#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vd0 n SER 2 N 0.00 0.23 -4.41 3.42 3.41 -1.26 -5.02 113.62 109.99 1vd0 n SER 2 Ca 0.00 0.31 -0.39 0.00 -0.26 0.00 0.00 58.87 58.53 1vd0 n SER 2 Cb 0.00 0.13 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 1vd0 n SER 2 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1vd0 n LYS 3 N -3.36 -1.45 -2.17 4.33 4.01 -1.26 -4.91 118.16 113.36 1vd0 n LYS 3 Ca 0.00 0.20 -0.26 0.00 -0.51 0.00 0.00 58.31 57.74 1vd0 n LYS 3 Cb 0.03 -4.65 0.07 0.00 -0.51 0.00 0.00 35.03 29.97 1vd0 n LYS 3 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 1vd0 s GLU 4 N -7.16 2.19 -0.08 1.97 0.41 -1.26 -5.11 118.70 109.66 1vd0 s GLU 4 Ca 0.67 -0.20 -0.31 0.00 -0.41 0.00 0.00 54.97 54.72 1vd0 s GLU 4 Cb -0.38 -2.14 0.12 0.00 -1.78 0.00 0.00 34.13 29.94 1vd0 s GLU 4 CO 1.00 -1.27 0.99 -0.08 -0.49 0.00 0.00 175.26 175.41 1vd0 s THR 5 N -3.28 0.00 -0.29 3.63 -1.32 -1.26 -5.18 115.64 107.94 1vd0 s THR 5 Ca 0.60 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.89 1vd0 s THR 5 Cb -0.11 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.03 1vd0 s THR 5 CO 0.45 0.00 1.06 0.12 -2.21 0.00 0.00 174.62 174.04 1vd0 s PHE 6 N -2.59 -0.45 -0.19 9.09 2.19 -1.26 -5.18 117.98 119.59 1vd0 s PHE 6 Ca 0.05 0.96 -0.28 0.00 0.33 0.00 0.00 56.93 57.99 1vd0 s PHE 6 Cb -0.01 0.33 0.11 0.00 -1.31 0.00 0.00 43.02 42.14 1vd0 s PHE 6 CO -0.06 -0.22 0.93 -0.08 1.83 0.00 0.00 175.22 177.61 1vd0 s THR 7 N 0.90 0.00 0.05 0.12 -1.32 -1.26 -5.18 115.64 108.95 1vd0 s THR 7 Ca -0.04 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.17 1vd0 s THR 7 Cb -0.04 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.04 1vd0 s THR 7 CO -0.12 0.00 1.20 -1.00 -2.21 0.00 0.00 174.62 172.49 1vd0 s HIS 8 N -0.57 0.03 0.23 9.09 3.76 -1.26 -5.19 115.29 121.38 1vd0 s HIS 8 Ca -0.02 -0.25 -0.13 0.00 -0.15 0.00 0.00 55.06 54.52 1vd0 s HIS 8 Cb -0.02 0.61 -0.00 0.00 1.11 0.00 0.00 32.58 34.27 1vd0 s HIS 8 CO 0.01 -0.50 0.46 -0.47 -0.85 0.00 0.00 174.74 173.39 1vd0 s TYR 9 N -2.13 0.30 -0.10 1.40 5.04 -1.26 -5.16 117.35 115.43 1vd0 s TYR 9 Ca 0.25 -0.66 0.02 0.00 -2.44 0.00 0.00 57.07 54.25 1vd0 s TYR 9 Cb -0.01 0.19 -0.01 0.00 0.35 0.00 0.00 41.96 42.49 1vd0 s TYR 9 CO 0.01 -0.95 -0.18 -0.65 -1.34 0.00 0.00 175.55 172.44 1vd0 s GLN 10 N -3.99 3.09 0.80 4.97 -1.52 -1.26 -5.12 119.66 116.62 1vd0 s GLN 10 Ca 0.20 -0.76 -0.11 0.00 -1.95 0.00 0.00 55.36 52.74 1vd0 s GLN 10 Cb -0.00 -2.46 0.07 0.00 -0.22 0.00 0.00 33.01 30.40 1vd0 s GLN 10 CO 0.06 0.28 1.09 -1.25 -0.25 0.00 0.00 175.29 175.22 1vd0 s PRO 11 N 0.15 2.06 0.62 2.91 0.04 -1.26 -5.05 135.00 134.48 1vd0 s PRO 11 Ca -0.09 1.10 -0.07 0.00 0.04 0.00 0.00 61.00 61.97 1vd0 s PRO 11 Cb -0.16 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.52 1vd0 s PRO 11 CO 0.06 -1.76 0.95 1.14 0.04 0.00 0.00 177.00 177.43 1vd0 s GLN 12 N -4.91 2.88 -0.00 4.56 1.03 -1.26 -5.10 119.66 116.86 1vd0 s GLN 12 Ca 0.62 0.10 0.00 0.00 0.04 0.00 0.00 55.36 56.12 1vd0 s GLN 12 Cb -0.17 -2.21 0.00 0.00 0.03 0.00 0.00 33.01 30.66 1vd0 s GLN 12 CO 0.56 -0.80 -0.01 0.20 -2.54 0.00 0.00 175.29 172.71 1vd0 s GLY 13 N -4.32 0.05 -0.07 2.60 0.00 -1.26 -5.14 107.32 99.17 1vd0 s GLY 13 Ca 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 44.72 45.24 1vd0 s GLY 13 CO 0.47 -0.01 -0.04 -1.31 0.00 0.00 0.00 173.10 172.20 1vd0 s ASN 14 N 0.01 1.45 -0.11 1.64 -0.87 -1.26 -5.13 114.94 110.68 1vd0 s ASN 14 Ca 0.00 -0.16 0.01 0.00 -1.57 0.00 0.00 52.86 51.14 1vd0 s ASN 14 Cb -0.01 -0.56 0.02 0.00 -0.02 0.00 0.00 41.25 40.68 1vd0 s ASN 14 CO -0.00 -0.10 -0.13 -0.94 -2.57 0.00 0.00 177.10 173.36 1vd0 s SER 15 N 1.35 2.28 0.02 -1.22 1.04 -1.26 -5.13 113.70 110.78 1vd0 s SER 15 Ca -0.04 -0.38 0.04 0.00 0.48 0.00 0.00 55.95 56.05 1vd0 s SER 15 Cb -0.14 -0.99 -0.02 0.00 0.10 0.00 0.00 66.02 64.97 1vd0 s SER 15 CO -0.03 -0.02 -0.13 -1.81 0.98 0.00 0.00 173.24 172.23 1vd0 s ASP 16 N 1.16 1.54 0.00 7.02 1.11 -1.26 -5.02 116.67 121.22 1vd0 s ASP 16 Ca -0.04 -0.37 0.15 0.00 0.18 0.00 0.00 52.55 52.47 1vd0 s ASP 16 Cb -0.14 -0.12 0.78 0.00 1.07 0.00 0.00 42.92 44.51 1vd0 s ASP 16 CO -0.03 0.07 1.39 -0.81 1.18 0.00 0.00 175.17 176.97 1vd0 n PRO 17 N 2.22 0.26 -2.19 8.23 -0.04 -1.26 -4.80 135.00 137.42 1vd0 n PRO 17 Ca -0.17 0.12 -0.36 0.00 -0.04 0.00 0.00 63.50 63.05 1vd0 n PRO 17 Cb 0.55 -1.50 0.00 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 -2.46 2.81 -0.10 0.55 0.00 -1.26 -4.98 121.76 116.32 1vd0 s ALA 18 Ca 0.16 0.94 -0.19 0.00 0.00 0.00 0.00 51.96 52.87 1vd0 s ALA 18 Cb 0.10 -3.40 -0.16 0.00 0.00 0.00 0.00 23.12 19.67 1vd0 s ALA 18 CO 0.22 -0.81 0.61 0.45 0.00 0.00 0.00 175.76 176.22 1vd0 h HIS 19 N 1.56 -0.07 -3.10 0.00 3.86 -1.99 -3.47 115.15 111.94 1vd0 h HIS 19 Ca -0.50 -0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.08 1vd0 h HIS 19 Cb 1.26 0.02 -0.13 0.00 1.06 0.00 0.00 27.41 29.62 1vd0 h HIS 19 CO 0.51 0.47 -0.70 0.95 0.86 0.00 0.00 177.93 180.02 1vd0 s THR 20 N -2.47 3.42 0.11 2.45 -4.23 -1.26 -3.33 115.64 110.33 1vd0 s THR 20 Ca -0.12 -1.48 0.02 0.00 -1.18 0.00 0.00 61.69 58.94 1vd0 s THR 20 Cb -0.01 -2.68 -0.04 0.00 1.34 0.00 0.00 72.50 71.11 1vd0 s THR 20 CO 0.43 -0.05 0.19 0.00 -0.54 0.00 0.00 174.62 174.65 1vd0 s ALA 21 N -1.59 3.80 -0.33 3.99 0.00 0.97 -4.94 121.76 123.67 1vd0 s ALA 21 Ca 0.25 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.19 1vd0 s ALA 21 Cb -0.10 -1.62 0.08 0.00 0.00 0.00 0.00 23.12 21.48 1vd0 s ALA 21 CO 0.16 0.66 0.04 0.95 0.00 0.00 0.00 175.76 177.56 1vd0 s THR 22 N -1.60 2.75 0.33 0.00 -4.23 -1.26 -1.94 115.64 109.69 1vd0 s THR 22 Ca 0.33 -1.80 -0.10 0.00 -1.18 0.00 0.00 61.69 58.94 1vd0 s THR 22 Cb -0.12 -2.76 -0.07 0.00 1.34 0.00 0.00 72.50 70.90 1vd0 s THR 22 CO 0.26 -0.33 0.67 0.00 -0.54 0.00 0.00 174.62 174.68 1vd0 s ALA 23 N 1.12 3.45 -2.00 3.99 0.00 -0.58 -4.88 121.76 122.86 1vd0 s ALA 23 Ca 0.01 -0.26 0.08 0.00 0.00 0.00 0.00 51.96 51.79 1vd0 s ALA 23 Cb -0.20 -2.57 0.46 0.00 0.00 0.00 0.00 23.12 20.81 1vd0 s ALA 23 CO -0.04 0.20 0.91 -0.35 0.00 0.00 0.00 175.76 176.49 1vd0 n PRO 24 N -0.84 0.49 -2.20 0.00 -0.04 -1.26 -1.61 135.00 129.53 1vd0 n PRO 24 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1vd0 n PRO 24 Cb 0.54 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 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 -4.90 1.26 0.55 0.00 -1.26 -4.40 105.19 96.43 1vd0 n GLY 25 Ca 0.06 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.08 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 1.90 0.87 3.73 -0.02 0.00 -0.29 -4.77 105.19 106.61 1vd0 n GLY 26 Ca 0.00 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 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 3.04 0.00 0.99 1.02 -1.21 -4.61 118.68 117.91 1vd0 s LEU 27 Ca 0.24 2.02 0.14 0.00 0.02 0.00 0.00 54.13 56.55 1vd0 s LEU 27 Cb 0.28 -4.55 0.03 0.00 0.02 0.00 0.00 46.19 41.97 1vd0 s LEU 27 CO -0.12 -2.38 0.81 -1.20 0.02 0.00 0.00 176.35 173.49 1vd0 n SER 28 N -3.56 1.65 -3.21 2.29 7.64 -1.26 -4.15 113.62 113.02 1vd0 n SER 28 Ca 0.11 -1.33 -0.06 0.00 1.01 0.00 0.00 58.87 58.60 1vd0 n SER 28 Cb 0.52 0.34 0.02 0.00 -1.01 0.00 0.00 64.21 64.09 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 -1.55 -1.20 0.18 -0.43 0.00 -1.26 -4.75 121.76 112.75 1vd0 s ALA 29 Ca 0.13 -0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.29 1vd0 s ALA 29 Cb 0.11 0.72 -0.08 0.00 0.00 0.00 0.00 23.12 23.87 1vd0 s ALA 29 CO 0.30 -1.03 1.13 -1.59 0.00 0.00 0.00 175.76 174.57 1vd0 s LYS 30 N -2.36 4.56 -0.10 0.00 -2.85 -1.26 -2.03 119.74 115.70 1vd0 s LYS 30 Ca 0.18 1.77 -0.07 0.00 -1.00 0.00 0.00 55.97 56.85 1vd0 s LYS 30 Cb -0.04 -3.26 0.04 0.00 -2.06 0.00 0.00 37.83 32.51 1vd0 s LYS 30 CO 0.08 0.03 0.25 0.00 0.10 0.00 0.00 175.35 175.81 1vd0 s ALA 31 N -0.23 -0.59 0.90 0.59 0.00 0.73 -4.96 121.76 118.21 1vd0 s ALA 31 Ca 0.50 0.91 -0.12 0.00 0.00 0.00 0.00 51.96 53.25 1vd0 s ALA 31 Cb -0.30 -0.56 0.13 0.00 0.00 0.00 0.00 23.12 22.39 1vd0 s ALA 31 CO 0.36 -0.17 1.09 -1.25 0.00 0.00 0.00 175.76 175.79 1vd0 s PRO 32 N 0.86 1.19 0.47 0.00 0.04 -1.26 -0.91 135.00 135.39 1vd0 s PRO 32 Ca -0.06 0.80 -0.08 0.00 0.04 0.00 0.00 61.00 61.70 1vd0 s PRO 32 Cb -0.07 -1.80 0.11 0.00 0.04 0.00 0.00 34.50 32.77 1vd0 s PRO 32 CO -0.05 -2.28 0.64 0.00 0.04 0.00 0.00 177.00 175.35 1vd0 n ALA 33 N -3.91 -0.72 -3.35 8.56 0.00 -1.26 -4.57 120.51 115.25 1vd0 n ALA 33 Ca 0.07 -0.84 -0.16 0.00 0.00 0.00 0.00 53.44 52.50 1vd0 n ALA 33 Cb 0.55 -0.04 0.08 0.00 0.00 0.00 0.00 19.45 20.05 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 -5.66 -3.64 0.00 2.81 0.93 -4.80 117.12 104.40 1vd0 n MET 34 Ca 0.08 0.83 -0.15 0.00 -1.81 0.00 0.00 57.70 56.65 1vd0 n MET 34 Cb 0.28 -5.75 -0.08 0.00 -0.71 0.00 0.00 33.22 26.96 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 -3.35 0.01 0.44 2.03 -4.23 -1.25 -1.78 115.64 107.50 1vd0 s THR 35 Ca 0.08 -0.06 -0.24 0.00 -1.18 0.00 0.00 61.69 60.29 1vd0 s THR 35 Cb -0.01 -0.85 -0.08 0.00 1.34 0.00 0.00 72.50 72.91 1vd0 s THR 35 CO 0.71 -0.03 1.17 -2.16 -0.54 0.00 0.00 174.62 173.77 1vd0 s PRO 36 N -0.31 3.87 0.34 3.99 0.04 -1.26 -0.49 135.00 141.18 1vd0 s PRO 36 Ca -0.05 1.82 0.04 0.00 0.04 0.00 0.00 61.00 62.85 1vd0 s PRO 36 Cb -0.03 -2.52 -0.06 0.00 0.04 0.00 0.00 34.50 31.93 1vd0 s PRO 36 CO 0.04 -0.47 0.05 -0.51 0.04 0.00 0.00 177.00 176.15 1vd0 s LEU 37 N -2.81 2.25 0.14 -3.56 1.43 0.14 -3.08 118.68 113.19 1vd0 s LEU 37 Ca 0.61 -1.39 0.11 0.00 -1.03 0.00 0.00 54.13 52.43 1vd0 s LEU 37 Cb -0.30 -0.43 -0.04 0.00 0.03 0.00 0.00 46.19 45.45 1vd0 s LEU 37 CO 0.37 -0.60 -0.26 0.00 0.23 0.00 0.00 176.35 176.09 1vd0 s MET 38 N -3.87 1.39 -0.18 1.70 0.23 0.36 -0.39 119.30 118.55 1vd0 s MET 38 Ca 0.36 -1.36 -0.05 0.00 -1.03 0.00 0.00 55.69 53.61 1vd0 s MET 38 Cb 0.09 -1.83 -0.03 0.00 -1.53 0.00 0.00 34.83 31.53 1vd0 s MET 38 CO 0.16 0.42 -0.00 -1.17 -2.03 0.00 0.00 175.02 172.40 1vd0 s LEU 39 N -2.16 3.36 0.00 0.18 1.98 -1.26 -1.18 118.68 119.60 1vd0 s LEU 39 Ca 0.14 -0.12 -0.13 0.00 -2.89 0.00 0.00 54.13 51.13 1vd0 s LEU 39 Cb -0.10 -1.84 0.20 0.00 0.66 0.00 0.00 46.19 45.11 1vd0 s LEU 39 CO 0.06 0.12 0.57 -0.67 -1.89 0.00 0.00 176.35 174.55 1vd0 n ASP 40 N 3.86 -2.33 0.00 3.68 2.03 0.65 -4.97 116.55 119.47 1vd0 n ASP 40 Ca -0.17 -0.72 0.00 0.00 0.52 0.00 0.00 54.79 54.42 1vd0 n ASP 40 Cb 0.52 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 40.34 1vd0 n ASP 40 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1vd0 n THR 41 N -4.19 0.00 -0.07 5.18 -1.04 -1.26 -4.57 114.28 108.33 1vd0 n THR 41 Ca 0.08 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.99 1vd0 n THR 41 Cb 0.34 -0.37 -0.07 0.00 -1.82 0.00 0.00 70.33 68.41 1vd0 n THR 41 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1vd0 h SER 42 N 0.00 0.00 0.83 8.00 0.02 -1.98 -3.36 113.55 117.06 1vd0 h SER 42 Ca 0.00 -0.46 -0.11 0.00 -0.84 0.00 0.00 61.79 60.38 1vd0 h SER 42 Cb 0.47 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1vd0 h SER 42 CO 0.00 0.93 -0.52 0.77 -1.14 0.00 0.00 176.83 176.86 1vd0 h SER 43 N -1.00 0.00 -4.39 3.07 4.64 -2.01 -3.47 113.55 110.38 1vd0 h SER 43 Ca -0.07 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.02 1vd0 h SER 43 Cb 0.71 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.91 1vd0 h SER 43 CO -0.04 0.52 -0.50 0.54 -0.87 0.00 0.00 176.83 176.48 1vd0 n ARG 44 N -3.59 -4.58 -4.31 4.77 5.12 -1.26 -5.04 116.66 107.77 1vd0 n ARG 44 Ca -0.00 0.56 -0.16 0.00 -1.93 0.00 0.00 57.85 56.32 1vd0 n ARG 44 Cb 0.60 -4.75 -0.10 0.00 -1.16 0.00 0.00 32.46 27.05 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 -5.08 1.26 -0.18 5.56 3.01 -1.26 -4.84 119.74 118.20 1vd0 s LYS 45 Ca 0.07 -1.61 -0.07 0.00 -1.01 0.00 0.00 55.97 53.36 1vd0 s LYS 45 Cb -0.03 -0.69 -0.04 0.00 -1.01 0.00 0.00 37.83 36.07 1vd0 s LYS 45 CO 0.49 -0.02 0.05 -1.17 0.51 0.00 0.00 175.35 175.21 1vd0 s LEU 46 N -3.27 3.69 0.13 3.17 2.96 -1.26 -0.26 118.68 123.85 1vd0 s LEU 46 Ca 0.24 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 1vd0 s LEU 46 Cb 0.04 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1vd0 s LEU 46 CO 0.06 0.16 -0.08 0.68 -1.32 0.00 0.00 176.35 175.85 1vd0 s VAL 47 N 0.46 0.97 0.32 1.68 -7.23 -0.33 -1.14 120.40 115.13 1vd0 s VAL 47 Ca 0.02 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 57.89 1vd0 s VAL 47 Cb -0.13 -1.83 -0.12 0.00 0.56 0.00 0.00 36.38 34.87 1vd0 s VAL 47 CO 0.01 -0.76 1.51 0.00 -0.31 0.00 0.00 175.10 175.55 1vd0 n ALA 48 N -0.15 2.22 -1.72 1.32 0.00 -1.26 -0.48 120.51 120.44 1vd0 n ALA 48 Ca -0.10 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.31 1vd0 n ALA 48 Cb 0.61 -2.41 0.03 0.00 0.00 0.00 0.00 19.45 17.68 1vd0 n ALA 48 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1vd0 n TRP 49 N 1.36 2.12 -0.06 0.00 -0.00 -1.18 -4.59 117.44 115.10 1vd0 n TRP 49 Ca 0.06 0.45 -0.12 0.00 -0.00 0.00 0.00 57.50 57.89 1vd0 n TRP 49 Cb 0.37 -2.35 -0.11 0.00 -0.00 0.00 0.00 31.31 29.22 1vd0 n TRP 49 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 177.69 177.25 1vd0 h ASP 50 N 1.60 -0.01 0.00 5.87 5.19 -1.91 -3.47 116.42 123.69 1vd0 h ASP 50 Ca -0.50 -0.80 0.00 0.00 -0.62 0.00 0.00 57.03 55.11 1vd0 h ASP 50 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.82 1vd0 h ASP 50 CO 0.58 0.86 0.00 0.61 -3.12 0.00 0.00 179.24 178.16 1vd0 n GLY 51 N 1.45 1.56 0.25 2.75 0.00 -1.26 -4.58 105.19 105.36 1vd0 n GLY 51 Ca -0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.85 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 0.59 -1.46 2.61 -2.24 -1.26 -2.92 114.28 109.60 1vd0 n THR 52 Ca 0.00 -0.20 -0.55 0.00 -2.27 0.00 0.00 64.05 61.03 1vd0 n THR 52 Cb 0.00 -1.12 -0.08 0.00 -2.10 0.00 0.00 70.33 67.03 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 -3.03 0.17 -2.44 4.28 -1.04 -1.26 -4.87 114.28 106.08 1vd0 n THR 53 Ca -0.19 -0.15 -0.42 0.00 -2.04 0.00 0.00 64.05 61.25 1vd0 n THR 53 Cb 0.68 -1.27 -0.03 0.00 -1.82 0.00 0.00 70.33 67.89 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 6.16 7.10 -0.75 8.00 1.47 -1.26 -2.98 116.67 134.42 1vd0 s ASP 54 Ca 1.10 1.99 0.00 0.00 1.18 0.00 0.00 52.55 56.82 1vd0 s ASP 54 Cb -1.06 -2.58 0.00 0.00 -0.34 0.00 0.00 42.92 38.94 1vd0 s ASP 54 CO 0.57 -0.45 0.00 0.61 0.68 0.00 0.00 175.17 176.58 1vd0 n GLY 55 N 3.17 0.71 0.14 2.12 0.00 -1.26 -4.92 105.19 105.14 1vd0 n GLY 55 Ca 0.09 -0.67 -0.23 0.00 0.00 0.00 0.00 46.02 45.20 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 0.10 0.12 -1.84 4.61 0.00 -1.66 -3.45 119.26 117.14 1vd0 h ALA 56 Ca -0.16 -1.09 -0.60 0.00 0.00 0.00 0.00 54.91 53.05 1vd0 h ALA 56 Cb 0.67 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1vd0 h ALA 56 CO 0.22 0.94 1.49 0.00 0.00 0.00 0.00 179.25 181.90 1vd0 n ALA 57 N -2.86 1.68 -0.08 0.00 0.00 -1.18 -4.03 120.51 114.04 1vd0 n ALA 57 Ca -0.24 -0.23 -0.10 0.00 0.00 0.00 0.00 53.44 52.87 1vd0 n ALA 57 Cb 1.05 -2.87 -0.11 0.00 0.00 0.00 0.00 19.45 17.52 1vd0 n ALA 57 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1vd0 n VAL 58 N 7.69 1.07 -3.89 0.00 0.24 0.48 -4.22 118.33 119.70 1vd0 n VAL 58 Ca 0.32 -0.55 -0.08 0.00 -2.04 0.00 0.00 64.34 61.99 1vd0 n VAL 58 Cb 0.42 -0.85 -0.03 0.00 -1.47 0.00 0.00 33.84 31.90 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 -5.30 0.12 -0.17 7.63 0.00 -1.24 -4.95 107.32 103.41 1vd0 s GLY 59 Ca -0.16 -0.49 -0.04 0.00 0.00 0.00 0.00 44.72 44.04 1vd0 s GLY 59 CO 0.55 -0.29 -0.04 -0.42 0.00 0.00 0.00 173.10 172.89 1vd0 s ILE 60 N -3.95 3.75 0.05 0.90 1.01 -1.26 0.28 121.20 121.99 1vd0 s ILE 60 Ca 0.15 -0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.10 1vd0 s ILE 60 Cb -0.04 -2.66 -0.08 0.00 0.01 0.00 0.00 42.46 39.70 1vd0 s ILE 60 CO 0.06 0.47 1.71 -0.22 0.00 0.00 0.00 174.94 176.97 1vd0 s LEU 61 N 0.65 4.37 -0.04 2.97 0.20 0.36 -0.26 118.68 126.93 1vd0 s LEU 61 Ca -0.02 2.50 -0.23 0.00 0.69 0.00 0.00 54.13 57.06 1vd0 s LEU 61 Cb -0.14 -3.55 -0.25 0.00 -0.43 0.00 0.00 46.19 41.81 1vd0 s LEU 61 CO 0.02 -0.93 1.01 0.00 -0.29 0.00 0.00 176.35 176.16 1vd0 h ALA 62 N 8.85 0.02 -3.25 5.97 0.00 -1.22 0.26 119.26 129.91 1vd0 h ALA 62 Ca -0.43 -0.52 -0.68 0.00 0.00 0.00 0.00 54.91 53.28 1vd0 h ALA 62 Cb 1.20 0.03 -0.33 0.00 0.00 0.00 0.00 17.79 18.69 1vd0 h ALA 62 CO 0.94 0.18 -0.87 0.08 0.00 0.00 0.00 179.25 179.58 1vd0 s VAL 63 N -2.99 2.11 0.23 0.00 1.01 -1.23 -4.34 120.40 115.20 1vd0 s VAL 63 Ca -0.15 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.58 1vd0 s VAL 63 Cb 0.01 -1.83 -0.16 0.00 0.00 0.00 0.00 36.38 34.40 1vd0 s VAL 63 CO 0.77 0.55 0.52 0.00 0.00 0.00 0.00 175.10 176.94 1vd0 n ALA 64 N 3.88 -2.63 -2.36 5.51 0.00 -1.26 -4.67 120.51 118.98 1vd0 n ALA 64 Ca -0.20 0.40 -0.11 0.00 0.00 0.00 0.00 53.44 53.53 1vd0 n ALA 64 Cb 0.52 -1.64 -0.09 0.00 0.00 0.00 0.00 19.45 18.24 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 -1.09 0.76 0.25 0.00 0.00 -0.09 -4.82 121.76 116.77 1vd0 s ALA 65 Ca 0.63 -1.43 0.04 0.00 0.00 0.00 0.00 51.96 51.20 1vd0 s ALA 65 Cb -0.87 1.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 1vd0 s ALA 65 CO 0.57 -0.59 0.13 -0.25 0.00 0.00 0.00 175.76 175.62 1vd0 n ASP 66 N -0.22 0.53 0.20 0.00 8.00 -1.26 -0.19 116.55 123.61 1vd0 n ASP 66 Ca -0.02 -2.43 0.14 0.00 0.71 0.00 0.00 54.79 53.19 1vd0 n ASP 66 Cb 0.64 0.84 0.67 0.00 -0.02 0.00 0.00 41.12 43.25 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 -0.01 -1.24 -0.00 -1.57 -0.85 115.11 111.44 1vd0 h GLN 67 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.46 1vd0 h GLN 67 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.28 1vd0 h GLN 67 CO 0.29 0.00 -0.29 -2.37 -0.00 0.00 0.00 178.83 176.47 1vd0 n THR 68 N -2.53 0.00 -2.07 1.86 5.66 -1.26 -4.62 114.28 111.33 1vd0 n THR 68 Ca 0.00 -0.09 -0.42 0.00 -3.05 0.00 0.00 64.05 60.49 1vd0 n THR 68 Cb 0.16 0.30 -0.03 0.00 -1.55 0.00 0.00 70.33 69.22 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 -2.61 6.72 -0.01 1.09 0.01 -0.33 -4.90 113.70 113.67 1vd0 s SER 69 Ca 0.22 2.48 0.19 0.00 1.31 0.00 0.00 55.95 60.15 1vd0 s SER 69 Cb 0.19 -2.60 -0.24 0.00 0.21 0.00 0.00 66.02 63.58 1vd0 s SER 69 CO 0.55 -0.71 0.69 1.07 0.41 0.00 0.00 173.24 175.25 1vd0 n THR 70 N 3.65 0.00 -3.21 1.44 5.66 -1.26 -4.44 114.28 116.13 1vd0 n THR 70 Ca 0.11 -0.18 -0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1vd0 n THR 70 Cb 0.41 0.69 -0.03 0.00 -1.55 0.00 0.00 70.33 69.85 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 -2.99 -0.87 0.14 1.09 2.01 -1.26 -4.02 115.64 109.74 1vd0 s THR 71 Ca 0.03 -0.05 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 1vd0 s THR 71 Cb 0.14 -0.96 -0.05 0.00 0.01 0.00 0.00 72.50 71.63 1vd0 s THR 71 CO 0.80 -0.06 0.36 -0.76 -0.69 0.00 0.00 174.62 174.27 1vd0 s LEU 72 N 2.75 4.27 -0.44 4.42 1.02 -0.63 -4.91 118.68 125.16 1vd0 s LEU 72 Ca 0.16 0.57 0.02 0.00 0.02 0.00 0.00 54.13 54.90 1vd0 s LEU 72 Cb -0.14 -3.28 0.12 0.00 0.02 0.00 0.00 46.19 42.91 1vd0 s LEU 72 CO -0.22 0.06 0.19 -0.89 0.02 0.00 0.00 176.35 175.51 1vd0 s THR 73 N -1.64 2.67 0.26 5.49 2.01 -1.26 -1.52 115.64 121.64 1vd0 s THR 73 Ca 0.40 -2.73 0.08 0.00 0.31 0.00 0.00 61.69 59.76 1vd0 s THR 73 Cb -0.12 -2.88 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 1vd0 s THR 73 CO 0.25 -0.71 0.09 0.72 -0.69 0.00 0.00 174.62 174.27 1vd0 s PHE 74 N 0.39 2.89 0.81 4.92 -0.71 -0.82 -0.67 117.98 124.79 1vd0 s PHE 74 Ca 0.13 -0.17 -0.11 0.00 -1.04 0.00 0.00 56.93 55.74 1vd0 s PHE 74 Cb -0.22 -1.29 0.08 0.00 -1.21 0.00 0.00 43.02 40.38 1vd0 s PHE 74 CO -0.04 0.58 1.09 0.71 -1.34 0.00 0.00 175.22 176.21 1vd0 s TYR 75 N -2.23 2.69 -0.18 3.49 2.02 0.64 -0.02 117.35 123.77 1vd0 s TYR 75 Ca 0.32 1.25 0.00 0.00 -0.37 0.00 0.00 57.07 58.27 1vd0 s TYR 75 Cb -0.07 -3.10 -0.11 0.00 -0.40 0.00 0.00 41.96 38.28 1vd0 s TYR 75 CO 0.22 -1.89 -0.17 0.36 -1.57 0.00 0.00 175.55 172.51 1vd0 n LYS 76 N -3.54 0.44 -3.74 -0.62 -0.00 -1.21 -4.01 118.16 105.48 1vd0 n LYS 76 Ca 0.07 0.11 -0.02 0.00 -0.00 0.00 0.00 58.31 58.47 1vd0 n LYS 76 Cb 0.55 -1.33 -0.01 0.00 -0.00 0.00 0.00 35.03 34.24 1vd0 n LYS 76 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1vd0 s SER 77 N -5.82 -0.14 0.00 -5.58 0.01 -1.26 -4.66 113.70 96.25 1vd0 s SER 77 Ca -0.24 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.64 1vd0 s SER 77 Cb 0.07 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.72 1vd0 s SER 77 CO 0.40 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.86 1vd0 n GLY 78 N -0.49 1.04 3.72 3.44 0.00 -1.24 -4.98 105.19 106.68 1vd0 n GLY 78 Ca -0.06 -2.17 -0.40 0.00 0.00 0.00 0.00 46.02 43.39 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 -1.06 5.00 0.05 2.61 2.01 -1.26 -1.46 115.64 121.54 1vd0 s THR 79 Ca 0.00 1.48 0.03 0.00 0.31 0.00 0.00 61.69 63.51 1vd0 s THR 79 Cb 0.00 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 1vd0 s THR 79 CO 0.00 0.27 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.74 1vd0 s PHE 80 N 0.66 0.83 -0.08 4.92 0.40 0.16 -4.99 117.98 119.88 1vd0 s PHE 80 Ca 0.38 -0.52 -0.24 0.00 -0.60 0.00 0.00 56.93 55.95 1vd0 s PHE 80 Cb -0.18 -0.48 -0.03 0.00 0.51 0.00 0.00 43.02 42.83 1vd0 s PHE 80 CO 0.19 -0.05 0.74 1.03 0.70 0.00 0.00 175.22 177.83 1vd0 s ARG 81 N -1.77 4.42 0.04 0.44 3.00 -1.26 -0.28 118.95 123.54 1vd0 s ARG 81 Ca -0.06 0.94 -0.16 0.00 0.00 0.00 0.00 55.73 56.44 1vd0 s ARG 81 Cb -0.09 -3.47 -0.24 0.00 0.00 0.00 0.00 34.95 31.14 1vd0 s ARG 81 CO 0.01 -0.01 1.14 -0.92 0.00 0.00 0.00 175.30 175.51 1vd0 h TYR 82 N 6.87 0.88 -0.16 -0.53 5.03 -1.91 -2.16 116.97 124.99 1vd0 h TYR 82 Ca -0.39 -0.49 0.05 0.00 2.58 0.00 0.00 58.73 60.48 1vd0 h TYR 82 Cb 1.19 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 39.37 1vd0 h TYR 82 CO 0.66 1.33 0.21 1.05 -1.32 0.00 0.00 178.16 180.09 1vd0 h GLU 83 N 0.18 0.00 0.07 1.82 4.11 -1.93 -1.50 114.58 117.34 1vd0 h GLU 83 Ca -0.12 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 58.96 1vd0 h GLU 83 Cb 1.59 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.81 1vd0 h GLU 83 CO 0.18 0.00 -2.03 -3.47 0.07 0.00 0.00 179.01 173.76 1vd0 n ASP 84 N -3.68 1.68 -4.69 3.06 2.03 -1.20 -4.90 116.55 108.86 1vd0 n ASP 84 Ca 0.01 0.19 -0.42 0.00 0.52 0.00 0.00 54.79 55.09 1vd0 n ASP 84 Cb 0.32 -0.50 -0.03 0.00 -0.72 0.00 0.00 41.12 40.20 1vd0 n ASP 84 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1vd0 s VAL 85 N -2.56 2.82 -0.80 5.18 1.01 -0.56 -4.93 120.40 120.56 1vd0 s VAL 85 Ca -0.19 0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.89 1vd0 s VAL 85 Cb 0.07 -3.20 0.09 0.00 0.00 0.00 0.00 36.38 33.34 1vd0 s VAL 85 CO 0.76 -0.00 1.07 -0.76 0.00 0.00 0.00 175.10 176.17 1vd0 s LEU 86 N 2.63 4.58 0.40 3.92 1.02 -0.73 -4.92 118.68 125.57 1vd0 s LEU 86 Ca 0.77 -1.45 -0.13 0.00 0.02 0.00 0.00 54.13 53.33 1vd0 s LEU 86 Cb -0.42 -2.42 -0.08 0.00 0.02 0.00 0.00 46.19 43.29 1vd0 s LEU 86 CO 0.34 -1.30 0.80 0.26 0.02 0.00 0.00 176.35 176.47 1vd0 s TRP 87 N 3.59 3.43 0.18 0.29 0.52 -1.26 -4.68 118.94 121.00 1vd0 s TRP 87 Ca 0.28 1.19 -0.30 0.00 0.02 0.00 0.00 56.10 57.29 1vd0 s TRP 87 Cb -0.11 -2.54 -0.08 0.00 -1.15 0.00 0.00 33.47 29.59 1vd0 s TRP 87 CO 0.01 -0.09 1.32 -1.25 0.02 0.00 0.00 176.95 176.96 1vd0 s PRO 88 N -3.59 4.38 0.40 4.98 0.04 -1.26 -4.91 135.00 135.04 1vd0 s PRO 88 Ca 0.54 2.05 0.18 0.00 0.04 0.00 0.00 61.00 63.81 1vd0 s PRO 88 Cb -0.10 -3.21 1.10 0.00 0.04 0.00 0.00 34.50 32.33 1vd0 s PRO 88 CO 0.26 -0.29 1.77 1.05 0.04 0.00 0.00 177.00 179.84 1vd0 h GLU 89 N 5.71 0.38 -0.73 4.56 9.09 -1.96 -1.64 114.58 129.99 1vd0 h GLU 89 Ca -0.44 -0.02 0.21 0.00 0.05 0.00 0.00 59.36 59.15 1vd0 h GLU 89 Cb 1.21 -0.09 -0.14 0.00 -1.65 0.00 0.00 28.75 28.09 1vd0 h GLU 89 CO 0.79 0.25 0.03 0.00 0.05 0.00 0.00 179.01 180.14 1vd0 n ALA 90 N -2.48 0.39 -2.17 1.06 0.00 -1.26 -3.91 120.51 112.15 1vd0 n ALA 90 Ca 0.25 0.78 -0.43 0.00 0.00 0.00 0.00 53.44 54.04 1vd0 n ALA 90 Cb 0.87 -0.58 -0.02 0.00 0.00 0.00 0.00 19.45 19.72 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 -5.62 3.05 -0.03 0.00 0.00 -0.62 -4.80 121.76 113.75 1vd0 s ALA 91 Ca -0.09 0.17 -0.09 0.00 0.00 0.00 0.00 51.96 51.94 1vd0 s ALA 91 Cb 0.22 -3.94 -0.30 0.00 0.00 0.00 0.00 23.12 19.09 1vd0 s ALA 91 CO 0.57 -2.34 0.75 0.66 0.00 0.00 0.00 175.76 175.39 1vd0 h SER 92 N 11.44 0.59 -3.45 0.00 4.64 -1.87 -3.46 113.55 121.44 1vd0 h SER 92 Ca -0.31 -0.83 -0.54 0.00 -0.47 0.00 0.00 61.79 59.63 1vd0 h SER 92 Cb 1.14 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 63.00 1vd0 h SER 92 CO 1.04 1.70 0.19 -0.62 -0.87 0.00 0.00 176.83 178.27 1vd0 s ASP 93 N -7.25 7.26 0.20 4.97 2.15 -1.26 -4.97 116.67 117.77 1vd0 s ASP 93 Ca -0.14 1.50 -0.07 0.00 0.43 0.00 0.00 52.55 54.27 1vd0 s ASP 93 Cb 0.06 -2.49 0.12 0.00 -0.30 0.00 0.00 42.92 40.30 1vd0 s ASP 93 CO 0.86 0.00 1.65 1.05 -0.17 0.00 0.00 175.17 178.56 1vd0 h GLU 94 N 5.65 0.99 -0.72 4.34 4.11 -2.02 -2.99 114.58 123.94 1vd0 h GLU 94 Ca -0.44 -0.33 -0.05 0.00 0.07 0.00 0.00 59.36 58.61 1vd0 h GLU 94 Cb 1.21 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 1vd0 h GLU 94 CO 0.71 1.01 0.24 1.15 0.07 0.00 0.00 179.01 182.19 1vd0 h THR 95 N 0.90 1.26 -0.59 -1.06 2.02 -1.99 -2.91 112.91 110.53 1vd0 h THR 95 Ca 0.15 -0.87 0.12 0.00 0.77 0.00 0.00 66.41 66.58 1vd0 h THR 95 Cb 0.60 0.46 -0.09 0.00 -1.74 0.00 0.00 68.15 67.38 1vd0 h THR 95 CO 0.04 0.34 0.06 0.50 0.37 0.00 0.00 175.52 176.83 1vd0 h LYS 96 N 1.05 0.18 -0.11 6.66 3.11 -1.92 0.64 116.57 126.18 1vd0 h LYS 96 Ca 0.23 -0.01 0.01 0.00 -2.81 0.00 0.00 60.65 58.08 1vd0 h LYS 96 Cb 0.28 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.46 1vd0 h LYS 96 CO -0.01 0.12 0.03 0.87 -2.81 0.00 0.00 179.45 177.64 1vd0 h LYS 97 N 0.18 0.07 0.00 1.90 1.57 -1.52 0.14 116.57 118.91 1vd0 h LYS 97 Ca 0.31 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1vd0 h LYS 97 Cb 0.48 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1vd0 h LYS 97 CO -0.45 0.05 -0.11 0.00 -0.57 0.00 0.00 179.45 178.36 1vd0 h ARG 98 N 0.08 0.00 -0.01 3.15 3.08 -1.17 -2.08 114.38 117.43 1vd0 h ARG 98 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1vd0 h ARG 98 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1vd0 h ARG 98 CO -0.06 0.11 -0.31 2.41 -1.07 0.00 0.00 179.97 181.05 1vd0 n THR 99 N -3.33 0.00 0.32 2.04 -1.04 0.21 -3.97 114.28 108.51 1vd0 n THR 99 Ca -0.00 -0.11 0.22 0.00 -2.04 0.00 0.00 64.05 62.11 1vd0 n THR 99 Cb 0.32 0.41 1.14 0.00 -1.82 0.00 0.00 70.33 70.38 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 3.57 1.00 -0.88 2.41 0.00 -0.02 -0.68 119.26 124.66 1vd0 h ALA 100 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.50 1vd0 h ALA 100 Cb 0.51 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.06 1vd0 h ALA 100 CO 0.00 0.00 0.52 1.19 0.00 0.00 0.00 179.25 180.96 1vd0 n PHE 101 N -3.01 2.76 -1.85 0.00 3.72 -1.25 -3.08 117.46 114.75 1vd0 n PHE 101 Ca -0.03 -1.60 -0.43 0.00 -0.05 0.00 0.00 57.45 55.35 1vd0 n PHE 101 Cb 0.08 -0.84 -0.03 0.00 -0.94 0.00 0.00 39.48 37.75 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 -3.04 3.17 0.00 4.37 0.00 -0.26 -1.93 121.76 124.06 1vd0 s ALA 102 Ca 0.53 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1vd0 s ALA 102 Cb 0.44 -3.92 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1vd0 s ALA 102 CO 0.11 -2.14 0.00 0.41 0.00 0.00 0.00 175.76 174.14 1vd0 n GLY 103 N 4.99 1.71 3.91 0.00 0.00 -1.26 -4.90 105.19 109.63 1vd0 n GLY 103 Ca 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.93 4.79 -0.80 2.61 -4.23 -0.81 -4.96 115.64 110.30 1vd0 s THR 104 Ca 0.00 0.21 0.04 0.00 -1.18 0.00 0.00 61.69 60.76 1vd0 s THR 104 Cb 0.00 -3.83 0.22 0.00 1.34 0.00 0.00 72.50 70.23 1vd0 s THR 104 CO 0.00 -0.83 0.83 0.00 -0.54 0.00 0.00 174.62 174.08 1vd0 n ALA 105 N -2.31 2.87 -2.58 3.99 0.00 -1.26 -4.86 120.51 116.35 1vd0 n ALA 105 Ca 0.01 -0.51 -0.39 0.00 0.00 0.00 0.00 53.44 52.55 1vd0 n ALA 105 Cb 0.55 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 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 -1.47 4.97 -0.14 0.00 1.01 -1.26 -3.73 121.20 120.58 1vd0 s ILE 106 Ca 0.14 1.33 0.01 0.00 0.00 0.00 0.00 60.65 62.14 1vd0 s ILE 106 Cb 0.11 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.59 1vd0 s ILE 106 CO 0.04 0.34 -0.16 -0.94 0.00 0.00 0.00 174.94 174.23 1vd0 s SER 107 N 0.27 3.70 -0.11 3.58 1.04 -0.54 -4.93 113.70 116.71 1vd0 s SER 107 Ca 0.34 -0.44 0.01 0.00 0.48 0.00 0.00 55.95 56.34 1vd0 s SER 107 Cb -0.18 -1.56 -0.02 0.00 0.10 0.00 0.00 66.02 64.37 1vd0 s SER 107 CO 0.17 0.12 -0.14 -0.51 0.98 0.00 0.00 173.24 173.86 1vd0 s ILE 108 N 0.61 2.97 -2.91 -1.02 1.10 -1.26 -0.67 121.20 120.02 1vd0 s ILE 108 Ca -0.09 -0.70 0.25 0.00 -0.51 0.00 0.00 60.65 59.60 1vd0 s ILE 108 Cb -0.16 -2.22 0.25 0.00 0.15 0.00 0.00 42.46 40.48 1vd0 s ILE 108 CO 0.03 0.54 1.35 0.52 -2.11 0.00 0.00 174.94 175.26