#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 -0.41 -0.30 1.09 1.04 -1.26 -5.17 113.70 108.70 1vd0 s SER 2 Ca 0.00 0.24 -0.16 0.00 0.48 0.00 0.00 55.95 56.50 1vd0 s SER 2 Cb 0.00 0.38 0.18 0.00 0.10 0.00 0.00 66.02 66.68 1vd0 s SER 2 CO 0.00 -0.52 1.15 -1.59 0.98 0.00 0.00 173.24 173.25 1vd0 s LYS 3 N -2.15 0.17 -0.29 4.02 -2.85 -1.26 -5.17 119.74 112.21 1vd0 s LYS 3 Ca 0.00 0.33 -0.22 0.00 -1.00 0.00 0.00 55.97 55.09 1vd0 s LYS 3 Cb -0.01 0.09 0.17 0.00 -2.06 0.00 0.00 37.83 36.03 1vd0 s LYS 3 CO -0.03 -0.04 1.24 -2.00 0.10 0.00 0.00 175.35 174.62 1vd0 s GLU 4 N 1.49 0.22 -0.29 1.78 2.12 -1.26 -5.18 118.70 117.58 1vd0 s GLU 4 Ca -0.06 0.30 -0.22 0.00 0.36 0.00 0.00 54.97 55.34 1vd0 s GLU 4 Cb -0.03 0.09 0.15 0.00 0.26 0.00 0.00 34.13 34.60 1vd0 s GLU 4 CO -0.13 -0.03 1.14 -0.08 -0.54 0.00 0.00 175.26 175.62 1vd0 s THR 5 N 0.43 0.00 -0.29 -1.70 -1.32 -1.26 -5.17 115.64 106.33 1vd0 s THR 5 Ca 0.01 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.31 1vd0 s THR 5 Cb -0.04 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.09 1vd0 s THR 5 CO -0.12 0.00 1.02 0.12 -2.21 0.00 0.00 174.62 173.43 1vd0 s PHE 6 N 0.47 -0.51 -0.15 9.09 5.36 -1.26 -5.18 117.98 125.80 1vd0 s PHE 6 Ca 0.01 1.06 -0.28 0.00 -0.96 0.00 0.00 56.93 56.76 1vd0 s PHE 6 Cb -0.04 0.34 0.07 0.00 -0.34 0.00 0.00 43.02 43.05 1vd0 s PHE 6 CO -0.11 -0.25 0.72 -0.08 -1.46 0.00 0.00 175.22 174.04 1vd0 s THR 7 N 1.05 0.00 0.13 0.12 -1.32 -1.26 -5.18 115.64 109.18 1vd0 s THR 7 Ca -0.06 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 60.34 1vd0 s THR 7 Cb -0.04 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.94 1vd0 s THR 7 CO -0.13 0.00 0.21 -1.38 -2.21 0.00 0.00 174.62 171.11 1vd0 s HIS 8 N -0.49 0.37 -0.29 9.09 -3.43 -1.26 -5.17 115.29 114.11 1vd0 s HIS 8 Ca -0.06 -0.77 -0.13 0.00 -0.80 0.00 0.00 55.06 53.31 1vd0 s HIS 8 Cb -0.02 -0.12 0.11 0.00 -1.43 0.00 0.00 32.58 31.12 1vd0 s HIS 8 CO 0.05 -0.62 0.69 -0.47 -2.00 0.00 0.00 174.74 172.39 1vd0 s TYR 9 N -3.94 -1.19 -0.70 0.38 6.14 -1.26 -5.10 117.35 111.68 1vd0 s TYR 9 Ca 0.13 2.19 0.02 0.00 0.64 0.00 0.00 57.07 60.06 1vd0 s TYR 9 Cb 0.04 0.71 0.17 0.00 0.42 0.00 0.00 41.96 43.31 1vd0 s TYR 9 CO -0.04 -0.59 0.50 -0.65 0.64 0.00 0.00 175.55 175.41 1vd0 s GLN 10 N 2.31 2.55 -0.89 4.97 -0.21 -1.26 -5.04 119.66 122.10 1vd0 s GLN 10 Ca -0.08 -3.10 -0.25 0.00 0.02 0.00 0.00 55.36 51.96 1vd0 s GLN 10 Cb -0.09 -3.55 -0.05 0.00 1.00 0.00 0.00 33.01 30.32 1vd0 s GLN 10 CO -0.19 -1.23 1.94 -1.25 -2.12 0.00 0.00 175.29 172.44 1vd0 s PRO 11 N -1.05 2.56 -0.01 2.91 0.04 -1.26 -4.91 135.00 133.28 1vd0 s PRO 11 Ca 0.23 -0.26 -0.03 0.00 0.04 0.00 0.00 61.00 60.98 1vd0 s PRO 11 Cb -0.11 -5.04 0.00 0.00 0.04 0.00 0.00 34.50 29.39 1vd0 s PRO 11 CO -0.11 -3.35 0.07 -0.65 0.04 0.00 0.00 177.00 173.00 1vd0 s GLN 12 N 7.01 0.23 0.00 4.56 -0.21 -1.26 -4.96 119.66 125.02 1vd0 s GLN 12 Ca 0.70 -0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.92 1vd0 s GLN 12 Cb -0.07 0.09 0.00 0.00 1.00 0.00 0.00 33.01 34.04 1vd0 s GLN 12 CO -0.00 -0.04 0.00 0.41 -2.12 0.00 0.00 175.29 173.54 1vd0 n GLY 13 N 2.37 0.34 3.23 3.09 0.00 -1.26 -5.13 105.19 107.84 1vd0 n GLY 13 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1vd0 n GLY 13 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vd0 s ASN 14 N -0.34 5.08 0.28 1.61 0.01 -1.26 -5.10 114.94 115.22 1vd0 s ASN 14 Ca 0.00 -1.15 0.06 0.00 -0.71 0.00 0.00 52.86 51.06 1vd0 s ASN 14 Cb 0.00 -1.80 -0.03 0.00 0.41 0.00 0.00 41.25 39.84 1vd0 s ASN 14 CO 0.00 -0.28 0.32 -0.44 -1.51 0.00 0.00 177.10 175.19 1vd0 s SER 15 N 1.35 5.84 -0.01 -1.22 0.01 -1.26 -5.11 113.70 113.30 1vd0 s SER 15 Ca -0.03 -0.17 0.03 0.00 1.31 0.00 0.00 55.95 57.09 1vd0 s SER 15 Cb -0.19 -1.45 -0.01 0.00 0.21 0.00 0.00 66.02 64.58 1vd0 s SER 15 CO 0.01 -0.18 -0.11 1.51 0.41 0.00 0.00 173.24 174.88 1vd0 s ASP 16 N -3.98 1.25 0.00 2.44 1.47 -1.26 -5.01 116.67 111.57 1vd0 s ASP 16 Ca 0.37 -0.19 0.15 0.00 1.18 0.00 0.00 52.55 54.06 1vd0 s ASP 16 Cb -0.08 -0.15 0.86 0.00 -0.34 0.00 0.00 42.92 43.20 1vd0 s ASP 16 CO 0.28 0.13 1.37 -0.81 0.68 0.00 0.00 175.17 176.82 1vd0 n PRO 17 N 2.85 0.37 -3.72 2.11 -0.04 -1.26 -4.74 135.00 130.57 1vd0 n PRO 17 Ca -0.14 0.06 -0.22 0.00 -0.04 0.00 0.00 63.50 63.17 1vd0 n PRO 17 Cb 0.56 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.51 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 -2.24 3.89 -0.40 0.55 0.00 -1.26 -5.00 121.76 117.30 1vd0 s ALA 18 Ca 0.20 -1.16 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 1vd0 s ALA 18 Cb 0.10 -1.84 0.28 0.00 0.00 0.00 0.00 23.12 21.67 1vd0 s ALA 18 CO 0.20 0.11 2.00 0.72 0.00 0.00 0.00 175.76 178.79 1vd0 n HIS 19 N -1.56 1.99 -4.23 0.00 8.25 -1.26 -4.90 115.22 113.50 1vd0 n HIS 19 Ca -0.06 -2.20 -0.13 0.00 -0.26 0.00 0.00 57.72 55.06 1vd0 n HIS 19 Cb 0.57 -1.07 -0.10 0.00 1.12 0.00 0.00 29.99 30.51 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 -2.92 0.80 0.12 1.59 -4.23 -1.26 -3.48 115.64 106.26 1vd0 s THR 20 Ca 0.40 -1.99 0.06 0.00 -1.18 0.00 0.00 61.69 58.97 1vd0 s THR 20 Cb 0.31 -1.98 -0.04 0.00 1.34 0.00 0.00 72.50 72.13 1vd0 s THR 20 CO -0.00 -0.61 0.00 0.00 -0.54 0.00 0.00 174.62 173.47 1vd0 s ALA 21 N -3.57 3.27 -0.25 3.99 0.00 -0.63 -4.93 121.76 119.65 1vd0 s ALA 21 Ca 0.20 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.99 1vd0 s ALA 21 Cb 0.05 -1.14 0.06 0.00 0.00 0.00 0.00 23.12 22.09 1vd0 s ALA 21 CO 0.02 0.63 -0.10 0.95 0.00 0.00 0.00 175.76 177.26 1vd0 s THR 22 N -1.43 1.97 0.30 0.00 -4.23 -1.26 -2.77 115.64 108.23 1vd0 s THR 22 Ca 0.26 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 1vd0 s THR 22 Cb -0.11 -2.11 -0.04 0.00 1.34 0.00 0.00 72.50 71.59 1vd0 s THR 22 CO 0.18 -0.01 0.50 0.00 -0.54 0.00 0.00 174.62 174.75 1vd0 s ALA 23 N 1.20 3.74 -2.00 3.99 0.00 -0.77 -4.89 121.76 123.03 1vd0 s ALA 23 Ca -0.07 -0.89 0.10 0.00 0.00 0.00 0.00 51.96 51.10 1vd0 s ALA 23 Cb -0.19 -2.07 0.62 0.00 0.00 0.00 0.00 23.12 21.49 1vd0 s ALA 23 CO -0.06 0.13 1.06 -0.35 0.00 0.00 0.00 175.76 176.54 1vd0 n PRO 24 N -1.42 0.49 -1.40 0.00 -0.04 -1.26 -1.98 135.00 129.38 1vd0 n PRO 24 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1vd0 n PRO 24 Cb 0.56 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 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 -4.10 0.00 0.55 0.00 -1.20 -4.32 105.19 96.11 1vd0 n GLY 25 Ca 0.08 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 0.73 -0.19 3.31 -0.02 0.00 0.22 -4.68 105.19 104.57 1vd0 n GLY 26 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1vd0 n GLY 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vd0 n LEU 27 N -0.09 -2.11 -0.20 0.99 7.99 -1.06 -4.51 117.00 118.01 1vd0 n LEU 27 Ca 0.00 0.62 0.05 0.00 -0.01 0.00 0.00 56.01 56.67 1vd0 n LEU 27 Cb 0.23 -0.98 -0.01 0.00 -0.11 0.00 0.00 43.42 42.56 1vd0 n LEU 27 CO 0.00 -4.22 0.19 -0.24 -1.51 0.00 0.00 177.39 171.60 1vd0 n SER 28 N 1.68 1.13 -2.25 -1.43 2.88 -1.26 -4.37 113.62 110.00 1vd0 n SER 28 Ca 0.08 -1.06 -0.02 0.00 -1.33 0.00 0.00 58.87 56.54 1vd0 n SER 28 Cb 0.48 0.53 0.01 0.00 -0.75 0.00 0.00 64.21 64.49 1vd0 n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vd0 n ALA 29 N -0.37 -1.46 -2.38 -1.46 0.00 -1.26 -4.70 120.51 108.88 1vd0 n ALA 29 Ca 0.04 -0.55 -0.42 0.00 0.00 0.00 0.00 53.44 52.50 1vd0 n ALA 29 Cb 0.20 0.31 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1vd0 n ALA 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1vd0 s LYS 30 N -2.03 4.30 -0.04 0.00 0.00 -1.26 -1.42 119.74 119.29 1vd0 s LYS 30 Ca 0.12 1.75 -0.01 0.00 0.00 0.00 0.00 55.97 57.83 1vd0 s LYS 30 Cb -0.02 -3.63 0.03 0.00 0.00 0.00 0.00 37.83 34.21 1vd0 s LYS 30 CO 0.03 -0.56 0.04 0.00 0.00 0.00 0.00 175.35 174.86 1vd0 s ALA 31 N 2.67 0.27 0.71 0.59 0.00 0.24 -4.97 121.76 121.26 1vd0 s ALA 31 Ca 0.58 0.17 -0.13 0.00 0.00 0.00 0.00 51.96 52.58 1vd0 s ALA 31 Cb -0.26 -0.53 0.03 0.00 0.00 0.00 0.00 23.12 22.36 1vd0 s ALA 31 CO 0.21 -0.36 1.10 -1.25 0.00 0.00 0.00 175.76 175.46 1vd0 s PRO 32 N 1.80 2.54 0.66 0.00 0.04 -1.26 -0.94 135.00 137.85 1vd0 s PRO 32 Ca 0.01 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.23 1vd0 s PRO 32 Cb -0.12 -1.92 0.17 0.00 0.04 0.00 0.00 34.50 32.66 1vd0 s PRO 32 CO -0.03 -1.44 0.48 0.00 0.04 0.00 0.00 177.00 176.05 1vd0 n ALA 33 N -2.93 -2.15 -3.31 8.56 0.00 -1.26 -4.43 120.51 114.99 1vd0 n ALA 33 Ca 0.10 -0.77 -0.16 0.00 0.00 0.00 0.00 53.44 52.61 1vd0 n ALA 33 Cb 0.52 -0.06 0.08 0.00 0.00 0.00 0.00 19.45 19.99 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 -3.52 -5.80 -3.64 0.00 2.81 0.96 -4.74 117.12 103.19 1vd0 n MET 34 Ca 0.07 0.79 -0.15 0.00 -1.81 0.00 0.00 57.70 56.61 1vd0 n MET 34 Cb 0.29 -5.63 -0.08 0.00 -0.71 0.00 0.00 33.22 27.09 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 -3.34 0.00 0.52 2.03 -4.23 -1.23 -0.01 115.64 109.38 1vd0 s THR 35 Ca 0.04 -0.04 -0.20 0.00 -1.18 0.00 0.00 61.69 60.31 1vd0 s THR 35 Cb -0.01 -0.88 -0.06 0.00 1.34 0.00 0.00 72.50 72.89 1vd0 s THR 35 CO 0.68 -0.02 1.14 -2.16 -0.54 0.00 0.00 174.62 173.72 1vd0 s PRO 36 N -0.17 3.47 0.36 3.99 0.04 -1.26 -0.19 135.00 141.24 1vd0 s PRO 36 Ca -0.04 1.66 0.05 0.00 0.04 0.00 0.00 61.00 62.71 1vd0 s PRO 36 Cb -0.03 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.32 1vd0 s PRO 36 CO 0.03 -0.77 0.04 -0.51 0.04 0.00 0.00 177.00 175.83 1vd0 s LEU 37 N -3.58 2.48 -0.03 -3.56 1.43 0.99 -2.70 118.68 113.71 1vd0 s LEU 37 Ca 0.70 -1.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 1vd0 s LEU 37 Cb -0.25 -0.61 0.03 0.00 0.03 0.00 0.00 46.19 45.39 1vd0 s LEU 37 CO 0.29 -0.53 0.00 0.00 0.23 0.00 0.00 176.35 176.34 1vd0 s MET 38 N -3.81 0.27 0.14 1.70 0.23 0.77 -1.30 119.30 117.30 1vd0 s MET 38 Ca 0.36 0.08 -0.30 0.00 -1.03 0.00 0.00 55.69 54.79 1vd0 s MET 38 Cb 0.09 -0.45 -0.07 0.00 -1.53 0.00 0.00 34.83 32.87 1vd0 s MET 38 CO 0.17 -0.13 1.19 -0.51 -2.03 0.00 0.00 175.02 173.70 1vd0 s LEU 39 N 0.99 4.43 -0.22 0.18 1.43 -1.26 -1.39 118.68 122.83 1vd0 s LEU 39 Ca -0.10 2.14 -0.17 0.00 -1.03 0.00 0.00 54.13 54.97 1vd0 s LEU 39 Cb -0.13 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 1vd0 s LEU 39 CO -0.02 -0.39 0.46 -0.62 0.23 0.00 0.00 176.35 176.01 1vd0 s ASP 40 N 0.43 6.45 -0.17 2.29 -1.08 0.38 -4.90 116.67 120.06 1vd0 s ASP 40 Ca 0.55 0.53 0.02 0.00 -0.52 0.00 0.00 52.55 53.13 1vd0 s ASP 40 Cb -0.31 -2.26 0.28 0.00 -1.46 0.00 0.00 42.92 39.17 1vd0 s ASP 40 CO 0.34 -0.17 1.33 1.07 0.52 0.00 0.00 175.17 178.25 1vd0 n THR 41 N 4.71 1.81 -0.10 1.71 5.66 -1.26 -2.96 114.28 123.85 1vd0 n THR 41 Ca -0.06 -0.76 -0.13 0.00 -3.05 0.00 0.00 64.05 60.04 1vd0 n THR 41 Cb 0.50 -0.74 -0.04 0.00 -1.55 0.00 0.00 70.33 68.51 1vd0 n THR 41 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1vd0 n SER 42 N -0.12 1.93 -0.08 1.09 2.88 -1.26 -4.75 113.62 113.31 1vd0 n SER 42 Ca 0.23 0.33 0.06 0.00 -1.33 0.00 0.00 58.87 58.16 1vd0 n SER 42 Cb 0.94 -0.75 0.08 0.00 -0.75 0.00 0.00 64.21 63.74 1vd0 n SER 42 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1vd0 n SER 43 N -4.40 1.99 -3.15 -3.46 2.88 -1.26 -4.99 113.62 101.23 1vd0 n SER 43 Ca -0.22 -2.61 -0.15 0.00 -1.33 0.00 0.00 58.87 54.55 1vd0 n SER 43 Cb 0.59 -0.27 0.08 0.00 -0.75 0.00 0.00 64.21 63.86 1vd0 n SER 43 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1vd0 n ARG 44 N -1.01 -5.51 -4.29 -1.46 1.74 -1.16 -5.03 116.66 99.94 1vd0 n ARG 44 Ca 0.10 0.76 -0.18 0.00 -0.77 0.00 0.00 57.85 57.75 1vd0 n ARG 44 Cb 0.53 -5.48 -0.14 0.00 -1.02 0.00 0.00 32.46 26.35 1vd0 n ARG 44 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1vd0 s LYS 45 N -5.11 0.69 -0.11 5.56 -0.14 -1.17 -4.77 119.74 114.70 1vd0 s LYS 45 Ca 0.04 -0.44 -0.24 0.00 -1.36 0.00 0.00 55.97 53.97 1vd0 s LYS 45 Cb -0.01 -0.65 -0.03 0.00 -1.68 0.00 0.00 37.83 35.47 1vd0 s LYS 45 CO 0.65 0.17 0.75 -1.17 -0.76 0.00 0.00 175.35 174.99 1vd0 s LEU 46 N -0.54 4.26 0.14 3.17 0.20 -1.26 -0.47 118.68 124.18 1vd0 s LEU 46 Ca 0.01 1.18 0.07 0.00 0.69 0.00 0.00 54.13 56.07 1vd0 s LEU 46 Cb -0.05 -3.14 -0.04 0.00 -0.43 0.00 0.00 46.19 42.53 1vd0 s LEU 46 CO 0.00 -0.23 -0.15 0.68 -0.29 0.00 0.00 176.35 176.37 1vd0 s VAL 47 N 1.33 1.46 0.67 1.68 -7.23 -0.48 0.71 120.40 118.55 1vd0 s VAL 47 Ca 0.38 -1.85 -0.17 0.00 -1.81 0.00 0.00 61.98 58.53 1vd0 s VAL 47 Cb -0.17 -1.69 -0.07 0.00 0.56 0.00 0.00 36.38 35.01 1vd0 s VAL 47 CO 0.16 -0.45 0.38 0.00 -0.31 0.00 0.00 175.10 174.89 1vd0 n ALA 48 N 0.30 -1.81 -1.77 1.32 0.00 -1.26 -0.17 120.51 117.14 1vd0 n ALA 48 Ca -0.14 -0.19 -0.39 0.00 0.00 0.00 0.00 53.44 52.73 1vd0 n ALA 48 Cb 0.58 -1.76 -0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.88 2.80 0.07 0.00 -0.00 -1.10 -4.19 118.94 114.65 1vd0 s TRP 49 Ca 0.64 1.45 -0.16 0.00 -0.00 0.00 0.00 56.10 58.03 1vd0 s TRP 49 Cb -0.38 -3.60 -0.14 0.00 -0.00 0.00 0.00 33.47 29.36 1vd0 s TRP 49 CO 0.59 -1.97 1.32 0.22 -0.00 0.00 0.00 176.95 177.11 1vd0 h ASP 50 N 2.43 0.71 0.00 5.86 1.82 -1.91 -3.48 116.42 121.85 1vd0 h ASP 50 Ca -0.50 -0.56 0.00 0.00 -0.39 0.00 0.00 57.03 55.58 1vd0 h ASP 50 Cb 1.25 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 41.06 1vd0 h ASP 50 CO 0.62 1.15 0.00 0.61 -1.61 0.00 0.00 179.24 180.00 1vd0 n GLY 51 N 0.46 2.81 0.11 -0.78 0.00 -1.26 -4.63 105.19 101.90 1vd0 n GLY 51 Ca -0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.50 1.17 -1.90 2.61 -2.24 -1.26 -2.58 114.28 108.57 1vd0 n THR 52 Ca 0.00 -0.44 -0.43 0.00 -2.27 0.00 0.00 64.05 60.91 1vd0 n THR 52 Cb 0.00 -1.25 -0.03 0.00 -2.10 0.00 0.00 70.33 66.96 1vd0 n THR 52 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1vd0 s THR 53 N -2.41 3.37 0.41 4.28 2.01 -1.26 -4.96 115.64 117.08 1vd0 s THR 53 Ca -0.27 0.40 -0.24 0.00 0.31 0.00 0.00 61.69 61.88 1vd0 s THR 53 Cb 0.07 -3.46 -0.09 0.00 0.01 0.00 0.00 72.50 69.04 1vd0 s THR 53 CO 0.46 -0.26 1.07 -0.62 -0.69 0.00 0.00 174.62 174.59 1vd0 s ASP 54 N 6.14 6.65 -1.93 3.53 2.15 -1.26 -3.26 116.67 128.69 1vd0 s ASP 54 Ca 0.84 2.08 0.00 0.00 0.43 0.00 0.00 52.55 55.90 1vd0 s ASP 54 Cb -0.27 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.76 1vd0 s ASP 54 CO 0.34 -0.57 0.00 0.61 -0.17 0.00 0.00 175.17 175.38 1vd0 n GLY 55 N 0.34 0.53 0.10 2.66 0.00 -1.21 -4.85 105.19 102.75 1vd0 n GLY 55 Ca 0.05 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1vd0 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vd0 n ALA 56 N -0.60 1.46 -1.62 4.61 0.00 -1.20 -4.89 120.51 118.27 1vd0 n ALA 56 Ca -0.23 -1.05 -0.43 0.00 0.00 0.00 0.00 53.44 51.74 1vd0 n ALA 56 Cb 0.68 -0.48 -0.03 0.00 0.00 0.00 0.00 19.45 19.62 1vd0 n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vd0 s ALA 57 N -2.54 2.96 -0.17 0.00 0.00 -1.25 -4.51 121.76 116.24 1vd0 s ALA 57 Ca -0.10 0.93 0.03 0.00 0.00 0.00 0.00 51.96 52.82 1vd0 s ALA 57 Cb 0.07 -4.01 -0.22 0.00 0.00 0.00 0.00 23.12 18.95 1vd0 s ALA 57 CO 0.81 -2.47 0.16 1.33 0.00 0.00 0.00 175.76 175.59 1vd0 n VAL 58 N 7.15 1.60 -3.99 0.00 0.24 -0.42 -4.52 118.33 118.40 1vd0 n VAL 58 Ca 0.27 -0.68 -0.11 0.00 -2.04 0.00 0.00 64.34 61.78 1vd0 n VAL 58 Cb 0.44 -1.33 -0.03 0.00 -1.47 0.00 0.00 33.84 31.44 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 -5.82 0.85 -0.18 7.63 0.00 -1.25 -4.91 107.32 103.63 1vd0 s GLY 59 Ca -0.22 -1.08 -0.00 0.00 0.00 0.00 0.00 44.72 43.41 1vd0 s GLY 59 CO 0.73 -0.68 -0.15 -0.42 0.00 0.00 0.00 173.10 172.57 1vd0 s ILE 60 N -3.25 2.49 0.02 0.90 1.01 -1.26 -0.01 121.20 121.10 1vd0 s ILE 60 Ca 0.24 -0.80 -0.30 0.00 0.00 0.00 0.00 60.65 59.79 1vd0 s ILE 60 Cb -0.02 -2.07 -0.08 0.00 0.01 0.00 0.00 42.46 40.30 1vd0 s ILE 60 CO 0.14 0.51 1.90 -0.22 0.00 0.00 0.00 174.94 177.27 1vd0 s LEU 61 N 1.25 4.41 -0.04 2.97 0.20 0.73 -0.86 118.68 127.34 1vd0 s LEU 61 Ca 0.03 2.59 -0.23 0.00 0.69 0.00 0.00 54.13 57.21 1vd0 s LEU 61 Cb -0.14 -3.53 -0.25 0.00 -0.43 0.00 0.00 46.19 41.84 1vd0 s LEU 61 CO -0.08 -1.03 1.02 0.00 -0.29 0.00 0.00 176.35 175.97 1vd0 h ALA 62 N 10.32 0.03 -2.90 5.97 0.00 -1.81 0.27 119.26 131.14 1vd0 h ALA 62 Ca -0.47 -0.53 -0.60 0.00 0.00 0.00 0.00 54.91 53.31 1vd0 h ALA 62 Cb 1.23 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 1vd0 h ALA 62 CO 0.94 0.19 -0.61 0.08 0.00 0.00 0.00 179.25 179.86 1vd0 s VAL 63 N -3.01 4.20 0.15 0.00 1.01 -1.25 -4.15 120.40 117.36 1vd0 s VAL 63 Ca -0.15 -1.14 -0.31 0.00 0.00 0.00 0.00 61.98 60.39 1vd0 s VAL 63 Cb 0.01 -3.10 -0.09 0.00 0.00 0.00 0.00 36.38 33.21 1vd0 s VAL 63 CO 0.77 -0.05 1.41 0.00 0.00 0.00 0.00 175.10 177.23 1vd0 s ALA 64 N -1.64 3.62 0.46 5.51 0.00 -1.26 -4.15 121.76 124.29 1vd0 s ALA 64 Ca 0.29 1.18 0.03 0.00 0.00 0.00 0.00 51.96 53.46 1vd0 s ALA 64 Cb -0.10 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.46 1vd0 s ALA 64 CO 0.21 -0.64 0.09 0.00 0.00 0.00 0.00 175.76 175.42 1vd0 s ALA 65 N 0.84 3.42 0.33 0.00 0.00 -0.11 -4.83 121.76 121.42 1vd0 s ALA 65 Ca 0.64 -0.83 -0.13 0.00 0.00 0.00 0.00 51.96 51.64 1vd0 s ALA 65 Cb -0.38 0.50 0.03 0.00 0.00 0.00 0.00 23.12 23.26 1vd0 s ALA 65 CO 0.33 -0.23 0.65 0.16 0.00 0.00 0.00 175.76 176.68 1vd0 s ASP 66 N -3.72 0.15 0.24 0.00 1.47 -1.26 -0.60 116.67 112.96 1vd0 s ASP 66 Ca 0.16 -1.09 0.17 0.00 1.18 0.00 0.00 52.55 52.96 1vd0 s ASP 66 Cb 0.01 0.74 0.89 0.00 -0.34 0.00 0.00 42.92 44.23 1vd0 s ASP 66 CO 0.10 -1.45 1.51 0.00 0.68 0.00 0.00 175.17 176.01 1vd0 n GLN 67 N -0.50 0.11 0.00 2.11 0.00 -0.51 -0.07 117.38 118.52 1vd0 n GLN 67 Ca -0.04 0.60 0.13 0.00 0.00 0.00 0.00 57.00 57.68 1vd0 n GLN 67 Cb 0.60 -1.85 0.26 0.00 0.00 0.00 0.00 30.24 29.26 1vd0 n GLN 67 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1vd0 n THR 68 N -2.07 0.00 -2.63 -0.39 5.66 -1.26 -4.83 114.28 108.75 1vd0 n THR 68 Ca -0.01 -0.32 -0.42 0.00 -3.05 0.00 0.00 64.05 60.24 1vd0 n THR 68 Cb 0.03 0.97 -0.03 0.00 -1.55 0.00 0.00 70.33 69.75 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 -2.15 7.22 0.01 1.09 0.01 0.90 -4.92 113.70 115.86 1vd0 s SER 69 Ca 0.29 1.63 0.23 0.00 1.31 0.00 0.00 55.95 59.41 1vd0 s SER 69 Cb 0.20 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.93 1vd0 s SER 69 CO 0.39 -0.45 1.08 0.41 0.41 0.00 0.00 173.24 175.08 1vd0 n THR 70 N 4.43 0.04 -3.68 1.44 -1.04 -1.26 -4.50 114.28 109.70 1vd0 n THR 70 Ca 0.09 -0.07 -0.14 0.00 -2.04 0.00 0.00 64.05 61.89 1vd0 n THR 70 Cb 0.48 0.56 -0.13 0.00 -1.82 0.00 0.00 70.33 69.42 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 -3.06 -0.28 -0.13 12.58 2.01 -1.26 -3.21 115.64 122.30 1vd0 s THR 71 Ca 0.08 0.25 -0.04 0.00 0.31 0.00 0.00 61.69 62.28 1vd0 s THR 71 Cb 0.16 -0.40 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 1vd0 s THR 71 CO 0.80 0.10 0.01 -0.76 -0.69 0.00 0.00 174.62 174.09 1vd0 s LEU 72 N 2.03 3.59 -0.62 4.42 1.43 -0.84 -4.87 118.68 123.82 1vd0 s LEU 72 Ca -0.02 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.15 1vd0 s LEU 72 Cb -0.12 -1.86 0.16 0.00 0.03 0.00 0.00 46.19 44.41 1vd0 s LEU 72 CO -0.08 0.27 0.41 -0.89 0.23 0.00 0.00 176.35 176.30 1vd0 s THR 73 N -0.25 3.39 0.31 5.49 2.01 -1.26 -1.84 115.64 123.49 1vd0 s THR 73 Ca 0.06 -3.20 0.07 0.00 0.31 0.00 0.00 61.69 58.93 1vd0 s THR 73 Cb -0.12 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 1vd0 s THR 73 CO 0.02 -0.88 0.25 0.72 -0.69 0.00 0.00 174.62 174.04 1vd0 s PHE 74 N -0.30 2.94 0.78 4.92 -0.71 -1.11 -2.48 117.98 122.02 1vd0 s PHE 74 Ca 0.18 -0.25 -0.11 0.00 -1.04 0.00 0.00 56.93 55.71 1vd0 s PHE 74 Cb -0.20 -1.66 0.06 0.00 -1.21 0.00 0.00 43.02 40.00 1vd0 s PHE 74 CO -0.03 0.30 1.08 0.71 -1.34 0.00 0.00 175.22 175.94 1vd0 s TYR 75 N -2.27 2.81 -0.16 3.49 2.02 -0.04 -1.61 117.35 121.61 1vd0 s TYR 75 Ca 0.38 1.29 0.14 0.00 -0.37 0.00 0.00 57.07 58.51 1vd0 s TYR 75 Cb -0.06 -3.05 -0.19 0.00 -0.40 0.00 0.00 41.96 38.26 1vd0 s TYR 75 CO 0.26 -1.70 0.05 0.36 -1.57 0.00 0.00 175.55 172.94 1vd0 n LYS 76 N -3.42 1.38 -3.27 -0.62 -0.00 -1.23 -4.02 118.16 106.99 1vd0 n LYS 76 Ca 0.07 -0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.39 1vd0 n LYS 76 Cb 0.55 -1.41 0.01 0.00 -0.00 0.00 0.00 35.03 34.18 1vd0 n LYS 76 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1vd0 n SER 77 N -2.61 -0.93 0.00 -5.58 3.41 -1.26 -4.50 113.62 102.16 1vd0 n SER 77 Ca -0.26 -1.29 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 1vd0 n SER 77 Cb 1.01 1.46 0.00 0.00 -0.26 0.00 0.00 64.21 66.42 1vd0 n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vd0 n GLY 78 N -0.60 2.41 3.63 5.00 0.00 -1.25 -4.96 105.19 109.42 1vd0 n GLY 78 Ca 0.02 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 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 -2.08 4.68 0.09 2.61 2.01 -1.26 -2.77 115.64 118.93 1vd0 s THR 79 Ca 0.00 1.50 0.09 0.00 0.31 0.00 0.00 61.69 63.59 1vd0 s THR 79 Cb 0.00 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 1vd0 s THR 79 CO 0.00 -0.32 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.04 1vd0 s PHE 80 N 3.23 2.46 -0.03 4.92 0.40 -1.11 -5.04 117.98 122.81 1vd0 s PHE 80 Ca 0.39 -0.31 -0.29 0.00 -0.60 0.00 0.00 56.93 56.11 1vd0 s PHE 80 Cb -0.14 -1.36 -0.03 0.00 0.51 0.00 0.00 43.02 42.01 1vd0 s PHE 80 CO 0.12 0.31 0.96 1.03 0.70 0.00 0.00 175.22 178.34 1vd0 s ARG 81 N -1.84 4.51 0.16 0.44 3.00 -1.26 -2.91 118.95 121.05 1vd0 s ARG 81 Ca 0.15 1.36 0.06 0.00 0.00 0.00 0.00 55.73 57.30 1vd0 s ARG 81 Cb -0.10 -3.48 -0.04 0.00 0.00 0.00 0.00 34.95 31.33 1vd0 s ARG 81 CO 0.07 -0.11 1.37 -0.92 0.00 0.00 0.00 175.30 175.71 1vd0 h TYR 82 N 6.88 0.11 0.00 -0.53 5.03 -1.89 -2.44 116.97 124.13 1vd0 h TYR 82 Ca -0.38 -0.07 -0.09 0.00 2.58 0.00 0.00 58.73 60.77 1vd0 h TYR 82 Cb 1.20 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 39.46 1vd0 h TYR 82 CO 0.69 0.93 -0.41 1.05 -1.32 0.00 0.00 178.16 179.09 1vd0 h GLU 83 N 0.03 0.00 0.00 1.82 4.11 -1.92 -3.26 114.58 115.36 1vd0 h GLU 83 Ca -0.03 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.35 1vd0 h GLU 83 Cb 1.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.81 1vd0 h GLU 83 CO 0.12 0.41 -0.30 0.22 0.07 0.00 0.00 179.01 179.54 1vd0 h ASP 84 N 0.00 0.00 -1.81 3.06 1.82 -1.96 -3.46 116.42 114.06 1vd0 h ASP 84 Ca -0.00 -0.70 -0.66 0.00 -0.39 0.00 0.00 57.03 55.27 1vd0 h ASP 84 Cb 0.83 0.00 0.07 0.00 0.68 0.00 0.00 39.33 40.91 1vd0 h ASP 84 CO 0.05 1.02 0.37 0.52 -1.61 0.00 0.00 179.24 179.59 1vd0 n VAL 85 N -4.60 0.44 -2.37 2.25 0.31 -0.92 -4.85 118.33 108.58 1vd0 n VAL 85 Ca -0.13 -0.11 -0.42 0.00 -0.01 0.00 0.00 64.34 63.67 1vd0 n VAL 85 Cb 0.44 -0.84 0.00 0.00 -0.91 0.00 0.00 33.84 32.54 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 2.28 6.81 -4.58 7.52 7.94 0.98 -4.94 117.00 133.01 1vd0 n LEU 86 Ca 0.17 -4.75 -0.36 0.00 -1.11 0.00 0.00 56.01 49.96 1vd0 n LEU 86 Cb 0.22 -1.44 0.08 0.00 0.53 0.00 0.00 43.42 42.81 1vd0 n LEU 86 CO 0.62 1.51 0.42 0.79 -1.11 0.00 0.00 177.39 179.62 1vd0 n TRP 87 N 3.27 0.35 -2.25 1.96 7.02 -1.26 -4.78 117.44 121.74 1vd0 n TRP 87 Ca 0.41 0.39 -0.37 0.00 -1.02 0.00 0.00 57.50 56.91 1vd0 n TRP 87 Cb 0.34 -2.05 -0.01 0.00 -2.42 0.00 0.00 31.31 27.17 1vd0 n TRP 87 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 1vd0 s PRO 88 N -3.08 3.78 0.33 -0.99 0.04 -1.26 -4.94 135.00 128.87 1vd0 s PRO 88 Ca 0.72 1.79 0.04 0.00 0.04 0.00 0.00 61.00 63.59 1vd0 s PRO 88 Cb -0.36 -2.43 0.57 0.00 0.04 0.00 0.00 34.50 32.32 1vd0 s PRO 88 CO 0.51 -0.54 1.85 1.05 0.04 0.00 0.00 177.00 179.91 1vd0 h GLU 89 N 2.10 0.50 -0.70 4.56 9.09 -1.92 -3.05 114.58 125.16 1vd0 h GLU 89 Ca -0.49 -0.12 0.28 0.00 0.05 0.00 0.00 59.36 59.08 1vd0 h GLU 89 Cb 1.25 -0.06 -0.13 0.00 -1.65 0.00 0.00 28.75 28.16 1vd0 h GLU 89 CO 0.60 0.57 0.35 0.00 0.05 0.00 0.00 179.01 180.58 1vd0 n ALA 90 N -2.48 0.69 -2.17 1.06 0.00 -1.26 -4.01 120.51 112.34 1vd0 n ALA 90 Ca 0.01 0.71 -0.43 0.00 0.00 0.00 0.00 53.44 53.73 1vd0 n ALA 90 Cb 0.28 -0.70 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 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 -5.10 3.34 0.02 0.00 0.00 -1.06 -4.68 121.76 114.28 1vd0 s ALA 91 Ca -0.06 0.46 0.10 0.00 0.00 0.00 0.00 51.96 52.46 1vd0 s ALA 91 Cb 0.23 -3.82 -0.17 0.00 0.00 0.00 0.00 23.12 19.37 1vd0 s ALA 91 CO 0.54 -1.82 1.12 0.77 0.00 0.00 0.00 175.76 176.37 1vd0 h SER 92 N 10.26 0.00 -3.42 0.00 0.02 -1.85 -3.45 113.55 115.11 1vd0 h SER 92 Ca -0.33 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.02 1vd0 h SER 92 Cb 1.14 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.56 1vd0 h SER 92 CO 1.00 0.89 -0.41 -0.62 -1.14 0.00 0.00 176.83 176.56 1vd0 s ASP 93 N -6.45 6.27 0.62 3.07 -1.08 -1.26 -4.96 116.67 112.88 1vd0 s ASP 93 Ca -0.00 0.30 0.39 0.00 -0.52 0.00 0.00 52.55 52.72 1vd0 s ASP 93 Cb 0.09 -2.14 2.06 0.00 -1.46 0.00 0.00 42.92 41.47 1vd0 s ASP 93 CO 0.81 0.08 2.25 1.05 0.52 0.00 0.00 175.17 179.88 1vd0 h GLU 94 N 7.08 0.00 0.00 4.34 4.11 -2.02 -0.53 114.58 127.57 1vd0 h GLU 94 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.04 1vd0 h GLU 94 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1vd0 h GLU 94 CO 0.72 0.01 -0.50 1.15 0.07 0.00 0.00 179.01 180.46 1vd0 h THR 95 N 0.00 0.00 0.25 -1.06 2.02 -1.98 -3.31 112.91 108.83 1vd0 h THR 95 Ca -0.00 -0.85 -0.01 0.00 0.77 0.00 0.00 66.41 66.32 1vd0 h THR 95 Cb 0.14 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1vd0 h THR 95 CO 0.00 0.00 -0.12 0.50 0.37 0.00 0.00 175.52 176.27 1vd0 h LYS 96 N 0.00 -0.33 0.78 6.66 1.63 -1.46 0.09 116.57 123.94 1vd0 h LYS 96 Ca 0.00 0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.78 1vd0 h LYS 96 Cb 0.92 0.07 0.01 0.00 -0.60 0.00 0.00 32.23 32.64 1vd0 h LYS 96 CO 0.00 -0.09 -0.37 1.57 -3.45 0.00 0.00 179.45 177.11 1vd0 h LYS 97 N -0.53 -1.01 -0.02 1.90 -0.00 -1.70 -0.05 116.57 115.16 1vd0 h LYS 97 Ca -0.03 0.07 0.01 0.00 -0.00 0.00 0.00 60.65 60.69 1vd0 h LYS 97 Cb 0.39 0.23 -0.00 0.00 -0.00 0.00 0.00 32.23 32.85 1vd0 h LYS 97 CO 0.06 -0.67 0.11 0.07 -0.00 0.00 0.00 179.45 179.02 1vd0 h ARG 98 N -1.06 0.00 -0.56 0.07 -0.00 -1.65 0.30 114.38 111.49 1vd0 h ARG 98 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.87 1vd0 h ARG 98 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.77 1vd0 h ARG 98 CO 0.18 0.00 0.00 2.41 -0.00 0.00 0.00 179.97 182.56 1vd0 n THR 99 N -3.17 1.60 0.11 0.08 -1.04 0.02 -4.38 114.28 107.50 1vd0 n THR 99 Ca -0.02 -1.21 -0.03 0.00 -2.04 0.00 0.00 64.05 60.75 1vd0 n THR 99 Cb 0.18 0.22 0.08 0.00 -1.82 0.00 0.00 70.33 68.99 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 3.48 0.78 -0.75 2.41 0.00 0.15 -3.11 119.26 122.22 1vd0 h ALA 100 Ca 0.00 -0.66 -0.40 0.00 0.00 0.00 0.00 54.91 53.84 1vd0 h ALA 100 Cb 1.24 -0.12 -0.23 0.00 0.00 0.00 0.00 17.79 18.68 1vd0 h ALA 100 CO 0.15 0.91 0.51 1.19 0.00 0.00 0.00 179.25 182.02 1vd0 n PHE 101 N -3.66 2.34 -2.12 0.00 3.72 -1.26 -3.36 117.46 113.12 1vd0 n PHE 101 Ca -0.01 -1.61 -0.42 0.00 -0.05 0.00 0.00 57.45 55.36 1vd0 n PHE 101 Cb 0.71 -0.82 -0.03 0.00 -0.94 0.00 0.00 39.48 38.41 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 -2.53 3.62 -0.20 4.37 0.00 -1.18 -2.62 121.76 123.23 1vd0 s ALA 102 Ca 0.44 0.91 -0.00 0.00 0.00 0.00 0.00 51.96 53.31 1vd0 s ALA 102 Cb 0.36 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.82 1vd0 s ALA 102 CO 0.07 -1.15 0.01 0.41 0.00 0.00 0.00 175.76 175.11 1vd0 n GLY 103 N 3.87 0.31 3.56 0.00 0.00 -1.26 -4.92 105.19 106.75 1vd0 n GLY 103 Ca 0.15 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.19 1.37 -0.55 2.61 -4.23 -1.08 -5.02 115.64 106.56 1vd0 s THR 104 Ca 0.01 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.75 1vd0 s THR 104 Cb -0.00 -2.72 0.25 0.00 1.34 0.00 0.00 72.50 71.36 1vd0 s THR 104 CO 0.01 0.00 1.71 0.00 -0.54 0.00 0.00 174.62 175.79 1vd0 n ALA 105 N -0.89 1.75 -2.33 3.99 0.00 -1.26 -4.72 120.51 117.05 1vd0 n ALA 105 Ca -0.06 0.06 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1vd0 n ALA 105 Cb 0.67 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.67 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 -3.27 4.81 -0.24 0.00 1.01 -1.26 -3.88 121.20 118.38 1vd0 s ILE 106 Ca 0.05 1.07 0.01 0.00 0.00 0.00 0.00 60.65 61.78 1vd0 s ILE 106 Cb 0.10 -3.83 0.06 0.00 0.01 0.00 0.00 42.46 38.80 1vd0 s ILE 106 CO 0.41 0.49 -0.04 -0.44 0.00 0.00 0.00 174.94 175.37 1vd0 s SER 107 N -1.23 3.85 -0.13 3.58 0.01 -1.11 -4.87 113.70 113.80 1vd0 s SER 107 Ca 0.30 -1.23 -0.10 0.00 1.31 0.00 0.00 55.95 56.23 1vd0 s SER 107 Cb -0.18 -1.15 -0.05 0.00 0.21 0.00 0.00 66.02 64.85 1vd0 s SER 107 CO 0.18 -0.26 0.22 -0.51 0.41 0.00 0.00 173.24 173.28 1vd0 s ILE 108 N 1.41 5.36 0.00 1.44 1.10 -1.26 -2.74 121.20 126.51 1vd0 s ILE 108 Ca -0.04 0.39 0.00 0.00 -0.51 0.00 0.00 60.65 60.49 1vd0 s ILE 108 Cb -0.19 -3.52 0.00 0.00 0.15 0.00 0.00 42.46 38.90 1vd0 s ILE 108 CO -0.07 0.52 0.35 1.33 -2.11 0.00 0.00 174.94 174.96