#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 -1.52 3.05 3.17 0.00 -1.26 -4.82 105.19 103.81 2kvu n GLY 2 Ca 0.00 -0.17 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 2kvu n GLY 2 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2kvu s HIS 3 N -3.13 0.90 -0.01 1.61 0.00 -1.26 -5.08 115.29 108.32 2kvu s HIS 3 Ca 0.08 -0.22 -0.01 0.00 -3.00 0.00 0.00 55.06 51.92 2kvu s HIS 3 Cb 0.13 -0.57 -0.00 0.00 -4.00 0.00 0.00 32.58 28.14 2kvu s HIS 3 CO 0.67 -0.01 -0.01 0.72 -1.00 0.00 0.00 174.74 175.11 2kvu n HIS 4 N 2.58 0.00 -3.28 0.38 -0.00 -1.26 -5.03 115.22 108.60 2kvu n HIS 4 Ca -0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.54 2kvu n HIS 4 Cb 0.56 -0.02 -0.05 0.00 -0.00 0.00 0.00 29.99 30.48 2kvu n HIS 4 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2kvu s HIS 5 N -1.06 -1.16 -0.24 4.41 -0.00 -1.26 -5.09 115.29 110.89 2kvu s HIS 5 Ca -0.01 1.26 -0.04 0.00 -0.00 0.00 0.00 55.06 56.27 2kvu s HIS 5 Cb 0.00 0.27 0.08 0.00 -0.00 0.00 0.00 32.58 32.94 2kvu s HIS 5 CO 0.01 -0.78 0.09 -1.01 -0.00 0.00 0.00 174.74 173.06 2kvu s HIS 6 N 2.69 0.62 0.02 0.38 3.76 -1.26 -5.15 115.29 116.35 2kvu s HIS 6 Ca 0.15 -0.82 0.06 0.00 -0.15 0.00 0.00 55.06 54.30 2kvu s HIS 6 Cb -0.15 -0.97 -0.03 0.00 1.11 0.00 0.00 32.58 32.53 2kvu s HIS 6 CO -0.18 -0.69 -0.15 -3.38 -0.85 0.00 0.00 174.74 169.48 2kvu s HIS 7 N 1.99 2.64 0.47 1.40 -0.00 -1.26 -5.12 115.29 115.42 2kvu s HIS 7 Ca 0.05 -0.21 -0.13 0.00 -0.00 0.00 0.00 55.06 54.78 2kvu s HIS 7 Cb -0.16 -1.51 -0.07 0.00 -0.00 0.00 0.00 32.58 30.84 2kvu s HIS 7 CO -0.21 0.26 0.88 -1.01 -0.00 0.00 0.00 174.74 174.67 2kvu s HIS 8 N -0.91 3.48 0.30 0.38 4.02 -1.26 -4.97 115.29 116.33 2kvu s HIS 8 Ca 0.15 1.22 0.13 0.00 1.02 0.00 0.00 55.06 57.58 2kvu s HIS 8 Cb -0.11 -2.60 0.55 0.00 -1.02 0.00 0.00 32.58 29.40 2kvu s HIS 8 CO 0.05 -0.28 1.72 0.66 1.02 0.00 0.00 174.74 177.91 2kvu h SER 9 N 0.91 0.00 -3.71 1.40 4.64 -2.06 -3.38 113.55 111.34 2kvu h SER 9 Ca -0.47 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.21 2kvu h SER 9 Cb 1.19 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.90 2kvu h SER 9 CO 0.63 0.49 -0.78 -1.00 -0.87 0.00 0.00 176.83 175.29 2kvu s HIS 10 N -3.85 2.94 -0.12 4.77 0.09 -1.26 -5.00 115.29 112.87 2kvu s HIS 10 Ca -0.02 -2.20 -0.10 0.00 -0.00 0.00 0.00 55.06 52.75 2kvu s HIS 10 Cb 0.13 -1.96 -0.08 0.00 -0.00 0.00 0.00 32.58 30.67 2kvu s HIS 10 CO 0.74 -0.85 0.20 1.98 -0.00 0.00 0.00 174.74 176.81 2kvu h MET 11 N 7.83 0.00 -4.59 1.40 1.85 -2.01 -3.43 114.93 115.99 2kvu h MET 11 Ca -0.16 0.00 -0.68 0.00 -0.61 0.00 0.00 59.70 58.25 2kvu h MET 11 Cb 1.05 0.00 -0.37 0.00 0.43 0.00 0.00 31.60 32.71 2kvu h MET 11 CO 0.45 0.31 -0.63 -1.54 -0.40 0.00 0.00 176.91 175.10 2kvu s SER 12 N -5.80 5.02 -0.30 1.39 1.04 -1.26 -5.07 113.70 108.72 2kvu s SER 12 Ca -0.08 -2.07 -0.11 0.00 0.48 0.00 0.00 55.95 54.17 2kvu s SER 12 Cb -0.00 -1.73 -0.03 0.00 0.10 0.00 0.00 66.02 64.35 2kvu s SER 12 CO 0.23 -0.46 0.18 -0.89 0.98 0.00 0.00 173.24 173.28 2kvu s THR 13 N 1.03 5.05 -0.40 2.02 2.01 -1.26 -5.05 115.64 119.04 2kvu s THR 13 Ca 0.09 -0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.72 2kvu s THR 13 Cb -0.21 -3.48 0.01 0.00 0.01 0.00 0.00 72.50 68.83 2kvu s THR 13 CO -0.06 0.16 1.37 -2.84 -0.69 0.00 0.00 174.62 172.57 2kvu s PRO 14 N 1.71 3.65 0.37 4.92 0.02 -1.26 -4.88 135.00 139.51 2kvu s PRO 14 Ca 0.06 0.97 0.07 0.00 0.02 0.00 0.00 61.00 62.12 2kvu s PRO 14 Cb -0.16 -3.99 0.71 0.00 0.02 0.00 0.00 34.50 31.07 2kvu s PRO 14 CO 0.09 -1.47 1.91 -0.07 -0.33 0.00 0.00 177.00 177.12 2kvu h LEU 15 N 11.89 0.36 -7.59 -5.54 -0.00 -2.06 -3.41 115.31 108.96 2kvu h LEU 15 Ca -0.27 -0.07 -0.29 0.00 -0.00 0.00 0.00 57.88 57.25 2kvu h LEU 15 Cb 1.10 -0.10 -0.33 0.00 -0.00 0.00 0.00 40.66 41.34 2kvu h LEU 15 CO 1.08 0.46 -0.73 0.28 -0.00 0.00 0.00 178.44 179.53 2kvu s THR 16 N -4.89 0.01 -0.20 0.22 -1.32 -1.26 -5.13 115.64 103.07 2kvu s THR 16 Ca -0.07 0.13 -0.25 0.00 -1.21 0.00 0.00 61.69 60.30 2kvu s THR 16 Cb 0.16 -0.11 -0.01 0.00 -1.51 0.00 0.00 72.50 71.03 2kvu s THR 16 CO 0.75 0.08 0.85 -0.83 -2.21 0.00 0.00 174.62 173.25 2kvu s GLY 17 N 0.80 1.95 0.33 6.08 0.00 -1.26 -5.03 107.32 110.18 2kvu s GLY 17 Ca -0.07 -0.02 -0.28 0.00 0.00 0.00 0.00 44.72 44.35 2kvu s GLY 17 CO -0.02 1.76 1.22 0.54 0.00 0.00 0.00 173.10 176.59 2kvu s LYS 18 N 2.48 4.39 1.34 2.90 3.01 -1.26 -5.02 119.74 127.58 2kvu s LYS 18 Ca 0.37 2.02 -0.20 0.00 -1.01 0.00 0.00 55.97 57.16 2kvu s LYS 18 Cb -0.16 -3.04 0.34 0.00 -1.01 0.00 0.00 37.83 33.96 2kvu s LYS 18 CO 0.10 -0.09 0.97 -2.14 0.51 0.00 0.00 175.35 174.70 2kvu s PRO 19 N -1.78 -2.31 -0.45 -1.68 0.02 -1.26 -4.80 135.00 122.74 2kvu s PRO 19 Ca 0.49 0.28 -0.05 0.00 0.02 0.00 0.00 61.00 61.74 2kvu s PRO 19 Cb -0.36 -1.44 -0.12 0.00 0.02 0.00 0.00 34.50 32.60 2kvu s PRO 19 CO 0.47 -4.51 2.39 0.41 -0.33 0.00 0.00 177.00 175.43 2kvu n GLY 20 N 1.02 2.72 3.52 0.52 0.00 -1.26 -4.72 105.19 106.98 2kvu n GLY 20 Ca 0.10 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.13 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 2.36 0.67 0.16 4.61 0.00 -1.26 -5.00 121.76 123.30 2kvu s ALA 21 Ca 0.43 -1.48 0.11 0.00 0.00 0.00 0.00 51.96 51.03 2kvu s ALA 21 Cb 0.17 1.11 -0.04 0.00 0.00 0.00 0.00 23.12 24.35 2kvu s ALA 21 CO -0.02 -0.81 -0.25 -0.51 0.00 0.00 0.00 175.76 174.18 2kvu s LEU 22 N -3.23 2.38 0.21 0.00 1.43 -1.26 -5.07 118.68 113.13 2kvu s LEU 22 Ca 0.29 -0.81 -0.31 0.00 -1.03 0.00 0.00 54.13 52.28 2kvu s LEU 22 Cb -0.01 -1.15 -0.11 0.00 0.03 0.00 0.00 46.19 44.96 2kvu s LEU 22 CO 0.20 0.13 1.58 -2.16 0.23 0.00 0.00 176.35 176.33 2kvu s PRO 23 N -2.37 4.19 0.00 1.29 0.04 -1.26 -4.88 135.00 132.01 2kvu s PRO 23 Ca 0.17 2.44 0.02 0.00 0.04 0.00 0.00 61.00 63.66 2kvu s PRO 23 Cb -0.09 -3.11 0.11 0.00 0.04 0.00 0.00 34.50 31.45 2kvu s PRO 23 CO 0.08 -0.61 0.80 0.00 0.04 0.00 0.00 177.00 177.31 2kvu n ALA 24 N 3.36 2.23 -2.43 8.56 0.00 -1.26 -3.26 120.51 127.72 2kvu n ALA 24 Ca 0.12 -0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.34 2kvu n ALA 24 Cb 0.38 -1.03 0.02 0.00 0.00 0.00 0.00 19.45 18.82 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 -0.54 3.88 0.16 0.00 4.13 -1.26 -4.79 115.26 116.84 2kvu n ASN 25 Ca 0.01 -3.38 0.04 0.00 1.68 0.00 0.00 54.58 52.93 2kvu n ASN 25 Cb 0.01 -0.44 0.43 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 2.55 0.15 -1.33 3.41 3.38 -1.94 -1.47 115.31 120.05 2kvu h LEU 26 Ca 0.20 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 2kvu h LEU 26 Cb 1.16 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2kvu h LEU 26 CO 0.70 0.30 -0.31 0.44 0.09 0.00 0.00 178.44 179.66 2kvu h ASP 27 N 0.15 0.04 1.71 -0.43 3.32 -1.91 -2.42 116.42 116.87 2kvu h ASP 27 Ca 0.03 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2kvu h ASP 27 Cb 0.34 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2kvu h ASP 27 CO 0.02 0.35 0.00 0.44 -1.72 0.00 0.00 179.24 178.33 2kvu h ASP 28 N 0.03 0.00 -3.96 6.45 5.19 -1.65 -3.46 116.42 119.03 2kvu h ASP 28 Ca 0.00 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 55.91 2kvu h ASP 28 Cb 0.57 0.00 0.05 0.00 0.18 0.00 0.00 39.33 40.13 2kvu h ASP 28 CO 0.04 0.00 0.26 -0.04 -3.12 0.00 0.00 179.24 176.38 2kvu s MET 29 N -3.18 3.55 0.94 3.56 -1.94 -0.91 -5.07 119.30 116.24 2kvu s MET 29 Ca 0.08 0.46 -0.15 0.00 -1.71 0.00 0.00 55.69 54.38 2kvu s MET 29 Cb 0.08 -2.23 0.17 0.00 2.01 0.00 0.00 34.83 34.86 2kvu s MET 29 CO 0.63 -0.40 1.23 0.15 -0.01 0.00 0.00 175.02 176.62 2kvu s LYS 30 N -4.96 0.87 0.10 2.03 1.02 -1.26 -4.91 119.74 112.63 2kvu s LYS 30 Ca 0.51 -0.12 -0.17 0.00 0.02 0.00 0.00 55.97 56.21 2kvu s LYS 30 Cb -0.11 -1.85 -0.06 0.00 -0.52 0.00 0.00 37.83 35.30 2kvu s LYS 30 CO 0.49 -2.30 1.55 0.28 -0.92 0.00 0.00 175.35 174.45 2kvu h VAL 31 N -1.57 1.25 -0.57 3.17 2.07 -1.97 -2.47 116.25 116.16 2kvu h VAL 31 Ca -0.46 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.13 2kvu h VAL 31 Cb 1.28 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 2kvu h VAL 31 CO 0.49 0.29 0.20 0.00 0.02 0.00 0.00 177.57 178.57 2kvu h ALA 32 N 0.85 1.28 -0.78 1.67 0.00 -1.99 -1.86 119.26 118.43 2kvu h ALA 32 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2kvu h ALA 32 Cb 0.41 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2kvu h ALA 32 CO 0.01 0.52 0.50 0.93 0.00 0.00 0.00 179.25 181.22 2kvu h GLU 33 N 0.82 1.03 -0.49 0.00 4.39 -1.88 0.04 114.58 118.50 2kvu h GLU 33 Ca 0.19 -0.07 -0.11 0.00 0.34 0.00 0.00 59.36 59.71 2kvu h GLU 33 Cb 0.21 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2kvu h GLU 33 CO -0.01 0.70 -0.13 -0.07 -1.16 0.00 0.00 179.01 178.33 2kvu h LEU 34 N 1.06 0.92 -1.23 1.33 3.38 -1.03 -2.15 115.31 117.59 2kvu h LEU 34 Ca 0.28 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2kvu h LEU 34 Cb -0.10 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 2kvu h LEU 34 CO -0.06 1.06 0.15 0.11 0.09 0.00 0.00 178.44 179.79 2kvu h LYS 35 N 0.82 0.69 -0.69 1.13 1.57 -0.67 0.11 116.57 119.52 2kvu h LYS 35 Ca 0.13 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2kvu h LYS 35 Cb 0.67 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 2kvu h LYS 35 CO 0.05 0.60 0.27 1.96 -0.57 0.00 0.00 179.45 181.75 2kvu h GLN 36 N 0.67 1.04 -0.16 3.15 1.08 -0.61 0.11 115.11 120.40 2kvu h GLN 36 Ca 0.16 -0.19 -0.07 0.00 -1.45 0.00 0.00 58.65 57.10 2kvu h GLN 36 Cb 0.20 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 2kvu h GLN 36 CO -0.01 0.87 -0.20 0.93 -0.95 0.00 0.00 178.83 179.46 2kvu h GLU 37 N 0.99 0.27 0.07 1.46 4.39 -0.70 -2.80 114.58 118.26 2kvu h GLU 37 Ca 0.23 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.85 2kvu h GLU 37 Cb 0.22 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2kvu h GLU 37 CO -0.02 0.47 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.20 2kvu h LEU 38 N 0.25 -0.08 -2.12 1.33 3.38 -0.44 -3.27 115.31 114.36 2kvu h LEU 38 Ca 0.04 -0.53 -0.02 0.00 0.09 0.00 0.00 57.88 57.47 2kvu h LEU 38 Cb 0.51 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2kvu h LEU 38 CO 0.03 0.54 -0.08 0.07 0.09 0.00 0.00 178.44 179.10 2kvu h LYS 39 N -0.77 0.00 0.00 1.13 2.10 -0.78 0.18 116.57 118.43 2kvu h LYS 39 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2kvu h LYS 39 Cb 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 2kvu h LYS 39 CO 0.02 0.08 0.00 1.28 -2.00 0.00 0.00 179.45 178.82 2kvu n LEU 40 N -3.70 0.80 -0.07 7.07 4.77 -1.06 -3.39 117.00 121.41 2kvu n LEU 40 Ca -0.02 0.59 0.08 0.00 -0.03 0.00 0.00 56.01 56.63 2kvu n LEU 40 Cb 0.18 -0.35 0.11 0.00 -2.33 0.00 0.00 43.42 41.03 2kvu n LEU 40 CO 0.29 -0.23 0.55 0.54 -1.33 0.00 0.00 177.39 177.21 2kvu n ARG 41 N -2.26 1.50 -1.95 3.23 1.74 0.18 -4.97 116.66 114.13 2kvu n ARG 41 Ca 0.05 -2.35 -0.15 0.00 -0.77 0.00 0.00 57.85 54.63 2kvu n ARG 41 Cb 0.41 -1.39 -0.03 0.00 -1.02 0.00 0.00 32.46 30.43 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 -1.24 -4.63 -4.87 0.55 2.88 -0.75 -5.00 113.62 100.55 2kvu n SER 42 Ca 0.13 0.14 -0.35 0.00 -1.33 0.00 0.00 58.87 57.45 2kvu n SER 42 Cb 0.58 -3.65 -0.05 0.00 -0.75 0.00 0.00 64.21 60.34 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 -3.94 4.38 0.08 2.46 1.43 0.38 -4.99 118.68 118.47 2kvu s LEU 43 Ca 0.00 0.64 -0.31 0.00 -1.03 0.00 0.00 54.13 53.43 2kvu s LEU 43 Cb 0.00 -2.65 -0.10 0.00 0.03 0.00 0.00 46.19 43.48 2kvu s LEU 43 CO 0.00 0.27 1.88 -2.16 0.23 0.00 0.00 176.35 176.57 2kvu s PRO 44 N -1.62 4.14 -0.08 1.29 0.04 -1.26 -3.79 135.00 133.72 2kvu s PRO 44 Ca 0.27 2.59 0.04 0.00 0.04 0.00 0.00 61.00 63.93 2kvu s PRO 44 Cb -0.14 -3.85 0.23 0.00 0.04 0.00 0.00 34.50 30.78 2kvu s PRO 44 CO 0.15 -0.89 0.92 1.33 0.04 0.00 0.00 177.00 178.55 2kvu n VAL 45 N 5.11 0.92 -4.70 -0.36 0.24 -1.26 -4.80 118.33 113.48 2kvu n VAL 45 Ca 0.19 -0.43 -0.33 0.00 -2.04 0.00 0.00 64.34 61.73 2kvu n VAL 45 Cb 0.40 -0.50 -0.13 0.00 -1.47 0.00 0.00 33.84 32.13 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 -0.14 4.26 0.00 -1.34 0.15 -1.26 -4.90 113.70 110.47 2kvu s SER 46 Ca 0.16 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2kvu s SER 46 Cb 0.12 -1.46 0.00 0.00 -1.71 0.00 0.00 66.02 62.97 2kvu s SER 46 CO 0.04 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.32 2kvu n GLY 47 N 3.15 0.59 3.95 9.45 0.00 -1.26 -4.90 105.19 116.17 2kvu n GLY 47 Ca -0.18 -1.63 -0.25 0.00 0.00 0.00 0.00 46.02 43.96 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 -1.55 2.29 0.21 2.61 -4.23 -1.26 -4.81 115.64 108.90 2kvu s THR 48 Ca 0.00 -0.36 -0.12 0.00 -1.18 0.00 0.00 61.69 60.03 2kvu s THR 48 Cb 0.00 -2.93 0.19 0.00 1.34 0.00 0.00 72.50 71.10 2kvu s THR 48 CO 0.00 0.00 1.66 0.50 -0.54 0.00 0.00 174.62 176.24 2kvu h LYS 49 N -0.57 0.10 -0.42 3.99 1.63 -1.99 0.89 116.57 120.20 2kvu h LYS 49 Ca -0.43 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.32 2kvu h LYS 49 Cb 1.30 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.89 2kvu h LYS 49 CO 0.54 0.07 0.09 1.79 -3.45 0.00 0.00 179.45 178.48 2kvu h THR 50 N 0.10 1.24 -0.31 1.00 1.35 -2.00 -2.56 112.91 111.74 2kvu h THR 50 Ca 0.31 -0.84 0.02 0.00 -0.55 0.00 0.00 66.41 65.35 2kvu h THR 50 Cb 0.49 0.98 -0.03 0.00 -1.73 0.00 0.00 68.15 67.86 2kvu h THR 50 CO -0.52 0.29 0.14 -0.33 -0.25 0.00 0.00 175.52 174.85 2kvu h GLU 51 N 0.55 0.29 -0.61 4.72 4.39 -1.65 -1.00 114.58 121.26 2kvu h GLU 51 Ca 0.13 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 2kvu h GLU 51 Cb 0.35 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.90 2kvu h GLU 51 CO 0.00 0.19 0.28 -0.07 -1.16 0.00 0.00 179.01 178.26 2kvu h LEU 52 N 0.29 0.82 0.08 1.33 3.38 -0.80 0.23 115.31 120.64 2kvu h LEU 52 Ca 0.13 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2kvu h LEU 52 Cb 0.06 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2kvu h LEU 52 CO -0.10 0.73 -0.04 0.40 0.09 0.00 0.00 178.44 179.52 2kvu h ILE 53 N 0.85 1.00 -0.31 1.22 2.04 -1.24 -1.74 117.51 119.32 2kvu h ILE 53 Ca 0.21 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 2kvu h ILE 53 Cb 0.14 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2kvu h ILE 53 CO -0.02 0.06 -0.17 -0.33 0.00 0.00 0.00 178.15 177.69 2kvu h GLU 54 N -0.22 0.57 -0.55 2.37 4.39 -0.98 -0.61 114.58 119.55 2kvu h GLU 54 Ca -0.01 -0.19 -0.11 0.00 0.34 0.00 0.00 59.36 59.39 2kvu h GLU 54 Cb 0.18 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2kvu h GLU 54 CO 0.02 0.72 -0.08 -0.09 -1.16 0.00 0.00 179.01 178.41 2kvu h ARG 55 N 0.51 1.03 0.07 2.33 2.43 -0.43 0.30 114.38 120.61 2kvu h ARG 55 Ca 0.09 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 58.89 2kvu h ARG 55 Cb 0.59 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 2kvu h ARG 55 CO 0.04 1.05 -0.03 -0.07 -1.51 0.00 0.00 179.97 179.45 2kvu h LEU 56 N 0.92 -0.08 -0.56 3.80 3.38 -1.07 -2.32 115.31 119.37 2kvu h LEU 56 Ca 0.15 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2kvu h LEU 56 Cb 0.65 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 2kvu h LEU 56 CO 0.04 0.17 0.36 0.03 0.09 0.00 0.00 178.44 179.14 2kvu h ARG 57 N -0.32 0.72 -0.25 1.13 3.08 -0.86 -0.05 114.38 117.81 2kvu h ARG 57 Ca -0.01 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 2kvu h ARG 57 Cb 0.28 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2kvu h ARG 57 CO 0.02 0.47 -0.15 0.00 -1.07 0.00 0.00 179.97 179.24 2kvu h ALA 58 N 1.22 1.28 -0.21 0.04 0.00 -0.45 0.19 119.26 121.32 2kvu h ALA 58 Ca 0.21 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 2kvu h ALA 58 Cb -0.06 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2kvu h ALA 58 CO -0.06 0.48 -0.35 -0.92 0.00 0.00 0.00 179.25 178.40 2kvu h TYR 59 N 0.40 0.76 -0.06 0.00 3.20 -0.82 -2.85 116.97 117.60 2kvu h TYR 59 Ca 0.07 -0.26 -0.12 0.00 3.14 0.00 0.00 58.73 61.56 2kvu h TYR 59 Cb 0.50 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2kvu h TYR 59 CO 0.01 1.01 -0.53 0.37 -1.64 0.00 0.00 178.16 177.38 2kvu h GLN 60 N 0.30 0.16 -0.33 1.82 -0.00 -0.75 -2.79 115.11 113.53 2kvu h GLN 60 Ca 0.02 -0.10 -0.00 0.00 -0.00 0.00 0.00 58.65 58.57 2kvu h GLN 60 Cb 0.94 0.01 -0.02 0.00 0.00 0.00 0.00 27.48 28.41 2kvu h GLN 60 CO 0.08 0.65 0.20 0.22 0.00 0.00 0.00 178.83 179.98 2kvu h ASP 61 N 0.13 0.39 1.46 -0.69 3.58 -0.59 -1.73 116.42 118.96 2kvu h ASP 61 Ca 0.00 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.41 2kvu h ASP 61 Cb 0.97 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.93 2kvu h ASP 61 CO 0.08 0.32 0.00 0.06 -2.88 0.00 0.00 179.24 176.81 2kvu h GLN 62 N 0.43 0.00 -0.25 0.28 3.07 -1.43 -2.31 115.11 114.89 2kvu h GLN 62 Ca 0.12 0.00 -0.17 0.00 0.09 0.00 0.00 58.65 58.68 2kvu h GLN 62 Cb -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.55 2kvu h GLN 62 CO -0.02 0.00 -0.54 0.82 0.09 0.00 0.00 178.83 179.18 2kvu h ILE 63 N 0.00 1.29 -4.00 1.86 2.04 -1.18 -3.45 117.51 114.07 2kvu h ILE 63 Ca 0.00 -1.75 -0.50 0.00 1.00 0.00 0.00 64.86 63.62 2kvu h ILE 63 Cb 0.73 1.67 0.05 0.00 -0.74 0.00 0.00 36.82 38.53 2kvu h ILE 63 CO 0.00 0.56 0.45 -0.44 0.00 0.00 0.00 178.15 178.72 2kvu s SER 64 N -6.93 6.33 -0.10 1.72 0.01 -0.69 -4.94 113.70 109.10 2kvu s SER 64 Ca -0.09 2.19 -0.29 0.00 1.31 0.00 0.00 55.95 59.06 2kvu s SER 64 Cb 0.11 -2.59 -0.06 0.00 0.21 0.00 0.00 66.02 63.68 2kvu s SER 64 CO 0.87 -0.80 2.04 -2.84 0.41 0.00 0.00 173.24 172.92 2kvu s PRO 65 N -2.72 3.66 0.03 12.44 0.02 -1.26 -4.95 135.00 142.21 2kvu s PRO 65 Ca 0.63 2.25 -0.25 0.00 0.02 0.00 0.00 61.00 63.65 2kvu s PRO 65 Cb -0.25 -4.24 -0.05 0.00 0.02 0.00 0.00 34.50 29.97 2kvu s PRO 65 CO 0.31 -1.50 0.76 0.14 -0.33 0.00 0.00 177.00 176.37 2kvu s VAL 66 N 6.24 4.76 0.00 3.83 -7.23 -1.26 -4.94 120.40 121.80 2kvu s VAL 66 Ca 0.92 1.61 -0.01 0.00 -1.81 0.00 0.00 61.98 62.68 2kvu s VAL 66 Cb -0.36 -4.10 -0.06 0.00 0.56 0.00 0.00 36.38 32.41 2kvu s VAL 66 CO 0.37 0.36 2.01 -0.81 -0.31 0.00 0.00 175.10 176.72 2kvu n PRO 67 N 2.89 1.03 -1.13 4.82 -0.04 -1.26 -4.67 135.00 136.64 2kvu n PRO 67 Ca -0.02 -0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.22 2kvu n PRO 67 Cb 0.50 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 2kvu n PRO 67 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kvu n GLY 68 N 1.85 -2.16 3.34 0.55 0.00 -1.26 -5.13 105.19 102.38 2kvu n GLY 68 Ca 0.09 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 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 0.00 -1.11 -0.01 4.61 0.00 -1.26 -5.12 121.76 118.87 2kvu s ALA 69 Ca 0.00 0.98 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 2kvu s ALA 69 Cb 0.00 -0.38 -0.09 0.00 0.00 0.00 0.00 23.12 22.65 2kvu s ALA 69 CO 0.00 -0.25 2.01 -2.30 0.00 0.00 0.00 175.76 175.22 2kvu n PRO 70 N 2.07 2.68 -2.29 0.00 -0.02 -1.26 -4.88 135.00 131.30 2kvu n PRO 70 Ca -0.17 0.96 -0.34 0.00 -2.02 0.00 0.00 63.50 61.93 2kvu n PRO 70 Cb 0.57 -3.01 -0.04 0.00 -0.02 0.00 0.00 33.50 30.99 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 4.73 3.03 -0.40 -0.52 2.20 -1.26 -4.80 119.74 122.72 2kvu s LYS 71 Ca 0.91 -0.59 0.04 0.00 -0.36 0.00 0.00 55.97 55.97 2kvu s LYS 71 Cb -0.44 -5.11 0.16 0.00 -1.51 0.00 0.00 37.83 30.93 2kvu s LYS 71 CO 0.42 -2.79 0.44 0.00 -0.36 0.00 0.00 175.35 173.05 2kvu s ALA 72 N 7.67 -0.58 0.28 3.13 0.00 -1.26 -5.15 121.76 125.86 2kvu s ALA 72 Ca 0.58 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 2kvu s ALA 72 Cb -0.04 -2.14 -0.10 0.00 0.00 0.00 0.00 23.12 20.84 2kvu s ALA 72 CO -0.03 -2.15 1.09 -2.14 0.00 0.00 0.00 175.76 172.53 2kvu s PRO 73 N 1.22 4.65 -0.15 0.00 0.02 -1.26 -5.03 135.00 134.45 2kvu s PRO 73 Ca 0.20 1.79 -0.20 0.00 0.02 0.00 0.00 61.00 62.81 2kvu s PRO 73 Cb -0.10 -3.19 -0.03 0.00 0.02 0.00 0.00 34.50 31.20 2kvu s PRO 73 CO -0.05 0.23 0.56 0.00 -0.33 0.00 0.00 177.00 177.41 2kvu s ALA 74 N -1.17 3.48 0.00 -1.55 0.00 -1.26 -5.21 121.76 116.05 2kvu s ALA 74 Ca 0.44 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.20 2kvu s ALA 74 Cb -0.32 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 19.98 2kvu s ALA 74 CO 0.40 -0.26 0.00 0.00 0.00 0.00 0.00 175.76 175.91