#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys9 n SER 2 N 0.00 1.44 -4.71 1.61 2.88 -1.26 -4.98 113.62 108.61 2ys9 n SER 2 Ca 0.00 0.24 -0.42 0.00 -1.33 0.00 0.00 58.87 57.36 2ys9 n SER 2 Cb 0.00 -0.58 -0.03 0.00 -0.75 0.00 0.00 64.21 62.85 2ys9 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ys9 s SER 3 N -6.49 6.67 0.00 -3.46 0.15 -1.26 -4.97 113.70 104.34 2ys9 s SER 3 Ca -0.25 2.50 0.00 0.00 0.70 0.00 0.00 55.95 58.90 2ys9 s SER 3 Cb 0.08 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2ys9 s SER 3 CO 0.32 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.60 2ys9 n GLY 4 N 3.69 2.68 3.20 9.45 0.00 -1.26 -5.14 105.19 117.81 2ys9 n GLY 4 Ca 0.13 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2ys9 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ys9 s SER 5 N 1.00 2.70 -0.21 1.61 1.04 -1.26 -5.04 113.70 113.55 2ys9 s SER 5 Ca 0.00 -0.46 -0.17 0.00 0.48 0.00 0.00 55.95 55.81 2ys9 s SER 5 Cb 0.00 -0.88 -0.12 0.00 0.10 0.00 0.00 66.02 65.12 2ys9 s SER 5 CO 0.00 0.19 -0.07 -1.20 0.98 0.00 0.00 173.24 173.13 2ys9 n SER 6 N 3.18 1.88 0.00 7.02 7.64 -1.26 -4.95 113.62 127.13 2ys9 n SER 6 Ca -0.18 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2ys9 n SER 6 Cb 0.52 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 2ys9 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ys9 n GLY 7 N 1.44 1.12 3.59 0.23 0.00 -1.26 -4.34 105.19 105.97 2ys9 n GLY 7 Ca -0.29 0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 3.31 0.34 1.61 0.04 -1.26 -4.99 135.00 134.05 2ys9 s PRO 8 Ca 0.00 1.23 -0.19 0.00 0.04 0.00 0.00 61.00 62.08 2ys9 s PRO 8 Cb 0.00 -4.18 -0.10 0.00 0.04 0.00 0.00 34.50 30.27 2ys9 s PRO 8 CO 0.00 -1.88 0.82 -0.48 0.04 0.00 0.00 177.00 175.50 2ys9 s LEU 9 N 6.79 4.11 0.74 -3.56 2.34 -1.26 -5.05 118.68 122.78 2ys9 s LEU 9 Ca 0.74 1.50 -0.12 0.00 0.06 0.00 0.00 54.13 56.31 2ys9 s LEU 9 Cb -0.19 -4.12 0.04 0.00 -0.56 0.00 0.00 46.19 41.35 2ys9 s LEU 9 CO 0.32 -0.19 1.10 -2.16 -1.06 0.00 0.00 176.35 174.36 2ys9 s PRO 10 N -2.74 2.41 0.63 1.48 0.04 -1.26 -4.99 135.00 130.57 2ys9 s PRO 10 Ca 0.54 1.24 -0.19 0.00 0.04 0.00 0.00 61.00 62.63 2ys9 s PRO 10 Cb -0.12 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 2ys9 s PRO 10 CO 0.17 -1.53 1.31 0.96 0.04 0.00 0.00 177.00 177.96 2ys9 s ILE 11 N -2.73 2.01 0.46 0.56 -4.36 -1.26 -4.96 121.20 110.91 2ys9 s ILE 11 Ca 0.63 0.01 -0.23 0.00 -0.26 0.00 0.00 60.65 60.79 2ys9 s ILE 11 Cb -0.18 -3.00 -0.07 0.00 1.25 0.00 0.00 42.46 40.45 2ys9 s ILE 11 CO 0.52 -0.00 1.17 -2.16 0.24 0.00 0.00 174.94 174.70 2ys9 s PRO 12 N -3.28 3.77 1.01 0.37 0.04 -1.26 -5.03 135.00 130.62 2ys9 s PRO 12 Ca 0.80 1.78 -0.12 0.00 0.04 0.00 0.00 61.00 63.50 2ys9 s PRO 12 Cb -0.39 -2.42 0.19 0.00 0.04 0.00 0.00 34.50 31.93 2ys9 s PRO 12 CO 0.42 -0.54 1.09 -1.25 0.04 0.00 0.00 177.00 176.76 2ys9 s PRO 13 N -2.67 0.35 0.96 0.56 0.04 -1.26 -5.04 135.00 127.93 2ys9 s PRO 13 Ca 0.63 0.49 -0.12 0.00 0.04 0.00 0.00 61.00 62.04 2ys9 s PRO 13 Cb -0.29 -1.73 0.17 0.00 0.04 0.00 0.00 34.50 32.69 2ys9 s PRO 13 CO 0.35 -2.78 1.09 -1.25 0.04 0.00 0.00 177.00 174.45 2ys9 s PRO 14 N -4.97 0.74 -0.34 0.56 0.04 -1.26 -4.94 135.00 124.84 2ys9 s PRO 14 Ca 0.65 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 62.05 2ys9 s PRO 14 Cb -0.19 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2ys9 s PRO 14 CO 0.58 -2.55 1.69 -1.25 0.04 0.00 0.00 177.00 175.51 2ys9 s PRO 15 N -4.95 3.43 0.83 0.56 0.04 -1.26 -4.99 135.00 128.66 2ys9 s PRO 15 Ca 0.65 1.33 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 2ys9 s PRO 15 Cb -0.18 -4.14 0.09 0.00 0.04 0.00 0.00 34.50 30.31 2ys9 s PRO 15 CO 0.57 -1.74 1.09 -1.25 0.04 0.00 0.00 177.00 175.72 2ys9 s PRO 16 N 5.40 1.77 -0.35 0.56 0.04 -1.26 -5.02 135.00 136.14 2ys9 s PRO 16 Ca 0.75 1.01 -0.11 0.00 0.04 0.00 0.00 61.00 62.69 2ys9 s PRO 16 Cb -0.21 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.49 2ys9 s PRO 16 CO 0.33 -1.94 0.20 -0.51 0.04 0.00 0.00 177.00 175.12 2ys9 s ASP 17 N -3.40 5.73 0.05 6.66 1.01 -0.83 -4.92 116.67 120.97 2ys9 s ASP 17 Ca 0.62 -0.78 0.23 0.00 0.71 0.00 0.00 52.55 53.33 2ys9 s ASP 17 Cb -0.18 -2.04 0.17 0.00 1.01 0.00 0.00 42.92 41.89 2ys9 s ASP 17 CO 0.56 -0.32 1.15 -0.38 0.21 0.00 0.00 175.17 176.40 2ys9 n ILE 18 N 5.01 0.17 -0.33 0.77 2.08 -1.26 -4.04 119.36 121.77 2ys9 n ILE 18 Ca -0.12 -0.20 -0.03 0.00 0.56 0.00 0.00 62.75 62.96 2ys9 n ILE 18 Cb 0.47 0.19 0.09 0.00 -0.75 0.00 0.00 39.64 39.64 2ys9 n ILE 18 CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 2ys9 h GLN 19 N 0.00 1.16 -0.88 0.38 7.50 -1.97 -1.41 115.11 119.88 2ys9 h GLN 19 Ca 0.00 -0.07 0.21 0.00 0.50 0.00 0.00 58.65 59.30 2ys9 h GLN 19 Cb 0.68 -0.26 -0.12 0.00 0.05 0.00 0.00 27.48 27.83 2ys9 h GLN 19 CO 0.00 0.77 0.37 -1.35 -1.50 0.00 0.00 178.83 177.11 2ys9 h PRO 20 N 1.19 0.37 0.19 1.46 0.11 -1.94 0.23 132.00 133.61 2ys9 h PRO 20 Ca 0.33 -0.02 -0.33 0.00 0.11 0.00 0.00 66.00 66.09 2ys9 h PRO 20 Cb -0.11 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 30.93 2ys9 h PRO 20 CO -0.08 0.25 -1.58 -0.07 -0.21 0.00 0.00 178.00 176.31 2ys9 h LEU 21 N 0.38 0.62 -0.54 2.35 3.38 -1.74 -3.08 115.31 116.68 2ys9 h LEU 21 Ca 0.55 -0.79 0.08 0.00 0.09 0.00 0.00 57.88 57.81 2ys9 h LEU 21 Cb 1.03 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.51 2ys9 h LEU 21 CO -0.53 1.65 0.17 -0.33 0.09 0.00 0.00 178.44 179.48 2ys9 h GLU 22 N 0.11 0.32 0.49 1.13 5.08 -0.14 0.33 114.58 121.90 2ys9 h GLU 22 Ca -0.28 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.04 2ys9 h GLU 22 Cb 2.09 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.28 2ys9 h GLU 22 CO 0.21 0.21 -0.24 0.00 -1.00 0.00 0.00 179.01 178.19 2ys9 h ARG 23 N 0.33 -0.64 -0.99 2.33 3.08 -1.13 -2.84 114.38 114.52 2ys9 h ARG 23 Ca 0.27 0.04 0.20 0.00 0.07 0.00 0.00 59.98 60.56 2ys9 h ARG 23 Cb 0.34 0.14 -0.11 0.00 0.08 0.00 0.00 29.97 30.42 2ys9 h ARG 23 CO -0.30 -0.35 0.59 -0.92 -1.07 0.00 0.00 179.97 177.92 2ys9 h TYR 24 N -1.06 1.03 0.29 3.04 3.20 -1.42 0.36 116.97 122.41 2ys9 h TYR 24 Ca -0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.84 2ys9 h TYR 24 Cb 0.58 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2ys9 h TYR 24 CO 0.01 0.20 -0.28 2.35 -1.64 0.00 0.00 178.16 178.80 2ys9 h TRP 25 N 0.72 -0.75 0.00 -3.82 2.91 -0.33 0.21 115.95 114.89 2ys9 h TRP 25 Ca 0.58 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.60 2ys9 h TRP 25 Cb 0.93 0.29 0.00 0.00 -0.51 0.00 0.00 29.16 29.87 2ys9 h TRP 25 CO -0.02 -0.41 0.00 0.00 -1.03 0.00 0.00 178.44 176.99 2ys9 n ALA 26 N -2.56 2.33 -0.07 2.65 0.00 -0.63 0.07 120.51 122.29 2ys9 n ALA 26 Ca -0.09 -0.13 -0.08 0.00 0.00 0.00 0.00 53.44 53.15 2ys9 n ALA 26 Cb 0.31 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 2ys9 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ys9 h ALA 27 N 3.28 0.05 0.00 0.00 0.00 0.81 -3.43 119.26 119.96 2ys9 h ALA 27 Ca 0.00 -0.60 -0.32 0.00 0.00 0.00 0.00 54.91 54.00 2ys9 h ALA 27 Cb 0.22 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 2ys9 h ALA 27 CO 0.00 0.49 -2.20 0.72 0.00 0.00 0.00 179.25 178.26 2ys9 n HIS 28 N -4.60 0.00 -2.52 0.00 8.25 0.63 -5.01 115.22 111.98 2ys9 n HIS 28 Ca -0.11 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.17 2ys9 n HIS 28 Cb 0.32 -0.84 0.00 0.00 1.12 0.00 0.00 29.99 30.60 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 -2.86 -2.31 -3.69 -0.41 6.02 0.11 -4.99 117.38 109.25 2ys9 n GLN 29 Ca -0.33 0.82 -0.10 0.00 -0.01 0.00 0.00 57.00 57.38 2ys9 n GLN 29 Cb 0.99 -5.31 -0.11 0.00 1.02 0.00 0.00 30.24 26.83 2ys9 n GLN 29 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2ys9 s GLN 30 N -5.09 0.36 -0.05 -1.09 -0.21 -1.26 -5.07 119.66 107.26 2ys9 s GLN 30 Ca 0.09 0.81 -0.20 0.00 0.02 0.00 0.00 55.36 56.08 2ys9 s GLN 30 Cb -0.04 0.03 -0.05 0.00 1.00 0.00 0.00 33.01 33.95 2ys9 s GLN 30 CO 0.11 -0.18 0.58 -1.17 -2.12 0.00 0.00 175.29 172.51 2ys9 s LEU 31 N 1.62 4.36 -0.06 2.90 2.96 -1.26 -5.02 118.68 124.17 2ys9 s LEU 31 Ca -0.08 1.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.92 2ys9 s LEU 31 Cb -0.09 -2.88 0.01 0.00 0.50 0.00 0.00 46.19 43.73 2ys9 s LEU 31 CO -0.12 0.04 -0.12 -0.13 -1.32 0.00 0.00 176.35 174.70 2ys9 s ARG 32 N 0.20 1.63 0.62 1.98 0.52 -1.26 -5.00 118.95 117.64 2ys9 s ARG 32 Ca 0.31 -0.40 0.24 0.00 -0.52 0.00 0.00 55.73 55.36 2ys9 s ARG 32 Cb -0.17 -1.36 1.08 0.00 0.52 0.00 0.00 34.95 35.02 2ys9 s ARG 32 CO 0.15 0.03 1.55 0.93 0.02 0.00 0.00 175.30 177.98 2ys9 h GLU 33 N 6.95 0.00 0.14 3.54 5.08 -1.99 1.07 114.58 129.37 2ys9 h GLU 33 Ca -0.31 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 57.76 2ys9 h GLU 33 Cb 1.18 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.45 2ys9 h GLU 33 CO 0.47 0.00 -1.26 0.00 -1.00 0.00 0.00 179.01 177.22 2ys9 h THR 34 N 0.00 1.39 0.00 1.13 1.03 -2.02 -3.27 112.91 111.18 2ys9 h THR 34 Ca 0.26 -2.78 0.00 0.00 -0.01 0.00 0.00 66.41 63.88 2ys9 h THR 34 Cb 1.89 2.85 0.00 0.00 -1.07 0.00 0.00 68.15 71.82 2ys9 h THR 34 CO -0.00 0.82 -0.47 -0.90 -0.01 0.00 0.00 175.52 174.96 2ys9 n ASP 35 N -3.66 0.66 0.27 0.00 5.68 0.34 -3.79 116.55 116.05 2ys9 n ASP 35 Ca -0.11 0.18 -0.17 0.00 -0.50 0.00 0.00 54.79 54.18 2ys9 n ASP 35 Cb 1.01 -0.03 -0.09 0.00 -1.14 0.00 0.00 41.12 40.87 2ys9 n ASP 35 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 2ys9 h ILE 36 N 0.00 0.11 -0.39 2.12 2.04 -0.60 0.19 117.51 120.98 2ys9 h ILE 36 Ca 0.00 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 65.70 2ys9 h ILE 36 Cb 0.70 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 2ys9 h ILE 36 CO 0.00 0.00 -0.38 1.55 0.00 0.00 0.00 178.15 179.32 2ys9 h PRO 37 N -0.91 0.95 -0.81 2.37 0.13 -1.73 -1.06 132.00 130.94 2ys9 h PRO 37 Ca -0.05 -0.50 -0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2ys9 h PRO 37 Cb 0.80 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 31.91 2ys9 h PRO 37 CO -0.06 1.16 0.50 0.37 -0.23 0.00 0.00 178.00 179.74 2ys9 h GLN 38 N 0.77 1.09 -0.04 0.86 5.75 -1.63 -1.40 115.11 120.50 2ys9 h GLN 38 Ca 0.06 -0.09 -0.15 0.00 -0.15 0.00 0.00 58.65 58.33 2ys9 h GLN 38 Cb 0.98 -0.23 0.01 0.00 1.07 0.00 0.00 27.48 29.31 2ys9 h GLN 38 CO 0.10 0.75 -0.54 -0.07 -2.65 0.00 0.00 178.83 176.42 2ys9 h LEU 39 N 1.10 0.55 -0.81 -2.39 3.38 -0.59 -3.16 115.31 113.39 2ys9 h LEU 39 Ca 0.29 -0.71 0.11 0.00 0.09 0.00 0.00 57.88 57.66 2ys9 h LEU 39 Cb -0.07 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.44 2ys9 h LEU 39 CO -0.06 1.18 0.45 -1.28 0.09 0.00 0.00 178.44 178.82 2ys9 h SER 40 N -0.04 0.61 0.25 -0.43 0.87 -1.01 0.14 113.55 113.94 2ys9 h SER 40 Ca -0.06 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 2ys9 h SER 40 Cb 1.22 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 2ys9 h SER 40 CO 0.11 0.33 -0.18 1.56 -0.53 0.00 0.00 176.83 178.12 2ys9 h GLN 41 N 0.72 0.00 0.06 2.24 1.08 -1.31 -0.73 115.11 117.19 2ys9 h GLN 41 Ca 0.41 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.51 2ys9 h GLN 41 Cb 0.43 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.87 2ys9 h GLN 41 CO -0.28 0.18 -0.44 0.00 -0.95 0.00 0.00 178.83 177.34 2ys9 h ALA 42 N 1.82 -0.03 0.00 3.87 0.00 -0.80 -3.24 119.26 120.88 2ys9 h ALA 42 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2ys9 h ALA 42 Cb 0.35 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2ys9 h ALA 42 CO 0.02 0.20 0.00 0.43 0.00 0.00 0.00 179.25 179.90 2ys9 n SER 43 N -4.36 0.00 -2.82 0.00 7.64 0.07 -4.63 113.62 109.52 2ys9 n SER 43 Ca -0.12 -0.39 -0.21 0.00 1.01 0.00 0.00 58.87 59.16 2ys9 n SER 43 Cb 0.65 -0.12 0.03 0.00 -1.01 0.00 0.00 64.21 63.76 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 -1.12 -4.49 -4.58 1.43 5.12 -0.49 -1.97 116.66 110.56 2ys9 n ARG 44 Ca 0.14 0.87 -0.31 0.00 -1.93 0.00 0.00 57.85 56.62 2ys9 n ARG 44 Cb 0.12 -5.62 -0.07 0.00 -1.16 0.00 0.00 32.46 25.72 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 -6.30 2.51 0.20 0.55 1.43 -0.40 -4.87 118.68 111.79 2ys9 s LEU 45 Ca 0.27 -1.51 -0.15 0.00 -1.03 0.00 0.00 54.13 51.70 2ys9 s LEU 45 Cb -0.12 -0.87 -0.08 0.00 0.03 0.00 0.00 46.19 45.16 2ys9 s LEU 45 CO 0.34 -0.79 0.62 -0.94 0.23 0.00 0.00 176.35 175.81 2ys9 s SER 46 N -3.90 6.86 0.42 2.29 1.04 -1.26 -4.44 113.70 114.71 2ys9 s SER 46 Ca 0.17 1.18 0.29 0.00 0.48 0.00 0.00 55.95 58.07 2ys9 s SER 46 Cb 0.03 -2.33 1.44 0.00 0.10 0.00 0.00 66.02 65.26 2ys9 s SER 46 CO 0.09 0.02 1.59 0.74 0.98 0.00 0.00 173.24 176.66 2ys9 h THR 47 N 2.58 0.03 -0.13 2.02 2.02 -1.92 1.36 112.91 118.86 2ys9 h THR 47 Ca -0.48 -0.01 -0.22 0.00 0.77 0.00 0.00 66.41 66.47 2ys9 h THR 47 Cb 1.19 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2ys9 h THR 47 CO 0.66 0.00 -0.80 -0.61 0.37 0.00 0.00 175.52 175.14 2ys9 h GLN 48 N 0.02 0.73 -0.37 6.66 5.75 -1.97 -3.13 115.11 122.80 2ys9 h GLN 48 Ca 0.86 -0.62 0.08 0.00 -0.15 0.00 0.00 58.65 58.83 2ys9 h GLN 48 Cb 2.63 0.13 -0.08 0.00 1.07 0.00 0.00 27.48 31.24 2ys9 h GLN 48 CO -0.54 1.22 -0.17 1.96 -2.65 0.00 0.00 178.83 178.66 2ys9 h GLN 49 N 0.49 -0.10 -0.96 1.69 1.08 0.14 -0.81 115.11 116.65 2ys9 h GLN 49 Ca -0.06 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2ys9 h GLN 49 Cb 1.43 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 28.83 2ys9 h GLN 49 CO 0.16 -0.06 0.63 0.28 -0.95 0.00 0.00 178.83 178.89 2ys9 h VAL 50 N -0.10 1.25 -0.97 -0.54 2.07 -1.54 0.12 116.25 116.54 2ys9 h VAL 50 Ca 0.18 -0.45 0.06 0.00 0.82 0.00 0.00 66.70 67.31 2ys9 h VAL 50 Cb 0.38 -0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 29.92 2ys9 h VAL 50 CO -0.43 0.24 0.63 -0.07 0.02 0.00 0.00 177.57 177.95 2ys9 h LEU 51 N 1.30 1.01 0.02 2.57 3.38 -1.13 -1.73 115.31 120.73 2ys9 h LEU 51 Ca 0.35 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.07 2ys9 h LEU 51 Cb -0.15 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.39 2ys9 h LEU 51 CO -0.08 0.66 -1.15 -0.78 0.09 0.00 0.00 178.44 177.19 2ys9 h ASP 52 N 1.16 0.48 0.04 -0.43 1.82 -0.67 -2.82 116.42 115.99 2ys9 h ASP 52 Ca 0.41 -0.46 0.02 0.00 -0.39 0.00 0.00 57.03 56.61 2ys9 h ASP 52 Cb 0.12 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 39.95 2ys9 h ASP 52 CO -0.16 1.32 -0.17 -0.25 -1.61 0.00 0.00 179.24 178.37 2ys9 h TRP 53 N 0.13 -0.46 -0.03 0.28 7.01 -0.16 0.17 115.95 122.89 2ys9 h TRP 53 Ca -0.12 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 60.89 2ys9 h TRP 53 Cb 1.84 0.20 -0.00 0.00 -2.10 0.00 0.00 29.16 29.10 2ys9 h TRP 53 CO 0.07 -0.25 0.00 0.74 -2.79 0.00 0.00 178.44 176.20 2ys9 h PHE 54 N -0.31 0.07 -0.91 2.65 -1.00 -1.45 -2.56 116.94 113.43 2ys9 h PHE 54 Ca 0.04 -0.01 0.20 0.00 2.81 0.00 0.00 57.97 61.01 2ys9 h PHE 54 Cb 0.36 -0.02 -0.07 0.00 3.61 0.00 0.00 35.95 39.83 2ys9 h PHE 54 CO -0.21 0.33 0.60 0.22 -1.61 0.00 0.00 178.31 177.64 2ys9 h ASP 55 N -0.22 0.45 0.23 2.17 3.58 -1.34 0.17 116.42 121.46 2ys9 h ASP 55 Ca 0.01 0.05 -0.16 0.00 0.42 0.00 0.00 57.03 57.35 2ys9 h ASP 55 Cb 0.31 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 2ys9 h ASP 55 CO 0.00 0.18 -0.60 -1.28 -2.88 0.00 0.00 179.24 174.66 2ys9 h SER 56 N 0.45 0.42 -0.97 2.28 0.87 -0.75 -3.11 113.55 112.72 2ys9 h SER 56 Ca 0.47 -0.24 0.01 0.00 -1.23 0.00 0.00 61.79 60.81 2ys9 h SER 56 Cb 1.12 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.91 2ys9 h SER 56 CO -0.19 0.92 0.64 0.03 -0.53 0.00 0.00 176.83 177.70 2ys9 h ARG 57 N 0.27 1.27 -5.99 2.24 2.47 -0.25 -3.45 114.38 110.95 2ys9 h ARG 57 Ca -0.01 -0.08 -0.60 0.00 -1.26 0.00 0.00 59.98 58.03 2ys9 h ARG 57 Cb 1.13 -0.29 0.17 0.00 -1.65 0.00 0.00 29.97 29.34 2ys9 h ARG 57 CO 0.10 0.84 -1.10 1.28 0.56 0.00 0.00 179.97 181.65 2ys9 n LEU 58 N -4.39 -3.46 -4.55 3.04 4.77 -1.04 -4.73 117.00 106.64 2ys9 n LEU 58 Ca 0.12 0.69 -0.34 0.00 -0.03 0.00 0.00 56.01 56.46 2ys9 n LEU 58 Cb 0.02 -0.86 -0.04 0.00 -2.33 0.00 0.00 43.42 40.22 2ys9 n LEU 58 CO 0.37 -4.63 1.50 -2.16 -1.33 0.00 0.00 177.39 171.13 2ys9 s PRO 59 N -1.00 2.60 0.05 3.23 0.04 -1.26 -4.97 135.00 133.68 2ys9 s PRO 59 Ca 0.57 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.84 2ys9 s PRO 59 Cb -0.53 -4.67 -0.04 0.00 0.04 0.00 0.00 34.50 29.29 2ys9 s PRO 59 CO 0.65 -3.00 0.15 1.14 0.04 0.00 0.00 177.00 175.97 2ys9 s GLN 60 N 7.03 3.22 -0.83 4.56 0.00 -1.26 -5.03 119.66 127.34 2ys9 s GLN 60 Ca 0.68 -0.50 -0.25 0.00 -0.00 0.00 0.00 55.36 55.29 2ys9 s GLN 60 Cb -0.10 -2.93 -0.04 0.00 0.00 0.00 0.00 33.01 29.94 2ys9 s GLN 60 CO 0.12 0.61 1.93 -1.25 0.00 0.00 0.00 175.29 176.69 2ys9 s PRO 61 N -2.27 2.57 0.07 9.60 0.04 -1.26 -4.87 135.00 138.88 2ys9 s PRO 61 Ca 0.30 -0.08 -0.27 0.00 0.04 0.00 0.00 61.00 61.00 2ys9 s PRO 61 Cb -0.13 -4.90 0.08 0.00 0.04 0.00 0.00 34.50 29.60 2ys9 s PRO 61 CO 0.23 -3.22 0.88 0.00 0.04 0.00 0.00 177.00 174.93 2ys9 s ALA 62 N 9.84 -1.73 -0.35 8.56 0.00 -1.26 -5.06 121.76 131.76 2ys9 s ALA 62 Ca 0.69 0.62 0.06 0.00 0.00 0.00 0.00 51.96 53.34 2ys9 s ALA 62 Cb -0.08 0.55 0.45 0.00 0.00 0.00 0.00 23.12 24.04 2ys9 s ALA 62 CO 0.04 -0.83 1.28 -1.91 0.00 0.00 0.00 175.76 174.34 2ys9 n GLU 63 N -0.34 3.49 -0.32 0.00 4.07 -1.26 -4.84 120.64 121.44 2ys9 n GLU 63 Ca -0.08 -4.11 0.21 0.00 -0.06 0.00 0.00 57.16 53.11 2ys9 n GLU 63 Cb 0.62 -2.28 0.41 0.00 -0.06 0.00 0.00 31.44 30.13 2ys9 n GLU 63 CO 0.00 0.00 0.00 -0.24 -0.06 0.00 0.00 177.13 176.83 2ys9 h VAL 64 N 2.11 0.20 -3.93 6.31 3.04 -1.97 -3.42 116.25 118.59 2ys9 h VAL 64 Ca 0.39 -0.06 -0.12 0.00 -1.01 0.00 0.00 66.70 65.90 2ys9 h VAL 64 Cb 1.37 0.01 -0.11 0.00 -2.01 0.00 0.00 31.29 30.56 2ys9 h VAL 64 CO 0.86 0.03 -0.25 -0.94 -1.01 0.00 0.00 177.57 176.26 2ys9 s SER 65 N -4.90 0.04 0.00 3.17 1.04 -1.26 -5.14 113.70 106.64 2ys9 s SER 65 Ca -0.11 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 55.23 2ys9 s SER 65 Cb 0.29 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.95 2ys9 s SER 65 CO 0.78 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 174.54 2ys9 n GLY 66 N -0.37 1.43 3.57 7.32 0.00 -1.26 -4.74 105.19 111.15 2ys9 n GLY 66 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 0.13 2.53 0.15 1.61 0.04 -1.26 -4.81 135.00 133.39 2ys9 s PRO 67 Ca 0.00 -0.60 -0.18 0.00 0.04 0.00 0.00 61.00 60.26 2ys9 s PRO 67 Cb 0.00 -5.13 0.03 0.00 0.04 0.00 0.00 34.50 29.45 2ys9 s PRO 67 CO 0.00 -3.59 1.70 0.66 0.04 0.00 0.00 177.00 175.81 2ys9 h SER 68 N 10.74 -0.18 -6.78 6.66 4.64 -2.04 -3.45 113.55 123.14 2ys9 h SER 68 Ca 0.14 0.08 -0.56 0.00 -0.47 0.00 0.00 61.79 60.98 2ys9 h SER 68 Cb 0.98 0.14 -0.20 0.00 -0.31 0.00 0.00 62.40 63.02 2ys9 h SER 68 CO 1.21 -0.06 -0.86 -0.24 -0.87 0.00 0.00 176.83 176.02 2ys9 n SER 69 N -5.20 -2.21 0.00 4.97 2.88 -1.26 -5.19 113.62 107.61 2ys9 n SER 69 Ca -0.00 -1.06 0.00 0.00 -1.33 0.00 0.00 58.87 56.48 2ys9 n SER 69 Cb 0.16 -2.59 0.00 0.00 -0.75 0.00 0.00 64.21 61.03 2ys9 n SER 69 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42