#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 -0.70 -0.18 8.00 1.04 -1.26 -5.14 113.70 115.45 1vd0 s SER 2 Ca 0.00 0.35 -0.04 0.00 0.48 0.00 0.00 55.95 56.73 1vd0 s SER 2 Cb 0.00 1.55 0.06 0.00 0.10 0.00 0.00 66.02 67.74 1vd0 s SER 2 CO 0.00 -0.13 0.08 -0.54 0.98 0.00 0.00 173.24 173.63 1vd0 s LYS 3 N 2.93 0.19 -0.27 4.02 1.02 -1.26 -5.10 119.74 121.27 1vd0 s LYS 3 Ca 0.08 -0.19 -0.01 0.00 0.02 0.00 0.00 55.97 55.88 1vd0 s LYS 3 Cb -0.10 -1.84 0.16 0.00 -0.52 0.00 0.00 37.83 35.53 1vd0 s LYS 3 CO -0.16 -0.69 0.47 -1.21 -0.92 0.00 0.00 175.35 172.84 1vd0 s GLU 4 N 2.08 0.45 -0.23 1.68 8.01 -1.26 -5.15 118.70 124.28 1vd0 s GLU 4 Ca 0.02 0.62 -0.29 0.00 0.01 0.00 0.00 54.97 55.33 1vd0 s GLU 4 Cb -0.16 -0.05 0.15 0.00 -4.31 0.00 0.00 34.13 29.76 1vd0 s GLU 4 CO -0.11 -0.74 1.16 -0.08 0.01 0.00 0.00 175.26 175.50 1vd0 s THR 5 N 2.67 0.00 -0.29 3.63 -1.32 -1.26 -5.15 115.64 113.92 1vd0 s THR 5 Ca 0.15 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.64 1vd0 s THR 5 Cb -0.14 -1.00 0.19 0.00 -1.51 0.00 0.00 72.50 70.03 1vd0 s THR 5 CO -0.21 0.00 0.57 0.12 -2.21 0.00 0.00 174.62 172.89 1vd0 s PHE 6 N -0.86 -1.59 0.07 9.09 2.19 -1.26 -5.16 117.98 120.46 1vd0 s PHE 6 Ca 0.03 1.36 -0.10 0.00 0.33 0.00 0.00 56.93 58.56 1vd0 s PHE 6 Cb -0.01 0.40 0.00 0.00 -1.31 0.00 0.00 43.02 42.10 1vd0 s PHE 6 CO -0.04 -0.94 0.21 -0.08 1.83 0.00 0.00 175.22 176.21 1vd0 s THR 7 N 2.80 0.12 -0.85 0.12 -1.32 -1.26 -5.07 115.64 110.19 1vd0 s THR 7 Ca 0.16 -0.99 -0.23 0.00 -1.21 0.00 0.00 61.69 59.42 1vd0 s THR 7 Cb -0.13 -1.13 -0.18 0.00 -1.51 0.00 0.00 72.50 69.55 1vd0 s THR 7 CO -0.23 -0.54 2.26 0.00 -2.21 0.00 0.00 174.62 173.89 1vd0 n HIS 8 N 0.28 0.92 -1.55 9.09 1.44 -1.26 -4.84 115.22 119.31 1vd0 n HIS 8 Ca -0.17 -0.05 -0.55 0.00 -2.01 0.00 0.00 57.72 54.95 1vd0 n HIS 8 Cb 0.61 -2.29 -0.07 0.00 0.12 0.00 0.00 29.99 28.36 1vd0 n HIS 8 CO 0.00 0.00 0.00 2.48 -2.81 0.00 0.00 176.34 176.01 1vd0 n TYR 9 N 16.99 1.11 -4.38 -1.40 0.18 -1.26 -4.96 117.16 123.44 1vd0 n TYR 9 Ca 0.46 0.82 -0.23 0.00 1.88 0.00 0.00 57.90 60.83 1vd0 n TYR 9 Cb 0.41 -2.22 -0.16 0.00 -0.38 0.00 0.00 39.34 36.98 1vd0 n TYR 9 CO 0.00 0.00 0.00 1.14 -2.08 0.00 0.00 176.86 175.92 1vd0 s GLN 10 N 0.21 1.31 0.18 -3.48 -2.07 -1.26 -5.01 119.66 109.53 1vd0 s GLN 10 Ca 0.86 -0.27 0.21 0.00 -1.82 0.00 0.00 55.36 54.34 1vd0 s GLN 10 Cb -1.07 -1.16 0.87 0.00 -1.09 0.00 0.00 33.01 30.55 1vd0 s GLN 10 CO 0.51 -0.03 1.63 -0.35 -1.32 0.00 0.00 175.29 175.73 1vd0 n PRO 11 N 3.95 0.13 -3.44 9.60 -0.04 -1.26 -4.18 135.00 139.76 1vd0 n PRO 11 Ca -0.23 0.37 -0.43 0.00 -0.04 0.00 0.00 63.50 63.17 1vd0 n PRO 11 Cb 0.51 -1.76 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 1vd0 n PRO 11 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1vd0 s GLN 12 N -3.22 3.62 0.00 0.54 1.11 -1.26 -4.91 119.66 115.54 1vd0 s GLN 12 Ca 0.05 -2.90 0.00 0.00 0.01 0.00 0.00 55.36 52.52 1vd0 s GLN 12 Cb 0.09 -4.29 0.00 0.00 -1.01 0.00 0.00 33.01 27.80 1vd0 s GLN 12 CO 0.35 -1.25 0.00 0.41 0.01 0.00 0.00 175.29 174.81 1vd0 n GLY 13 N 3.15 3.16 3.31 3.09 0.00 -1.26 -5.17 105.19 111.48 1vd0 n GLY 13 Ca 0.18 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 1vd0 n GLY 13 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1vd0 s ASN 14 N 0.00 -0.47 -0.22 1.61 3.84 -1.26 -4.97 114.94 113.48 1vd0 s ASN 14 Ca 0.00 1.01 -0.13 0.00 0.21 0.00 0.00 52.86 53.95 1vd0 s ASN 14 Cb 0.00 1.12 0.07 0.00 -0.55 0.00 0.00 41.25 41.88 1vd0 s ASN 14 CO 0.00 -0.21 0.53 -0.55 -2.79 0.00 0.00 177.10 174.08 1vd0 s SER 15 N 1.98 -0.68 0.02 -4.21 0.15 -1.26 -5.17 113.70 104.53 1vd0 s SER 15 Ca -0.06 1.15 0.08 0.00 0.70 0.00 0.00 55.95 57.82 1vd0 s SER 15 Cb -0.10 1.05 -0.02 0.00 -1.71 0.00 0.00 66.02 65.24 1vd0 s SER 15 CO -0.14 -0.21 -0.22 -1.81 1.20 0.00 0.00 173.24 172.06 1vd0 s ASP 16 N 1.30 2.66 0.00 5.45 1.11 -1.26 -5.01 116.67 120.91 1vd0 s ASP 16 Ca -0.08 -0.50 0.14 0.00 0.18 0.00 0.00 52.55 52.29 1vd0 s ASP 16 Cb -0.06 -0.25 0.61 0.00 1.07 0.00 0.00 42.92 44.29 1vd0 s ASP 16 CO -0.13 0.22 1.45 -0.81 1.18 0.00 0.00 175.17 177.08 1vd0 n PRO 17 N 2.05 0.01 -2.35 8.23 -0.04 -1.26 -4.77 135.00 136.88 1vd0 n PRO 17 Ca -0.17 0.25 -0.24 0.00 -0.04 0.00 0.00 63.50 63.30 1vd0 n PRO 17 Cb 0.53 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.55 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 -2.97 3.39 -0.59 0.55 0.00 -1.26 -5.01 121.76 115.87 1vd0 s ALA 18 Ca 0.07 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1vd0 s ALA 18 Cb 0.09 -2.40 0.43 0.00 0.00 0.00 0.00 23.12 21.24 1vd0 s ALA 18 CO 0.26 -1.20 1.73 0.72 0.00 0.00 0.00 175.76 177.26 1vd0 n HIS 19 N -2.78 3.09 -4.09 0.00 8.25 -1.26 -4.98 115.22 113.46 1vd0 n HIS 19 Ca 0.09 -2.70 -0.08 0.00 -0.26 0.00 0.00 57.72 54.77 1vd0 n HIS 19 Cb 0.60 -0.98 -0.10 0.00 1.12 0.00 0.00 29.99 30.63 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 -4.91 0.30 0.05 1.59 -4.23 -1.26 -3.22 115.64 103.95 1vd0 s THR 20 Ca 0.57 -1.66 0.03 0.00 -1.18 0.00 0.00 61.69 59.45 1vd0 s THR 20 Cb 0.46 -1.32 -0.04 0.00 1.34 0.00 0.00 72.50 72.94 1vd0 s THR 20 CO -0.10 -0.88 0.02 0.00 -0.54 0.00 0.00 174.62 173.12 1vd0 s ALA 21 N -3.39 3.36 -0.34 3.99 0.00 -0.33 -4.92 121.76 120.12 1vd0 s ALA 21 Ca 0.04 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.00 1vd0 s ALA 21 Cb 0.04 -1.32 0.10 0.00 0.00 0.00 0.00 23.12 21.94 1vd0 s ALA 21 CO -0.07 0.69 0.09 0.95 0.00 0.00 0.00 175.76 177.42 1vd0 s THR 22 N -1.23 1.66 0.43 0.00 -4.23 -1.26 -2.30 115.64 108.71 1vd0 s THR 22 Ca 0.24 -2.03 -0.09 0.00 -1.18 0.00 0.00 61.69 58.63 1vd0 s THR 22 Cb -0.12 -2.23 -0.06 0.00 1.34 0.00 0.00 72.50 71.44 1vd0 s THR 22 CO 0.15 -0.66 0.78 0.00 -0.54 0.00 0.00 174.62 174.35 1vd0 s ALA 23 N 1.09 3.35 -2.00 3.99 0.00 -0.72 -4.86 121.76 122.62 1vd0 s ALA 23 Ca 0.11 -0.26 0.11 0.00 0.00 0.00 0.00 51.96 51.92 1vd0 s ALA 23 Cb -0.19 -2.69 0.67 0.00 0.00 0.00 0.00 23.12 20.90 1vd0 s ALA 23 CO -0.14 -0.11 1.10 -0.35 0.00 0.00 0.00 175.76 176.26 1vd0 n PRO 24 N -1.56 0.49 -0.41 0.00 -0.04 -1.26 -0.88 135.00 131.34 1vd0 n PRO 24 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1vd0 n PRO 24 Cb 0.54 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 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 -0.02 -3.65 0.93 0.55 0.00 -1.25 -3.93 105.19 97.83 1vd0 n GLY 25 Ca 0.08 -0.89 -0.06 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.41 0.59 3.65 -0.02 0.00 -1.16 -4.79 105.19 103.05 1vd0 n GLY 26 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 1.35 0.00 0.99 1.02 -1.24 -4.68 118.68 116.12 1vd0 s LEU 27 Ca 0.01 1.05 0.01 0.00 0.02 0.00 0.00 54.13 55.22 1vd0 s LEU 27 Cb 0.01 -3.12 -0.01 0.00 0.02 0.00 0.00 46.19 43.09 1vd0 s LEU 27 CO -0.00 -3.40 0.03 -1.20 0.02 0.00 0.00 176.35 171.80 1vd0 n SER 28 N -4.33 0.04 -3.45 2.29 7.64 -1.26 -4.39 113.62 110.15 1vd0 n SER 28 Ca 0.07 -0.52 -0.07 0.00 1.01 0.00 0.00 58.87 59.35 1vd0 n SER 28 Cb 0.58 1.00 -0.00 0.00 -1.01 0.00 0.00 64.21 64.77 1vd0 n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vd0 s ALA 29 N -1.06 -1.06 0.21 -0.43 0.00 -1.26 -4.71 121.76 113.46 1vd0 s ALA 29 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1vd0 s ALA 29 Cb 0.01 0.76 -0.08 0.00 0.00 0.00 0.00 23.12 23.81 1vd0 s ALA 29 CO 0.03 -1.02 1.12 -1.59 0.00 0.00 0.00 175.76 174.30 1vd0 s LYS 30 N -3.17 4.59 -0.07 0.00 -2.85 -1.26 -2.86 119.74 114.12 1vd0 s LYS 30 Ca 0.13 1.78 -0.06 0.00 -1.00 0.00 0.00 55.97 56.82 1vd0 s LYS 30 Cb -0.05 -3.24 0.02 0.00 -2.06 0.00 0.00 37.83 32.50 1vd0 s LYS 30 CO 0.09 0.09 0.19 0.00 0.10 0.00 0.00 175.35 175.82 1vd0 s ALA 31 N -0.53 -0.45 0.76 0.59 0.00 0.40 -4.97 121.76 117.55 1vd0 s ALA 31 Ca 0.48 0.58 -0.11 0.00 0.00 0.00 0.00 51.96 52.91 1vd0 s ALA 31 Cb -0.31 -0.34 0.05 0.00 0.00 0.00 0.00 23.12 22.52 1vd0 s ALA 31 CO 0.37 -0.10 1.09 -1.25 0.00 0.00 0.00 175.76 175.87 1vd0 s PRO 32 N 0.27 2.31 0.47 0.00 0.04 -1.26 -1.67 135.00 135.17 1vd0 s PRO 32 Ca -0.01 1.19 -0.08 0.00 0.04 0.00 0.00 61.00 62.13 1vd0 s PRO 32 Cb -0.03 -1.90 0.11 0.00 0.04 0.00 0.00 34.50 32.72 1vd0 s PRO 32 CO -0.01 -1.60 0.63 0.00 0.04 0.00 0.00 177.00 176.06 1vd0 n ALA 33 N -3.41 -0.75 -3.49 8.56 0.00 -1.26 -4.55 120.51 115.60 1vd0 n ALA 33 Ca 0.09 -0.82 -0.19 0.00 0.00 0.00 0.00 53.44 52.52 1vd0 n ALA 33 Cb 0.53 -0.04 0.07 0.00 0.00 0.00 0.00 19.45 20.00 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 -2.36 -4.96 -3.59 0.00 2.81 0.14 -4.77 117.12 104.40 1vd0 n MET 34 Ca 0.08 0.76 -0.16 0.00 -1.81 0.00 0.00 57.70 56.57 1vd0 n MET 34 Cb 0.27 -5.55 -0.06 0.00 -0.71 0.00 0.00 33.22 27.17 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 -3.47 0.02 0.48 2.03 -4.23 -1.24 -1.68 115.64 107.56 1vd0 s THR 35 Ca 0.12 -0.17 -0.22 0.00 -1.18 0.00 0.00 61.69 60.24 1vd0 s THR 35 Cb -0.02 -0.91 -0.07 0.00 1.34 0.00 0.00 72.50 72.84 1vd0 s THR 35 CO 0.76 -0.09 1.15 -2.16 -0.54 0.00 0.00 174.62 173.74 1vd0 s PRO 36 N -1.59 3.64 0.23 3.99 0.04 -1.26 0.02 135.00 140.08 1vd0 s PRO 36 Ca -0.10 1.73 0.02 0.00 0.04 0.00 0.00 61.00 62.69 1vd0 s PRO 36 Cb -0.01 -2.29 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 1vd0 s PRO 36 CO 0.05 -0.64 0.04 -0.51 0.04 0.00 0.00 177.00 175.98 1vd0 s LEU 37 N -3.25 1.96 0.05 -3.56 1.43 0.16 -3.18 118.68 112.30 1vd0 s LEU 37 Ca 0.66 -1.28 0.08 0.00 -1.03 0.00 0.00 54.13 52.56 1vd0 s LEU 37 Cb -0.27 -0.11 -0.03 0.00 0.03 0.00 0.00 46.19 45.80 1vd0 s LEU 37 CO 0.32 -0.61 -0.20 0.00 0.23 0.00 0.00 176.35 176.09 1vd0 s MET 38 N -3.94 1.97 -0.16 1.70 0.23 0.12 -0.17 119.30 119.05 1vd0 s MET 38 Ca 0.31 -1.04 -0.04 0.00 -1.03 0.00 0.00 55.69 53.89 1vd0 s MET 38 Cb 0.07 -2.14 -0.03 0.00 -1.53 0.00 0.00 34.83 31.20 1vd0 s MET 38 CO 0.10 0.52 -0.03 -1.17 -2.03 0.00 0.00 175.02 172.41 1vd0 s LEU 39 N -1.52 3.27 0.99 0.18 2.96 -1.26 -1.12 118.68 122.18 1vd0 s LEU 39 Ca 0.15 -0.12 -0.12 0.00 -0.22 0.00 0.00 54.13 53.82 1vd0 s LEU 39 Cb -0.10 -1.79 0.18 0.00 0.50 0.00 0.00 46.19 44.98 1vd0 s LEU 39 CO 0.05 0.17 1.08 -0.62 -1.32 0.00 0.00 176.35 175.72 1vd0 s ASP 40 N 0.36 2.56 -0.14 3.68 -1.08 0.26 -4.94 116.67 117.38 1vd0 s ASP 40 Ca -0.04 1.62 0.05 0.00 -0.52 0.00 0.00 52.55 53.66 1vd0 s ASP 40 Cb -0.14 -2.27 -0.12 0.00 -1.46 0.00 0.00 42.92 38.93 1vd0 s ASP 40 CO 0.03 -3.23 -0.07 0.41 0.52 0.00 0.00 175.17 172.83 1vd0 n THR 41 N -4.28 0.86 -0.11 1.71 -1.04 -1.26 -4.13 114.28 106.02 1vd0 n THR 41 Ca 0.07 -0.41 -0.21 0.00 -2.04 0.00 0.00 64.05 61.47 1vd0 n THR 41 Cb 0.54 -0.90 -0.08 0.00 -1.82 0.00 0.00 70.33 68.07 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 -2.75 1.90 0.17 8.00 7.64 -1.26 -4.33 113.62 122.99 1vd0 n SER 42 Ca -0.24 0.41 0.13 0.00 1.01 0.00 0.00 58.87 60.19 1vd0 n SER 42 Cb 0.83 -0.87 0.50 0.00 -1.01 0.00 0.00 64.21 63.66 1vd0 n SER 42 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1vd0 h SER 43 N -1.00 0.00 -6.40 6.43 0.02 -2.00 -3.46 113.55 107.14 1vd0 h SER 43 Ca -0.38 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.09 1vd0 h SER 43 Cb 1.26 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.77 1vd0 h SER 43 CO -0.23 0.00 -0.88 0.54 -1.14 0.00 0.00 176.83 175.12 1vd0 n ARG 44 N -2.52 -3.54 -4.41 3.45 5.12 -1.26 -4.98 116.66 108.53 1vd0 n ARG 44 Ca 0.02 0.45 -0.21 0.00 -1.93 0.00 0.00 57.85 56.19 1vd0 n ARG 44 Cb 0.31 -4.64 -0.10 0.00 -1.16 0.00 0.00 32.46 26.86 1vd0 n ARG 44 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 1vd0 s LYS 45 N -6.41 1.49 -0.26 5.56 -2.85 -1.26 -4.83 119.74 111.19 1vd0 s LYS 45 Ca 0.02 -1.70 -0.09 0.00 -1.00 0.00 0.00 55.97 53.20 1vd0 s LYS 45 Cb -0.01 -1.30 -0.04 0.00 -2.06 0.00 0.00 37.83 34.43 1vd0 s LYS 45 CO 0.87 0.17 0.12 -1.17 0.10 0.00 0.00 175.35 175.44 1vd0 s LEU 46 N -3.41 3.68 0.10 2.77 1.98 -1.26 -0.57 118.68 121.96 1vd0 s LEU 46 Ca 0.27 -0.12 0.04 0.00 -2.89 0.00 0.00 54.13 51.42 1vd0 s LEU 46 Cb -0.00 -2.00 -0.04 0.00 0.66 0.00 0.00 46.19 44.81 1vd0 s LEU 46 CO 0.11 -0.04 -0.10 0.68 -1.89 0.00 0.00 176.35 175.11 1vd0 s VAL 47 N 1.65 0.92 0.53 1.68 -7.23 -0.27 -2.99 120.40 114.68 1vd0 s VAL 47 Ca 0.07 -1.64 -0.20 0.00 -1.81 0.00 0.00 61.98 58.39 1vd0 s VAL 47 Cb -0.15 -1.36 -0.08 0.00 0.56 0.00 0.00 36.38 35.35 1vd0 s VAL 47 CO 0.06 -0.57 0.86 0.00 -0.31 0.00 0.00 175.10 175.15 1vd0 n ALA 48 N 0.55 -0.18 -1.77 1.32 0.00 -1.26 0.11 120.51 119.27 1vd0 n ALA 48 Ca -0.16 0.08 -0.36 0.00 0.00 0.00 0.00 53.44 53.00 1vd0 n ALA 48 Cb 0.58 -2.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.00 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 -1.48 2.79 0.01 0.00 -0.00 -1.19 -4.24 118.94 114.83 1vd0 s TRP 49 Ca 0.69 1.54 -0.20 0.00 -0.00 0.00 0.00 56.10 58.14 1vd0 s TRP 49 Cb -0.48 -3.33 -0.21 0.00 -0.00 0.00 0.00 33.47 29.46 1vd0 s TRP 49 CO 0.52 -1.51 1.16 0.22 -0.00 0.00 0.00 176.95 177.35 1vd0 h ASP 50 N 1.66 0.50 0.00 5.86 3.58 -1.92 -3.48 116.42 122.62 1vd0 h ASP 50 Ca -0.50 -0.69 0.00 0.00 0.42 0.00 0.00 57.03 56.26 1vd0 h ASP 50 Cb 1.25 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.15 1vd0 h ASP 50 CO 0.59 1.12 0.00 0.61 -2.88 0.00 0.00 179.24 178.67 1vd0 n GLY 51 N 0.85 2.41 0.28 -0.78 0.00 -1.26 -4.71 105.19 101.98 1vd0 n GLY 51 Ca -0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.54 1.32 -1.50 2.61 -2.24 -1.26 -3.32 114.28 109.35 1vd0 n THR 52 Ca 0.00 -0.17 -0.62 0.00 -2.27 0.00 0.00 64.05 60.99 1vd0 n THR 52 Cb 0.00 -1.94 -0.10 0.00 -2.10 0.00 0.00 70.33 66.19 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 -4.11 0.04 -2.20 4.28 -1.04 -1.26 -4.83 114.28 105.17 1vd0 n THR 53 Ca -0.35 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.05 61.21 1vd0 n THR 53 Cb 0.70 -0.65 -0.03 0.00 -1.82 0.00 0.00 70.33 68.53 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 4.72 6.84 -1.10 8.00 -4.77 -1.26 -2.79 116.67 126.32 1vd0 s ASP 54 Ca 1.11 2.22 -0.02 0.00 -3.30 0.00 0.00 52.55 52.56 1vd0 s ASP 54 Cb -1.41 -2.57 0.00 0.00 -1.09 0.00 0.00 42.92 37.85 1vd0 s ASP 54 CO 0.71 -0.68 0.25 0.61 0.70 0.00 0.00 175.17 176.76 1vd0 n GLY 55 N 3.57 -0.15 0.09 2.12 0.00 -1.26 -4.91 105.19 104.65 1vd0 n GLY 55 Ca 0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 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 0.67 0.70 -2.25 4.61 0.00 -1.63 -3.46 119.26 117.89 1vd0 h ALA 56 Ca -0.35 -1.08 -0.55 0.00 0.00 0.00 0.00 54.91 52.93 1vd0 h ALA 56 Cb 1.25 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 1vd0 h ALA 56 CO 0.38 1.18 1.10 0.00 0.00 0.00 0.00 179.25 181.92 1vd0 s ALA 57 N -2.79 3.58 -0.09 0.00 0.00 -1.19 -4.16 121.76 117.10 1vd0 s ALA 57 Ca -0.03 0.93 0.12 0.00 0.00 0.00 0.00 51.96 52.98 1vd0 s ALA 57 Cb 0.08 -3.76 -0.18 0.00 0.00 0.00 0.00 23.12 19.26 1vd0 s ALA 57 CO 0.82 -1.46 0.13 1.33 0.00 0.00 0.00 175.76 176.57 1vd0 n VAL 58 N 5.58 0.58 -3.80 0.00 0.24 0.76 -4.34 118.33 117.36 1vd0 n VAL 58 Ca 0.18 -0.47 -0.04 0.00 -2.04 0.00 0.00 64.34 61.96 1vd0 n VAL 58 Cb 0.43 -0.37 -0.00 0.00 -1.47 0.00 0.00 33.84 32.42 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 -4.25 -0.09 -0.17 7.63 0.00 -1.23 -4.89 107.32 104.32 1vd0 s GLY 59 Ca -0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 44.72 44.52 1vd0 s GLY 59 CO 0.54 0.40 -0.06 -0.42 0.00 0.00 0.00 173.10 173.57 1vd0 s ILE 60 N -3.07 3.48 0.05 0.90 1.01 -1.26 0.40 121.20 122.72 1vd0 s ILE 60 Ca 0.14 -0.48 -0.30 0.00 0.00 0.00 0.00 60.65 60.00 1vd0 s ILE 60 Cb -0.03 -2.54 -0.08 0.00 0.01 0.00 0.00 42.46 39.83 1vd0 s ILE 60 CO 0.04 0.47 1.72 -0.22 0.00 0.00 0.00 174.94 176.95 1vd0 s LEU 61 N 0.80 4.37 -0.03 2.97 0.20 0.10 -0.12 118.68 126.98 1vd0 s LEU 61 Ca -0.02 2.51 -0.22 0.00 0.69 0.00 0.00 54.13 57.08 1vd0 s LEU 61 Cb -0.15 -3.55 -0.25 0.00 -0.43 0.00 0.00 46.19 41.81 1vd0 s LEU 61 CO 0.01 -0.93 1.02 0.00 -0.29 0.00 0.00 176.35 176.17 1vd0 h ALA 62 N 8.85 0.03 -3.30 5.97 0.00 -1.61 0.41 119.26 129.61 1vd0 h ALA 62 Ca -0.43 -0.54 -0.63 0.00 0.00 0.00 0.00 54.91 53.30 1vd0 h ALA 62 Cb 1.20 0.03 -0.34 0.00 0.00 0.00 0.00 17.79 18.69 1vd0 h ALA 62 CO 0.94 0.23 -0.86 0.08 0.00 0.00 0.00 179.25 179.64 1vd0 s VAL 63 N -3.00 1.78 0.34 0.00 1.01 -1.24 -4.26 120.40 115.02 1vd0 s VAL 63 Ca -0.15 -0.83 -0.24 0.00 0.00 0.00 0.00 61.98 60.77 1vd0 s VAL 63 Cb 0.02 -1.57 -0.16 0.00 0.00 0.00 0.00 36.38 34.67 1vd0 s VAL 63 CO 0.78 0.50 0.28 0.00 0.00 0.00 0.00 175.10 176.66 1vd0 n ALA 64 N 3.87 -2.80 -2.51 5.51 0.00 -1.26 -4.71 120.51 118.60 1vd0 n ALA 64 Ca -0.20 0.23 -0.15 0.00 0.00 0.00 0.00 53.44 53.32 1vd0 n ALA 64 Cb 0.52 -1.55 -0.07 0.00 0.00 0.00 0.00 19.45 18.35 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 -1.43 1.11 0.32 0.00 0.00 -0.67 -4.86 121.76 116.23 1vd0 s ALA 65 Ca 0.61 -1.67 0.02 0.00 0.00 0.00 0.00 51.96 50.92 1vd0 s ALA 65 Cb -0.73 1.32 -0.01 0.00 0.00 0.00 0.00 23.12 23.71 1vd0 s ALA 65 CO 0.60 -0.69 0.38 -0.40 0.00 0.00 0.00 175.76 175.64 1vd0 n ASP 66 N -0.95 -1.02 0.18 0.00 5.68 -1.26 -0.45 116.55 118.73 1vd0 n ASP 66 Ca 0.03 -2.87 0.13 0.00 -0.50 0.00 0.00 54.79 51.58 1vd0 n ASP 66 Cb 0.63 2.03 0.62 0.00 -1.14 0.00 0.00 41.12 43.27 1vd0 n ASP 66 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 1vd0 h GLN 67 N 0.00 0.00 -0.01 0.11 -0.00 -1.73 -0.61 115.11 112.87 1vd0 h GLN 67 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 1vd0 h GLN 67 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.59 1vd0 h GLN 67 CO 0.33 0.00 -0.19 -2.37 -0.00 0.00 0.00 178.83 176.60 1vd0 n THR 68 N -2.43 0.00 -2.23 1.86 5.66 -1.26 -4.63 114.28 111.26 1vd0 n THR 68 Ca 0.00 -0.22 -0.43 0.00 -3.05 0.00 0.00 64.05 60.35 1vd0 n THR 68 Cb 0.15 0.68 -0.02 0.00 -1.55 0.00 0.00 70.33 69.59 1vd0 n THR 68 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1vd0 s SER 69 N -2.30 6.72 0.01 1.09 0.01 -0.24 -4.88 113.70 114.12 1vd0 s SER 69 Ca 0.28 1.80 0.28 0.00 1.31 0.00 0.00 55.95 59.62 1vd0 s SER 69 Cb 0.20 -2.54 1.00 0.00 0.21 0.00 0.00 66.02 64.89 1vd0 s SER 69 CO 0.45 -0.95 1.77 0.41 0.41 0.00 0.00 173.24 175.34 1vd0 n THR 70 N 5.70 0.04 -3.66 1.44 -1.04 -1.26 -4.31 114.28 111.18 1vd0 n THR 70 Ca 0.16 -0.02 -0.08 0.00 -2.04 0.00 0.00 64.05 62.07 1vd0 n THR 70 Cb 0.44 -0.29 -0.08 0.00 -1.82 0.00 0.00 70.33 68.58 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 -3.01 -0.36 -0.13 12.58 2.01 -1.25 -3.74 115.64 121.73 1vd0 s THR 71 Ca 0.13 0.08 -0.03 0.00 0.31 0.00 0.00 61.69 62.18 1vd0 s THR 71 Cb 0.18 -0.77 -0.03 0.00 0.01 0.00 0.00 72.50 71.89 1vd0 s THR 71 CO 0.58 0.03 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.75 1vd0 s LEU 72 N 2.05 3.31 -0.52 4.42 1.43 -0.06 -4.85 118.68 124.45 1vd0 s LEU 72 Ca -0.07 -0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1vd0 s LEU 72 Cb -0.09 -1.78 0.14 0.00 0.03 0.00 0.00 46.19 44.48 1vd0 s LEU 72 CO -0.15 0.23 0.34 -0.89 0.23 0.00 0.00 176.35 176.10 1vd0 s THR 73 N 0.01 3.63 0.24 5.49 2.01 -1.26 -1.75 115.64 124.01 1vd0 s THR 73 Ca 0.01 -2.46 0.10 0.00 0.31 0.00 0.00 61.69 59.65 1vd0 s THR 73 Cb -0.13 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 1vd0 s THR 73 CO 0.03 -0.79 -0.07 0.72 -0.69 0.00 0.00 174.62 173.81 1vd0 s PHE 74 N 0.58 2.59 1.14 4.92 -0.71 -0.97 -1.53 117.98 124.00 1vd0 s PHE 74 Ca 0.12 -0.25 -0.16 0.00 -1.04 0.00 0.00 56.93 55.61 1vd0 s PHE 74 Cb -0.22 -1.18 0.26 0.00 -1.21 0.00 0.00 43.02 40.67 1vd0 s PHE 74 CO -0.04 0.61 1.08 0.71 -1.34 0.00 0.00 175.22 176.24 1vd0 s TYR 75 N -2.17 1.17 0.00 3.49 2.02 0.83 -1.19 117.35 121.51 1vd0 s TYR 75 Ca 0.29 0.77 0.00 0.00 -0.37 0.00 0.00 57.07 57.76 1vd0 s TYR 75 Cb -0.07 -3.29 0.00 0.00 -0.40 0.00 0.00 41.96 38.20 1vd0 s TYR 75 CO 0.17 -3.58 0.00 0.36 -1.57 0.00 0.00 175.55 170.93 1vd0 n LYS 76 N -4.62 1.25 -3.83 -0.62 -0.00 -1.20 -4.16 118.16 104.99 1vd0 n LYS 76 Ca 0.08 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.32 1vd0 n LYS 76 Cb 0.58 -0.85 0.01 0.00 -0.00 0.00 0.00 35.03 34.77 1vd0 n LYS 76 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1vd0 s SER 77 N -3.13 -0.09 0.00 -5.58 1.04 -1.26 -4.30 113.70 100.38 1vd0 s SER 77 Ca 0.00 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.51 1vd0 s SER 77 Cb 0.00 0.79 0.00 0.00 0.10 0.00 0.00 66.02 66.91 1vd0 s SER 77 CO 0.00 -1.52 0.00 0.61 0.98 0.00 0.00 173.24 173.31 1vd0 n GLY 78 N -0.51 2.91 3.63 7.32 0.00 -1.26 -4.96 105.19 112.32 1vd0 n GLY 78 Ca -0.07 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 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 -3.00 4.71 0.28 2.61 2.01 -1.26 -3.49 115.64 117.50 1vd0 s THR 79 Ca 0.00 1.46 0.09 0.00 0.31 0.00 0.00 61.69 63.55 1vd0 s THR 79 Cb 0.00 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 1vd0 s THR 79 CO 0.00 -0.29 0.07 -0.36 -0.69 0.00 0.00 174.62 173.35 1vd0 s PHE 80 N 3.17 2.80 -0.20 4.92 0.40 -1.24 -5.03 117.98 122.79 1vd0 s PHE 80 Ca 0.37 -0.23 -0.24 0.00 -0.60 0.00 0.00 56.93 56.24 1vd0 s PHE 80 Cb -0.14 -1.33 -0.01 0.00 0.51 0.00 0.00 43.02 42.04 1vd0 s PHE 80 CO 0.12 0.54 0.78 1.03 0.70 0.00 0.00 175.22 178.39 1vd0 s ARG 81 N -3.75 4.24 0.12 0.44 0.52 -1.26 -3.22 118.95 116.03 1vd0 s ARG 81 Ca 0.33 0.90 -0.04 0.00 -0.52 0.00 0.00 55.73 56.40 1vd0 s ARG 81 Cb -0.06 -3.60 -0.13 0.00 0.52 0.00 0.00 34.95 31.68 1vd0 s ARG 81 CO 0.22 -0.37 1.27 -0.92 0.02 0.00 0.00 175.30 175.52 1vd0 h TYR 82 N 7.49 0.56 0.00 -0.53 5.03 -1.91 -1.74 116.97 125.87 1vd0 h TYR 82 Ca -0.28 -0.33 -0.00 0.00 2.58 0.00 0.00 58.73 60.70 1vd0 h TYR 82 Cb 1.12 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 39.35 1vd0 h TYR 82 CO 0.73 1.17 -0.00 1.05 -1.32 0.00 0.00 178.16 179.78 1vd0 h GLU 83 N 0.18 0.00 0.02 1.82 4.11 -1.92 -2.90 114.58 115.89 1vd0 h GLU 83 Ca -0.09 0.00 -0.39 0.00 0.07 0.00 0.00 59.36 58.95 1vd0 h GLU 83 Cb 1.66 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.86 1vd0 h GLU 83 CO 0.17 0.00 -2.25 -3.47 0.07 0.00 0.00 179.01 173.54 1vd0 n ASP 84 N -3.56 1.97 -4.69 3.06 -0.08 -1.19 -4.93 116.55 107.13 1vd0 n ASP 84 Ca -0.03 0.20 -0.54 0.00 -1.51 0.00 0.00 54.79 52.91 1vd0 n ASP 84 Cb 0.08 -0.73 -0.06 0.00 2.34 0.00 0.00 41.12 42.75 1vd0 n ASP 84 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1vd0 n VAL 85 N -3.90 0.32 -2.66 5.18 0.31 -0.66 -4.86 118.33 112.06 1vd0 n VAL 85 Ca -0.46 -0.06 -0.42 0.00 -0.01 0.00 0.00 64.34 63.40 1vd0 n VAL 85 Cb 0.90 -1.34 -0.03 0.00 -0.91 0.00 0.00 33.84 32.46 1vd0 n VAL 85 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1vd0 s LEU 86 N 3.16 3.80 0.46 7.52 1.43 -0.68 -4.92 118.68 129.46 1vd0 s LEU 86 Ca 0.94 -1.19 -0.20 0.00 -1.03 0.00 0.00 54.13 52.65 1vd0 s LEU 86 Cb -0.95 -2.51 -0.10 0.00 0.03 0.00 0.00 46.19 42.66 1vd0 s LEU 86 CO 0.59 -1.52 0.97 0.26 0.23 0.00 0.00 176.35 176.88 1vd0 s TRP 87 N 4.67 3.28 0.27 0.29 0.52 -1.26 -4.68 118.94 122.03 1vd0 s TRP 87 Ca 0.37 1.58 -0.29 0.00 0.02 0.00 0.00 56.10 57.78 1vd0 s TRP 87 Cb -0.06 -2.87 -0.10 0.00 -1.15 0.00 0.00 33.47 29.29 1vd0 s TRP 87 CO 0.00 -0.28 1.25 -1.25 0.02 0.00 0.00 176.95 176.70 1vd0 s PRO 88 N -3.35 4.44 0.42 4.98 0.04 -1.26 -4.92 135.00 135.34 1vd0 s PRO 88 Ca 0.62 2.05 0.12 0.00 0.04 0.00 0.00 61.00 63.83 1vd0 s PRO 88 Cb -0.10 -3.15 0.96 0.00 0.04 0.00 0.00 34.50 32.24 1vd0 s PRO 88 CO 0.17 -0.11 1.98 1.05 0.04 0.00 0.00 177.00 180.13 1vd0 h GLU 89 N 4.24 0.48 -1.86 4.56 4.11 -1.95 -1.93 114.58 122.23 1vd0 h GLU 89 Ca -0.47 -0.03 0.54 0.00 0.07 0.00 0.00 59.36 59.47 1vd0 h GLU 89 Cb 1.22 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 30.29 1vd0 h GLU 89 CO 0.70 0.32 1.39 0.00 0.07 0.00 0.00 179.01 181.49 1vd0 h ALA 90 N 1.68 3.77 -1.54 1.06 0.00 -1.85 -3.34 119.26 119.04 1vd0 h ALA 90 Ca 0.28 -0.07 -0.51 0.00 0.00 0.00 0.00 54.91 54.62 1vd0 h ALA 90 Cb 0.46 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1vd0 h ALA 90 CO -0.08 -2.35 1.35 0.00 0.00 0.00 0.00 179.25 178.16 1vd0 s ALA 91 N -4.81 2.25 0.12 0.00 0.00 -0.73 -4.66 121.76 113.92 1vd0 s ALA 91 Ca -0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 51.96 51.30 1vd0 s ALA 91 Cb 0.25 -4.27 -0.13 0.00 0.00 0.00 0.00 23.12 18.98 1vd0 s ALA 91 CO 0.85 -3.75 1.28 1.03 0.00 0.00 0.00 175.76 175.17 1vd0 h SER 92 N 14.74 0.64 -3.27 0.00 0.87 -1.86 -3.44 113.55 121.24 1vd0 h SER 92 Ca -0.27 -0.51 -0.62 0.00 -1.23 0.00 0.00 61.79 59.16 1vd0 h SER 92 Cb 1.16 -0.20 -0.16 0.00 -0.44 0.00 0.00 62.40 62.77 1vd0 h SER 92 CO 1.20 1.31 -0.56 -0.62 -0.53 0.00 0.00 176.83 177.62 1vd0 s ASP 93 N -7.14 5.66 0.44 6.23 -1.08 -1.26 -4.99 116.67 114.54 1vd0 s ASP 93 Ca -0.07 0.10 0.11 0.00 -0.52 0.00 0.00 52.55 52.17 1vd0 s ASP 93 Cb 0.08 -1.95 0.99 0.00 -1.46 0.00 0.00 42.92 40.58 1vd0 s ASP 93 CO 0.88 0.19 2.05 1.05 0.52 0.00 0.00 175.17 179.86 1vd0 h GLU 94 N 6.58 0.24 0.00 4.34 4.11 -2.02 -1.15 114.58 126.68 1vd0 h GLU 94 Ca -0.38 -0.03 -0.05 0.00 0.07 0.00 0.00 59.36 58.97 1vd0 h GLU 94 Cb 1.17 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1vd0 h GLU 94 CO 0.70 0.23 -0.25 1.15 0.07 0.00 0.00 179.01 180.91 1vd0 h THR 95 N 0.24 0.57 0.48 -1.06 2.02 -1.97 -2.55 112.91 110.65 1vd0 h THR 95 Ca 0.06 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.00 1vd0 h THR 95 Cb 0.10 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1vd0 h THR 95 CO -0.00 0.24 -0.23 0.50 0.37 0.00 0.00 175.52 176.40 1vd0 h LYS 96 N 0.00 -0.62 -0.26 6.66 1.63 -1.60 -2.36 116.57 120.02 1vd0 h LYS 96 Ca -0.00 0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.74 1vd0 h LYS 96 Cb 0.81 0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 32.58 1vd0 h LYS 96 CO 0.03 -0.38 -0.22 1.57 -3.45 0.00 0.00 179.45 177.00 1vd0 h LYS 97 N -0.70 0.61 -0.07 1.90 2.10 -1.60 -2.55 116.57 116.25 1vd0 h LYS 97 Ca -0.07 -0.31 0.02 0.00 -2.00 0.00 0.00 60.65 58.30 1vd0 h LYS 97 Cb 0.52 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.85 1vd0 h LYS 97 CO 0.11 0.90 0.35 0.00 -2.00 0.00 0.00 179.45 178.81 1vd0 h ARG 98 N 0.34 0.00 0.00 0.07 3.08 -1.44 0.30 114.38 116.73 1vd0 h ARG 98 Ca 0.05 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1vd0 h ARG 98 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1vd0 h ARG 98 CO 0.06 0.00 -0.35 2.41 -1.07 0.00 0.00 179.97 181.01 1vd0 n THR 99 N -3.05 2.03 0.30 2.04 -1.04 -0.89 -4.68 114.28 108.98 1vd0 n THR 99 Ca -0.00 -2.84 0.14 0.00 -2.04 0.00 0.00 64.05 59.30 1vd0 n THR 99 Cb 0.42 -0.20 0.41 0.00 -1.82 0.00 0.00 70.33 69.13 1vd0 n THR 99 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vd0 h ALA 100 N 0.67 1.00 -1.00 2.41 0.00 0.02 -3.08 119.26 119.28 1vd0 h ALA 100 Ca -0.01 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.38 1vd0 h ALA 100 Cb 1.03 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.51 1vd0 h ALA 100 CO 0.00 0.00 0.66 1.19 0.00 0.00 0.00 179.25 181.10 1vd0 n PHE 101 N -2.95 3.07 -2.31 0.00 3.72 -1.26 -3.19 117.46 114.55 1vd0 n PHE 101 Ca 0.03 -1.87 -0.43 0.00 -0.05 0.00 0.00 57.45 55.13 1vd0 n PHE 101 Cb 0.42 -0.96 -0.02 0.00 -0.94 0.00 0.00 39.48 37.98 1vd0 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vd0 s ALA 102 N -3.30 3.23 0.00 4.37 0.00 -1.16 -2.89 121.76 122.00 1vd0 s ALA 102 Ca 0.57 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.66 1vd0 s ALA 102 Cb 0.48 -3.85 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1vd0 s ALA 102 CO 0.11 -2.02 0.00 0.41 0.00 0.00 0.00 175.76 174.25 1vd0 n GLY 103 N 4.66 0.82 3.96 0.00 0.00 -1.26 -4.92 105.19 108.44 1vd0 n GLY 103 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.26 2.44 -2.02 2.61 -4.23 -1.14 -4.97 115.64 107.07 1vd0 s THR 104 Ca 0.00 -0.49 0.10 0.00 -1.18 0.00 0.00 61.69 60.12 1vd0 s THR 104 Cb 0.00 -2.94 0.28 0.00 1.34 0.00 0.00 72.50 71.18 1vd0 s THR 104 CO 0.00 0.00 1.37 0.00 -0.54 0.00 0.00 174.62 175.45 1vd0 n ALA 105 N -2.65 2.55 -2.40 3.99 0.00 -1.26 -4.82 120.51 115.91 1vd0 n ALA 105 Ca 0.09 -0.12 -0.39 0.00 0.00 0.00 0.00 53.44 53.03 1vd0 n ALA 105 Cb 0.60 -1.14 -0.06 0.00 0.00 0.00 0.00 19.45 18.85 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 -1.96 4.85 -0.26 0.00 1.01 -1.26 -3.99 121.20 119.59 1vd0 s ILE 106 Ca 0.16 1.21 -0.02 0.00 0.00 0.00 0.00 60.65 61.99 1vd0 s ILE 106 Cb 0.07 -3.91 0.08 0.00 0.01 0.00 0.00 42.46 38.72 1vd0 s ILE 106 CO 0.12 0.48 0.08 -0.44 0.00 0.00 0.00 174.94 175.18 1vd0 s SER 107 N -0.60 3.44 0.12 3.58 0.01 -1.23 -4.86 113.70 114.16 1vd0 s SER 107 Ca 0.30 -1.22 -0.03 0.00 1.31 0.00 0.00 55.95 56.31 1vd0 s SER 107 Cb -0.19 -0.63 -0.05 0.00 0.21 0.00 0.00 66.02 65.37 1vd0 s SER 107 CO 0.18 -0.38 0.33 -0.51 0.41 0.00 0.00 173.24 173.27 1vd0 s ILE 108 N 1.84 5.23 -0.30 1.44 2.07 -1.26 -3.71 121.20 126.50 1vd0 s ILE 108 Ca 0.05 -0.09 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 1vd0 s ILE 108 Cb -0.17 -3.63 0.02 0.00 0.13 0.00 0.00 42.46 38.81 1vd0 s ILE 108 CO -0.21 0.06 0.58 1.33 -1.91 0.00 0.00 174.94 174.79