#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 2.06 -0.04 1.09 1.04 -1.26 -5.16 113.70 111.43 1vd0 s SER 2 Ca 0.00 -1.62 0.03 0.00 0.48 0.00 0.00 55.95 54.83 1vd0 s SER 2 Cb 0.00 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.53 1vd0 s SER 2 CO 0.00 -0.92 -0.11 -0.75 0.98 0.00 0.00 173.24 172.44 1vd0 s LYS 3 N -3.72 2.56 -0.13 4.02 2.47 -1.26 -5.11 119.74 118.57 1vd0 s LYS 3 Ca 0.32 -0.67 -0.05 0.00 -1.56 0.00 0.00 55.97 54.02 1vd0 s LYS 3 Cb 0.04 -2.45 0.07 0.00 -1.46 0.00 0.00 37.83 34.02 1vd0 s LYS 3 CO 0.18 0.63 0.27 -1.21 0.16 0.00 0.00 175.35 175.38 1vd0 s GLU 4 N -0.87 0.16 -0.05 4.03 2.02 -1.26 -5.15 118.70 117.58 1vd0 s GLU 4 Ca 0.13 0.76 -0.05 0.00 0.02 0.00 0.00 54.97 55.82 1vd0 s GLU 4 Cb -0.11 -0.02 0.01 0.00 0.10 0.00 0.00 34.13 34.12 1vd0 s GLU 4 CO 0.02 -0.28 0.14 0.95 0.02 0.00 0.00 175.26 176.11 1vd0 s THR 5 N 2.38 0.01 -0.29 3.63 -4.23 -1.26 -5.15 115.64 110.74 1vd0 s THR 5 Ca 0.01 -0.06 -0.16 0.00 -1.18 0.00 0.00 61.69 60.30 1vd0 s THR 5 Cb -0.12 -0.23 0.12 0.00 1.34 0.00 0.00 72.50 73.61 1vd0 s THR 5 CO -0.09 -0.03 0.86 0.12 -0.54 0.00 0.00 174.62 174.94 1vd0 s PHE 6 N -0.05 -0.78 0.18 3.99 5.36 -1.26 -5.18 117.98 120.24 1vd0 s PHE 6 Ca -0.01 1.54 -0.21 0.00 -0.96 0.00 0.00 56.93 57.28 1vd0 s PHE 6 Cb -0.02 0.47 0.05 0.00 -0.34 0.00 0.00 43.02 43.18 1vd0 s PHE 6 CO 0.00 -0.39 0.58 -0.08 -1.46 0.00 0.00 175.22 173.88 1vd0 s THR 7 N 1.55 0.01 0.28 0.12 -1.32 -1.26 -5.19 115.64 109.83 1vd0 s THR 7 Ca -0.09 -0.33 -0.19 0.00 -1.21 0.00 0.00 61.69 59.87 1vd0 s THR 7 Cb -0.04 -1.24 0.02 0.00 -1.51 0.00 0.00 72.50 69.72 1vd0 s THR 7 CO -0.17 -0.06 0.68 -1.00 -2.21 0.00 0.00 174.62 171.86 1vd0 s HIS 8 N -3.80 -0.08 0.02 9.09 3.76 -1.26 -5.19 115.29 117.84 1vd0 s HIS 8 Ca 0.04 -0.37 -0.22 0.00 -0.15 0.00 0.00 55.06 54.35 1vd0 s HIS 8 Cb -0.01 0.62 0.05 0.00 1.11 0.00 0.00 32.58 34.35 1vd0 s HIS 8 CO -0.09 -1.21 0.51 1.52 -0.85 0.00 0.00 174.74 174.63 1vd0 s TYR 9 N -3.88 -0.42 0.01 1.40 1.13 -1.26 -5.17 117.35 109.16 1vd0 s TYR 9 Ca 0.13 0.53 0.02 0.00 -1.41 0.00 0.00 57.07 56.34 1vd0 s TYR 9 Cb -0.05 0.31 -0.01 0.00 -1.10 0.00 0.00 41.96 41.11 1vd0 s TYR 9 CO 0.08 -0.60 -0.06 -0.65 -2.51 0.00 0.00 175.55 171.80 1vd0 s GLN 10 N -2.13 0.44 0.93 -3.49 -0.21 -1.26 -5.16 119.66 108.78 1vd0 s GLN 10 Ca -0.07 -0.34 -0.16 0.00 0.02 0.00 0.00 55.36 54.81 1vd0 s GLN 10 Cb -0.01 -0.37 0.23 0.00 1.00 0.00 0.00 33.01 33.86 1vd0 s GLN 10 CO 0.01 0.09 0.82 -0.35 -2.12 0.00 0.00 175.29 173.74 1vd0 n PRO 11 N 2.55 -2.64 -3.67 2.91 -0.04 -1.26 -5.03 135.00 127.83 1vd0 n PRO 11 Ca -0.16 -1.32 -0.35 0.00 -0.04 0.00 0.00 63.50 61.63 1vd0 n PRO 11 Cb 0.57 -1.24 -0.08 0.00 -0.04 0.00 0.00 33.50 32.72 1vd0 n PRO 11 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1vd0 s GLN 12 N -4.87 4.21 -0.43 0.54 -2.07 -1.26 -5.05 119.66 110.72 1vd0 s GLN 12 Ca 0.54 -0.11 -0.27 0.00 -1.82 0.00 0.00 55.36 53.69 1vd0 s GLN 12 Cb -0.05 -3.42 0.02 0.00 -1.09 0.00 0.00 33.01 28.47 1vd0 s GLN 12 CO 0.41 0.28 0.99 0.20 -1.32 0.00 0.00 175.29 175.85 1vd0 s GLY 13 N 0.40 1.45 -0.10 2.60 0.00 -1.26 -5.01 107.32 105.40 1vd0 s GLY 13 Ca 0.11 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.25 1vd0 s GLY 13 CO -0.00 2.15 -0.09 -1.31 0.00 0.00 0.00 173.10 173.85 1vd0 s ASN 14 N 2.19 2.05 0.11 1.64 0.01 -1.26 -5.14 114.94 114.54 1vd0 s ASN 14 Ca 0.41 -0.30 0.04 0.00 -0.71 0.00 0.00 52.86 52.30 1vd0 s ASN 14 Cb -0.10 -0.84 -0.04 0.00 0.41 0.00 0.00 41.25 40.68 1vd0 s ASN 14 CO 0.25 -0.07 0.08 -0.44 -1.51 0.00 0.00 177.10 175.41 1vd0 s SER 15 N 1.38 5.43 -0.06 -1.22 0.01 -1.26 -5.12 113.70 112.85 1vd0 s SER 15 Ca -0.01 -0.08 0.04 0.00 1.31 0.00 0.00 55.95 57.21 1vd0 s SER 15 Cb -0.14 -1.41 -0.02 0.00 0.21 0.00 0.00 66.02 64.66 1vd0 s SER 15 CO -0.05 0.14 -0.19 -0.62 0.41 0.00 0.00 173.24 172.93 1vd0 s ASP 16 N -2.62 3.61 0.07 2.44 -1.08 -1.26 -5.00 116.67 112.82 1vd0 s ASP 16 Ca 0.29 -0.35 0.17 0.00 -0.52 0.00 0.00 52.55 52.14 1vd0 s ASP 16 Cb -0.11 -0.90 0.70 0.00 -1.46 0.00 0.00 42.92 41.15 1vd0 s ASP 16 CO 0.22 0.28 1.52 -0.81 0.52 0.00 0.00 175.17 176.90 1vd0 n PRO 17 N 2.71 0.05 -3.10 4.34 -0.04 -1.26 -4.69 135.00 133.01 1vd0 n PRO 17 Ca -0.17 0.30 -0.39 0.00 -0.04 0.00 0.00 63.50 63.20 1vd0 n PRO 17 Cb 0.52 -1.60 -0.05 0.00 -0.04 0.00 0.00 33.50 32.33 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 -3.08 3.38 -0.17 0.55 0.00 -1.26 -4.98 121.76 116.20 1vd0 s ALA 18 Ca 0.06 0.04 -0.26 0.00 0.00 0.00 0.00 51.96 51.80 1vd0 s ALA 18 Cb 0.09 -2.90 -0.23 0.00 0.00 0.00 0.00 23.12 20.08 1vd0 s ALA 18 CO 0.29 -0.13 0.55 0.45 0.00 0.00 0.00 175.76 176.93 1vd0 h HIS 19 N 6.82 0.01 -4.29 0.00 3.86 -2.01 -3.47 115.15 116.07 1vd0 h HIS 19 Ca -0.40 -0.01 -0.46 0.00 -1.16 0.00 0.00 60.37 58.33 1vd0 h HIS 19 Cb 1.19 -0.00 0.10 0.00 1.06 0.00 0.00 27.41 29.76 1vd0 h HIS 19 CO 0.65 1.21 0.35 0.95 0.86 0.00 0.00 177.93 181.95 1vd0 s THR 20 N -2.28 2.08 0.11 2.45 -4.23 -1.26 -4.60 115.64 107.90 1vd0 s THR 20 Ca -0.23 -0.09 0.04 0.00 -1.18 0.00 0.00 61.69 60.24 1vd0 s THR 20 Cb 0.01 -2.99 -0.04 0.00 1.34 0.00 0.00 72.50 70.81 1vd0 s THR 20 CO 0.65 0.00 0.07 0.00 -0.54 0.00 0.00 174.62 174.81 1vd0 s ALA 21 N -3.50 3.49 -0.32 3.99 0.00 -0.73 -4.98 121.76 119.71 1vd0 s ALA 21 Ca 0.63 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 51.48 1vd0 s ALA 21 Cb -0.10 -1.34 0.10 0.00 0.00 0.00 0.00 23.12 21.78 1vd0 s ALA 21 CO 0.48 0.65 0.09 0.95 0.00 0.00 0.00 175.76 177.93 1vd0 s THR 22 N -1.50 1.31 0.68 0.00 -4.23 -1.26 -2.54 115.64 108.10 1vd0 s THR 22 Ca 0.29 -1.72 -0.09 0.00 -1.18 0.00 0.00 61.69 58.98 1vd0 s THR 22 Cb -0.11 -1.98 0.02 0.00 1.34 0.00 0.00 72.50 71.76 1vd0 s THR 22 CO 0.21 -0.66 1.04 0.00 -0.54 0.00 0.00 174.62 174.67 1vd0 s ALA 23 N 1.36 3.02 -1.60 3.99 0.00 -0.91 -4.85 121.76 122.77 1vd0 s ALA 23 Ca 0.10 -0.51 0.15 0.00 0.00 0.00 0.00 51.96 51.70 1vd0 s ALA 23 Cb -0.18 -2.86 0.80 0.00 0.00 0.00 0.00 23.12 20.88 1vd0 s ALA 23 CO -0.19 -1.08 1.39 -0.35 0.00 0.00 0.00 175.76 175.53 1vd0 n PRO 24 N -2.89 0.29 -1.24 0.00 -0.04 -1.26 -2.11 135.00 127.75 1vd0 n PRO 24 Ca 0.06 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1vd0 n PRO 24 Cb 0.58 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.03 -4.19 0.30 0.55 0.00 -1.24 -3.85 105.19 96.73 1vd0 n GLY 25 Ca 0.08 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.71 -0.14 3.33 -0.02 0.00 -1.13 -4.79 105.19 103.14 1vd0 n GLY 26 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1vd0 n GLY 26 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1vd0 n LEU 27 N 0.00 -1.43 -0.09 0.99 0.00 -1.20 -4.79 117.00 110.48 1vd0 n LEU 27 Ca 0.00 0.27 -0.18 0.00 0.00 0.00 0.00 56.01 56.10 1vd0 n LEU 27 Cb 0.57 -1.10 -0.11 0.00 0.00 0.00 0.00 43.42 42.78 1vd0 n LEU 27 CO 0.00 -4.04 -0.28 -1.28 0.00 0.00 0.00 177.39 171.79 1vd0 h SER 28 N -1.48 0.00 -5.76 1.96 0.87 -1.93 -3.41 113.55 103.80 1vd0 h SER 28 Ca -0.44 -0.56 -0.39 0.00 -1.23 0.00 0.00 61.79 59.17 1vd0 h SER 28 Cb 1.29 0.00 -0.12 0.00 -0.44 0.00 0.00 62.40 63.13 1vd0 h SER 28 CO 0.32 1.29 -0.43 0.00 -0.53 0.00 0.00 176.83 177.48 1vd0 s ALA 29 N -2.37 1.48 0.27 6.23 0.00 -1.26 -4.60 121.76 121.52 1vd0 s ALA 29 Ca -0.25 -1.88 -0.29 0.00 0.00 0.00 0.00 51.96 49.55 1vd0 s ALA 29 Cb 0.03 1.39 -0.14 0.00 0.00 0.00 0.00 23.12 24.40 1vd0 s ALA 29 CO 0.57 -0.69 1.08 1.63 0.00 0.00 0.00 175.76 178.34 1vd0 n LYS 30 N -0.56 1.43 -3.72 0.00 5.02 -1.26 -3.46 118.16 115.61 1vd0 n LYS 30 Ca 0.05 0.50 -0.12 0.00 -2.02 0.00 0.00 58.31 56.73 1vd0 n LYS 30 Cb 0.63 -1.92 -0.12 0.00 -0.02 0.00 0.00 35.03 33.59 1vd0 n LYS 30 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vd0 s ALA 31 N -0.88 -0.78 0.79 7.82 0.00 -0.63 -4.92 121.76 123.16 1vd0 s ALA 31 Ca 0.61 1.22 -0.11 0.00 0.00 0.00 0.00 51.96 53.68 1vd0 s ALA 31 Cb -0.71 -0.75 0.06 0.00 0.00 0.00 0.00 23.12 21.72 1vd0 s ALA 31 CO 0.58 -0.22 1.09 -1.25 0.00 0.00 0.00 175.76 175.96 1vd0 s PRO 32 N 1.27 2.15 0.48 0.00 0.04 -1.26 -2.12 135.00 135.56 1vd0 s PRO 32 Ca -0.09 1.14 -0.08 0.00 0.04 0.00 0.00 61.00 62.01 1vd0 s PRO 32 Cb -0.09 -1.89 0.11 0.00 0.04 0.00 0.00 34.50 32.67 1vd0 s PRO 32 CO -0.10 -1.71 0.65 0.00 0.04 0.00 0.00 177.00 175.88 1vd0 n ALA 33 N -3.56 -0.74 -3.50 8.56 0.00 -1.26 -4.55 120.51 115.46 1vd0 n ALA 33 Ca 0.09 -0.86 -0.19 0.00 0.00 0.00 0.00 53.44 52.48 1vd0 n ALA 33 Cb 0.53 -0.04 0.06 0.00 0.00 0.00 0.00 19.45 20.01 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 -2.38 -4.70 -3.60 0.00 2.81 0.74 -4.80 117.12 105.19 1vd0 n MET 34 Ca 0.08 0.75 -0.16 0.00 -1.81 0.00 0.00 57.70 56.56 1vd0 n MET 34 Cb 0.28 -5.50 -0.07 0.00 -0.71 0.00 0.00 33.22 27.23 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 0.54 2.03 -4.23 -1.24 -1.61 115.64 107.67 1vd0 s THR 35 Ca 0.14 -0.17 -0.20 0.00 -1.18 0.00 0.00 61.69 60.28 1vd0 s THR 35 Cb -0.03 -0.87 -0.06 0.00 1.34 0.00 0.00 72.50 72.88 1vd0 s THR 35 CO 0.77 -0.09 1.13 -2.16 -0.54 0.00 0.00 174.62 173.73 1vd0 s PRO 36 N -1.31 3.37 0.31 3.99 0.04 -1.26 -0.19 135.00 139.96 1vd0 s PRO 36 Ca -0.12 1.61 0.03 0.00 0.04 0.00 0.00 61.00 62.57 1vd0 s PRO 36 Cb -0.02 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.44 1vd0 s PRO 36 CO 0.07 -0.83 0.07 -0.51 0.04 0.00 0.00 177.00 175.84 1vd0 s LEU 37 N -3.77 2.08 0.04 -3.56 1.43 0.19 -3.19 118.68 111.91 1vd0 s LEU 37 Ca 0.72 -1.38 0.04 0.00 -1.03 0.00 0.00 54.13 52.48 1vd0 s LEU 37 Cb -0.24 -0.31 -0.02 0.00 0.03 0.00 0.00 46.19 45.65 1vd0 s LEU 37 CO 0.27 -0.63 -0.11 0.00 0.23 0.00 0.00 176.35 176.11 1vd0 s MET 38 N -3.92 0.70 0.88 1.70 0.23 0.87 -1.07 119.30 118.69 1vd0 s MET 38 Ca 0.37 -0.76 -0.11 0.00 -1.03 0.00 0.00 55.69 54.16 1vd0 s MET 38 Cb 0.09 -0.61 0.12 0.00 -1.53 0.00 0.00 34.83 32.90 1vd0 s MET 38 CO 0.15 0.14 1.09 -0.51 -2.03 0.00 0.00 175.02 173.86 1vd0 s LEU 39 N -1.37 2.36 1.06 0.18 1.43 -1.26 -1.84 118.68 119.25 1vd0 s LEU 39 Ca -0.04 1.56 -0.14 0.00 -1.03 0.00 0.00 54.13 54.48 1vd0 s LEU 39 Cb -0.09 -4.01 0.22 0.00 0.03 0.00 0.00 46.19 42.34 1vd0 s LEU 39 CO 0.01 -2.60 1.10 -0.62 0.23 0.00 0.00 176.35 174.47 1vd0 s ASP 40 N -3.37 2.08 0.00 2.29 2.15 -0.55 -4.76 116.67 114.50 1vd0 s ASP 40 Ca 0.63 1.01 0.03 0.00 0.43 0.00 0.00 52.55 54.66 1vd0 s ASP 40 Cb -0.18 -1.56 0.15 0.00 -0.30 0.00 0.00 42.92 41.03 1vd0 s ASP 40 CO 0.57 -3.45 1.00 1.07 -0.17 0.00 0.00 175.17 174.19 1vd0 n THR 41 N -4.36 1.35 -1.79 1.71 5.66 -1.26 -1.23 114.28 114.36 1vd0 n THR 41 Ca 0.07 0.34 0.03 0.00 -3.05 0.00 0.00 64.05 61.44 1vd0 n THR 41 Cb 0.58 -1.28 0.05 0.00 -1.55 0.00 0.00 70.33 68.13 1vd0 n THR 41 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1vd0 n SER 42 N -1.38 0.82 -4.17 1.09 7.64 -1.26 -5.00 113.62 111.37 1vd0 n SER 42 Ca 0.01 -2.39 -0.33 0.00 1.01 0.00 0.00 58.87 57.18 1vd0 n SER 42 Cb 0.03 -0.29 -0.04 0.00 -1.01 0.00 0.00 64.21 62.91 1vd0 n SER 42 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1vd0 n SER 43 N -0.39 -1.79 -0.04 6.43 2.88 -0.36 -4.83 113.62 115.51 1vd0 n SER 43 Ca 0.06 -1.05 -0.09 0.00 -1.33 0.00 0.00 58.87 56.46 1vd0 n SER 43 Cb 0.73 -2.66 -0.03 0.00 -0.75 0.00 0.00 64.21 61.50 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 -4.40 0.18 -3.58 -1.46 5.12 -1.26 -4.88 116.66 106.39 1vd0 n ARG 44 Ca -0.09 0.08 -0.23 0.00 -1.93 0.00 0.00 57.85 55.67 1vd0 n ARG 44 Cb 0.57 -0.84 0.01 0.00 -1.16 0.00 0.00 32.46 31.04 1vd0 n ARG 44 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1vd0 s LYS 45 N -2.16 2.34 -0.12 5.56 1.02 -1.26 -4.73 119.74 120.39 1vd0 s LYS 45 Ca -0.12 -1.80 0.02 0.00 0.02 0.00 0.00 55.97 54.10 1vd0 s LYS 45 Cb 0.04 -2.32 0.01 0.00 -0.52 0.00 0.00 37.83 35.05 1vd0 s LYS 45 CO 0.15 -0.58 -0.19 -1.17 -0.92 0.00 0.00 175.35 172.64 1vd0 s LEU 46 N -4.35 1.94 0.08 3.17 1.98 -1.26 -1.49 118.68 118.75 1vd0 s LEU 46 Ca 0.45 -0.52 0.01 0.00 -2.89 0.00 0.00 54.13 51.18 1vd0 s LEU 46 Cb -0.03 -1.28 -0.04 0.00 0.66 0.00 0.00 46.19 45.50 1vd0 s LEU 46 CO 0.28 0.06 -0.05 0.68 -1.89 0.00 0.00 176.35 175.42 1vd0 s VAL 47 N 0.81 0.53 0.71 1.68 -7.23 -0.77 -2.86 120.40 113.28 1vd0 s VAL 47 Ca -0.09 -1.84 -0.16 0.00 -1.81 0.00 0.00 61.98 58.08 1vd0 s VAL 47 Cb -0.16 -1.56 -0.00 0.00 0.56 0.00 0.00 36.38 35.22 1vd0 s VAL 47 CO -0.00 -0.88 0.92 0.00 -0.31 0.00 0.00 175.10 174.82 1vd0 n ALA 48 N 0.10 -0.35 -1.77 1.32 0.00 -1.26 -0.09 120.51 118.46 1vd0 n ALA 48 Ca -0.13 -0.18 -0.39 0.00 0.00 0.00 0.00 53.44 52.74 1vd0 n ALA 48 Cb 0.60 -2.09 -0.04 0.00 0.00 0.00 0.00 19.45 17.93 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 -1.81 3.42 0.17 0.00 -0.00 -1.19 -4.14 118.94 115.40 1vd0 s TRP 49 Ca 0.73 1.66 -0.09 0.00 -0.00 0.00 0.00 56.10 58.39 1vd0 s TRP 49 Cb -0.35 -3.27 0.03 0.00 -0.00 0.00 0.00 33.47 29.88 1vd0 s TRP 49 CO 0.51 -0.71 1.57 0.22 -0.00 0.00 0.00 176.95 178.54 1vd0 h ASP 50 N 3.34 1.01 0.00 5.86 3.58 -1.93 -3.48 116.42 124.81 1vd0 h ASP 50 Ca -0.47 -0.37 0.00 0.00 0.42 0.00 0.00 57.03 56.60 1vd0 h ASP 50 Cb 1.22 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.99 1vd0 h ASP 50 CO 0.65 1.17 0.00 0.61 -2.88 0.00 0.00 179.24 178.79 1vd0 n GLY 51 N -0.15 2.74 0.18 -0.78 0.00 -1.26 -4.66 105.19 101.26 1vd0 n GLY 51 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.90 1.46 -1.42 2.61 -2.24 -1.26 -2.68 114.28 109.85 1vd0 n THR 52 Ca 0.00 0.03 -0.63 0.00 -2.27 0.00 0.00 64.05 61.19 1vd0 n THR 52 Cb 0.00 -2.18 -0.11 0.00 -2.10 0.00 0.00 70.33 65.94 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 -4.32 0.00 -2.44 4.28 -1.04 -1.26 -4.83 114.28 104.66 1vd0 n THR 53 Ca -0.22 -0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.36 1vd0 n THR 53 Cb 0.57 -0.50 -0.02 0.00 -1.82 0.00 0.00 70.33 68.55 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 5.01 7.01 0.00 8.00 -4.77 -1.26 -2.78 116.67 127.87 1vd0 s ASP 54 Ca 1.15 1.76 0.00 0.00 -3.30 0.00 0.00 52.55 52.16 1vd0 s ASP 54 Cb -1.50 -2.55 0.00 0.00 -1.09 0.00 0.00 42.92 37.78 1vd0 s ASP 54 CO 0.71 -0.66 0.00 0.61 0.70 0.00 0.00 175.17 176.53 1vd0 n GLY 55 N 3.47 0.63 0.11 2.12 0.00 -1.23 -4.93 105.19 105.36 1vd0 n GLY 55 Ca 0.12 -0.07 -0.03 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 0.74 -2.32 4.61 0.00 -1.63 -3.44 119.26 117.23 1vd0 h ALA 56 Ca 0.00 -0.69 -0.54 0.00 0.00 0.00 0.00 54.91 53.68 1vd0 h ALA 56 Cb 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.68 1vd0 h ALA 56 CO 0.00 0.95 1.17 0.00 0.00 0.00 0.00 179.25 181.37 1vd0 s ALA 57 N -3.28 3.60 -0.04 0.00 0.00 -1.18 -4.16 121.76 116.70 1vd0 s ALA 57 Ca -0.00 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.15 1vd0 s ALA 57 Cb 0.12 -3.80 -0.05 0.00 0.00 0.00 0.00 23.12 19.38 1vd0 s ALA 57 CO 0.78 -1.50 0.01 1.33 0.00 0.00 0.00 175.76 176.39 1vd0 n VAL 58 N 5.52 0.29 -3.89 0.00 0.24 -0.23 -4.40 118.33 115.86 1vd0 n VAL 58 Ca 0.19 -0.18 -0.09 0.00 -2.04 0.00 0.00 64.34 62.22 1vd0 n VAL 58 Cb 0.42 -0.88 -0.01 0.00 -1.47 0.00 0.00 33.84 31.89 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 -3.56 0.29 -0.17 7.63 0.00 -1.25 -4.88 107.32 105.39 1vd0 s GLY 59 Ca -0.02 -0.65 0.01 0.00 0.00 0.00 0.00 44.72 44.06 1vd0 s GLY 59 CO 0.17 -0.33 -0.20 -0.42 0.00 0.00 0.00 173.10 172.33 1vd0 s ILE 60 N -3.35 2.14 0.07 0.90 1.01 -1.25 0.54 121.20 121.26 1vd0 s ILE 60 Ca 0.16 -0.92 -0.33 0.00 0.00 0.00 0.00 60.65 59.56 1vd0 s ILE 60 Cb -0.04 -1.89 -0.12 0.00 0.01 0.00 0.00 42.46 40.42 1vd0 s ILE 60 CO 0.10 0.54 1.81 -0.11 0.00 0.00 0.00 174.94 177.27 1vd0 n LEU 61 N 4.49 3.68 -0.04 2.97 0.00 0.74 -0.42 117.00 128.42 1vd0 n LEU 61 Ca -0.21 1.00 -0.15 0.00 0.00 0.00 0.00 56.01 56.65 1vd0 n LEU 61 Cb 0.50 -1.47 -0.12 0.00 0.00 0.00 0.00 43.42 42.34 1vd0 n LEU 61 CO 0.26 0.01 0.40 0.00 0.00 0.00 0.00 177.39 178.07 1vd0 h ALA 62 N 8.33 0.01 -4.22 1.96 0.00 -1.74 0.21 119.26 123.80 1vd0 h ALA 62 Ca -0.47 -0.46 -0.69 0.00 0.00 0.00 0.00 54.91 53.28 1vd0 h ALA 62 Cb 1.24 0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.79 1vd0 h ALA 62 CO 0.93 0.03 -0.82 0.08 0.00 0.00 0.00 179.25 179.47 1vd0 s VAL 63 N -2.90 2.66 0.11 0.00 1.01 -1.24 -4.19 120.40 115.84 1vd0 s VAL 63 Ca -0.17 -0.94 -0.32 0.00 0.00 0.00 0.00 61.98 60.55 1vd0 s VAL 63 Cb -0.00 -2.02 -0.11 0.00 0.00 0.00 0.00 36.38 34.25 1vd0 s VAL 63 CO 0.72 0.54 1.83 0.00 0.00 0.00 0.00 175.10 178.19 1vd0 n ALA 64 N 2.22 2.00 -2.66 5.51 0.00 -1.26 -4.55 120.51 121.76 1vd0 n ALA 64 Ca -0.17 0.32 -0.30 0.00 0.00 0.00 0.00 53.44 53.29 1vd0 n ALA 64 Cb 0.52 -2.57 -0.08 0.00 0.00 0.00 0.00 19.45 17.32 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 2.75 3.60 0.18 0.00 0.00 -0.90 -4.84 121.76 122.54 1vd0 s ALA 65 Ca 0.83 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.90 1vd0 s ALA 65 Cb -0.51 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 1vd0 s ALA 65 CO 0.39 -0.13 0.00 0.16 0.00 0.00 0.00 175.76 176.18 1vd0 s ASP 66 N -3.77 1.25 0.41 0.00 1.47 -1.26 -1.60 116.67 113.18 1vd0 s ASP 66 Ca 0.15 -1.18 0.29 0.00 1.18 0.00 0.00 52.55 52.99 1vd0 s ASP 66 Cb 0.03 0.11 1.43 0.00 -0.34 0.00 0.00 42.92 44.16 1vd0 s ASP 66 CO 0.08 -0.57 1.87 0.06 0.68 0.00 0.00 175.17 177.30 1vd0 h GLN 67 N 2.67 0.00 -0.00 2.11 -0.00 -1.79 -0.17 115.11 117.93 1vd0 h GLN 67 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.28 1vd0 h GLN 67 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.69 1vd0 h GLN 67 CO 0.63 0.00 -0.34 -2.37 -0.00 0.00 0.00 178.83 176.75 1vd0 n THR 68 N -2.54 0.00 -1.70 1.86 5.66 -1.26 -4.63 114.28 111.66 1vd0 n THR 68 Ca -0.01 -0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.65 1vd0 n THR 68 Cb 0.12 0.02 0.06 0.00 -1.55 0.00 0.00 70.33 68.98 1vd0 n THR 68 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1vd0 s SER 69 N -2.98 4.85 0.00 1.09 0.15 -0.08 -4.95 113.70 111.77 1vd0 s SER 69 Ca 0.12 2.16 0.20 0.00 0.70 0.00 0.00 55.95 59.13 1vd0 s SER 69 Cb 0.18 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.95 1vd0 s SER 69 CO 0.64 -1.81 1.01 1.07 1.20 0.00 0.00 173.24 175.35 1vd0 n THR 70 N -2.37 0.00 -3.62 6.45 5.66 -1.26 -4.69 114.28 114.44 1vd0 n THR 70 Ca 0.12 -0.33 -0.15 0.00 -3.05 0.00 0.00 64.05 60.63 1vd0 n THR 70 Cb 0.51 1.27 -0.07 0.00 -1.55 0.00 0.00 70.33 70.49 1vd0 n THR 70 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1vd0 s THR 71 N -2.12 0.00 -0.18 1.09 2.01 -1.25 -3.74 115.64 111.46 1vd0 s THR 71 Ca 0.18 -0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.16 1vd0 s THR 71 Cb 0.16 -0.92 0.02 0.00 0.01 0.00 0.00 72.50 71.77 1vd0 s THR 71 CO 0.45 -0.02 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.40 1vd0 s LEU 72 N -0.22 2.12 -0.69 4.42 1.43 -0.90 -4.77 118.68 120.08 1vd0 s LEU 72 Ca -0.04 -0.65 -0.15 0.00 -1.03 0.00 0.00 54.13 52.26 1vd0 s LEU 72 Cb -0.03 -1.47 0.17 0.00 0.03 0.00 0.00 46.19 44.88 1vd0 s LEU 72 CO 0.04 0.00 0.66 -0.89 0.23 0.00 0.00 176.35 176.39 1vd0 s THR 73 N 1.27 5.34 0.30 5.49 2.01 -1.26 -2.14 115.64 126.65 1vd0 s THR 73 Ca 0.05 -1.89 0.10 0.00 0.31 0.00 0.00 61.69 60.25 1vd0 s THR 73 Cb -0.13 -4.43 -0.05 0.00 0.01 0.00 0.00 72.50 67.90 1vd0 s THR 73 CO -0.13 -0.99 -0.02 0.72 -0.69 0.00 0.00 174.62 173.51 1vd0 s PHE 74 N 1.10 2.57 0.84 4.92 -0.71 -1.05 -2.08 117.98 123.57 1vd0 s PHE 74 Ca 0.12 -0.33 -0.12 0.00 -1.04 0.00 0.00 56.93 55.56 1vd0 s PHE 74 Cb -0.20 -1.29 0.09 0.00 -1.21 0.00 0.00 43.02 40.42 1vd0 s PHE 74 CO -0.03 0.57 1.11 0.71 -1.34 0.00 0.00 175.22 176.25 1vd0 s TYR 75 N -2.43 2.74 -0.07 3.49 2.02 0.44 -1.77 117.35 121.77 1vd0 s TYR 75 Ca 0.33 1.02 0.02 0.00 -0.37 0.00 0.00 57.07 58.07 1vd0 s TYR 75 Cb -0.04 -3.23 -0.05 0.00 -0.40 0.00 0.00 41.96 38.24 1vd0 s TYR 75 CO 0.19 -1.97 -0.04 0.36 -1.57 0.00 0.00 175.55 172.52 1vd0 n LYS 76 N -3.54 0.93 -3.77 -0.62 -0.00 -1.26 -3.87 118.16 106.04 1vd0 n LYS 76 Ca 0.07 0.03 -0.04 0.00 -0.00 0.00 0.00 58.31 58.37 1vd0 n LYS 76 Cb 0.58 -1.14 -0.01 0.00 -0.00 0.00 0.00 35.03 34.45 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 -4.41 -0.18 0.00 -5.58 1.04 -1.26 -4.57 113.70 98.73 1vd0 s SER 77 Ca -0.08 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1vd0 s SER 77 Cb 0.02 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.66 1vd0 s SER 77 CO 0.18 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1vd0 n GLY 78 N -0.47 3.23 3.65 7.32 0.00 -1.26 -5.00 105.19 112.66 1vd0 n GLY 78 Ca -0.06 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.62 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 -2.35 4.30 -0.05 2.61 2.01 -1.26 -2.73 115.64 118.18 1vd0 s THR 79 Ca 0.00 1.55 0.05 0.00 0.31 0.00 0.00 61.69 63.60 1vd0 s THR 79 Cb 0.00 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 1vd0 s THR 79 CO 0.00 -0.21 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.14 1vd0 s PHE 80 N 3.65 2.11 0.04 4.92 0.08 -0.26 -5.02 117.98 123.50 1vd0 s PHE 80 Ca 0.54 -0.61 -0.30 0.00 0.12 0.00 0.00 56.93 56.67 1vd0 s PHE 80 Cb -0.20 -1.39 -0.06 0.00 -0.57 0.00 0.00 43.02 40.80 1vd0 s PHE 80 CO 0.15 -0.19 1.35 1.03 -0.10 0.00 0.00 175.22 177.47 1vd0 s ARG 81 N -0.10 4.32 0.07 0.44 0.52 -1.26 -2.47 118.95 120.47 1vd0 s ARG 81 Ca -0.03 1.95 -0.14 0.00 -0.52 0.00 0.00 55.73 56.98 1vd0 s ARG 81 Cb -0.13 -3.45 -0.26 0.00 0.52 0.00 0.00 34.95 31.63 1vd0 s ARG 81 CO 0.03 -0.48 1.15 -0.92 0.02 0.00 0.00 175.30 175.09 1vd0 h TYR 82 N 7.39 1.03 -0.00 -0.53 5.03 -1.91 -1.89 116.97 126.09 1vd0 h TYR 82 Ca -0.39 -0.60 0.00 0.00 2.58 0.00 0.00 58.73 60.31 1vd0 h TYR 82 Cb 1.19 -0.10 -0.00 0.00 1.55 0.00 0.00 36.73 39.37 1vd0 h TYR 82 CO 0.71 1.44 0.02 1.05 -1.32 0.00 0.00 178.16 180.06 1vd0 h GLU 83 N 0.33 0.00 0.01 1.82 9.09 -1.91 -2.74 114.58 121.18 1vd0 h GLU 83 Ca -0.16 0.00 -0.38 0.00 0.05 0.00 0.00 59.36 58.87 1vd0 h GLU 83 Cb 1.82 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.86 1vd0 h GLU 83 CO 0.22 0.00 -2.13 -3.47 0.05 0.00 0.00 179.01 173.68 1vd0 n ASP 84 N -3.10 1.95 -4.63 3.06 2.03 -1.19 -4.94 116.55 109.72 1vd0 n ASP 84 Ca -0.03 0.27 -0.49 0.00 0.52 0.00 0.00 54.79 55.06 1vd0 n ASP 84 Cb 0.09 -0.80 -0.05 0.00 -0.72 0.00 0.00 41.12 39.63 1vd0 n ASP 84 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1vd0 n VAL 85 N -4.07 0.02 -2.91 5.18 0.31 -0.71 -4.89 118.33 111.25 1vd0 n VAL 85 Ca -0.45 -0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 63.44 1vd0 n VAL 85 Cb 0.86 -1.20 -0.03 0.00 -0.91 0.00 0.00 33.84 32.57 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 0.81 4.92 0.46 7.52 1.43 -0.64 -4.92 118.68 128.26 1vd0 s LEU 86 Ca 0.82 -1.85 -0.21 0.00 -1.03 0.00 0.00 54.13 51.86 1vd0 s LEU 86 Cb -0.82 -2.40 -0.10 0.00 0.03 0.00 0.00 46.19 42.90 1vd0 s LEU 86 CO 0.43 -1.14 0.99 0.26 0.23 0.00 0.00 176.35 177.12 1vd0 s TRP 87 N 2.96 3.16 0.38 0.29 0.52 -1.26 -4.67 118.94 120.32 1vd0 s TRP 87 Ca 0.31 1.59 -0.26 0.00 0.02 0.00 0.00 56.10 57.76 1vd0 s TRP 87 Cb -0.07 -2.95 -0.09 0.00 -1.15 0.00 0.00 33.47 29.21 1vd0 s TRP 87 CO -0.06 -0.45 1.20 -1.25 0.02 0.00 0.00 176.95 176.41 1vd0 s PRO 88 N -3.21 4.14 0.33 4.98 0.04 -1.26 -4.94 135.00 135.08 1vd0 s PRO 88 Ca 0.64 1.93 0.03 0.00 0.04 0.00 0.00 61.00 63.65 1vd0 s PRO 88 Cb -0.12 -2.79 0.56 0.00 0.04 0.00 0.00 34.50 32.18 1vd0 s PRO 88 CO 0.16 -0.27 1.87 1.05 0.04 0.00 0.00 177.00 179.85 1vd0 h GLU 89 N 2.87 0.60 -0.75 4.56 4.11 -1.95 -2.99 114.58 121.03 1vd0 h GLU 89 Ca -0.49 -0.12 0.30 0.00 0.07 0.00 0.00 59.36 59.12 1vd0 h GLU 89 Cb 1.23 -0.09 -0.14 0.00 0.50 0.00 0.00 28.75 30.26 1vd0 h GLU 89 CO 0.63 0.59 0.36 0.00 0.07 0.00 0.00 179.01 180.67 1vd0 n ALA 90 N -2.47 0.73 -2.15 1.06 0.00 -1.26 -3.89 120.51 112.53 1vd0 n ALA 90 Ca 0.02 0.77 -0.42 0.00 0.00 0.00 0.00 53.44 53.81 1vd0 n ALA 90 Cb 0.23 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.91 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 -5.21 2.79 0.03 0.00 0.00 -1.09 -4.69 121.76 113.60 1vd0 s ALA 91 Ca -0.07 -0.12 -0.18 0.00 0.00 0.00 0.00 51.96 51.59 1vd0 s ALA 91 Cb 0.25 -4.05 -0.20 0.00 0.00 0.00 0.00 23.12 19.11 1vd0 s ALA 91 CO 0.59 -2.81 1.18 1.03 0.00 0.00 0.00 175.76 175.74 1vd0 h SER 92 N 12.40 0.62 -3.32 0.00 0.87 -1.86 -3.43 113.55 118.83 1vd0 h SER 92 Ca -0.30 -0.70 -0.58 0.00 -1.23 0.00 0.00 61.79 58.99 1vd0 h SER 92 Cb 1.14 -0.18 -0.07 0.00 -0.44 0.00 0.00 62.40 62.84 1vd0 h SER 92 CO 1.10 1.22 0.36 -0.62 -0.53 0.00 0.00 176.83 178.35 1vd0 s ASP 93 N -6.76 6.92 0.36 6.23 -1.08 -1.26 -4.94 116.67 116.15 1vd0 s ASP 93 Ca -0.13 1.13 0.05 0.00 -0.52 0.00 0.00 52.55 53.09 1vd0 s ASP 93 Cb 0.05 -2.44 0.73 0.00 -1.46 0.00 0.00 42.92 39.80 1vd0 s ASP 93 CO 0.83 -0.38 1.98 1.05 0.52 0.00 0.00 175.17 179.17 1vd0 h GLU 94 N 7.34 0.74 -0.19 4.34 4.11 -2.02 -1.20 114.58 127.70 1vd0 h GLU 94 Ca -0.30 -0.04 -0.09 0.00 0.07 0.00 0.00 59.36 59.00 1vd0 h GLU 94 Cb 1.13 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 1vd0 h GLU 94 CO 0.83 0.49 -0.28 1.15 0.07 0.00 0.00 179.01 181.27 1vd0 h THR 95 N 0.76 1.26 -0.44 -1.06 2.02 -1.98 -2.56 112.91 110.91 1vd0 h THR 95 Ca 0.29 -1.25 0.05 0.00 0.77 0.00 0.00 66.41 66.27 1vd0 h THR 95 Cb 0.17 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.96 1vd0 h THR 95 CO -0.09 0.39 0.16 0.50 0.37 0.00 0.00 175.52 176.86 1vd0 h LYS 96 N 0.32 0.33 -0.15 6.66 1.63 -1.62 0.16 116.57 123.91 1vd0 h LYS 96 Ca 0.05 -0.02 -0.14 0.00 -0.85 0.00 0.00 60.65 59.68 1vd0 h LYS 96 Cb 0.66 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.20 1vd0 h LYS 96 CO 0.05 0.22 -0.52 1.57 -3.45 0.00 0.00 179.45 177.32 1vd0 h LYS 97 N 0.34 0.42 -0.17 1.90 2.10 -1.50 0.14 116.57 119.79 1vd0 h LYS 97 Ca 0.21 -0.25 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 1vd0 h LYS 97 Cb 0.19 0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.54 1vd0 h LYS 97 CO -0.20 0.84 0.03 0.00 -2.00 0.00 0.00 179.45 178.11 1vd0 h ARG 98 N 0.33 0.29 -0.48 0.07 3.08 -0.94 -2.80 114.38 113.91 1vd0 h ARG 98 Ca 0.01 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1vd0 h ARG 98 Cb 1.02 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1vd0 h ARG 98 CO 0.09 0.46 0.00 0.25 -1.07 0.00 0.00 179.97 179.70 1vd0 n THR 99 N -4.77 0.71 0.33 2.04 -2.24 0.50 -4.25 114.28 106.60 1vd0 n THR 99 Ca -0.05 -0.63 0.19 0.00 -2.27 0.00 0.00 64.05 61.29 1vd0 n THR 99 Cb 0.19 0.24 0.99 0.00 -2.10 0.00 0.00 70.33 69.65 1vd0 n THR 99 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vd0 h ALA 100 N 3.78 1.18 -0.58 6.98 0.00 -0.68 0.12 119.26 130.06 1vd0 h ALA 100 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1vd0 h ALA 100 Cb 0.68 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.34 1vd0 h ALA 100 CO 0.03 -0.18 0.29 1.19 0.00 0.00 0.00 179.25 180.58 1vd0 n PHE 101 N -2.96 1.86 -1.77 0.00 3.72 -1.26 -3.10 117.46 113.95 1vd0 n PHE 101 Ca -0.02 -1.09 -0.40 0.00 -0.05 0.00 0.00 57.45 55.89 1vd0 n PHE 101 Cb 0.24 -0.60 -0.03 0.00 -0.94 0.00 0.00 39.48 38.14 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 -2.23 2.29 0.00 4.37 0.00 0.42 -1.67 121.76 124.94 1vd0 s ALA 102 Ca 0.38 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.45 1vd0 s ALA 102 Cb 0.31 -4.20 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1vd0 s ALA 102 CO 0.09 -3.53 0.00 0.41 0.00 0.00 0.00 175.76 172.72 1vd0 n GLY 103 N 5.75 1.80 3.99 0.00 0.00 -1.26 -4.79 105.19 110.69 1vd0 n GLY 103 Ca 0.28 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.40 3.78 -2.07 2.61 -4.23 -0.67 -5.00 115.64 108.66 1vd0 s THR 104 Ca 0.00 -0.98 0.12 0.00 -1.18 0.00 0.00 61.69 59.66 1vd0 s THR 104 Cb 0.00 -3.30 0.32 0.00 1.34 0.00 0.00 72.50 70.86 1vd0 s THR 104 CO 0.00 -0.12 1.33 0.00 -0.54 0.00 0.00 174.62 175.29 1vd0 n ALA 105 N -1.72 2.49 -2.20 3.99 0.00 -1.26 -4.89 120.51 116.92 1vd0 n ALA 105 Ca 0.02 -0.45 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 1vd0 n ALA 105 Cb 0.58 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.97 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 -1.71 3.72 -0.16 0.00 1.01 -1.26 -4.32 121.20 118.49 1vd0 s ILE 106 Ca 0.22 1.35 -0.02 0.00 0.00 0.00 0.00 60.65 62.20 1vd0 s ILE 106 Cb 0.12 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.71 1vd0 s ILE 106 CO 0.17 0.17 -0.08 -0.44 0.00 0.00 0.00 174.94 174.75 1vd0 s SER 107 N 0.54 4.31 -0.05 3.58 0.01 -1.10 -4.94 113.70 116.05 1vd0 s SER 107 Ca 0.56 -0.28 0.06 0.00 1.31 0.00 0.00 55.95 57.60 1vd0 s SER 107 Cb -0.32 -1.69 -0.02 0.00 0.21 0.00 0.00 66.02 64.21 1vd0 s SER 107 CO 0.33 0.13 -0.21 -0.51 0.41 0.00 0.00 173.24 173.39 1vd0 s ILE 108 N 0.57 2.41 -2.99 1.44 1.10 -1.26 -1.10 121.20 121.38 1vd0 s ILE 108 Ca -0.06 -0.96 0.24 0.00 -0.51 0.00 0.00 60.65 59.37 1vd0 s ILE 108 Cb -0.15 -1.89 0.20 0.00 0.15 0.00 0.00 42.46 40.77 1vd0 s ILE 108 CO 0.03 0.58 1.27 0.52 -2.11 0.00 0.00 174.94 175.23