#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eli s SER 2 N 0.00 -0.62 -1.61 1.61 0.01 -1.26 -4.95 113.70 106.89 2eli s SER 2 Ca 0.00 0.79 -0.06 0.00 1.31 0.00 0.00 55.95 57.99 2eli s SER 2 Cb 0.00 0.70 0.06 0.00 0.21 0.00 0.00 66.02 66.99 2eli s SER 2 CO 0.00 -0.51 0.21 -0.24 0.41 0.00 0.00 173.24 173.11 2eli n SER 3 N 1.36 0.05 -0.66 2.44 2.88 -1.26 -4.92 113.62 113.52 2eli n SER 3 Ca -0.18 -1.23 0.00 0.00 -1.33 0.00 0.00 58.87 56.13 2eli n SER 3 Cb 0.57 -1.80 0.00 0.00 -0.75 0.00 0.00 64.21 62.23 2eli n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eli n GLY 4 N -2.15 5.38 3.16 0.46 0.00 -1.26 -5.15 105.19 105.63 2eli n GLY 4 Ca -0.22 -2.08 -0.11 0.00 0.00 0.00 0.00 46.02 43.61 2eli n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eli s SER 5 N -0.02 -0.07 0.99 1.61 0.15 -1.26 -5.16 113.70 109.94 2eli s SER 5 Ca 0.00 0.81 -0.12 0.00 0.70 0.00 0.00 55.95 57.34 2eli s SER 5 Cb 0.00 0.99 0.18 0.00 -1.71 0.00 0.00 66.02 65.48 2eli s SER 5 CO 0.00 -0.23 0.39 -1.54 1.20 0.00 0.00 173.24 173.07 2eli n SER 6 N 5.17 -3.06 0.00 5.45 3.41 -1.26 -5.01 113.62 118.32 2eli n SER 6 Ca -0.10 -0.41 0.00 0.00 -0.26 0.00 0.00 58.87 58.09 2eli n SER 6 Cb 0.50 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2eli n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eli n GLY 7 N 2.47 1.07 3.61 5.00 0.00 -1.26 -5.18 105.19 110.90 2eli n GLY 7 Ca 0.06 0.05 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 2eli n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2eli s GLY 8 N 0.00 -0.54 1.21 -0.02 0.00 -1.26 -5.17 107.32 101.54 2eli s GLY 8 Ca 0.00 2.57 -0.20 0.00 0.00 0.00 0.00 44.72 47.10 2eli s GLY 8 CO 0.00 2.84 1.11 2.56 0.00 0.00 0.00 173.10 179.61 2eli s PRO 9 N 2.26 -1.31 0.25 2.90 0.04 -1.26 -5.07 135.00 132.81 2eli s PRO 9 Ca -0.07 -0.10 0.08 0.00 0.04 0.00 0.00 61.00 60.95 2eli s PRO 9 Cb -0.08 -1.59 -0.04 0.00 0.04 0.00 0.00 34.50 32.83 2eli s PRO 9 CO -0.19 -3.76 0.13 -0.51 0.04 0.00 0.00 177.00 172.71 2eli s ASP 10 N -3.92 5.19 0.00 6.66 1.11 -1.26 -5.05 116.67 119.41 2eli s ASP 10 Ca 0.71 -0.38 0.00 0.00 0.18 0.00 0.00 52.55 53.06 2eli s ASP 10 Cb -0.09 -1.21 0.00 0.00 1.07 0.00 0.00 42.92 42.68 2eli s ASP 10 CO 0.56 -0.02 0.00 0.41 1.18 0.00 0.00 175.17 177.30 2eli n THR 11 N -1.05 0.00 -2.78 -1.27 -1.04 -1.26 -5.08 114.28 101.81 2eli n THR 11 Ca -0.07 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.66 2eli n THR 11 Cb 0.58 -0.87 -0.01 0.00 -1.82 0.00 0.00 70.33 68.22 2eli n THR 11 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 2eli s ASP 12 N -4.44 6.31 -0.27 8.00 -4.77 -1.26 -5.08 116.67 115.17 2eli s ASP 12 Ca 0.00 0.90 0.03 0.00 -3.30 0.00 0.00 52.55 50.18 2eli s ASP 12 Cb 0.00 -2.23 0.07 0.00 -1.09 0.00 0.00 42.92 39.66 2eli s ASP 12 CO 0.00 -0.50 -0.08 -1.81 0.70 0.00 0.00 175.17 173.48 2eli s ASP 13 N -3.90 4.44 0.00 2.11 1.11 -1.26 -4.97 116.67 114.20 2eli s ASP 13 Ca 0.47 -1.50 0.15 0.00 0.18 0.00 0.00 52.55 51.85 2eli s ASP 13 Cb -0.10 -1.52 0.87 0.00 1.07 0.00 0.00 42.92 43.24 2eli s ASP 13 CO 0.41 -0.23 1.36 -0.81 1.18 0.00 0.00 175.17 177.09 2eli n PRO 14 N 4.43 0.40 -0.01 8.23 -0.04 -1.26 -2.55 135.00 144.19 2eli n PRO 14 Ca -0.11 0.05 -0.17 0.00 -0.04 0.00 0.00 63.50 63.23 2eli n PRO 14 Cb 0.42 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 2eli n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2eli h ARG 15 N 0.00 0.48 0.00 0.54 3.08 -2.01 -3.33 114.38 113.14 2eli h ARG 15 Ca 0.00 -0.43 -0.24 0.00 0.07 0.00 0.00 59.98 59.37 2eli h ARG 15 Cb 0.04 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 2eli h ARG 15 CO 0.00 1.07 -1.80 -1.13 -1.07 0.00 0.00 179.97 177.05 2eli n SER 16 N -4.22 0.58 -4.33 7.04 3.41 -1.15 -4.86 113.62 110.08 2eli n SER 16 Ca -0.09 0.27 -0.38 0.00 -0.26 0.00 0.00 58.87 58.41 2eli n SER 16 Cb 0.63 0.44 0.03 0.00 -0.26 0.00 0.00 64.21 65.05 2eli n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2eli n LYS 17 N -2.85 0.21 -2.86 4.33 4.76 -1.06 0.18 118.16 120.87 2eli n LYS 17 Ca -0.17 0.08 -0.33 0.00 -2.87 0.00 0.00 58.31 55.02 2eli n LYS 17 Cb 0.96 -1.34 -0.07 0.00 -1.84 0.00 0.00 35.03 32.75 2eli n LYS 17 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2eli s HIS 18 N -1.90 3.33 -0.36 2.13 3.76 -0.80 -4.59 115.29 116.86 2eli s HIS 18 Ca 0.61 1.52 0.06 0.00 -0.15 0.00 0.00 55.06 57.10 2eli s HIS 18 Cb -0.44 -2.78 0.48 0.00 1.11 0.00 0.00 32.58 30.95 2eli s HIS 18 CO 0.62 -0.09 1.48 1.63 -0.85 0.00 0.00 174.74 177.53 2eli n LYS 19 N -0.65 2.59 -1.57 1.40 5.02 -1.26 -5.05 118.16 118.64 2eli n LYS 19 Ca 0.06 -3.55 -0.40 0.00 -2.02 0.00 0.00 58.31 52.41 2eli n LYS 19 Cb 0.54 -2.06 0.03 0.00 -0.02 0.00 0.00 35.03 33.52 2eli n LYS 19 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2eli n PHE 20 N -0.95 0.59 -3.74 2.13 3.72 -1.26 -3.81 117.46 114.14 2eli n PHE 20 Ca 0.42 0.50 -0.13 0.00 -0.05 0.00 0.00 57.45 58.20 2eli n PHE 20 Cb 0.94 -2.13 -0.13 0.00 -0.94 0.00 0.00 39.48 37.22 2eli n PHE 20 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2eli s LYS 21 N -2.22 0.17 -0.51 -1.08 -0.14 -0.62 -4.87 119.74 110.47 2eli s LYS 21 Ca 0.68 0.45 -0.26 0.00 -1.36 0.00 0.00 55.97 55.48 2eli s LYS 21 Cb -0.50 -0.11 -0.06 0.00 -1.68 0.00 0.00 37.83 35.48 2eli s LYS 21 CO 0.53 -0.15 2.33 -1.50 -0.76 0.00 0.00 175.35 175.81 2eli s ILE 22 N 1.09 3.05 0.02 2.17 1.10 -1.26 -1.89 121.20 125.48 2eli s ILE 22 Ca -0.08 0.03 -0.00 0.00 -0.51 0.00 0.00 60.65 60.09 2eli s ILE 22 Cb -0.10 -3.14 -0.02 0.00 0.15 0.00 0.00 42.46 39.35 2eli s ILE 22 CO -0.07 -0.14 -0.02 -2.28 -2.11 0.00 0.00 174.94 170.33 2eli s HIS 23 N 11.79 0.24 0.24 3.50 2.46 -1.21 -4.89 115.29 127.42 2eli s HIS 23 Ca 0.93 -0.49 -0.16 0.00 0.47 0.00 0.00 55.06 55.82 2eli s HIS 23 Cb -0.16 -0.17 -0.08 0.00 -0.13 0.00 0.00 32.58 32.03 2eli s HIS 23 CO 0.25 -0.19 0.67 -0.08 -2.47 0.00 0.00 174.74 172.92 2eli s THR 24 N -1.40 4.71 0.09 0.89 -1.32 -1.26 -4.19 115.64 113.17 2eli s THR 24 Ca -0.15 0.97 -0.00 0.00 -1.21 0.00 0.00 61.69 61.30 2eli s THR 24 Cb -0.09 -3.72 -0.04 0.00 -1.51 0.00 0.00 72.50 67.13 2eli s THR 24 CO -0.01 0.05 0.26 -0.31 -2.21 0.00 0.00 174.62 172.40 2eli s TYR 25 N -1.70 3.51 -0.82 9.09 1.51 -1.26 -4.97 117.35 122.71 2eli s TYR 25 Ca 0.46 0.28 0.27 0.00 -1.01 0.00 0.00 57.07 57.07 2eli s TYR 25 Cb -0.13 -1.79 0.87 0.00 -0.11 0.00 0.00 41.96 40.80 2eli s TYR 25 CO 0.19 0.54 1.75 0.41 -1.11 0.00 0.00 175.55 177.34 2eli n GLY 26 N 0.07 -1.59 3.16 0.71 0.00 -1.26 -4.88 105.19 101.41 2eli n GLY 26 Ca -0.05 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2eli n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eli s SER 27 N -3.95 0.31 -0.64 1.61 0.01 -1.26 -5.10 113.70 104.68 2eli s SER 27 Ca 0.11 -1.06 -0.26 0.00 1.31 0.00 0.00 55.95 56.05 2eli s SER 27 Cb 0.15 0.29 -0.02 0.00 0.21 0.00 0.00 66.02 66.65 2eli s SER 27 CO 0.60 -0.72 1.87 -2.16 0.41 0.00 0.00 173.24 173.24 2eli s PRO 28 N -3.98 2.62 0.26 12.44 0.04 -1.26 -4.98 135.00 140.14 2eli s PRO 28 Ca 0.17 0.52 0.03 0.00 0.04 0.00 0.00 61.00 61.76 2eli s PRO 28 Cb 0.07 -4.45 -0.03 0.00 0.04 0.00 0.00 34.50 30.13 2eli s PRO 28 CO -0.03 -2.79 0.41 0.99 0.04 0.00 0.00 177.00 175.62 2eli s THR 29 N 9.16 5.21 -0.17 1.26 2.01 -1.26 -4.93 115.64 126.93 2eli s THR 29 Ca 0.67 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.91 2eli s THR 29 Cb -0.12 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 2eli s THR 29 CO 0.19 -0.36 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.32 2eli s PHE 30 N -2.05 2.92 0.99 4.92 0.08 -1.26 -1.12 117.98 122.47 2eli s PHE 30 Ca 0.36 -0.64 -0.16 0.00 0.12 0.00 0.00 56.93 56.61 2eli s PHE 30 Cb -0.10 -1.97 -0.10 0.00 -0.57 0.00 0.00 43.02 40.29 2eli s PHE 30 CO 0.31 -0.28 -0.46 0.00 -0.10 0.00 0.00 175.22 174.69 2eli n ASP 32 N 2.12 2.27 -0.02 0.00 -0.08 -0.54 -3.95 116.55 116.34 2eli n ASP 32 Ca 0.00 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.28 2eli n ASP 32 Cb 0.55 1.47 -0.00 0.00 2.34 0.00 0.00 41.12 45.49 2eli n ASP 32 CO 0.00 0.00 0.00 -0.74 0.12 0.00 0.00 177.20 176.58 2eli h HIS 33 N 0.00 0.00 0.12 -0.67 2.76 -1.92 -3.42 115.15 112.02 2eli h HIS 33 Ca -0.03 0.00 -0.19 0.00 -2.20 0.00 0.00 60.37 57.95 2eli h HIS 33 Cb 0.65 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.63 2eli h HIS 33 CO 0.00 0.00 -0.90 0.00 -1.30 0.00 0.00 177.93 175.73 2eli n GLY 35 N 1.67 0.84 2.92 0.00 0.00 -1.25 -5.06 105.19 104.31 2eli n GLY 35 Ca -0.17 -0.68 -0.11 0.00 0.00 0.00 0.00 46.02 45.07 2eli n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eli s SER 36 N -2.20 0.12 0.14 1.61 0.01 -1.26 -4.86 113.70 107.26 2eli s SER 36 Ca 0.00 -0.22 -0.33 0.00 1.31 0.00 0.00 55.95 56.72 2eli s SER 36 Cb 0.00 0.04 -0.13 0.00 0.21 0.00 0.00 66.02 66.15 2eli s SER 36 CO 0.00 -0.13 1.70 -0.11 0.41 0.00 0.00 173.24 175.12 2eli n LEU 37 N 2.45 3.55 -4.69 2.44 -0.00 -1.26 -1.82 117.00 117.67 2eli n LEU 37 Ca -0.17 1.04 -0.42 0.00 -0.00 0.00 0.00 56.01 56.46 2eli n LEU 37 Cb 0.58 -1.48 -0.03 0.00 -0.00 0.00 0.00 43.42 42.49 2eli n LEU 37 CO 0.23 -0.05 0.85 -0.76 -0.00 0.00 0.00 177.39 177.66 2eli s LEU 38 N 1.72 4.25 0.40 -1.96 1.43 -0.27 -4.93 118.68 119.32 2eli s LEU 38 Ca 0.80 1.62 0.08 0.00 -1.03 0.00 0.00 54.13 55.60 2eli s LEU 38 Cb -0.60 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.03 2eli s LEU 38 CO 0.38 -0.50 0.25 -0.31 0.23 0.00 0.00 176.35 176.40 2eli s TYR 39 N 2.12 2.68 0.00 0.29 2.02 -1.26 -4.64 117.35 118.57 2eli s TYR 39 Ca 0.51 -0.50 0.00 0.00 -0.37 0.00 0.00 57.07 56.71 2eli s TYR 39 Cb -0.20 -1.97 0.00 0.00 -0.40 0.00 0.00 41.96 39.39 2eli s TYR 39 CO 0.19 0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.68 2eli n GLY 40 N -1.34 2.75 0.07 0.71 0.00 -1.26 -4.61 105.19 101.51 2eli n GLY 40 Ca 0.00 -1.76 -0.13 0.00 0.00 0.00 0.00 46.02 44.13 2eli n GLY 40 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2eli h LEU 41 N 0.00 0.00 -8.39 0.99 7.12 -1.99 -3.45 115.31 109.59 2eli h LEU 41 Ca 0.00 -0.89 -0.31 0.00 0.13 0.00 0.00 57.88 56.81 2eli h LEU 41 Cb 0.00 0.00 -0.19 0.00 -0.53 0.00 0.00 40.66 39.94 2eli h LEU 41 CO 0.00 0.98 -0.73 -0.51 -0.13 0.00 0.00 178.44 178.04 2eli s ILE 42 N -2.17 0.86 -1.47 4.05 2.07 -1.26 -4.80 121.20 118.48 2eli s ILE 42 Ca -0.18 -1.53 -0.07 0.00 -1.41 0.00 0.00 60.65 57.46 2eli s ILE 42 Cb -0.02 -1.22 0.03 0.00 0.13 0.00 0.00 42.46 41.38 2eli s ILE 42 CO 0.62 -0.52 0.69 1.41 -1.91 0.00 0.00 174.94 175.23 2eli n HIS 43 N 0.75 -2.08 0.08 3.50 8.25 -1.26 -4.91 115.22 119.54 2eli n HIS 43 Ca -0.17 0.61 -0.06 0.00 -0.26 0.00 0.00 57.72 57.84 2eli n HIS 43 Cb 0.57 -4.17 -0.03 0.00 1.12 0.00 0.00 29.99 27.48 2eli n HIS 43 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2eli h GLN 44 N -1.53 -0.28 0.00 -0.41 4.20 -1.82 -3.47 115.11 111.80 2eli h GLN 44 Ca -0.52 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2eli h GLN 44 Cb 1.35 0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.19 2eli h GLN 44 CO 0.57 -0.19 0.00 0.41 -0.67 0.00 0.00 178.83 178.95 2eli n GLY 45 N -1.17 5.30 2.98 3.46 0.00 -1.26 -4.54 105.19 109.96 2eli n GLY 45 Ca -0.03 -1.04 -0.14 0.00 0.00 0.00 0.00 46.02 44.81 2eli n GLY 45 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2eli s MET 46 N 4.85 0.40 -0.07 1.61 -1.94 0.12 -3.30 119.30 120.97 2eli s MET 46 Ca 0.00 -0.39 0.03 0.00 -1.71 0.00 0.00 55.69 53.62 2eli s MET 46 Cb 0.00 -0.29 0.01 0.00 2.01 0.00 0.00 34.83 36.56 2eli s MET 46 CO 0.00 0.07 -0.14 0.21 -0.01 0.00 0.00 175.02 175.15 2eli s LYS 47 N -0.69 1.90 0.83 2.03 2.47 -0.79 -1.92 119.74 123.58 2eli s LYS 47 Ca -0.03 -0.49 -0.12 0.00 -1.56 0.00 0.00 55.97 53.77 2eli s LYS 47 Cb -0.05 -1.54 0.09 0.00 -1.46 0.00 0.00 37.83 34.87 2eli s LYS 47 CO -0.00 0.06 1.10 0.00 0.16 0.00 0.00 175.35 176.67 2eli n ASP 49 N -3.58 1.09 -0.09 0.00 -0.08 -1.25 -3.30 116.55 109.34 2eli n ASP 49 Ca 0.07 -0.34 -0.15 0.00 -1.51 0.00 0.00 54.79 52.86 2eli n ASP 49 Cb 0.56 1.45 -0.08 0.00 2.34 0.00 0.00 41.12 45.40 2eli n ASP 49 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 2eli n THR 50 N -1.79 1.02 0.26 5.18 5.66 -1.26 -4.62 114.28 118.73 2eli n THR 50 Ca -0.01 -0.34 0.08 0.00 -3.05 0.00 0.00 64.05 60.73 2eli n THR 50 Cb 0.35 -1.34 0.13 0.00 -1.55 0.00 0.00 70.33 67.93 2eli n THR 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2eli n ASP 52 N 0.92 -0.12 -4.76 0.00 8.00 -1.21 -4.84 116.55 114.54 2eli n ASP 52 Ca 0.12 -0.61 -0.37 0.00 0.71 0.00 0.00 54.79 54.64 2eli n ASP 52 Cb 0.44 -0.76 -0.06 0.00 -0.02 0.00 0.00 41.12 40.72 2eli n ASP 52 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2eli s MET 53 N -5.36 4.16 -0.38 -1.24 1.75 -1.26 -4.72 119.30 112.25 2eli s MET 53 Ca 0.06 0.31 -0.19 0.00 -1.25 0.00 0.00 55.69 54.62 2eli s MET 53 Cb -0.03 -3.36 0.01 0.00 2.84 0.00 0.00 34.83 34.29 2eli s MET 53 CO 0.47 0.37 0.56 -0.80 -0.65 0.00 0.00 175.02 174.97 2eli s ASN 54 N 0.00 6.32 0.04 1.11 -0.87 -1.26 -2.94 114.94 117.34 2eli s ASN 54 Ca 0.22 -0.15 -0.02 0.00 -1.57 0.00 0.00 52.86 51.34 2eli s ASN 54 Cb -0.15 -2.29 -0.03 0.00 -0.02 0.00 0.00 41.25 38.77 2eli s ASN 54 CO 0.09 -0.59 -0.00 0.68 -2.57 0.00 0.00 177.10 174.71 2eli s VAL 55 N 2.53 0.16 0.69 1.60 -7.23 -0.81 -1.47 120.40 115.87 2eli s VAL 55 Ca 0.20 -1.34 -0.14 0.00 -1.81 0.00 0.00 61.98 58.89 2eli s VAL 55 Cb -0.15 -0.95 0.01 0.00 0.56 0.00 0.00 36.38 35.86 2eli s VAL 55 CO 0.15 -0.74 1.11 -1.00 -0.31 0.00 0.00 175.10 174.31 2eli s HIS 56 N -2.79 2.60 0.51 2.82 3.76 -1.26 0.13 115.29 121.07 2eli s HIS 56 Ca -0.04 1.55 0.18 0.00 -0.15 0.00 0.00 55.06 56.60 2eli s HIS 56 Cb -0.00 -3.14 1.29 0.00 1.11 0.00 0.00 32.58 31.83 2eli s HIS 56 CO -0.06 -1.73 2.13 0.87 -0.85 0.00 0.00 174.74 175.11 2eli h LYS 57 N -0.26 0.00 -0.00 1.40 1.79 -1.85 -0.14 116.57 117.51 2eli h LYS 57 Ca -0.46 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 2eli h LYS 57 Cb 1.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 2eli h LYS 57 CO 0.53 0.04 -0.46 0.00 -1.08 0.00 0.00 179.45 178.48 2eli n GLN 58 N -4.38 0.48 0.07 3.15 -0.00 -1.26 -3.84 117.38 111.58 2eli n GLN 58 Ca -0.03 -0.31 0.11 0.00 -0.00 0.00 0.00 57.00 56.77 2eli n GLN 58 Cb 0.12 -1.49 0.01 0.00 -0.00 0.00 0.00 30.24 28.88 2eli n GLN 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2eli h VAL 60 N 0.00 1.26 0.00 0.00 -1.51 -1.52 -2.37 116.25 112.11 2eli h VAL 60 Ca 0.00 -1.25 -0.03 0.00 -1.23 0.00 0.00 66.70 64.19 2eli h VAL 60 Cb 0.90 1.68 -0.00 0.00 -2.13 0.00 0.00 31.29 31.73 2eli h VAL 60 CO 0.00 0.36 -0.13 -0.29 -1.23 0.00 0.00 177.57 176.28 2eli h ILE 61 N 0.00 0.62 0.12 7.19 2.10 -1.78 -2.96 117.51 122.79 2eli h ILE 61 Ca -0.00 -0.57 -0.29 0.00 1.08 0.00 0.00 64.86 65.08 2eli h ILE 61 Cb 0.65 1.36 -0.00 0.00 -1.09 0.00 0.00 36.82 37.74 2eli h ILE 61 CO 0.05 0.13 -1.49 0.78 -1.08 0.00 0.00 178.15 176.54 2eli h ASN 62 N 0.00 0.39 -2.00 2.19 2.35 -1.66 -3.47 115.58 113.38 2eli h ASN 62 Ca -0.00 -0.86 -0.63 0.00 -0.55 0.00 0.00 56.30 54.26 2eli h ASN 62 Cb 0.35 -0.13 0.10 0.00 0.05 0.00 0.00 38.32 38.70 2eli h ASN 62 CO 0.02 1.65 0.00 0.52 -1.65 0.00 0.00 177.43 177.97 2eli n VAL 63 N -3.87 1.74 -2.20 2.81 0.31 -1.01 -4.87 118.33 111.23 2eli n VAL 63 Ca -0.26 -0.44 -0.42 0.00 -0.01 0.00 0.00 64.34 63.22 2eli n VAL 63 Cb 0.92 -0.72 -0.03 0.00 -0.91 0.00 0.00 33.84 33.10 2eli n VAL 63 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2eli s PRO 64 N -1.17 4.34 0.05 5.55 0.04 -1.26 -4.94 135.00 137.61 2eli s PRO 64 Ca 0.63 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 63.62 2eli s PRO 64 Cb -0.79 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 30.47 2eli s PRO 64 CO 0.57 -0.40 0.90 0.43 0.04 0.00 0.00 177.00 178.54 2eli n SER 65 N 3.83 -0.31 -4.13 6.66 7.64 -1.26 -4.49 113.62 121.56 2eli n SER 65 Ca 0.11 0.97 -0.36 0.00 1.01 0.00 0.00 58.87 60.59 2eli n SER 65 Cb 0.43 -0.29 0.05 0.00 -1.01 0.00 0.00 64.21 63.38 2eli n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2eli n LEU 66 N -3.60 -4.43 -3.52 -3.43 -0.00 -1.25 -1.90 117.00 98.86 2eli n LEU 66 Ca 0.01 0.32 -0.11 0.00 -0.00 0.00 0.00 56.01 56.23 2eli n LEU 66 Cb 0.08 -0.86 -0.02 0.00 -0.00 0.00 0.00 43.42 42.61 2eli n LEU 66 CO -0.05 -5.32 0.39 0.00 -0.00 0.00 0.00 177.39 172.41 2eli n GLY 68 N -0.38 0.59 0.00 0.00 0.00 -1.26 -4.79 105.19 99.34 2eli n GLY 68 Ca -0.14 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2eli n GLY 68 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2eli n MET 69 N -0.43 0.15 -3.30 1.61 3.85 -1.26 -5.06 117.12 112.69 2eli n MET 69 Ca 0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 57.70 56.54 2eli n MET 69 Cb 0.18 -0.63 0.08 0.00 -1.05 0.00 0.00 33.22 31.80 2eli n MET 69 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2eli n ASP 70 N -1.63 -2.61 -3.67 3.17 8.00 -1.26 -2.84 116.55 115.71 2eli n ASP 70 Ca 0.00 -0.54 -0.23 0.00 0.71 0.00 0.00 54.79 54.74 2eli n ASP 70 Cb 0.13 -4.58 0.05 0.00 -0.02 0.00 0.00 41.12 36.70 2eli n ASP 70 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2eli n HIS 71 N -3.91 -2.17 -1.39 1.24 8.25 -1.26 -4.86 115.22 111.12 2eli n HIS 71 Ca -0.22 0.90 -0.43 0.00 -0.26 0.00 0.00 57.72 57.71 2eli n HIS 71 Cb 0.64 -4.54 -0.01 0.00 1.12 0.00 0.00 29.99 27.20 2eli n HIS 71 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2eli n THR 72 N -4.42 1.39 -3.92 1.59 5.66 -1.13 -4.99 114.28 108.47 2eli n THR 72 Ca -0.19 -0.50 -0.09 0.00 -3.05 0.00 0.00 64.05 60.22 2eli n THR 72 Cb 0.63 -0.25 -0.08 0.00 -1.55 0.00 0.00 70.33 69.09 2eli n THR 72 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2eli s GLU 73 N -1.24 0.86 -0.43 1.09 2.02 -1.26 -5.10 118.70 114.65 2eli s GLU 73 Ca 0.62 -1.05 -0.44 0.00 0.02 0.00 0.00 54.97 54.11 2eli s GLU 73 Cb -0.69 0.32 -0.18 0.00 0.10 0.00 0.00 34.13 33.68 2eli s GLU 73 CO 0.60 -0.27 1.71 0.36 0.02 0.00 0.00 175.26 177.67 2eli n LYS 74 N -0.06 0.41 -3.65 1.61 2.85 -1.26 -4.92 118.16 113.13 2eli n LYS 74 Ca -0.13 0.15 -0.05 0.00 -1.05 0.00 0.00 58.31 57.23 2eli n LYS 74 Cb 0.62 -1.72 -0.07 0.00 -0.65 0.00 0.00 35.03 33.21 2eli n LYS 74 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 2eli s ARG 75 N 3.50 0.48 0.00 -1.58 3.52 -1.26 -5.16 118.95 118.45 2eli s ARG 75 Ca 1.04 1.25 0.00 0.00 -0.13 0.00 0.00 55.73 57.89 2eli s ARG 75 Cb -1.34 0.58 0.00 0.00 -1.56 0.00 0.00 34.95 32.63 2eli s ARG 75 CO 0.75 -0.21 0.00 0.41 -0.81 0.00 0.00 175.30 175.43 2eli n GLY 76 N 5.30 -1.13 3.86 8.12 0.00 -1.26 -5.16 105.19 114.92 2eli n GLY 76 Ca -0.12 -0.96 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 2eli n GLY 76 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2eli s ARG 77 N -1.51 3.86 -0.07 1.61 1.81 -1.26 -5.08 118.95 118.31 2eli s ARG 77 Ca 0.00 0.68 0.05 0.00 -1.72 0.00 0.00 55.73 54.74 2eli s ARG 77 Cb 0.00 -2.29 -0.01 0.00 -0.45 0.00 0.00 34.95 32.21 2eli s ARG 77 CO 0.00 -0.12 -0.24 0.42 -0.68 0.00 0.00 175.30 174.68 2eli s ILE 78 N -2.45 2.00 -0.27 1.52 1.09 -1.26 -5.11 121.20 116.71 2eli s ILE 78 Ca 0.55 -1.02 -0.10 0.00 -1.10 0.00 0.00 60.65 58.97 2eli s ILE 78 Cb -0.10 -1.70 0.11 0.00 -1.06 0.00 0.00 42.46 39.71 2eli s ILE 78 CO 0.30 0.55 0.60 -0.72 -0.10 0.00 0.00 174.94 175.58 2eli s TYR 79 N 0.01 -1.15 -0.93 3.97 1.13 -1.26 -5.10 117.35 114.01 2eli s TYR 79 Ca -0.08 2.09 -0.19 0.00 -1.41 0.00 0.00 57.07 57.47 2eli s TYR 79 Cb -0.15 0.65 0.12 0.00 -1.10 0.00 0.00 41.96 41.48 2eli s TYR 79 CO 0.05 -0.59 1.16 -0.51 -2.51 0.00 0.00 175.55 173.15 2eli s LEU 80 N 2.54 4.86 0.17 -3.49 1.02 -1.26 -4.97 118.68 117.55 2eli s LEU 80 Ca -0.06 -1.95 0.00 0.00 0.02 0.00 0.00 54.13 52.14 2eli s LEU 80 Cb -0.11 -2.42 -0.04 0.00 0.02 0.00 0.00 46.19 43.64 2eli s LEU 80 CO -0.18 -1.12 0.05 -0.75 0.02 0.00 0.00 176.35 174.37 2eli s LYS 81 N 2.98 1.09 -0.78 1.70 2.47 -1.26 -4.89 119.74 121.06 2eli s LYS 81 Ca 0.34 -1.54 -0.04 0.00 -1.56 0.00 0.00 55.97 53.17 2eli s LYS 81 Cb -0.04 -0.01 0.00 0.00 -1.46 0.00 0.00 37.83 36.33 2eli s LYS 81 CO -0.09 -0.23 0.67 0.00 0.16 0.00 0.00 175.35 175.86 2eli n ALA 82 N -0.22 -0.83 -3.57 3.13 0.00 -1.26 -4.98 120.51 112.78 2eli n ALA 82 Ca -0.04 0.19 -0.37 0.00 0.00 0.00 0.00 53.44 53.22 2eli n ALA 82 Cb 0.64 -3.13 -0.05 0.00 0.00 0.00 0.00 19.45 16.91 2eli n ALA 82 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2eli n GLU 83 N -3.08 2.82 -4.24 0.00 4.07 -1.26 -5.03 120.64 113.92 2eli n GLU 83 Ca -0.02 -4.49 -0.13 0.00 -0.06 0.00 0.00 57.16 52.46 2eli n GLU 83 Cb 0.55 -2.43 -0.10 0.00 -0.06 0.00 0.00 31.44 29.40 2eli n GLU 83 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2eli s VAL 84 N -1.46 0.66 0.00 6.31 -7.23 -1.26 -5.28 120.40 112.14 2eli s VAL 84 Ca 0.29 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2eli s VAL 84 Cb -0.06 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 34.77 2eli s VAL 84 CO -0.11 -0.49 0.00 0.00 -0.31 0.00 0.00 175.10 174.19