#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 2.16 3.61 3.17 0.00 -1.26 -4.75 105.19 108.12 2kvu n GLY 2 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 2kvu n GLY 2 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kvu s HIS 3 N 0.00 -0.40 -0.29 1.61 5.65 -1.26 -5.13 115.29 115.47 2kvu s HIS 3 Ca 0.00 0.87 -0.29 0.00 0.25 0.00 0.00 55.06 55.89 2kvu s HIS 3 Cb 0.00 0.41 0.01 0.00 -1.18 0.00 0.00 32.58 31.82 2kvu s HIS 3 CO 0.00 -0.26 1.04 -1.58 -0.65 0.00 0.00 174.74 173.29 2kvu s HIS 4 N -0.35 3.22 -0.06 3.88 5.65 -1.26 -5.01 115.29 121.37 2kvu s HIS 4 Ca 0.01 1.26 -0.07 0.00 0.25 0.00 0.00 55.06 56.52 2kvu s HIS 4 Cb -0.03 -3.51 0.02 0.00 -1.18 0.00 0.00 32.58 27.87 2kvu s HIS 4 CO -0.04 -0.65 0.18 -3.38 -0.65 0.00 0.00 174.74 170.20 2kvu s HIS 5 N 3.44 -0.16 0.12 3.88 -0.00 -1.26 -5.16 115.29 116.16 2kvu s HIS 5 Ca 0.44 0.38 0.06 0.00 -0.00 0.00 0.00 55.06 55.94 2kvu s HIS 5 Cb -0.13 0.05 -0.04 0.00 -0.00 0.00 0.00 32.58 32.46 2kvu s HIS 5 CO 0.12 -0.14 -0.15 -3.38 -0.00 0.00 0.00 174.74 171.18 2kvu s HIS 6 N -0.21 1.48 0.22 0.38 -3.43 -1.26 -5.11 115.29 107.36 2kvu s HIS 6 Ca -0.03 -0.52 -0.32 0.00 -0.80 0.00 0.00 55.06 53.40 2kvu s HIS 6 Cb -0.03 -0.78 -0.13 0.00 -1.43 0.00 0.00 32.58 30.22 2kvu s HIS 6 CO 0.01 0.17 1.61 -2.39 -2.00 0.00 0.00 174.74 172.13 2kvu n HIS 7 N 0.66 2.58 -3.57 0.38 -0.00 -1.26 -4.97 115.22 109.04 2kvu n HIS 7 Ca -0.16 0.21 -0.13 0.00 -0.00 0.00 0.00 57.72 57.64 2kvu n HIS 7 Cb 0.56 -2.59 -0.06 0.00 -0.00 0.00 0.00 29.99 27.91 2kvu n HIS 7 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2kvu s HIS 8 N 0.61 -0.48 -0.02 -1.40 -0.00 -1.26 -5.13 115.29 107.61 2kvu s HIS 8 Ca 0.72 0.88 -0.30 0.00 -0.00 0.00 0.00 55.06 56.36 2kvu s HIS 8 Cb -0.57 0.42 -0.06 0.00 -0.00 0.00 0.00 32.58 32.38 2kvu s HIS 8 CO 0.41 -0.42 1.65 -1.12 -0.00 0.00 0.00 174.74 175.26 2kvu s SER 9 N -0.97 6.66 -1.14 7.38 0.01 -1.26 -4.89 113.70 119.48 2kvu s SER 9 Ca -0.04 2.30 -0.22 0.00 1.31 0.00 0.00 55.95 59.30 2kvu s SER 9 Cb -0.01 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.66 2kvu s SER 9 CO 0.04 -0.91 1.82 -2.28 0.41 0.00 0.00 173.24 172.32 2kvu s HIS 10 N 3.63 2.23 0.27 2.43 5.65 -1.26 -4.20 115.29 124.04 2kvu s HIS 10 Ca 0.73 -0.25 0.00 0.00 0.25 0.00 0.00 55.06 55.80 2kvu s HIS 10 Cb -0.35 -4.31 0.00 0.00 -1.18 0.00 0.00 32.58 26.74 2kvu s HIS 10 CO 0.30 -1.56 0.00 -1.33 -0.65 0.00 0.00 174.74 171.50 2kvu n MET 11 N 8.50 0.00 -2.42 2.88 2.00 -1.26 -5.01 117.12 121.80 2kvu n MET 11 Ca 0.44 0.00 -0.40 0.00 0.00 0.00 0.00 57.70 57.73 2kvu n MET 11 Cb 0.47 -0.07 -0.03 0.00 0.00 0.00 0.00 33.22 33.59 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 -5.15 5.94 -0.19 7.83 0.01 -1.26 -4.98 113.70 115.90 2kvu s SER 12 Ca 0.00 -0.26 -0.06 0.00 1.31 0.00 0.00 55.95 56.94 2kvu s SER 12 Cb 0.00 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 2kvu s SER 12 CO 0.00 -1.98 0.03 -0.89 0.41 0.00 0.00 173.24 170.81 2kvu s THR 13 N 6.58 4.36 -0.72 1.44 2.01 -1.26 -5.05 115.64 123.01 2kvu s THR 13 Ca 0.43 -0.18 -0.26 0.00 0.31 0.00 0.00 61.69 61.99 2kvu s THR 13 Cb -0.09 -2.96 -0.03 0.00 0.01 0.00 0.00 72.50 69.42 2kvu s THR 13 CO 0.16 0.45 1.91 -2.84 -0.69 0.00 0.00 174.62 173.61 2kvu s PRO 14 N 0.63 2.57 0.06 4.92 0.02 -1.26 -4.76 135.00 137.18 2kvu s PRO 14 Ca 0.01 0.30 -0.07 0.00 0.02 0.00 0.00 61.00 61.25 2kvu s PRO 14 Cb -0.14 -4.65 -0.30 0.00 0.02 0.00 0.00 34.50 29.43 2kvu s PRO 14 CO 0.02 -3.01 1.08 1.25 -0.33 0.00 0.00 177.00 176.01 2kvu h LEU 15 N 17.13 0.53 -6.65 -5.54 7.12 -2.02 -3.42 115.31 122.47 2kvu h LEU 15 Ca -0.12 -0.58 -0.43 0.00 0.13 0.00 0.00 57.88 56.88 2kvu h LEU 15 Cb 1.10 -0.17 -0.36 0.00 -0.53 0.00 0.00 40.66 40.70 2kvu h LEU 15 CO 1.21 1.46 -0.71 -0.89 -0.13 0.00 0.00 178.44 179.38 2kvu s THR 16 N -2.64 -0.24 -1.17 1.05 2.01 -1.26 -5.07 115.64 108.32 2kvu s THR 16 Ca -0.06 -0.61 -0.22 0.00 0.31 0.00 0.00 61.69 61.10 2kvu s THR 16 Cb 0.06 -0.98 -0.07 0.00 0.01 0.00 0.00 72.50 71.53 2kvu s THR 16 CO 0.90 -0.59 1.91 -0.83 -0.69 0.00 0.00 174.62 175.32 2kvu s GLY 17 N 2.24 0.34 -0.16 4.40 0.00 -1.26 -4.93 107.32 107.94 2kvu s GLY 17 Ca 0.09 -2.18 -0.23 0.00 0.00 0.00 0.00 44.72 42.40 2kvu s GLY 17 CO -0.35 3.45 0.72 0.54 0.00 0.00 0.00 173.10 177.46 2kvu s LYS 18 N 6.27 4.29 1.16 2.90 1.02 -1.26 -5.06 119.74 129.05 2kvu s LYS 18 Ca 0.67 0.82 -0.17 0.00 0.02 0.00 0.00 55.97 57.30 2kvu s LYS 18 Cb -0.01 -3.55 0.26 0.00 -0.52 0.00 0.00 37.83 34.01 2kvu s LYS 18 CO 0.11 -0.21 1.09 -1.25 -0.92 0.00 0.00 175.35 174.16 2kvu s PRO 19 N 1.79 -0.84 -0.56 -1.68 0.04 -1.26 -4.88 135.00 127.61 2kvu s PRO 19 Ca 0.34 0.17 -0.07 0.00 0.04 0.00 0.00 61.00 61.48 2kvu s PRO 19 Cb -0.16 -1.62 -0.17 0.00 0.04 0.00 0.00 34.50 32.58 2kvu s PRO 19 CO 0.12 -3.51 3.31 0.41 0.04 0.00 0.00 177.00 177.38 2kvu n GLY 20 N -0.74 3.57 3.27 0.56 0.00 -1.26 -4.81 105.19 105.78 2kvu n GLY 20 Ca 0.10 -1.39 -0.09 0.00 0.00 0.00 0.00 46.02 44.63 2kvu n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvu s ALA 21 N 0.98 0.27 0.10 4.61 0.00 -1.26 -4.91 121.76 121.54 2kvu s ALA 21 Ca 0.67 -1.06 0.10 0.00 0.00 0.00 0.00 51.96 51.66 2kvu s ALA 21 Cb 0.28 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 24.20 2kvu s ALA 21 CO -0.04 -0.58 -0.26 -0.51 0.00 0.00 0.00 175.76 174.37 2kvu s LEU 22 N -2.99 2.26 0.49 0.00 1.43 -1.26 -5.11 118.68 113.51 2kvu s LEU 22 Ca 0.18 -0.68 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 2kvu s LEU 22 Cb 0.05 -1.19 -0.08 0.00 0.03 0.00 0.00 46.19 45.00 2kvu s LEU 22 CO -0.00 0.19 1.00 -2.16 0.23 0.00 0.00 176.35 175.60 2kvu s PRO 23 N -1.74 3.91 -0.00 1.29 0.04 -1.26 -4.94 135.00 132.29 2kvu s PRO 23 Ca 0.12 1.15 0.01 0.00 0.04 0.00 0.00 61.00 62.31 2kvu s PRO 23 Cb -0.10 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.34 2kvu s PRO 23 CO 0.04 -0.31 0.89 0.00 0.04 0.00 0.00 177.00 177.66 2kvu n ALA 24 N -1.19 2.51 -0.69 8.56 0.00 -1.26 -3.26 120.51 125.18 2kvu n ALA 24 Ca 0.08 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.55 2kvu n ALA 24 Cb 0.53 -1.00 0.32 0.00 0.00 0.00 0.00 19.45 19.30 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 -0.30 4.47 -0.12 0.00 4.13 -1.26 -4.51 115.26 117.66 2kvu n ASN 25 Ca 0.01 -2.60 0.07 0.00 1.68 0.00 0.00 54.58 53.74 2kvu n ASN 25 Cb 0.09 -0.54 0.39 0.00 -1.54 0.00 0.00 39.78 38.19 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 3.26 0.57 -1.62 3.41 3.38 -1.92 0.35 115.31 122.74 2kvu h LEU 26 Ca 0.00 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2kvu h LEU 26 Cb 1.44 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2kvu h LEU 26 CO 0.24 0.38 -0.21 0.44 0.09 0.00 0.00 178.44 179.37 2kvu h ASP 27 N 0.65 0.00 0.63 -0.43 5.19 -1.90 -2.69 116.42 117.87 2kvu h ASP 27 Ca 0.27 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 56.41 2kvu h ASP 27 Cb 0.23 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.70 2kvu h ASP 27 CO -0.08 0.21 -1.46 -0.78 -3.12 0.00 0.00 179.24 174.01 2kvu h ASP 28 N 0.00 0.10 -3.95 6.45 1.82 -1.33 -3.46 116.42 116.06 2kvu h ASP 28 Ca -0.00 -0.15 -0.54 0.00 -0.39 0.00 0.00 57.03 55.95 2kvu h ASP 28 Cb 0.42 -0.03 0.10 0.00 0.68 0.00 0.00 39.33 40.50 2kvu h ASP 28 CO 0.03 1.13 0.72 -0.04 -1.61 0.00 0.00 179.24 179.46 2kvu s MET 29 N -2.64 4.03 0.75 0.28 -1.94 -0.36 -4.99 119.30 114.43 2kvu s MET 29 Ca -0.04 2.43 -0.08 0.00 -1.71 0.00 0.00 55.69 56.28 2kvu s MET 29 Cb 0.08 -2.88 0.08 0.00 2.01 0.00 0.00 34.83 34.12 2kvu s MET 29 CO 0.83 -0.54 1.08 0.15 -0.01 0.00 0.00 175.02 176.52 2kvu s LYS 30 N -2.15 1.99 0.25 2.03 3.01 -1.26 -4.80 119.74 118.80 2kvu s LYS 30 Ca 0.55 -0.23 -0.04 0.00 -1.01 0.00 0.00 55.97 55.23 2kvu s LYS 30 Cb -0.44 -2.10 0.37 0.00 -1.01 0.00 0.00 37.83 34.65 2kvu s LYS 30 CO 0.58 -1.43 1.84 0.28 0.51 0.00 0.00 175.35 177.13 2kvu h VAL 31 N -0.79 1.00 -0.53 3.17 2.07 -1.97 0.14 116.25 119.35 2kvu h VAL 31 Ca -0.44 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 2kvu h VAL 31 Cb 1.31 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2kvu h VAL 31 CO 0.59 0.17 0.26 0.00 0.02 0.00 0.00 177.57 178.61 2kvu h ALA 32 N 1.43 0.68 -0.81 1.67 0.00 -1.99 -0.72 119.26 119.51 2kvu h ALA 32 Ca 0.39 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2kvu h ALA 32 Cb 0.25 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2kvu h ALA 32 CO -0.20 0.23 0.35 0.93 0.00 0.00 0.00 179.25 180.56 2kvu h GLU 33 N 0.71 1.19 -0.60 0.00 4.39 -1.57 -2.31 114.58 116.39 2kvu h GLU 33 Ca 0.18 -0.20 -0.08 0.00 0.34 0.00 0.00 59.36 59.60 2kvu h GLU 33 Cb 0.10 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 2kvu h GLU 33 CO -0.02 0.95 0.06 -0.07 -1.16 0.00 0.00 179.01 178.76 2kvu h LEU 34 N 1.17 0.99 -1.59 1.33 3.38 -0.48 -2.69 115.31 117.41 2kvu h LEU 34 Ca 0.27 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2kvu h LEU 34 Cb 0.18 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2kvu h LEU 34 CO -0.03 1.02 0.15 0.11 0.09 0.00 0.00 178.44 179.78 2kvu h LYS 35 N 0.92 0.41 -0.34 1.13 1.57 -0.74 -0.52 116.57 119.01 2kvu h LYS 35 Ca 0.18 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2kvu h LYS 35 Cb 0.48 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 2kvu h LYS 35 CO 0.02 0.33 0.19 1.96 -0.57 0.00 0.00 179.45 181.38 2kvu h GLN 36 N 0.42 0.46 -0.20 3.15 1.08 -1.08 0.11 115.11 119.06 2kvu h GLN 36 Ca 0.11 -0.05 -0.12 0.00 -1.45 0.00 0.00 58.65 57.14 2kvu h GLN 36 Cb 0.05 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 2kvu h GLN 36 CO -0.02 0.37 -0.39 0.93 -0.95 0.00 0.00 178.83 178.77 2kvu h GLU 37 N 0.43 0.45 0.39 1.46 4.39 -1.34 -2.64 114.58 117.72 2kvu h GLU 37 Ca 0.12 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 2kvu h GLU 37 Cb 0.03 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2kvu h GLU 37 CO -0.02 0.77 -0.19 -0.07 -1.16 0.00 0.00 179.01 178.34 2kvu h LEU 38 N 0.37 -0.45 -1.19 1.33 3.38 -0.68 -2.62 115.31 115.46 2kvu h LEU 38 Ca 0.04 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2kvu h LEU 38 Cb 0.85 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 2kvu h LEU 38 CO 0.07 -0.12 -0.03 0.07 0.09 0.00 0.00 178.44 178.51 2kvu h LYS 39 N -0.79 0.52 0.00 1.13 2.10 -0.82 0.16 116.57 118.87 2kvu h LYS 39 Ca -0.05 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 58.48 2kvu h LYS 39 Cb 0.53 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 2kvu h LYS 39 CO 0.09 0.57 -0.04 1.28 -2.00 0.00 0.00 179.45 179.35 2kvu n LEU 40 N -4.26 0.08 -0.10 7.07 4.77 -1.00 -2.90 117.00 120.66 2kvu n LEU 40 Ca 0.01 0.47 0.04 0.00 -0.03 0.00 0.00 56.01 56.50 2kvu n LEU 40 Cb 0.27 -0.47 0.07 0.00 -2.33 0.00 0.00 43.42 40.95 2kvu n LEU 40 CO 0.39 -0.00 0.54 0.54 -1.33 0.00 0.00 177.39 177.53 2kvu n ARG 41 N -1.54 2.42 -2.86 3.23 1.74 -0.79 -5.02 116.66 113.83 2kvu n ARG 41 Ca 0.07 -1.95 -0.01 0.00 -0.77 0.00 0.00 57.85 55.19 2kvu n ARG 41 Cb 0.35 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 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 -0.74 -6.96 -3.98 0.55 7.64 -0.50 -5.03 113.62 104.60 2kvu n SER 42 Ca 0.07 -0.10 -0.10 0.00 1.01 0.00 0.00 58.87 59.75 2kvu n SER 42 Cb 0.42 -4.73 -0.11 0.00 -1.01 0.00 0.00 64.21 58.78 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 -3.81 2.21 0.04 -3.43 1.43 0.45 -5.00 118.68 110.57 2kvu s LEU 43 Ca 0.03 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.37 2kvu s LEU 43 Cb -0.00 0.04 -0.08 0.00 0.03 0.00 0.00 46.19 46.18 2kvu s LEU 43 CO 0.65 -0.25 1.80 -2.16 0.23 0.00 0.00 176.35 176.62 2kvu s PRO 44 N -1.31 4.16 0.00 1.29 0.04 -1.26 -4.18 135.00 133.74 2kvu s PRO 44 Ca -0.13 2.45 0.19 0.00 0.04 0.00 0.00 61.00 63.55 2kvu s PRO 44 Cb -0.09 -3.90 0.57 0.00 0.04 0.00 0.00 34.50 31.12 2kvu s PRO 44 CO -0.01 -0.86 1.45 1.33 0.04 0.00 0.00 177.00 178.95 2kvu n VAL 45 N 5.21 0.40 -4.00 -0.36 0.24 -1.26 -4.87 118.33 113.70 2kvu n VAL 45 Ca 0.18 -0.52 -0.36 0.00 -2.04 0.00 0.00 64.34 61.59 2kvu n VAL 45 Cb 0.41 0.50 -0.07 0.00 -1.47 0.00 0.00 33.84 33.21 2kvu n VAL 45 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2kvu s SER 46 N -1.38 6.11 0.00 -1.34 0.01 -1.26 -4.92 113.70 110.91 2kvu s SER 46 Ca 0.33 0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.98 2kvu s SER 46 Cb 0.18 -1.93 0.00 0.00 0.21 0.00 0.00 66.02 64.49 2kvu s SER 46 CO 0.26 0.40 0.00 0.61 0.41 0.00 0.00 173.24 174.92 2kvu n GLY 47 N 2.04 0.97 3.89 3.44 0.00 -1.26 -4.93 105.19 109.34 2kvu n GLY 47 Ca -0.20 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 43.60 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 -1.17 4.36 0.26 2.61 -4.23 -1.26 -4.86 115.64 111.35 2kvu s THR 48 Ca 0.00 0.48 -0.04 0.00 -1.18 0.00 0.00 61.69 60.95 2kvu s THR 48 Cb 0.00 -3.73 0.26 0.00 1.34 0.00 0.00 72.50 70.38 2kvu s THR 48 CO 0.00 -0.86 1.92 0.50 -0.54 0.00 0.00 174.62 175.64 2kvu h LYS 49 N -0.21 1.23 -0.31 3.99 3.64 -1.99 0.11 116.57 123.03 2kvu h LYS 49 Ca -0.45 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 58.89 2kvu h LYS 49 Cb 1.22 -0.28 -0.04 0.00 -0.41 0.00 0.00 32.23 32.72 2kvu h LYS 49 CO 0.62 0.82 0.09 1.15 -2.27 0.00 0.00 179.45 179.85 2kvu h THR 50 N 1.27 0.88 -0.32 1.00 2.02 -1.99 0.11 112.91 115.88 2kvu h THR 50 Ca 0.38 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.47 2kvu h THR 50 Cb -0.06 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2kvu h THR 50 CO -0.10 0.04 0.15 -0.33 0.37 0.00 0.00 175.52 175.65 2kvu h GLU 51 N 0.21 0.46 -0.34 6.66 4.39 -1.71 -2.33 114.58 121.92 2kvu h GLU 51 Ca 0.14 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 2kvu h GLU 51 Cb 0.13 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 2kvu h GLU 51 CO -0.17 0.43 0.17 -0.07 -1.16 0.00 0.00 179.01 178.22 2kvu h LEU 52 N 0.38 0.44 0.05 1.33 3.38 -0.34 0.24 115.31 120.79 2kvu h LEU 52 Ca 0.11 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2kvu h LEU 52 Cb 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2kvu h LEU 52 CO -0.01 0.43 -0.02 0.40 0.09 0.00 0.00 178.44 179.32 2kvu h ILE 53 N 0.42 1.00 0.00 1.22 2.04 -0.76 -1.45 117.51 119.99 2kvu h ILE 53 Ca 0.12 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 2kvu h ILE 53 Cb 0.09 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2kvu h ILE 53 CO -0.02 0.04 -0.23 -0.33 0.00 0.00 0.00 178.15 177.61 2kvu h GLU 54 N -0.13 0.00 -0.52 2.37 4.39 -1.29 -1.26 114.58 118.14 2kvu h GLU 54 Ca -0.01 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 2kvu h GLU 54 Cb 0.11 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 2kvu h GLU 54 CO 0.01 0.23 0.03 -0.09 -1.16 0.00 0.00 179.01 178.03 2kvu h ARG 55 N 0.00 0.90 -0.38 2.33 2.43 -0.04 0.33 114.38 119.96 2kvu h ARG 55 Ca -0.00 -0.27 -0.06 0.00 -0.81 0.00 0.00 59.98 58.84 2kvu h ARG 55 Cb 0.57 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2kvu h ARG 55 CO 0.03 0.91 0.01 -0.07 -1.51 0.00 0.00 179.97 179.34 2kvu h LEU 56 N 0.78 0.64 -0.84 3.80 3.38 -0.64 -1.04 115.31 121.40 2kvu h LEU 56 Ca 0.15 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2kvu h LEU 56 Cb 0.48 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 2kvu h LEU 56 CO 0.02 0.79 0.39 0.03 0.09 0.00 0.00 178.44 179.76 2kvu h ARG 57 N 0.48 1.22 -0.33 1.13 3.08 -1.02 -1.38 114.38 117.56 2kvu h ARG 57 Ca 0.11 -0.19 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 2kvu h ARG 57 Cb 0.45 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 2kvu h ARG 57 CO 0.02 0.95 -0.08 0.00 -1.07 0.00 0.00 179.97 179.79 2kvu h ALA 58 N 1.21 1.25 -0.55 0.04 0.00 -0.22 0.14 119.26 121.13 2kvu h ALA 58 Ca 0.29 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2kvu h ALA 58 Cb 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2kvu h ALA 58 CO -0.03 0.49 -0.02 -0.92 0.00 0.00 0.00 179.25 178.77 2kvu h TYR 59 N 0.51 1.08 -0.11 0.00 3.20 -0.37 -0.63 116.97 120.65 2kvu h TYR 59 Ca 0.10 -0.19 -0.19 0.00 3.14 0.00 0.00 58.73 61.58 2kvu h TYR 59 Cb 0.45 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.44 2kvu h TYR 59 CO 0.02 0.98 -0.72 0.37 -1.64 0.00 0.00 178.16 177.16 2kvu h GLN 60 N 0.86 0.51 0.00 1.82 -0.00 -1.00 -2.98 115.11 114.33 2kvu h GLN 60 Ca 0.15 -0.41 -0.03 0.00 -0.00 0.00 0.00 58.65 58.37 2kvu h GLN 60 Cb 0.56 0.08 -0.00 0.00 0.00 0.00 0.00 27.48 28.12 2kvu h GLN 60 CO 0.03 1.04 -0.13 0.22 0.00 0.00 0.00 178.83 179.99 2kvu h ASP 61 N 0.36 0.00 0.47 -0.69 3.58 -0.51 0.12 116.42 119.76 2kvu h ASP 61 Ca -0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.42 2kvu h ASP 61 Cb 1.31 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.36 2kvu h ASP 61 CO 0.13 0.13 -0.57 0.00 -2.88 0.00 0.00 179.24 176.06 2kvu n GLN 62 N -3.27 0.02 -0.04 0.28 10.64 -0.26 -1.80 117.38 122.96 2kvu n GLN 62 Ca 0.01 0.00 -0.21 0.00 -1.83 0.00 0.00 57.00 54.96 2kvu n GLN 62 Cb 0.39 -1.51 -0.13 0.00 -0.86 0.00 0.00 30.24 28.13 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 0.87 -1.80 -0.39 2.04 -1.20 -3.45 117.51 113.57 2kvu h ILE 63 Ca 0.00 -2.29 -0.24 0.00 1.00 0.00 0.00 64.86 63.33 2kvu h ILE 63 Cb 0.52 2.46 -0.29 0.00 -0.74 0.00 0.00 36.82 38.76 2kvu h ILE 63 CO 0.00 0.60 -0.58 -0.44 0.00 0.00 0.00 178.15 177.73 2kvu s SER 64 N -6.95 0.70 0.76 1.72 0.01 0.36 -5.11 113.70 105.19 2kvu s SER 64 Ca -0.24 -0.70 -0.12 0.00 1.31 0.00 0.00 55.95 56.20 2kvu s SER 64 Cb 0.06 0.93 0.05 0.00 0.21 0.00 0.00 66.02 67.27 2kvu s SER 64 CO 0.69 -0.34 1.11 -2.16 0.41 0.00 0.00 173.24 172.96 2kvu s PRO 65 N 2.27 2.21 -0.17 12.44 0.04 -0.74 -4.34 135.00 146.71 2kvu s PRO 65 Ca 0.11 1.32 -0.29 0.00 0.04 0.00 0.00 61.00 62.19 2kvu s PRO 65 Cb -0.13 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.47 2kvu s PRO 65 CO -0.25 -1.70 2.12 0.14 0.04 0.00 0.00 177.00 177.36 2kvu s VAL 66 N -2.66 3.06 -0.24 -0.36 -7.23 -1.26 -4.93 120.40 106.77 2kvu s VAL 66 Ca 0.64 0.06 -0.29 0.00 -1.81 0.00 0.00 61.98 60.58 2kvu s VAL 66 Cb -0.20 -3.06 0.00 0.00 0.56 0.00 0.00 36.38 33.68 2kvu s VAL 66 CO 0.52 -0.03 1.16 -2.84 -0.31 0.00 0.00 175.10 173.60 2kvu s PRO 67 N 5.84 4.15 -1.35 4.82 0.02 -1.26 -3.70 135.00 143.53 2kvu s PRO 67 Ca 0.96 1.38 -0.08 0.00 0.02 0.00 0.00 61.00 63.28 2kvu s PRO 67 Cb -0.34 -3.74 0.01 0.00 0.02 0.00 0.00 34.50 30.44 2kvu s PRO 67 CO 0.36 -0.80 1.05 0.41 -0.33 0.00 0.00 177.00 177.70 2kvu n GLY 68 N 3.70 -0.50 3.18 0.52 0.00 -1.26 -5.00 105.19 105.83 2kvu n GLY 68 Ca 0.13 0.21 -0.13 0.00 0.00 0.00 0.00 46.02 46.23 2kvu n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvu s ALA 69 N -3.28 -0.62 0.87 4.61 0.00 -1.24 -5.16 121.76 116.93 2kvu s ALA 69 Ca 0.52 0.35 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 2kvu s ALA 69 Cb -0.23 -0.09 0.12 0.00 0.00 0.00 0.00 23.12 22.92 2kvu s ALA 69 CO 0.65 -0.20 1.11 -2.14 0.00 0.00 0.00 175.76 175.17 2kvu s PRO 70 N -0.86 1.42 0.00 0.00 0.02 -1.26 -4.84 135.00 129.47 2kvu s PRO 70 Ca -0.09 1.25 0.29 0.00 0.02 0.00 0.00 61.00 62.47 2kvu s PRO 70 Cb -0.05 -1.79 1.30 0.00 0.02 0.00 0.00 34.50 33.98 2kvu s PRO 70 CO 0.02 -2.26 1.89 1.17 -0.33 0.00 0.00 177.00 177.49 2kvu n LYS 71 N -3.95 1.35 -4.01 5.54 3.00 -1.26 -4.79 118.16 114.04 2kvu n LYS 71 Ca 0.09 -0.60 -0.29 0.00 -0.00 0.00 0.00 58.31 57.51 2kvu n LYS 71 Cb 0.53 -1.49 -0.05 0.00 0.00 0.00 0.00 35.03 34.02 2kvu n LYS 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kvu s ALA 72 N -2.06 3.73 0.41 3.14 0.00 -1.26 -5.08 121.76 120.63 2kvu s ALA 72 Ca 0.39 -1.01 -0.25 0.00 0.00 0.00 0.00 51.96 51.09 2kvu s ALA 72 Cb 0.21 -1.56 -0.10 0.00 0.00 0.00 0.00 23.12 21.66 2kvu s ALA 72 CO 0.37 0.69 1.19 -2.30 0.00 0.00 0.00 175.76 175.71 2kvu n PRO 73 N 0.11 1.75 -1.97 0.00 -0.02 -1.26 -4.91 135.00 128.71 2kvu n PRO 73 Ca -0.07 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 2kvu n PRO 73 Cb 0.52 -2.26 -0.01 0.00 -0.02 0.00 0.00 33.50 31.73 2kvu n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kvu s ALA 74 N -1.21 3.55 0.00 3.55 0.00 -1.26 -5.10 121.76 121.29 2kvu s ALA 74 Ca 0.61 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.98 2kvu s ALA 74 Cb -0.53 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.04 2kvu s ALA 74 CO 0.58 -0.83 0.17 0.00 0.00 0.00 0.00 175.76 175.68