#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys9 s SER 2 N 0.00 -0.15 0.33 1.61 1.04 -1.26 -5.16 113.70 110.11 2ys9 s SER 2 Ca 0.00 -0.27 -0.18 0.00 0.48 0.00 0.00 55.95 55.98 2ys9 s SER 2 Cb 0.00 0.36 0.05 0.00 0.10 0.00 0.00 66.02 66.53 2ys9 s SER 2 CO 0.00 -0.66 0.81 -0.94 0.98 0.00 0.00 173.24 173.43 2ys9 s SER 3 N -2.89 -0.07 0.10 7.02 1.04 -1.26 -5.18 113.70 112.46 2ys9 s SER 3 Ca 0.12 -0.92 0.09 0.00 0.48 0.00 0.00 55.95 55.72 2ys9 s SER 3 Cb 0.01 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.86 2ys9 s SER 3 CO -0.01 -1.49 -0.24 -0.83 0.98 0.00 0.00 173.24 171.65 2ys9 s GLY 4 N -3.06 1.40 0.16 7.32 0.00 -1.26 -5.15 107.32 106.73 2ys9 s GLY 4 Ca 0.15 -1.32 0.10 0.00 0.00 0.00 0.00 44.72 43.64 2ys9 s GLY 4 CO 0.09 -1.29 -0.17 -0.56 0.00 0.00 0.00 173.10 171.17 2ys9 s SER 5 N -1.80 3.90 -0.21 1.64 0.01 -1.26 -5.12 113.70 110.86 2ys9 s SER 5 Ca 0.11 -0.64 -0.04 0.00 1.31 0.00 0.00 55.95 56.68 2ys9 s SER 5 Cb -0.10 -0.53 0.08 0.00 0.21 0.00 0.00 66.02 65.68 2ys9 s SER 5 CO 0.04 0.14 0.15 -0.94 0.41 0.00 0.00 173.24 173.05 2ys9 s SER 6 N -2.51 2.20 0.00 2.44 1.04 -1.26 -5.11 113.70 110.50 2ys9 s SER 6 Ca 0.21 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 56.02 2ys9 s SER 6 Cb -0.09 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.02 2ys9 s SER 6 CO 0.12 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.59 2ys9 n GLY 7 N 5.29 0.64 3.56 7.32 0.00 -1.26 -5.02 105.19 115.72 2ys9 n GLY 7 Ca -0.06 -1.70 -0.27 0.00 0.00 0.00 0.00 46.02 43.99 2ys9 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ys9 s PRO 8 N -2.00 2.55 0.32 1.61 0.04 -1.26 -4.94 135.00 131.32 2ys9 s PRO 8 Ca 0.00 -0.29 -0.22 0.00 0.04 0.00 0.00 61.00 60.53 2ys9 s PRO 8 Cb 0.00 -5.06 -0.15 0.00 0.04 0.00 0.00 34.50 29.32 2ys9 s PRO 8 CO 0.00 -3.38 0.22 1.28 0.04 0.00 0.00 177.00 175.16 2ys9 n LEU 9 N 13.98 -2.19 0.00 -3.56 4.77 -1.26 -4.94 117.00 123.80 2ys9 n LEU 9 Ca 0.40 0.87 -0.16 0.00 -0.03 0.00 0.00 56.01 57.09 2ys9 n LEU 9 Cb 0.47 -0.85 0.13 0.00 -2.33 0.00 0.00 43.42 40.84 2ys9 n LEU 9 CO 0.60 -3.58 0.32 -0.81 -1.33 0.00 0.00 177.39 172.59 2ys9 n PRO 10 N 1.16 -2.16 -2.06 3.23 -0.04 -1.26 -4.99 135.00 128.86 2ys9 n PRO 10 Ca 0.13 -0.92 -0.35 0.00 -0.04 0.00 0.00 63.50 62.31 2ys9 n PRO 10 Cb 0.33 -0.87 0.03 0.00 -0.04 0.00 0.00 33.50 32.95 2ys9 n PRO 10 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2ys9 s ILE 11 N -2.04 2.84 0.30 0.52 -4.36 -1.26 -4.98 121.20 112.22 2ys9 s ILE 11 Ca 0.38 0.51 -0.29 0.00 -0.26 0.00 0.00 60.65 60.99 2ys9 s ILE 11 Cb -0.04 -3.18 -0.10 0.00 1.25 0.00 0.00 42.46 40.39 2ys9 s ILE 11 CO 0.29 -0.12 1.23 -2.16 0.24 0.00 0.00 174.94 174.42 2ys9 s PRO 12 N -3.38 4.46 1.01 0.37 0.04 -1.26 -5.03 135.00 131.21 2ys9 s PRO 12 Ca 0.75 2.06 -0.12 0.00 0.04 0.00 0.00 61.00 63.73 2ys9 s PRO 12 Cb -0.27 -3.12 0.19 0.00 0.04 0.00 0.00 34.50 31.34 2ys9 s PRO 12 CO 0.32 -0.05 1.09 -1.25 0.04 0.00 0.00 177.00 177.15 2ys9 s PRO 13 N -1.57 0.35 0.95 0.56 0.04 -1.26 -5.04 135.00 129.03 2ys9 s PRO 13 Ca 0.48 0.51 -0.12 0.00 0.04 0.00 0.00 61.00 61.90 2ys9 s PRO 13 Cb -0.37 -1.73 0.16 0.00 0.04 0.00 0.00 34.50 32.60 2ys9 s PRO 13 CO 0.48 -2.78 1.09 -1.25 0.04 0.00 0.00 177.00 174.58 2ys9 s PRO 14 N -4.96 0.81 -0.34 0.56 0.04 -1.26 -4.94 135.00 124.91 2ys9 s PRO 14 Ca 0.65 0.67 -0.29 0.00 0.04 0.00 0.00 61.00 62.08 2ys9 s PRO 14 Cb -0.19 -1.77 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 2ys9 s PRO 14 CO 0.58 -2.51 1.70 -1.25 0.04 0.00 0.00 177.00 175.55 2ys9 s PRO 15 N -4.94 3.43 0.88 0.56 0.04 -1.26 -5.00 135.00 128.71 2ys9 s PRO 15 Ca 0.64 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 2ys9 s PRO 15 Cb -0.18 -4.14 0.12 0.00 0.04 0.00 0.00 34.50 30.33 2ys9 s PRO 15 CO 0.57 -1.74 1.09 -1.25 0.04 0.00 0.00 177.00 175.71 2ys9 s PRO 16 N 5.41 1.38 -0.40 0.56 0.04 -1.26 -5.02 135.00 135.71 2ys9 s PRO 16 Ca 0.75 0.86 -0.11 0.00 0.04 0.00 0.00 61.00 62.54 2ys9 s PRO 16 Cb -0.21 -1.82 0.05 0.00 0.04 0.00 0.00 34.50 32.56 2ys9 s PRO 16 CO 0.33 -2.17 0.25 -0.51 0.04 0.00 0.00 177.00 174.94 2ys9 s ASP 17 N -3.42 5.77 0.19 6.66 1.11 -0.46 -4.92 116.67 121.60 2ys9 s ASP 17 Ca 0.63 -1.17 0.23 0.00 0.18 0.00 0.00 52.55 52.42 2ys9 s ASP 17 Cb -0.18 -2.04 0.08 0.00 1.07 0.00 0.00 42.92 41.85 2ys9 s ASP 17 CO 0.57 -0.46 1.11 0.40 1.18 0.00 0.00 175.17 177.97 2ys9 h ILE 18 N 5.91 0.00 -0.67 0.77 1.08 -1.94 -3.36 117.51 119.31 2ys9 h ILE 18 Ca -0.25 -0.88 0.13 0.00 -0.39 0.00 0.00 64.86 63.47 2ys9 h ILE 18 Cb 1.10 1.40 -0.09 0.00 -3.07 0.00 0.00 36.82 36.15 2ys9 h ILE 18 CO 0.72 0.00 0.18 1.56 -0.69 0.00 0.00 178.15 179.92 2ys9 h GLN 19 N 0.00 0.30 -0.83 2.37 1.08 -1.97 0.27 115.11 116.33 2ys9 h GLN 19 Ca 0.00 -0.02 0.20 0.00 -1.45 0.00 0.00 58.65 57.38 2ys9 h GLN 19 Cb 0.94 -0.07 -0.12 0.00 -0.05 0.00 0.00 27.48 28.18 2ys9 h GLN 19 CO 0.00 0.20 0.26 -1.35 -0.95 0.00 0.00 178.83 176.99 2ys9 h PRO 20 N 0.31 0.29 0.23 1.46 0.11 -1.94 0.48 132.00 132.95 2ys9 h PRO 20 Ca 0.36 -0.02 -0.33 0.00 0.11 0.00 0.00 66.00 66.13 2ys9 h PRO 20 Cb 0.56 -0.07 0.03 0.00 0.11 0.00 0.00 31.00 31.64 2ys9 h PRO 20 CO -0.43 0.19 -1.44 -0.07 -0.21 0.00 0.00 178.00 176.05 2ys9 h LEU 21 N 0.30 0.79 -0.30 2.35 3.38 -1.52 -2.69 115.31 117.63 2ys9 h LEU 21 Ca 0.50 -0.84 0.06 0.00 0.09 0.00 0.00 57.88 57.68 2ys9 h LEU 21 Cb 0.92 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 2ys9 h LEU 21 CO -0.55 1.66 -0.04 -0.33 0.09 0.00 0.00 178.44 179.27 2ys9 h GLU 22 N 0.14 0.04 0.14 1.13 5.08 0.23 0.11 114.58 121.46 2ys9 h GLU 22 Ca -0.24 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2ys9 h GLU 22 Cb 2.14 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.38 2ys9 h GLU 22 CO 0.27 0.03 -0.07 0.00 -1.00 0.00 0.00 179.01 178.24 2ys9 h ARG 23 N 0.05 -0.18 -0.95 2.33 2.47 -1.07 -2.98 114.38 114.04 2ys9 h ARG 23 Ca 0.15 0.01 0.23 0.00 -1.26 0.00 0.00 59.98 59.11 2ys9 h ARG 23 Cb 0.21 0.04 -0.07 0.00 -1.65 0.00 0.00 29.97 28.50 2ys9 h ARG 23 CO -0.28 0.21 0.63 -0.92 0.56 0.00 0.00 179.97 180.17 2ys9 h TYR 24 N -0.64 0.52 0.41 3.04 3.20 -1.30 0.46 116.97 122.66 2ys9 h TYR 24 Ca -0.02 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 2ys9 h TYR 24 Cb 0.48 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.60 2ys9 h TYR 24 CO 0.06 0.11 -0.20 2.35 -1.64 0.00 0.00 178.16 178.84 2ys9 h TRP 25 N 0.37 -0.51 0.00 -3.82 2.91 -0.71 0.20 115.95 114.38 2ys9 h TRP 25 Ca 0.51 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.51 2ys9 h TRP 25 Cb 1.34 0.17 0.00 0.00 -0.51 0.00 0.00 29.16 30.16 2ys9 h TRP 25 CO -0.00 -0.22 0.00 0.00 -1.03 0.00 0.00 178.44 177.19 2ys9 n ALA 26 N -2.44 2.42 -0.09 2.65 0.00 -0.57 0.10 120.51 122.59 2ys9 n ALA 26 Ca -0.11 -0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.08 2ys9 n ALA 26 Cb 0.28 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.24 2ys9 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ys9 n ALA 27 N -1.16 0.74 -0.10 0.00 0.00 0.15 -4.74 120.51 115.40 2ys9 n ALA 27 Ca 0.16 -0.66 -0.11 0.00 0.00 0.00 0.00 53.44 52.83 2ys9 n ALA 27 Cb 0.16 -0.02 -0.15 0.00 0.00 0.00 0.00 19.45 19.44 2ys9 n ALA 27 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2ys9 n HIS 28 N -4.50 0.02 -3.70 0.00 8.25 0.67 -5.00 115.22 110.95 2ys9 n HIS 28 Ca -0.18 0.01 -0.26 0.00 -0.26 0.00 0.00 57.72 57.03 2ys9 n HIS 28 Cb 0.48 -1.00 0.06 0.00 1.12 0.00 0.00 29.99 30.65 2ys9 n HIS 28 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2ys9 n GLN 29 N -2.82 -7.14 -3.33 -0.41 6.02 0.12 -4.96 117.38 104.85 2ys9 n GLN 29 Ca -0.34 0.75 0.02 0.00 -0.01 0.00 0.00 57.00 57.42 2ys9 n GLN 29 Cb 1.14 -5.75 -0.04 0.00 1.02 0.00 0.00 30.24 26.61 2ys9 n GLN 29 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2ys9 s GLN 30 N -6.40 0.23 -0.01 -1.09 -2.07 -1.26 -5.08 119.66 103.99 2ys9 s GLN 30 Ca 0.60 0.57 -0.16 0.00 -1.82 0.00 0.00 55.36 54.54 2ys9 s GLN 30 Cb -0.28 0.34 -0.06 0.00 -1.09 0.00 0.00 33.01 31.93 2ys9 s GLN 30 CO 0.76 -0.10 0.45 -1.17 -1.32 0.00 0.00 175.29 173.91 2ys9 s LEU 31 N 2.43 4.45 0.08 2.60 2.96 -1.26 -5.04 118.68 124.90 2ys9 s LEU 31 Ca -0.01 0.99 0.07 0.00 -0.22 0.00 0.00 54.13 54.95 2ys9 s LEU 31 Cb -0.06 -2.66 -0.03 0.00 0.50 0.00 0.00 46.19 43.95 2ys9 s LEU 31 CO -0.17 0.26 -0.18 0.00 -1.32 0.00 0.00 176.35 174.94 2ys9 s ARG 32 N -0.77 1.05 0.62 1.98 1.70 -1.26 -5.01 118.95 117.25 2ys9 s ARG 32 Ca 0.25 -1.04 0.31 0.00 -0.47 0.00 0.00 55.73 54.78 2ys9 s ARG 32 Cb -0.17 -1.20 1.69 0.00 -0.57 0.00 0.00 34.95 34.70 2ys9 s ARG 32 CO 0.14 0.28 2.03 0.93 -1.08 0.00 0.00 175.30 177.60 2ys9 h GLU 33 N 4.31 0.00 0.06 3.89 5.08 -1.99 0.59 114.58 126.52 2ys9 h GLU 33 Ca -0.43 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.69 2ys9 h GLU 33 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2ys9 h GLU 33 CO 0.41 0.00 -1.08 0.00 -1.00 0.00 0.00 179.01 177.33 2ys9 h THR 34 N 0.00 1.58 0.00 1.13 1.03 -2.03 -3.27 112.91 111.35 2ys9 h THR 34 Ca 0.08 -3.11 0.00 0.00 -0.01 0.00 0.00 66.41 63.37 2ys9 h THR 34 Cb 0.64 2.82 0.00 0.00 -1.07 0.00 0.00 68.15 70.54 2ys9 h THR 34 CO -0.00 0.90 -0.85 -0.67 -0.01 0.00 0.00 175.52 174.89 2ys9 n ASP 35 N -3.49 0.70 0.40 0.00 2.03 0.49 -4.10 116.55 112.58 2ys9 n ASP 35 Ca -0.04 -0.50 -0.19 0.00 0.52 0.00 0.00 54.79 54.58 2ys9 n ASP 35 Cb 0.95 0.70 -0.09 0.00 -0.72 0.00 0.00 41.12 41.96 2ys9 n ASP 35 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2ys9 h ILE 36 N 0.00 0.12 0.00 5.18 2.04 -0.02 0.15 117.51 124.98 2ys9 h ILE 36 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2ys9 h ILE 36 Cb 0.58 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2ys9 h ILE 36 CO 0.00 0.00 -0.21 1.55 0.00 0.00 0.00 178.15 179.49 2ys9 h PRO 37 N -1.09 0.00 -0.04 2.37 0.13 -1.77 -1.98 132.00 129.63 2ys9 h PRO 37 Ca -0.09 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.90 2ys9 h PRO 37 Cb 0.87 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.01 2ys9 h PRO 37 CO 0.10 0.21 -0.50 0.37 -0.23 0.00 0.00 178.00 177.94 2ys9 h GLN 38 N 0.00 0.40 -0.04 0.86 5.75 -1.65 -2.97 115.11 117.47 2ys9 h GLN 38 Ca -0.00 -0.39 -0.02 0.00 -0.15 0.00 0.00 58.65 58.10 2ys9 h GLN 38 Cb 0.65 0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.30 2ys9 h GLN 38 CO 0.03 1.04 -0.04 -0.07 -2.65 0.00 0.00 178.83 177.13 2ys9 h LEU 39 N -0.09 0.10 -0.75 -2.39 3.38 -0.64 -3.13 115.31 111.79 2ys9 h LEU 39 Ca -0.05 -0.51 0.15 0.00 0.09 0.00 0.00 57.88 57.56 2ys9 h LEU 39 Cb 1.19 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.81 2ys9 h LEU 39 CO 0.10 0.60 0.24 -1.28 0.09 0.00 0.00 178.44 178.19 2ys9 h SER 40 N -0.39 0.15 -0.12 -0.43 0.87 -1.48 0.43 113.55 112.57 2ys9 h SER 40 Ca 0.00 0.13 0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2ys9 h SER 40 Cb 0.57 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 2ys9 h SER 40 CO 0.01 0.03 0.08 1.56 -0.53 0.00 0.00 176.83 177.98 2ys9 h GLN 41 N 0.35 0.11 0.20 2.24 1.08 -1.53 0.26 115.11 117.82 2ys9 h GLN 41 Ca 0.42 -0.01 -0.32 0.00 -1.45 0.00 0.00 58.65 57.30 2ys9 h GLN 41 Cb 0.69 -0.02 0.02 0.00 -0.05 0.00 0.00 27.48 28.11 2ys9 h GLN 41 CO -0.46 0.07 -1.48 0.00 -0.95 0.00 0.00 178.83 176.01 2ys9 h ALA 42 N 1.93 -0.00 0.00 3.87 0.00 -0.30 -3.28 119.26 121.48 2ys9 h ALA 42 Ca 0.05 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 54.00 2ys9 h ALA 42 Cb 0.07 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2ys9 h ALA 42 CO -0.01 0.78 0.00 0.43 0.00 0.00 0.00 179.25 180.45 2ys9 n SER 43 N -3.76 0.00 -2.88 0.00 7.64 0.84 -4.60 113.62 110.87 2ys9 n SER 43 Ca -0.20 0.01 -0.20 0.00 1.01 0.00 0.00 58.87 59.48 2ys9 n SER 43 Cb 1.03 -0.32 0.05 0.00 -1.01 0.00 0.00 64.21 63.96 2ys9 n SER 43 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2ys9 n ARG 44 N -1.32 -5.51 -4.65 1.43 5.12 0.80 -1.35 116.66 111.19 2ys9 n ARG 44 Ca 0.11 0.75 -0.29 0.00 -1.93 0.00 0.00 57.85 56.50 2ys9 n ARG 44 Cb 0.23 -5.40 -0.09 0.00 -1.16 0.00 0.00 32.46 26.03 2ys9 n ARG 44 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2ys9 s LEU 45 N -6.11 2.48 0.23 0.55 1.43 -0.56 -4.83 118.68 111.88 2ys9 s LEU 45 Ca 0.38 -1.51 -0.19 0.00 -1.03 0.00 0.00 54.13 51.78 2ys9 s LEU 45 Cb -0.17 -0.70 -0.08 0.00 0.03 0.00 0.00 46.19 45.27 2ys9 s LEU 45 CO 0.47 -0.67 0.72 -0.44 0.23 0.00 0.00 176.35 176.66 2ys9 s SER 46 N -3.74 7.03 0.39 2.29 0.01 -1.26 -4.48 113.70 113.94 2ys9 s SER 46 Ca 0.23 1.40 0.27 0.00 1.31 0.00 0.00 55.95 59.16 2ys9 s SER 46 Cb 0.06 -2.41 1.35 0.00 0.21 0.00 0.00 66.02 65.22 2ys9 s SER 46 CO 0.11 0.01 1.46 0.41 0.41 0.00 0.00 173.24 175.64 2ys9 n THR 47 N 0.63 -0.28 -0.03 1.44 -1.04 -1.26 0.12 114.28 113.86 2ys9 n THR 47 Ca -0.02 1.74 -0.13 0.00 -2.04 0.00 0.00 64.05 63.60 2ys9 n THR 47 Cb 0.51 -2.84 -0.09 0.00 -1.82 0.00 0.00 70.33 66.10 2ys9 n THR 47 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2ys9 h GLN 48 N 0.00 0.15 -0.76 -2.82 5.75 -1.97 -3.05 115.11 112.41 2ys9 h GLN 48 Ca 0.81 -0.08 0.13 0.00 -0.15 0.00 0.00 58.65 59.36 2ys9 h GLN 48 Cb 2.48 0.00 -0.14 0.00 1.07 0.00 0.00 27.48 30.90 2ys9 h GLN 48 CO -0.51 0.60 -0.32 1.96 -2.65 0.00 0.00 178.83 177.91 2ys9 h GLN 49 N -0.28 -0.07 -0.68 1.69 1.08 0.58 0.27 115.11 117.68 2ys9 h GLN 49 Ca 0.01 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.26 2ys9 h GLN 49 Cb 0.57 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.97 2ys9 h GLN 49 CO 0.02 -0.05 0.40 0.28 -0.95 0.00 0.00 178.83 178.53 2ys9 h VAL 50 N -0.07 1.03 -0.28 -0.54 2.07 -1.55 0.16 116.25 117.07 2ys9 h VAL 50 Ca 0.31 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.61 2ys9 h VAL 50 Cb 0.58 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 2ys9 h VAL 50 CO -0.81 0.14 0.02 -0.07 0.02 0.00 0.00 177.57 176.88 2ys9 h LEU 51 N 0.77 -0.06 -0.45 2.57 3.38 -0.43 -1.48 115.31 119.61 2ys9 h LEU 51 Ca 0.29 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 58.19 2ys9 h LEU 51 Cb 0.11 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2ys9 h LEU 51 CO -0.15 0.00 -0.19 -0.78 0.09 0.00 0.00 178.44 177.41 2ys9 h ASP 52 N 0.12 0.95 0.13 -0.43 3.58 -0.70 -0.22 116.42 119.84 2ys9 h ASP 52 Ca 0.13 -0.39 0.02 0.00 0.42 0.00 0.00 57.03 57.21 2ys9 h ASP 52 Cb 0.16 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 40.90 2ys9 h ASP 52 CO -0.20 1.13 -0.43 -0.25 -2.88 0.00 0.00 179.24 176.62 2ys9 h TRP 53 N 0.77 -1.20 -0.36 0.28 7.01 -0.22 0.10 115.95 122.33 2ys9 h TRP 53 Ca 0.10 0.03 -0.12 0.00 2.11 0.00 0.00 58.89 61.01 2ys9 h TRP 53 Cb 0.76 0.51 -0.01 0.00 -2.10 0.00 0.00 29.16 28.32 2ys9 h TRP 53 CO 0.05 -0.52 -0.28 0.74 -2.79 0.00 0.00 178.44 175.64 2ys9 h PHE 54 N -0.67 0.86 -0.76 2.65 0.04 -1.32 -3.01 116.94 114.74 2ys9 h PHE 54 Ca 0.02 -0.21 0.07 0.00 2.80 0.00 0.00 57.97 60.65 2ys9 h PHE 54 Cb 0.69 -0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.58 2ys9 h PHE 54 CO -0.37 0.94 0.44 -0.44 -0.60 0.00 0.00 178.31 178.28 2ys9 h ASP 55 N 0.64 0.64 -0.34 2.17 5.19 -0.56 -0.52 116.42 123.65 2ys9 h ASP 55 Ca 0.08 0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.46 2ys9 h ASP 55 Cb 0.80 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.20 2ys9 h ASP 55 CO 0.07 0.40 -0.00 -1.28 -3.12 0.00 0.00 179.24 175.30 2ys9 h SER 56 N 0.77 0.66 -0.12 6.45 0.87 -0.69 -3.02 113.55 118.47 2ys9 h SER 56 Ca 0.35 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.73 2ys9 h SER 56 Cb 0.25 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 2ys9 h SER 56 CO -0.21 0.74 -0.03 0.03 -0.53 0.00 0.00 176.83 176.83 2ys9 h ARG 57 N 0.66 0.23 -6.80 2.24 2.47 -1.13 -3.43 114.38 108.62 2ys9 h ARG 57 Ca 0.13 -0.09 -0.50 0.00 -1.26 0.00 0.00 59.98 58.26 2ys9 h ARG 57 Cb 0.41 -0.01 0.01 0.00 -1.65 0.00 0.00 29.97 28.73 2ys9 h ARG 57 CO 0.02 0.53 0.45 -0.48 0.56 0.00 0.00 179.97 181.05 2ys9 s LEU 58 N -9.41 4.56 1.15 3.04 0.05 -0.32 -5.04 118.68 112.71 2ys9 s LEU 58 Ca -0.14 2.21 -0.17 0.00 0.05 0.00 0.00 54.13 56.07 2ys9 s LEU 58 Cb 0.05 -3.64 0.26 0.00 -2.05 0.00 0.00 46.19 40.81 2ys9 s LEU 58 CO 0.72 -0.10 1.10 -2.16 -0.55 0.00 0.00 176.35 175.36 2ys9 s PRO 59 N -1.43 -0.77 0.03 1.48 0.04 -1.26 -4.86 135.00 128.23 2ys9 s PRO 59 Ca 0.44 0.09 0.01 0.00 0.04 0.00 0.00 61.00 61.59 2ys9 s PRO 59 Cb -0.31 -1.63 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 2ys9 s PRO 59 CO 0.39 -3.44 -0.05 -0.65 0.04 0.00 0.00 177.00 173.28 2ys9 s GLN 60 N -5.28 0.42 0.86 4.56 -0.21 -1.26 -5.08 119.66 113.67 2ys9 s GLN 60 Ca 0.69 -0.70 -0.11 0.00 0.02 0.00 0.00 55.36 55.26 2ys9 s GLN 60 Cb -0.12 -0.08 0.10 0.00 1.00 0.00 0.00 33.01 33.91 2ys9 s GLN 60 CO 0.57 -0.00 1.09 -1.25 -2.12 0.00 0.00 175.29 173.57 2ys9 s PRO 61 N -1.59 1.59 0.14 2.91 0.04 -1.26 -5.07 135.00 131.75 2ys9 s PRO 61 Ca -0.12 0.94 -0.25 0.00 0.04 0.00 0.00 61.00 61.60 2ys9 s PRO 61 Cb -0.09 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.68 2ys9 s PRO 61 CO -0.01 -2.05 0.97 0.00 0.04 0.00 0.00 177.00 175.96 2ys9 s ALA 62 N -2.92 -1.69 -0.43 8.56 0.00 -1.26 -5.05 121.76 118.97 2ys9 s ALA 62 Ca 0.63 0.19 0.04 0.00 0.00 0.00 0.00 51.96 52.82 2ys9 s ALA 62 Cb -0.18 0.62 0.45 0.00 0.00 0.00 0.00 23.12 24.01 2ys9 s ALA 62 CO 0.57 -1.03 1.45 -0.85 0.00 0.00 0.00 175.76 175.90 2ys9 n GLU 63 N -0.46 3.31 -4.06 0.00 0.28 -1.26 -5.02 120.64 113.44 2ys9 n GLU 63 Ca -0.06 -3.93 -0.33 0.00 -0.16 0.00 0.00 57.16 52.68 2ys9 n GLU 63 Cb 0.61 -2.28 -0.07 0.00 1.43 0.00 0.00 31.44 31.13 2ys9 n GLU 63 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2ys9 s VAL 64 N -4.76 4.92 -0.27 3.84 -7.23 -1.26 -5.03 120.40 110.61 2ys9 s VAL 64 Ca 0.55 -0.30 -0.41 0.00 -1.81 0.00 0.00 61.98 60.01 2ys9 s VAL 64 Cb 0.44 -3.24 -0.16 0.00 0.56 0.00 0.00 36.38 33.97 2ys9 s VAL 64 CO -0.01 0.38 1.68 -1.20 -0.31 0.00 0.00 175.10 175.64 2ys9 n SER 65 N 1.25 2.14 -4.56 4.85 7.64 -1.26 -4.84 113.62 118.84 2ys9 n SER 65 Ca -0.13 1.09 -0.40 0.00 1.01 0.00 0.00 58.87 60.44 2ys9 n SER 65 Cb 0.53 -1.11 0.03 0.00 -1.01 0.00 0.00 64.21 62.65 2ys9 n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ys9 n GLY 66 N 3.99 -0.70 3.57 0.23 0.00 -1.26 -4.98 105.19 106.05 2ys9 n GLY 66 Ca 0.26 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.98 2ys9 n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ys9 s PRO 67 N -2.13 -1.61 -1.25 1.61 0.04 -1.26 -4.91 135.00 125.50 2ys9 s PRO 67 Ca 0.67 -0.20 -0.16 0.00 0.04 0.00 0.00 61.00 61.34 2ys9 s PRO 67 Cb -0.51 -1.56 0.11 0.00 0.04 0.00 0.00 34.50 32.58 2ys9 s PRO 67 CO 0.54 -3.94 1.59 -1.12 0.04 0.00 0.00 177.00 174.12 2ys9 s SER 68 N -4.00 6.92 -0.65 6.66 0.01 -1.26 -4.95 113.70 116.43 2ys9 s SER 68 Ca 0.72 -2.64 -0.27 0.00 1.31 0.00 0.00 55.95 55.07 2ys9 s SER 68 Cb -0.07 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.67 2ys9 s SER 68 CO 0.56 -1.00 1.39 -0.94 0.41 0.00 0.00 173.24 173.66 2ys9 s SER 69 N 3.65 6.06 0.00 2.44 1.04 -1.26 -5.37 113.70 120.26 2ys9 s SER 69 Ca 0.49 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.87 2ys9 s SER 69 Cb 0.01 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2ys9 s SER 69 CO 0.04 -1.83 0.00 0.61 0.98 0.00 0.00 173.24 173.04