#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 -0.59 -0.00 1.61 1.04 -1.26 -5.08 113.70 109.42 2eli s SER 2 Ca 0.00 0.94 -0.24 0.00 0.48 0.00 0.00 55.95 57.13 2eli s SER 2 Cb 0.00 0.92 -0.14 0.00 0.10 0.00 0.00 66.02 66.90 2eli s SER 2 CO 0.00 -0.37 1.00 0.28 0.98 0.00 0.00 173.24 175.14 2eli h SER 3 N 4.32 -0.66 0.00 7.02 0.02 -2.12 -3.50 113.55 118.64 2eli h SER 3 Ca -0.28 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2eli h SER 3 Cb 1.16 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.87 2eli h SER 3 CO 0.24 -0.27 0.00 0.61 -1.14 0.00 0.00 176.83 176.27 2eli n GLY 4 N -0.34 0.89 0.56 -3.77 0.00 -1.26 -4.85 105.19 96.43 2eli n GLY 4 Ca -0.10 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.09 2eli n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eli n SER 5 N 0.00 1.07 -3.41 1.61 7.64 -1.26 -5.03 113.62 114.24 2eli n SER 5 Ca 0.00 0.14 -0.21 0.00 1.01 0.00 0.00 58.87 59.80 2eli n SER 5 Cb 0.00 -0.36 0.08 0.00 -1.01 0.00 0.00 64.21 62.92 2eli n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2eli n SER 6 N -3.51 -5.41 -0.30 6.43 7.64 -1.26 -5.01 113.62 112.20 2eli n SER 6 Ca -0.25 -0.53 0.00 0.00 1.01 0.00 0.00 58.87 59.11 2eli n SER 6 Cb 0.68 -4.81 0.00 0.00 -1.01 0.00 0.00 64.21 59.07 2eli n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eli n GLY 7 N -1.79 1.32 0.00 0.23 0.00 -1.26 -5.01 105.19 98.69 2eli n GLY 7 Ca -0.04 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.44 2eli n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eli n GLY 8 N 5.00 1.34 3.77 -0.02 0.00 -1.26 -5.11 105.19 108.91 2eli n GLY 8 Ca 0.00 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 2eli n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eli s PRO 9 N 0.00 3.03 -0.23 1.61 0.04 -1.26 -5.04 135.00 133.14 2eli s PRO 9 Ca 0.00 1.48 0.01 0.00 0.04 0.00 0.00 61.00 62.53 2eli s PRO 9 Cb 0.00 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2eli s PRO 9 CO 0.00 -1.08 -0.09 -0.51 0.04 0.00 0.00 177.00 175.36 2eli s ASP 10 N -2.25 3.87 -0.79 6.66 1.01 -1.26 -5.07 116.67 118.84 2eli s ASP 10 Ca 0.69 -1.14 -0.06 0.00 0.71 0.00 0.00 52.55 52.75 2eli s ASP 10 Cb -0.22 -1.32 0.20 0.00 1.01 0.00 0.00 42.92 42.60 2eli s ASP 10 CO 0.36 -0.19 0.67 0.42 0.21 0.00 0.00 175.17 176.64 2eli s THR 11 N 1.30 4.60 -0.12 -1.27 -4.23 -1.26 -4.82 115.64 109.85 2eli s THR 11 Ca -0.05 -3.10 0.20 0.00 -1.18 0.00 0.00 61.69 57.56 2eli s THR 11 Cb -0.18 -3.88 -0.24 0.00 1.34 0.00 0.00 72.50 69.54 2eli s THR 11 CO -0.07 -1.00 0.51 -0.90 -0.54 0.00 0.00 174.62 172.63 2eli n ASP 12 N 3.25 0.28 -3.23 3.99 5.75 -1.26 -4.61 116.55 120.73 2eli n ASP 12 Ca 0.14 0.12 -0.24 0.00 -0.01 0.00 0.00 54.79 54.80 2eli n ASP 12 Cb 0.40 1.18 -0.06 0.00 -1.03 0.00 0.00 41.12 41.61 2eli n ASP 12 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2eli n ASP 13 N -2.56 1.29 0.03 -1.12 8.00 -1.26 -4.92 116.55 116.00 2eli n ASP 13 Ca -0.12 -2.96 0.08 0.00 0.71 0.00 0.00 54.79 52.50 2eli n ASP 13 Cb 0.77 -0.64 0.34 0.00 -0.02 0.00 0.00 41.12 41.58 2eli n ASP 13 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2eli n PRO 14 N 1.03 0.04 -0.29 -0.24 -0.04 -1.26 -3.01 135.00 131.22 2eli n PRO 14 Ca 0.24 0.29 -0.02 0.00 -0.04 0.00 0.00 63.50 63.97 2eli n PRO 14 Cb 0.52 -1.57 0.15 0.00 -0.04 0.00 0.00 33.50 32.56 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 1.16 0.00 0.54 3.08 -1.95 -2.81 114.38 114.40 2eli h ARG 15 Ca 0.00 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 2eli h ARG 15 Cb 0.27 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2eli h ARG 15 CO 0.00 0.81 -1.64 -1.13 -1.07 0.00 0.00 179.97 176.94 2eli n SER 16 N -4.37 0.45 -4.50 7.04 3.41 -1.16 -4.89 113.62 109.60 2eli n SER 16 Ca 0.09 0.19 -0.38 0.00 -0.26 0.00 0.00 58.87 58.51 2eli n SER 16 Cb 0.06 0.96 0.04 0.00 -0.26 0.00 0.00 64.21 65.01 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 -2.61 0.63 -3.30 4.33 4.76 -1.06 -1.25 118.16 119.66 2eli n LYS 17 Ca -0.09 0.24 -0.38 0.00 -2.87 0.00 0.00 58.31 55.21 2eli n LYS 17 Cb 0.72 -1.79 -0.06 0.00 -1.84 0.00 0.00 35.03 32.07 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 -1.64 3.61 -0.32 2.13 3.76 -1.26 -4.77 115.29 116.79 2eli s HIS 18 Ca 0.69 1.02 0.01 0.00 -0.15 0.00 0.00 55.06 56.63 2eli s HIS 18 Cb -0.46 -2.54 0.35 0.00 1.11 0.00 0.00 32.58 31.04 2eli s HIS 18 CO 0.53 0.30 1.74 1.63 -0.85 0.00 0.00 174.74 178.09 2eli n LYS 19 N 3.07 1.85 -1.64 1.40 4.01 -1.26 -4.96 118.16 120.63 2eli n LYS 19 Ca -0.08 -1.86 -0.53 0.00 -0.51 0.00 0.00 58.31 55.33 2eli n LYS 19 Cb 0.51 -1.73 -0.06 0.00 -0.51 0.00 0.00 35.03 33.24 2eli n LYS 19 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2eli n PHE 20 N -0.26 2.05 -4.66 2.13 3.72 -1.25 -3.59 117.46 115.59 2eli n PHE 20 Ca 0.36 0.29 -0.33 0.00 -0.05 0.00 0.00 57.45 57.72 2eli n PHE 20 Cb 0.96 -2.55 -0.16 0.00 -0.94 0.00 0.00 39.48 36.79 2eli n PHE 20 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2eli s LYS 21 N 4.39 3.18 -0.21 -1.08 2.36 0.46 -4.84 119.74 123.98 2eli s LYS 21 Ca 0.99 -0.78 -0.28 0.00 -2.55 0.00 0.00 55.97 53.35 2eli s LYS 21 Cb -0.89 -2.55 -0.05 0.00 -1.05 0.00 0.00 37.83 33.29 2eli s LYS 21 CO 0.57 0.05 2.18 -1.50 1.55 0.00 0.00 175.35 178.20 2eli s ILE 22 N 0.72 3.04 0.08 5.43 1.10 -1.26 -3.10 121.20 127.21 2eli s ILE 22 Ca -0.08 0.04 -0.06 0.00 -0.51 0.00 0.00 60.65 60.05 2eli s ILE 22 Cb -0.16 -3.05 -0.02 0.00 0.15 0.00 0.00 42.46 39.38 2eli s ILE 22 CO 0.01 -0.03 0.11 -1.00 -2.11 0.00 0.00 174.94 171.92 2eli s HIS 23 N 8.02 0.30 0.46 3.50 3.76 -1.24 -4.99 115.29 125.11 2eli s HIS 23 Ca 0.99 -0.77 -0.05 0.00 -0.15 0.00 0.00 55.06 55.07 2eli s HIS 23 Cb -0.33 -0.18 -0.04 0.00 1.11 0.00 0.00 32.58 33.14 2eli s HIS 23 CO 0.35 -0.49 0.76 0.95 -0.85 0.00 0.00 174.74 175.46 2eli s THR 24 N -3.89 4.91 -0.13 1.30 -4.23 -1.26 -4.26 115.64 108.08 2eli s THR 24 Ca 0.07 0.19 0.03 0.00 -1.18 0.00 0.00 61.69 60.80 2eli s THR 24 Cb 0.06 -3.85 0.01 0.00 1.34 0.00 0.00 72.50 70.05 2eli s THR 24 CO -0.10 -0.79 -0.22 -0.31 -0.54 0.00 0.00 174.62 172.66 2eli s TYR 25 N -2.67 2.65 0.57 3.99 1.51 -1.26 -5.00 117.35 117.15 2eli s TYR 25 Ca 0.47 -1.21 0.40 0.00 -1.01 0.00 0.00 57.07 55.72 2eli s TYR 25 Cb -0.10 -1.79 2.16 0.00 -0.11 0.00 0.00 41.96 42.11 2eli s TYR 25 CO 0.43 -0.53 2.29 0.78 -1.11 0.00 0.00 175.55 177.41 2eli h GLY 26 N 7.12 0.00 -2.92 0.71 0.00 -1.98 -3.43 103.07 102.56 2eli h GLY 26 Ca -0.28 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.84 2eli h GLY 26 CO 0.53 0.00 -0.67 -0.56 0.00 0.00 0.00 176.54 175.84 2eli s SER 27 N -5.43 0.78 -0.57 0.19 0.01 -1.26 -5.10 113.70 102.31 2eli s SER 27 Ca -0.04 -1.12 -0.27 0.00 1.31 0.00 0.00 55.95 55.83 2eli s SER 27 Cb 0.13 0.18 -0.02 0.00 0.21 0.00 0.00 66.02 66.52 2eli s SER 27 CO 0.46 -0.61 1.84 -2.16 0.41 0.00 0.00 173.24 173.19 2eli s PRO 28 N -3.94 2.73 0.13 12.44 0.04 -1.26 -4.98 135.00 140.15 2eli s PRO 28 Ca 0.18 0.71 -0.05 0.00 0.04 0.00 0.00 61.00 61.89 2eli s PRO 28 Cb 0.07 -4.36 -0.05 0.00 0.04 0.00 0.00 34.50 30.20 2eli s PRO 28 CO -0.01 -2.61 0.36 0.99 0.04 0.00 0.00 177.00 175.77 2eli s THR 29 N 8.76 5.19 -0.20 1.26 2.01 -1.26 -4.89 115.64 126.50 2eli s THR 29 Ca 0.69 0.01 -0.10 0.00 0.31 0.00 0.00 61.69 62.60 2eli s THR 29 Cb -0.14 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.70 2eli s THR 29 CO 0.22 0.07 0.12 -0.36 -0.69 0.00 0.00 174.62 173.99 2eli s PHE 30 N -1.62 3.37 0.93 4.92 0.08 -1.26 -0.83 117.98 123.58 2eli s PHE 30 Ca 0.40 0.27 -0.13 0.00 0.12 0.00 0.00 56.93 57.58 2eli s PHE 30 Cb -0.12 -2.16 0.01 0.00 -0.57 0.00 0.00 43.02 40.18 2eli s PHE 30 CO 0.24 0.24 0.29 0.00 -0.10 0.00 0.00 175.22 175.89 2eli n ASP 32 N -0.71 1.47 0.14 0.00 -0.08 0.18 -3.54 116.55 114.01 2eli n ASP 32 Ca 0.06 -0.03 -0.06 0.00 -1.51 0.00 0.00 54.79 53.26 2eli n ASP 32 Cb 0.53 0.59 -0.03 0.00 2.34 0.00 0.00 41.12 44.56 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 -0.35 0.06 -0.67 2.76 -1.93 -3.39 115.15 111.63 2eli h HIS 33 Ca -0.43 -0.01 -0.26 0.00 -2.20 0.00 0.00 60.37 57.47 2eli h HIS 33 Cb 1.89 0.12 -0.02 0.00 1.55 0.00 0.00 27.41 30.95 2eli h HIS 33 CO 0.01 -0.22 -1.41 0.00 -1.30 0.00 0.00 177.93 175.01 2eli n GLY 35 N 1.66 0.81 2.92 0.00 0.00 -1.23 -5.05 105.19 104.30 2eli n GLY 35 Ca -0.29 -0.57 -0.18 0.00 0.00 0.00 0.00 46.02 44.98 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 0.73 -0.12 1.61 0.01 -1.26 -4.84 113.70 107.83 2eli s SER 36 Ca 0.00 -0.10 -0.41 0.00 1.31 0.00 0.00 55.95 56.75 2eli s SER 36 Cb 0.00 -0.23 -0.19 0.00 0.21 0.00 0.00 66.02 65.81 2eli s SER 36 CO 0.00 0.00 1.32 -0.11 0.41 0.00 0.00 173.24 174.86 2eli n LEU 37 N 3.50 0.89 -4.61 2.44 -0.00 -1.26 -2.70 117.00 115.25 2eli n LEU 37 Ca -0.20 1.15 -0.43 0.00 -0.00 0.00 0.00 56.01 56.53 2eli n LEU 37 Cb 0.54 -1.00 -0.02 0.00 -0.00 0.00 0.00 43.42 42.95 2eli n LEU 37 CO 0.24 -1.32 1.03 -0.76 -0.00 0.00 0.00 177.39 176.58 2eli s LEU 38 N 1.14 3.74 0.61 -1.96 1.43 -0.01 -4.90 118.68 118.74 2eli s LEU 38 Ca 0.93 0.72 0.02 0.00 -1.03 0.00 0.00 54.13 54.77 2eli s LEU 38 Cb -1.23 -3.55 0.08 0.00 0.03 0.00 0.00 46.19 41.52 2eli s LEU 38 CO 0.61 -1.14 0.85 -0.31 0.23 0.00 0.00 176.35 176.59 2eli s TYR 39 N 4.27 2.15 0.00 0.29 1.51 -1.26 -4.58 117.35 119.73 2eli s TYR 39 Ca 0.49 -0.25 0.00 0.00 -1.01 0.00 0.00 57.07 56.30 2eli s TYR 39 Cb -0.10 -2.74 0.00 0.00 -0.11 0.00 0.00 41.96 39.02 2eli s TYR 39 CO 0.26 -1.20 0.00 0.41 -1.11 0.00 0.00 175.55 173.91 2eli n GLY 40 N -2.48 2.33 0.10 0.71 0.00 -1.26 -4.60 105.19 100.00 2eli n GLY 40 Ca 0.12 -1.79 -0.20 0.00 0.00 0.00 0.00 46.02 44.16 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 0.00 -9.11 0.99 -0.00 -1.99 -3.44 115.31 101.76 2eli h LEU 41 Ca 0.00 -0.57 -0.66 0.00 -0.00 0.00 0.00 57.88 56.65 2eli h LEU 41 Cb 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 40.66 40.48 2eli h LEU 41 CO 0.00 1.36 -0.80 -0.51 -0.00 0.00 0.00 178.44 178.49 2eli s ILE 42 N -2.32 2.65 -1.58 1.22 2.07 -1.26 -4.70 121.20 117.27 2eli s ILE 42 Ca -0.26 -1.81 -0.11 0.00 -1.41 0.00 0.00 60.65 57.06 2eli s ILE 42 Cb 0.04 -2.26 0.09 0.00 0.13 0.00 0.00 42.46 40.46 2eli s ILE 42 CO 0.59 -0.05 0.62 1.41 -1.91 0.00 0.00 174.94 175.59 2eli n HIS 43 N 0.37 -1.70 0.31 3.50 8.25 -1.26 -4.87 115.22 119.82 2eli n HIS 43 Ca -0.13 0.77 -0.17 0.00 -0.26 0.00 0.00 57.72 57.94 2eli n HIS 43 Cb 0.55 -3.27 -0.09 0.00 1.12 0.00 0.00 29.99 28.30 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 -1.66 -0.74 0.00 -0.41 7.50 -1.81 -3.48 115.11 114.51 2eli h GLN 44 Ca -0.61 0.05 0.00 0.00 0.50 0.00 0.00 58.65 58.59 2eli h GLN 44 Cb 1.38 0.17 0.00 0.00 0.05 0.00 0.00 27.48 29.08 2eli h GLN 44 CO 0.72 -0.47 0.00 0.41 -1.50 0.00 0.00 178.83 177.99 2eli n GLY 45 N -1.29 5.02 3.10 3.46 0.00 -1.26 -4.42 105.19 109.80 2eli n GLY 45 Ca -0.12 -1.55 -0.18 0.00 0.00 0.00 0.00 46.02 44.16 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 0.08 0.80 -0.02 1.61 1.00 0.92 -3.66 119.30 120.03 2eli s MET 46 Ca 0.00 -0.65 0.05 0.00 0.00 0.00 0.00 55.69 55.10 2eli s MET 46 Cb 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 34.83 34.06 2eli s MET 46 CO 0.00 0.19 -0.18 0.21 0.00 0.00 0.00 175.02 175.24 2eli s LYS 47 N -0.99 1.52 0.79 2.03 2.20 -1.18 -2.07 119.74 122.05 2eli s LYS 47 Ca 0.00 -0.64 -0.12 0.00 -0.36 0.00 0.00 55.97 54.86 2eli s LYS 47 Cb -0.07 -1.44 0.07 0.00 -1.51 0.00 0.00 37.83 34.88 2eli s LYS 47 CO 0.01 0.36 1.11 0.00 -0.36 0.00 0.00 175.35 176.47 2eli n ASP 49 N -3.38 2.80 0.00 0.00 2.03 -1.24 -3.02 116.55 113.74 2eli n ASP 49 Ca 0.07 -1.90 0.00 0.00 0.52 0.00 0.00 54.79 53.48 2eli n ASP 49 Cb 0.57 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 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 1.21 0.00 0.29 5.18 5.66 -1.26 -4.81 114.28 120.54 2eli n THR 50 Ca 0.13 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.16 2eli n THR 50 Cb 0.54 -0.40 0.02 0.00 -1.55 0.00 0.00 70.33 68.94 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 0.16 -0.95 -4.68 0.00 8.00 -1.17 -4.82 116.55 113.09 2eli n ASP 52 Ca 0.04 -0.79 -0.39 0.00 0.71 0.00 0.00 54.79 54.35 2eli n ASP 52 Cb 0.16 -0.97 -0.06 0.00 -0.02 0.00 0.00 41.12 40.23 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 -6.11 4.25 -0.34 -1.24 1.75 -1.26 -4.64 119.30 111.71 2eli s MET 53 Ca 0.15 0.51 -0.29 0.00 -1.25 0.00 0.00 55.69 54.82 2eli s MET 53 Cb -0.09 -3.52 0.02 0.00 2.84 0.00 0.00 34.83 34.08 2eli s MET 53 CO 0.60 -0.08 1.07 -0.80 -0.65 0.00 0.00 175.02 175.17 2eli s ASN 54 N 1.00 6.87 0.03 1.11 -0.87 -1.26 -3.73 114.94 118.10 2eli s ASN 54 Ca 0.27 0.94 -0.06 0.00 -1.57 0.00 0.00 52.86 52.43 2eli s ASN 54 Cb -0.16 -2.54 -0.01 0.00 -0.02 0.00 0.00 41.25 38.53 2eli s ASN 54 CO 0.11 -0.93 0.12 0.68 -2.57 0.00 0.00 177.10 174.51 2eli s VAL 55 N 3.74 0.12 0.75 1.60 -7.23 -0.88 0.49 120.40 118.99 2eli s VAL 55 Ca 0.45 -1.00 -0.12 0.00 -1.81 0.00 0.00 61.98 59.50 2eli s VAL 55 Cb -0.11 -0.83 0.05 0.00 0.56 0.00 0.00 36.38 36.05 2eli s VAL 55 CO 0.18 -0.55 1.12 -1.00 -0.31 0.00 0.00 175.10 174.54 2eli s HIS 56 N -2.42 2.40 0.46 2.82 3.76 -1.26 -0.05 115.29 121.00 2eli s HIS 56 Ca -0.06 1.59 0.12 0.00 -0.15 0.00 0.00 55.06 56.55 2eli s HIS 56 Cb -0.02 -3.18 1.05 0.00 1.11 0.00 0.00 32.58 31.54 2eli s HIS 56 CO -0.04 -1.99 2.09 -0.22 -0.85 0.00 0.00 174.74 173.73 2eli h LYS 57 N -0.74 0.25 -0.00 1.40 3.64 -1.88 -0.64 116.57 118.61 2eli h LYS 57 Ca -0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2eli h LYS 57 Cb 1.25 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2eli h LYS 57 CO 0.51 0.19 -0.57 0.00 -2.27 0.00 0.00 179.45 177.30 2eli n GLN 58 N -4.49 0.17 0.13 1.90 -0.00 -1.26 -3.89 117.38 109.95 2eli n GLN 58 Ca -0.00 -0.12 0.08 0.00 -0.00 0.00 0.00 57.00 56.97 2eli n GLN 58 Cb 0.09 -1.50 0.04 0.00 -0.00 0.00 0.00 30.24 28.87 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 1.22 0.00 0.00 -1.51 -1.54 -1.51 116.25 112.91 2eli h VAL 60 Ca -0.03 -1.01 -0.02 0.00 -1.23 0.00 0.00 66.70 64.41 2eli h VAL 60 Cb 1.15 1.45 -0.00 0.00 -2.13 0.00 0.00 31.29 31.76 2eli h VAL 60 CO 0.02 0.30 -0.09 -0.29 -1.23 0.00 0.00 177.57 176.28 2eli h ILE 61 N 0.11 0.28 0.03 7.19 2.10 -1.78 -2.92 117.51 122.51 2eli h ILE 61 Ca 0.02 -0.60 -0.34 0.00 1.08 0.00 0.00 64.86 65.02 2eli h ILE 61 Cb 0.52 1.46 -0.05 0.00 -1.09 0.00 0.00 36.82 37.66 2eli h ILE 61 CO 0.04 0.08 -2.03 0.59 -1.08 0.00 0.00 178.15 175.75 2eli n ASN 62 N -3.31 1.03 -4.73 2.19 3.02 -0.80 -4.92 115.26 107.75 2eli n ASN 62 Ca -0.01 0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 54.33 2eli n ASN 62 Cb 0.29 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.43 2eli n ASN 62 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2eli s VAL 63 N -2.55 2.36 0.57 2.41 1.01 -0.63 -4.97 120.40 118.59 2eli s VAL 63 Ca -0.13 0.28 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 2eli s VAL 63 Cb 0.07 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 2eli s VAL 63 CO 0.79 0.03 1.13 -2.16 0.00 0.00 0.00 175.10 174.88 2eli s PRO 64 N 0.56 3.25 -0.07 2.72 0.04 -1.26 -4.92 135.00 135.32 2eli s PRO 64 Ca 0.68 1.57 0.03 0.00 0.04 0.00 0.00 61.00 63.32 2eli s PRO 64 Cb -0.46 -1.99 0.21 0.00 0.04 0.00 0.00 34.50 32.30 2eli s PRO 64 CO 0.37 -0.93 0.90 0.43 0.04 0.00 0.00 177.00 177.81 2eli n SER 65 N -1.52 2.41 -1.42 6.66 7.64 -1.26 -4.17 113.62 121.96 2eli n SER 65 Ca 0.11 -2.28 -0.08 0.00 1.01 0.00 0.00 58.87 57.64 2eli n SER 65 Cb 0.51 -0.56 0.08 0.00 -1.01 0.00 0.00 64.21 63.24 2eli n SER 65 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2eli n LEU 66 N 0.15 4.24 -4.04 -3.43 7.99 -1.25 -2.61 117.00 118.05 2eli n LEU 66 Ca 0.09 -2.20 -0.36 0.00 -0.01 0.00 0.00 56.01 53.52 2eli n LEU 66 Cb 0.55 -0.62 0.05 0.00 -0.11 0.00 0.00 43.42 43.28 2eli n LEU 66 CO 0.10 0.67 -1.38 0.00 -1.51 0.00 0.00 177.39 175.26 2eli n GLY 68 N 3.33 0.93 1.99 0.00 0.00 -1.26 -4.73 105.19 105.44 2eli n GLY 68 Ca -0.01 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 2eli n GLY 68 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2eli n MET 69 N -0.04 3.28 -2.69 1.61 2.81 -1.26 -4.95 117.12 115.89 2eli n MET 69 Ca 0.00 -3.93 -0.43 0.00 -1.81 0.00 0.00 57.70 51.54 2eli n MET 69 Cb 0.03 -2.24 -0.01 0.00 -0.71 0.00 0.00 33.22 30.29 2eli n MET 69 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2eli s ASP 70 N -3.20 6.74 -0.24 7.83 -1.08 -1.26 -4.90 116.67 120.56 2eli s ASP 70 Ca 0.53 -2.15 -0.03 0.00 -0.52 0.00 0.00 52.55 50.37 2eli s ASP 70 Cb 0.43 -2.52 0.08 0.00 -1.46 0.00 0.00 42.92 39.45 2eli s ASP 70 CO 0.02 -1.19 0.08 -1.00 0.52 0.00 0.00 175.17 173.60 2eli s HIS 71 N 3.79 0.82 -0.10 -5.34 3.76 -1.26 -5.12 115.29 111.84 2eli s HIS 71 Ca 0.46 -0.93 0.02 0.00 -0.15 0.00 0.00 55.06 54.47 2eli s HIS 71 Cb 0.00 -1.06 0.01 0.00 1.11 0.00 0.00 32.58 32.64 2eli s HIS 71 CO -0.02 -0.70 -0.16 0.99 -0.85 0.00 0.00 174.74 174.01 2eli s THR 72 N 1.93 1.49 -0.66 1.30 2.01 -1.26 -5.03 115.64 115.42 2eli s THR 72 Ca 0.04 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.36 2eli s THR 72 Cb -0.17 -1.35 0.27 0.00 0.01 0.00 0.00 72.50 71.27 2eli s THR 72 CO -0.19 0.44 2.24 1.21 -0.69 0.00 0.00 174.62 177.63 2eli n GLU 73 N 4.01 2.56 -1.75 4.92 2.13 -1.26 -4.66 120.64 126.59 2eli n GLU 73 Ca -0.20 -2.98 -0.37 0.00 0.66 0.00 0.00 57.16 54.27 2eli n GLU 73 Cb 0.52 -2.18 0.05 0.00 0.27 0.00 0.00 31.44 30.10 2eli n GLU 73 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2eli n LYS 74 N -0.13 2.79 -3.41 5.31 4.81 -1.26 -4.75 118.16 121.52 2eli n LYS 74 Ca 0.52 -3.52 -0.27 0.00 -0.87 0.00 0.00 58.31 54.18 2eli n LYS 74 Cb 0.43 -2.28 -0.08 0.00 0.02 0.00 0.00 35.03 33.12 2eli n LYS 74 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2eli n ARG 75 N -0.67 2.24 0.00 1.64 0.00 -1.26 -4.99 116.66 113.62 2eli n ARG 75 Ca 0.56 -4.46 0.00 0.00 -0.00 0.00 0.00 57.85 53.95 2eli n ARG 75 Cb 0.42 -2.12 0.00 0.00 -0.00 0.00 0.00 32.46 30.77 2eli n ARG 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2eli n GLY 76 N 0.99 3.58 3.61 2.89 0.00 -1.26 -5.17 105.19 109.83 2eli n GLY 76 Ca 0.28 -1.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 2eli n GLY 76 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2eli s ARG 77 N -4.93 0.85 -0.02 1.61 1.04 -1.26 -5.16 118.95 111.07 2eli s ARG 77 Ca 0.00 0.83 0.02 0.00 -1.04 0.00 0.00 55.73 55.54 2eli s ARG 77 Cb 0.00 0.41 0.00 0.00 -2.04 0.00 0.00 34.95 33.32 2eli s ARG 77 CO 0.00 -0.14 -0.08 0.42 -0.04 0.00 0.00 175.30 175.46 2eli s ILE 78 N 0.08 0.69 0.04 4.99 1.09 -1.26 -5.15 121.20 121.68 2eli s ILE 78 Ca -0.02 -0.31 0.00 0.00 -1.10 0.00 0.00 60.65 59.22 2eli s ILE 78 Cb -0.04 -0.63 -0.03 0.00 -1.06 0.00 0.00 42.46 40.70 2eli s ILE 78 CO 0.02 0.22 -0.04 -0.72 -0.10 0.00 0.00 174.94 174.32 2eli s TYR 79 N 0.23 0.43 0.10 3.97 1.13 -1.26 -5.16 117.35 116.80 2eli s TYR 79 Ca -0.03 -0.72 -0.00 0.00 -1.41 0.00 0.00 57.07 54.90 2eli s TYR 79 Cb -0.08 -0.30 -0.04 0.00 -1.10 0.00 0.00 41.96 40.44 2eli s TYR 79 CO 0.00 -0.24 0.26 -0.51 -2.51 0.00 0.00 175.55 172.56 2eli s LEU 80 N -2.04 4.33 0.00 -3.49 2.01 -1.26 -5.05 118.68 113.18 2eli s LEU 80 Ca -0.06 0.31 0.00 0.00 0.01 0.00 0.00 54.13 54.39 2eli s LEU 80 Cb -0.03 -3.02 0.00 0.00 0.01 0.00 0.00 46.19 43.15 2eli s LEU 80 CO -0.04 0.11 0.00 0.29 1.01 0.00 0.00 176.35 177.72 2eli n LYS 81 N 0.01 0.00 -0.96 1.70 4.76 -1.26 -5.00 118.16 117.41 2eli n LYS 81 Ca -0.05 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.05 2eli n LYS 81 Cb 0.52 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.61 2eli n LYS 81 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2eli n ALA 82 N -1.67 0.18 -2.57 7.82 0.00 -1.26 -4.77 120.51 118.24 2eli n ALA 82 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 53.44 53.28 2eli n ALA 82 Cb 0.00 -1.52 0.03 0.00 0.00 0.00 0.00 19.45 17.97 2eli n ALA 82 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2eli n GLU 83 N 5.59 2.19 -0.00 0.00 0.28 -1.26 -4.76 120.64 122.68 2eli n GLU 83 Ca 0.42 -3.71 0.01 0.00 -0.16 0.00 0.00 57.16 53.72 2eli n GLU 83 Cb -0.00 -1.74 -0.02 0.00 1.43 0.00 0.00 31.44 31.12 2eli n GLU 83 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 2eli n VAL 84 N -0.46 0.00 0.00 3.84 3.14 -1.26 -5.33 118.33 118.26 2eli n VAL 84 Ca 0.20 -0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.36 2eli n VAL 84 Cb 0.82 0.68 0.00 0.00 -1.06 0.00 0.00 33.84 34.28 2eli n VAL 84 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37