#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eli n SER 2 N 0.00 -4.78 -3.83 1.61 2.88 -1.26 -4.99 113.62 103.26 2eli n SER 2 Ca 0.00 -0.68 -0.12 0.00 -1.33 0.00 0.00 58.87 56.73 2eli n SER 2 Cb 0.00 -4.42 -0.13 0.00 -0.75 0.00 0.00 64.21 58.91 2eli n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2eli s SER 3 N -3.51 -0.13 0.00 -3.46 0.01 -1.26 -5.00 113.70 100.35 2eli s SER 3 Ca 0.51 0.26 0.00 0.00 1.31 0.00 0.00 55.95 58.03 2eli s SER 3 Cb -0.24 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.26 2eli s SER 3 CO 0.78 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.99 2eli n GLY 4 N 2.98 0.59 2.95 3.44 0.00 -1.26 -5.12 105.19 108.77 2eli n GLY 4 Ca -0.13 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 2eli n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eli s SER 5 N -0.73 4.46 -0.13 1.61 1.04 -1.26 -5.08 113.70 113.60 2eli s SER 5 Ca 0.00 -1.85 -0.33 0.00 0.48 0.00 0.00 55.95 54.25 2eli s SER 5 Cb 0.00 -1.39 0.13 0.00 0.10 0.00 0.00 66.02 64.86 2eli s SER 5 CO 0.00 -0.35 1.10 -0.94 0.98 0.00 0.00 173.24 174.03 2eli s SER 6 N 1.14 -0.22 0.00 7.02 1.04 -1.26 -5.18 113.70 116.25 2eli s SER 6 Ca 0.07 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.52 2eli s SER 6 Cb -0.19 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.16 2eli s SER 6 CO -0.11 -0.35 0.00 0.61 0.98 0.00 0.00 173.24 174.36 2eli n GLY 7 N -0.07 4.48 0.00 7.32 0.00 -1.26 -5.13 105.19 110.53 2eli n GLY 7 Ca -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.14 -1.41 3.77 -0.02 0.00 -1.26 -5.16 105.19 99.97 2eli n GLY 8 Ca 0.00 0.44 -0.38 0.00 0.00 0.00 0.00 46.02 46.07 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 3.98 -0.17 1.61 0.04 -1.26 -5.05 135.00 134.15 2eli s PRO 9 Ca 0.00 1.86 -0.20 0.00 0.04 0.00 0.00 61.00 62.71 2eli s PRO 9 Cb 0.00 -2.63 0.05 0.00 0.04 0.00 0.00 34.50 31.97 2eli s PRO 9 CO 0.00 -0.39 0.53 -0.51 0.04 0.00 0.00 177.00 176.67 2eli s ASP 10 N -1.14 -0.54 0.00 6.66 1.01 -1.26 -5.17 116.67 116.24 2eli s ASP 10 Ca 0.58 0.95 -0.29 0.00 0.71 0.00 0.00 52.55 54.50 2eli s ASP 10 Cb -0.31 0.96 0.10 0.00 1.01 0.00 0.00 42.92 44.68 2eli s ASP 10 CO 0.39 -0.26 0.92 0.28 0.21 0.00 0.00 175.17 176.71 2eli s THR 11 N -0.04 0.00 1.41 -1.27 -1.32 -1.26 -5.17 115.64 107.98 2eli s THR 11 Ca -0.03 -0.08 -0.22 0.00 -1.21 0.00 0.00 61.69 60.15 2eli s THR 11 Cb -0.03 -1.13 0.36 0.00 -1.51 0.00 0.00 72.50 70.19 2eli s THR 11 CO 0.02 0.00 0.94 1.51 -2.21 0.00 0.00 174.62 174.88 2eli s ASP 12 N -2.52 -0.97 -0.62 8.08 1.47 -1.26 -4.98 116.67 115.87 2eli s ASP 12 Ca 0.06 0.87 -0.04 0.00 1.18 0.00 0.00 52.55 54.62 2eli s ASP 12 Cb -0.01 -1.24 0.16 0.00 -0.34 0.00 0.00 42.92 41.49 2eli s ASP 12 CO -0.07 -5.31 0.45 -1.81 0.68 0.00 0.00 175.17 169.11 2eli s ASP 13 N -3.14 5.42 0.39 2.11 1.01 -1.26 -4.91 116.67 116.29 2eli s ASP 13 Ca 0.69 -2.73 0.28 0.00 0.71 0.00 0.00 52.55 51.50 2eli s ASP 13 Cb -0.14 -1.90 1.17 0.00 1.01 0.00 0.00 42.92 43.07 2eli s ASP 13 CO 0.58 -0.42 1.84 1.55 0.21 0.00 0.00 175.17 178.93 2eli h PRO 14 N 7.26 0.00 -0.09 8.23 0.13 -1.97 -3.07 132.00 142.48 2eli h PRO 14 Ca -0.02 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 2eli h PRO 14 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2eli h PRO 14 CO 0.72 0.00 -0.33 0.00 -0.23 0.00 0.00 178.00 178.17 2eli h ARG 15 N 0.00 0.38 -0.20 0.86 2.47 -2.01 -3.19 114.38 112.69 2eli h ARG 15 Ca 0.00 -0.29 -0.03 0.00 -1.26 0.00 0.00 59.98 58.41 2eli h ARG 15 Cb 0.41 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.78 2eli h ARG 15 CO 0.00 0.92 0.01 0.66 0.56 0.00 0.00 179.97 182.12 2eli h SER 16 N -0.09 0.26 -2.39 7.04 4.64 -1.83 -3.45 113.55 117.74 2eli h SER 16 Ca -0.02 -0.03 -0.59 0.00 -0.47 0.00 0.00 61.79 60.68 2eli h SER 16 Cb 0.96 -0.07 0.18 0.00 -0.31 0.00 0.00 62.40 63.17 2eli h SER 16 CO 0.07 0.31 -0.87 0.29 -0.87 0.00 0.00 176.83 175.76 2eli n LYS 17 N -4.38 0.19 -3.03 4.77 4.76 -1.21 -3.11 118.16 116.16 2eli n LYS 17 Ca 0.00 0.08 -0.39 0.00 -2.87 0.00 0.00 58.31 55.12 2eli n LYS 17 Cb 0.17 -1.28 -0.06 0.00 -1.84 0.00 0.00 35.03 32.03 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 -1.89 3.84 -0.58 2.13 3.76 -1.26 -4.84 115.29 116.44 2eli s HIS 18 Ca 0.61 1.53 -0.01 0.00 -0.15 0.00 0.00 55.06 57.03 2eli s HIS 18 Cb -0.47 -2.74 0.41 0.00 1.11 0.00 0.00 32.58 30.90 2eli s HIS 18 CO 0.62 0.45 2.02 1.63 -0.85 0.00 0.00 174.74 178.61 2eli n LYS 19 N 1.99 2.47 -1.70 1.40 5.02 -1.26 -5.00 118.16 121.08 2eli n LYS 19 Ca -0.05 -2.90 -0.43 0.00 -2.02 0.00 0.00 58.31 52.90 2eli n LYS 19 Cb 0.49 -2.14 -0.02 0.00 -0.02 0.00 0.00 35.03 33.34 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 -0.67 2.49 -4.25 2.13 3.72 -1.26 -3.52 117.46 116.10 2eli n PHE 20 Ca 0.56 0.33 -0.25 0.00 -0.05 0.00 0.00 57.45 58.04 2eli n PHE 20 Cb 0.71 -2.53 -0.17 0.00 -0.94 0.00 0.00 39.48 36.55 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 -0.35 1.54 -0.06 -1.08 -0.14 -0.47 -4.86 119.74 114.34 2eli s LYS 21 Ca 0.67 -0.31 -0.30 0.00 -1.36 0.00 0.00 55.97 54.67 2eli s LYS 21 Cb -0.58 -1.43 -0.08 0.00 -1.68 0.00 0.00 37.83 34.06 2eli s LYS 21 CO 0.48 -0.11 2.06 1.51 -0.76 0.00 0.00 175.35 178.53 2eli n ILE 22 N 4.33 0.62 -3.98 2.17 0.13 -1.26 -2.42 119.36 118.95 2eli n ILE 22 Ca -0.18 -0.25 -0.09 0.00 -1.10 0.00 0.00 62.75 61.13 2eli n ILE 22 Cb 0.51 -2.37 -0.08 0.00 -0.84 0.00 0.00 39.64 36.85 2eli n ILE 22 CO 0.00 0.00 0.00 -2.28 2.80 0.00 0.00 176.55 177.07 2eli s HIS 23 N 5.77 0.42 0.31 9.51 2.46 -1.16 -4.97 115.29 127.63 2eli s HIS 23 Ca 0.93 -0.83 0.01 0.00 0.47 0.00 0.00 55.06 55.64 2eli s HIS 23 Cb -0.42 -0.18 -0.03 0.00 -0.13 0.00 0.00 32.58 31.82 2eli s HIS 23 CO 0.40 -0.59 0.50 0.95 -2.47 0.00 0.00 174.74 173.54 2eli s THR 24 N -3.94 5.14 0.21 0.89 -4.23 -1.26 -3.95 115.64 108.49 2eli s THR 24 Ca 0.14 -0.51 0.10 0.00 -1.18 0.00 0.00 61.69 60.24 2eli s THR 24 Cb 0.05 -3.84 -0.04 0.00 1.34 0.00 0.00 72.50 70.00 2eli s THR 24 CO -0.04 -0.47 -0.21 -0.31 -0.54 0.00 0.00 174.62 173.05 2eli s TYR 25 N -2.20 2.11 -0.19 3.99 1.51 -1.26 -5.04 117.35 116.27 2eli s TYR 25 Ca 0.39 -0.40 0.17 0.00 -1.01 0.00 0.00 57.07 56.22 2eli s TYR 25 Cb -0.10 -1.01 -0.25 0.00 -0.11 0.00 0.00 41.96 40.50 2eli s TYR 25 CO 0.34 0.49 0.45 0.41 -1.11 0.00 0.00 175.55 176.13 2eli n GLY 26 N 0.01 -0.74 3.43 0.71 0.00 -1.26 -5.00 105.19 102.34 2eli n GLY 26 Ca -0.11 -0.42 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.68 3.19 -0.87 1.61 1.04 -1.26 -5.07 113.70 108.67 2eli s SER 27 Ca -0.04 -1.05 -0.25 0.00 0.48 0.00 0.00 55.95 55.09 2eli s SER 27 Cb 0.11 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.95 2eli s SER 27 CO 0.71 -0.08 1.94 -2.16 0.98 0.00 0.00 173.24 174.62 2eli s PRO 28 N -3.58 2.56 0.25 4.02 0.04 -1.26 -4.96 135.00 132.07 2eli s PRO 28 Ca 0.28 -0.17 -0.01 0.00 0.04 0.00 0.00 61.00 61.13 2eli s PRO 28 Cb -0.02 -4.98 -0.04 0.00 0.04 0.00 0.00 34.50 29.50 2eli s PRO 28 CO 0.12 -3.30 0.45 0.99 0.04 0.00 0.00 177.00 175.30 2eli s THR 29 N 9.96 5.16 -0.06 1.26 2.01 -1.26 -4.94 115.64 127.76 2eli s THR 29 Ca 0.70 -0.36 0.04 0.00 0.31 0.00 0.00 61.69 62.38 2eli s THR 29 Cb -0.07 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.65 2eli s THR 29 CO 0.02 -0.29 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.11 2eli s PHE 30 N -2.01 2.60 0.97 4.92 0.40 -1.26 -0.23 117.98 123.37 2eli s PHE 30 Ca 0.39 -0.45 -0.14 0.00 -0.60 0.00 0.00 56.93 56.13 2eli s PHE 30 Cb -0.10 -1.65 -0.04 0.00 0.51 0.00 0.00 43.02 41.74 2eli s PHE 30 CO 0.31 -0.04 -0.06 0.00 0.70 0.00 0.00 175.22 176.12 2eli n ASP 32 N 0.55 0.30 0.00 0.00 2.03 0.28 -3.49 116.55 116.22 2eli n ASP 32 Ca 0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.34 2eli n ASP 32 Cb 0.54 1.07 0.00 0.00 -0.72 0.00 0.00 41.12 42.01 2eli n ASP 32 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2eli n HIS 33 N -2.66 0.00 0.11 -0.67 -0.00 -1.26 -4.51 115.22 106.24 2eli n HIS 33 Ca -0.28 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 57.72 2eli n HIS 33 Cb 1.06 -0.44 -0.14 0.00 -0.12 0.00 0.00 29.99 30.35 2eli n HIS 33 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2eli n GLY 35 N 1.56 0.49 2.85 0.00 0.00 -1.23 -5.02 105.19 103.84 2eli n GLY 35 Ca -0.11 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.53 0.01 0.10 1.61 0.01 -1.26 -4.79 113.70 106.85 2eli s SER 36 Ca 0.00 0.01 -0.29 0.00 1.31 0.00 0.00 55.95 56.98 2eli s SER 36 Cb 0.00 -0.01 -0.16 0.00 0.21 0.00 0.00 66.02 66.06 2eli s SER 36 CO 0.00 -0.02 0.66 -0.11 0.41 0.00 0.00 173.24 174.18 2eli n LEU 37 N 3.27 -0.61 -4.27 2.44 -0.00 -1.26 -2.03 117.00 114.54 2eli n LEU 37 Ca -0.15 0.99 -0.44 0.00 -0.00 0.00 0.00 56.01 56.41 2eli n LEU 37 Cb 0.58 -0.81 -0.06 0.00 -0.00 0.00 0.00 43.42 43.13 2eli n LEU 37 CO 0.25 -2.18 0.09 -0.76 -0.00 0.00 0.00 177.39 174.79 2eli s LEU 38 N 1.46 6.02 0.52 -1.96 1.43 0.68 -4.80 118.68 122.03 2eli s LEU 38 Ca 0.66 -1.90 0.06 0.00 -1.03 0.00 0.00 54.13 51.91 2eli s LEU 38 Cb -0.93 -2.13 0.04 0.00 0.03 0.00 0.00 46.19 43.20 2eli s LEU 38 CO 0.49 -0.77 0.72 -0.72 0.23 0.00 0.00 176.35 176.29 2eli s TYR 39 N 1.41 2.40 0.00 0.29 1.13 -1.26 -4.58 117.35 116.74 2eli s TYR 39 Ca 0.05 -0.35 0.00 0.00 -1.41 0.00 0.00 57.07 55.36 2eli s TYR 39 Cb -0.27 -2.51 0.00 0.00 -1.10 0.00 0.00 41.96 38.08 2eli s TYR 39 CO 0.01 -0.83 0.00 0.41 -2.51 0.00 0.00 175.55 172.62 2eli n GLY 40 N -2.17 3.91 0.11 5.49 0.00 -1.26 -4.65 105.19 106.63 2eli n GLY 40 Ca 0.10 -1.59 -0.23 0.00 0.00 0.00 0.00 46.02 44.30 2eli n GLY 40 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2eli n LEU 41 N 0.00 1.88 -4.03 0.99 -0.00 -1.26 -4.76 117.00 109.82 2eli n LEU 41 Ca 0.00 0.41 -0.25 0.00 -0.00 0.00 0.00 56.01 56.17 2eli n LEU 41 Cb 0.00 -0.94 -0.17 0.00 -0.00 0.00 0.00 43.42 42.32 2eli n LEU 41 CO 0.00 0.33 -0.47 -0.51 -0.00 0.00 0.00 177.39 176.74 2eli s ILE 42 N -2.39 1.16 -0.89 1.96 2.07 -1.26 -4.78 121.20 117.06 2eli s ILE 42 Ca -0.31 -0.49 -0.03 0.00 -1.41 0.00 0.00 60.65 58.42 2eli s ILE 42 Cb 0.08 -1.06 0.00 0.00 0.13 0.00 0.00 42.46 41.61 2eli s ILE 42 CO 0.57 0.36 0.76 1.41 -1.91 0.00 0.00 174.94 176.13 2eli n HIS 43 N 3.84 -1.76 0.32 3.50 8.25 -1.26 -4.95 115.22 123.15 2eli n HIS 43 Ca -0.23 0.69 -0.17 0.00 -0.26 0.00 0.00 57.72 57.75 2eli n HIS 43 Cb 0.52 -4.03 -0.09 0.00 1.12 0.00 0.00 29.99 27.51 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 -1.59 -0.96 0.00 -0.41 4.20 -1.83 -3.48 115.11 111.04 2eli h GLN 44 Ca -0.41 0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.37 2eli h GLN 44 Cb 1.25 0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.25 2eli h GLN 44 CO 0.37 -0.64 0.00 0.41 -0.67 0.00 0.00 178.83 178.30 2eli n GLY 45 N -1.54 5.34 3.20 3.46 0.00 -1.25 -4.51 105.19 109.88 2eli n GLY 45 Ca -0.12 -1.48 -0.21 0.00 0.00 0.00 0.00 46.02 44.21 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 0.87 0.97 -0.05 1.61 -1.94 0.58 -2.96 119.30 118.39 2eli s MET 46 Ca 0.00 -0.97 0.00 0.00 -1.71 0.00 0.00 55.69 53.02 2eli s MET 46 Cb 0.00 -1.06 0.02 0.00 2.01 0.00 0.00 34.83 35.80 2eli s MET 46 CO 0.00 0.25 -0.03 0.21 -0.01 0.00 0.00 175.02 175.44 2eli s LYS 47 N -1.61 0.75 0.95 2.03 2.20 -1.01 -1.06 119.74 121.98 2eli s LYS 47 Ca 0.02 -0.05 -0.12 0.00 -0.36 0.00 0.00 55.97 55.46 2eli s LYS 47 Cb -0.09 -0.85 0.16 0.00 -1.51 0.00 0.00 37.83 35.53 2eli s LYS 47 CO 0.03 -0.14 1.09 0.00 -0.36 0.00 0.00 175.35 175.97 2eli n ASP 49 N -4.10 0.94 -0.09 0.00 8.00 -1.23 -3.18 116.55 116.89 2eli n ASP 49 Ca 0.07 -0.54 -0.15 0.00 0.71 0.00 0.00 54.79 54.87 2eli n ASP 49 Cb 0.55 1.28 -0.07 0.00 -0.02 0.00 0.00 41.12 42.86 2eli n ASP 49 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2eli n THR 50 N -1.64 0.99 0.34 -3.53 5.66 -1.26 -4.64 114.28 110.20 2eli n THR 50 Ca 0.01 -0.33 0.07 0.00 -3.05 0.00 0.00 64.05 60.74 2eli n THR 50 Cb 0.32 -1.35 0.09 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 0.73 -0.96 -4.55 0.00 9.92 -1.19 -4.85 116.55 115.65 2eli n ASP 52 Ca 0.09 -0.85 -0.40 0.00 -0.53 0.00 0.00 54.79 53.10 2eli n ASP 52 Cb 0.37 -1.04 -0.10 0.00 -0.64 0.00 0.00 41.12 39.71 2eli n ASP 52 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 2eli s MET 53 N -6.26 3.63 -0.20 -1.24 1.75 -1.26 -4.70 119.30 111.02 2eli s MET 53 Ca 0.16 -0.43 -0.29 0.00 -1.25 0.00 0.00 55.69 53.87 2eli s MET 53 Cb -0.09 -3.77 0.00 0.00 2.84 0.00 0.00 34.83 33.81 2eli s MET 53 CO 0.65 -0.43 1.08 0.54 -0.65 0.00 0.00 175.02 176.21 2eli s ASN 54 N 1.72 7.08 0.01 1.11 4.22 -1.26 -3.26 114.94 124.57 2eli s ASN 54 Ca 0.10 1.46 -0.10 0.00 -2.14 0.00 0.00 52.86 52.18 2eli s ASN 54 Cb -0.17 -2.54 0.01 0.00 1.28 0.00 0.00 41.25 39.83 2eli s ASN 54 CO 0.11 -0.67 0.21 0.68 -2.04 0.00 0.00 177.10 175.39 2eli s VAL 55 N 3.13 0.09 0.81 3.54 -7.23 -0.22 -0.56 120.40 119.96 2eli s VAL 55 Ca 0.47 -0.71 -0.13 0.00 -1.81 0.00 0.00 61.98 59.79 2eli s VAL 55 Cb -0.17 -0.67 0.08 0.00 0.56 0.00 0.00 36.38 36.18 2eli s VAL 55 CO 0.09 -0.39 1.16 1.41 -0.31 0.00 0.00 175.10 177.06 2eli n HIS 56 N 1.09 1.14 0.24 2.82 8.25 -1.26 -0.31 115.22 127.20 2eli n HIS 56 Ca -0.21 0.40 0.07 0.00 -0.26 0.00 0.00 57.72 57.73 2eli n HIS 56 Cb 0.57 -2.09 0.59 0.00 1.12 0.00 0.00 29.99 30.18 2eli n HIS 56 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2eli h LYS 57 N -0.92 0.00 0.00 -0.41 3.64 -1.88 -1.07 116.57 115.92 2eli h LYS 57 Ca -0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2eli h LYS 57 Cb 1.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2eli h LYS 57 CO 0.45 0.11 -0.68 0.00 -2.27 0.00 0.00 179.45 177.07 2eli n GLN 58 N -4.28 0.04 0.07 1.90 10.64 -1.26 -3.94 117.38 120.56 2eli n GLN 58 Ca -0.03 0.00 0.03 0.00 -1.83 0.00 0.00 57.00 55.18 2eli n GLN 58 Cb 0.19 -1.52 -0.04 0.00 -0.86 0.00 0.00 30.24 28.02 2eli n GLN 58 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2eli h VAL 60 N 0.00 0.95 0.00 0.00 -1.51 -1.49 0.11 116.25 114.31 2eli h VAL 60 Ca -0.10 -0.16 -0.10 0.00 -1.23 0.00 0.00 66.70 65.12 2eli h VAL 60 Cb 1.42 0.44 -0.01 0.00 -2.13 0.00 0.00 31.29 31.01 2eli h VAL 60 CO 0.04 0.08 -0.46 -0.29 -1.23 0.00 0.00 177.57 175.71 2eli h ILE 61 N 0.46 1.17 0.16 7.19 2.10 -1.79 -3.15 117.51 123.65 2eli h ILE 61 Ca 0.25 -1.68 -0.32 0.00 1.08 0.00 0.00 64.86 64.19 2eli h ILE 61 Cb 0.39 1.95 0.01 0.00 -1.09 0.00 0.00 36.82 38.07 2eli h ILE 61 CO -0.07 0.45 -1.57 0.78 -1.08 0.00 0.00 178.15 176.67 2eli h ASN 62 N 0.00 0.53 -2.64 2.19 2.35 -1.18 -3.46 115.58 113.37 2eli h ASN 62 Ca -0.00 -0.71 -0.59 0.00 -0.55 0.00 0.00 56.30 54.45 2eli h ASN 62 Cb 0.91 -0.17 0.09 0.00 0.05 0.00 0.00 38.32 39.19 2eli h ASN 62 CO 0.06 1.58 0.55 0.52 -1.65 0.00 0.00 177.43 178.49 2eli n VAL 63 N -3.54 1.08 -2.15 2.81 0.31 0.19 -4.89 118.33 112.15 2eli n VAL 63 Ca -0.18 -0.27 -0.42 0.00 -0.01 0.00 0.00 64.34 63.45 2eli n VAL 63 Cb 1.06 -1.39 -0.03 0.00 -0.91 0.00 0.00 33.84 32.57 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 -0.59 4.20 0.43 5.55 0.04 -1.26 -4.85 135.00 138.52 2eli s PRO 64 Ca 0.67 2.01 0.38 0.00 0.04 0.00 0.00 61.00 64.10 2eli s PRO 64 Cb -0.67 -3.91 1.37 0.00 0.04 0.00 0.00 34.50 31.33 2eli s PRO 64 CO 0.51 -0.80 1.27 -1.13 0.04 0.00 0.00 177.00 176.89 2eli n SER 65 N 6.96 0.04 -4.26 6.66 3.41 -1.26 -4.41 113.62 120.76 2eli n SER 65 Ca 0.16 0.89 -0.42 0.00 -0.26 0.00 0.00 58.87 59.24 2eli n SER 65 Cb 0.43 -0.44 -0.14 0.00 -0.26 0.00 0.00 64.21 63.80 2eli n SER 65 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2eli n LEU 66 N -3.75 0.35 -4.02 1.04 7.99 -1.26 -4.17 117.00 113.17 2eli n LEU 66 Ca 0.36 0.25 -0.19 0.00 -0.01 0.00 0.00 56.01 56.42 2eli n LEU 66 Cb 1.56 -0.88 -0.15 0.00 -0.11 0.00 0.00 43.42 43.85 2eli n LEU 66 CO 0.31 -0.70 -0.43 0.00 -1.51 0.00 0.00 177.39 175.06 2eli n GLY 68 N 2.88 0.73 3.67 0.00 0.00 -1.26 -4.76 105.19 106.45 2eli n GLY 68 Ca -0.14 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 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 0.34 3.22 -0.65 1.61 -1.94 -1.26 -5.01 119.30 115.60 2eli s MET 69 Ca 0.00 -0.39 -0.00 0.00 -1.71 0.00 0.00 55.69 53.58 2eli s MET 69 Cb 0.00 -2.89 0.42 0.00 2.01 0.00 0.00 34.83 34.38 2eli s MET 69 CO 0.00 0.60 1.87 -3.47 -0.01 0.00 0.00 175.02 174.01 2eli n ASP 70 N 2.47 7.12 -2.31 3.03 -0.08 -1.26 -4.63 116.55 120.89 2eli n ASP 70 Ca -0.18 -3.79 -0.28 0.00 -1.51 0.00 0.00 54.79 49.02 2eli n ASP 70 Cb 0.53 -0.89 0.03 0.00 2.34 0.00 0.00 41.12 43.13 2eli n ASP 70 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2eli n HIS 71 N -0.77 3.06 -3.94 -0.67 8.25 -1.26 -5.00 115.22 114.88 2eli n HIS 71 Ca 0.57 -2.63 -0.10 0.00 -0.26 0.00 0.00 57.72 55.30 2eli n HIS 71 Cb 0.59 -0.53 -0.12 0.00 1.12 0.00 0.00 29.99 31.05 2eli n HIS 71 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2eli s THR 72 N -4.97 0.08 0.00 1.59 2.01 -1.26 -5.03 115.64 108.05 2eli s THR 72 Ca 0.52 -0.69 0.00 0.00 0.31 0.00 0.00 61.69 61.84 2eli s THR 72 Cb 0.43 -0.22 0.00 0.00 0.01 0.00 0.00 72.50 72.71 2eli s THR 72 CO -0.09 -0.38 0.00 1.21 -0.69 0.00 0.00 174.62 174.67 2eli n GLU 73 N 1.92 3.27 -3.06 4.92 4.07 -1.26 -5.05 120.64 125.45 2eli n GLU 73 Ca -0.21 0.00 -0.35 0.00 -0.06 0.00 0.00 57.16 56.54 2eli n GLU 73 Cb 0.56 -0.65 -0.06 0.00 -0.06 0.00 0.00 31.44 31.23 2eli n GLU 73 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2eli s LYS 74 N -1.19 4.22 -0.24 5.31 2.47 -1.26 -5.07 119.74 123.98 2eli s LYS 74 Ca 0.00 0.88 -0.05 0.00 -1.56 0.00 0.00 55.97 55.24 2eli s LYS 74 Cb 0.00 -2.71 0.13 0.00 -1.46 0.00 0.00 37.83 33.79 2eli s LYS 74 CO 0.00 0.29 0.46 0.50 0.16 0.00 0.00 175.35 176.76 2eli s ARG 75 N -2.33 0.40 0.80 4.03 6.06 -1.26 -5.17 118.95 121.49 2eli s ARG 75 Ca 0.48 0.90 -0.13 0.00 -2.50 0.00 0.00 55.73 54.47 2eli s ARG 75 Cb -0.15 0.14 0.20 0.00 0.06 0.00 0.00 34.95 35.20 2eli s ARG 75 CO 0.20 -0.45 0.79 0.41 -2.50 0.00 0.00 175.30 173.75 2eli n GLY 76 N 5.40 -2.35 3.33 8.12 0.00 -1.26 -5.08 105.19 113.34 2eli n GLY 76 Ca -0.06 -1.53 -0.23 0.00 0.00 0.00 0.00 46.02 44.20 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 -4.78 1.25 -0.06 1.61 3.03 -1.26 -5.15 118.95 113.60 2eli s ARG 77 Ca 0.50 -1.35 -0.00 0.00 2.03 0.00 0.00 55.73 56.91 2eli s ARG 77 Cb -0.04 -1.39 -0.03 0.00 -1.03 0.00 0.00 34.95 32.46 2eli s ARG 77 CO 0.37 0.30 -0.02 0.42 -1.13 0.00 0.00 175.30 175.23 2eli s ILE 78 N -1.77 4.06 0.50 4.99 1.09 -1.26 -5.12 121.20 123.69 2eli s ILE 78 Ca 0.13 -0.42 0.06 0.00 -1.10 0.00 0.00 60.65 59.33 2eli s ILE 78 Cb -0.07 -2.72 0.01 0.00 -1.06 0.00 0.00 42.46 38.62 2eli s ILE 78 CO 0.06 0.55 0.35 -0.31 -0.10 0.00 0.00 174.94 175.48 2eli s TYR 79 N -0.91 2.00 0.03 3.97 1.51 -1.26 -5.15 117.35 117.54 2eli s TYR 79 Ca 0.14 -0.74 -0.08 0.00 -1.01 0.00 0.00 57.07 55.39 2eli s TYR 79 Cb -0.11 -1.96 -0.00 0.00 -0.11 0.00 0.00 41.96 39.78 2eli s TYR 79 CO 0.04 -0.27 0.15 -0.51 -1.11 0.00 0.00 175.55 173.84 2eli s LEU 80 N -4.17 1.57 0.38 -1.29 1.43 -1.26 -5.16 118.68 110.16 2eli s LEU 80 Ca 0.37 -0.38 0.08 0.00 -1.03 0.00 0.00 54.13 53.17 2eli s LEU 80 Cb -0.01 0.76 -0.05 0.00 0.03 0.00 0.00 46.19 46.91 2eli s LEU 80 CO 0.22 -0.49 0.10 -0.54 0.23 0.00 0.00 176.35 175.88 2eli s LYS 81 N -2.24 2.18 0.42 1.70 3.01 -1.26 -5.16 119.74 118.40 2eli s LYS 81 Ca -0.08 -1.78 0.04 0.00 -1.01 0.00 0.00 55.97 53.14 2eli s LYS 81 Cb -0.03 -1.97 -0.04 0.00 -1.01 0.00 0.00 37.83 34.78 2eli s LYS 81 CO -0.02 0.01 0.05 0.00 0.51 0.00 0.00 175.35 175.89 2eli s ALA 82 N -2.55 3.25 0.33 5.17 0.00 -1.26 -5.17 121.76 121.53 2eli s ALA 82 Ca 0.38 -1.37 -0.13 0.00 0.00 0.00 0.00 51.96 50.84 2eli s ALA 82 Cb 0.02 0.37 0.02 0.00 0.00 0.00 0.00 23.12 23.53 2eli s ALA 82 CO 0.21 -0.18 0.64 -1.83 0.00 0.00 0.00 175.76 174.60 2eli s GLU 83 N -3.80 1.93 -0.02 0.00 1.03 -1.26 -5.19 118.70 111.40 2eli s GLU 83 Ca 0.23 -1.39 -0.21 0.00 0.03 0.00 0.00 54.97 53.63 2eli s GLU 83 Cb 0.05 0.55 0.04 0.00 -0.80 0.00 0.00 34.13 33.97 2eli s GLU 83 CO 0.12 -0.86 0.47 0.54 -1.33 0.00 0.00 175.26 174.19 2eli s VAL 84 N -3.14 0.03 -1.50 1.83 0.11 -1.26 -5.38 120.40 111.10 2eli s VAL 84 Ca 0.20 -0.29 0.12 0.00 -2.93 0.00 0.00 61.98 59.08 2eli s VAL 84 Cb -0.03 -0.81 0.09 0.00 -1.53 0.00 0.00 36.38 34.10 2eli s VAL 84 CO 0.12 -0.16 0.88 0.00 -3.33 0.00 0.00 175.10 172.61