#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vd0 s SER 2 N 0.00 -0.18 0.40 3.42 1.04 -1.26 -5.16 113.70 111.96 1vd0 s SER 2 Ca 0.00 -0.39 -0.21 0.00 0.48 0.00 0.00 55.95 55.83 1vd0 s SER 2 Cb 0.00 0.48 -0.11 0.00 0.10 0.00 0.00 66.02 66.50 1vd0 s SER 2 CO 0.00 -0.89 0.91 -1.59 0.98 0.00 0.00 173.24 172.66 1vd0 s LYS 3 N -3.27 4.23 -0.99 4.02 -2.85 -1.26 -5.00 119.74 114.62 1vd0 s LYS 3 Ca 0.12 1.07 -0.16 0.00 -1.00 0.00 0.00 55.97 56.00 1vd0 s LYS 3 Cb -0.01 -2.29 0.16 0.00 -2.06 0.00 0.00 37.83 33.63 1vd0 s LYS 3 CO 0.02 0.03 1.15 -1.21 0.10 0.00 0.00 175.35 175.44 1vd0 s GLU 4 N -3.03 3.75 -0.38 1.78 0.41 -1.26 -4.81 118.70 115.16 1vd0 s GLU 4 Ca 0.59 -2.14 0.05 0.00 -0.41 0.00 0.00 54.97 53.07 1vd0 s GLU 4 Cb -0.10 -4.86 0.48 0.00 -1.78 0.00 0.00 34.13 27.86 1vd0 s GLU 4 CO 0.15 -1.67 1.49 0.25 -0.49 0.00 0.00 175.26 174.98 1vd0 n THR 5 N 4.92 2.80 -3.64 3.63 -2.24 -1.26 -4.97 114.28 113.52 1vd0 n THR 5 Ca 0.26 -3.41 -0.06 0.00 -2.27 0.00 0.00 64.05 58.56 1vd0 n THR 5 Cb 0.47 -0.86 -0.07 0.00 -2.10 0.00 0.00 70.33 67.77 1vd0 n THR 5 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1vd0 s PHE 6 N -3.54 -0.39 -0.29 4.78 5.36 -1.26 -5.16 117.98 117.48 1vd0 s PHE 6 Ca 0.52 0.91 -0.10 0.00 -0.96 0.00 0.00 56.93 57.30 1vd0 s PHE 6 Cb 0.43 0.37 0.13 0.00 -0.34 0.00 0.00 43.02 43.61 1vd0 s PHE 6 CO 0.01 -0.19 0.63 -0.08 -1.46 0.00 0.00 175.22 174.14 1vd0 s THR 7 N 0.42 -0.94 0.08 0.12 -1.32 -1.26 -5.17 115.64 107.58 1vd0 s THR 7 Ca 0.01 0.01 -0.27 0.00 -1.21 0.00 0.00 61.69 60.24 1vd0 s THR 7 Cb -0.05 -0.97 0.08 0.00 -1.51 0.00 0.00 72.50 70.05 1vd0 s THR 7 CO -0.10 0.01 0.98 -1.00 -2.21 0.00 0.00 174.62 172.30 1vd0 s HIS 8 N 2.83 -0.18 0.06 9.09 3.76 -1.26 -5.18 115.29 124.41 1vd0 s HIS 8 Ca -0.06 -0.05 0.02 0.00 -0.15 0.00 0.00 55.06 54.82 1vd0 s HIS 8 Cb -0.12 0.60 -0.03 0.00 1.11 0.00 0.00 32.58 34.14 1vd0 s HIS 8 CO -0.19 -0.68 -0.07 1.52 -0.85 0.00 0.00 174.74 174.48 1vd0 s TYR 9 N -3.13 0.71 -0.03 1.40 -0.85 -1.26 -5.08 117.35 109.11 1vd0 s TYR 9 Ca 0.10 -0.65 -0.18 0.00 -0.52 0.00 0.00 57.07 55.83 1vd0 s TYR 9 Cb -0.01 -0.43 -0.11 0.00 0.38 0.00 0.00 41.96 41.80 1vd0 s TYR 9 CO -0.02 -0.12 0.75 0.37 -1.52 0.00 0.00 175.55 175.02 1vd0 h GLN 10 N 3.99 -0.48 -7.28 -3.49 4.15 -2.00 -3.41 115.11 106.59 1vd0 h GLN 10 Ca -0.35 0.03 -0.51 0.00 0.77 0.00 0.00 58.65 58.59 1vd0 h GLN 10 Cb 1.19 0.11 0.12 0.00 0.21 0.00 0.00 27.48 29.11 1vd0 h GLN 10 CO 0.49 -0.24 0.33 -1.25 -1.93 0.00 0.00 178.83 176.24 1vd0 s PRO 11 N -3.53 2.39 -1.14 -2.39 0.04 -1.26 -3.28 135.00 125.83 1vd0 s PRO 11 Ca -0.10 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.17 1vd0 s PRO 11 Cb 0.01 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1vd0 s PRO 11 CO 0.32 -1.55 0.00 0.94 0.04 0.00 0.00 177.00 176.75 1vd0 n GLN 12 N -3.23 -1.91 -3.88 4.56 7.27 -1.26 -4.92 117.38 114.00 1vd0 n GLN 12 Ca 0.09 0.64 -0.26 0.00 0.07 0.00 0.00 57.00 57.54 1vd0 n GLN 12 Cb 0.53 -5.12 -0.01 0.00 2.41 0.00 0.00 30.24 28.05 1vd0 n GLN 12 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1vd0 n GLY 13 N -0.62 2.83 3.84 1.69 0.00 -1.21 -5.06 105.19 106.67 1vd0 n GLY 13 Ca -0.14 -2.31 -0.22 0.00 0.00 0.00 0.00 46.02 43.36 1vd0 n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vd0 s ASN 14 N -4.14 4.89 0.74 1.61 4.22 -1.26 -5.12 114.94 115.89 1vd0 s ASN 14 Ca 0.28 -0.82 -0.11 0.00 -2.14 0.00 0.00 52.86 50.07 1vd0 s ASN 14 Cb -0.02 -0.56 0.05 0.00 1.28 0.00 0.00 41.25 42.00 1vd0 s ASN 14 CO 0.17 -0.61 1.11 -0.94 -2.04 0.00 0.00 177.10 174.79 1vd0 s SER 15 N -4.07 4.95 -0.21 3.54 1.04 -1.26 -5.02 113.70 112.67 1vd0 s SER 15 Ca 0.46 0.86 -0.25 0.00 0.48 0.00 0.00 55.95 57.50 1vd0 s SER 15 Cb -0.01 -1.51 -0.01 0.00 0.10 0.00 0.00 66.02 64.59 1vd0 s SER 15 CO 0.26 -1.61 0.84 -1.81 0.98 0.00 0.00 173.24 171.90 1vd0 s ASP 16 N -4.48 6.90 0.00 7.02 1.01 -1.26 -4.92 116.67 120.95 1vd0 s ASP 16 Ca 0.60 1.12 0.15 0.00 0.71 0.00 0.00 52.55 55.13 1vd0 s ASP 16 Cb -0.11 -2.45 0.77 0.00 1.01 0.00 0.00 42.92 42.14 1vd0 s ASP 16 CO 0.49 -0.47 1.40 -0.81 0.21 0.00 0.00 175.17 175.99 1vd0 n PRO 17 N 5.66 0.25 -3.28 8.23 -0.04 -1.26 -4.67 135.00 139.89 1vd0 n PRO 17 Ca 0.05 0.12 -0.39 0.00 -0.04 0.00 0.00 63.50 63.25 1vd0 n PRO 17 Cb 0.48 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.37 1vd0 n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vd0 s ALA 18 N -2.49 3.53 -0.69 0.55 0.00 -1.26 -4.99 121.76 116.42 1vd0 s ALA 18 Ca 0.15 -0.36 0.02 0.00 0.00 0.00 0.00 51.96 51.77 1vd0 s ALA 18 Cb 0.10 -2.75 0.37 0.00 0.00 0.00 0.00 23.12 20.84 1vd0 s ALA 18 CO 0.22 -0.32 1.48 0.72 0.00 0.00 0.00 175.76 177.86 1vd0 n HIS 19 N 4.48 3.30 -4.60 0.00 8.25 -1.26 -5.01 115.22 120.38 1vd0 n HIS 19 Ca -0.06 -2.95 -0.28 0.00 -0.26 0.00 0.00 57.72 54.17 1vd0 n HIS 19 Cb 0.51 -0.68 -0.11 0.00 1.12 0.00 0.00 29.99 30.83 1vd0 n HIS 19 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1vd0 s THR 20 N -5.00 1.98 -0.09 1.59 -4.23 -1.26 -4.14 115.64 104.50 1vd0 s THR 20 Ca 0.48 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 59.02 1vd0 s THR 20 Cb 0.35 -2.97 -0.02 0.00 1.34 0.00 0.00 72.50 71.21 1vd0 s THR 20 CO -0.24 0.00 -0.14 0.00 -0.54 0.00 0.00 174.62 173.70 1vd0 s ALA 21 N -2.71 2.62 -0.39 3.99 0.00 0.26 -4.92 121.76 120.61 1vd0 s ALA 21 Ca 0.34 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 51.31 1vd0 s ALA 21 Cb 0.09 -1.07 0.08 0.00 0.00 0.00 0.00 23.12 22.23 1vd0 s ALA 21 CO 0.18 0.40 0.18 0.95 0.00 0.00 0.00 175.76 177.47 1vd0 s THR 22 N -0.19 3.57 0.45 0.00 -4.23 -1.26 -2.08 115.64 111.91 1vd0 s THR 22 Ca -0.00 -1.66 -0.11 0.00 -1.18 0.00 0.00 61.69 58.74 1vd0 s THR 22 Cb -0.13 -3.26 -0.06 0.00 1.34 0.00 0.00 72.50 70.39 1vd0 s THR 22 CO 0.03 -0.49 0.83 0.00 -0.54 0.00 0.00 174.62 174.45 1vd0 s ALA 23 N 1.27 3.29 -2.00 3.99 0.00 -0.53 -4.87 121.76 122.91 1vd0 s ALA 23 Ca 0.03 -0.16 0.11 0.00 0.00 0.00 0.00 51.96 51.94 1vd0 s ALA 23 Cb -0.22 -2.79 0.64 0.00 0.00 0.00 0.00 23.12 20.75 1vd0 s ALA 23 CO -0.01 -0.15 1.08 -0.35 0.00 0.00 0.00 175.76 176.33 1vd0 n PRO 24 N -1.58 0.49 -2.27 0.00 -0.04 -1.26 -1.15 135.00 129.19 1vd0 n PRO 24 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1vd0 n PRO 24 Cb 0.54 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 1vd0 n PRO 24 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vd0 n GLY 25 N -0.01 -5.58 0.60 0.55 0.00 -1.25 -4.15 105.19 95.35 1vd0 n GLY 25 Ca 0.08 -0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.09 1vd0 n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vd0 n GLY 26 N 1.91 0.59 3.73 -0.02 0.00 -1.20 -4.77 105.19 105.42 1vd0 n GLY 26 Ca 0.00 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 1vd0 n GLY 26 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vd0 s LEU 27 N -0.03 3.34 0.00 0.99 1.43 -1.26 -4.84 118.68 118.32 1vd0 s LEU 27 Ca 0.04 2.34 0.09 0.00 -1.03 0.00 0.00 54.13 55.57 1vd0 s LEU 27 Cb 0.04 -4.59 0.02 0.00 0.03 0.00 0.00 46.19 41.70 1vd0 s LEU 27 CO -0.02 -2.18 0.67 -0.24 0.23 0.00 0.00 176.35 174.81 1vd0 n SER 28 N -2.62 1.37 -2.92 2.29 2.88 -1.26 -3.89 113.62 109.47 1vd0 n SER 28 Ca 0.13 -1.19 -0.12 0.00 -1.33 0.00 0.00 58.87 56.37 1vd0 n SER 28 Cb 0.50 0.30 0.00 0.00 -0.75 0.00 0.00 64.21 64.27 1vd0 n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vd0 s ALA 29 N -1.10 -0.07 0.19 -1.46 0.00 -1.26 -4.75 121.76 113.30 1vd0 s ALA 29 Ca 0.09 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 1vd0 s ALA 29 Cb 0.07 0.85 -0.08 0.00 0.00 0.00 0.00 23.12 23.96 1vd0 s ALA 29 CO 0.19 -0.91 1.29 0.15 0.00 0.00 0.00 175.76 176.48 1vd0 s LYS 30 N -2.40 4.41 -0.10 0.00 1.02 -1.26 -2.50 119.74 118.90 1vd0 s LYS 30 Ca 0.22 2.01 -0.02 0.00 0.02 0.00 0.00 55.97 58.20 1vd0 s LYS 30 Cb -0.03 -3.21 0.04 0.00 -0.52 0.00 0.00 37.83 34.10 1vd0 s LYS 30 CO 0.16 -0.23 0.02 0.00 -0.92 0.00 0.00 175.35 174.38 1vd0 s ALA 31 N 0.14 0.72 0.57 5.17 0.00 0.56 -4.98 121.76 123.94 1vd0 s ALA 31 Ca 0.56 -0.23 -0.18 0.00 0.00 0.00 0.00 51.96 52.11 1vd0 s ALA 31 Cb -0.36 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.88 1vd0 s ALA 31 CO 0.37 -0.64 1.12 -1.25 0.00 0.00 0.00 175.76 175.37 1vd0 s PRO 32 N 1.97 3.22 1.04 0.00 0.04 -1.26 -1.00 135.00 139.00 1vd0 s PRO 32 Ca 0.04 1.56 -0.17 0.00 0.04 0.00 0.00 61.00 62.46 1vd0 s PRO 32 Cb -0.13 -1.99 0.25 0.00 0.04 0.00 0.00 34.50 32.67 1vd0 s PRO 32 CO -0.06 -0.94 1.03 0.00 0.04 0.00 0.00 177.00 177.07 1vd0 n ALA 33 N -1.58 -2.60 -3.47 8.56 0.00 -1.26 -4.42 120.51 115.74 1vd0 n ALA 33 Ca 0.11 -1.48 -0.18 0.00 0.00 0.00 0.00 53.44 51.89 1vd0 n ALA 33 Cb 0.51 -0.09 0.07 0.00 0.00 0.00 0.00 19.45 19.94 1vd0 n ALA 33 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1vd0 n MET 34 N -4.22 -5.45 -3.59 0.00 2.81 -0.14 -4.73 117.12 101.81 1vd0 n MET 34 Ca 0.14 0.79 -0.16 0.00 -1.81 0.00 0.00 57.70 56.66 1vd0 n MET 34 Cb 0.52 -5.66 -0.07 0.00 -0.71 0.00 0.00 33.22 27.30 1vd0 n MET 34 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1vd0 s THR 35 N -3.44 0.01 0.42 2.03 -4.23 -1.25 -0.31 115.64 108.87 1vd0 s THR 35 Ca 0.08 -0.09 -0.25 0.00 -1.18 0.00 0.00 61.69 60.25 1vd0 s THR 35 Cb -0.01 -0.90 -0.08 0.00 1.34 0.00 0.00 72.50 72.84 1vd0 s THR 35 CO 0.75 -0.05 1.18 -2.16 -0.54 0.00 0.00 174.62 173.80 1vd0 s PRO 36 N -0.93 3.96 0.44 3.99 0.04 -1.26 -0.66 135.00 140.59 1vd0 s PRO 36 Ca -0.09 1.85 0.04 0.00 0.04 0.00 0.00 61.00 62.84 1vd0 s PRO 36 Cb -0.02 -2.61 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 1vd0 s PRO 36 CO 0.07 -0.40 0.02 -0.51 0.04 0.00 0.00 177.00 176.22 1vd0 s LEU 37 N -2.63 2.53 0.06 -3.56 1.43 0.12 -2.93 118.68 113.70 1vd0 s LEU 37 Ca 0.59 -1.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.23 1vd0 s LEU 37 Cb -0.31 -0.73 -0.03 0.00 0.03 0.00 0.00 46.19 45.15 1vd0 s LEU 37 CO 0.38 -0.65 -0.12 0.00 0.23 0.00 0.00 176.35 176.20 1vd0 s MET 38 N -3.79 0.71 0.48 1.70 0.23 0.71 -0.83 119.30 118.52 1vd0 s MET 38 Ca 0.23 -0.89 -0.04 0.00 -1.03 0.00 0.00 55.69 53.96 1vd0 s MET 38 Cb 0.06 -0.62 -0.03 0.00 -1.53 0.00 0.00 34.83 32.71 1vd0 s MET 38 CO 0.12 0.13 0.77 -0.51 -2.03 0.00 0.00 175.02 173.50 1vd0 s LEU 39 N -1.71 3.62 1.03 0.18 1.43 -1.26 -1.25 118.68 120.72 1vd0 s LEU 39 Ca -0.05 0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 1vd0 s LEU 39 Cb -0.10 -3.76 0.23 0.00 0.03 0.00 0.00 46.19 42.59 1vd0 s LEU 39 CO 0.02 -0.61 1.27 -0.62 0.23 0.00 0.00 176.35 176.64 1vd0 s ASP 40 N -4.13 2.47 0.00 2.29 2.15 -0.32 -4.80 116.67 114.34 1vd0 s ASP 40 Ca 0.47 0.34 0.00 0.00 0.43 0.00 0.00 52.55 53.79 1vd0 s ASP 40 Cb -0.10 -0.41 0.00 0.00 -0.30 0.00 0.00 42.92 42.11 1vd0 s ASP 40 CO 0.44 -3.14 0.54 0.41 -0.17 0.00 0.00 175.17 173.25 1vd0 n THR 41 N -4.05 0.00 -0.60 1.71 -1.04 -1.26 0.07 114.28 109.11 1vd0 n THR 41 Ca 0.15 0.89 -0.12 0.00 -2.04 0.00 0.00 64.05 62.93 1vd0 n THR 41 Cb 0.59 -1.23 0.18 0.00 -1.82 0.00 0.00 70.33 68.05 1vd0 n THR 41 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1vd0 n SER 42 N -1.86 3.84 -3.53 8.00 7.64 -1.26 -4.88 113.62 121.58 1vd0 n SER 42 Ca 0.00 -3.06 -0.19 0.00 1.01 0.00 0.00 58.87 56.62 1vd0 n SER 42 Cb 0.00 -0.72 0.07 0.00 -1.01 0.00 0.00 64.21 62.55 1vd0 n SER 42 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1vd0 n SER 43 N -0.40 -2.37 -0.07 6.43 7.64 0.11 -4.93 113.62 120.04 1vd0 n SER 43 Ca 0.38 -0.66 -0.18 0.00 1.01 0.00 0.00 58.87 59.42 1vd0 n SER 43 Cb 1.27 -4.83 -0.13 0.00 -1.01 0.00 0.00 64.21 59.50 1vd0 n SER 43 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1vd0 n ARG 44 N -4.27 0.69 -4.63 1.43 1.85 -1.26 -4.79 116.66 105.68 1vd0 n ARG 44 Ca -0.25 0.19 -0.24 0.00 -1.00 0.00 0.00 57.85 56.54 1vd0 n ARG 44 Cb 0.66 -1.61 -0.16 0.00 -1.05 0.00 0.00 32.46 30.30 1vd0 n ARG 44 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1vd0 s LYS 45 N -2.54 1.54 -0.30 2.89 1.02 -1.26 -4.62 119.74 116.47 1vd0 s LYS 45 Ca -0.26 -0.46 -0.19 0.00 0.02 0.00 0.00 55.97 55.09 1vd0 s LYS 45 Cb 0.08 -1.33 -0.02 0.00 -0.52 0.00 0.00 37.83 36.04 1vd0 s LYS 45 CO 0.70 0.13 0.55 -1.17 -0.92 0.00 0.00 175.35 174.64 1vd0 s LEU 46 N 0.30 4.15 0.16 3.17 2.96 -1.26 -1.17 118.68 126.99 1vd0 s LEU 46 Ca -0.08 0.34 0.08 0.00 -0.22 0.00 0.00 54.13 54.26 1vd0 s LEU 46 Cb -0.12 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 43.84 1vd0 s LEU 46 CO 0.02 -0.40 -0.18 0.68 -1.32 0.00 0.00 176.35 175.15 1vd0 s VAL 47 N 2.43 1.79 0.69 1.68 -7.23 -0.38 -3.24 120.40 116.13 1vd0 s VAL 47 Ca 0.22 -1.89 -0.17 0.00 -1.81 0.00 0.00 61.98 58.33 1vd0 s VAL 47 Cb -0.15 -1.81 -0.04 0.00 0.56 0.00 0.00 36.38 34.93 1vd0 s VAL 47 CO 0.11 -0.31 0.61 0.00 -0.31 0.00 0.00 175.10 175.21 1vd0 n ALA 48 N 0.35 -1.17 -1.69 1.32 0.00 -1.26 -0.20 120.51 117.85 1vd0 n ALA 48 Ca -0.14 -0.18 -0.34 0.00 0.00 0.00 0.00 53.44 52.79 1vd0 n ALA 48 Cb 0.57 -1.90 0.01 0.00 0.00 0.00 0.00 19.45 18.13 1vd0 n ALA 48 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1vd0 s TRP 49 N -1.84 2.77 -0.08 0.00 -0.00 -1.15 -4.29 118.94 114.36 1vd0 s TRP 49 Ca 0.68 1.55 -0.18 0.00 -0.00 0.00 0.00 56.10 58.15 1vd0 s TRP 49 Cb -0.37 -3.17 -0.14 0.00 -0.00 0.00 0.00 33.47 29.79 1vd0 s TRP 49 CO 0.56 -1.40 0.65 0.22 -0.00 0.00 0.00 176.95 176.97 1vd0 h ASP 50 N 0.80 -0.12 0.00 5.86 1.82 -1.91 -3.49 116.42 119.38 1vd0 h ASP 50 Ca -0.48 -0.39 0.00 0.00 -0.39 0.00 0.00 57.03 55.76 1vd0 h ASP 50 Cb 1.24 0.03 0.00 0.00 0.68 0.00 0.00 39.33 41.28 1vd0 h ASP 50 CO 0.57 0.51 0.00 0.61 -1.61 0.00 0.00 179.24 179.31 1vd0 n GLY 51 N 1.06 0.98 0.36 -0.78 0.00 -1.26 -4.66 105.19 100.88 1vd0 n GLY 51 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1vd0 n GLY 51 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vd0 n THR 52 N 0.00 0.00 -1.62 2.61 -2.24 -1.26 0.07 114.28 111.84 1vd0 n THR 52 Ca 0.00 0.00 -0.49 0.00 -2.27 0.00 0.00 64.05 61.29 1vd0 n THR 52 Cb 0.00 -0.74 -0.05 0.00 -2.10 0.00 0.00 70.33 67.44 1vd0 n THR 52 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1vd0 n THR 53 N -2.55 0.45 -2.69 4.28 -1.04 -1.26 -4.91 114.28 106.56 1vd0 n THR 53 Ca 0.00 -0.18 -0.42 0.00 -2.04 0.00 0.00 64.05 61.41 1vd0 n THR 53 Cb 0.44 -1.88 -0.03 0.00 -1.82 0.00 0.00 70.33 67.04 1vd0 n THR 53 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1vd0 s ASP 54 N 5.29 7.31 -0.17 8.00 -4.77 -1.26 -3.34 116.67 127.73 1vd0 s ASP 54 Ca 0.98 1.62 0.00 0.00 -3.30 0.00 0.00 52.55 51.84 1vd0 s ASP 54 Cb -0.71 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 38.56 1vd0 s ASP 54 CO 0.50 -0.35 0.00 0.61 0.70 0.00 0.00 175.17 176.63 1vd0 n GLY 55 N 3.00 0.46 0.09 2.12 0.00 -1.25 -4.93 105.19 104.67 1vd0 n GLY 55 Ca 0.07 -0.97 -0.11 0.00 0.00 0.00 0.00 46.02 45.02 1vd0 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vd0 h ALA 56 N 0.02 0.71 -2.31 4.61 0.00 -1.64 -3.46 119.26 117.18 1vd0 h ALA 56 Ca -0.04 -1.44 -0.54 0.00 0.00 0.00 0.00 54.91 52.89 1vd0 h ALA 56 Cb 0.33 0.51 0.02 0.00 0.00 0.00 0.00 17.79 18.64 1vd0 h ALA 56 CO 0.05 1.54 1.26 0.00 0.00 0.00 0.00 179.25 182.10 1vd0 s ALA 57 N -2.59 3.48 -0.15 0.00 0.00 -1.14 -4.33 121.76 117.02 1vd0 s ALA 57 Ca -0.07 1.25 0.06 0.00 0.00 0.00 0.00 51.96 53.20 1vd0 s ALA 57 Cb 0.08 -3.87 -0.14 0.00 0.00 0.00 0.00 23.12 19.19 1vd0 s ALA 57 CO 0.82 -1.72 -0.06 1.33 0.00 0.00 0.00 175.76 176.12 1vd0 n VAL 58 N 5.82 0.96 -3.91 0.00 0.24 -0.01 -4.46 118.33 116.97 1vd0 n VAL 58 Ca 0.21 -0.46 -0.09 0.00 -2.04 0.00 0.00 64.34 61.96 1vd0 n VAL 58 Cb 0.42 -0.90 -0.02 0.00 -1.47 0.00 0.00 33.84 31.87 1vd0 n VAL 58 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1vd0 s GLY 59 N -5.21 0.38 -0.18 7.63 0.00 -1.25 -4.90 107.32 103.79 1vd0 s GLY 59 Ca -0.16 -0.71 -0.03 0.00 0.00 0.00 0.00 44.72 43.82 1vd0 s GLY 59 CO 0.46 -0.39 -0.07 -0.42 0.00 0.00 0.00 173.10 172.68 1vd0 s ILE 60 N -3.40 3.32 0.09 0.90 1.01 -1.26 0.12 121.20 121.99 1vd0 s ILE 60 Ca 0.17 -0.53 -0.31 0.00 0.00 0.00 0.00 60.65 59.98 1vd0 s ILE 60 Cb -0.04 -2.47 -0.09 0.00 0.01 0.00 0.00 42.46 39.87 1vd0 s ILE 60 CO 0.10 0.47 1.73 -0.22 0.00 0.00 0.00 174.94 177.02 1vd0 s LEU 61 N 0.96 4.38 -0.08 2.97 0.20 0.17 -0.51 118.68 126.77 1vd0 s LEU 61 Ca -0.01 2.60 -0.27 0.00 0.69 0.00 0.00 54.13 57.14 1vd0 s LEU 61 Cb -0.15 -3.56 -0.24 0.00 -0.43 0.00 0.00 46.19 41.81 1vd0 s LEU 61 CO 0.00 -0.94 0.98 0.00 -0.29 0.00 0.00 176.35 176.11 1vd0 h ALA 62 N 8.44 0.01 -4.29 5.97 0.00 -1.34 -0.34 119.26 127.72 1vd0 h ALA 62 Ca -0.44 -0.43 -0.67 0.00 0.00 0.00 0.00 54.91 53.37 1vd0 h ALA 62 Cb 1.21 0.01 -0.31 0.00 0.00 0.00 0.00 17.79 18.70 1vd0 h ALA 62 CO 0.94 -0.03 -0.88 0.08 0.00 0.00 0.00 179.25 179.36 1vd0 s VAL 63 N -3.04 1.94 0.53 0.00 1.01 -1.23 -4.32 120.40 115.30 1vd0 s VAL 63 Ca -0.17 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 60.58 1vd0 s VAL 63 Cb -0.00 -1.63 -0.08 0.00 0.00 0.00 0.00 36.38 34.67 1vd0 s VAL 63 CO 0.71 0.55 0.80 0.00 0.00 0.00 0.00 175.10 177.16 1vd0 n ALA 64 N 2.72 -0.36 -3.29 5.51 0.00 -1.26 -4.62 120.51 119.20 1vd0 n ALA 64 Ca -0.17 0.06 -0.09 0.00 0.00 0.00 0.00 53.44 53.24 1vd0 n ALA 64 Cb 0.52 -1.99 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 1vd0 n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vd0 s ALA 65 N -1.52 -0.80 0.39 0.00 0.00 -0.17 -4.85 121.76 114.81 1vd0 s ALA 65 Ca 0.70 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 52.35 1vd0 s ALA 65 Cb -0.47 0.88 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 1vd0 s ALA 65 CO 0.53 -0.82 0.19 -0.25 0.00 0.00 0.00 175.76 175.41 1vd0 n ASP 66 N -0.35 0.61 0.33 0.00 8.00 -1.26 -0.33 116.55 123.55 1vd0 n ASP 66 Ca -0.08 -3.22 0.21 0.00 0.71 0.00 0.00 54.79 52.41 1vd0 n ASP 66 Cb 0.62 1.26 1.13 0.00 -0.02 0.00 0.00 41.12 44.10 1vd0 n ASP 66 CO 0.00 0.00 0.00 0.06 -0.39 0.00 0.00 177.20 176.87 1vd0 h GLN 67 N 0.00 0.00 -0.00 -1.24 -0.00 -1.60 0.25 115.11 112.52 1vd0 h GLN 67 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.35 1vd0 h GLN 67 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.71 1vd0 h GLN 67 CO 0.46 0.00 -0.01 -2.37 -0.00 0.00 0.00 178.83 176.91 1vd0 n THR 68 N -3.00 0.00 -2.74 1.86 5.66 -1.26 -4.65 114.28 110.15 1vd0 n THR 68 Ca -0.03 -0.08 -0.43 0.00 -3.05 0.00 0.00 64.05 60.47 1vd0 n THR 68 Cb 0.12 -0.17 -0.03 0.00 -1.55 0.00 0.00 70.33 68.69 1vd0 n THR 68 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1vd0 s SER 69 N -2.09 6.85 0.11 1.09 1.04 0.88 -4.90 113.70 116.68 1vd0 s SER 69 Ca 0.42 0.93 0.22 0.00 0.48 0.00 0.00 55.95 58.00 1vd0 s SER 69 Cb 0.21 -2.50 0.89 0.00 0.10 0.00 0.00 66.02 64.73 1vd0 s SER 69 CO 0.38 -0.78 1.69 0.41 0.98 0.00 0.00 173.24 175.92 1vd0 n THR 70 N 5.73 0.66 -3.65 2.02 -1.04 -1.26 -4.42 114.28 112.31 1vd0 n THR 70 Ca 0.09 0.09 -0.12 0.00 -2.04 0.00 0.00 64.05 62.07 1vd0 n THR 70 Cb 0.47 -0.86 -0.08 0.00 -1.82 0.00 0.00 70.33 68.05 1vd0 n THR 70 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1vd0 s THR 71 N -3.10 -0.00 -0.09 12.58 2.01 -1.26 -3.83 115.64 121.94 1vd0 s THR 71 Ca 0.08 0.01 -0.01 0.00 0.31 0.00 0.00 61.69 62.08 1vd0 s THR 71 Cb 0.12 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1vd0 s THR 71 CO 0.42 0.00 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.54 1vd0 s LEU 72 N 0.70 3.25 -0.57 4.42 1.43 -0.30 -4.80 118.68 122.80 1vd0 s LEU 72 Ca -0.03 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 1vd0 s LEU 72 Cb -0.05 -1.73 0.15 0.00 0.03 0.00 0.00 46.19 44.59 1vd0 s LEU 72 CO -0.05 0.32 0.43 -0.89 0.23 0.00 0.00 176.35 176.39 1vd0 s THR 73 N -0.52 4.18 0.27 5.49 2.01 -1.26 -1.46 115.64 124.35 1vd0 s THR 73 Ca 0.08 -2.31 0.11 0.00 0.31 0.00 0.00 61.69 59.89 1vd0 s THR 73 Cb -0.12 -3.72 -0.05 0.00 0.01 0.00 0.00 72.50 68.62 1vd0 s THR 73 CO 0.02 -0.84 -0.17 0.72 -0.69 0.00 0.00 174.62 173.66 1vd0 s PHE 74 N 0.68 2.36 0.98 4.92 -0.71 -0.88 -0.88 117.98 124.45 1vd0 s PHE 74 Ca 0.12 -0.31 -0.15 0.00 -1.04 0.00 0.00 56.93 55.54 1vd0 s PHE 74 Cb -0.21 -1.04 0.19 0.00 -1.21 0.00 0.00 43.02 40.74 1vd0 s PHE 74 CO -0.03 0.68 1.22 0.71 -1.34 0.00 0.00 175.22 176.46 1vd0 s TYR 75 N -2.38 1.74 0.00 3.49 2.02 0.33 -0.57 117.35 121.99 1vd0 s TYR 75 Ca 0.29 0.52 0.00 0.00 -0.37 0.00 0.00 57.07 57.52 1vd0 s TYR 75 Cb -0.06 -3.75 0.00 0.00 -0.40 0.00 0.00 41.96 37.76 1vd0 s TYR 75 CO 0.15 -2.73 0.00 0.36 -1.57 0.00 0.00 175.55 171.76 1vd0 n LYS 76 N -3.91 2.79 -3.73 -0.62 -0.00 -1.26 -4.06 118.16 107.36 1vd0 n LYS 76 Ca 0.12 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.38 1vd0 n LYS 76 Cb 0.60 -0.86 -0.02 0.00 -0.00 0.00 0.00 35.03 34.75 1vd0 n LYS 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1vd0 s SER 77 N -2.36 -0.23 0.00 -5.58 0.15 -1.26 -4.47 113.70 99.95 1vd0 s SER 77 Ca 0.00 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1vd0 s SER 77 Cb 0.00 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 1vd0 s SER 77 CO 0.00 -0.97 0.00 0.61 1.20 0.00 0.00 173.24 174.08 1vd0 n GLY 78 N -0.44 3.50 3.60 9.45 0.00 -1.26 -4.98 105.19 115.05 1vd0 n GLY 78 Ca -0.06 -1.88 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1vd0 n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vd0 s THR 79 N -2.78 4.01 -0.10 2.61 2.01 -1.25 -2.89 115.64 117.24 1vd0 s THR 79 Ca 0.00 1.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.99 1vd0 s THR 79 Cb 0.00 -4.42 -0.03 0.00 0.01 0.00 0.00 72.50 68.06 1vd0 s THR 79 CO 0.00 -0.95 -0.06 -0.36 -0.69 0.00 0.00 174.62 172.57 1vd0 s PHE 80 N 5.12 2.98 0.01 4.92 0.08 -0.41 -4.99 117.98 125.68 1vd0 s PHE 80 Ca 0.54 -0.09 -0.30 0.00 0.12 0.00 0.00 56.93 57.19 1vd0 s PHE 80 Cb -0.10 -1.80 -0.05 0.00 -0.57 0.00 0.00 43.02 40.49 1vd0 s PHE 80 CO 0.31 0.21 1.36 1.03 -0.10 0.00 0.00 175.22 178.03 1vd0 s ARG 81 N -0.40 4.31 0.12 0.44 3.00 -1.26 -2.37 118.95 122.79 1vd0 s ARG 81 Ca 0.06 1.93 -0.07 0.00 0.00 0.00 0.00 55.73 57.65 1vd0 s ARG 81 Cb -0.12 -3.52 -0.10 0.00 0.00 0.00 0.00 34.95 31.21 1vd0 s ARG 81 CO 0.02 -0.52 1.31 -0.92 0.00 0.00 0.00 175.30 175.19 1vd0 h TYR 82 N 7.61 0.74 -0.04 -0.53 5.03 -1.92 -2.42 116.97 125.43 1vd0 h TYR 82 Ca -0.38 -0.38 0.01 0.00 2.58 0.00 0.00 58.73 60.56 1vd0 h TYR 82 Cb 1.18 -0.09 -0.00 0.00 1.55 0.00 0.00 36.73 39.37 1vd0 h TYR 82 CO 0.73 1.19 0.04 1.05 -1.32 0.00 0.00 178.16 179.85 1vd0 h GLU 83 N 0.31 0.00 0.00 1.82 4.11 -1.92 -2.97 114.58 115.93 1vd0 h GLU 83 Ca -0.08 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.26 1vd0 h GLU 83 Cb 1.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 1vd0 h GLU 83 CO 0.16 0.00 -0.62 0.22 0.07 0.00 0.00 179.01 178.84 1vd0 h ASP 84 N 0.00 0.00 -1.55 3.06 1.82 -1.95 -3.47 116.42 114.33 1vd0 h ASP 84 Ca 0.02 -0.46 -0.70 0.00 -0.39 0.00 0.00 57.03 55.49 1vd0 h ASP 84 Cb 0.09 0.00 0.05 0.00 0.68 0.00 0.00 39.33 40.15 1vd0 h ASP 84 CO -0.00 1.09 0.42 0.52 -1.61 0.00 0.00 179.24 179.66 1vd0 n VAL 85 N -4.56 0.02 -2.90 2.25 0.31 -0.92 -4.85 118.33 107.68 1vd0 n VAL 85 Ca -0.17 -0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 63.72 1vd0 n VAL 85 Cb 0.46 -0.71 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 1vd0 n VAL 85 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1vd0 n LEU 86 N 2.54 5.26 -4.75 7.52 7.94 0.58 -4.93 117.00 131.16 1vd0 n LEU 86 Ca 0.19 -4.44 -0.37 0.00 -1.11 0.00 0.00 56.01 50.29 1vd0 n LEU 86 Cb 0.17 -1.62 0.04 0.00 0.53 0.00 0.00 43.42 42.53 1vd0 n LEU 86 CO 0.63 0.72 0.90 0.26 -1.11 0.00 0.00 177.39 178.79 1vd0 s TRP 87 N 1.68 2.33 0.21 1.96 0.52 -1.26 -4.75 118.94 119.63 1vd0 s TRP 87 Ca 0.43 1.47 -0.30 0.00 0.02 0.00 0.00 56.10 57.72 1vd0 s TRP 87 Cb -0.02 -3.62 -0.09 0.00 -1.15 0.00 0.00 33.47 28.59 1vd0 s TRP 87 CO 0.01 -2.53 1.29 -1.25 0.02 0.00 0.00 176.95 174.49 1vd0 s PRO 88 N -3.15 4.40 0.33 4.98 0.04 -1.26 -4.92 135.00 135.42 1vd0 s PRO 88 Ca 0.76 2.04 0.05 0.00 0.04 0.00 0.00 61.00 63.89 1vd0 s PRO 88 Cb -0.35 -3.19 0.68 0.00 0.04 0.00 0.00 34.50 31.68 1vd0 s PRO 88 CO 0.39 -0.22 1.91 1.05 0.04 0.00 0.00 177.00 180.17 1vd0 h GLU 89 N 5.15 0.82 -0.89 4.56 4.11 -1.92 -2.34 114.58 124.06 1vd0 h GLU 89 Ca -0.45 -0.05 0.33 0.00 0.07 0.00 0.00 59.36 59.26 1vd0 h GLU 89 Cb 1.22 -0.18 -0.12 0.00 0.50 0.00 0.00 28.75 30.16 1vd0 h GLU 89 CO 0.76 0.54 0.54 0.00 0.07 0.00 0.00 179.01 180.92 1vd0 n ALA 90 N -2.42 0.90 -2.05 1.06 0.00 -1.26 -3.70 120.51 113.04 1vd0 n ALA 90 Ca 0.14 0.70 -0.34 0.00 0.00 0.00 0.00 53.44 53.94 1vd0 n ALA 90 Cb 0.30 -0.77 -0.04 0.00 0.00 0.00 0.00 19.45 18.94 1vd0 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vd0 s ALA 91 N -4.97 1.98 0.19 0.00 0.00 0.11 -4.63 121.76 114.44 1vd0 s ALA 91 Ca -0.06 -1.01 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 1vd0 s ALA 91 Cb 0.24 -4.41 0.11 0.00 0.00 0.00 0.00 23.12 19.06 1vd0 s ALA 91 CO 0.59 -4.25 1.53 0.66 0.00 0.00 0.00 175.76 174.29 1vd0 h SER 92 N 13.44 0.73 -3.30 0.00 4.64 -1.80 -3.43 113.55 123.84 1vd0 h SER 92 Ca -0.12 -0.34 -0.57 0.00 -0.47 0.00 0.00 61.79 60.29 1vd0 h SER 92 Cb 1.10 -0.21 -0.06 0.00 -0.31 0.00 0.00 62.40 62.93 1vd0 h SER 92 CO 1.22 1.07 -0.03 -0.62 -0.87 0.00 0.00 176.83 177.60 1vd0 s ASP 93 N -6.87 6.95 0.17 4.97 2.15 -1.26 -4.98 116.67 117.80 1vd0 s ASP 93 Ca -0.09 1.13 -0.06 0.00 0.43 0.00 0.00 52.55 53.96 1vd0 s ASP 93 Cb 0.12 -2.36 0.06 0.00 -0.30 0.00 0.00 42.92 40.44 1vd0 s ASP 93 CO 0.85 0.10 1.49 1.05 -0.17 0.00 0.00 175.17 178.48 1vd0 h GLU 94 N 5.72 0.70 -0.23 4.34 4.11 -2.01 -3.04 114.58 124.17 1vd0 h GLU 94 Ca -0.45 -0.41 -0.05 0.00 0.07 0.00 0.00 59.36 58.52 1vd0 h GLU 94 Cb 1.20 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1vd0 h GLU 94 CO 0.70 1.03 -0.06 1.15 0.07 0.00 0.00 179.01 181.91 1vd0 h THR 95 N 0.55 1.18 0.47 -1.06 2.02 -1.96 0.17 112.91 114.27 1vd0 h THR 95 Ca 0.02 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 1vd0 h THR 95 Cb 1.05 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 1vd0 h THR 95 CO 0.10 0.24 -0.23 0.50 0.37 0.00 0.00 175.52 176.51 1vd0 h LYS 96 N 0.35 -0.61 -0.23 6.66 1.63 -1.91 -0.71 116.57 121.75 1vd0 h LYS 96 Ca 0.07 0.04 -0.15 0.00 -0.85 0.00 0.00 60.65 59.77 1vd0 h LYS 96 Cb 0.32 0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 1vd0 h LYS 96 CO 0.01 -0.37 -0.48 1.57 -3.45 0.00 0.00 179.45 176.74 1vd0 h LYS 97 N -0.72 0.61 0.00 1.90 2.10 -1.52 0.51 116.57 119.46 1vd0 h LYS 97 Ca -0.06 -0.35 -0.02 0.00 -2.00 0.00 0.00 60.65 58.22 1vd0 h LYS 97 Cb 0.53 0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 31.88 1vd0 h LYS 97 CO 0.11 0.95 -0.08 0.00 -2.00 0.00 0.00 179.45 178.43 1vd0 h ARG 98 N 0.48 0.00 0.00 0.07 2.47 -0.60 -2.66 114.38 114.14 1vd0 h ARG 98 Ca 0.03 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.74 1vd0 h ARG 98 Cb 1.01 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.31 1vd0 h ARG 98 CO 0.09 0.08 -0.24 2.41 0.56 0.00 0.00 179.97 182.87 1vd0 n THR 99 N -3.64 1.34 0.15 2.04 -1.04 -0.28 -4.75 114.28 108.09 1vd0 n THR 99 Ca -0.02 -1.73 0.06 0.00 -2.04 0.00 0.00 64.05 60.31 1vd0 n THR 99 Cb 0.20 0.02 0.29 0.00 -1.82 0.00 0.00 70.33 69.01 1vd0 n THR 99 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vd0 n ALA 100 N -0.93 1.15 -0.37 2.41 0.00 0.18 -0.84 120.51 122.10 1vd0 n ALA 100 Ca 0.12 0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.70 1vd0 n ALA 100 Cb 0.69 -1.17 0.32 0.00 0.00 0.00 0.00 19.45 19.28 1vd0 n ALA 100 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1vd0 n PHE 101 N -1.84 1.43 -1.62 0.00 3.72 -1.26 -2.91 117.46 114.98 1vd0 n PHE 101 Ca 0.00 -0.54 -0.44 0.00 -0.05 0.00 0.00 57.45 56.43 1vd0 n PHE 101 Cb 0.05 -0.30 -0.03 0.00 -0.94 0.00 0.00 39.48 38.26 1vd0 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vd0 n ALA 102 N 0.78 1.59 0.00 4.37 0.00 -0.02 -1.79 120.51 125.44 1vd0 n ALA 102 Ca 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1vd0 n ALA 102 Cb 0.87 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.54 1vd0 n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vd0 n GLY 103 N 5.24 0.53 3.99 0.00 0.00 -1.26 -4.75 105.19 108.95 1vd0 n GLY 103 Ca 0.26 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.06 1vd0 n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vd0 s THR 104 N -0.91 2.27 -2.03 2.61 -4.23 -0.74 -5.00 115.64 107.61 1vd0 s THR 104 Ca 0.00 -0.65 0.17 0.00 -1.18 0.00 0.00 61.69 60.03 1vd0 s THR 104 Cb 0.00 -2.62 0.48 0.00 1.34 0.00 0.00 72.50 71.70 1vd0 s THR 104 CO 0.00 0.00 1.41 0.00 -0.54 0.00 0.00 174.62 175.49 1vd0 n ALA 105 N -2.65 2.42 -2.62 3.99 0.00 -1.26 -4.90 120.51 115.48 1vd0 n ALA 105 Ca 0.13 -0.95 -0.43 0.00 0.00 0.00 0.00 53.44 52.20 1vd0 n ALA 105 Cb 0.60 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 19.08 1vd0 n ALA 105 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1vd0 s ILE 106 N -1.29 4.62 -0.23 0.00 1.01 -1.26 -4.30 121.20 119.74 1vd0 s ILE 106 Ca 0.37 1.95 -0.14 0.00 0.00 0.00 0.00 60.65 62.83 1vd0 s ILE 106 Cb 0.19 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 1vd0 s ILE 106 CO 0.25 -0.16 0.34 -0.94 0.00 0.00 0.00 174.94 174.43 1vd0 s SER 107 N 1.31 6.31 -0.14 3.58 1.04 -1.14 -4.94 113.70 119.72 1vd0 s SER 107 Ca 0.46 0.35 -0.01 0.00 0.48 0.00 0.00 55.95 57.24 1vd0 s SER 107 Cb -0.16 -2.20 -0.01 0.00 0.10 0.00 0.00 66.02 63.75 1vd0 s SER 107 CO 0.08 -0.08 -0.12 -0.51 0.98 0.00 0.00 173.24 173.60 1vd0 s ILE 108 N 1.48 3.11 -2.65 -1.02 1.10 -1.26 -1.29 121.20 120.68 1vd0 s ILE 108 Ca 0.15 -0.63 0.27 0.00 -0.51 0.00 0.00 60.65 59.93 1vd0 s ILE 108 Cb -0.15 -2.32 0.44 0.00 0.15 0.00 0.00 42.46 40.59 1vd0 s ILE 108 CO 0.08 0.51 1.60 0.52 -2.11 0.00 0.00 174.94 175.55