.02 -0.42 2.10 1.05 0.70 0.00 0.00 175.22 178.67 2jtf h GLU 48 N 1.29 0.00 0.00 0.44 -0.00 -1.84 -3.42 114.58 111.04 2jtf h GLU 48 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.88 2jtf h GLU 48 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 2jtf h GLU 48 CO 0.61 0.00 0.00 -2.13 -0.00 0.00 0.00 179.01 177.49 2jtf n ARG 49 N -4.24 0.00 -0.67 1.06 0.63 -1.26 -4.98 116.66 107.20 2jtf n ARG 49 Ca 0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 2jtf n ARG 49 Cb 0.30 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.21 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 -0.28 -0.28 -0.15 -0.14 4.27 -0.35 -4.97 117.44 115.55 2jtf n TRP 50 Ca 0.00 0.00 -0.04 0.00 -3.89 0.00 0.00 57.50 53.57 2jtf n TRP 50 Cb 0.00 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 29.91 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 -0.28 -0.38 0.14 -0.67 7.64 -1.26 -2.81 113.62 116.00 2jtf n SER 51 Ca 0.00 1.28 -0.07 0.00 1.01 0.00 0.00 58.87 61.09 2jtf n SER 51 Cb 0.00 -0.40 -0.04 0.00 -1.01 0.00 0.00 64.21 62.76 2jtf n SER 51 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 2jtf h HIS 52 N 0.00 -0.52 0.00 1.43 6.17 -1.98 -3.48 115.15 116.77 2jtf h HIS 52 Ca 0.06 -0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.14 2jtf h HIS 52 Cb 0.15 0.19 0.00 0.00 2.52 0.00 0.00 27.41 30.27 2jtf h HIS 52 CO -0.97 -0.27 0.00 0.54 0.71 0.00 0.00 177.93 177.94 2jtf n ARG 53 N -3.47 0.00 0.00 5.26 1.74 -1.12 -5.01 116.66 114.05 2jtf n ARG 53 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 2jtf n ARG 53 Cb 0.19 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.63 2jtf n ARG 53 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2jtf n TYR 54 N -0.84 -1.97 -3.32 -1.55 9.36 -1.26 -1.21 117.16 116.37 2jtf n TYR 54 Ca 0.00 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.92 2jtf n TYR 54 Cb 0.00 0.41 -0.04 0.00 -0.63 0.00 0.00 39.34 39.08 2jtf n TYR 54 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 2jtf s ASP 55 N -1.93 6.54 -0.14 2.98 -4.77 -1.26 -0.19 116.67 117.90 2jtf s ASP 55 Ca 0.00 0.86 -0.29 0.00 -3.30 0.00 0.00 52.55 49.82 2jtf s ASP 55 Cb 0.00 -2.20 0.10 0.00 -1.09 0.00 0.00 42.92 39.72 2jtf s ASP 55 CO 0.00 -0.16 0.86 -0.70 0.70 0.00 0.00 175.17 175.87 2jtf s GLU 56 N -3.23 0.78 -0.32 2.11 2.56 0.08 -4.88 118.70 115.81 2jtf s GLU 56 Ca 0.46 0.31 -0.14 0.00 0.00 0.00 0.00 54.97 55.61 2jtf s GLU 56 Cb -0.11 0.37 -0.02 0.00 2.00 0.00 0.00 34.13 36.37 2jtf s GLU 56 CO 0.26 -0.22 0.31 -1.58 -0.56 0.00 0.00 175.26 173.47 2jtf s TRP 57 N -0.87 3.22 0.13 5.30 0.52 -1.26 -0.33 118.94 125.65 2jtf s TRP 57 Ca -0.05 0.02 0.05 0.00 0.02 0.00 0.00 56.10 56.15 2jtf s TRP 57 Cb -0.01 -2.57 -0.04 0.00 -1.15 0.00 0.00 33.47 29.70 2jtf s TRP 57 CO 0.04 -0.34 -0.12 0.42 0.02 0.00 0.00 176.95 176.97 2jtf s ILE 58 N 1.92 1.23 0.58 2.03 1.01 -0.53 -4.92 121.20 122.52 2jtf s ILE 58 Ca 0.10 -1.85 0.00 0.00 0.00 0.00 0.00 60.65 58.91 2jtf s ILE 58 Cb -0.17 -1.63 0.04 0.00 0.01 0.00 0.00 42.46 40.72 2jtf s ILE 58 CO 0.11 -0.56 0.82 -0.31 0.00 0.00 0.00 174.94 175.00 2jtf s TYR 59 N -2.64 2.74 -0.22 3.97 1.51 -1.26 0.10 117.35 121.56 2jtf s TYR 59 Ca 0.12 0.01 -0.28 0.00 -1.01 0.00 0.00 57.07 55.90 2jtf s TYR 59 Cb -0.02 -2.82 -0.05 0.00 -0.11 0.00 0.00 41.96 38.97 2jtf s TYR 59 CO 0.02 -1.01 2.11 -1.58 -1.11 0.00 0.00 175.55 173.99 2jtf s TRP 60 N -2.85 1.31 -1.45 2.71 0.52 -1.01 -3.23 118.94 114.95 2jtf s TRP 60 Ca 0.58 0.49 -0.06 0.00 0.02 0.00 0.00 56.10 57.14 2jtf s TRP 60 Cb -0.10 -3.98 0.01 0.00 -1.15 0.00 0.00 33.47 28.24 2jtf s TRP 60 CO 0.40 -3.95 0.24 -0.40 0.02 0.00 0.00 176.95 173.26 2jtf n ASP 61 N 11.12 -0.34 0.18 2.95 5.75 -1.26 -4.90 116.55 130.04 2jtf n ASP 61 Ca 0.28 -1.19 -0.07 0.00 -0.01 0.00 0.00 54.79 53.79 2jtf n ASP 61 Cb 0.45 -2.10 -0.04 0.00 -1.03 0.00 0.00 41.12 38.41 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 -1.92 -0.41 0.00 -1.12 4.64 -1.80 -3.44 113.55 109.51 2jtf h SER 62 Ca -0.66 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 2jtf h SER 62 Cb 1.39 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 2jtf h SER 62 CO 0.65 -0.25 -0.11 -0.46 -0.87 0.00 0.00 176.83 175.80 2jtf n ASN 63 N -3.54 0.51 -0.21 4.97 0.23 -1.26 -4.90 115.26 111.06 2jtf n ASN 63 Ca -0.06 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.06 2jtf n ASN 63 Cb 0.19 0.04 0.10 0.00 -2.08 0.00 0.00 39.78 38.03 2jtf n ASN 63 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 2jtf n ARG 64 N -0.85 0.91 -4.43 -3.83 0.00 -1.26 -5.00 116.66 102.19 2jtf n ARG 64 Ca 0.00 -2.13 -0.31 0.00 -0.00 0.00 0.00 57.85 55.41 2jtf n ARG 64 Cb 0.05 -1.20 -0.10 0.00 -0.00 0.00 0.00 32.46 31.20 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 -2.04 3.09 -0.08 2.89 2.01 -1.26 0.66 118.68 123.96 2jtf s LEU 65 Ca 0.23 -0.22 -0.03 0.00 0.01 0.00 0.00 54.13 54.12 2jtf s LEU 65 Cb 0.20 -1.80 0.04 0.00 0.01 0.00 0.00 46.19 44.64 2jtf s LEU 65 CO 0.02 0.26 0.06 -0.60 1.01 0.00 0.00 176.35 177.10 2jtf s ARG 66 N -1.60 0.01 -0.86 1.70 3.52 0.14 -4.20 118.95 117.67 2jtf s ARG 66 Ca 0.18 0.24 -0.18 0.00 -0.13 0.00 0.00 55.73 55.84 2jtf s ARG 66 Cb -0.11 -0.88 0.14 0.00 -1.56 0.00 0.00 34.95 32.54 2jtf s ARG 66 CO 0.09 -0.41 1.01 -1.25 -0.81 0.00 0.00 175.30 173.92 2jtf s PRO 67 N 2.14 3.51 0.00 5.12 0.05 -1.26 -1.69 135.00 142.87 2jtf s PRO 67 Ca 0.04 -1.79 0.00 0.00 0.05 0.00 0.00 61.00 59.30 2jtf s PRO 67 Cb -0.13 -4.71 0.00 0.00 0.05 0.00 0.00 34.50 29.70 2jtf s PRO 67 CO -0.05 -1.66 0.00 -0.11 0.05 0.00 0.00 177.00 175.23 2jtf n LEU 68 N 6.12 0.00 0.00 -3.56 7.94 -1.26 -1.66 117.00 124.58 2jtf n LEU 68 Ca 0.17 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.07 2jtf n LEU 68 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 2jtf n LEU 68 CO 0.49 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 174.93 2jtf n GLU 69 N 0.00 0.00 -0.62 1.96 0.28 -1.26 -4.83 120.64 116.16 2jtf n GLU 69 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2jtf n GLU 69 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2jtf n GLU 69 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51