#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eli h SER 2 N 0.00 0.00 -6.22 1.61 0.02 -2.14 -3.47 113.55 103.36 2eli h SER 2 Ca 0.00 0.00 -0.47 0.00 -0.84 0.00 0.00 61.79 60.48 2eli h SER 2 Cb 0.00 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 62.28 2eli h SER 2 CO 0.00 0.59 -0.69 -1.54 -1.14 0.00 0.00 176.83 174.05 2eli n SER 3 N -4.57 -0.93 -4.35 3.07 3.41 -1.26 -4.87 113.62 104.11 2eli n SER 3 Ca -0.03 -0.93 -0.28 0.00 -0.26 0.00 0.00 58.87 57.36 2eli n SER 3 Cb 0.12 -1.19 -0.13 0.00 -0.26 0.00 0.00 64.21 62.74 2eli n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2eli s GLY 4 N -2.96 1.46 0.13 5.00 0.00 -1.26 -5.14 107.32 104.55 2eli s GLY 4 Ca 0.49 -1.36 0.10 0.00 0.00 0.00 0.00 44.72 43.96 2eli s GLY 4 CO 0.76 -1.31 -0.24 -0.56 0.00 0.00 0.00 173.10 171.75 2eli s SER 5 N -1.76 3.07 -0.10 1.64 0.01 -1.26 -5.07 113.70 110.23 2eli s SER 5 Ca 0.12 -0.75 -0.02 0.00 1.31 0.00 0.00 55.95 56.60 2eli s SER 5 Cb -0.10 -0.20 -0.02 0.00 0.21 0.00 0.00 66.02 65.92 2eli s SER 5 CO 0.04 0.12 0.08 -1.28 0.41 0.00 0.00 173.24 172.62 2eli h SER 6 N 3.81 -0.04 0.00 2.44 0.87 -2.04 -3.51 113.55 115.08 2eli h SER 6 Ca -0.48 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2eli h SER 6 Cb 1.18 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2eli h SER 6 CO 0.41 0.47 0.00 0.61 -0.53 0.00 0.00 176.83 177.79 2eli n GLY 7 N 1.65 0.81 2.61 5.77 0.00 -1.26 -5.05 105.19 109.71 2eli n GLY 7 Ca -0.01 -1.83 -0.26 0.00 0.00 0.00 0.00 46.02 43.92 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 0.34 0.21 -0.02 0.00 -1.26 -5.13 107.32 101.46 2eli s GLY 8 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 44.72 44.02 2eli s GLY 8 CO 0.00 1.83 1.30 2.56 0.00 0.00 0.00 173.10 178.79 2eli s PRO 9 N 2.15 4.40 0.65 2.90 0.04 -1.26 -4.98 135.00 138.90 2eli s PRO 9 Ca 0.04 2.04 -0.17 0.00 0.04 0.00 0.00 61.00 62.95 2eli s PRO 9 Cb -0.16 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.14 2eli s PRO 9 CO -0.14 -0.23 0.71 -0.25 0.04 0.00 0.00 177.00 177.13 2eli n ASP 10 N 2.50 -0.37 -1.74 6.66 9.92 -1.26 -4.84 116.55 127.42 2eli n ASP 10 Ca 0.06 0.70 -0.11 0.00 -0.53 0.00 0.00 54.79 54.91 2eli n ASP 10 Cb 0.43 -1.28 0.03 0.00 -0.64 0.00 0.00 41.12 39.65 2eli n ASP 10 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 2eli n THR 11 N -2.05 2.47 -3.94 -3.53 5.66 -1.26 -4.90 114.28 106.73 2eli n THR 11 Ca 0.12 -1.22 -0.24 0.00 -3.05 0.00 0.00 64.05 59.66 2eli n THR 11 Cb 0.49 -1.37 -0.03 0.00 -1.55 0.00 0.00 70.33 67.87 2eli n THR 11 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2eli s ASP 12 N 0.79 6.33 -0.57 1.09 1.11 -1.26 -5.07 116.67 119.09 2eli s ASP 12 Ca 0.20 0.13 -0.11 0.00 0.18 0.00 0.00 52.55 52.95 2eli s ASP 12 Cb 0.16 -1.89 0.15 0.00 1.07 0.00 0.00 42.92 42.40 2eli s ASP 12 CO -0.00 -0.01 0.48 -0.62 1.18 0.00 0.00 175.17 176.20 2eli s ASP 13 N -3.58 6.00 0.00 0.27 2.15 -1.26 -4.91 116.67 115.34 2eli s ASP 13 Ca 0.34 -2.12 0.15 0.00 0.43 0.00 0.00 52.55 51.36 2eli s ASP 13 Cb -0.10 -2.09 0.90 0.00 -0.30 0.00 0.00 42.92 41.33 2eli s ASP 13 CO 0.29 -0.69 1.36 -0.81 -0.17 0.00 0.00 175.17 175.15 2eli n PRO 14 N 4.69 0.44 -0.02 4.34 -0.04 -1.26 -2.45 135.00 140.70 2eli n PRO 14 Ca -0.04 0.03 -0.13 0.00 -0.04 0.00 0.00 63.50 63.31 2eli n PRO 14 Cb 0.41 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.23 2eli n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2eli n ARG 15 N -1.05 0.68 0.20 0.54 1.74 -1.26 -3.96 116.66 113.55 2eli n ARG 15 Ca 0.11 0.27 0.14 0.00 -0.77 0.00 0.00 57.85 57.61 2eli n ARG 15 Cb 0.07 -1.75 0.53 0.00 -1.02 0.00 0.00 32.46 30.28 2eli n ARG 15 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2eli h SER 16 N 0.03 0.00 -3.18 0.55 4.64 -1.80 -3.46 113.55 110.33 2eli h SER 16 Ca -0.35 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.41 2eli h SER 16 Cb 2.03 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 64.31 2eli h SER 16 CO 0.08 0.00 -0.50 0.29 -0.87 0.00 0.00 176.83 175.83 2eli n LYS 17 N -2.72 0.18 -3.22 4.77 4.76 -1.23 0.23 118.16 120.93 2eli n LYS 17 Ca 0.02 0.10 -0.39 0.00 -2.87 0.00 0.00 58.31 55.17 2eli n LYS 17 Cb 0.32 -1.79 -0.06 0.00 -1.84 0.00 0.00 35.03 31.67 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 -2.00 3.77 -0.96 2.13 3.76 -0.86 -4.56 115.29 116.57 2eli s HIS 18 Ca 0.63 1.28 -0.01 0.00 -0.15 0.00 0.00 55.06 56.80 2eli s HIS 18 Cb -0.32 -2.56 0.29 0.00 1.11 0.00 0.00 32.58 31.10 2eli s HIS 18 CO 0.61 0.50 1.27 1.63 -0.85 0.00 0.00 174.74 177.90 2eli n LYS 19 N 2.08 3.93 -3.05 1.40 4.01 -1.26 -5.02 118.16 120.24 2eli n LYS 19 Ca -0.09 -4.59 -0.39 0.00 -0.51 0.00 0.00 58.31 52.73 2eli n LYS 19 Cb 0.51 -2.44 -0.06 0.00 -0.51 0.00 0.00 35.03 32.52 2eli n LYS 19 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2eli s PHE 20 N -2.66 3.84 -0.03 2.13 0.08 -1.26 -0.28 117.98 119.79 2eli s PHE 20 Ca 0.33 1.51 0.01 0.00 0.12 0.00 0.00 56.93 58.90 2eli s PHE 20 Cb 0.07 -2.72 0.02 0.00 -0.57 0.00 0.00 43.02 39.81 2eli s PHE 20 CO 0.07 0.46 -0.05 0.21 -0.10 0.00 0.00 175.22 175.81 2eli s LYS 21 N -0.82 0.74 -0.10 0.44 2.20 -0.29 -4.89 119.74 117.02 2eli s LYS 21 Ca 0.35 -0.13 -0.29 0.00 -0.36 0.00 0.00 55.97 55.54 2eli s LYS 21 Cb -0.22 -0.75 -0.07 0.00 -1.51 0.00 0.00 37.83 35.29 2eli s LYS 21 CO 0.24 -0.03 2.09 -1.50 -0.36 0.00 0.00 175.35 175.79 2eli s ILE 22 N 0.66 3.03 0.12 5.43 1.10 -1.26 -2.99 121.20 127.28 2eli s ILE 22 Ca -0.09 0.03 -0.05 0.00 -0.51 0.00 0.00 60.65 60.03 2eli s ILE 22 Cb -0.12 -3.03 -0.02 0.00 0.15 0.00 0.00 42.46 39.44 2eli s ILE 22 CO 0.00 -0.01 0.15 -2.28 -2.11 0.00 0.00 174.94 170.69 2eli s HIS 23 N 6.48 0.48 -0.05 3.50 2.46 -1.24 -5.02 115.29 121.90 2eli s HIS 23 Ca 0.94 -0.90 -0.03 0.00 0.47 0.00 0.00 55.06 55.55 2eli s HIS 23 Cb -0.37 -0.23 -0.04 0.00 -0.13 0.00 0.00 32.58 31.81 2eli s HIS 23 CO 0.38 -0.57 0.10 0.99 -2.47 0.00 0.00 174.74 173.17 2eli s THR 24 N -3.96 4.97 -0.14 0.89 2.01 -1.26 -3.92 115.64 114.24 2eli s THR 24 Ca 0.14 -0.16 -0.03 0.00 0.31 0.00 0.00 61.69 61.95 2eli s THR 24 Cb 0.06 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.32 2eli s THR 24 CO -0.04 0.47 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.02 2eli s TYR 25 N -1.11 3.04 -1.94 4.92 1.51 -1.26 -4.99 117.35 117.52 2eli s TYR 25 Ca 0.19 -0.20 0.28 0.00 -1.01 0.00 0.00 57.07 56.34 2eli s TYR 25 Cb -0.12 -1.92 1.15 0.00 -0.11 0.00 0.00 41.96 40.96 2eli s TYR 25 CO 0.10 0.07 1.81 0.41 -1.11 0.00 0.00 175.55 176.82 2eli n GLY 26 N 3.24 -0.62 3.19 0.71 0.00 -1.26 -4.87 105.19 105.58 2eli n GLY 26 Ca -0.18 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 2eli n GLY 26 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eli s SER 27 N -2.30 1.47 -0.58 1.61 1.04 -1.26 -5.09 113.70 108.59 2eli s SER 27 Ca 0.33 -0.85 -0.27 0.00 0.48 0.00 0.00 55.95 55.64 2eli s SER 27 Cb 0.20 0.01 -0.02 0.00 0.10 0.00 0.00 66.02 66.31 2eli s SER 27 CO 0.43 -0.29 1.85 -2.16 0.98 0.00 0.00 173.24 174.06 2eli s PRO 28 N -2.99 2.71 0.24 4.02 0.04 -1.26 -4.98 135.00 132.78 2eli s PRO 28 Ca 0.07 0.69 0.04 0.00 0.04 0.00 0.00 61.00 61.85 2eli s PRO 28 Cb -0.02 -4.36 -0.03 0.00 0.04 0.00 0.00 34.50 30.13 2eli s PRO 28 CO -0.00 -2.63 0.37 0.99 0.04 0.00 0.00 177.00 175.76 2eli s THR 29 N 8.83 5.25 -0.13 1.26 2.01 -1.26 -4.96 115.64 126.64 2eli s THR 29 Ca 0.68 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.80 2eli s THR 29 Cb -0.13 -3.85 -0.00 0.00 0.01 0.00 0.00 72.50 68.53 2eli s THR 29 CO 0.22 -0.32 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.28 2eli s PHE 30 N -1.98 2.69 0.92 4.92 0.40 -1.26 0.05 117.98 123.72 2eli s PHE 30 Ca 0.35 -1.05 -0.14 0.00 -0.60 0.00 0.00 56.93 55.48 2eli s PHE 30 Cb -0.09 -1.81 -0.02 0.00 0.51 0.00 0.00 43.02 41.61 2eli s PHE 30 CO 0.30 -0.45 0.13 0.00 0.70 0.00 0.00 175.22 175.90 2eli n ASP 32 N 0.06 1.90 -0.03 0.00 2.03 -1.01 -3.80 116.55 115.69 2eli n ASP 32 Ca 0.05 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.36 2eli n ASP 32 Cb 0.53 1.38 -0.00 0.00 -0.72 0.00 0.00 41.12 42.31 2eli n ASP 32 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 2eli h HIS 33 N 0.00 0.00 0.05 -0.67 2.76 -1.92 -3.42 115.15 111.95 2eli h HIS 33 Ca -0.10 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 57.91 2eli h HIS 33 Cb 0.97 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.92 2eli h HIS 33 CO 0.00 0.00 -0.79 0.00 -1.30 0.00 0.00 177.93 175.84 2eli n GLY 35 N 1.61 1.94 3.47 0.00 0.00 -1.25 -5.06 105.19 105.90 2eli n GLY 35 Ca -0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.00 3.91 0.62 1.61 0.01 -1.26 -4.73 113.70 111.85 2eli s SER 36 Ca 0.00 -0.33 -0.18 0.00 1.31 0.00 0.00 55.95 56.75 2eli s SER 36 Cb 0.00 -0.71 -0.06 0.00 0.21 0.00 0.00 66.02 65.46 2eli s SER 36 CO 0.00 0.29 0.73 -0.11 0.41 0.00 0.00 173.24 174.56 2eli n LEU 37 N 1.83 2.19 -4.32 2.44 7.94 -1.26 -0.69 117.00 125.13 2eli n LEU 37 Ca -0.16 0.73 -0.45 0.00 -1.11 0.00 0.00 56.01 55.02 2eli n LEU 37 Cb 0.52 -1.28 -0.01 0.00 0.53 0.00 0.00 43.42 43.17 2eli n LEU 37 CO 0.26 -2.52 0.58 -0.76 -1.11 0.00 0.00 177.39 173.85 2eli s LEU 38 N -0.82 6.48 0.94 -1.96 1.43 0.11 -4.74 118.68 120.11 2eli s LEU 38 Ca 0.72 -3.17 -0.14 0.00 -1.03 0.00 0.00 54.13 50.51 2eli s LEU 38 Cb -0.41 -2.19 0.16 0.00 0.03 0.00 0.00 46.19 43.78 2eli s LEU 38 CO 0.51 -0.42 1.18 -0.72 0.23 0.00 0.00 176.35 177.13 2eli s TYR 39 N -0.58 2.17 0.00 0.29 -0.85 -1.26 -4.60 117.35 112.52 2eli s TYR 39 Ca 0.24 0.69 0.00 0.00 -0.52 0.00 0.00 57.07 57.48 2eli s TYR 39 Cb -0.10 -3.56 0.00 0.00 0.38 0.00 0.00 41.96 38.68 2eli s TYR 39 CO -0.09 -2.50 0.00 0.41 -1.52 0.00 0.00 175.55 171.85 2eli n GLY 40 N -2.56 3.30 0.13 5.49 0.00 -1.26 -4.61 105.19 105.68 2eli n GLY 40 Ca 0.09 -1.55 -0.10 0.00 0.00 0.00 0.00 46.02 44.46 2eli n GLY 40 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2eli h LEU 41 N 0.00 -0.17 -8.64 0.99 3.38 -1.96 -3.43 115.31 105.48 2eli h LEU 41 Ca 0.00 -0.35 -0.55 0.00 0.09 0.00 0.00 57.88 57.06 2eli h LEU 41 Cb 0.00 0.04 -0.22 0.00 0.09 0.00 0.00 40.66 40.57 2eli h LEU 41 CO 0.00 0.40 -0.83 -0.51 0.09 0.00 0.00 178.44 177.60 2eli s ILE 42 N -3.19 1.67 -1.37 1.22 2.07 -1.26 -4.76 121.20 115.58 2eli s ILE 42 Ca -0.12 -1.47 -0.03 0.00 -1.41 0.00 0.00 60.65 57.62 2eli s ILE 42 Cb 0.00 -1.51 -0.00 0.00 0.13 0.00 0.00 42.46 41.08 2eli s ILE 42 CO 0.44 -0.03 0.47 1.41 -1.91 0.00 0.00 174.94 175.32 2eli n HIS 43 N 1.22 -1.68 0.43 3.50 8.25 -1.26 -4.89 115.22 120.79 2eli n HIS 43 Ca -0.19 0.70 -0.18 0.00 -0.26 0.00 0.00 57.72 57.79 2eli n HIS 43 Cb 0.54 -3.72 -0.09 0.00 1.12 0.00 0.00 29.99 27.84 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 -1.86 -1.05 0.00 -0.41 4.20 -1.82 -3.48 115.11 110.69 2eli h GLN 44 Ca -0.64 0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.15 2eli h GLN 44 Cb 1.37 0.24 0.00 0.00 0.30 0.00 0.00 27.48 29.39 2eli h GLN 44 CO 0.60 -0.69 0.00 0.41 -0.67 0.00 0.00 178.83 178.49 2eli n GLY 45 N -1.33 4.83 3.35 3.46 0.00 -1.26 -4.56 105.19 109.68 2eli n GLY 45 Ca -0.14 -1.38 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 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 0.66 2.12 -0.06 1.61 -1.94 0.58 -3.66 119.30 118.62 2eli s MET 46 Ca 0.00 -0.92 0.05 0.00 -1.71 0.00 0.00 55.69 53.10 2eli s MET 46 Cb 0.00 -2.10 -0.00 0.00 2.01 0.00 0.00 34.83 34.74 2eli s MET 46 CO 0.00 0.56 -0.21 0.21 -0.01 0.00 0.00 175.02 175.58 2eli s LYS 47 N -0.79 2.28 0.91 2.03 2.20 -1.16 -1.38 119.74 123.83 2eli s LYS 47 Ca 0.11 -0.74 -0.12 0.00 -0.36 0.00 0.00 55.97 54.86 2eli s LYS 47 Cb -0.10 -1.89 0.14 0.00 -1.51 0.00 0.00 37.83 34.47 2eli s LYS 47 CO 0.00 0.26 1.09 0.00 -0.36 0.00 0.00 175.35 176.34 2eli n ASP 49 N -3.94 0.84 -0.07 0.00 2.03 0.61 -3.46 116.55 112.56 2eli n ASP 49 Ca 0.07 -0.38 -0.14 0.00 0.52 0.00 0.00 54.79 54.86 2eli n ASP 49 Cb 0.55 1.49 -0.05 0.00 -0.72 0.00 0.00 41.12 42.39 2eli n ASP 49 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2eli n THR 50 N -1.84 0.76 -0.11 5.18 5.66 -1.26 -4.66 114.28 118.01 2eli n THR 50 Ca -0.01 -0.21 0.11 0.00 -3.05 0.00 0.00 64.05 60.90 2eli n THR 50 Cb 0.39 -1.59 0.26 0.00 -1.55 0.00 0.00 70.33 67.84 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 1.43 -0.05 -4.68 0.00 8.00 -1.22 -4.81 116.55 115.22 2eli n ASP 52 Ca 0.21 -0.83 -0.42 0.00 0.71 0.00 0.00 54.79 54.45 2eli n ASP 52 Cb 0.58 -1.05 -0.03 0.00 -0.02 0.00 0.00 41.12 40.61 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 -5.59 4.38 -0.59 -1.24 -2.45 -1.26 -4.58 119.30 107.96 2eli s MET 53 Ca 0.20 1.34 -0.19 0.00 -1.25 0.00 0.00 55.69 55.79 2eli s MET 53 Cb -0.12 -3.56 0.10 0.00 1.25 0.00 0.00 34.83 32.49 2eli s MET 53 CO 0.66 -0.38 0.72 -0.80 1.05 0.00 0.00 175.02 176.28 2eli s ASN 54 N 1.12 6.19 0.23 1.11 0.01 -1.26 -2.14 114.94 120.20 2eli s ASN 54 Ca 0.46 -1.35 0.09 0.00 -0.71 0.00 0.00 52.86 51.36 2eli s ASN 54 Cb -0.17 -2.31 -0.05 0.00 0.41 0.00 0.00 41.25 39.13 2eli s ASN 54 CO 0.15 -1.13 -0.16 0.68 -1.51 0.00 0.00 177.10 175.13 2eli s VAL 55 N 2.81 1.99 0.66 1.60 -7.23 -0.48 -2.41 120.40 117.35 2eli s VAL 55 Ca 0.13 -2.28 -0.13 0.00 -1.81 0.00 0.00 61.98 57.89 2eli s VAL 55 Cb -0.23 -2.15 -0.01 0.00 0.56 0.00 0.00 36.38 34.55 2eli s VAL 55 CO 0.07 -0.52 1.06 -1.00 -0.31 0.00 0.00 175.10 174.40 2eli s HIS 56 N -2.81 3.03 0.43 2.82 3.76 -1.26 -0.31 115.29 120.96 2eli s HIS 56 Ca 0.25 1.46 0.15 0.00 -0.15 0.00 0.00 55.06 56.78 2eli s HIS 56 Cb -0.02 -2.94 1.05 0.00 1.11 0.00 0.00 32.58 31.79 2eli s HIS 56 CO 0.10 -1.22 1.95 0.87 -0.85 0.00 0.00 174.74 175.59 2eli h LYS 57 N -0.31 0.39 -0.00 1.40 1.57 -1.90 0.26 116.57 117.96 2eli h LYS 57 Ca -0.45 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2eli h LYS 57 Cb 1.21 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2eli h LYS 57 CO 0.57 0.25 -0.49 0.00 -0.57 0.00 0.00 179.45 179.21 2eli n GLN 58 N -4.47 0.45 0.06 3.15 -0.00 -1.26 -3.91 117.38 111.40 2eli n GLN 58 Ca 0.12 -0.30 0.08 0.00 -0.00 0.00 0.00 57.00 56.89 2eli n GLN 58 Cb 0.46 -1.49 -0.06 0.00 -0.00 0.00 0.00 30.24 29.14 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 1.19 0.00 0.00 -1.51 -1.17 -2.53 116.25 112.22 2eli h VAL 60 Ca -0.06 -1.55 0.00 0.00 -1.23 0.00 0.00 66.70 63.86 2eli h VAL 60 Cb 1.20 1.86 0.00 0.00 -2.13 0.00 0.00 31.29 32.22 2eli h VAL 60 CO 0.01 0.42 0.00 -0.29 -1.23 0.00 0.00 177.57 176.49 2eli h ILE 61 N 0.00 0.00 0.10 7.19 2.10 -1.76 -3.12 117.51 122.03 2eli h ILE 61 Ca -0.00 -0.49 -0.32 0.00 1.08 0.00 0.00 64.86 65.13 2eli h ILE 61 Cb 0.83 1.47 -0.01 0.00 -1.09 0.00 0.00 36.82 38.01 2eli h ILE 61 CO 0.06 0.00 -1.68 0.78 -1.08 0.00 0.00 178.15 176.22 2eli h ASN 62 N 0.00 0.34 -1.67 2.19 2.35 -1.66 -3.47 115.58 113.66 2eli h ASN 62 Ca 0.00 -0.84 -0.65 0.00 -0.55 0.00 0.00 56.30 54.26 2eli h ASN 62 Cb 0.51 -0.11 0.10 0.00 0.05 0.00 0.00 38.32 38.87 2eli h ASN 62 CO 0.00 1.72 -0.13 0.52 -1.65 0.00 0.00 177.43 177.89 2eli n VAL 63 N -3.79 1.70 -2.21 2.81 0.31 -1.05 -4.86 118.33 111.24 2eli n VAL 63 Ca -0.30 -0.43 -0.42 0.00 -0.01 0.00 0.00 64.34 63.19 2eli n VAL 63 Cb 0.94 -0.49 -0.03 0.00 -0.91 0.00 0.00 33.84 33.35 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 -1.04 4.35 0.07 5.55 0.04 -1.26 -4.93 135.00 137.78 2eli s PRO 64 Ca 0.65 2.03 -0.14 0.00 0.04 0.00 0.00 61.00 63.59 2eli s PRO 64 Cb -0.86 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 30.40 2eli s PRO 64 CO 0.57 -0.38 0.86 -1.13 0.04 0.00 0.00 177.00 176.97 2eli n SER 65 N 3.67 -0.47 -4.21 6.66 3.41 -1.26 -4.44 113.62 116.98 2eli n SER 65 Ca 0.10 0.97 -0.35 0.00 -0.26 0.00 0.00 58.87 59.33 2eli n SER 65 Cb 0.43 -0.19 0.07 0.00 -0.26 0.00 0.00 64.21 64.26 2eli n SER 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2eli n LEU 66 N -4.16 -3.17 -3.61 1.04 -0.00 -1.23 -2.02 117.00 103.85 2eli n LEU 66 Ca 0.01 0.29 -0.16 0.00 -0.00 0.00 0.00 56.01 56.15 2eli n LEU 66 Cb 0.12 -0.97 -0.07 0.00 -0.00 0.00 0.00 43.42 42.49 2eli n LEU 66 CO -0.07 -4.84 0.30 0.00 -0.00 0.00 0.00 177.39 172.78 2eli n GLY 68 N 1.23 0.98 3.23 0.00 0.00 -1.26 -4.83 105.19 104.54 2eli n GLY 68 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2eli n GLY 68 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2eli s MET 69 N 0.05 3.11 0.42 1.61 -1.94 -1.26 -5.10 119.30 116.19 2eli s MET 69 Ca 0.00 -0.83 -0.21 0.00 -1.71 0.00 0.00 55.69 52.94 2eli s MET 69 Cb 0.00 -2.42 -0.15 0.00 2.01 0.00 0.00 34.83 34.27 2eli s MET 69 CO 0.00 0.12 0.19 -0.25 -0.01 0.00 0.00 175.02 175.07 2eli n ASP 70 N 3.72 -2.42 -3.66 3.03 9.92 -1.26 -4.99 116.55 120.89 2eli n ASP 70 Ca -0.19 0.82 -0.08 0.00 -0.53 0.00 0.00 54.79 54.81 2eli n ASP 70 Cb 0.52 -0.94 -0.09 0.00 -0.64 0.00 0.00 41.12 39.97 2eli n ASP 70 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 2eli s HIS 71 N -1.65 -0.83 -0.11 1.24 -3.43 -1.26 -5.16 115.29 104.10 2eli s HIS 71 Ca 0.60 1.58 -0.07 0.00 -0.80 0.00 0.00 55.06 56.37 2eli s HIS 71 Cb -0.62 0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 30.84 2eli s HIS 71 CO 0.62 -0.48 0.15 -0.08 -2.00 0.00 0.00 174.74 172.94 2eli s THR 72 N 2.43 5.49 -0.06 -5.38 -1.32 -1.26 -5.10 115.64 110.44 2eli s THR 72 Ca -0.04 0.21 0.05 0.00 -1.21 0.00 0.00 61.69 60.71 2eli s THR 72 Cb -0.11 -3.41 -0.00 0.00 -1.51 0.00 0.00 72.50 67.46 2eli s THR 72 CO -0.14 0.61 -0.21 -1.83 -2.21 0.00 0.00 174.62 170.85 2eli s GLU 73 N -1.06 2.25 -0.61 7.08 -1.05 -1.26 -5.09 118.70 118.96 2eli s GLU 73 Ca 0.16 -0.74 -0.16 0.00 -0.15 0.00 0.00 54.97 54.07 2eli s GLU 73 Cb -0.12 -1.88 0.15 0.00 -0.44 0.00 0.00 34.13 31.84 2eli s GLU 73 CO 0.05 0.27 0.58 0.15 0.95 0.00 0.00 175.26 177.25 2eli s LYS 74 N 0.06 3.13 0.42 -4.83 1.02 -1.26 -5.05 119.74 113.24 2eli s LYS 74 Ca -0.07 -1.85 -0.24 0.00 0.02 0.00 0.00 55.97 53.83 2eli s LYS 74 Cb -0.14 -4.33 -0.11 0.00 -0.52 0.00 0.00 37.83 32.74 2eli s LYS 74 CO 0.04 -1.34 0.96 0.54 -0.92 0.00 0.00 175.35 174.63 2eli n ARG 75 N 5.05 1.24 -2.78 1.68 1.74 -1.26 -5.00 116.66 117.33 2eli n ARG 75 Ca -0.07 0.45 -0.11 0.00 -0.77 0.00 0.00 57.85 57.34 2eli n ARG 75 Cb 0.42 -1.98 -0.02 0.00 -1.02 0.00 0.00 32.46 29.86 2eli n ARG 75 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2eli n GLY 76 N 1.25 3.63 2.96 -0.13 0.00 -1.26 -5.16 105.19 106.47 2eli n GLY 76 Ca 0.10 -2.25 -0.10 0.00 0.00 0.00 0.00 46.02 43.77 2eli n GLY 76 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2eli s ARG 77 N -2.73 0.24 -0.01 1.61 3.52 -1.26 -5.16 118.95 115.16 2eli s ARG 77 Ca 0.04 -0.47 0.02 0.00 -0.13 0.00 0.00 55.73 55.18 2eli s ARG 77 Cb -0.00 0.08 0.00 0.00 -1.56 0.00 0.00 34.95 33.47 2eli s ARG 77 CO 0.02 -0.04 -0.06 0.42 -0.81 0.00 0.00 175.30 174.83 2eli s ILE 78 N -1.13 0.53 -0.22 4.11 1.01 -1.26 -5.12 121.20 119.12 2eli s ILE 78 Ca -0.12 -0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.02 2eli s ILE 78 Cb -0.08 -0.47 -0.01 0.00 0.01 0.00 0.00 42.46 41.92 2eli s ILE 78 CO -0.01 0.17 0.87 -0.31 0.00 0.00 0.00 174.94 175.66 2eli s TYR 79 N 0.08 3.35 0.60 3.97 1.51 -1.26 -5.02 117.35 120.59 2eli s TYR 79 Ca -0.01 1.23 -0.18 0.00 -1.01 0.00 0.00 57.07 57.11 2eli s TYR 79 Cb -0.05 -3.08 -0.05 0.00 -0.11 0.00 0.00 41.96 38.67 2eli s TYR 79 CO -0.00 -0.37 0.85 -0.11 -1.11 0.00 0.00 175.55 174.81 2eli n LEU 80 N 5.82 3.02 -4.66 -1.29 7.94 -1.26 -4.91 117.00 121.67 2eli n LEU 80 Ca 0.06 0.78 -0.43 0.00 -1.11 0.00 0.00 56.01 55.31 2eli n LEU 80 Cb 0.48 -1.34 -0.02 0.00 0.53 0.00 0.00 43.42 43.07 2eli n LEU 80 CO 0.48 -2.18 0.92 -0.75 -1.11 0.00 0.00 177.39 174.76 2eli s LYS 81 N -2.63 4.23 -0.29 1.96 2.20 -1.26 -4.99 119.74 118.96 2eli s LYS 81 Ca 0.75 1.31 0.01 0.00 -0.36 0.00 0.00 55.97 57.68 2eli s LYS 81 Cb -0.42 -3.65 0.18 0.00 -1.51 0.00 0.00 37.83 32.43 2eli s LYS 81 CO 0.48 -0.67 0.55 0.00 -0.36 0.00 0.00 175.35 175.35 2eli s ALA 82 N 3.27 -2.03 -0.43 3.13 0.00 -1.26 -5.00 121.76 119.44 2eli s ALA 82 Ca 0.44 1.37 0.05 0.00 0.00 0.00 0.00 51.96 53.83 2eli s ALA 82 Cb -0.15 -2.18 -0.01 0.00 0.00 0.00 0.00 23.12 20.79 2eli s ALA 82 CO 0.07 -1.48 0.41 -0.85 0.00 0.00 0.00 175.76 173.92 2eli n GLU 83 N 5.41 2.94 -3.61 0.00 -0.00 -1.26 -5.03 120.64 119.09 2eli n GLU 83 Ca 0.00 -0.36 -0.11 0.00 -0.00 0.00 0.00 57.16 56.69 2eli n GLU 83 Cb 0.51 -0.90 -0.06 0.00 -0.00 0.00 0.00 31.44 31.00 2eli n GLU 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2eli s VAL 84 N -1.03 0.00 0.00 3.84 0.11 -1.26 -5.37 120.40 116.69 2eli s VAL 84 Ca 0.04 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.09 2eli s VAL 84 Cb 0.04 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.89 2eli s VAL 84 CO 0.14 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.91