#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 0.66 2.85 3.03 0.00 -1.26 -5.08 105.19 105.40 2kvu n GLY 2 Ca 0.00 -1.76 -0.14 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.74 -0.51 -0.10 1.61 -0.00 -1.26 -5.15 115.29 107.16 2kvu s HIS 3 Ca 0.00 0.56 0.01 0.00 -0.00 0.00 0.00 55.06 55.63 2kvu s HIS 3 Cb 0.00 -0.17 -0.02 0.00 -0.00 0.00 0.00 32.58 32.39 2kvu s HIS 3 CO 0.00 -0.62 -0.12 -1.58 -0.00 0.00 0.00 174.74 172.42 2kvu s HIS 4 N 2.43 2.81 0.13 0.38 5.65 -1.26 -5.09 115.29 120.34 2kvu s HIS 4 Ca 0.08 -0.35 -0.31 0.00 0.25 0.00 0.00 55.06 54.73 2kvu s HIS 4 Cb -0.15 -1.76 -0.08 0.00 -1.18 0.00 0.00 32.58 29.41 2kvu s HIS 4 CO -0.13 0.02 1.38 -1.01 -0.65 0.00 0.00 174.74 174.35 2kvu s HIS 5 N -0.19 3.24 -0.14 3.88 0.09 -1.26 -4.87 115.29 116.04 2kvu s HIS 5 Ca 0.01 1.00 0.06 0.00 -0.00 0.00 0.00 55.06 56.13 2kvu s HIS 5 Cb -0.13 -3.67 -0.08 0.00 -0.00 0.00 0.00 32.58 28.70 2kvu s HIS 5 CO 0.03 -2.30 0.19 0.72 -0.00 0.00 0.00 174.74 173.37 2kvu n HIS 6 N 3.68 0.00 -4.50 1.40 -0.00 -1.26 -4.99 115.22 109.55 2kvu n HIS 6 Ca 0.10 0.00 -0.24 0.00 -0.00 0.00 0.00 57.72 57.59 2kvu n HIS 6 Cb 0.42 -0.07 -0.14 0.00 -0.00 0.00 0.00 29.99 30.21 2kvu n HIS 6 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kvu s HIS 7 N -1.99 1.64 -0.00 4.41 4.02 -1.26 -5.13 115.29 116.98 2kvu s HIS 7 Ca -0.00 -0.38 -0.25 0.00 1.02 0.00 0.00 55.06 55.45 2kvu s HIS 7 Cb 0.04 -0.96 -0.04 0.00 -1.02 0.00 0.00 32.58 30.59 2kvu s HIS 7 CO 0.24 0.09 0.78 -3.38 1.02 0.00 0.00 174.74 173.49 2kvu s HIS 8 N -0.88 3.67 -0.15 1.40 0.00 -1.26 -4.93 115.29 113.13 2kvu s HIS 8 Ca 0.06 1.43 0.16 0.00 -3.00 0.00 0.00 55.06 53.71 2kvu s HIS 8 Cb -0.09 -2.86 -0.24 0.00 -4.00 0.00 0.00 32.58 25.39 2kvu s HIS 8 CO 0.02 0.16 0.24 0.45 -1.00 0.00 0.00 174.74 174.62 2kvu n SER 9 N 3.32 0.28 -4.71 7.38 2.88 -1.26 -4.80 113.62 116.71 2kvu n SER 9 Ca -0.01 0.12 -0.42 0.00 -1.33 0.00 0.00 58.87 57.23 2kvu n SER 9 Cb 0.51 0.67 -0.03 0.00 -0.75 0.00 0.00 64.21 64.61 2kvu n SER 9 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2kvu s HIS 10 N -2.52 3.36 -0.32 0.66 2.46 -1.26 -4.28 115.29 113.39 2kvu s HIS 10 Ca -0.09 1.26 -0.03 0.00 0.47 0.00 0.00 55.06 56.67 2kvu s HIS 10 Cb 0.07 -3.43 0.00 0.00 -0.13 0.00 0.00 32.58 29.09 2kvu s HIS 10 CO 0.83 -1.34 0.11 -0.12 -2.47 0.00 0.00 174.74 171.75 2kvu n MET 11 N 4.22 -3.18 -1.21 2.88 0.00 -1.26 -5.07 117.12 113.50 2kvu n MET 11 Ca 0.09 2.60 -0.00 0.00 -0.00 0.00 0.00 57.70 60.39 2kvu n MET 11 Cb 0.46 -5.30 0.00 0.00 0.00 0.00 0.00 33.22 28.38 2kvu n MET 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2kvu n SER 12 N 0.49 -0.11 -4.51 6.12 2.88 -1.26 -5.00 113.62 112.23 2kvu n SER 12 Ca 0.02 -1.07 -0.43 0.00 -1.33 0.00 0.00 58.87 56.07 2kvu n SER 12 Cb 0.09 0.18 -0.08 0.00 -0.75 0.00 0.00 64.21 63.64 2kvu n SER 12 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2kvu s THR 13 N -2.88 4.99 0.16 2.46 -4.23 -1.26 -5.03 115.64 109.85 2kvu s THR 13 Ca 0.01 -0.07 -0.31 0.00 -1.18 0.00 0.00 61.69 60.13 2kvu s THR 13 Cb -0.00 -4.07 -0.11 0.00 1.34 0.00 0.00 72.50 69.65 2kvu s THR 13 CO 0.01 -0.43 1.81 -2.65 -0.54 0.00 0.00 174.62 172.81 2kvu n PRO 14 N 5.83 2.82 0.00 3.99 -0.02 -1.26 -4.88 135.00 141.49 2kvu n PRO 14 Ca -0.05 1.02 0.12 0.00 -2.02 0.00 0.00 63.50 62.58 2kvu n PRO 14 Cb 0.48 -2.91 0.26 0.00 -0.02 0.00 0.00 33.50 31.31 2kvu n PRO 14 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2kvu n LEU 15 N 5.09 1.23 -4.49 2.45 7.94 -1.26 -4.64 117.00 123.32 2kvu n LEU 15 Ca 0.17 -0.37 -0.43 0.00 -1.11 0.00 0.00 56.01 54.27 2kvu n LEU 15 Cb 0.37 -0.10 -0.04 0.00 0.53 0.00 0.00 43.42 44.18 2kvu n LEU 15 CO 0.65 0.23 0.81 -0.89 -1.11 0.00 0.00 177.39 177.09 2kvu s THR 16 N -2.54 4.26 0.00 1.96 2.01 -1.26 -4.63 115.64 115.44 2kvu s THR 16 Ca 0.22 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.16 2kvu s THR 16 Cb 0.19 -4.67 0.00 0.00 0.01 0.00 0.00 72.50 68.02 2kvu s THR 16 CO 0.55 -1.41 0.00 0.61 -0.69 0.00 0.00 174.62 173.69 2kvu n GLY 17 N 5.27 1.43 0.88 4.40 0.00 -1.26 -5.03 105.19 110.89 2kvu n GLY 17 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2kvu n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kvu n LYS 18 N 0.00 -2.41 -2.00 1.61 5.02 -1.26 -4.79 118.16 114.33 2kvu n LYS 18 Ca 0.00 1.84 -0.43 0.00 -2.02 0.00 0.00 58.31 57.70 2kvu n LYS 18 Cb 0.00 -2.19 -0.03 0.00 -0.02 0.00 0.00 35.03 32.79 2kvu n LYS 18 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2kvu s PRO 19 N -4.75 3.64 -1.19 1.97 0.02 -1.26 -4.92 135.00 128.52 2kvu s PRO 19 Ca 0.00 1.71 -0.21 0.00 0.02 0.00 0.00 61.00 62.53 2kvu s PRO 19 Cb 0.00 -4.12 0.01 0.00 0.02 0.00 0.00 34.50 30.42 2kvu s PRO 19 CO 0.00 -1.49 1.76 0.20 -0.33 0.00 0.00 177.00 177.14 2kvu s GLY 20 N 5.10 1.06 -0.03 0.52 0.00 -1.26 -4.91 107.32 107.80 2kvu s GLY 20 Ca 0.78 -2.48 0.04 0.00 0.00 0.00 0.00 44.72 43.05 2kvu s GLY 20 CO 0.32 3.01 -0.16 0.00 0.00 0.00 0.00 173.10 176.27 2kvu s ALA 21 N 6.66 1.40 0.18 3.20 0.00 -1.26 -4.86 121.76 127.07 2kvu s ALA 21 Ca 0.58 -0.65 -0.05 0.00 0.00 0.00 0.00 51.96 51.83 2kvu s ALA 21 Cb 0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 23.12 22.63 2kvu s ALA 21 CO 0.06 0.27 0.43 -0.51 0.00 0.00 0.00 175.76 176.01 2kvu s LEU 22 N -0.04 4.22 0.06 0.00 1.43 -1.26 -5.06 118.68 118.03 2kvu s LEU 22 Ca -0.01 0.65 -0.31 0.00 -1.03 0.00 0.00 54.13 53.43 2kvu s LEU 22 Cb -0.10 -3.40 -0.07 0.00 0.03 0.00 0.00 46.19 42.65 2kvu s LEU 22 CO 0.01 -0.00 1.46 -2.16 0.23 0.00 0.00 176.35 175.89 2kvu s PRO 23 N -2.83 4.27 0.61 1.29 0.04 -1.26 -4.89 135.00 132.24 2kvu s PRO 23 Ca 0.42 2.10 0.33 0.00 0.04 0.00 0.00 61.00 63.89 2kvu s PRO 23 Cb -0.12 -3.45 1.96 0.00 0.04 0.00 0.00 34.50 32.93 2kvu s PRO 23 CO 0.25 -0.57 2.27 0.00 0.04 0.00 0.00 177.00 178.99 2kvu h ALA 24 N 7.56 1.42 -0.21 8.56 0.00 -2.04 -2.85 119.26 131.70 2kvu h ALA 24 Ca -0.40 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.27 2kvu h ALA 24 Cb 1.19 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.90 2kvu h ALA 24 CO 0.90 -0.03 0.04 0.09 0.00 0.00 0.00 179.25 180.24 2kvu n ASN 25 N -3.64 5.78 0.26 0.00 4.13 -1.26 -4.39 115.26 116.14 2kvu n ASN 25 Ca -0.03 -2.74 0.12 0.00 1.68 0.00 0.00 54.58 53.61 2kvu n ASN 25 Cb 0.11 -1.23 0.71 0.00 -1.54 0.00 0.00 39.78 37.82 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 3.76 0.00 -0.53 3.41 3.38 -1.90 -1.51 115.31 121.93 2kvu h LEU 26 Ca 0.21 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.09 2kvu h LEU 26 Cb 1.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2kvu h LEU 26 CO 0.42 0.12 -0.42 -0.78 0.09 0.00 0.00 178.44 177.87 2kvu h ASP 27 N 0.00 0.00 0.61 -0.43 3.58 -1.90 -2.66 116.42 115.62 2kvu h ASP 27 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kvu h ASP 27 Cb 0.30 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.35 2kvu h ASP 27 CO 0.02 0.42 -0.15 0.47 -2.88 0.00 0.00 179.24 177.12 2kvu n ASP 28 N -3.37 0.29 -4.87 2.28 9.92 -0.59 -4.85 116.55 115.37 2kvu n ASP 28 Ca 0.01 -0.14 -0.22 0.00 -0.53 0.00 0.00 54.79 53.91 2kvu n ASP 28 Cb 0.61 -0.15 0.06 0.00 -0.64 0.00 0.00 41.12 41.00 2kvu n ASP 28 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 2kvu s MET 29 N -2.76 2.21 0.28 -1.24 -1.94 -1.00 -5.10 119.30 109.75 2kvu s MET 29 Ca 0.20 -0.84 -0.03 0.00 -1.71 0.00 0.00 55.69 53.31 2kvu s MET 29 Cb 0.19 -2.40 -0.05 0.00 2.01 0.00 0.00 34.83 34.58 2kvu s MET 29 CO 0.54 -1.02 0.52 0.15 -0.01 0.00 0.00 175.02 175.20 2kvu s LYS 30 N -4.94 3.59 0.20 2.03 1.02 -1.26 -4.98 119.74 115.39 2kvu s LYS 30 Ca 0.61 -0.12 -0.11 0.00 0.02 0.00 0.00 55.97 56.37 2kvu s LYS 30 Cb -0.09 -2.69 0.17 0.00 -0.52 0.00 0.00 37.83 34.71 2kvu s LYS 30 CO 0.41 0.24 1.82 0.28 -0.92 0.00 0.00 175.35 177.18 2kvu h VAL 31 N 1.29 1.04 -0.50 3.17 2.07 -1.97 -1.30 116.25 120.05 2kvu h VAL 31 Ca -0.48 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 2kvu h VAL 31 Cb 1.19 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 2kvu h VAL 31 CO 0.66 0.13 0.13 0.00 0.02 0.00 0.00 177.57 178.51 2kvu h ALA 32 N 1.29 1.29 -0.65 1.67 0.00 -1.98 -0.80 119.26 120.07 2kvu h ALA 32 Ca 0.26 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2kvu h ALA 32 Cb 0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2kvu h ALA 32 CO -0.12 0.50 0.06 0.93 0.00 0.00 0.00 179.25 180.62 2kvu h GLU 33 N 0.74 1.11 -0.50 0.00 4.39 -1.71 -1.06 114.58 117.54 2kvu h GLU 33 Ca 0.17 -0.32 -0.04 0.00 0.34 0.00 0.00 59.36 59.50 2kvu h GLU 33 Cb 0.26 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2kvu h GLU 33 CO -0.00 1.04 0.14 -0.07 -1.16 0.00 0.00 179.01 178.95 2kvu h LEU 34 N 1.03 0.74 -1.88 1.33 3.38 -0.83 -2.69 115.31 116.38 2kvu h LEU 34 Ca 0.19 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2kvu h LEU 34 Cb 0.50 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2kvu h LEU 34 CO 0.02 0.76 -0.09 0.11 0.09 0.00 0.00 178.44 179.33 2kvu h LYS 35 N 0.67 0.00 0.73 1.13 1.57 -0.77 -2.07 116.57 117.84 2kvu h LYS 35 Ca 0.16 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 2kvu h LYS 35 Cb 0.30 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.62 2kvu h LYS 35 CO -0.00 0.09 -0.35 1.96 -0.57 0.00 0.00 179.45 180.58 2kvu h GLN 36 N 0.00 -0.95 0.00 3.15 1.08 -0.85 0.22 115.11 117.76 2kvu h GLN 36 Ca -0.00 0.06 -0.06 0.00 -1.45 0.00 0.00 58.65 57.21 2kvu h GLN 36 Cb 0.37 0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 28.01 2kvu h GLN 36 CO 0.01 -0.63 -0.28 0.93 -0.95 0.00 0.00 178.83 177.92 2kvu h GLU 37 N -1.00 0.00 0.75 1.46 5.08 -1.53 -1.57 114.58 117.76 2kvu h GLU 37 Ca -0.10 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2kvu h GLU 37 Cb 0.76 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.02 2kvu h GLU 37 CO 0.17 0.28 -0.36 -0.07 -1.00 0.00 0.00 179.01 178.03 2kvu h LEU 38 N 0.00 -0.85 -1.46 1.33 3.38 -1.18 -2.85 115.31 113.67 2kvu h LEU 38 Ca -0.00 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2kvu h LEU 38 Cb 0.53 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2kvu h LEU 38 CO 0.04 -0.49 -0.04 0.07 0.09 0.00 0.00 178.44 178.11 2kvu h LYS 39 N -1.23 0.30 -0.05 1.13 2.10 -0.37 0.38 116.57 118.83 2kvu h LYS 39 Ca -0.10 -0.05 -0.07 0.00 -2.00 0.00 0.00 60.65 58.43 2kvu h LYS 39 Cb 0.78 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 32.05 2kvu h LYS 39 CO 0.17 0.36 -0.28 -0.07 -2.00 0.00 0.00 179.45 177.63 2kvu h LEU 40 N 0.29 0.09 -2.85 7.07 3.38 -1.35 -1.97 115.31 119.97 2kvu h LEU 40 Ca 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2kvu h LEU 40 Cb 0.27 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2kvu h LEU 40 CO 0.01 0.37 0.00 0.54 0.09 0.00 0.00 178.44 179.45 2kvu n ARG 41 N -4.17 2.98 -2.05 1.13 1.74 -0.39 -4.92 116.66 110.97 2kvu n ARG 41 Ca -0.02 -2.72 -0.19 0.00 -0.77 0.00 0.00 57.85 54.15 2kvu n ARG 41 Cb 0.35 -1.65 -0.04 0.00 -1.02 0.00 0.00 32.46 30.11 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 1.52 -5.39 -4.84 0.55 7.64 -0.43 -4.98 113.62 107.70 2kvu n SER 42 Ca 0.25 0.17 -0.32 0.00 1.01 0.00 0.00 58.87 59.97 2kvu n SER 42 Cb 0.69 -4.48 -0.02 0.00 -1.01 0.00 0.00 64.21 59.38 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 -5.00 3.57 -0.28 -3.43 1.43 0.12 -4.96 118.68 110.12 2kvu s LEU 43 Ca 0.00 1.59 -0.29 0.00 -1.03 0.00 0.00 54.13 54.41 2kvu s LEU 43 Cb 0.00 -4.51 -0.02 0.00 0.03 0.00 0.00 46.19 41.69 2kvu s LEU 43 CO 0.00 -0.71 1.64 -2.84 0.23 0.00 0.00 176.35 174.67 2kvu s PRO 44 N -4.18 3.64 0.00 1.29 0.02 -1.26 -4.31 135.00 130.19 2kvu s PRO 44 Ca 0.59 1.50 0.29 0.00 0.02 0.00 0.00 61.00 63.40 2kvu s PRO 44 Cb -0.11 -4.08 1.24 0.00 0.02 0.00 0.00 34.50 31.57 2kvu s PRO 44 CO 0.34 -1.48 1.86 1.33 -0.33 0.00 0.00 177.00 178.72 2kvu n VAL 45 N 6.78 0.00 -2.28 3.83 0.24 -1.26 -4.88 118.33 120.76 2kvu n VAL 45 Ca 0.20 -0.08 -0.41 0.00 -2.04 0.00 0.00 64.34 62.00 2kvu n VAL 45 Cb 0.46 -0.02 -0.03 0.00 -1.47 0.00 0.00 33.84 32.78 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 -2.36 6.98 0.00 -1.34 0.01 -1.26 -4.85 113.70 110.87 2kvu s SER 46 Ca 0.32 2.36 0.00 0.00 1.31 0.00 0.00 55.95 59.94 2kvu s SER 46 Cb 0.20 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.82 2kvu s SER 46 CO 0.45 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 174.26 2kvu n GLY 47 N 2.06 0.34 3.98 3.44 0.00 -1.26 -4.89 105.19 108.86 2kvu n GLY 47 Ca 0.04 -2.26 -0.21 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 -0.29 2.86 0.26 2.61 -4.23 -1.26 -4.93 115.64 110.65 2kvu s THR 48 Ca 0.00 -0.70 -0.03 0.00 -1.18 0.00 0.00 61.69 59.79 2kvu s THR 48 Cb 0.00 -3.05 0.23 0.00 1.34 0.00 0.00 72.50 71.02 2kvu s THR 48 CO 0.00 -0.03 1.81 0.50 -0.54 0.00 0.00 174.62 176.36 2kvu h LYS 49 N 0.19 0.81 -0.93 3.99 3.64 -1.98 -1.20 116.57 121.09 2kvu h LYS 49 Ca -0.42 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 58.96 2kvu h LYS 49 Cb 1.29 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 32.87 2kvu h LYS 49 CO 0.52 0.53 0.59 1.15 -2.27 0.00 0.00 179.45 179.98 2kvu h THR 50 N 0.83 1.11 -0.20 1.00 2.02 -2.00 -1.50 112.91 114.17 2kvu h THR 50 Ca 0.43 -0.38 -0.05 0.00 0.77 0.00 0.00 66.41 67.18 2kvu h THR 50 Cb 0.42 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 2kvu h THR 50 CO -0.26 0.20 -0.07 -0.33 0.37 0.00 0.00 175.52 175.44 2kvu h GLU 51 N 1.12 0.39 -0.82 6.66 5.08 -1.66 -2.89 114.58 122.45 2kvu h GLU 51 Ca 0.39 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.62 2kvu h GLU 51 Cb 0.09 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 2kvu h GLU 51 CO -0.15 0.66 0.52 -0.07 -1.00 0.00 0.00 179.01 178.98 2kvu h LEU 52 N 0.10 0.86 0.39 1.33 3.38 -0.72 0.36 115.31 121.00 2kvu h LEU 52 Ca 0.05 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2kvu h LEU 52 Cb 0.53 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2kvu h LEU 52 CO 0.02 0.59 -0.19 0.40 0.09 0.00 0.00 178.44 179.36 2kvu h ILE 53 N 1.01 0.63 -0.23 1.22 2.04 -1.30 -1.36 117.51 119.51 2kvu h ILE 53 Ca 0.33 -0.09 -0.09 0.00 1.00 0.00 0.00 64.86 66.01 2kvu h ILE 53 Cb 0.03 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2kvu h ILE 53 CO -0.12 0.02 -0.25 -0.33 0.00 0.00 0.00 178.15 177.47 2kvu h GLU 54 N -0.57 0.43 -0.25 2.37 4.39 -1.25 -1.39 114.58 118.32 2kvu h GLU 54 Ca -0.05 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.48 2kvu h GLU 54 Cb 0.43 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 2kvu h GLU 54 CO 0.09 0.65 0.09 -0.09 -1.16 0.00 0.00 179.01 178.59 2kvu h ARG 55 N 0.38 0.37 -0.51 2.33 2.43 -0.19 0.26 114.38 119.46 2kvu h ARG 55 Ca 0.06 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2kvu h ARG 55 Cb 0.64 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 2kvu h ARG 55 CO 0.05 0.42 0.33 -0.07 -1.51 0.00 0.00 179.97 179.19 2kvu h LEU 56 N 0.25 0.56 0.12 3.80 3.38 -1.02 -1.49 115.31 120.90 2kvu h LEU 56 Ca 0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2kvu h LEU 56 Cb 0.19 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2kvu h LEU 56 CO -0.01 0.40 -0.06 0.03 0.09 0.00 0.00 178.44 178.90 2kvu h ARG 57 N 0.67 -0.15 -0.16 1.13 3.08 -0.92 0.46 114.38 118.49 2kvu h ARG 57 Ca 0.19 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 2kvu h ARG 57 Cb -0.05 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2kvu h ARG 57 CO -0.05 -0.07 0.04 0.00 -1.07 0.00 0.00 179.97 178.82 2kvu h ALA 58 N 0.69 1.78 0.01 0.04 0.00 -0.36 0.32 119.26 121.73 2kvu h ALA 58 Ca -0.02 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2kvu h ALA 58 Cb 0.15 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2kvu h ALA 58 CO 0.03 0.18 -0.39 -0.92 0.00 0.00 0.00 179.25 178.15 2kvu h TYR 59 N 0.22 0.38 -0.11 0.00 3.20 -0.99 -3.26 116.97 116.42 2kvu h TYR 59 Ca 0.06 -0.21 -0.17 0.00 3.14 0.00 0.00 58.73 61.54 2kvu h TYR 59 Cb 0.09 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 2kvu h TYR 59 CO 0.00 1.03 -0.66 0.37 -1.64 0.00 0.00 178.16 177.26 2kvu h GLN 60 N -0.38 0.42 -0.89 1.82 -0.00 -0.49 -3.13 115.11 112.47 2kvu h GLN 60 Ca -0.05 -0.31 0.00 0.00 -0.00 0.00 0.00 58.65 58.29 2kvu h GLN 60 Cb 1.14 0.05 -0.04 0.00 0.00 0.00 0.00 27.48 28.63 2kvu h GLN 60 CO 0.08 0.93 0.56 0.22 0.00 0.00 0.00 178.83 180.62 2kvu h ASP 61 N 0.30 1.05 1.32 -0.69 3.58 -0.50 -1.16 116.42 120.32 2kvu h ASP 61 Ca -0.02 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2kvu h ASP 61 Cb 1.21 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.00 2kvu h ASP 61 CO 0.11 0.79 0.00 0.00 -2.88 0.00 0.00 179.24 177.26 2kvu n GLN 62 N -4.38 0.19 0.08 0.28 10.64 -1.21 -2.60 117.38 120.38 2kvu n GLN 62 Ca 0.10 0.16 -0.04 0.00 -1.83 0.00 0.00 57.00 55.39 2kvu n GLN 62 Cb 0.04 -1.72 0.16 0.00 -0.86 0.00 0.00 30.24 27.86 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 1.35 -3.86 -0.39 2.04 -1.16 -3.43 117.51 112.06 2kvu h ILE 63 Ca 0.00 -1.79 -0.50 0.00 1.00 0.00 0.00 64.86 63.57 2kvu h ILE 63 Cb 0.66 1.86 0.03 0.00 -0.74 0.00 0.00 36.82 38.63 2kvu h ILE 63 CO 0.00 0.53 0.49 -0.55 0.00 0.00 0.00 178.15 178.62 2kvu s SER 64 N -6.89 7.01 -0.40 1.72 0.15 -1.07 -4.91 113.70 109.31 2kvu s SER 64 Ca -0.04 2.30 -0.30 0.00 0.70 0.00 0.00 55.95 58.60 2kvu s SER 64 Cb 0.13 -2.62 -0.09 0.00 -1.71 0.00 0.00 66.02 61.72 2kvu s SER 64 CO 0.79 -0.33 2.30 -2.65 1.20 0.00 0.00 173.24 174.55 2kvu n PRO 65 N 0.77 1.23 -2.87 5.44 -0.02 -1.26 -4.93 135.00 133.36 2kvu n PRO 65 Ca 0.01 0.26 -0.41 0.00 -2.02 0.00 0.00 63.50 61.34 2kvu n PRO 65 Cb 0.45 -2.86 -0.04 0.00 -0.02 0.00 0.00 33.50 31.03 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 9.03 4.91 -1.00 -1.45 -7.23 -1.26 -4.94 120.40 118.46 2kvu s VAL 66 Ca 1.06 1.71 0.13 0.00 -1.81 0.00 0.00 61.98 63.08 2kvu s VAL 66 Cb -0.56 -4.17 0.59 0.00 0.56 0.00 0.00 36.38 32.80 2kvu s VAL 66 CO 0.39 0.11 1.45 -0.81 -0.31 0.00 0.00 175.10 175.93 2kvu n PRO 67 N 4.55 3.39 0.16 4.82 -0.04 -1.26 -4.61 135.00 142.01 2kvu n PRO 67 Ca 0.04 -2.29 0.00 0.00 -0.04 0.00 0.00 63.50 61.20 2kvu n PRO 67 Cb 0.50 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 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 0.83 -0.84 1.56 0.55 0.00 -1.26 -5.15 105.19 100.87 2kvu n GLY 68 Ca 0.21 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 -3.34 -2.58 -1.48 4.61 0.00 -1.26 -5.02 120.51 111.44 2kvu n ALA 69 Ca 0.00 0.21 -0.32 0.00 0.00 0.00 0.00 53.44 53.33 2kvu n ALA 69 Cb 0.00 -0.64 0.06 0.00 0.00 0.00 0.00 19.45 18.87 2kvu n ALA 69 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2kvu s PRO 70 N -1.43 2.76 0.40 0.00 0.04 -1.26 -5.05 135.00 130.46 2kvu s PRO 70 Ca 0.00 1.17 -0.03 0.00 0.04 0.00 0.00 61.00 62.18 2kvu s PRO 70 Cb 0.00 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2kvu s PRO 70 CO 0.00 -1.25 0.66 -1.59 0.04 0.00 0.00 177.00 174.86 2kvu s LYS 71 N -4.60 3.55 0.08 4.56 -2.85 -1.26 -5.11 119.74 114.11 2kvu s LYS 71 Ca 0.62 -0.02 -0.04 0.00 -1.00 0.00 0.00 55.97 55.54 2kvu s LYS 71 Cb -0.17 -2.52 -0.03 0.00 -2.06 0.00 0.00 37.83 33.05 2kvu s LYS 71 CO 0.49 -0.00 0.07 0.00 0.10 0.00 0.00 175.35 176.00 2kvu s ALA 72 N -2.47 0.32 0.24 0.59 0.00 -1.26 -5.14 121.76 114.04 2kvu s ALA 72 Ca 0.44 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.04 2kvu s ALA 72 Cb -0.10 0.46 -0.09 0.00 0.00 0.00 0.00 23.12 23.39 2kvu s ALA 72 CO 0.39 -0.45 1.31 -1.25 0.00 0.00 0.00 175.76 175.76 2kvu s PRO 73 N -3.93 4.39 0.00 0.00 0.04 -1.26 -5.00 135.00 129.24 2kvu s PRO 73 Ca 0.10 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.23 2kvu s PRO 73 Cb 0.07 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.45 2kvu s PRO 73 CO -0.08 -0.22 0.00 0.00 0.04 0.00 0.00 177.00 176.74 2kvu n ALA 74 N 2.09 0.06 -1.86 8.56 0.00 -1.26 -5.35 120.51 122.75 2kvu n ALA 74 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2kvu n ALA 74 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2kvu n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50