#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 -1.02 0.37 -5.12 0.00 -1.26 -3.67 105.19 94.49 2kvu n GLY 2 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.25 0.00 -3.68 1.61 -0.00 -1.26 -4.97 115.22 105.67 2kvu n HIS 3 Ca 0.12 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.45 2kvu n HIS 3 Cb 0.17 0.03 -0.12 0.00 -0.00 0.00 0.00 29.99 30.08 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 -1.86 3.27 -0.26 4.41 0.09 -1.24 -5.07 115.29 114.63 2kvu s HIS 4 Ca 0.00 -1.31 -0.04 0.00 -0.00 0.00 0.00 55.06 53.71 2kvu s HIS 4 Cb 0.00 -2.43 0.01 0.00 -0.00 0.00 0.00 32.58 30.16 2kvu s HIS 4 CO 0.00 -0.72 0.01 -1.58 -0.00 0.00 0.00 174.74 172.45 2kvu s HIS 5 N 1.45 3.08 -0.27 1.40 5.65 -1.25 -4.21 115.29 121.14 2kvu s HIS 5 Ca 0.00 -1.15 -0.04 0.00 0.25 0.00 0.00 55.06 54.12 2kvu s HIS 5 Cb -0.20 -2.16 0.02 0.00 -1.18 0.00 0.00 32.58 29.06 2kvu s HIS 5 CO 0.04 -0.62 0.00 -1.01 -0.65 0.00 0.00 174.74 172.51 2kvu s HIS 6 N 1.44 3.11 0.00 3.88 0.09 -1.26 -4.85 115.29 117.69 2kvu s HIS 6 Ca 0.02 -1.30 0.00 0.00 -0.00 0.00 0.00 55.06 53.79 2kvu s HIS 6 Cb -0.16 -2.15 0.00 0.00 -0.00 0.00 0.00 32.58 30.27 2kvu s HIS 6 CO -0.01 -0.66 0.11 1.58 -0.00 0.00 0.00 174.74 175.76 2kvu n HIS 7 N 4.76 0.00 -4.11 1.40 -0.00 -1.26 -5.10 115.22 110.90 2kvu n HIS 7 Ca -0.16 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.43 2kvu n HIS 7 Cb 0.47 0.03 -0.11 0.00 -0.00 0.00 0.00 29.99 30.38 2kvu n HIS 7 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kvu s HIS 8 N 0.00 0.84 -0.09 1.57 0.09 -1.26 -5.16 115.29 111.28 2kvu s HIS 8 Ca 0.00 -0.59 -0.06 0.00 -0.00 0.00 0.00 55.06 54.41 2kvu s HIS 8 Cb 0.00 -0.49 0.03 0.00 -0.00 0.00 0.00 32.58 32.13 2kvu s HIS 8 CO 0.00 -0.06 0.23 0.45 -0.00 0.00 0.00 174.74 175.36 2kvu s SER 9 N -1.99 -0.24 -0.53 1.40 0.15 -1.26 -5.10 113.70 106.13 2kvu s SER 9 Ca -0.03 0.48 0.02 0.00 0.70 0.00 0.00 55.95 57.12 2kvu s SER 9 Cb -0.06 0.42 0.13 0.00 -1.71 0.00 0.00 66.02 64.80 2kvu s SER 9 CO -0.00 -0.13 0.28 -2.28 1.20 0.00 0.00 173.24 172.31 2kvu s HIS 10 N 0.75 3.30 -0.22 3.44 2.46 -1.26 -4.93 115.29 118.83 2kvu s HIS 10 Ca -0.05 -3.03 -0.16 0.00 0.47 0.00 0.00 55.06 52.29 2kvu s HIS 10 Cb -0.06 -2.93 -0.10 0.00 -0.13 0.00 0.00 32.58 29.35 2kvu s HIS 10 CO -0.04 -0.79 -0.26 -1.33 -2.47 0.00 0.00 174.74 169.85 2kvu n MET 11 N 3.34 0.55 -3.04 2.88 2.00 -1.26 -5.06 117.12 116.53 2kvu n MET 11 Ca 0.05 0.32 -0.06 0.00 0.00 0.00 0.00 57.70 58.01 2kvu n MET 11 Cb 0.35 -1.53 0.01 0.00 0.00 0.00 0.00 33.22 32.04 2kvu n MET 11 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2kvu n SER 12 N -4.39 -7.61 -4.71 7.83 7.64 -1.26 -4.93 113.62 106.19 2kvu n SER 12 Ca -0.33 0.10 -0.42 0.00 1.01 0.00 0.00 58.87 59.24 2kvu n SER 12 Cb 0.66 -5.00 -0.03 0.00 -1.01 0.00 0.00 64.21 58.84 2kvu n SER 12 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2kvu s THR 13 N -2.79 4.03 0.17 0.44 2.01 -1.26 -4.97 115.64 113.27 2kvu s THR 13 Ca 0.11 1.44 -0.33 0.00 0.31 0.00 0.00 61.69 63.22 2kvu s THR 13 Cb -0.03 -3.92 -0.14 0.00 0.01 0.00 0.00 72.50 68.42 2kvu s THR 13 CO 0.77 0.09 1.57 -2.65 -0.69 0.00 0.00 174.62 173.70 2kvu n PRO 14 N 4.22 2.17 -2.56 4.92 -0.02 -1.26 -4.94 135.00 137.53 2kvu n PRO 14 Ca 0.10 0.78 -0.41 0.00 -2.02 0.00 0.00 63.50 61.95 2kvu n PRO 14 Cb 0.46 -2.54 -0.04 0.00 -0.02 0.00 0.00 33.50 31.36 2kvu n PRO 14 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2kvu s LEU 15 N 0.81 4.49 -0.34 2.45 1.43 -1.26 -5.00 118.68 121.26 2kvu s LEU 15 Ca 0.77 2.03 -0.22 0.00 -1.03 0.00 0.00 54.13 55.68 2kvu s LEU 15 Cb -0.67 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 41.96 2kvu s LEU 15 CO 0.39 -0.18 0.73 -0.89 0.23 0.00 0.00 176.35 176.62 2kvu s THR 16 N -0.21 4.81 0.00 5.49 2.01 -1.26 -4.78 115.64 121.70 2kvu s THR 16 Ca 0.49 0.85 0.00 0.00 0.31 0.00 0.00 61.69 63.34 2kvu s THR 16 Cb -0.28 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.09 2kvu s THR 16 CO 0.34 -0.33 0.00 0.61 -0.69 0.00 0.00 174.62 174.55 2kvu n GLY 17 N 4.49 0.58 2.56 4.40 0.00 -1.26 -5.11 105.19 110.86 2kvu n GLY 17 Ca 0.01 -0.63 -0.05 0.00 0.00 0.00 0.00 46.02 45.35 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 -4.79 -1.95 1.61 5.02 -1.26 -4.87 118.16 111.92 2kvu n LYS 18 Ca 0.00 3.57 -0.42 0.00 -2.02 0.00 0.00 58.31 59.44 2kvu n LYS 18 Cb 0.00 -5.08 -0.03 0.00 -0.02 0.00 0.00 35.03 29.91 2kvu n LYS 18 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2kvu s PRO 19 N -0.66 4.01 0.01 1.97 0.04 -1.26 -4.88 135.00 134.23 2kvu s PRO 19 Ca -0.25 2.12 -0.04 0.00 0.04 0.00 0.00 61.00 62.87 2kvu s PRO 19 Cb 0.02 -4.05 -0.28 0.00 0.04 0.00 0.00 34.50 30.22 2kvu s PRO 19 CO 0.68 -1.06 0.87 0.78 0.04 0.00 0.00 177.00 178.31 2kvu h GLY 20 N 10.99 0.31 -0.38 0.56 0.00 -2.02 -3.47 103.07 109.06 2kvu h GLY 20 Ca -0.40 -0.80 -0.18 0.00 0.00 0.00 0.00 47.33 45.96 2kvu h GLY 20 CO 0.96 0.70 0.13 0.00 0.00 0.00 0.00 176.54 178.33 2kvu n ALA 21 N -2.67 -0.95 -2.80 3.60 0.00 -1.26 -4.92 120.51 111.50 2kvu n ALA 21 Ca -0.16 -0.73 -0.32 0.00 0.00 0.00 0.00 53.44 52.22 2kvu n ALA 21 Cb 1.05 -0.04 -0.06 0.00 0.00 0.00 0.00 19.45 20.39 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 3.97 0.62 0.00 1.43 -1.26 -5.09 118.68 118.35 2kvu s LEU 22 Ca 0.32 0.15 -0.16 0.00 -1.03 0.00 0.00 54.13 53.40 2kvu s LEU 22 Cb -0.02 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.78 2kvu s LEU 22 CO 0.23 0.24 1.11 -2.16 0.23 0.00 0.00 176.35 176.00 2kvu s PRO 23 N -1.95 3.00 0.00 1.29 0.04 -1.26 -4.95 135.00 131.18 2kvu s PRO 23 Ca 0.26 1.42 0.26 0.00 0.04 0.00 0.00 61.00 62.97 2kvu s PRO 23 Cb -0.12 -1.97 1.29 0.00 0.04 0.00 0.00 34.50 33.74 2kvu s PRO 23 CO 0.17 -1.10 1.86 0.00 0.04 0.00 0.00 177.00 177.98 2kvu n ALA 24 N -2.10 2.61 -1.43 8.56 0.00 -1.26 -3.79 120.51 123.10 2kvu n ALA 24 Ca 0.10 -0.30 -0.27 0.00 0.00 0.00 0.00 53.44 52.98 2kvu n ALA 24 Cb 0.52 -1.30 0.11 0.00 0.00 0.00 0.00 19.45 18.78 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 -0.41 5.64 -0.35 0.00 5.03 -1.26 -4.72 115.26 119.19 2kvu n ASN 25 Ca 0.19 -3.74 0.01 0.00 0.87 0.00 0.00 54.58 51.91 2kvu n ASN 25 Cb 0.20 -0.81 0.15 0.00 -1.02 0.00 0.00 39.78 38.31 2kvu n ASN 25 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 2kvu h LEU 26 N 1.65 0.99 0.00 3.41 3.38 -1.95 -0.28 115.31 122.51 2kvu h LEU 26 Ca 0.53 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.51 2kvu h LEU 26 Cb 1.52 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2kvu h LEU 26 CO 1.19 0.64 -0.19 -0.78 0.09 0.00 0.00 178.44 179.39 2kvu h ASP 27 N 1.13 0.00 0.72 -0.43 3.58 -1.94 -2.95 116.42 116.53 2kvu h ASP 27 Ca 0.40 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.82 2kvu h ASP 27 Cb 0.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2kvu h ASP 27 CO -0.16 0.02 -0.21 0.47 -2.88 0.00 0.00 179.24 176.48 2kvu n ASP 28 N -2.57 0.25 -4.88 2.28 9.92 -0.23 -4.84 116.55 116.47 2kvu n ASP 28 Ca 0.04 0.07 -0.33 0.00 -0.53 0.00 0.00 54.79 54.04 2kvu n ASP 28 Cb 0.48 -0.15 -0.05 0.00 -0.64 0.00 0.00 41.12 40.75 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 -2.93 3.69 0.84 -1.24 -1.94 -0.51 -5.10 119.30 112.11 2kvu s MET 29 Ca 0.15 0.05 -0.11 0.00 -1.71 0.00 0.00 55.69 54.07 2kvu s MET 29 Cb 0.19 -2.94 0.13 0.00 2.01 0.00 0.00 34.83 34.22 2kvu s MET 29 CO 0.59 0.53 1.18 0.15 -0.01 0.00 0.00 175.02 177.46 2kvu s LYS 30 N -2.21 1.39 0.13 2.03 1.02 -1.26 -4.84 119.74 116.01 2kvu s LYS 30 Ca 0.36 -0.36 -0.17 0.00 0.02 0.00 0.00 55.97 55.82 2kvu s LYS 30 Cb -0.13 -2.00 -0.02 0.00 -0.52 0.00 0.00 37.83 35.16 2kvu s LYS 30 CO 0.20 -1.86 1.74 0.28 -0.92 0.00 0.00 175.35 174.79 2kvu h VAL 31 N -1.15 1.13 -0.83 3.17 2.07 -1.97 0.33 116.25 119.01 2kvu h VAL 31 Ca -0.44 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 2kvu h VAL 31 Cb 1.28 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 2kvu h VAL 31 CO 0.49 0.14 0.43 0.00 0.02 0.00 0.00 177.57 178.65 2kvu h ALA 32 N 1.06 1.06 -0.50 1.67 0.00 -1.99 -1.25 119.26 119.31 2kvu h ALA 32 Ca 0.12 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2kvu h ALA 32 Cb 0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2kvu h ALA 32 CO -0.02 0.60 0.18 0.93 0.00 0.00 0.00 179.25 180.94 2kvu h GLU 33 N 1.16 0.76 -0.59 0.00 4.39 -1.80 -2.84 114.58 115.66 2kvu h GLU 33 Ca 0.29 -0.15 -0.08 0.00 0.34 0.00 0.00 59.36 59.76 2kvu h GLU 33 Cb 0.07 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2kvu h GLU 33 CO -0.04 0.69 0.03 -0.07 -1.16 0.00 0.00 179.01 178.46 2kvu h LEU 34 N 0.67 0.97 -1.68 1.33 3.38 -0.62 -2.68 115.31 116.68 2kvu h LEU 34 Ca 0.16 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2kvu h LEU 34 Cb 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2kvu h LEU 34 CO -0.01 1.00 0.17 0.11 0.09 0.00 0.00 178.44 179.81 2kvu h LYS 35 N 0.93 0.39 -0.06 1.13 1.57 -1.07 0.54 116.57 120.00 2kvu h LYS 35 Ca 0.18 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2kvu h LYS 35 Cb 0.49 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 2kvu h LYS 35 CO 0.02 0.27 0.02 1.96 -0.57 0.00 0.00 179.45 181.15 2kvu h GLN 36 N 0.40 0.08 -0.31 3.15 1.08 -1.24 -2.13 115.11 116.13 2kvu h GLN 36 Ca 0.11 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.24 2kvu h GLN 36 Cb -0.01 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 2kvu h GLN 36 CO -0.02 0.23 -0.01 0.93 -0.95 0.00 0.00 178.83 179.00 2kvu h GLU 37 N -0.08 0.48 0.75 1.46 4.39 -1.20 -2.41 114.58 117.98 2kvu h GLU 37 Ca 0.02 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 2kvu h GLU 37 Cb 0.18 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2kvu h GLU 37 CO -0.00 0.52 -0.36 -0.07 -1.16 0.00 0.00 179.01 177.94 2kvu h LEU 38 N 0.47 -0.85 -1.55 1.33 3.38 -0.75 -3.06 115.31 114.27 2kvu h LEU 38 Ca 0.10 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 2kvu h LEU 38 Cb 0.33 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2kvu h LEU 38 CO 0.01 -0.53 -0.22 0.07 0.09 0.00 0.00 178.44 177.86 2kvu h LYS 39 N -1.16 0.00 0.00 1.13 2.10 -1.35 0.16 116.57 117.45 2kvu h LYS 39 Ca -0.10 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.52 2kvu h LYS 39 Cb 0.77 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.10 2kvu h LYS 39 CO 0.17 0.22 -0.12 -0.07 -2.00 0.00 0.00 179.45 177.65 2kvu h LEU 40 N 0.00 0.00 -3.01 7.07 3.38 -1.49 -1.91 115.31 119.35 2kvu h LEU 40 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2kvu h LEU 40 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2kvu h LEU 40 CO 0.03 0.12 0.00 0.54 0.09 0.00 0.00 178.44 179.22 2kvu n ARG 41 N -3.34 3.15 -2.96 1.13 1.74 -0.11 -4.98 116.66 111.28 2kvu n ARG 41 Ca -0.00 -2.55 -0.03 0.00 -0.77 0.00 0.00 57.85 54.50 2kvu n ARG 41 Cb 0.33 -1.61 0.01 0.00 -1.02 0.00 0.00 32.46 30.17 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 0.70 -7.08 -4.00 0.55 7.64 -0.72 -5.06 113.62 105.65 2kvu n SER 42 Ca 0.20 -0.18 -0.14 0.00 1.01 0.00 0.00 58.87 59.76 2kvu n SER 42 Cb 0.68 -4.91 -0.13 0.00 -1.01 0.00 0.00 64.21 58.85 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 -4.10 2.15 0.44 -3.43 1.43 -0.28 -4.95 118.68 109.93 2kvu s LEU 43 Ca 0.09 -0.34 -0.26 0.00 -1.03 0.00 0.00 54.13 52.59 2kvu s LEU 43 Cb -0.01 -0.17 -0.09 0.00 0.03 0.00 0.00 46.19 45.95 2kvu s LEU 43 CO 0.68 -0.10 1.44 -2.84 0.23 0.00 0.00 176.35 175.77 2kvu s PRO 44 N -0.92 3.77 0.00 1.29 0.02 -1.26 -3.66 135.00 134.24 2kvu s PRO 44 Ca -0.05 2.46 0.15 0.00 0.02 0.00 0.00 61.00 63.58 2kvu s PRO 44 Cb -0.06 -2.72 0.15 0.00 0.02 0.00 0.00 34.50 31.89 2kvu s PRO 44 CO 0.00 -0.76 1.02 1.33 -0.33 0.00 0.00 177.00 178.25 2kvu n VAL 45 N -0.06 0.12 -1.50 3.83 0.24 -1.26 -4.87 118.33 114.83 2kvu n VAL 45 Ca 0.04 -0.56 -0.31 0.00 -2.04 0.00 0.00 64.34 61.47 2kvu n VAL 45 Cb 0.41 1.21 0.06 0.00 -1.47 0.00 0.00 33.84 34.05 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 -1.21 5.14 0.00 -1.34 0.01 -1.26 -4.92 113.70 110.11 2kvu s SER 46 Ca 0.19 1.69 0.00 0.00 1.31 0.00 0.00 55.95 59.14 2kvu s SER 46 Cb 0.13 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.85 2kvu s SER 46 CO 0.19 -1.61 0.00 0.61 0.41 0.00 0.00 173.24 172.84 2kvu n GLY 47 N -1.71 -1.80 3.31 3.44 0.00 -1.26 -4.74 105.19 102.42 2kvu n GLY 47 Ca 0.08 -2.16 -0.18 0.00 0.00 0.00 0.00 46.02 43.76 2kvu n GLY 47 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kvu n THR 48 N -0.13 0.00 0.03 2.61 -2.24 -1.26 -4.92 114.28 108.37 2kvu n THR 48 Ca 0.00 -1.50 -0.11 0.00 -2.27 0.00 0.00 64.05 60.17 2kvu n THR 48 Cb 0.00 -0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 67.43 2kvu n THR 48 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2kvu h LYS 49 N 0.00 -0.37 -0.50 -0.78 3.64 -1.96 -2.01 116.57 114.59 2kvu h LYS 49 Ca -0.25 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.11 2kvu h LYS 49 Cb 1.05 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 2kvu h LYS 49 CO 0.32 -0.24 0.15 1.15 -2.27 0.00 0.00 179.45 178.55 2kvu h THR 50 N -0.38 1.20 -0.82 1.00 2.02 -1.99 -1.40 112.91 112.54 2kvu h THR 50 Ca 0.08 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.60 2kvu h THR 50 Cb 0.50 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.53 2kvu h THR 50 CO -0.28 0.26 0.53 -0.33 0.37 0.00 0.00 175.52 176.07 2kvu h GLU 51 N 0.72 1.02 -0.47 6.66 4.39 -1.82 -0.32 114.58 124.76 2kvu h GLU 51 Ca 0.17 -0.06 -0.11 0.00 0.34 0.00 0.00 59.36 59.69 2kvu h GLU 51 Cb 0.22 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2kvu h GLU 51 CO -0.01 0.68 -0.14 -0.07 -1.16 0.00 0.00 179.01 178.31 2kvu h LEU 52 N 1.05 0.93 0.12 1.33 3.38 -0.60 -0.55 115.31 120.97 2kvu h LEU 52 Ca 0.32 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2kvu h LEU 52 Cb -0.04 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2kvu h LEU 52 CO -0.10 1.09 -0.08 0.40 0.09 0.00 0.00 178.44 179.84 2kvu h ILE 53 N 0.76 0.81 -0.48 1.22 2.04 -0.77 0.17 117.51 121.28 2kvu h ILE 53 Ca 0.11 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.92 2kvu h ILE 53 Cb 0.70 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 2kvu h ILE 53 CO 0.05 0.00 0.07 -0.33 0.00 0.00 0.00 178.15 177.94 2kvu h GLU 54 N -0.21 0.74 -0.57 2.37 5.08 -1.00 -1.34 114.58 119.65 2kvu h GLU 54 Ca -0.01 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.12 2kvu h GLU 54 Cb 0.18 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2kvu h GLU 54 CO -0.00 0.71 0.09 -0.09 -1.00 0.00 0.00 179.01 178.71 2kvu h ARG 55 N 0.71 0.95 -0.64 2.33 2.43 -0.81 -0.96 114.38 118.40 2kvu h ARG 55 Ca 0.15 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 2kvu h ARG 55 Cb 0.33 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 2kvu h ARG 55 CO 0.01 0.91 0.35 -0.07 -1.51 0.00 0.00 179.97 179.66 2kvu h LEU 56 N 0.85 0.81 -0.84 3.80 3.38 -0.50 -2.23 115.31 120.58 2kvu h LEU 56 Ca 0.17 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2kvu h LEU 56 Cb 0.43 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2kvu h LEU 56 CO 0.01 0.67 0.50 0.03 0.09 0.00 0.00 178.44 179.74 2kvu h ARG 57 N 0.88 1.15 -0.19 1.13 3.08 -0.87 -0.21 114.38 119.35 2kvu h ARG 57 Ca 0.23 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 2kvu h ARG 57 Cb 0.05 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 2kvu h ARG 57 CO -0.04 0.82 -0.08 0.00 -1.07 0.00 0.00 179.97 179.60 2kvu h ALA 58 N 1.27 1.52 0.02 0.04 0.00 -0.88 -1.03 119.26 120.21 2kvu h ALA 58 Ca 0.30 -0.18 -0.26 0.00 0.00 0.00 0.00 54.91 54.77 2kvu h ALA 58 Cb -0.03 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.69 2kvu h ALA 58 CO -0.05 0.34 -1.03 -0.92 0.00 0.00 0.00 179.25 177.59 2kvu h TYR 59 N 0.28 1.00 -0.66 0.00 3.20 -0.74 -3.11 116.97 116.93 2kvu h TYR 59 Ca 0.06 -0.56 -0.08 0.00 3.14 0.00 0.00 58.73 61.30 2kvu h TYR 59 Cb 0.32 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2kvu h TYR 59 CO 0.01 1.39 0.11 0.37 -1.64 0.00 0.00 178.16 178.40 2kvu h GLN 60 N 0.32 1.08 -0.76 1.82 -0.00 -0.72 -2.54 115.11 114.30 2kvu h GLN 60 Ca -0.13 -0.28 0.02 0.00 -0.00 0.00 0.00 58.65 58.25 2kvu h GLN 60 Cb 1.69 -0.13 -0.04 0.00 0.00 0.00 0.00 27.48 29.00 2kvu h GLN 60 CO 0.20 0.99 0.49 0.22 0.00 0.00 0.00 178.83 180.73 2kvu h ASP 61 N 1.01 0.84 0.24 -0.69 1.82 -1.26 -1.63 116.42 116.75 2kvu h ASP 61 Ca 0.20 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.83 2kvu h ASP 61 Cb 0.43 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.24 2kvu h ASP 61 CO 0.01 0.60 -0.01 0.00 -1.61 0.00 0.00 179.24 178.23 2kvu n GLN 62 N -4.58 0.78 0.19 0.28 10.64 -1.05 -2.26 117.38 121.39 2kvu n GLN 62 Ca 0.08 -0.04 0.08 0.00 -1.83 0.00 0.00 57.00 55.28 2kvu n GLN 62 Cb 0.05 -1.50 0.22 0.00 -0.86 0.00 0.00 30.24 28.15 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 0.10 0.53 -3.89 -0.39 1.08 -0.88 -3.49 117.51 110.57 2kvu h ILE 63 Ca 0.00 -1.52 0.00 0.00 -0.39 0.00 0.00 64.86 62.95 2kvu h ILE 63 Cb 0.15 2.08 -0.00 0.00 -3.07 0.00 0.00 36.82 35.97 2kvu h ILE 63 CO 0.00 0.27 -0.43 -1.20 -0.69 0.00 0.00 178.15 176.10 2kvu n SER 64 N -3.24 -4.37 -4.66 1.72 7.64 -0.96 -4.95 113.62 104.80 2kvu n SER 64 Ca 0.02 0.60 -0.42 0.00 1.01 0.00 0.00 58.87 60.08 2kvu n SER 64 Cb 0.57 -2.83 -0.03 0.00 -1.01 0.00 0.00 64.21 60.92 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 -0.69 4.20 0.42 1.43 0.02 -1.26 -4.98 135.00 134.13 2kvu s PRO 65 Ca -0.01 2.06 -0.26 0.00 0.02 0.00 0.00 61.00 62.82 2kvu s PRO 65 Cb 0.00 -3.88 -0.08 0.00 0.02 0.00 0.00 34.50 30.55 2kvu s PRO 65 CO 0.33 -0.79 1.32 0.14 -0.33 0.00 0.00 177.00 177.67 2kvu s VAL 66 N 3.71 2.55 0.00 3.83 -7.23 -1.26 -5.00 120.40 116.99 2kvu s VAL 66 Ca 0.68 0.49 0.00 0.00 -1.81 0.00 0.00 61.98 61.34 2kvu s VAL 66 Cb -0.31 -3.28 0.00 0.00 0.56 0.00 0.00 36.38 33.35 2kvu s VAL 66 CO 0.26 0.07 0.27 -2.65 -0.31 0.00 0.00 175.10 172.74 2kvu n PRO 67 N 0.04 0.00 -2.70 4.82 -0.02 -1.26 -4.62 135.00 131.26 2kvu n PRO 67 Ca 0.04 0.08 -0.26 0.00 -2.02 0.00 0.00 63.50 61.34 2kvu n PRO 67 Cb 0.43 -0.81 -0.02 0.00 -0.02 0.00 0.00 33.50 33.09 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 1.02 5.53 3.10 -1.23 0.00 -1.26 -4.98 105.19 107.36 2kvu n GLY 68 Ca 0.00 -2.66 -0.34 0.00 0.00 0.00 0.00 46.02 43.02 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 -3.45 3.03 -0.32 4.61 0.00 -1.26 -5.07 121.76 119.29 2kvu s ALA 69 Ca 0.47 -2.43 -0.29 0.00 0.00 0.00 0.00 51.96 49.71 2kvu s ALA 69 Cb 0.35 -2.21 -0.01 0.00 0.00 0.00 0.00 23.12 21.26 2kvu s ALA 69 CO -0.15 -1.69 1.50 -1.25 0.00 0.00 0.00 175.76 174.16 2kvu s PRO 70 N 1.08 3.68 -0.07 0.00 0.04 -1.26 -4.84 135.00 133.63 2kvu s PRO 70 Ca 0.07 1.28 0.13 0.00 0.04 0.00 0.00 61.00 62.52 2kvu s PRO 70 Cb -0.21 -4.02 0.40 0.00 0.04 0.00 0.00 34.50 30.71 2kvu s PRO 70 CO -0.05 -1.43 1.33 1.63 0.04 0.00 0.00 177.00 178.52 2kvu n LYS 71 N 7.84 2.93 -3.79 4.56 4.76 -1.26 -4.96 118.16 128.25 2kvu n LYS 71 Ca 0.18 -2.36 -0.13 0.00 -2.87 0.00 0.00 58.31 53.13 2kvu n LYS 71 Cb 0.47 -1.49 -0.11 0.00 -1.84 0.00 0.00 35.03 32.06 2kvu n LYS 71 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kvu s ALA 72 N -1.65 -0.65 -0.81 7.82 0.00 -1.26 -5.10 121.76 120.12 2kvu s ALA 72 Ca 0.31 0.54 -0.25 0.00 0.00 0.00 0.00 51.96 52.55 2kvu s ALA 72 Cb 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 2kvu s ALA 72 CO 0.14 -0.17 1.76 -2.14 0.00 0.00 0.00 175.76 175.35 2kvu s PRO 73 N -0.41 2.81 0.39 0.00 0.02 -1.26 -4.87 135.00 131.68 2kvu s PRO 73 Ca -0.05 -0.12 -0.15 0.00 0.02 0.00 0.00 61.00 60.70 2kvu s PRO 73 Cb -0.03 -4.78 0.05 0.00 0.02 0.00 0.00 34.50 29.76 2kvu s PRO 73 CO 0.01 -2.84 0.78 0.00 -0.33 0.00 0.00 177.00 174.62 2kvu s ALA 74 N 8.46 -0.64 -2.88 -1.55 0.00 -1.26 -5.28 121.76 118.61 2kvu s ALA 74 Ca 0.61 -0.81 0.23 0.00 0.00 0.00 0.00 51.96 51.99 2kvu s ALA 74 Cb -0.08 0.69 0.18 0.00 0.00 0.00 0.00 23.12 23.92 2kvu s ALA 74 CO 0.07 -0.97 1.23 0.00 0.00 0.00 0.00 175.76 176.08