#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhf s SER 2 N 0.00 1.50 -0.39 1.61 0.15 -1.26 -5.09 113.70 110.22 1uhf s SER 2 Ca 0.00 -0.37 0.02 0.00 0.70 0.00 0.00 55.95 56.30 1uhf s SER 2 Cb 0.00 0.40 0.12 0.00 -1.71 0.00 0.00 66.02 64.83 1uhf s SER 2 CO 0.00 -0.34 0.16 -0.55 1.20 0.00 0.00 173.24 173.71 1uhf s SER 3 N 2.33 4.11 0.00 5.45 0.15 -1.26 -5.06 113.70 119.42 1uhf s SER 3 Ca 0.08 -2.30 0.00 0.00 0.70 0.00 0.00 55.95 54.43 1uhf s SER 3 Cb -0.15 -1.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.95 1uhf s SER 3 CO -0.18 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1uhf n GLY 4 N 4.01 2.00 1.42 9.45 0.00 -1.26 -5.06 105.19 115.74 1uhf n GLY 4 Ca 0.04 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1uhf n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uhf n SER 5 N 0.00 0.51 0.14 1.61 2.88 -1.26 -5.07 113.62 112.44 1uhf n SER 5 Ca 0.00 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 1uhf n SER 5 Cb 0.00 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 1uhf n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uhf n SER 6 N -3.40 -1.94 0.00 -3.46 2.88 -1.26 -5.16 113.62 101.28 1uhf n SER 6 Ca 0.00 0.53 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1uhf n SER 6 Cb 0.04 1.96 0.00 0.00 -0.75 0.00 0.00 64.21 65.46 1uhf n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhf n GLY 7 N -0.40 4.83 0.00 0.46 0.00 -1.26 -5.19 105.19 103.63 1uhf n GLY 7 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1uhf n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uhf n GLY 8 N 0.00 2.21 3.18 -0.02 0.00 -1.26 -4.88 105.19 104.42 1uhf n GLY 8 Ca 0.00 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 1uhf n GLY 8 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uhf s GLU 9 N -2.00 3.10 -0.21 1.61 0.41 0.50 -4.92 118.70 117.19 1uhf s GLU 9 Ca 0.00 -0.78 -0.29 0.00 -0.41 0.00 0.00 54.97 53.48 1uhf s GLU 9 Cb 0.00 -2.64 0.01 0.00 -1.78 0.00 0.00 34.13 29.72 1uhf s GLU 9 CO 0.00 -0.14 1.06 -1.21 -0.49 0.00 0.00 175.26 174.48 1uhf s GLU 10 N 1.18 4.27 0.04 1.61 8.01 -1.26 0.28 118.70 132.84 1uhf s GLU 10 Ca 0.02 1.40 0.05 0.00 0.01 0.00 0.00 54.97 56.45 1uhf s GLU 10 Cb -0.14 -3.64 -0.02 0.00 -4.31 0.00 0.00 34.13 26.01 1uhf s GLU 10 CO -0.08 -0.61 -0.15 0.71 0.01 0.00 0.00 175.26 175.14 1uhf s TYR 11 N 3.12 1.31 -0.14 1.61 1.51 0.86 -0.86 117.35 124.76 1uhf s TYR 11 Ca 0.46 -0.37 -0.07 0.00 -1.01 0.00 0.00 57.07 56.08 1uhf s TYR 11 Cb -0.16 -0.77 -0.04 0.00 -0.11 0.00 0.00 41.96 40.87 1uhf s TYR 11 CO 0.08 0.05 0.11 0.42 -1.11 0.00 0.00 175.55 175.10 1uhf s ILE 12 N -0.89 5.26 -0.60 2.71 -1.09 0.12 0.12 121.20 126.84 1uhf s ILE 12 Ca 0.02 0.12 -0.28 0.00 -2.23 0.00 0.00 60.65 58.28 1uhf s ILE 12 Cb -0.08 -3.31 0.03 0.00 -1.58 0.00 0.00 42.46 37.51 1uhf s ILE 12 CO 0.01 0.57 1.21 0.00 -1.23 0.00 0.00 174.94 175.50 1uhf s ALA 13 N -0.59 2.95 0.17 9.38 0.00 -0.75 -0.32 121.76 132.61 1uhf s ALA 13 Ca 0.12 -0.90 -0.14 0.00 0.00 0.00 0.00 51.96 51.04 1uhf s ALA 13 Cb -0.12 -4.07 0.07 0.00 0.00 0.00 0.00 23.12 19.00 1uhf s ALA 13 CO 0.02 -2.76 1.81 -0.07 0.00 0.00 0.00 175.76 174.76 1uhf h LEU 14 N 12.12 0.47 -8.58 0.00 3.38 -1.78 0.42 115.31 121.35 1uhf h LEU 14 Ca -0.25 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.32 1uhf h LEU 14 Cb 1.06 -0.10 -0.18 0.00 0.09 0.00 0.00 40.66 41.53 1uhf h LEU 14 CO 1.20 0.33 -0.75 -0.31 0.09 0.00 0.00 178.44 179.00 1uhf s TYR 15 N -6.15 1.34 -0.21 1.13 2.02 -1.26 -4.63 117.35 109.61 1uhf s TYR 15 Ca -0.13 -0.57 -0.29 0.00 -0.37 0.00 0.00 57.07 55.71 1uhf s TYR 15 Cb 0.12 -0.71 -0.01 0.00 -0.40 0.00 0.00 41.96 40.96 1uhf s TYR 15 CO 0.73 0.12 1.30 -1.25 -1.57 0.00 0.00 175.55 174.88 1uhf s PRO 16 N -2.68 4.12 -0.26 -1.71 0.04 -1.26 -4.19 135.00 129.06 1uhf s PRO 16 Ca 0.08 1.55 -0.07 0.00 0.04 0.00 0.00 61.00 62.61 1uhf s PRO 16 Cb -0.05 -3.82 -0.01 0.00 0.04 0.00 0.00 34.50 30.67 1uhf s PRO 16 CO 0.03 -0.86 0.06 -0.47 0.04 0.00 0.00 177.00 175.80 1uhf s TYR 17 N 3.85 3.09 -0.10 0.56 6.14 -0.44 -4.89 117.35 125.55 1uhf s TYR 17 Ca 0.56 -0.70 0.03 0.00 0.64 0.00 0.00 57.07 57.61 1uhf s TYR 17 Cb -0.21 -2.23 0.00 0.00 0.42 0.00 0.00 41.96 39.95 1uhf s TYR 17 CO 0.18 -0.47 -0.22 -1.12 0.64 0.00 0.00 175.55 174.56 1uhf s SER 18 N 1.56 2.91 0.20 4.32 0.01 -1.26 -2.72 113.70 118.71 1uhf s SER 18 Ca 0.05 -0.53 -0.03 0.00 1.31 0.00 0.00 55.95 56.74 1uhf s SER 18 Cb -0.16 -1.33 -0.03 0.00 0.21 0.00 0.00 66.02 64.71 1uhf s SER 18 CO 0.02 0.13 0.18 -0.55 0.41 0.00 0.00 173.24 173.43 1uhf s SER 19 N 0.49 0.13 -0.36 2.44 0.15 -1.26 -5.07 113.70 110.22 1uhf s SER 19 Ca -0.16 -1.26 0.09 0.00 0.70 0.00 0.00 55.95 55.32 1uhf s SER 19 Cb -0.17 0.40 0.45 0.00 -1.71 0.00 0.00 66.02 64.99 1uhf s SER 19 CO 0.06 -0.87 1.12 1.33 1.20 0.00 0.00 173.24 176.07 1uhf n VAL 20 N -0.26 2.16 -4.26 4.45 0.24 -1.26 -4.97 118.33 114.43 1uhf n VAL 20 Ca -0.00 -4.29 -0.34 0.00 -2.04 0.00 0.00 64.34 57.66 1uhf n VAL 20 Cb 0.65 -0.77 -0.09 0.00 -1.47 0.00 0.00 33.84 32.17 1uhf n VAL 20 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1uhf s GLU 21 N -3.53 3.01 0.00 7.34 0.41 -1.26 -4.99 118.70 119.67 1uhf s GLU 21 Ca 0.45 -0.43 -0.04 0.00 -0.41 0.00 0.00 54.97 54.53 1uhf s GLU 21 Cb 0.40 -2.82 -0.20 0.00 -1.78 0.00 0.00 34.13 29.73 1uhf s GLU 21 CO -0.07 0.69 2.84 -0.35 -0.49 0.00 0.00 175.26 177.88 1uhf n PRO 22 N 1.82 1.50 0.00 0.39 -0.04 -1.26 -2.75 135.00 134.66 1uhf n PRO 22 Ca -0.17 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.54 1uhf n PRO 22 Cb 0.53 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.12 1uhf n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1uhf n GLY 23 N 2.62 0.00 2.89 0.55 0.00 -1.26 -5.09 105.19 104.90 1uhf n GLY 23 Ca 0.32 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.06 1uhf n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uhf s ASP 24 N 0.00 2.65 -0.54 1.61 1.11 -1.11 -0.31 116.67 120.08 1uhf s ASP 24 Ca 0.00 -0.57 -0.27 0.00 0.18 0.00 0.00 52.55 51.90 1uhf s ASP 24 Cb 0.00 -0.89 -0.02 0.00 1.07 0.00 0.00 42.92 43.07 1uhf s ASP 24 CO 0.00 -0.17 1.84 -0.22 1.18 0.00 0.00 175.17 177.81 1uhf s LEU 25 N 1.65 3.35 -0.06 1.23 2.96 -0.30 -4.72 118.68 122.79 1uhf s LEU 25 Ca 0.02 0.58 -0.30 0.00 -0.22 0.00 0.00 54.13 54.21 1uhf s LEU 25 Cb -0.14 -2.77 -0.02 0.00 0.50 0.00 0.00 46.19 43.75 1uhf s LEU 25 CO -0.08 -2.22 0.99 0.42 -1.32 0.00 0.00 176.35 174.14 1uhf s THR 26 N 8.57 4.83 0.22 3.68 -4.23 -1.26 -4.84 115.64 122.61 1uhf s THR 26 Ca 0.70 2.04 -0.13 0.00 -1.18 0.00 0.00 61.69 63.12 1uhf s THR 26 Cb -0.15 -4.31 0.00 0.00 1.34 0.00 0.00 72.50 69.38 1uhf s THR 26 CO 0.24 0.08 0.45 0.72 -0.54 0.00 0.00 174.62 175.57 1uhf s PHE 27 N 1.55 0.25 0.48 3.99 -0.12 -1.10 -5.06 117.98 117.97 1uhf s PHE 27 Ca 0.50 -0.61 0.06 0.00 -0.05 0.00 0.00 56.93 56.83 1uhf s PHE 27 Cb -0.19 0.19 -0.01 0.00 -0.63 0.00 0.00 43.02 42.38 1uhf s PHE 27 CO 0.22 -0.92 0.27 0.95 -0.05 0.00 0.00 175.22 175.70 1uhf s THR 28 N -3.97 1.92 0.13 -4.49 -4.23 -1.26 -1.33 115.64 102.40 1uhf s THR 28 Ca 0.18 -1.61 -0.31 0.00 -1.18 0.00 0.00 61.69 58.77 1uhf s THR 28 Cb 0.00 -2.53 -0.08 0.00 1.34 0.00 0.00 72.50 71.23 1uhf s THR 28 CO 0.04 0.00 1.37 -0.70 -0.54 0.00 0.00 174.62 174.79 1uhf s GLU 29 N -4.08 4.33 0.00 3.99 -6.30 -1.26 -2.43 118.70 112.95 1uhf s GLU 29 Ca 0.34 2.06 0.00 0.00 -2.50 0.00 0.00 54.97 54.88 1uhf s GLU 29 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 34.13 30.89 1uhf s GLU 29 CO 0.20 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.49 1uhf n GLY 30 N 3.30 3.00 3.66 -1.50 0.00 0.15 -4.93 105.19 108.87 1uhf n GLY 30 Ca 0.11 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1uhf n GLY 30 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uhf n GLU 31 N 0.00 1.69 -3.20 1.61 4.71 -1.02 -4.54 120.64 119.89 1uhf n GLU 31 Ca 0.00 0.60 -0.40 0.00 -0.01 0.00 0.00 57.16 57.36 1uhf n GLU 31 Cb 0.00 -2.24 -0.07 0.00 -1.01 0.00 0.00 31.44 28.12 1uhf n GLU 31 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1uhf s GLU 32 N -2.12 4.14 -0.12 3.49 2.02 -1.26 -1.80 118.70 123.05 1uhf s GLU 32 Ca 0.62 0.44 -0.01 0.00 0.02 0.00 0.00 54.97 56.04 1uhf s GLU 32 Cb -0.53 -3.61 -0.02 0.00 0.10 0.00 0.00 34.13 30.07 1uhf s GLU 32 CO 0.57 -0.27 -0.09 0.42 0.02 0.00 0.00 175.26 175.92 1uhf s ILE 33 N 2.03 3.48 -0.51 -1.63 1.01 0.12 -4.84 121.20 120.86 1uhf s ILE 33 Ca 0.24 -0.52 -0.15 0.00 0.00 0.00 0.00 60.65 60.22 1uhf s ILE 33 Cb -0.16 -2.47 0.11 0.00 0.01 0.00 0.00 42.46 39.95 1uhf s ILE 33 CO 0.09 0.54 0.45 -0.22 0.00 0.00 0.00 174.94 175.79 1uhf s LEU 34 N 0.02 5.93 0.16 2.97 2.96 0.22 -0.10 118.68 130.83 1uhf s LEU 34 Ca -0.02 -1.63 -0.26 0.00 -0.22 0.00 0.00 54.13 51.99 1uhf s LEU 34 Cb -0.14 -2.18 -0.08 0.00 0.50 0.00 0.00 46.19 44.30 1uhf s LEU 34 CO 0.03 -0.77 0.82 -0.69 -1.32 0.00 0.00 176.35 174.42 1uhf s VAL 35 N 1.59 4.38 0.00 1.68 1.01 0.14 -0.43 120.40 128.77 1uhf s VAL 35 Ca 0.04 1.79 0.00 0.00 0.00 0.00 0.00 61.98 63.80 1uhf s VAL 35 Cb -0.28 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1uhf s VAL 35 CO 0.04 0.48 0.00 0.35 0.00 0.00 0.00 175.10 175.97 1uhf n THR 36 N 1.86 0.00 -4.58 3.92 -2.24 -1.10 0.19 114.28 112.33 1uhf n THR 36 Ca -0.04 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.41 1uhf n THR 36 Cb 0.49 -0.53 -0.14 0.00 -2.10 0.00 0.00 70.33 68.05 1uhf n THR 36 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1uhf s GLN 37 N -1.68 3.38 -0.35 -0.78 0.74 -1.21 -4.95 119.66 114.80 1uhf s GLN 37 Ca 0.00 -0.67 0.00 0.00 0.05 0.00 0.00 55.36 54.74 1uhf s GLN 37 Cb 0.00 -2.70 0.09 0.00 1.10 0.00 0.00 33.01 31.50 1uhf s GLN 37 CO 0.00 0.12 0.09 0.15 -0.55 0.00 0.00 175.29 175.10 1uhf s LYS 38 N 0.59 1.91 -0.45 1.67 1.02 -1.26 0.19 119.74 123.40 1uhf s LYS 38 Ca -0.07 -1.71 -0.12 0.00 0.02 0.00 0.00 55.97 54.09 1uhf s LYS 38 Cb -0.15 -3.33 0.09 0.00 -0.52 0.00 0.00 37.83 33.92 1uhf s LYS 38 CO 0.03 -0.91 0.34 -0.51 -0.92 0.00 0.00 175.35 173.38 1uhf s ASP 39 N 1.34 5.87 1.87 2.83 1.11 -1.13 -4.96 116.67 123.61 1uhf s ASP 39 Ca 0.05 -1.52 0.00 0.00 0.18 0.00 0.00 52.55 51.26 1uhf s ASP 39 Cb -0.21 -2.08 0.00 0.00 1.07 0.00 0.00 42.92 41.71 1uhf s ASP 39 CO -0.05 -0.62 0.00 0.61 1.18 0.00 0.00 175.17 176.29 1uhf n GLY 40 N 5.04 3.95 0.13 0.21 0.00 -1.26 -2.58 105.19 110.69 1uhf n GLY 40 Ca -0.11 0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1uhf n GLY 40 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1uhf h GLU 41 N 0.00 0.24 -5.77 1.61 3.07 -1.98 -3.44 114.58 108.31 1uhf h GLU 41 Ca 0.00 -0.41 -0.60 0.00 -0.50 0.00 0.00 59.36 57.85 1uhf h GLU 41 Cb 0.00 0.15 -0.10 0.00 -0.84 0.00 0.00 28.75 27.96 1uhf h GLU 41 CO 0.00 1.20 0.39 -1.58 -1.40 0.00 0.00 179.01 177.62 1uhf s TRP 42 N -2.51 3.20 0.28 4.33 0.52 -1.06 -3.41 118.94 120.28 1uhf s TRP 42 Ca -0.22 0.79 0.06 0.00 0.02 0.00 0.00 56.10 56.75 1uhf s TRP 42 Cb 0.06 -3.23 -0.02 0.00 -1.15 0.00 0.00 33.47 29.13 1uhf s TRP 42 CO 0.75 -0.58 0.37 -1.58 0.02 0.00 0.00 176.95 175.94 1uhf s TRP 43 N 2.96 3.25 -0.34 -1.98 0.51 -1.11 -2.83 118.94 119.40 1uhf s TRP 43 Ca 0.32 -0.12 -0.14 0.00 -2.12 0.00 0.00 56.10 54.04 1uhf s TRP 43 Cb -0.14 -1.71 -0.02 0.00 -0.81 0.00 0.00 33.47 30.80 1uhf s TRP 43 CO 0.13 0.28 0.33 0.99 -0.51 0.00 0.00 176.95 178.17 1uhf s THR 44 N -2.09 5.20 0.53 2.01 2.01 0.49 -1.96 115.64 121.84 1uhf s THR 44 Ca 0.38 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.45 1uhf s THR 44 Cb -0.09 -3.78 0.05 0.00 0.01 0.00 0.00 72.50 68.69 1uhf s THR 44 CO 0.29 -0.05 0.73 -0.83 -0.69 0.00 0.00 174.62 174.08 1uhf s GLY 45 N 1.73 1.84 -0.07 4.40 0.00 -0.54 -2.69 107.32 111.99 1uhf s GLY 45 Ca 0.10 -1.68 -0.12 0.00 0.00 0.00 0.00 44.72 43.03 1uhf s GLY 45 CO 0.11 -1.36 0.29 -0.45 0.00 0.00 0.00 173.10 171.70 1uhf s SER 46 N -4.49 -0.24 -0.17 1.64 0.15 0.42 -2.79 113.70 108.22 1uhf s SER 46 Ca 0.59 0.35 -0.04 0.00 0.70 0.00 0.00 55.95 57.54 1uhf s SER 46 Cb -0.09 0.47 0.06 0.00 -1.71 0.00 0.00 66.02 64.75 1uhf s SER 46 CO 0.37 -0.25 0.07 -0.63 1.20 0.00 0.00 173.24 174.01 1uhf s ILE 47 N -0.50 0.09 0.00 6.45 1.01 -0.77 -0.61 121.20 126.86 1uhf s ILE 47 Ca -0.06 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1uhf s ILE 47 Cb -0.04 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.75 1uhf s ILE 47 CO 0.02 -0.23 0.00 0.61 0.00 0.00 0.00 174.94 175.34 1uhf n GLY 48 N 5.21 0.31 0.75 6.18 0.00 -1.26 -0.22 105.19 116.17 1uhf n GLY 48 Ca -0.07 0.20 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 1uhf n GLY 48 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1uhf n ASP 49 N 1.19 -0.02 -4.74 1.61 2.03 -1.26 -5.07 116.55 110.29 1uhf n ASP 49 Ca 0.00 -1.66 -0.29 0.00 0.52 0.00 0.00 54.79 53.37 1uhf n ASP 49 Cb 0.00 -0.06 -0.07 0.00 -0.72 0.00 0.00 41.12 40.28 1uhf n ASP 49 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1uhf s ARG 50 N 0.00 2.73 -0.03 -0.67 0.52 0.69 -5.12 118.95 117.08 1uhf s ARG 50 Ca 0.06 -0.82 -0.04 0.00 -0.52 0.00 0.00 55.73 54.40 1uhf s ARG 50 Cb 0.06 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.93 1uhf s ARG 50 CO -0.03 0.53 0.10 -1.54 0.02 0.00 0.00 175.30 174.37 1uhf s SER 51 N -2.60 -0.05 0.00 0.23 1.04 -1.26 -1.85 113.70 109.21 1uhf s SER 51 Ca 0.28 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.78 1uhf s SER 51 Cb -0.11 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.21 1uhf s SER 51 CO 0.21 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.92 1uhf n GLY 52 N 2.61 -1.18 3.92 7.32 0.00 -1.12 -4.62 105.19 112.11 1uhf n GLY 52 Ca -0.15 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 44.69 1uhf n GLY 52 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1uhf s ILE 53 N -2.35 5.02 0.15 -0.61 -5.25 0.57 -1.46 121.20 117.27 1uhf s ILE 53 Ca 0.00 -1.05 -0.24 0.00 -0.99 0.00 0.00 60.65 58.38 1uhf s ILE 53 Cb 0.00 -3.69 0.07 0.00 2.95 0.00 0.00 42.46 41.79 1uhf s ILE 53 CO 0.00 -0.28 0.68 0.72 -1.79 0.00 0.00 174.94 174.27 1uhf s PHE 54 N -1.96 -0.45 -0.16 1.37 -0.12 -0.83 -1.15 117.98 114.68 1uhf s PHE 54 Ca 0.34 0.21 -0.29 0.00 -0.05 0.00 0.00 56.93 57.14 1uhf s PHE 54 Cb -0.09 0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 42.86 1uhf s PHE 54 CO 0.28 -0.85 1.27 -1.25 -0.05 0.00 0.00 175.22 174.62 1uhf s PRO 55 N -3.65 4.23 0.00 1.99 0.04 -1.26 -2.75 135.00 133.60 1uhf s PRO 55 Ca 0.03 1.68 0.13 0.00 0.04 0.00 0.00 61.00 62.88 1uhf s PRO 55 Cb -0.02 -3.77 0.61 0.00 0.04 0.00 0.00 34.50 31.36 1uhf s PRO 55 CO -0.09 -0.71 1.37 -1.13 0.04 0.00 0.00 177.00 176.48 1uhf n SER 56 N 6.61 0.00 -0.87 6.66 3.41 -1.22 -0.88 113.62 127.33 1uhf n SER 56 Ca 0.14 0.29 0.11 0.00 -0.26 0.00 0.00 58.87 59.15 1uhf n SER 56 Cb 0.45 -0.39 0.28 0.00 -0.26 0.00 0.00 64.21 64.29 1uhf n SER 56 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1uhf n ASN 57 N -1.39 2.60 -0.06 4.04 5.15 -1.26 -3.78 115.26 120.56 1uhf n ASN 57 Ca 0.05 -1.87 0.06 0.00 -0.60 0.00 0.00 54.58 52.22 1uhf n ASN 57 Cb 0.13 -0.18 0.09 0.00 -0.53 0.00 0.00 39.78 39.28 1uhf n ASN 57 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1uhf n TYR 58 N 0.94 0.00 -4.06 1.20 4.02 -0.06 -5.02 117.16 114.18 1uhf n TYR 58 Ca 0.18 -0.79 -0.13 0.00 -0.01 0.00 0.00 57.90 57.14 1uhf n TYR 58 Cb 0.47 -0.11 -0.11 0.00 -0.02 0.00 0.00 39.34 39.57 1uhf n TYR 58 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1uhf s VAL 59 N -2.13 0.54 0.18 -0.72 -7.23 -1.24 -2.24 120.40 107.57 1uhf s VAL 59 Ca 0.20 -1.08 0.07 0.00 -1.81 0.00 0.00 61.98 59.36 1uhf s VAL 59 Cb 0.17 -0.61 -0.04 0.00 0.56 0.00 0.00 36.38 36.46 1uhf s VAL 59 CO 0.02 -0.38 -0.15 -1.59 -0.31 0.00 0.00 175.10 172.69 1uhf s LYS 60 N -1.58 1.26 -0.24 4.82 -2.85 0.57 -4.90 119.74 116.83 1uhf s LYS 60 Ca -0.10 -1.50 -0.29 0.00 -1.00 0.00 0.00 55.97 53.08 1uhf s LYS 60 Cb -0.10 -1.11 -0.01 0.00 -2.06 0.00 0.00 37.83 34.56 1uhf s LYS 60 CO 0.00 0.19 1.32 -1.25 0.10 0.00 0.00 175.35 175.72 1uhf s PRO 61 N -3.35 4.02 -0.59 1.78 0.04 -1.26 0.14 135.00 135.78 1uhf s PRO 61 Ca 0.19 1.44 -0.27 0.00 0.04 0.00 0.00 61.00 62.40 1uhf s PRO 61 Cb -0.02 -3.85 -0.10 0.00 0.04 0.00 0.00 34.50 30.57 1uhf s PRO 61 CO 0.06 -0.99 2.47 1.17 0.04 0.00 0.00 177.00 179.75 1uhf n LYS 62 N 7.10 0.84 -3.71 4.56 4.81 -0.04 -4.84 118.16 126.87 1uhf n LYS 62 Ca 0.15 -0.03 -0.36 0.00 -0.87 0.00 0.00 58.31 57.20 1uhf n LYS 62 Cb 0.46 -3.11 -0.10 0.00 0.02 0.00 0.00 35.03 32.30 1uhf n LYS 62 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1uhf s ASP 63 N 11.64 5.91 -0.04 3.14 1.01 -1.26 -4.97 116.67 132.11 1uhf s ASP 63 Ca 1.05 0.05 -0.40 0.00 0.71 0.00 0.00 52.55 53.96 1uhf s ASP 63 Cb -0.36 -2.06 -0.19 0.00 1.01 0.00 0.00 42.92 41.31 1uhf s ASP 63 CO 0.30 0.05 1.22 -1.54 0.21 0.00 0.00 175.17 175.41 1uhf n SER 64 N 4.37 0.66 0.00 0.27 3.41 -1.26 -4.61 113.62 116.45 1uhf n SER 64 Ca -0.15 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 1uhf n SER 64 Cb 0.52 -1.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 1uhf n SER 64 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uhf n GLY 65 N 2.14 0.42 3.70 5.00 0.00 -1.26 -5.08 105.19 110.10 1uhf n GLY 65 Ca 0.21 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 1uhf n GLY 65 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uhf s PRO 66 N -2.00 4.39 0.16 1.61 0.04 -1.26 -4.94 135.00 133.00 1uhf s PRO 66 Ca 0.00 1.71 -0.29 0.00 0.04 0.00 0.00 61.00 62.46 1uhf s PRO 66 Cb 0.00 -3.47 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 1uhf s PRO 66 CO 0.00 -0.36 1.55 0.77 0.04 0.00 0.00 177.00 179.00 1uhf h SER 67 N 7.19 -1.86 -4.63 6.66 0.02 -1.98 -3.48 113.55 115.48 1uhf h SER 67 Ca -0.38 0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1uhf h SER 67 Cb 1.19 0.82 0.00 0.00 0.14 0.00 0.00 62.40 64.54 1uhf h SER 67 CO 0.85 -0.32 -0.93 -1.20 -1.14 0.00 0.00 176.83 174.09 1uhf n SER 68 N -5.35 -9.20 0.00 3.07 7.64 -1.26 -5.03 113.62 103.49 1uhf n SER 68 Ca 0.01 1.76 0.00 0.00 1.01 0.00 0.00 58.87 61.65 1uhf n SER 68 Cb 0.32 -5.00 0.00 0.00 -1.01 0.00 0.00 64.21 58.52 1uhf n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64