#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvu n GLY 2 N 0.00 0.98 3.55 3.03 0.00 -1.26 -5.08 105.19 106.42 2kvu n GLY 2 Ca 0.00 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 2kvu n GLY 2 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kvu s HIS 3 N 0.56 3.10 -0.19 1.61 4.02 -1.26 -4.90 115.29 118.23 2kvu s HIS 3 Ca 0.00 0.23 -0.07 0.00 1.02 0.00 0.00 55.06 56.25 2kvu s HIS 3 Cb 0.00 -3.31 -0.21 0.00 -1.02 0.00 0.00 32.58 28.04 2kvu s HIS 3 CO 0.00 -0.77 0.08 0.72 1.02 0.00 0.00 174.74 175.80 2kvu n HIS 4 N 6.26 0.70 -2.75 1.40 8.25 -1.26 -4.68 115.22 123.15 2kvu n HIS 4 Ca -0.00 0.18 -0.43 0.00 -0.26 0.00 0.00 57.72 57.21 2kvu n HIS 4 Cb 0.48 -1.09 -0.02 0.00 1.12 0.00 0.00 29.99 30.49 2kvu n HIS 4 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2kvu s HIS 5 N -2.52 2.92 -0.08 4.41 5.65 -1.26 -4.80 115.29 119.61 2kvu s HIS 5 Ca -0.29 -1.36 -0.03 0.00 0.25 0.00 0.00 55.06 53.64 2kvu s HIS 5 Cb 0.08 -4.51 -0.01 0.00 -1.18 0.00 0.00 32.58 26.96 2kvu s HIS 5 CO 0.66 -1.68 -0.06 1.25 -0.65 0.00 0.00 174.74 174.27 2kvu h HIS 6 N 8.70 0.00 -3.87 3.88 2.76 -2.02 -3.46 115.15 121.13 2kvu h HIS 6 Ca 0.24 0.00 -0.49 0.00 -2.20 0.00 0.00 60.37 57.92 2kvu h HIS 6 Cb 0.97 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.94 2kvu h HIS 6 CO 1.24 0.00 0.43 -3.38 -1.30 0.00 0.00 177.93 174.92 2kvu s HIS 7 N -1.61 3.48 0.33 5.26 0.00 -1.26 -5.04 115.29 116.43 2kvu s HIS 7 Ca -0.05 1.70 0.08 0.00 -3.00 0.00 0.00 55.06 53.79 2kvu s HIS 7 Cb 0.01 -3.18 -0.04 0.00 -4.00 0.00 0.00 32.58 25.37 2kvu s HIS 7 CO 0.07 -0.48 0.14 -1.01 -1.00 0.00 0.00 174.74 172.46 2kvu s HIS 8 N -1.40 2.74 -0.16 0.38 4.02 -1.26 -5.04 115.29 114.57 2kvu s HIS 8 Ca 0.50 -0.34 0.15 0.00 1.02 0.00 0.00 55.06 56.39 2kvu s HIS 8 Cb -0.27 -1.58 0.34 0.00 -1.02 0.00 0.00 32.58 30.05 2kvu s HIS 8 CO 0.34 0.37 1.18 0.43 1.02 0.00 0.00 174.74 178.08 2kvu n SER 9 N -1.14 1.96 -3.99 1.40 7.64 -1.26 -4.71 113.62 113.51 2kvu n SER 9 Ca -0.04 -3.39 -0.31 0.00 1.01 0.00 0.00 58.87 56.14 2kvu n SER 9 Cb 0.61 -0.46 -0.15 0.00 -1.01 0.00 0.00 64.21 63.19 2kvu n SER 9 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2kvu s HIS 10 N -2.87 3.56 -1.21 1.43 5.65 -1.26 -4.72 115.29 115.86 2kvu s HIS 10 Ca 0.34 -2.87 0.00 0.00 0.25 0.00 0.00 55.06 52.78 2kvu s HIS 10 Cb 0.31 -2.79 0.00 0.00 -1.18 0.00 0.00 32.58 28.93 2kvu s HIS 10 CO -0.02 -0.94 0.00 -1.33 -0.65 0.00 0.00 174.74 171.80 2kvu n MET 11 N 4.31 -2.02 -3.16 2.88 2.00 -1.26 -4.87 117.12 114.99 2kvu n MET 11 Ca 0.03 0.68 -0.46 0.00 0.00 0.00 0.00 57.70 57.96 2kvu n MET 11 Cb 0.42 -5.24 -0.02 0.00 0.00 0.00 0.00 33.22 28.37 2kvu n MET 11 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2kvu s SER 12 N -2.05 6.68 -0.17 7.83 0.01 -1.26 -4.98 113.70 119.76 2kvu s SER 12 Ca 0.00 -2.37 0.01 0.00 1.31 0.00 0.00 55.95 54.90 2kvu s SER 12 Cb 0.00 -2.29 0.01 0.00 0.21 0.00 0.00 66.02 63.95 2kvu s SER 12 CO 0.00 -0.79 -0.19 0.42 0.41 0.00 0.00 173.24 173.09 2kvu s THR 13 N 1.27 2.24 -0.82 1.44 -4.23 -1.26 -4.96 115.64 109.32 2kvu s THR 13 Ca 0.23 -0.90 -0.25 0.00 -1.18 0.00 0.00 61.69 59.59 2kvu s THR 13 Cb -0.09 -1.93 -0.06 0.00 1.34 0.00 0.00 72.50 71.76 2kvu s THR 13 CO -0.08 0.53 2.02 -2.84 -0.54 0.00 0.00 174.62 173.71 2kvu s PRO 14 N 1.07 2.40 -0.38 3.99 0.02 -1.26 -4.91 135.00 135.94 2kvu s PRO 14 Ca -0.01 0.04 -0.03 0.00 0.02 0.00 0.00 61.00 61.02 2kvu s PRO 14 Cb -0.14 -4.89 0.09 0.00 0.02 0.00 0.00 34.50 29.57 2kvu s PRO 14 CO -0.07 -3.43 0.15 -1.17 -0.33 0.00 0.00 177.00 172.15 2kvu s LEU 15 N 10.72 4.84 -0.73 -5.54 1.98 -1.26 -5.05 118.68 123.64 2kvu s LEU 15 Ca 0.74 -1.74 -0.18 0.00 -2.89 0.00 0.00 54.13 50.07 2kvu s LEU 15 Cb -0.09 -1.82 0.14 0.00 0.66 0.00 0.00 46.19 45.08 2kvu s LEU 15 CO 0.05 -0.46 0.83 0.42 -1.89 0.00 0.00 176.35 175.30 2kvu s THR 16 N 1.21 4.99 -0.12 3.68 -4.23 -1.26 -4.99 115.64 114.93 2kvu s THR 16 Ca 0.04 -1.50 -0.01 0.00 -1.18 0.00 0.00 61.69 59.03 2kvu s THR 16 Cb -0.22 -4.56 0.04 0.00 1.34 0.00 0.00 72.50 69.10 2kvu s THR 16 CO -0.02 -1.20 -0.01 -0.83 -0.54 0.00 0.00 174.62 172.02 2kvu s GLY 17 N 3.27 0.63 -0.27 3.99 0.00 -1.26 -5.12 107.32 108.56 2kvu s GLY 17 Ca 0.18 -0.39 -0.12 0.00 0.00 0.00 0.00 44.72 44.39 2kvu s GLY 17 CO -0.01 1.13 0.22 0.54 0.00 0.00 0.00 173.10 174.98 2kvu s LYS 18 N 1.87 3.98 0.21 2.90 1.02 -1.26 -5.08 119.74 123.38 2kvu s LYS 18 Ca 0.03 -0.24 -0.24 0.00 0.02 0.00 0.00 55.97 55.54 2kvu s LYS 18 Cb -0.14 -3.65 -0.08 0.00 -0.52 0.00 0.00 37.83 33.44 2kvu s LYS 18 CO -0.07 -0.17 0.80 -1.25 -0.92 0.00 0.00 175.35 173.74 2kvu s PRO 19 N 1.74 4.50 0.28 -1.68 0.04 -1.26 -4.97 135.00 133.65 2kvu s PRO 19 Ca 0.09 1.13 0.15 0.00 0.04 0.00 0.00 61.00 62.41 2kvu s PRO 19 Cb -0.16 -3.09 0.07 0.00 0.04 0.00 0.00 34.50 31.36 2kvu s PRO 19 CO 0.10 0.48 1.44 0.78 0.04 0.00 0.00 177.00 179.84 2kvu h GLY 20 N 3.89 0.00 0.00 0.56 0.00 -2.05 -3.47 103.07 102.00 2kvu h GLY 20 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2kvu h GLY 20 CO 0.66 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.20 2kvu n ALA 21 N -2.22 0.00 -2.43 3.60 0.00 -1.26 -5.11 120.51 113.09 2kvu n ALA 21 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.18 2kvu n ALA 21 Cb 0.73 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 20.04 2kvu n ALA 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kvu s LEU 22 N 0.00 2.20 1.02 0.00 1.43 -1.26 -5.13 118.68 116.94 2kvu s LEU 22 Ca 0.00 -0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 2kvu s LEU 22 Cb 0.00 -1.11 0.20 0.00 0.03 0.00 0.00 46.19 45.31 2kvu s LEU 22 CO 0.00 0.19 1.09 -2.16 0.23 0.00 0.00 176.35 175.70 2kvu s PRO 23 N -1.41 0.22 0.00 1.29 0.04 -1.26 -4.94 135.00 128.94 2kvu s PRO 23 Ca 0.10 1.16 0.22 0.00 0.04 0.00 0.00 61.00 62.52 2kvu s PRO 23 Cb -0.10 -1.66 0.59 0.00 0.04 0.00 0.00 34.50 33.37 2kvu s PRO 23 CO 0.03 -3.05 1.47 0.00 0.04 0.00 0.00 177.00 175.49 2kvu n ALA 24 N -4.49 2.47 -2.15 8.56 0.00 -1.26 -4.18 120.51 119.47 2kvu n ALA 24 Ca 0.07 -0.73 -0.24 0.00 0.00 0.00 0.00 53.44 52.55 2kvu n ALA 24 Cb 0.53 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 19.01 2kvu n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kvu n ASN 25 N 0.85 4.78 0.20 0.00 4.13 -1.26 -4.70 115.26 119.25 2kvu n ASN 25 Ca 0.17 -3.70 0.04 0.00 1.68 0.00 0.00 54.58 52.78 2kvu n ASN 25 Cb 0.45 -0.37 0.40 0.00 -1.54 0.00 0.00 39.78 38.72 2kvu n ASN 25 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2kvu h LEU 26 N 2.29 0.00 -1.48 3.41 3.38 -1.96 -2.13 115.31 118.82 2kvu h LEU 26 Ca 0.34 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.25 2kvu h LEU 26 Cb 1.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 2kvu h LEU 26 CO 0.77 0.34 -0.26 0.44 0.09 0.00 0.00 178.44 179.81 2kvu h ASP 27 N 0.00 0.00 1.14 -0.43 5.19 -1.94 -2.49 116.42 117.89 2kvu h ASP 27 Ca -0.00 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.28 2kvu h ASP 27 Cb 0.63 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.12 2kvu h ASP 27 CO 0.04 0.26 -0.60 -0.78 -3.12 0.00 0.00 179.24 175.05 2kvu h ASP 28 N 0.00 0.00 -4.33 6.45 1.82 -1.75 -3.46 116.42 115.15 2kvu h ASP 28 Ca -0.00 0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 56.13 2kvu h ASP 28 Cb 0.48 0.00 0.10 0.00 0.68 0.00 0.00 39.33 40.59 2kvu h ASP 28 CO 0.03 0.60 0.36 -0.04 -1.61 0.00 0.00 179.24 178.59 2kvu s MET 29 N -3.12 2.82 0.64 0.28 -1.94 -0.94 -5.06 119.30 111.99 2kvu s MET 29 Ca 0.02 0.96 0.04 0.00 -1.71 0.00 0.00 55.69 54.99 2kvu s MET 29 Cb 0.09 -1.98 0.10 0.00 2.01 0.00 0.00 34.83 35.06 2kvu s MET 29 CO 0.75 -1.18 0.88 0.15 -0.01 0.00 0.00 175.02 175.61 2kvu s LYS 30 N -5.04 2.02 0.12 2.03 1.02 -1.26 -4.94 119.74 113.69 2kvu s LYS 30 Ca 0.58 -1.30 -0.17 0.00 0.02 0.00 0.00 55.97 55.11 2kvu s LYS 30 Cb -0.14 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.65 2kvu s LYS 30 CO 0.55 -1.13 1.67 0.28 -0.92 0.00 0.00 175.35 175.80 2kvu h VAL 31 N -0.17 1.18 -0.69 3.17 2.07 -1.97 -1.62 116.25 118.22 2kvu h VAL 31 Ca -0.34 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 2kvu h VAL 31 Cb 1.28 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 2kvu h VAL 31 CO 0.41 0.19 0.32 0.00 0.02 0.00 0.00 177.57 178.51 2kvu h ALA 32 N 0.98 1.27 -0.30 1.67 0.00 -1.99 -1.37 119.26 119.53 2kvu h ALA 32 Ca 0.11 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2kvu h ALA 32 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2kvu h ALA 32 CO -0.01 0.56 -0.02 0.93 0.00 0.00 0.00 179.25 180.71 2kvu h GLU 33 N 0.98 0.55 0.00 0.00 4.39 -1.89 -2.95 114.58 115.65 2kvu h GLU 33 Ca 0.24 -0.19 -0.06 0.00 0.34 0.00 0.00 59.36 59.69 2kvu h GLU 33 Cb 0.11 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2kvu h GLU 33 CO -0.03 0.71 -0.30 -0.07 -1.16 0.00 0.00 179.01 178.16 2kvu h LEU 34 N 0.33 0.00 -1.65 1.33 3.38 -0.92 -2.56 115.31 115.22 2kvu h LEU 34 Ca 0.08 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.08 2kvu h LEU 34 Cb 0.48 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2kvu h LEU 34 CO 0.02 0.30 0.28 0.11 0.09 0.00 0.00 178.44 179.24 2kvu h LYS 35 N 0.00 0.44 -0.41 1.13 1.57 -1.08 -0.54 116.57 117.68 2kvu h LYS 35 Ca -0.00 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 2kvu h LYS 35 Cb 0.54 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 2kvu h LYS 35 CO 0.04 0.29 -0.06 1.96 -0.57 0.00 0.00 179.45 181.12 2kvu h GLN 36 N 0.46 0.77 -0.11 3.15 1.08 -1.50 0.75 115.11 119.70 2kvu h GLN 36 Ca 0.17 -0.27 -0.09 0.00 -1.45 0.00 0.00 58.65 57.01 2kvu h GLN 36 Cb 0.12 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 2kvu h GLN 36 CO -0.04 0.87 -0.33 0.93 -0.95 0.00 0.00 178.83 179.31 2kvu h GLU 37 N 0.59 0.21 0.12 1.46 4.39 -1.43 -2.68 114.58 117.24 2kvu h GLU 37 Ca 0.11 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2kvu h GLU 37 Cb 0.56 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2kvu h GLU 37 CO 0.03 0.53 -0.06 -0.07 -1.16 0.00 0.00 179.01 178.28 2kvu h LEU 38 N 0.19 -0.14 -1.70 1.33 3.38 -0.84 -3.21 115.31 114.32 2kvu h LEU 38 Ca 0.02 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 2kvu h LEU 38 Cb 0.68 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2kvu h LEU 38 CO 0.05 0.40 0.11 0.07 0.09 0.00 0.00 178.44 179.16 2kvu h LYS 39 N -0.74 0.30 0.00 1.13 2.10 -0.83 0.26 116.57 118.79 2kvu h LYS 39 Ca -0.02 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 2kvu h LYS 39 Cb 0.54 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.80 2kvu h LYS 39 CO 0.03 0.24 0.00 1.28 -2.00 0.00 0.00 179.45 179.00 2kvu n LEU 40 N -4.46 0.47 -0.23 7.07 4.77 -1.02 -2.79 117.00 120.81 2kvu n LEU 40 Ca 0.00 0.57 0.06 0.00 -0.03 0.00 0.00 56.01 56.61 2kvu n LEU 40 Cb 0.11 -0.45 0.11 0.00 -2.33 0.00 0.00 43.42 40.86 2kvu n LEU 40 CO 0.35 -0.24 0.57 0.54 -1.33 0.00 0.00 177.39 177.28 2kvu n ARG 41 N -1.97 2.30 -1.97 3.23 1.74 -0.20 -4.96 116.66 114.83 2kvu n ARG 41 Ca 0.05 -2.18 -0.15 0.00 -0.77 0.00 0.00 57.85 54.79 2kvu n ARG 41 Cb 0.32 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.38 2kvu n ARG 41 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2kvu n SER 42 N -0.74 -4.72 -4.87 0.55 2.88 -0.84 -4.99 113.62 100.89 2kvu n SER 42 Ca 0.11 0.14 -0.34 0.00 -1.33 0.00 0.00 58.87 57.44 2kvu n SER 42 Cb 0.52 -3.75 -0.05 0.00 -0.75 0.00 0.00 64.21 60.18 2kvu n SER 42 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2kvu s LEU 43 N -4.08 4.34 0.14 2.46 1.43 0.76 -4.99 118.68 118.74 2kvu s LEU 43 Ca 0.00 0.81 -0.31 0.00 -1.03 0.00 0.00 54.13 53.59 2kvu s LEU 43 Cb 0.00 -3.05 -0.10 0.00 0.03 0.00 0.00 46.19 43.07 2kvu s LEU 43 CO 0.00 0.15 1.59 -2.16 0.23 0.00 0.00 176.35 176.16 2kvu s PRO 44 N -1.99 4.21 0.00 1.29 0.04 -1.26 -4.00 135.00 133.28 2kvu s PRO 44 Ca 0.34 2.35 0.25 0.00 0.04 0.00 0.00 61.00 63.99 2kvu s PRO 44 Cb -0.14 -3.26 0.73 0.00 0.04 0.00 0.00 34.50 31.87 2kvu s PRO 44 CO 0.19 -0.63 1.56 1.33 0.04 0.00 0.00 177.00 179.48 2kvu n VAL 45 N 4.15 0.09 -3.65 -0.36 0.24 -1.26 -4.87 118.33 112.67 2kvu n VAL 45 Ca 0.14 -0.37 -0.37 0.00 -2.04 0.00 0.00 64.34 61.70 2kvu n VAL 45 Cb 0.39 0.75 -0.06 0.00 -1.47 0.00 0.00 33.84 33.45 2kvu n VAL 45 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2kvu s SER 46 N -1.87 6.53 0.00 -1.34 1.04 -1.26 -4.94 113.70 111.85 2kvu s SER 46 Ca 0.35 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.40 2kvu s SER 46 Cb 0.20 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.16 2kvu s SER 46 CO 0.31 0.27 0.00 0.61 0.98 0.00 0.00 173.24 175.41 2kvu n GLY 47 N 2.45 1.49 3.80 7.32 0.00 -1.26 -4.94 105.19 114.05 2kvu n GLY 47 Ca -0.15 -1.93 -0.31 0.00 0.00 0.00 0.00 46.02 43.63 2kvu n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kvu s THR 48 N -1.22 3.69 0.30 2.61 -4.23 -1.26 -4.83 115.64 110.71 2kvu s THR 48 Ca 0.00 0.55 0.01 0.00 -1.18 0.00 0.00 61.69 61.07 2kvu s THR 48 Cb 0.00 -3.21 0.28 0.00 1.34 0.00 0.00 72.50 70.91 2kvu s THR 48 CO 0.00 -0.72 1.89 0.50 -0.54 0.00 0.00 174.62 175.75 2kvu h LYS 49 N -0.90 0.98 -0.28 3.99 3.64 -1.99 -0.25 116.57 121.76 2kvu h LYS 49 Ca -0.44 -0.06 0.04 0.00 -1.27 0.00 0.00 60.65 58.92 2kvu h LYS 49 Cb 1.22 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.78 2kvu h LYS 49 CO 0.55 0.65 0.03 1.15 -2.27 0.00 0.00 179.45 179.56 2kvu h THR 50 N 1.01 0.84 -0.20 1.00 2.02 -2.00 -0.61 112.91 114.97 2kvu h THR 50 Ca 0.42 -0.04 0.02 0.00 0.77 0.00 0.00 66.41 67.57 2kvu h THR 50 Cb 0.29 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2kvu h THR 50 CO -0.17 0.02 0.07 -0.33 0.37 0.00 0.00 175.52 175.49 2kvu h GLU 51 N 0.13 0.17 -0.02 6.66 5.08 -1.60 -1.35 114.58 123.65 2kvu h GLU 51 Ca 0.13 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.51 2kvu h GLU 51 Cb 0.16 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2kvu h GLU 51 CO -0.20 0.11 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.73 2kvu h LEU 52 N 0.17 -0.35 0.10 1.33 3.38 -0.56 0.42 115.31 119.80 2kvu h LEU 52 Ca 0.08 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 2kvu h LEU 52 Cb 0.05 0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2kvu h LEU 52 CO -0.08 -0.17 -0.05 0.40 0.09 0.00 0.00 178.44 178.63 2kvu h ILE 53 N -0.19 0.99 -0.18 1.22 2.04 -1.05 -1.48 117.51 118.85 2kvu h ILE 53 Ca 0.05 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 2kvu h ILE 53 Cb 0.26 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2kvu h ILE 53 CO -0.13 0.07 -0.24 -0.33 0.00 0.00 0.00 178.15 177.51 2kvu h GLU 54 N -0.27 0.33 -0.53 2.37 4.39 -1.07 0.10 114.58 119.91 2kvu h GLU 54 Ca -0.01 -0.11 -0.12 0.00 0.34 0.00 0.00 59.36 59.45 2kvu h GLU 54 Cb 0.22 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2kvu h GLU 54 CO 0.02 0.56 -0.15 -0.09 -1.16 0.00 0.00 179.01 178.19 2kvu h ARG 55 N 0.30 1.03 -0.25 2.33 2.43 -0.04 0.91 114.38 121.09 2kvu h ARG 55 Ca 0.05 -0.40 -0.02 0.00 -0.81 0.00 0.00 59.98 58.79 2kvu h ARG 55 Cb 0.60 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 2kvu h ARG 55 CO 0.04 1.09 0.08 -0.07 -1.51 0.00 0.00 179.97 179.60 2kvu h LEU 56 N 0.90 0.36 0.23 3.80 3.38 -0.80 -1.36 115.31 121.82 2kvu h LEU 56 Ca 0.13 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.91 2kvu h LEU 56 Cb 0.72 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2kvu h LEU 56 CO 0.06 0.47 -0.31 0.03 0.09 0.00 0.00 178.44 178.77 2kvu h ARG 57 N 0.23 -0.58 -0.59 1.13 3.08 -0.77 -0.60 114.38 116.28 2kvu h ARG 57 Ca 0.08 0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.18 2kvu h ARG 57 Cb 0.24 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 2kvu h ARG 57 CO -0.00 -0.39 0.39 0.00 -1.07 0.00 0.00 179.97 178.90 2kvu h ALA 58 N -0.01 1.62 -0.19 0.04 0.00 -0.81 0.51 119.26 120.42 2kvu h ALA 58 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2kvu h ALA 58 Cb 0.58 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2kvu h ALA 58 CO -0.11 0.34 -0.08 -0.92 0.00 0.00 0.00 179.25 178.49 2kvu h TYR 59 N 0.76 0.44 0.00 0.00 3.20 -0.87 -2.90 116.97 117.60 2kvu h TYR 59 Ca 0.22 -0.10 -0.19 0.00 3.14 0.00 0.00 58.73 61.80 2kvu h TYR 59 Cb -0.03 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.11 2kvu h TYR 59 CO -0.00 0.67 -0.91 0.37 -1.64 0.00 0.00 178.16 176.65 2kvu h GLN 60 N 0.08 0.00 -0.31 1.82 -0.00 -0.62 -3.30 115.11 112.78 2kvu h GLN 60 Ca 0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.69 2kvu h GLN 60 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 28.01 2kvu h GLN 60 CO 0.02 0.91 0.18 0.22 0.00 0.00 0.00 178.83 180.17 2kvu h ASP 61 N 0.00 0.38 0.38 -0.69 3.58 -0.00 -2.43 116.42 117.63 2kvu h ASP 61 Ca -0.01 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.37 2kvu h ASP 61 Cb 1.68 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.63 2kvu h ASP 61 CO 0.12 0.34 0.00 0.00 -2.88 0.00 0.00 179.24 176.82 2kvu n GLN 62 N -4.82 0.32 0.16 0.28 10.64 -1.10 -2.20 117.38 120.66 2kvu n GLN 62 Ca -0.01 0.08 0.02 0.00 -1.83 0.00 0.00 57.00 55.26 2kvu n GLN 62 Cb 0.06 -1.50 0.25 0.00 -0.86 0.00 0.00 30.24 28.19 2kvu n GLN 62 CO 0.00 0.00 0.00 0.82 -1.83 0.00 0.00 177.06 176.05 2kvu h ILE 63 N 0.00 1.14 -3.05 -0.39 2.04 -1.52 -3.44 117.51 112.30 2kvu h ILE 63 Ca 0.00 -1.83 -0.60 0.00 1.00 0.00 0.00 64.86 63.43 2kvu h ILE 63 Cb 0.19 2.05 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 2kvu h ILE 63 CO 0.00 0.48 -0.33 -0.55 0.00 0.00 0.00 178.15 177.75 2kvu s SER 64 N -6.62 6.52 -0.28 1.72 0.15 -0.94 -5.02 113.70 109.23 2kvu s SER 64 Ca -0.00 0.60 -0.28 0.00 0.70 0.00 0.00 55.95 56.97 2kvu s SER 64 Cb 0.12 -2.10 -0.06 0.00 -1.71 0.00 0.00 66.02 62.27 2kvu s SER 64 CO 0.72 0.15 2.27 -2.65 1.20 0.00 0.00 173.24 174.94 2kvu n PRO 65 N 0.63 1.73 -4.36 5.44 -0.02 -1.26 -4.97 135.00 132.20 2kvu n PRO 65 Ca -0.07 0.40 -0.30 0.00 -2.02 0.00 0.00 63.50 61.51 2kvu n PRO 65 Cb 0.52 -3.28 -0.11 0.00 -0.02 0.00 0.00 33.50 30.62 2kvu n PRO 65 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2kvu s VAL 66 N 9.25 3.19 -0.09 -1.45 -7.23 -1.26 -5.07 120.40 117.73 2kvu s VAL 66 Ca 1.01 -1.23 -0.33 0.00 -1.81 0.00 0.00 61.98 59.62 2kvu s VAL 66 Cb -0.31 -2.45 -0.10 0.00 0.56 0.00 0.00 36.38 34.09 2kvu s VAL 66 CO 0.33 0.19 1.97 -2.65 -0.31 0.00 0.00 175.10 174.63 2kvu n PRO 67 N 1.00 2.26 0.00 4.82 -0.02 -1.26 -2.21 135.00 139.58 2kvu n PRO 67 Ca -0.15 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2kvu n PRO 67 Cb 0.52 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 2kvu n PRO 67 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kvu n GLY 68 N 4.76 2.27 2.73 -1.23 0.00 -1.26 -4.74 105.19 107.72 2kvu n GLY 68 Ca 0.24 -0.49 -0.02 0.00 0.00 0.00 0.00 46.02 45.75 2kvu n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvu n ALA 69 N 0.00 -3.41 -1.58 4.61 0.00 -0.94 -4.80 120.51 114.40 2kvu n ALA 69 Ca 0.00 0.99 -0.46 0.00 0.00 0.00 0.00 53.44 53.98 2kvu n ALA 69 Cb 0.00 -2.00 -0.04 0.00 0.00 0.00 0.00 19.45 17.41 2kvu n ALA 69 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2kvu n PRO 70 N 1.07 1.89 -2.23 0.00 -0.02 -1.26 -4.95 135.00 129.49 2kvu n PRO 70 Ca -0.12 0.57 -0.38 0.00 -2.02 0.00 0.00 63.50 61.55 2kvu n PRO 70 Cb 0.21 -2.94 -0.01 0.00 -0.02 0.00 0.00 33.50 30.74 2kvu n PRO 70 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2kvu s LYS 71 N 5.78 3.94 -0.35 -0.52 2.20 -1.26 -4.87 119.74 124.67 2kvu s LYS 71 Ca 1.00 1.89 -0.38 0.00 -0.36 0.00 0.00 55.97 58.13 2kvu s LYS 71 Cb -0.52 -2.62 -0.13 0.00 -1.51 0.00 0.00 37.83 33.04 2kvu s LYS 71 CO 0.42 -0.43 2.09 0.00 -0.36 0.00 0.00 175.35 177.06 2kvu n ALA 72 N -0.07 0.68 -2.67 3.13 0.00 -1.26 -4.91 120.51 115.40 2kvu n ALA 72 Ca 0.05 0.08 -0.38 0.00 0.00 0.00 0.00 53.44 53.19 2kvu n ALA 72 Cb 0.46 -2.40 -0.06 0.00 0.00 0.00 0.00 19.45 17.45 2kvu n ALA 72 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2kvu s PRO 73 N 5.60 4.28 -0.04 0.00 0.05 -1.26 -5.08 135.00 138.54 2kvu s PRO 73 Ca 1.09 0.45 -0.02 0.00 0.05 0.00 0.00 61.00 62.56 2kvu s PRO 73 Cb -1.00 -3.40 -0.04 0.00 0.05 0.00 0.00 34.50 30.11 2kvu s PRO 73 CO 0.55 0.25 0.10 0.00 0.05 0.00 0.00 177.00 177.95 2kvu s ALA 74 N 0.34 3.68 -2.81 8.56 0.00 -1.26 -5.30 121.76 124.96 2kvu s ALA 74 Ca 0.26 -0.79 0.26 0.00 0.00 0.00 0.00 51.96 51.68 2kvu s ALA 74 Cb -0.15 -1.71 0.51 0.00 0.00 0.00 0.00 23.12 21.77 2kvu s ALA 74 CO 0.11 0.67 1.44 0.00 0.00 0.00 0.00 175.76 177.98