#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 4.38 -0.18 1.61 0.01 -1.26 -4.88 113.70 113.37 2ys9 s SER 2 Ca 0.00 -1.91 -0.04 0.00 1.31 0.00 0.00 55.95 55.31 2ys9 s SER 2 Cb 0.00 -1.23 0.06 0.00 0.21 0.00 0.00 66.02 65.06 2ys9 s SER 2 CO 0.00 -0.40 0.08 -0.44 0.41 0.00 0.00 173.24 172.89 2ys9 s SER 3 N 1.25 2.57 -0.91 2.44 0.01 -1.26 -5.08 113.70 112.72 2ys9 s SER 3 Ca 0.11 -0.71 -0.24 0.00 1.31 0.00 0.00 55.95 56.41 2ys9 s SER 3 Cb -0.18 -0.35 0.01 0.00 0.21 0.00 0.00 66.02 65.71 2ys9 s SER 3 CO -0.17 -0.34 1.60 -0.83 0.41 0.00 0.00 173.24 173.91 2ys9 s GLY 4 N 2.06 0.80 -0.33 3.44 0.00 -1.26 -4.88 107.32 107.14 2ys9 s GLY 4 Ca 0.02 -1.77 -0.12 0.00 0.00 0.00 0.00 44.72 42.85 2ys9 s GLY 4 CO -0.10 2.98 0.22 -0.56 0.00 0.00 0.00 173.10 175.64 2ys9 s SER 5 N 5.95 5.96 -0.45 1.64 0.01 -1.26 -5.05 113.70 120.50 2ys9 s SER 5 Ca 0.53 -0.42 -0.16 0.00 1.31 0.00 0.00 55.95 57.21 2ys9 s SER 5 Cb -0.04 -2.11 0.05 0.00 0.21 0.00 0.00 66.02 64.13 2ys9 s SER 5 CO -0.01 -0.22 0.40 -0.55 0.41 0.00 0.00 173.24 173.27 2ys9 s SER 6 N 1.70 6.15 0.00 2.44 0.15 -1.26 -4.71 113.70 118.18 2ys9 s SER 6 Ca 0.06 -1.08 0.00 0.00 0.70 0.00 0.00 55.95 55.63 2ys9 s SER 6 Cb -0.17 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 2ys9 s SER 6 CO 0.10 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.54 2ys9 n GLY 7 N 5.18 0.02 3.60 9.45 0.00 -1.26 -5.13 105.19 117.04 2ys9 n GLY 7 Ca -0.11 0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.04 0.83 1.61 0.04 -1.26 -4.98 135.00 130.19 2ys9 s PRO 8 Ca 0.00 0.00 -0.14 0.00 0.04 0.00 0.00 61.00 60.90 2ys9 s PRO 8 Cb 0.00 -1.61 0.02 0.00 0.04 0.00 0.00 34.50 32.95 2ys9 s PRO 8 CO 0.00 -3.61 0.70 1.28 0.04 0.00 0.00 177.00 175.41 2ys9 n LEU 9 N -4.70 1.59 -4.77 -3.56 4.77 -1.26 -4.94 117.00 104.13 2ys9 n LEU 9 Ca 0.12 0.50 -0.36 0.00 -0.03 0.00 0.00 56.01 56.24 2ys9 n LEU 9 Cb 0.59 -1.30 -0.00 0.00 -2.33 0.00 0.00 43.42 40.37 2ys9 n LEU 9 CO 0.47 -2.85 0.81 -2.16 -1.33 0.00 0.00 177.39 172.32 2ys9 s PRO 10 N -3.47 3.58 0.40 3.23 0.04 -1.26 -5.01 135.00 132.51 2ys9 s PRO 10 Ca 0.65 1.69 -0.24 0.00 0.04 0.00 0.00 61.00 63.14 2ys9 s PRO 10 Cb -0.28 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 31.95 2ys9 s PRO 10 CO 0.59 -0.68 1.10 0.96 0.04 0.00 0.00 177.00 179.01 2ys9 s ILE 11 N -1.65 3.46 -0.34 0.56 -4.36 -1.26 -4.96 121.20 112.64 2ys9 s ILE 11 Ca 0.68 1.16 -0.29 0.00 -0.26 0.00 0.00 60.65 61.94 2ys9 s ILE 11 Cb -0.26 -3.62 -0.01 0.00 1.25 0.00 0.00 42.46 39.82 2ys9 s ILE 11 CO 0.31 0.05 1.69 -2.16 0.24 0.00 0.00 174.94 175.06 2ys9 s PRO 12 N -2.41 3.44 0.55 0.37 0.04 -1.26 -4.99 135.00 130.74 2ys9 s PRO 12 Ca 0.58 1.33 -0.19 0.00 0.04 0.00 0.00 61.00 62.76 2ys9 s PRO 12 Cb -0.26 -4.14 -0.06 0.00 0.04 0.00 0.00 34.50 30.09 2ys9 s PRO 12 CO 0.32 -1.73 1.13 -1.25 0.04 0.00 0.00 177.00 175.51 2ys9 s PRO 13 N 5.38 3.32 0.92 0.56 0.04 -1.26 -4.64 135.00 139.32 2ys9 s PRO 13 Ca 0.75 1.59 -0.12 0.00 0.04 0.00 0.00 61.00 63.26 2ys9 s PRO 13 Cb -0.21 -2.00 0.14 0.00 0.04 0.00 0.00 34.50 32.47 2ys9 s PRO 13 CO 0.33 -0.87 1.09 -1.25 0.04 0.00 0.00 177.00 176.35 2ys9 s PRO 14 N -3.34 1.08 -0.34 0.56 0.04 -1.26 -4.94 135.00 126.80 2ys9 s PRO 14 Ca 0.72 0.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.25 2ys9 s PRO 14 Cb -0.24 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 2ys9 s PRO 14 CO 0.28 -2.35 1.69 -1.25 0.04 0.00 0.00 177.00 175.41 2ys9 s PRO 15 N -4.93 3.43 0.87 0.56 0.04 -1.26 -4.99 135.00 128.71 2ys9 s PRO 15 Ca 0.64 1.33 -0.11 0.00 0.04 0.00 0.00 61.00 62.89 2ys9 s PRO 15 Cb -0.18 -4.14 0.11 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 5.40 1.51 -0.28 0.56 0.04 -1.26 -5.03 135.00 135.94 2ys9 s PRO 16 Ca 0.75 0.91 -0.07 0.00 0.04 0.00 0.00 61.00 62.63 2ys9 s PRO 16 Cb -0.20 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 2ys9 s PRO 16 CO 0.33 -2.09 0.08 0.34 0.04 0.00 0.00 177.00 175.70 2ys9 s ASP 17 N -3.41 5.14 0.02 6.66 2.15 -1.02 -4.95 116.67 121.26 2ys9 s ASP 17 Ca 0.63 -0.50 0.24 0.00 0.43 0.00 0.00 52.55 53.35 2ys9 s ASP 17 Cb -0.18 -1.90 0.24 0.00 -0.30 0.00 0.00 42.92 40.78 2ys9 s ASP 17 CO 0.57 -0.13 1.21 -0.38 -0.17 0.00 0.00 175.17 176.27 2ys9 n ILE 18 N 4.90 0.06 -0.20 4.11 2.08 -1.26 -3.96 119.36 125.09 2ys9 n ILE 18 Ca -0.15 -0.08 -0.00 0.00 0.56 0.00 0.00 62.75 63.08 2ys9 n ILE 18 Cb 0.49 0.36 0.11 0.00 -0.75 0.00 0.00 39.64 39.86 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 0.41 -0.98 0.38 1.08 -1.98 0.58 115.11 114.61 2ys9 h GLN 19 Ca 0.00 -0.02 0.25 0.00 -1.45 0.00 0.00 58.65 57.42 2ys9 h GLN 19 Cb 0.57 -0.09 -0.13 0.00 -0.05 0.00 0.00 27.48 27.78 2ys9 h GLN 19 CO 0.00 0.27 0.54 -1.35 -0.95 0.00 0.00 178.83 177.35 2ys9 h PRO 20 N 0.43 0.50 0.07 1.46 0.11 -1.93 0.62 132.00 133.26 2ys9 h PRO 20 Ca 0.31 -0.03 -0.29 0.00 0.11 0.00 0.00 66.00 66.09 2ys9 h PRO 20 Cb 0.37 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 2ys9 h PRO 20 CO -0.30 0.33 -1.55 -0.07 -0.21 0.00 0.00 178.00 176.21 2ys9 h LEU 21 N 0.51 0.23 -0.38 2.35 3.38 -1.60 -3.19 115.31 116.61 2ys9 h LEU 21 Ca 0.63 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 58.27 2ys9 h LEU 21 Cb 1.23 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2ys9 h LEU 21 CO -0.50 1.30 0.22 -0.33 0.09 0.00 0.00 178.44 179.22 2ys9 h GLU 22 N 0.04 0.43 0.65 1.13 5.08 0.82 -0.62 114.58 122.12 2ys9 h GLU 22 Ca -0.24 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2ys9 h GLU 22 Cb 1.98 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 31.14 2ys9 h GLU 22 CO 0.13 0.28 -0.31 0.00 -1.00 0.00 0.00 179.01 178.11 2ys9 h ARG 23 N 0.44 -0.85 -1.08 2.33 3.08 -1.10 -0.07 114.38 117.13 2ys9 h ARG 23 Ca 0.15 0.06 0.30 0.00 0.07 0.00 0.00 59.98 60.55 2ys9 h ARG 23 Cb 0.01 0.19 -0.07 0.00 0.08 0.00 0.00 29.97 30.18 2ys9 h ARG 23 CO -0.07 -0.54 0.74 -0.92 -1.07 0.00 0.00 179.97 178.10 2ys9 h TYR 24 N -1.19 0.36 0.00 3.04 3.20 -1.53 0.73 116.97 121.58 2ys9 h TYR 24 Ca -0.09 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 2ys9 h TYR 24 Cb 0.70 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.86 2ys9 h TYR 24 CO 0.00 0.03 -0.00 2.35 -1.64 0.00 0.00 178.16 178.90 2ys9 h TRP 25 N 0.21 0.00 0.00 -3.82 2.91 -0.99 0.42 115.95 114.68 2ys9 h TRP 25 Ca 0.57 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.59 2ys9 h TRP 25 Cb 1.82 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 30.46 2ys9 h TRP 25 CO -0.00 0.80 0.00 0.00 -1.03 0.00 0.00 178.44 178.21 2ys9 h ALA 26 N 0.20 1.00 0.00 2.65 0.00 0.72 0.79 119.26 124.63 2ys9 h ALA 26 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 2ys9 h ALA 26 Cb 0.80 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2ys9 h ALA 26 CO 0.00 0.00 -1.52 0.00 0.00 0.00 0.00 179.25 177.73 2ys9 n ALA 27 N -2.00 0.89 -0.09 0.00 0.00 0.24 -4.76 120.51 114.80 2ys9 n ALA 27 Ca 0.00 -0.77 -0.23 0.00 0.00 0.00 0.00 53.44 52.44 2ys9 n ALA 27 Cb 0.24 -0.08 -0.12 0.00 0.00 0.00 0.00 19.45 19.49 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 -4.41 0.75 -1.87 0.00 8.25 0.14 -5.00 115.22 113.09 2ys9 n HIS 28 Ca -0.32 0.26 -0.07 0.00 -0.26 0.00 0.00 57.72 57.33 2ys9 n HIS 28 Cb 0.64 -1.08 -0.01 0.00 1.12 0.00 0.00 29.99 30.66 2ys9 n HIS 28 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2ys9 n GLN 29 N -4.04 -0.57 -3.74 -0.41 -0.06 0.28 -4.99 117.38 103.85 2ys9 n GLN 29 Ca -0.38 0.48 -0.13 0.00 -2.00 0.00 0.00 57.00 54.96 2ys9 n GLN 29 Cb 0.85 -4.37 -0.08 0.00 -4.06 0.00 0.00 30.24 22.58 2ys9 n GLN 29 CO 0.00 0.00 0.00 -0.65 -0.20 0.00 0.00 177.06 176.21 2ys9 s GLN 30 N -3.86 0.73 0.04 3.69 -0.21 -1.26 -5.04 119.66 113.75 2ys9 s GLN 30 Ca 0.00 -0.24 0.04 0.00 0.02 0.00 0.00 55.36 55.17 2ys9 s GLN 30 Cb 0.00 0.33 -0.04 0.00 1.00 0.00 0.00 33.01 34.30 2ys9 s GLN 30 CO 0.00 -0.22 -0.03 -1.17 -2.12 0.00 0.00 175.29 171.75 2ys9 s LEU 31 N -1.52 3.33 -0.02 2.90 2.96 -1.26 -4.87 118.68 120.21 2ys9 s LEU 31 Ca -0.11 -0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.65 2ys9 s LEU 31 Cb -0.04 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.69 2ys9 s LEU 31 CO 0.03 0.24 0.00 -0.13 -1.32 0.00 0.00 176.35 175.17 2ys9 s ARG 32 N -1.82 0.18 0.61 1.98 0.52 -1.26 -5.01 118.95 114.15 2ys9 s ARG 32 Ca 0.21 0.08 0.27 0.00 -0.52 0.00 0.00 55.73 55.77 2ys9 s ARG 32 Cb -0.11 -0.36 1.17 0.00 0.52 0.00 0.00 34.95 36.17 2ys9 s ARG 32 CO 0.12 -0.11 1.58 0.93 0.02 0.00 0.00 175.30 177.84 2ys9 h GLU 33 N 7.05 0.00 0.12 3.54 4.39 -2.00 1.07 114.58 128.76 2ys9 h GLU 33 Ca -0.41 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.01 2ys9 h GLU 33 Cb 1.14 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.81 2ys9 h GLU 33 CO 0.48 0.00 -1.22 1.15 -1.16 0.00 0.00 179.01 178.26 2ys9 h THR 34 N 0.00 1.38 0.00 1.13 2.02 -2.03 -3.25 112.91 112.16 2ys9 h THR 34 Ca 0.34 -2.71 0.00 0.00 0.77 0.00 0.00 66.41 64.81 2ys9 h THR 34 Cb 2.05 2.78 0.00 0.00 -1.74 0.00 0.00 68.15 71.24 2ys9 h THR 34 CO -0.00 0.81 -0.42 -0.90 0.37 0.00 0.00 175.52 175.38 2ys9 n ASP 35 N -3.68 0.48 0.43 4.18 5.68 0.33 -3.76 116.55 120.22 2ys9 n ASP 35 Ca -0.11 0.04 -0.19 0.00 -0.50 0.00 0.00 54.79 54.03 2ys9 n ASP 35 Cb 0.99 0.03 -0.09 0.00 -1.14 0.00 0.00 41.12 40.90 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 0.13 -0.30 2.12 2.04 -0.48 0.14 117.51 121.16 2ys9 h ILE 36 Ca 0.00 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.71 2ys9 h ILE 36 Cb 0.58 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2ys9 h ILE 36 CO 0.00 0.00 -0.41 1.55 0.00 0.00 0.00 178.15 179.29 2ys9 h PRO 37 N -1.13 0.74 -0.43 2.37 0.13 -1.73 -1.04 132.00 130.90 2ys9 h PRO 37 Ca -0.11 -0.39 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 2ys9 h PRO 37 Cb 0.89 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 2ys9 h PRO 37 CO 0.15 1.01 0.15 0.37 -0.23 0.00 0.00 178.00 179.44 2ys9 h GLN 38 N 0.60 0.66 -0.13 0.86 4.15 -1.64 -2.45 115.11 117.17 2ys9 h GLN 38 Ca 0.05 -0.14 -0.09 0.00 0.77 0.00 0.00 58.65 59.24 2ys9 h GLN 38 Cb 0.96 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.55 2ys9 h GLN 38 CO 0.09 0.64 -0.29 -0.07 -1.93 0.00 0.00 178.83 177.27 2ys9 h LEU 39 N 0.56 0.47 -1.09 -2.39 3.38 -0.71 -3.13 115.31 112.40 2ys9 h LEU 39 Ca 0.14 -0.57 0.20 0.00 0.09 0.00 0.00 57.88 57.74 2ys9 h LEU 39 Cb 0.24 -0.14 -0.10 0.00 0.09 0.00 0.00 40.66 40.75 2ys9 h LEU 39 CO -0.01 0.96 0.61 -1.28 0.09 0.00 0.00 178.44 178.81 2ys9 h SER 40 N 0.01 0.72 0.36 -0.43 0.87 -1.13 0.39 113.55 114.34 2ys9 h SER 40 Ca 0.00 0.09 -0.08 0.00 -1.23 0.00 0.00 61.79 60.57 2ys9 h SER 40 Cb 0.89 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.80 2ys9 h SER 40 CO 0.06 0.25 -0.38 1.56 -0.53 0.00 0.00 176.83 177.79 2ys9 h GLN 41 N 0.70 0.03 -0.05 2.24 1.08 -1.41 0.17 115.11 117.87 2ys9 h GLN 41 Ca 0.57 -0.01 -0.18 0.00 -1.45 0.00 0.00 58.65 57.57 2ys9 h GLN 41 Cb 0.98 -0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.42 2ys9 h GLN 41 CO -0.35 0.41 -0.69 0.00 -0.95 0.00 0.00 178.83 177.24 2ys9 h ALA 42 N 1.59 0.15 -0.01 3.87 0.00 -0.25 -3.13 119.26 121.49 2ys9 h ALA 42 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2ys9 h ALA 42 Cb 0.69 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2ys9 h ALA 42 CO 0.05 0.47 0.00 -1.13 0.00 0.00 0.00 179.25 178.64 2ys9 n SER 43 N -4.11 0.43 -2.62 0.00 3.41 -0.28 -4.65 113.62 105.79 2ys9 n SER 43 Ca -0.09 -1.16 -0.21 0.00 -0.26 0.00 0.00 58.87 57.14 2ys9 n SER 43 Cb 0.71 -0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.67 2ys9 n SER 43 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ys9 n ARG 44 N -0.66 -3.31 -3.43 4.33 3.00 -0.38 -2.45 116.66 113.77 2ys9 n ARG 44 Ca 0.22 0.92 -0.21 0.00 -0.01 0.00 0.00 57.85 58.78 2ys9 n ARG 44 Cb 0.18 -5.63 -0.01 0.00 0.00 0.00 0.00 32.46 26.99 2ys9 n ARG 44 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2ys9 n LEU 45 N -3.43 0.00 -4.95 0.55 4.77 0.47 -4.91 117.00 109.49 2ys9 n LEU 45 Ca -0.17 -2.24 -0.23 0.00 -0.03 0.00 0.00 56.01 53.34 2ys9 n LEU 45 Cb 0.65 0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.75 2ys9 n LEU 45 CO 0.37 -0.48 0.14 -0.94 -1.33 0.00 0.00 177.39 175.16 2ys9 s SER 46 N -3.41 6.23 0.53 -1.43 1.04 -1.26 -4.44 113.70 110.97 2ys9 s SER 46 Ca 0.19 0.34 0.29 0.00 0.48 0.00 0.00 55.95 57.25 2ys9 s SER 46 Cb -0.02 -1.91 1.45 0.00 0.10 0.00 0.00 66.02 65.64 2ys9 s SER 46 CO 0.12 -0.31 1.94 0.74 0.98 0.00 0.00 173.24 176.71 2ys9 h THR 47 N 0.79 0.63 0.20 2.02 2.02 -1.93 -0.48 112.91 116.16 2ys9 h THR 47 Ca -0.50 -0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.41 2ys9 h THR 47 Cb 1.23 0.63 0.03 0.00 -1.74 0.00 0.00 68.15 68.29 2ys9 h THR 47 CO 0.60 0.00 -1.23 -0.61 0.37 0.00 0.00 175.52 174.66 2ys9 h GLN 48 N 0.00 0.42 -0.36 6.66 5.75 -1.96 -3.21 115.11 122.41 2ys9 h GLN 48 Ca 0.35 -0.71 0.07 0.00 -0.15 0.00 0.00 58.65 58.21 2ys9 h GLN 48 Cb 1.41 0.27 -0.09 0.00 1.07 0.00 0.00 27.48 30.14 2ys9 h GLN 48 CO -0.00 1.34 -0.32 1.96 -2.65 0.00 0.00 178.83 179.15 2ys9 h GLN 49 N -0.10 -0.26 -0.95 1.69 1.08 -1.47 -0.20 115.11 114.90 2ys9 h GLN 49 Ca -0.22 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.03 2ys9 h GLN 49 Cb 1.93 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 29.36 2ys9 h GLN 49 CO 0.21 -0.17 0.62 0.28 -0.95 0.00 0.00 178.83 178.81 2ys9 h VAL 50 N -0.27 1.18 -0.88 -0.54 2.07 -1.62 -0.99 116.25 115.19 2ys9 h VAL 50 Ca 0.16 -0.42 0.06 0.00 0.82 0.00 0.00 66.70 67.32 2ys9 h VAL 50 Cb 0.54 -0.15 -0.06 0.00 -1.52 0.00 0.00 31.29 30.10 2ys9 h VAL 50 CO -0.51 0.22 0.55 -0.07 0.02 0.00 0.00 177.57 177.78 2ys9 h LEU 51 N 1.22 0.88 -0.60 2.57 3.38 -1.10 -1.40 115.31 120.26 2ys9 h LEU 51 Ca 0.37 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.20 2ys9 h LEU 51 Cb -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2ys9 h LEU 51 CO -0.11 0.57 -0.69 -0.78 0.09 0.00 0.00 178.44 177.52 2ys9 h ASP 52 N 1.02 0.09 0.33 -0.43 1.82 -0.48 -2.11 116.42 116.66 2ys9 h ASP 52 Ca 0.37 -0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.94 2ys9 h ASP 52 Cb 0.13 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.12 2ys9 h ASP 52 CO -0.16 0.75 -0.16 -0.25 -1.61 0.00 0.00 179.24 177.81 2ys9 h TRP 53 N 0.05 -0.41 -0.38 0.28 7.01 -0.16 0.25 115.95 122.60 2ys9 h TRP 53 Ca -0.01 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 60.90 2ys9 h TRP 53 Cb 1.22 0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 28.40 2ys9 h TRP 53 CO 0.01 -0.19 -0.09 0.74 -2.79 0.00 0.00 178.44 176.12 2ys9 h PHE 54 N -0.55 0.82 -0.60 2.65 -1.00 -1.42 -1.84 116.94 115.00 2ys9 h PHE 54 Ca -0.05 -0.18 -0.03 0.00 2.81 0.00 0.00 57.97 60.53 2ys9 h PHE 54 Cb 0.41 -0.20 -0.03 0.00 3.61 0.00 0.00 35.95 39.74 2ys9 h PHE 54 CO -0.03 0.87 0.26 0.22 -1.61 0.00 0.00 178.31 178.02 2ys9 h ASP 55 N 0.54 0.78 0.50 2.17 1.82 -1.34 -2.24 116.42 118.65 2ys9 h ASP 55 Ca 0.10 -0.09 -0.14 0.00 -0.39 0.00 0.00 57.03 56.50 2ys9 h ASP 55 Cb 0.60 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.40 2ys9 h ASP 55 CO 0.04 0.69 -0.62 -1.28 -1.61 0.00 0.00 179.24 176.46 2ys9 h SER 56 N 0.86 0.14 -0.38 2.28 0.87 -0.34 -3.07 113.55 113.90 2ys9 h SER 56 Ca 0.21 -0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 2ys9 h SER 56 Cb 0.14 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2ys9 h SER 56 CO -0.02 0.73 0.10 0.03 -0.53 0.00 0.00 176.83 177.13 2ys9 h ARG 57 N 0.09 0.69 -6.35 2.24 2.47 -0.73 -3.45 114.38 109.34 2ys9 h ARG 57 Ca -0.01 -0.13 -0.59 0.00 -1.26 0.00 0.00 59.98 57.99 2ys9 h ARG 57 Cb 1.12 -0.11 0.16 0.00 -1.65 0.00 0.00 29.97 29.50 2ys9 h ARG 57 CO 0.09 0.64 -0.54 1.28 0.56 0.00 0.00 179.97 182.00 2ys9 n LEU 58 N -4.29 -0.34 -0.44 3.04 4.77 -1.09 -4.75 117.00 113.90 2ys9 n LEU 58 Ca 0.03 0.78 0.00 0.00 -0.03 0.00 0.00 56.01 56.79 2ys9 n LEU 58 Cb 0.22 -1.09 0.00 0.00 -2.33 0.00 0.00 43.42 40.21 2ys9 n LEU 58 CO 0.39 -3.34 0.14 -0.81 -1.33 0.00 0.00 177.39 172.44 2ys9 n PRO 59 N 0.45 0.49 -1.86 3.23 -0.04 -1.26 -4.85 135.00 131.16 2ys9 n PRO 59 Ca 0.11 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.19 2ys9 n PRO 59 Cb 0.45 -1.21 0.04 0.00 -0.04 0.00 0.00 33.50 32.74 2ys9 n PRO 59 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2ys9 s GLN 60 N -1.13 3.01 -0.55 0.54 -2.07 -1.26 -4.89 119.66 113.31 2ys9 s GLN 60 Ca 0.00 2.07 -0.27 0.00 -1.82 0.00 0.00 55.36 55.34 2ys9 s GLN 60 Cb 0.00 -2.10 -0.02 0.00 -1.09 0.00 0.00 33.01 29.80 2ys9 s GLN 60 CO 0.00 -1.24 1.82 -1.25 -1.32 0.00 0.00 175.29 173.30 2ys9 s PRO 61 N -3.09 2.81 -0.29 9.60 0.04 -1.26 -4.90 135.00 137.91 2ys9 s PRO 61 Ca 0.75 0.77 -0.16 0.00 0.04 0.00 0.00 61.00 62.40 2ys9 s PRO 61 Cb -0.37 -4.33 0.16 0.00 0.04 0.00 0.00 34.50 30.00 2ys9 s PRO 61 CO 0.42 -2.51 1.03 0.00 0.04 0.00 0.00 177.00 175.98 2ys9 s ALA 62 N 8.46 -2.36 -0.12 8.56 0.00 -1.26 -5.15 121.76 129.88 2ys9 s ALA 62 Ca 0.69 2.16 -0.17 0.00 0.00 0.00 0.00 51.96 54.64 2ys9 s ALA 62 Cb -0.14 -1.77 -0.04 0.00 0.00 0.00 0.00 23.12 21.16 2ys9 s ALA 62 CO 0.24 -0.35 0.42 -2.00 0.00 0.00 0.00 175.76 174.07 2ys9 s GLU 63 N 1.30 4.29 0.02 0.00 -6.30 -1.26 -5.08 118.70 111.67 2ys9 s GLU 63 Ca -0.09 0.34 0.05 0.00 -2.50 0.00 0.00 54.97 52.77 2ys9 s GLU 63 Cb -0.03 -3.42 -0.02 0.00 0.00 0.00 0.00 34.13 30.66 2ys9 s GLU 63 CO -0.14 0.22 -0.15 0.54 0.02 0.00 0.00 175.26 175.75 2ys9 s VAL 64 N 0.47 1.17 -0.25 3.70 0.11 -1.26 -5.14 120.40 119.19 2ys9 s VAL 64 Ca 0.23 -0.90 -0.27 0.00 -2.93 0.00 0.00 61.98 58.10 2ys9 s VAL 64 Cb -0.15 -1.03 0.16 0.00 -1.53 0.00 0.00 36.38 33.83 2ys9 s VAL 64 CO 0.09 0.12 1.19 -0.94 -3.33 0.00 0.00 175.10 172.22 2ys9 s SER 65 N -0.90 -0.24 -0.01 3.54 1.04 -1.26 -5.19 113.70 110.67 2ys9 s SER 65 Ca 0.03 0.38 -0.20 0.00 0.48 0.00 0.00 55.95 56.64 2ys9 s SER 65 Cb -0.07 0.35 0.04 0.00 0.10 0.00 0.00 66.02 66.44 2ys9 s SER 65 CO 0.01 -0.15 0.44 -0.83 0.98 0.00 0.00 173.24 173.69 2ys9 s GLY 66 N -0.46 -0.30 0.40 7.32 0.00 -1.26 -5.04 107.32 107.98 2ys9 s GLY 66 Ca 0.04 0.62 0.19 0.00 0.00 0.00 0.00 44.72 45.57 2ys9 s GLY 66 CO -0.07 0.36 1.82 -0.56 0.00 0.00 0.00 173.10 174.65 2ys9 h PRO 67 N 3.44 0.00 -3.88 2.90 0.13 -2.09 -3.46 132.00 129.04 2ys9 h PRO 67 Ca -0.29 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.73 2ys9 h PRO 67 Cb 1.17 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.18 2ys9 h PRO 67 CO 0.40 0.33 -0.29 -1.12 -0.23 0.00 0.00 178.00 177.09 2ys9 s SER 68 N -6.50 0.00 -0.26 1.44 0.01 -1.26 -5.15 113.70 101.99 2ys9 s SER 68 Ca -0.01 -0.94 -0.08 0.00 1.31 0.00 0.00 55.95 56.23 2ys9 s SER 68 Cb 0.12 0.48 -0.03 0.00 0.21 0.00 0.00 66.02 66.80 2ys9 s SER 68 CO 0.68 -0.97 0.10 -0.55 0.41 0.00 0.00 173.24 172.91 2ys9 s SER 69 N -3.00 5.35 0.00 2.44 0.15 -1.26 -5.17 113.70 112.21 2ys9 s SER 69 Ca 0.21 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.66 2ys9 s SER 69 Cb 0.02 -1.97 0.00 0.00 -1.71 0.00 0.00 66.02 62.36 2ys9 s SER 69 CO 0.04 -0.05 0.04 0.61 1.20 0.00 0.00 173.24 175.08