#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 -0.16 0.14 1.61 1.04 -1.26 -5.19 113.70 109.88 2eli s SER 2 Ca 0.00 0.02 -0.18 0.00 0.48 0.00 0.00 55.95 56.28 2eli s SER 2 Cb 0.00 0.16 0.04 0.00 0.10 0.00 0.00 66.02 66.32 2eli s SER 2 CO 0.00 -0.25 0.45 -0.44 0.98 0.00 0.00 173.24 173.98 2eli s SER 3 N -2.07 -0.31 -0.01 7.02 0.01 -1.26 -5.18 113.70 111.91 2eli s SER 3 Ca 0.08 -0.26 -0.05 0.00 1.31 0.00 0.00 55.95 57.03 2eli s SER 3 Cb -0.01 0.51 0.02 0.00 0.21 0.00 0.00 66.02 66.75 2eli s SER 3 CO -0.05 -0.90 0.22 0.61 0.41 0.00 0.00 173.24 173.53 2eli n GLY 4 N -0.27 0.44 3.31 3.44 0.00 -1.26 -5.19 105.19 105.67 2eli n GLY 4 Ca -0.16 -0.85 -0.17 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.48 1.27 -0.12 1.61 0.15 -1.26 -5.18 113.70 108.70 2eli s SER 5 Ca 0.05 -1.53 -0.28 0.00 0.70 0.00 0.00 55.95 54.90 2eli s SER 5 Cb -0.00 0.37 0.07 0.00 -1.71 0.00 0.00 66.02 64.75 2eli s SER 5 CO -0.00 -0.87 0.67 -0.94 1.20 0.00 0.00 173.24 173.29 2eli s SER 6 N -3.33 -0.66 0.00 5.45 1.04 -1.26 -5.17 113.70 109.77 2eli s SER 6 Ca 0.37 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.72 2eli s SER 6 Cb 0.05 0.82 0.00 0.00 0.10 0.00 0.00 66.02 67.00 2eli s SER 6 CO 0.17 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.52 2eli n GLY 7 N 1.54 4.32 3.98 7.32 0.00 -1.26 -5.16 105.19 115.93 2eli n GLY 7 Ca -0.17 -1.01 -0.20 0.00 0.00 0.00 0.00 46.02 44.64 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 1.75 0.06 -0.02 0.00 -1.26 -5.04 107.32 102.82 2eli s GLY 8 Ca 0.00 -1.37 -0.18 0.00 0.00 0.00 0.00 44.72 43.16 2eli s GLY 8 CO 0.00 -1.18 1.37 -0.56 0.00 0.00 0.00 173.10 172.73 2eli h PRO 9 N 0.44 0.47 -6.48 2.90 0.13 -2.01 -3.46 132.00 123.99 2eli h PRO 9 Ca -0.43 -0.25 -0.48 0.00 -0.87 0.00 0.00 66.00 63.97 2eli h PRO 9 Cb 1.27 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.20 2eli h PRO 9 CO 0.52 0.82 -0.73 -3.47 -0.23 0.00 0.00 178.00 174.91 2eli n ASP 10 N -4.46 -0.02 -3.80 1.44 2.03 -1.26 -4.87 116.55 105.61 2eli n ASP 10 Ca -0.05 -0.98 -0.10 0.00 0.52 0.00 0.00 54.79 54.18 2eli n ASP 10 Cb 0.40 -1.23 -0.07 0.00 -0.72 0.00 0.00 41.12 39.50 2eli n ASP 10 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2eli s THR 11 N -3.60 0.12 1.00 5.18 2.01 -1.26 -5.15 115.64 113.94 2eli s THR 11 Ca 0.23 -0.98 -0.18 0.00 0.31 0.00 0.00 61.69 61.07 2eli s THR 11 Cb -0.13 -1.20 -0.15 0.00 0.01 0.00 0.00 72.50 71.03 2eli s THR 11 CO 0.78 -0.54 -0.86 -0.67 -0.69 0.00 0.00 174.62 172.64 2eli n ASP 12 N 0.10 -5.60 -4.37 3.53 2.03 -1.26 -4.49 116.55 106.48 2eli n ASP 12 Ca -0.16 0.16 -0.60 0.00 0.52 0.00 0.00 54.79 54.71 2eli n ASP 12 Cb 0.62 -0.74 -0.11 0.00 -0.72 0.00 0.00 41.12 40.17 2eli n ASP 12 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2eli n ASP 13 N 3.36 1.04 0.00 1.67 8.00 -1.26 -4.75 116.55 124.61 2eli n ASP 13 Ca -0.02 0.74 0.07 0.00 0.71 0.00 0.00 54.79 56.30 2eli n ASP 13 Cb 0.58 -0.95 0.36 0.00 -0.02 0.00 0.00 41.12 41.10 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 6.96 0.19 0.04 -0.24 -0.04 -1.26 -2.70 135.00 137.94 2eli n PRO 14 Ca 0.49 0.16 -0.22 0.00 -0.04 0.00 0.00 63.50 63.88 2eli n PRO 14 Cb -0.01 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.81 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 0.33 -0.36 0.54 3.08 -1.98 -3.35 114.38 112.64 2eli h ARG 15 Ca 0.00 -0.56 -0.00 0.00 0.07 0.00 0.00 59.98 59.49 2eli h ARG 15 Cb 0.15 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 2eli h ARG 15 CO 0.00 1.26 0.20 0.66 -1.07 0.00 0.00 179.97 181.02 2eli h SER 16 N 0.09 0.42 -2.46 7.04 4.64 -1.81 -3.44 113.55 118.03 2eli h SER 16 Ca -0.38 -0.02 -0.59 0.00 -0.47 0.00 0.00 61.79 60.32 2eli h SER 16 Cb 2.07 -0.11 0.17 0.00 -0.31 0.00 0.00 62.40 64.22 2eli h SER 16 CO 0.13 0.34 -0.70 0.29 -0.87 0.00 0.00 176.83 176.02 2eli n LYS 17 N -4.45 0.30 -2.88 4.77 4.01 -1.24 0.22 118.16 118.88 2eli n LYS 17 Ca 0.02 0.12 -0.40 0.00 -0.51 0.00 0.00 58.31 57.54 2eli n LYS 17 Cb 0.09 -1.38 -0.05 0.00 -0.51 0.00 0.00 35.03 33.18 2eli n LYS 17 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 2eli s HIS 18 N -1.79 3.83 -0.57 2.13 3.76 -0.38 -4.59 115.29 117.68 2eli s HIS 18 Ca 0.63 1.65 -0.02 0.00 -0.15 0.00 0.00 55.06 57.17 2eli s HIS 18 Cb -0.50 -2.89 0.32 0.00 1.11 0.00 0.00 32.58 30.62 2eli s HIS 18 CO 0.60 0.33 2.13 1.63 -0.85 0.00 0.00 174.74 178.57 2eli n LYS 19 N 2.38 2.40 -1.68 1.40 5.02 -1.26 -4.98 118.16 121.44 2eli n LYS 19 Ca -0.02 -2.70 -0.42 0.00 -2.02 0.00 0.00 58.31 53.15 2eli n LYS 19 Cb 0.49 -2.07 -0.03 0.00 -0.02 0.00 0.00 35.03 33.40 2eli n LYS 19 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2eli s PHE 20 N -3.01 1.31 -0.12 2.13 0.08 -1.26 -3.49 117.98 113.62 2eli s PHE 20 Ca 0.52 -0.44 0.03 0.00 0.12 0.00 0.00 56.93 57.16 2eli s PHE 20 Cb 0.41 -4.24 -0.00 0.00 -0.57 0.00 0.00 43.02 38.61 2eli s PHE 20 CO -0.10 -5.53 -0.20 0.21 -0.10 0.00 0.00 175.22 169.49 2eli s LYS 21 N 4.40 3.14 -0.58 0.44 2.36 -0.51 -4.83 119.74 124.16 2eli s LYS 21 Ca 0.88 -0.82 -0.26 0.00 -2.55 0.00 0.00 55.97 53.22 2eli s LYS 21 Cb -0.43 -2.42 -0.09 0.00 -1.05 0.00 0.00 37.83 33.85 2eli s LYS 21 CO 0.41 0.16 2.41 -1.50 1.55 0.00 0.00 175.35 178.38 2eli s ILE 22 N 0.42 3.01 0.11 5.43 1.10 -1.26 -2.17 121.20 127.83 2eli s ILE 22 Ca -0.15 0.00 0.02 0.00 -0.51 0.00 0.00 60.65 60.02 2eli s ILE 22 Cb -0.17 -3.02 -0.04 0.00 0.15 0.00 0.00 42.46 39.37 2eli s ILE 22 CO 0.07 -0.02 -0.07 -2.28 -2.11 0.00 0.00 174.94 170.52 2eli s HIS 23 N 12.99 0.97 0.03 3.50 2.46 -1.21 -4.89 115.29 129.15 2eli s HIS 23 Ca 0.96 -0.87 -0.01 0.00 0.47 0.00 0.00 55.06 55.61 2eli s HIS 23 Cb -0.16 -0.54 -0.04 0.00 -0.13 0.00 0.00 32.58 31.71 2eli s HIS 23 CO 0.21 -0.10 0.18 -0.08 -2.47 0.00 0.00 174.74 172.48 2eli s THR 24 N -3.51 5.31 0.08 0.89 -1.32 -1.26 -3.99 115.64 111.84 2eli s THR 24 Ca 0.12 -0.33 0.00 0.00 -1.21 0.00 0.00 61.69 60.28 2eli s THR 24 Cb 0.04 -3.54 -0.04 0.00 -1.51 0.00 0.00 72.50 67.45 2eli s THR 24 CO -0.03 0.22 0.23 -0.31 -2.21 0.00 0.00 174.62 172.52 2eli s TYR 25 N -1.41 3.51 -2.03 9.09 1.51 -1.26 -4.98 117.35 121.78 2eli s TYR 25 Ca 0.31 0.24 0.25 0.00 -1.01 0.00 0.00 57.07 56.86 2eli s TYR 25 Cb -0.13 -1.76 0.43 0.00 -0.11 0.00 0.00 41.96 40.39 2eli s TYR 25 CO 0.23 0.57 1.36 0.41 -1.11 0.00 0.00 175.55 177.02 2eli n GLY 26 N 0.16 -0.17 3.15 0.71 0.00 -1.26 -4.95 105.19 102.83 2eli n GLY 26 Ca -0.05 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.41 0.43 -0.49 1.61 0.01 -1.26 -5.10 113.70 106.49 2eli s SER 27 Ca 0.23 -1.18 -0.27 0.00 1.31 0.00 0.00 55.95 56.04 2eli s SER 27 Cb 0.19 0.26 -0.02 0.00 0.21 0.00 0.00 66.02 66.67 2eli s SER 27 CO 0.51 -0.70 1.79 -2.16 0.41 0.00 0.00 173.24 173.09 2eli s PRO 28 N -4.02 2.99 0.16 12.44 0.04 -1.26 -4.99 135.00 140.37 2eli s PRO 28 Ca 0.22 0.94 0.07 0.00 0.04 0.00 0.00 61.00 62.27 2eli s PRO 28 Cb 0.07 -4.28 -0.04 0.00 0.04 0.00 0.00 34.50 30.30 2eli s PRO 28 CO 0.01 -2.28 0.00 0.99 0.04 0.00 0.00 177.00 175.76 2eli s THR 29 N 7.86 3.77 -0.14 1.26 2.01 -1.26 -5.01 115.64 124.12 2eli s THR 29 Ca 0.71 -1.35 0.01 0.00 0.31 0.00 0.00 61.69 61.37 2eli s THR 29 Cb -0.16 -2.88 -0.00 0.00 0.01 0.00 0.00 72.50 69.46 2eli s THR 29 CO 0.27 -0.07 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.61 2eli s PHE 30 N -1.65 2.76 0.88 4.92 0.40 -1.26 -1.01 117.98 123.01 2eli s PHE 30 Ca 0.27 -0.94 -0.16 0.00 -0.60 0.00 0.00 56.93 55.51 2eli s PHE 30 Cb -0.10 -1.85 -0.08 0.00 0.51 0.00 0.00 43.02 41.50 2eli s PHE 30 CO 0.18 -0.40 -0.14 0.00 0.70 0.00 0.00 175.22 175.56 2eli n ASP 32 N 1.33 1.20 -0.04 0.00 -0.08 -1.11 -3.61 116.55 114.25 2eli n ASP 32 Ca 0.04 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.31 2eli n ASP 32 Cb 0.53 1.58 -0.00 0.00 2.34 0.00 0.00 41.12 45.56 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 0.00 0.05 -0.67 2.76 -1.92 -3.42 115.15 111.96 2eli h HIS 33 Ca -0.09 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 57.92 2eli h HIS 33 Cb 1.01 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.96 2eli h HIS 33 CO 0.00 0.00 -0.81 0.00 -1.30 0.00 0.00 177.93 175.82 2eli n GLY 35 N 1.61 0.59 2.91 0.00 0.00 -1.24 -5.05 105.19 104.00 2eli n GLY 35 Ca -0.20 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.08 -0.03 0.49 1.61 0.01 -1.26 -4.82 113.70 108.62 2eli s SER 36 Ca 0.00 0.05 -0.22 0.00 1.31 0.00 0.00 55.95 57.08 2eli s SER 36 Cb 0.00 0.06 -0.08 0.00 0.21 0.00 0.00 66.02 66.21 2eli s SER 36 CO 0.00 -0.02 1.05 -0.11 0.41 0.00 0.00 173.24 174.57 2eli n LEU 37 N 3.02 3.32 -4.43 2.44 7.94 -1.26 -1.04 117.00 126.99 2eli n LEU 37 Ca -0.12 0.97 -0.44 0.00 -1.11 0.00 0.00 56.01 55.31 2eli n LEU 37 Cb 0.60 -1.40 -0.07 0.00 0.53 0.00 0.00 43.42 43.07 2eli n LEU 37 CO 0.25 -1.42 0.19 -0.76 -1.11 0.00 0.00 177.39 174.54 2eli s LEU 38 N -1.32 5.16 0.41 -1.96 1.43 -0.18 -4.83 118.68 117.39 2eli s LEU 38 Ca 0.67 -1.00 -0.04 0.00 -1.03 0.00 0.00 54.13 52.73 2eli s LEU 38 Cb -0.49 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.34 2eli s LEU 38 CO 0.54 -0.75 0.68 -0.31 0.23 0.00 0.00 176.35 176.73 2eli s TYR 39 N 2.22 3.53 0.00 0.29 2.02 -1.26 -4.72 117.35 119.42 2eli s TYR 39 Ca 0.11 0.67 0.00 0.00 -0.37 0.00 0.00 57.07 57.48 2eli s TYR 39 Cb -0.20 -2.16 0.00 0.00 -0.40 0.00 0.00 41.96 39.19 2eli s TYR 39 CO 0.11 -0.08 0.00 0.41 -1.57 0.00 0.00 175.55 174.41 2eli n GLY 40 N -1.86 3.81 0.11 0.71 0.00 -1.26 -4.67 105.19 102.03 2eli n GLY 40 Ca -0.01 -1.52 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.12 -8.36 0.99 6.46 -1.98 -3.44 115.31 108.86 2eli h LEU 41 Ca 0.00 -0.44 -0.29 0.00 -0.12 0.00 0.00 57.88 57.02 2eli h LEU 41 Cb 0.00 0.03 -0.18 0.00 -0.73 0.00 0.00 40.66 39.78 2eli h LEU 41 CO 0.00 0.45 -0.73 -0.51 -0.62 0.00 0.00 178.44 177.04 2eli s ILE 42 N -3.52 0.78 -1.46 4.05 2.07 -1.26 -4.79 121.20 117.07 2eli s ILE 42 Ca -0.14 -1.52 -0.08 0.00 -1.41 0.00 0.00 60.65 57.51 2eli s ILE 42 Cb 0.00 -1.19 0.04 0.00 0.13 0.00 0.00 42.46 41.44 2eli s ILE 42 CO 0.54 -0.55 0.70 1.41 -1.91 0.00 0.00 174.94 175.13 2eli n HIS 43 N 0.74 -2.09 -0.26 3.50 8.25 -1.26 -4.86 115.22 119.25 2eli n HIS 43 Ca -0.18 0.63 -0.01 0.00 -0.26 0.00 0.00 57.72 57.90 2eli n HIS 43 Cb 0.57 -4.06 0.11 0.00 1.12 0.00 0.00 29.99 27.74 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 -1.54 0.75 0.00 -0.41 4.20 -1.83 -3.47 115.11 112.80 2eli h GLN 44 Ca -0.52 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.15 2eli h GLN 44 Cb 1.35 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.96 2eli h GLN 44 CO 0.57 0.49 0.00 0.41 -0.67 0.00 0.00 178.83 179.64 2eli n GLY 45 N -1.30 3.97 3.03 3.46 0.00 -1.26 -4.62 105.19 108.48 2eli n GLY 45 Ca 0.10 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 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 4.72 0.53 -0.06 1.61 -1.94 0.03 -3.33 119.30 120.87 2eli s MET 46 Ca 0.00 -0.56 0.02 0.00 -1.71 0.00 0.00 55.69 53.44 2eli s MET 46 Cb 0.00 -0.40 0.02 0.00 2.01 0.00 0.00 34.83 36.45 2eli s MET 46 CO 0.00 0.09 -0.10 0.21 -0.01 0.00 0.00 175.02 175.21 2eli s LYS 47 N -1.02 1.46 0.66 2.03 2.47 -0.92 -1.80 119.74 122.62 2eli s LYS 47 Ca -0.05 -0.32 -0.13 0.00 -1.56 0.00 0.00 55.97 53.91 2eli s LYS 47 Cb -0.07 -1.27 -0.00 0.00 -1.46 0.00 0.00 37.83 35.02 2eli s LYS 47 CO 0.00 -0.02 1.06 0.00 0.16 0.00 0.00 175.35 176.56 2eli n ASP 49 N -2.72 2.55 -0.01 0.00 9.92 -1.23 -3.02 116.55 122.04 2eli n ASP 49 Ca 0.08 -1.77 -0.02 0.00 -0.53 0.00 0.00 54.79 52.55 2eli n ASP 49 Cb 0.53 0.04 -0.01 0.00 -0.64 0.00 0.00 41.12 41.04 2eli n ASP 49 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 2eli n THR 50 N 0.99 0.15 0.06 -3.53 5.66 -1.26 -4.75 114.28 111.60 2eli n THR 50 Ca 0.11 -0.06 0.04 0.00 -3.05 0.00 0.00 64.05 61.09 2eli n THR 50 Cb 0.48 -0.73 0.07 0.00 -1.55 0.00 0.00 70.33 68.60 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 0.25 -0.15 -4.46 0.00 8.00 -1.17 -4.84 116.55 114.19 2eli n ASP 52 Ca 0.06 -0.81 -0.43 0.00 0.71 0.00 0.00 54.79 54.31 2eli n ASP 52 Cb 0.28 -1.00 -0.10 0.00 -0.02 0.00 0.00 41.12 40.28 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 -5.97 2.99 0.00 -1.24 1.75 -1.26 -4.75 119.30 110.83 2eli s MET 53 Ca 0.07 -0.98 -0.30 0.00 -1.25 0.00 0.00 55.69 53.23 2eli s MET 53 Cb -0.04 -3.98 -0.04 0.00 2.84 0.00 0.00 34.83 33.60 2eli s MET 53 CO 0.63 -0.78 1.14 0.54 -0.65 0.00 0.00 175.02 175.89 2eli s ASN 54 N 1.74 7.15 0.12 1.11 2.20 -1.26 -3.63 114.94 122.37 2eli s ASN 54 Ca 0.06 1.84 -0.13 0.00 -0.94 0.00 0.00 52.86 53.70 2eli s ASN 54 Cb -0.19 -2.57 0.02 0.00 -2.00 0.00 0.00 41.25 36.51 2eli s ASN 54 CO 0.11 -0.45 0.33 0.68 -2.94 0.00 0.00 177.10 174.83 2eli s VAL 55 N 1.43 0.09 0.55 3.54 -7.23 -0.74 -2.73 120.40 115.31 2eli s VAL 55 Ca 0.56 -0.84 -0.19 0.00 -1.81 0.00 0.00 61.98 59.70 2eli s VAL 55 Cb -0.25 -1.29 -0.05 0.00 0.56 0.00 0.00 36.38 35.34 2eli s VAL 55 CO 0.26 -0.41 1.11 -1.00 -0.31 0.00 0.00 175.10 174.75 2eli s HIS 56 N -3.84 2.71 0.52 2.82 3.76 -1.26 -0.79 115.29 119.22 2eli s HIS 56 Ca 0.05 1.55 0.22 0.00 -0.15 0.00 0.00 55.06 56.73 2eli s HIS 56 Cb 0.03 -3.24 1.34 0.00 1.11 0.00 0.00 32.58 31.82 2eli s HIS 56 CO -0.10 -1.48 2.04 0.87 -0.85 0.00 0.00 174.74 175.21 2eli h LYS 57 N 1.07 0.03 -0.00 1.40 1.79 -1.87 0.28 116.57 119.26 2eli h LYS 57 Ca -0.49 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 2eli h LYS 57 Cb 1.25 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 2eli h LYS 57 CO 0.57 0.02 -0.54 0.00 -1.08 0.00 0.00 179.45 178.41 2eli n GLN 58 N -4.43 0.09 0.11 3.15 10.64 -1.26 -3.81 117.38 121.87 2eli n GLN 58 Ca 0.06 -0.06 0.12 0.00 -1.83 0.00 0.00 57.00 55.29 2eli n GLN 58 Cb 0.45 -1.50 0.09 0.00 -0.86 0.00 0.00 30.24 28.42 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 0.66 0.00 0.00 -1.51 -1.51 -2.71 116.25 111.18 2eli h VAL 60 Ca 0.00 -1.29 -0.02 0.00 -1.23 0.00 0.00 66.70 64.16 2eli h VAL 60 Cb 0.91 1.85 -0.00 0.00 -2.13 0.00 0.00 31.29 31.92 2eli h VAL 60 CO 0.00 0.27 -0.12 -0.29 -1.23 0.00 0.00 177.57 176.21 2eli h ILE 61 N 0.00 0.31 0.05 7.19 2.10 -1.77 -3.20 117.51 122.20 2eli h ILE 61 Ca -0.00 -0.79 -0.30 0.00 1.08 0.00 0.00 64.86 64.85 2eli h ILE 61 Cb 0.83 1.60 -0.03 0.00 -1.09 0.00 0.00 36.82 38.13 2eli h ILE 61 CO 0.04 0.11 -1.62 0.59 -1.08 0.00 0.00 178.15 176.19 2eli n ASN 62 N -3.29 1.98 -4.63 2.19 3.02 -1.06 -4.93 115.26 108.53 2eli n ASN 62 Ca 0.00 0.33 -0.44 0.00 -0.03 0.00 0.00 54.58 54.44 2eli n ASN 62 Cb 0.35 -0.92 -0.01 0.00 -0.61 0.00 0.00 39.78 38.59 2eli n ASN 62 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2eli n VAL 63 N -4.02 1.93 -2.17 2.41 0.31 -1.05 -4.89 118.33 110.85 2eli n VAL 63 Ca -0.33 -0.48 -0.42 0.00 -0.01 0.00 0.00 64.34 63.10 2eli n VAL 63 Cb 0.84 -1.22 -0.03 0.00 -0.91 0.00 0.00 33.84 32.53 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 -1.60 4.26 0.11 5.55 0.04 -1.26 -4.92 135.00 137.18 2eli s PRO 64 Ca 0.58 2.02 -0.20 0.00 0.04 0.00 0.00 61.00 63.44 2eli s PRO 64 Cb -0.65 -3.61 -0.04 0.00 0.04 0.00 0.00 34.50 30.23 2eli s PRO 64 CO 0.60 -0.62 1.02 -1.13 0.04 0.00 0.00 177.00 176.91 2eli n SER 65 N 5.55 -0.70 -3.48 6.66 3.41 -1.26 -4.50 113.62 119.30 2eli n SER 65 Ca 0.14 1.17 -0.32 0.00 -0.26 0.00 0.00 58.87 59.61 2eli n SER 65 Cb 0.43 -0.15 0.02 0.00 -0.26 0.00 0.00 64.21 64.25 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 -4.83 -4.27 -3.62 1.04 -0.00 -1.25 -1.25 117.00 102.83 2eli n LEU 66 Ca 0.01 0.33 -0.10 0.00 -0.00 0.00 0.00 56.01 56.25 2eli n LEU 66 Cb 0.17 -0.68 -0.04 0.00 -0.00 0.00 0.00 43.42 42.88 2eli n LEU 66 CO -0.11 -4.68 0.27 0.00 -0.00 0.00 0.00 177.39 172.87 2eli n GLY 68 N -0.31 0.37 0.11 0.00 0.00 -1.26 -4.76 105.19 99.33 2eli n GLY 68 Ca -0.14 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.94 0.68 -4.09 1.61 2.81 -1.26 -4.92 117.12 111.01 2eli n MET 69 Ca 0.00 0.05 -0.22 0.00 -1.81 0.00 0.00 57.70 55.72 2eli n MET 69 Cb 0.39 -1.53 -0.04 0.00 -0.71 0.00 0.00 33.22 31.33 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 -5.82 5.42 -1.23 7.83 -1.08 -1.26 -4.64 116.67 115.89 2eli s ASP 70 Ca -0.17 -0.31 -0.02 0.00 -0.52 0.00 0.00 52.55 51.53 2eli s ASP 70 Cb 0.07 -1.30 -0.01 0.00 -1.46 0.00 0.00 42.92 40.22 2eli s ASP 70 CO 0.76 -0.08 0.85 1.41 0.52 0.00 0.00 175.17 178.63 2eli n HIS 71 N -1.19 -2.08 -2.63 -5.34 8.25 -1.26 -4.94 115.22 106.04 2eli n HIS 71 Ca -0.07 0.86 -0.41 0.00 -0.26 0.00 0.00 57.72 57.85 2eli n HIS 71 Cb 0.58 -4.60 -0.04 0.00 1.12 0.00 0.00 29.99 27.05 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 -3.51 4.11 -0.24 1.59 2.01 -1.26 -4.95 115.64 113.39 2eli s THR 72 Ca 0.07 1.85 -0.28 0.00 0.31 0.00 0.00 61.69 63.64 2eli s THR 72 Cb -0.01 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2eli s THR 72 CO 0.77 0.33 2.14 -0.70 -0.69 0.00 0.00 174.62 176.47 2eli s GLU 73 N -0.40 3.17 -0.07 4.92 2.56 -1.26 -4.86 118.70 122.76 2eli s GLU 73 Ca 0.47 1.92 -0.41 0.00 0.00 0.00 0.00 54.97 56.95 2eli s GLU 73 Cb -0.27 -4.34 -0.20 0.00 2.00 0.00 0.00 34.13 31.33 2eli s GLU 73 CO 0.33 -2.06 1.20 1.63 -0.56 0.00 0.00 175.26 175.80 2eli n LYS 74 N 8.69 0.16 -4.24 4.30 5.02 -1.26 -4.95 118.16 125.87 2eli n LYS 74 Ca 0.28 0.06 -0.14 0.00 -2.02 0.00 0.00 58.31 56.49 2eli n LYS 74 Cb 0.45 -1.58 -0.10 0.00 -0.02 0.00 0.00 35.03 33.79 2eli n LYS 74 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2eli s ARG 75 N 0.60 1.07 -0.59 1.97 3.52 -1.26 -5.07 118.95 119.19 2eli s ARG 75 Ca 0.93 -1.49 -0.31 0.00 -0.13 0.00 0.00 55.73 54.73 2eli s ARG 75 Cb -1.27 -0.43 -0.13 0.00 -1.56 0.00 0.00 34.95 31.56 2eli s ARG 75 CO 0.60 -0.03 2.42 0.41 -0.81 0.00 0.00 175.30 177.89 2eli n GLY 76 N -0.21 0.09 3.62 8.12 0.00 -1.26 -4.83 105.19 110.71 2eli n GLY 76 Ca -0.09 0.90 -0.05 0.00 0.00 0.00 0.00 46.02 46.78 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 7.77 0.27 -0.01 1.61 3.52 -1.26 -5.17 118.95 125.68 2eli s ARG 77 Ca 1.13 0.06 0.05 0.00 -0.13 0.00 0.00 55.73 56.84 2eli s ARG 77 Cb -0.74 0.13 -0.01 0.00 -1.56 0.00 0.00 34.95 32.77 2eli s ARG 77 CO 0.41 -0.09 -0.15 0.42 -0.81 0.00 0.00 175.30 175.08 2eli s ILE 78 N -1.10 1.22 -0.08 4.11 1.09 -1.26 -5.13 121.20 120.04 2eli s ILE 78 Ca 0.05 -0.66 -0.22 0.00 -1.10 0.00 0.00 60.65 58.72 2eli s ILE 78 Cb -0.01 -1.02 -0.04 0.00 -1.06 0.00 0.00 42.46 40.34 2eli s ILE 78 CO -0.04 0.34 0.64 -0.31 -0.10 0.00 0.00 174.94 175.47 2eli s TYR 79 N -0.37 3.55 0.25 3.97 2.02 -1.26 -5.06 117.35 120.47 2eli s TYR 79 Ca 0.06 1.15 -0.22 0.00 -0.37 0.00 0.00 57.07 57.68 2eli s TYR 79 Cb -0.06 -2.74 -0.09 0.00 -0.40 0.00 0.00 41.96 38.67 2eli s TYR 79 CO -0.01 0.10 0.80 -1.17 -1.57 0.00 0.00 175.55 173.71 2eli s LEU 80 N 0.78 4.36 -0.19 -1.29 2.96 -1.26 -5.06 118.68 118.98 2eli s LEU 80 Ca 0.34 1.57 -0.07 0.00 -0.22 0.00 0.00 54.13 55.76 2eli s LEU 80 Cb -0.17 -3.71 -0.04 0.00 0.50 0.00 0.00 46.19 42.77 2eli s LEU 80 CO 0.16 0.01 0.06 -0.75 -1.32 0.00 0.00 176.35 174.51 2eli s LYS 81 N -1.95 3.90 1.05 1.98 2.47 -1.26 -5.09 119.74 120.85 2eli s LYS 81 Ca 0.45 -0.38 -0.17 0.00 -1.56 0.00 0.00 55.97 54.31 2eli s LYS 81 Cb -0.18 -3.21 0.07 0.00 -1.46 0.00 0.00 37.83 33.05 2eli s LYS 81 CO 0.22 0.19 0.09 0.00 0.16 0.00 0.00 175.35 176.01 2eli n ALA 82 N 3.77 -3.68 -2.32 3.13 0.00 -1.26 -5.04 120.51 115.11 2eli n ALA 82 Ca -0.16 -1.04 -0.20 0.00 0.00 0.00 0.00 53.44 52.04 2eli n ALA 82 Cb 0.52 -1.59 -0.08 0.00 0.00 0.00 0.00 19.45 18.30 2eli n ALA 82 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2eli s GLU 83 N -3.44 1.74 0.23 0.00 0.41 -1.26 -5.16 118.70 111.21 2eli s GLU 83 Ca 0.55 -2.01 -0.09 0.00 -0.41 0.00 0.00 54.97 53.01 2eli s GLU 83 Cb -0.15 0.15 -0.07 0.00 -1.78 0.00 0.00 34.13 32.28 2eli s GLU 83 CO 0.67 -0.59 0.54 0.08 -0.49 0.00 0.00 175.26 175.47 2eli s VAL 84 N -3.47 4.94 0.00 2.63 1.01 -1.26 -5.36 120.40 118.89 2eli s VAL 84 Ca 0.38 0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.79 2eli s VAL 84 Cb 0.03 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2eli s VAL 84 CO 0.24 -0.08 0.48 0.00 0.00 0.00 0.00 175.10 175.74