#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 -1.90 1.41 3.17 0.00 -1.26 -5.07 105.19 101.54 2kvu n GLY 2 Ca 0.00 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 2kvu n GLY 2 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2kvu n HIS 3 N -0.02 -0.33 -2.42 1.61 -0.00 -1.26 -5.09 115.22 107.72 2kvu n HIS 3 Ca 0.00 -1.22 -0.42 0.00 -0.00 0.00 0.00 57.72 56.07 2kvu n HIS 3 Cb 0.00 0.12 -0.02 0.00 -0.00 0.00 0.00 29.99 30.09 2kvu n HIS 3 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kvu s HIS 4 N -2.57 2.43 -0.11 4.41 4.02 -1.26 -4.82 115.29 117.39 2kvu s HIS 4 Ca 0.17 0.59 0.14 0.00 1.02 0.00 0.00 55.06 56.98 2kvu s HIS 4 Cb 0.01 -4.38 -0.03 0.00 -1.02 0.00 0.00 32.58 27.16 2kvu s HIS 4 CO 0.12 -1.85 1.25 0.45 1.02 0.00 0.00 174.74 175.74 2kvu h HIS 5 N 10.56 0.00 -3.33 1.40 3.86 -2.03 -3.45 115.15 122.16 2kvu h HIS 5 Ca -0.26 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.28 2kvu h HIS 5 Cb 1.09 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.40 2kvu h HIS 5 CO 1.00 0.60 -0.63 -1.58 0.86 0.00 0.00 177.93 178.19 2kvu s HIS 6 N -2.91 3.14 0.16 2.45 5.04 -1.26 -5.08 115.29 116.84 2kvu s HIS 6 Ca 0.02 0.11 -0.31 0.00 -1.54 0.00 0.00 55.06 53.34 2kvu s HIS 6 Cb 0.08 -1.83 -0.11 0.00 0.04 0.00 0.00 32.58 30.76 2kvu s HIS 6 CO 0.77 0.38 1.77 -1.58 -2.34 0.00 0.00 174.74 173.74 2kvu s HIS 7 N -0.62 2.54 0.09 3.88 5.65 -1.26 -4.93 115.29 120.63 2kvu s HIS 7 Ca 0.10 0.17 -0.31 0.00 0.25 0.00 0.00 55.06 55.28 2kvu s HIS 7 Cb -0.12 -4.15 -0.07 0.00 -1.18 0.00 0.00 32.58 27.06 2kvu s HIS 7 CO 0.02 -4.56 1.39 -3.38 -0.65 0.00 0.00 174.74 167.56 2kvu s HIS 8 N 1.95 3.15 0.05 3.88 0.00 -1.26 -4.94 115.29 118.11 2kvu s HIS 8 Ca 0.78 0.93 -0.31 0.00 -3.00 0.00 0.00 55.06 53.46 2kvu s HIS 8 Cb -0.48 -3.67 -0.06 0.00 -4.00 0.00 0.00 32.58 24.37 2kvu s HIS 8 CO 0.34 -2.38 1.37 -1.12 -1.00 0.00 0.00 174.74 171.95 2kvu s SER 9 N 1.30 6.87 -0.44 7.38 0.01 -1.26 -4.99 113.70 122.57 2kvu s SER 9 Ca 0.64 2.18 -0.10 0.00 1.31 0.00 0.00 55.95 59.98 2kvu s SER 9 Cb -0.35 -2.57 0.09 0.00 0.21 0.00 0.00 66.02 63.39 2kvu s SER 9 CO 0.29 -0.66 0.30 -2.28 0.41 0.00 0.00 173.24 171.31 2kvu s HIS 10 N 1.77 3.34 -0.35 2.43 5.65 -1.26 -4.99 115.29 121.88 2kvu s HIS 10 Ca 0.63 -1.52 -0.00 0.00 0.25 0.00 0.00 55.06 54.42 2kvu s HIS 10 Cb -0.33 -3.14 0.13 0.00 -1.18 0.00 0.00 32.58 28.07 2kvu s HIS 10 CO 0.28 -0.88 0.20 1.41 -0.65 0.00 0.00 174.74 175.10 2kvu s MET 11 N 1.44 0.52 -0.58 2.88 0.00 -1.26 -5.05 119.30 117.26 2kvu s MET 11 Ca 0.04 -1.25 0.04 0.00 0.00 0.00 0.00 55.69 54.52 2kvu s MET 11 Cb -0.24 -1.31 0.16 0.00 0.00 0.00 0.00 34.83 33.44 2kvu s MET 11 CO 0.02 -1.19 0.40 0.45 0.00 0.00 0.00 175.02 174.71 2kvu s SER 12 N 1.18 3.77 0.08 1.11 0.15 -1.26 -5.08 113.70 113.65 2kvu s SER 12 Ca 0.17 -3.42 -0.08 0.00 0.70 0.00 0.00 55.95 53.33 2kvu s SER 12 Cb -0.22 -1.25 -0.01 0.00 -1.71 0.00 0.00 66.02 62.83 2kvu s SER 12 CO -0.04 -0.14 0.16 0.42 1.20 0.00 0.00 173.24 174.84 2kvu s THR 13 N -0.73 0.15 -0.11 6.45 -4.23 -1.26 -5.11 115.64 110.80 2kvu s THR 13 Ca 0.25 -1.26 -0.29 0.00 -1.18 0.00 0.00 61.69 59.22 2kvu s THR 13 Cb -0.07 -1.34 -0.06 0.00 1.34 0.00 0.00 72.50 72.37 2kvu s THR 13 CO -0.14 -0.69 2.02 -2.16 -0.54 0.00 0.00 174.62 173.11 2kvu s PRO 14 N -3.78 3.66 -0.54 3.99 0.04 -1.26 -4.93 135.00 132.17 2kvu s PRO 14 Ca 0.05 2.22 -0.28 0.00 0.04 0.00 0.00 61.00 63.03 2kvu s PRO 14 Cb 0.05 -4.23 0.03 0.00 0.04 0.00 0.00 34.50 30.39 2kvu s PRO 14 CO -0.10 -1.50 1.15 -1.17 0.04 0.00 0.00 177.00 175.42 2kvu s LEU 15 N 6.21 3.57 -0.25 -3.56 0.20 -1.26 -4.98 118.68 118.61 2kvu s LEU 15 Ca 0.91 0.18 0.02 0.00 0.69 0.00 0.00 54.13 55.94 2kvu s LEU 15 Cb -0.36 -3.26 0.05 0.00 -0.43 0.00 0.00 46.19 42.20 2kvu s LEU 15 CO 0.37 -1.38 -0.13 0.42 -0.29 0.00 0.00 176.35 175.34 2kvu s THR 16 N 4.69 2.17 -0.69 3.68 -4.23 -1.26 -5.07 115.64 114.94 2kvu s THR 16 Ca 0.43 -1.49 -0.09 0.00 -1.18 0.00 0.00 61.69 59.36 2kvu s THR 16 Cb -0.08 -2.21 0.18 0.00 1.34 0.00 0.00 72.50 71.73 2kvu s THR 16 CO 0.27 0.08 0.56 -0.83 -0.54 0.00 0.00 174.62 174.16 2kvu s GLY 17 N 1.14 2.50 -0.32 3.99 0.00 -1.26 -5.04 107.32 108.34 2kvu s GLY 17 Ca -0.06 -3.18 -0.09 0.00 0.00 0.00 0.00 44.72 41.40 2kvu s GLY 17 CO -0.06 1.17 0.13 1.25 0.00 0.00 0.00 173.10 175.59 2kvu s LYS 18 N 0.25 3.13 -0.30 2.90 2.20 -1.26 -5.07 119.74 121.61 2kvu s LYS 18 Ca 0.16 -0.85 -0.29 0.00 -0.36 0.00 0.00 55.97 54.63 2kvu s LYS 18 Cb -0.17 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.65 2kvu s LYS 18 CO -0.05 -0.48 1.19 -2.14 -0.36 0.00 0.00 175.35 173.51 2kvu s PRO 19 N 1.55 4.02 -1.31 4.03 0.02 -1.26 -4.95 135.00 137.10 2kvu s PRO 19 Ca 0.03 1.21 -0.08 0.00 0.02 0.00 0.00 61.00 62.18 2kvu s PRO 19 Cb -0.18 -3.80 0.14 0.00 0.02 0.00 0.00 34.50 30.69 2kvu s PRO 19 CO 0.05 -0.97 2.12 0.41 -0.33 0.00 0.00 177.00 178.28 2kvu n GLY 20 N 4.02 4.93 0.00 0.52 0.00 -1.26 -4.88 105.19 108.52 2kvu n GLY 20 Ca 0.13 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.10 2kvu n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvu n ALA 21 N 3.02 0.00 -2.65 4.61 0.00 -1.26 -5.06 120.51 119.17 2kvu n ALA 21 Ca 0.50 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.67 2kvu n ALA 21 Cb 0.31 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.68 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 3.25 0.92 0.00 1.43 -1.26 -5.14 118.68 117.89 2kvu s LEU 22 Ca 0.00 -0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 52.56 2kvu s LEU 22 Cb 0.00 -1.91 0.14 0.00 0.03 0.00 0.00 46.19 44.45 2kvu s LEU 22 CO 0.00 0.10 1.13 -2.16 0.23 0.00 0.00 176.35 175.65 2kvu s PRO 23 N -2.89 1.04 0.17 1.29 0.04 -1.26 -4.99 135.00 128.41 2kvu s PRO 23 Ca 0.27 0.33 0.23 0.00 0.04 0.00 0.00 61.00 61.87 2kvu s PRO 23 Cb -0.09 -1.82 0.16 0.00 0.04 0.00 0.00 34.50 32.79 2kvu s PRO 23 CO 0.18 -2.27 1.18 0.00 0.04 0.00 0.00 177.00 176.13 2kvu h ALA 24 N -1.55 0.54 -0.55 8.56 0.00 -2.07 -3.36 119.26 120.82 2kvu h ALA 24 Ca -0.51 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.08 2kvu h ALA 24 Cb 1.33 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.95 2kvu h ALA 24 CO 0.61 0.00 0.40 0.09 0.00 0.00 0.00 179.25 180.35 2kvu n ASN 25 N -2.41 4.53 -0.17 0.00 4.13 -1.26 -4.51 115.26 115.57 2kvu n ASN 25 Ca 0.02 -2.98 0.03 0.00 1.68 0.00 0.00 54.58 53.33 2kvu n ASN 25 Cb 0.49 -0.81 0.31 0.00 -1.54 0.00 0.00 39.78 38.24 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 1.50 0.73 0.00 3.41 3.38 -1.95 0.06 115.31 122.44 2kvu h LEU 26 Ca 0.34 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2kvu h LEU 26 Cb 1.64 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2kvu h LEU 26 CO 0.70 0.51 -0.38 -2.24 0.09 0.00 0.00 178.44 177.11 2kvu h ASP 27 N 0.85 0.00 0.46 -0.43 2.03 -1.95 -3.26 116.42 114.11 2kvu h ASP 27 Ca 0.27 -0.10 -0.30 0.00 -0.73 0.00 0.00 57.03 56.17 2kvu h ASP 27 Cb 0.04 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.53 2kvu h ASP 27 CO -0.07 0.05 -1.52 -0.78 -1.03 0.00 0.00 179.24 175.88 2kvu h ASP 28 N 0.00 0.39 -4.24 4.15 3.58 -1.49 -3.47 116.42 115.35 2kvu h ASP 28 Ca 0.00 -0.54 -0.53 0.00 0.42 0.00 0.00 57.03 56.39 2kvu h ASP 28 Cb 0.80 -0.13 0.17 0.00 1.72 0.00 0.00 39.33 41.89 2kvu h ASP 28 CO 0.00 1.45 0.31 -0.04 -2.88 0.00 0.00 179.24 178.08 2kvu s MET 29 N -2.62 1.65 1.16 0.28 -1.94 -0.14 -5.02 119.30 112.67 2kvu s MET 29 Ca -0.09 1.60 -0.19 0.00 -1.71 0.00 0.00 55.69 55.30 2kvu s MET 29 Cb 0.07 -1.79 0.27 0.00 2.01 0.00 0.00 34.83 35.39 2kvu s MET 29 CO 0.85 -2.17 1.17 0.15 -0.01 0.00 0.00 175.02 175.01 2kvu s LYS 30 N -4.36 -0.90 0.06 2.03 1.02 -1.26 -4.89 119.74 111.44 2kvu s LYS 30 Ca 0.69 -0.22 -0.18 0.00 0.02 0.00 0.00 55.97 56.28 2kvu s LYS 30 Cb -0.25 -1.65 -0.12 0.00 -0.52 0.00 0.00 37.83 35.29 2kvu s LYS 30 CO 0.52 -3.47 1.36 0.28 -0.92 0.00 0.00 175.35 173.13 2kvu h VAL 31 N -2.40 1.33 -0.35 3.17 2.07 -1.96 -2.80 116.25 115.31 2kvu h VAL 31 Ca -0.44 -1.42 -0.05 0.00 0.82 0.00 0.00 66.70 65.61 2kvu h VAL 31 Cb 1.27 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.82 2kvu h VAL 31 CO 0.32 0.43 -0.00 0.00 0.02 0.00 0.00 177.57 178.34 2kvu h ALA 32 N 0.63 1.35 -0.74 1.67 0.00 -1.99 -2.03 119.26 118.15 2kvu h ALA 32 Ca 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2kvu h ALA 32 Cb 0.79 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2kvu h ALA 32 CO 0.06 0.45 0.39 0.93 0.00 0.00 0.00 179.25 181.08 2kvu h GLU 33 N 0.52 1.05 -0.47 0.00 4.39 -1.90 -0.22 114.58 117.95 2kvu h GLU 33 Ca 0.11 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.56 2kvu h GLU 33 Cb 0.34 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2kvu h GLU 33 CO 0.01 0.79 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.43 2kvu h LEU 34 N 1.03 0.90 -1.66 1.33 3.38 -1.21 -2.53 115.31 116.55 2kvu h LEU 34 Ca 0.26 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2kvu h LEU 34 Cb 0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2kvu h LEU 34 CO -0.04 1.05 -0.14 0.11 0.09 0.00 0.00 178.44 179.51 2kvu h LYS 35 N 0.79 0.04 -0.19 1.13 1.57 -0.73 -1.54 116.57 117.65 2kvu h LYS 35 Ca 0.12 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2kvu h LYS 35 Cb 0.69 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2kvu h LYS 35 CO 0.05 0.18 0.11 1.96 -0.57 0.00 0.00 179.45 181.18 2kvu h GLN 36 N 0.04 0.25 -0.53 3.15 1.08 -0.62 -0.54 115.11 117.94 2kvu h GLN 36 Ca 0.01 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 2kvu h GLN 36 Cb 0.27 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 2kvu h GLN 36 CO 0.02 0.21 0.23 0.93 -0.95 0.00 0.00 178.83 179.27 2kvu h GLU 37 N 0.22 0.79 0.47 1.46 4.39 -1.32 -2.26 114.58 118.33 2kvu h GLU 37 Ca 0.07 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 2kvu h GLU 37 Cb 0.02 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 2kvu h GLU 37 CO -0.01 0.68 -0.37 -0.07 -1.16 0.00 0.00 179.01 178.08 2kvu h LEU 38 N 0.72 -0.96 -1.24 1.33 3.38 -1.03 -1.61 115.31 115.90 2kvu h LEU 38 Ca 0.18 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.16 2kvu h LEU 38 Cb 0.17 0.31 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2kvu h LEU 38 CO -0.02 -0.54 -0.16 0.07 0.09 0.00 0.00 178.44 177.88 2kvu h LYS 39 N -0.83 0.32 0.00 1.13 2.10 -1.09 0.12 116.57 118.33 2kvu h LYS 39 Ca -0.05 -0.09 -0.10 0.00 -2.00 0.00 0.00 60.65 58.41 2kvu h LYS 39 Cb 0.71 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.99 2kvu h LYS 39 CO -0.00 0.49 -0.50 -0.07 -2.00 0.00 0.00 179.45 177.37 2kvu h LEU 40 N 0.30 0.00 -3.08 7.07 3.38 -1.26 -2.91 115.31 118.80 2kvu h LEU 40 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2kvu h LEU 40 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2kvu h LEU 40 CO 0.03 0.50 0.00 0.54 0.09 0.00 0.00 178.44 179.60 2kvu n ARG 41 N -3.71 3.41 -2.73 1.13 1.74 -0.62 -4.98 116.66 110.90 2kvu n ARG 41 Ca -0.01 -2.72 -0.02 0.00 -0.77 0.00 0.00 57.85 54.33 2kvu n ARG 41 Cb 0.56 -1.75 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 2kvu n ARG 41 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2kvu n SER 42 N 0.83 -6.82 -3.96 0.55 7.64 -0.46 -5.03 113.62 106.37 2kvu n SER 42 Ca 0.23 0.10 -0.09 0.00 1.01 0.00 0.00 58.87 60.12 2kvu n SER 42 Cb 0.79 -4.57 -0.09 0.00 -1.01 0.00 0.00 64.21 59.32 2kvu n SER 42 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2kvu s LEU 43 N -3.24 1.95 0.12 -3.43 1.43 0.29 -4.98 118.68 110.82 2kvu s LEU 43 Ca 0.06 -0.67 -0.31 0.00 -1.03 0.00 0.00 54.13 52.18 2kvu s LEU 43 Cb -0.02 0.53 -0.09 0.00 0.03 0.00 0.00 46.19 46.65 2kvu s LEU 43 CO 0.62 -0.55 1.51 -2.84 0.23 0.00 0.00 176.35 175.32 2kvu s PRO 44 N -3.05 4.25 0.00 1.29 0.02 -1.26 -4.13 135.00 132.12 2kvu s PRO 44 Ca -0.01 2.22 0.22 0.00 0.02 0.00 0.00 61.00 63.45 2kvu s PRO 44 Cb 0.02 -3.29 -0.07 0.00 0.02 0.00 0.00 34.50 31.17 2kvu s PRO 44 CO -0.07 -0.57 1.03 1.33 -0.33 0.00 0.00 177.00 178.39 2kvu n VAL 45 N 4.14 0.00 -2.54 3.83 0.24 -1.26 -4.92 118.33 117.83 2kvu n VAL 45 Ca 0.13 -0.14 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 2kvu n VAL 45 Cb 0.41 1.10 -0.03 0.00 -1.47 0.00 0.00 33.84 33.84 2kvu n VAL 45 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2kvu s SER 46 N -2.72 7.19 0.00 -1.34 0.15 -1.26 -4.89 113.70 110.82 2kvu s SER 46 Ca 0.14 1.86 0.00 0.00 0.70 0.00 0.00 55.95 58.65 2kvu s SER 46 Cb 0.17 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.91 2kvu s SER 46 CO 0.71 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 175.36 2kvu n GLY 47 N 3.10 -0.02 3.78 9.45 0.00 -1.26 -4.97 105.19 115.28 2kvu n GLY 47 Ca 0.08 -1.49 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.82 1.73 0.15 2.61 -4.23 -1.26 -4.97 115.64 106.85 2kvu s THR 48 Ca 0.00 -1.77 -0.27 0.00 -1.18 0.00 0.00 61.69 58.47 2kvu s THR 48 Cb 0.00 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 2kvu s THR 48 CO 0.00 0.00 1.58 0.50 -0.54 0.00 0.00 174.62 176.16 2kvu h LYS 49 N 1.26 -0.36 -0.71 3.99 1.63 -1.97 -0.46 116.57 119.95 2kvu h LYS 49 Ca -0.42 0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.37 2kvu h LYS 49 Cb 1.28 0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.96 2kvu h LYS 49 CO 0.69 -0.24 0.30 1.15 -3.45 0.00 0.00 179.45 177.90 2kvu h THR 50 N -0.38 1.24 -0.30 1.00 2.02 -2.00 -1.83 112.91 112.67 2kvu h THR 50 Ca 0.12 -0.73 0.01 0.00 0.77 0.00 0.00 66.41 66.58 2kvu h THR 50 Cb 0.59 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2kvu h THR 50 CO -0.49 0.30 0.18 -0.08 0.37 0.00 0.00 175.52 175.80 2kvu h GLU 51 N 1.02 0.37 -0.35 6.66 4.22 -1.76 -2.59 114.58 122.15 2kvu h GLU 51 Ca 0.24 -0.02 -0.14 0.00 0.08 0.00 0.00 59.36 59.52 2kvu h GLU 51 Cb 0.17 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2kvu h GLU 51 CO -0.02 0.24 -0.35 -0.07 -2.18 0.00 0.00 179.01 176.63 2kvu h LEU 52 N 0.38 0.85 0.14 1.64 3.38 -0.73 -1.63 115.31 119.34 2kvu h LEU 52 Ca 0.12 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.72 2kvu h LEU 52 Cb -0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2kvu h LEU 52 CO -0.04 1.12 -0.16 0.40 0.09 0.00 0.00 178.44 179.84 2kvu h ILE 53 N 0.67 0.64 -0.52 1.22 2.04 -1.21 -0.21 117.51 120.14 2kvu h ILE 53 Ca 0.07 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.88 2kvu h ILE 53 Cb 0.90 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2kvu h ILE 53 CO 0.08 0.00 0.13 -0.33 0.00 0.00 0.00 178.15 178.03 2kvu h GLU 54 N -0.34 0.80 -0.63 2.37 4.39 -1.41 -2.17 114.58 117.60 2kvu h GLU 54 Ca 0.01 -0.16 -0.08 0.00 0.34 0.00 0.00 59.36 59.47 2kvu h GLU 54 Cb 0.33 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2kvu h GLU 54 CO -0.06 0.72 0.07 -0.09 -1.16 0.00 0.00 179.01 178.50 2kvu h ARG 55 N 0.77 1.06 -0.59 2.33 2.43 -0.88 -0.93 114.38 118.57 2kvu h ARG 55 Ca 0.17 -0.30 -0.05 0.00 -0.81 0.00 0.00 59.98 58.99 2kvu h ARG 55 Cb 0.28 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 2kvu h ARG 55 CO -0.00 1.00 0.15 -0.07 -1.51 0.00 0.00 179.97 179.54 2kvu h LEU 56 N 0.97 0.88 -0.36 3.80 3.38 -0.76 -0.26 115.31 122.96 2kvu h LEU 56 Ca 0.19 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2kvu h LEU 56 Cb 0.47 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2kvu h LEU 56 CO 0.02 0.88 0.23 0.03 0.09 0.00 0.00 178.44 179.69 2kvu h ARG 57 N 0.84 0.47 -0.61 1.13 3.08 -1.01 0.25 114.38 118.52 2kvu h ARG 57 Ca 0.18 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.14 2kvu h ARG 57 Cb 0.33 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 2kvu h ARG 57 CO -0.00 0.31 0.13 0.00 -1.07 0.00 0.00 179.97 179.33 2kvu h ALA 58 N 1.13 0.81 0.15 0.04 0.00 -1.04 -2.31 119.26 118.04 2kvu h ALA 58 Ca 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2kvu h ALA 58 Cb -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2kvu h ALA 58 CO -0.03 0.54 -0.07 -0.92 0.00 0.00 0.00 179.25 178.77 2kvu h TYR 59 N 0.91 -0.18 -0.05 0.00 3.20 -0.61 -1.13 116.97 119.10 2kvu h TYR 59 Ca 0.19 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.99 2kvu h TYR 59 Cb 0.39 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2kvu h TYR 59 CO 0.03 -0.04 -0.26 0.37 -1.64 0.00 0.00 178.16 176.62 2kvu h GLN 60 N -0.29 0.08 -0.18 1.82 5.75 -0.93 -1.94 115.11 119.43 2kvu h GLN 60 Ca -0.02 -0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.33 2kvu h GLN 60 Cb 0.23 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.77 2kvu h GLN 60 CO 0.03 0.34 -0.37 0.22 -2.65 0.00 0.00 178.83 176.41 2kvu h ASP 61 N 0.08 0.63 0.86 -0.69 3.58 -1.24 -2.85 116.42 116.79 2kvu h ASP 61 Ca 0.01 -0.56 -0.00 0.00 0.42 0.00 0.00 57.03 56.90 2kvu h ASP 61 Cb 0.50 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.37 2kvu h ASP 61 CO 0.04 1.07 -0.02 0.06 -2.88 0.00 0.00 179.24 177.51 2kvu h GLN 62 N 0.21 0.00 0.43 0.28 3.07 -0.85 -1.68 115.11 116.57 2kvu h GLN 62 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 2kvu h GLN 62 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.53 2kvu h GLN 62 CO 0.08 0.02 -0.21 0.82 0.09 0.00 0.00 178.83 179.63 2kvu h ILE 63 N 0.00 0.56 -2.33 1.86 1.08 -1.24 -3.50 117.51 113.94 2kvu h ILE 63 Ca -0.00 -0.28 0.24 0.00 -0.39 0.00 0.00 64.86 64.43 2kvu h ILE 63 Cb 0.45 0.69 -0.12 0.00 -3.07 0.00 0.00 36.82 34.77 2kvu h ILE 63 CO 0.00 0.05 -0.80 -1.20 -0.69 0.00 0.00 178.15 175.51 2kvu n SER 64 N -5.27 -5.37 -4.59 1.72 7.64 -0.63 -4.62 113.62 102.50 2kvu n SER 64 Ca -0.11 0.92 -0.42 0.00 1.01 0.00 0.00 58.87 60.27 2kvu n SER 64 Cb 0.28 -3.28 -0.03 0.00 -1.01 0.00 0.00 64.21 60.17 2kvu n SER 64 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2kvu s PRO 65 N -3.64 3.17 -0.05 1.43 0.02 -1.26 -4.93 135.00 129.73 2kvu s PRO 65 Ca 0.00 1.42 -0.29 0.00 0.02 0.00 0.00 61.00 62.14 2kvu s PRO 65 Cb 0.00 -4.26 -0.07 0.00 0.02 0.00 0.00 34.50 30.18 2kvu s PRO 65 CO 0.00 -2.06 2.01 0.14 -0.33 0.00 0.00 177.00 176.76 2kvu s VAL 66 N 7.59 3.07 -0.49 3.83 -7.23 -1.26 -4.86 120.40 121.05 2kvu s VAL 66 Ca 0.82 0.08 -0.26 0.00 -1.81 0.00 0.00 61.98 60.81 2kvu s VAL 66 Cb -0.22 -3.06 -0.05 0.00 0.56 0.00 0.00 36.38 33.60 2kvu s VAL 66 CO 0.32 -0.02 2.19 -2.84 -0.31 0.00 0.00 175.10 174.44 2kvu s PRO 67 N 4.98 2.42 0.00 4.82 0.02 -1.26 -1.61 135.00 144.36 2kvu s PRO 67 Ca 0.90 1.23 0.00 0.00 0.02 0.00 0.00 61.00 63.16 2kvu s PRO 67 Cb -0.39 -4.48 0.00 0.00 0.02 0.00 0.00 34.50 29.65 2kvu s PRO 67 CO 0.39 -2.93 0.00 0.41 -0.33 0.00 0.00 177.00 174.54 2kvu n GLY 68 N 5.86 2.38 1.59 0.52 0.00 -1.26 -4.59 105.19 109.69 2kvu n GLY 68 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 0.26 -2.28 -1.63 4.61 0.00 -0.64 -4.81 120.51 116.02 2kvu n ALA 69 Ca 0.00 0.36 -0.52 0.00 0.00 0.00 0.00 53.44 53.28 2kvu n ALA 69 Cb 0.00 -1.22 -0.06 0.00 0.00 0.00 0.00 19.45 18.17 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 1.08 1.52 -3.25 0.00 -0.02 -1.26 -4.88 135.00 128.19 2kvu n PRO 70 Ca 0.00 0.53 -0.46 0.00 -2.02 0.00 0.00 63.50 61.55 2kvu n PRO 70 Cb 0.00 -2.43 -0.01 0.00 -0.02 0.00 0.00 33.50 31.04 2kvu n PRO 70 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2kvu s LYS 71 N 4.57 3.83 -0.51 -0.52 0.00 -1.26 -4.98 119.74 120.87 2kvu s LYS 71 Ca 1.00 -2.61 -0.17 0.00 0.00 0.00 0.00 55.97 54.18 2kvu s LYS 71 Cb -0.86 -4.58 0.08 0.00 0.00 0.00 0.00 37.83 32.47 2kvu s LYS 71 CO 0.55 -1.38 0.51 0.00 0.00 0.00 0.00 175.35 175.04 2kvu s ALA 72 N 0.17 3.50 0.98 0.59 0.00 -1.26 -5.07 121.76 120.67 2kvu s ALA 72 Ca 0.26 -2.08 -0.15 0.00 0.00 0.00 0.00 51.96 49.99 2kvu s ALA 72 Cb -0.09 -3.24 0.21 0.00 0.00 0.00 0.00 23.12 20.01 2kvu s ALA 72 CO -0.08 -1.93 1.26 -0.35 0.00 0.00 0.00 175.76 174.66 2kvu n PRO 73 N 5.63 -1.15 -0.54 0.00 -0.05 -1.26 -5.00 135.00 132.63 2kvu n PRO 73 Ca -0.11 -2.05 0.05 0.00 -0.05 0.00 0.00 63.50 61.35 2kvu n PRO 73 Cb 0.43 -1.26 0.25 0.00 -0.05 0.00 0.00 33.50 32.87 2kvu n PRO 73 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2kvu n ALA 74 N -3.75 3.32 0.87 0.55 0.00 -1.26 -5.33 120.51 114.91 2kvu n ALA 74 Ca -0.20 -2.46 0.10 0.00 0.00 0.00 0.00 53.44 50.88 2kvu n ALA 74 Cb 0.56 -0.75 0.09 0.00 0.00 0.00 0.00 19.45 19.34 2kvu n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50