#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 -0.76 0.00 1.09 0.15 -1.26 -5.17 113.70 107.75 1vd0 s SER 2 Ca 0.00 1.04 -0.07 0.00 0.70 0.00 0.00 55.95 57.62 1vd0 s SER 2 Cb 0.00 1.87 -0.00 0.00 -1.71 0.00 0.00 66.02 66.18 1vd0 s SER 2 CO 0.00 -0.15 0.12 -0.54 1.20 0.00 0.00 173.24 173.88 1vd0 s LYS 3 N 2.60 0.47 0.24 5.44 3.01 -1.26 -5.17 119.74 125.06 1vd0 s LYS 3 Ca -0.04 -0.41 -0.02 0.00 -1.01 0.00 0.00 55.97 54.49 1vd0 s LYS 3 Cb -0.08 0.19 -0.03 0.00 -1.01 0.00 0.00 37.83 36.90 1vd0 s LYS 3 CO -0.18 -0.11 0.24 -1.21 0.51 0.00 0.00 175.35 174.60 1vd0 s GLU 4 N -1.38 1.40 -0.01 1.68 2.02 -1.26 -5.17 118.70 115.98 1vd0 s GLU 4 Ca -0.15 -1.63 0.01 0.00 0.02 0.00 0.00 54.97 53.22 1vd0 s GLU 4 Cb -0.08 0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.48 1vd0 s GLU 4 CO 0.01 -0.51 -0.04 0.99 0.02 0.00 0.00 175.26 175.74 1vd0 s THR 5 N -3.94 0.36 -0.30 3.63 2.01 -1.26 -5.12 115.64 111.02 1vd0 s THR 5 Ca 0.36 -0.15 -0.13 0.00 0.31 0.00 0.00 61.69 62.07 1vd0 s THR 5 Cb 0.04 -0.33 0.18 0.00 0.01 0.00 0.00 72.50 72.40 1vd0 s THR 5 CO 0.14 0.12 1.05 0.12 -0.69 0.00 0.00 174.62 175.37 1vd0 s PHE 6 N 0.17 -0.54 -0.24 4.92 5.36 -1.26 -5.17 117.98 121.23 1vd0 s PHE 6 Ca -0.02 0.63 -0.27 0.00 -0.96 0.00 0.00 56.93 56.32 1vd0 s PHE 6 Cb -0.05 0.21 0.11 0.00 -0.34 0.00 0.00 43.02 42.95 1vd0 s PHE 6 CO -0.00 -0.29 0.95 -0.08 -1.46 0.00 0.00 175.22 174.33 1vd0 s THR 7 N 2.84 0.00 -0.35 0.12 -1.32 -1.26 -5.14 115.64 110.53 1vd0 s THR 7 Ca -0.01 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.37 1vd0 s THR 7 Cb -0.09 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.91 1vd0 s THR 7 CO -0.12 0.00 0.18 -2.28 -2.21 0.00 0.00 174.62 170.18 1vd0 s HIS 8 N -0.13 3.22 0.23 9.09 2.46 -1.26 -5.05 115.29 123.84 1vd0 s HIS 8 Ca 0.01 -0.87 -0.19 0.00 0.47 0.00 0.00 55.06 54.47 1vd0 s HIS 8 Cb -0.04 -2.39 0.03 0.00 -0.13 0.00 0.00 32.58 30.05 1vd0 s HIS 8 CO -0.02 -0.59 0.60 -0.47 -2.47 0.00 0.00 174.74 171.79 1vd0 s TYR 9 N 1.56 -0.16 0.39 3.88 5.04 -1.26 -5.16 117.35 121.65 1vd0 s TYR 9 Ca 0.03 -0.21 -0.25 0.00 -2.44 0.00 0.00 57.07 54.20 1vd0 s TYR 9 Cb -0.18 0.51 -0.09 0.00 0.35 0.00 0.00 41.96 42.55 1vd0 s TYR 9 CO 0.06 -1.03 1.07 1.14 -1.34 0.00 0.00 175.55 175.45 1vd0 s GLN 10 N -3.89 4.18 0.53 4.97 -2.07 -1.26 -5.05 119.66 117.07 1vd0 s GLN 10 Ca 0.10 1.59 -0.09 0.00 -1.82 0.00 0.00 55.36 55.14 1vd0 s GLN 10 Cb -0.03 -2.61 0.13 0.00 -1.09 0.00 0.00 33.01 29.41 1vd0 s GLN 10 CO 0.00 -0.15 0.47 -0.35 -1.32 0.00 0.00 175.29 173.95 1vd0 n PRO 11 N 0.04 -1.94 -2.56 9.60 -0.04 -1.26 -3.80 135.00 135.04 1vd0 n PRO 11 Ca 0.04 -0.75 -0.12 0.00 -0.04 0.00 0.00 63.50 62.63 1vd0 n PRO 11 Cb 0.49 -0.71 -0.02 0.00 -0.04 0.00 0.00 33.50 33.22 1vd0 n PRO 11 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1vd0 n GLN 12 N -2.95 -1.77 -3.66 0.54 -0.06 -1.26 -4.83 117.38 103.40 1vd0 n GLN 12 Ca 0.07 0.04 -0.37 0.00 -2.00 0.00 0.00 57.00 54.73 1vd0 n GLN 12 Cb 0.25 -3.17 -0.06 0.00 -4.06 0.00 0.00 30.24 23.20 1vd0 n GLN 12 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 1vd0 s GLY 13 N -1.84 2.26 -0.85 1.69 0.00 -1.25 -4.39 107.32 102.94 1vd0 s GLY 13 Ca 0.23 -0.47 -0.11 0.00 0.00 0.00 0.00 44.72 44.37 1vd0 s GLY 13 CO 0.28 0.06 0.27 0.70 0.00 0.00 0.00 173.10 174.41 1vd0 n ASN 14 N 2.53 -1.07 -4.47 1.64 3.02 -1.26 -4.78 115.26 110.87 1vd0 n ASN 14 Ca -0.15 -0.44 -0.43 0.00 -0.03 0.00 0.00 54.58 53.52 1vd0 n ASN 14 Cb 0.53 -0.97 -0.04 0.00 -0.61 0.00 0.00 39.78 38.69 1vd0 n ASN 14 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1vd0 s SER 15 N -2.15 6.21 -0.27 6.41 1.04 -1.26 -4.97 113.70 118.70 1vd0 s SER 15 Ca 0.38 -0.84 -0.24 0.00 0.48 0.00 0.00 55.95 55.73 1vd0 s SER 15 Cb -0.22 -2.42 0.07 0.00 0.10 0.00 0.00 66.02 63.55 1vd0 s SER 15 CO 0.46 -1.40 0.70 -0.62 0.98 0.00 0.00 173.24 173.37 1vd0 s ASP 16 N 3.48 -0.75 0.28 7.02 -1.08 -1.26 -5.05 116.67 119.31 1vd0 s ASP 16 Ca 0.24 1.43 0.06 0.00 -0.52 0.00 0.00 52.55 53.76 1vd0 s ASP 16 Cb -0.16 1.43 0.41 0.00 -1.46 0.00 0.00 42.92 43.15 1vd0 s ASP 16 CO 0.12 -0.24 1.67 1.55 0.52 0.00 0.00 175.17 178.79 1vd0 h PRO 17 N 5.22 0.22 -6.67 4.34 0.13 -2.02 -3.45 132.00 129.77 1vd0 h PRO 17 Ca -0.29 -0.11 -0.58 0.00 -0.87 0.00 0.00 66.00 64.15 1vd0 h PRO 17 Cb 1.17 0.00 0.14 0.00 0.13 0.00 0.00 31.00 32.44 1vd0 h PRO 17 CO 0.07 0.64 0.11 0.00 -0.23 0.00 0.00 178.00 178.59 1vd0 n ALA 18 N -2.47 0.08 -1.91 -0.56 0.00 -1.26 -4.91 120.51 109.47 1vd0 n ALA 18 Ca -0.02 0.16 -0.31 0.00 0.00 0.00 0.00 53.44 53.27 1vd0 n ALA 18 Cb 0.51 -2.07 0.04 0.00 0.00 0.00 0.00 19.45 17.93 1vd0 n ALA 18 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1vd0 n HIS 19 N -0.84 3.09 -4.18 0.00 8.25 -1.26 -4.99 115.22 115.28 1vd0 n HIS 19 Ca 0.10 -2.67 -0.12 0.00 -0.26 0.00 0.00 57.72 54.78 1vd0 n HIS 19 Cb 0.41 -0.78 -0.10 0.00 1.12 0.00 0.00 29.99 30.65 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 -4.98 0.81 0.10 1.59 -4.23 -1.26 -4.20 115.64 103.47 1vd0 s THR 20 Ca 0.54 -1.91 -0.10 0.00 -1.18 0.00 0.00 61.69 59.04 1vd0 s THR 20 Cb 0.44 -1.66 -0.06 0.00 1.34 0.00 0.00 72.50 72.56 1vd0 s THR 20 CO -0.13 -0.81 0.43 0.00 -0.54 0.00 0.00 174.62 173.58 1vd0 s ALA 21 N -3.39 3.70 -0.30 3.99 0.00 0.10 -4.94 121.76 120.92 1vd0 s ALA 21 Ca 0.12 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.76 1vd0 s ALA 21 Cb 0.04 -2.32 0.08 0.00 0.00 0.00 0.00 23.12 20.92 1vd0 s ALA 21 CO -0.03 0.55 0.00 0.95 0.00 0.00 0.00 175.76 177.23 1vd0 s THR 22 N -1.44 1.93 0.24 0.00 -4.23 -1.26 -2.33 115.64 108.56 1vd0 s THR 22 Ca 0.35 -1.85 -0.06 0.00 -1.18 0.00 0.00 61.69 58.95 1vd0 s THR 22 Cb -0.14 -2.29 -0.06 0.00 1.34 0.00 0.00 72.50 71.35 1vd0 s THR 22 CO 0.19 -0.39 0.51 0.00 -0.54 0.00 0.00 174.62 174.38 1vd0 s ALA 23 N 1.13 3.66 -2.00 3.99 0.00 -0.69 -4.91 121.76 122.94 1vd0 s ALA 23 Ca 0.03 -0.52 0.11 0.00 0.00 0.00 0.00 51.96 51.58 1vd0 s ALA 23 Cb -0.19 -2.27 0.63 0.00 0.00 0.00 0.00 23.12 21.28 1vd0 s ALA 23 CO -0.09 0.39 1.06 -0.35 0.00 0.00 0.00 175.76 176.77 1vd0 n PRO 24 N -0.58 0.49 -1.60 0.00 -0.04 -1.26 -1.05 135.00 130.96 1vd0 n PRO 24 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1vd0 n PRO 24 Cb 0.53 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 1vd0 n PRO 24 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vd0 n GLY 25 N -0.02 -4.85 1.65 0.55 0.00 -1.24 -4.09 105.19 97.19 1vd0 n GLY 25 Ca 0.08 -0.46 -0.03 0.00 0.00 0.00 0.00 46.02 45.61 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 0.79 1.07 3.82 -0.02 0.00 -1.16 -4.82 105.19 104.88 1vd0 n GLY 26 Ca 0.00 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.31 3.21 0.00 0.99 1.43 -1.26 -4.75 118.68 116.99 1vd0 s LEU 27 Ca 0.11 1.64 0.07 0.00 -1.03 0.00 0.00 54.13 54.92 1vd0 s LEU 27 Cb 0.21 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.95 1vd0 s LEU 27 CO -0.07 -1.36 0.62 -0.24 0.23 0.00 0.00 176.35 175.54 1vd0 n SER 28 N -2.90 1.29 -3.80 2.29 2.88 -1.26 -4.24 113.62 107.87 1vd0 n SER 28 Ca 0.08 -1.14 -0.06 0.00 -1.33 0.00 0.00 58.87 56.41 1vd0 n SER 28 Cb 0.53 0.26 -0.02 0.00 -0.75 0.00 0.00 64.21 64.24 1vd0 n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vd0 s ALA 29 N -0.88 -1.34 0.29 -1.46 0.00 -1.26 -4.76 121.76 112.35 1vd0 s ALA 29 Ca 0.07 -0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.54 1vd0 s ALA 29 Cb 0.06 0.78 -0.11 0.00 0.00 0.00 0.00 23.12 23.85 1vd0 s ALA 29 CO 0.14 -1.04 1.57 0.15 0.00 0.00 0.00 175.76 176.58 1vd0 s LYS 30 N -3.67 4.14 -0.04 0.00 1.02 -1.26 -3.05 119.74 116.87 1vd0 s LYS 30 Ca 0.12 2.55 -0.01 0.00 0.02 0.00 0.00 55.97 58.64 1vd0 s LYS 30 Cb -0.05 -3.03 0.03 0.00 -0.52 0.00 0.00 37.83 34.27 1vd0 s LYS 30 CO 0.06 -0.60 0.03 0.00 -0.92 0.00 0.00 175.35 173.91 1vd0 s ALA 31 N -0.09 0.37 0.60 5.17 0.00 0.82 -4.97 121.76 123.66 1vd0 s ALA 31 Ca 0.62 0.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.51 1vd0 s ALA 31 Cb -0.47 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.06 1vd0 s ALA 31 CO 0.49 -0.36 1.12 -1.25 0.00 0.00 0.00 175.76 175.76 1vd0 s PRO 32 N 1.77 3.08 0.80 0.00 0.04 -1.26 -0.94 135.00 138.48 1vd0 s PRO 32 Ca 0.00 1.50 -0.14 0.00 0.04 0.00 0.00 61.00 62.41 1vd0 s PRO 32 Cb -0.13 -1.98 0.19 0.00 0.04 0.00 0.00 34.50 32.63 1vd0 s PRO 32 CO -0.03 -1.05 0.92 0.00 0.04 0.00 0.00 177.00 176.88 1vd0 n ALA 33 N -1.87 -1.68 -3.49 8.56 0.00 -1.26 -4.47 120.51 116.30 1vd0 n ALA 33 Ca 0.11 -1.26 -0.19 0.00 0.00 0.00 0.00 53.44 52.10 1vd0 n ALA 33 Cb 0.51 -0.07 0.07 0.00 0.00 0.00 0.00 19.45 19.96 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 -3.44 -5.16 -3.59 0.00 2.81 0.18 -4.78 117.12 103.16 1vd0 n MET 34 Ca 0.12 0.77 -0.17 0.00 -1.81 0.00 0.00 57.70 56.61 1vd0 n MET 34 Cb 0.43 -5.58 -0.07 0.00 -0.71 0.00 0.00 33.22 27.30 1vd0 n MET 34 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1vd0 s THR 35 N -3.46 0.01 0.35 2.03 -4.23 -1.25 -0.99 115.64 108.10 1vd0 s THR 35 Ca 0.10 -0.12 -0.27 0.00 -1.18 0.00 0.00 61.69 60.21 1vd0 s THR 35 Cb -0.02 -0.90 -0.09 0.00 1.34 0.00 0.00 72.50 72.83 1vd0 s THR 35 CO 0.76 -0.07 1.21 -2.16 -0.54 0.00 0.00 174.62 173.83 1vd0 s PRO 36 N -1.16 4.29 0.45 3.99 0.04 -1.26 -0.84 135.00 140.51 1vd0 s PRO 36 Ca -0.11 1.99 0.03 0.00 0.04 0.00 0.00 61.00 62.95 1vd0 s PRO 36 Cb -0.02 -2.94 -0.03 0.00 0.04 0.00 0.00 34.50 31.56 1vd0 s PRO 36 CO 0.08 -0.16 0.06 -0.51 0.04 0.00 0.00 177.00 176.51 1vd0 s LEU 37 N -2.00 2.20 0.10 -3.56 1.43 0.39 -2.80 118.68 114.44 1vd0 s LEU 37 Ca 0.51 -1.63 0.08 0.00 -1.03 0.00 0.00 54.13 52.06 1vd0 s LEU 37 Cb -0.35 -0.45 -0.03 0.00 0.03 0.00 0.00 46.19 45.39 1vd0 s LEU 37 CO 0.45 -0.85 -0.20 0.00 0.23 0.00 0.00 176.35 175.98 1vd0 s MET 38 N -3.79 1.10 -0.21 1.70 0.23 0.60 -0.93 119.30 117.99 1vd0 s MET 38 Ca 0.17 -1.16 -0.05 0.00 -1.03 0.00 0.00 55.69 53.62 1vd0 s MET 38 Cb 0.03 -1.33 -0.02 0.00 -1.53 0.00 0.00 34.83 31.98 1vd0 s MET 38 CO 0.10 0.30 0.01 -1.17 -2.03 0.00 0.00 175.02 172.23 1vd0 s LEU 39 N -1.94 3.26 1.06 0.18 1.98 -1.26 -1.25 118.68 120.70 1vd0 s LEU 39 Ca 0.06 -0.22 -0.15 0.00 -2.89 0.00 0.00 54.13 50.94 1vd0 s LEU 39 Cb -0.10 -1.84 0.22 0.00 0.66 0.00 0.00 46.19 45.13 1vd0 s LEU 39 CO 0.04 0.04 1.11 -0.62 -1.89 0.00 0.00 176.35 175.04 1vd0 s ASP 40 N 1.14 2.17 -0.02 3.68 -1.08 0.73 -4.95 116.67 118.35 1vd0 s ASP 40 Ca 0.03 0.93 0.01 0.00 -0.52 0.00 0.00 52.55 52.99 1vd0 s ASP 40 Cb -0.14 -1.42 -0.02 0.00 -1.46 0.00 0.00 42.92 39.88 1vd0 s ASP 40 CO 0.02 -3.38 -0.00 0.41 0.52 0.00 0.00 175.17 172.73 1vd0 n THR 41 N -4.31 0.13 0.34 1.71 -1.04 -1.26 -3.92 114.28 105.93 1vd0 n THR 41 Ca 0.08 -0.07 -0.13 0.00 -2.04 0.00 0.00 64.05 61.89 1vd0 n THR 41 Cb 0.58 -0.82 -0.06 0.00 -1.82 0.00 0.00 70.33 68.21 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 -0.73 -0.36 8.00 0.02 -1.97 -3.31 113.55 115.19 1vd0 h SER 42 Ca -0.05 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1vd0 h SER 42 Cb 1.10 0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1vd0 h SER 42 CO -0.00 -0.48 0.00 -1.20 -1.14 0.00 0.00 176.83 174.01 1vd0 n SER 43 N -4.58 3.08 -3.10 3.07 7.64 -1.26 -4.96 113.62 113.52 1vd0 n SER 43 Ca -0.11 -1.90 -0.21 0.00 1.01 0.00 0.00 58.87 57.66 1vd0 n SER 43 Cb 0.34 -0.24 0.01 0.00 -1.01 0.00 0.00 64.21 63.31 1vd0 n SER 43 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1vd0 n ARG 44 N 1.01 -3.58 -3.35 1.43 1.74 -1.25 -4.94 116.66 107.72 1vd0 n ARG 44 Ca 0.15 0.62 -0.35 0.00 -0.77 0.00 0.00 57.85 57.50 1vd0 n ARG 44 Cb 0.49 -5.35 -0.06 0.00 -1.02 0.00 0.00 32.46 26.52 1vd0 n ARG 44 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1vd0 s LYS 45 N -5.75 3.96 -0.22 5.56 -2.85 -1.26 -4.69 119.74 114.49 1vd0 s LYS 45 Ca 0.30 0.47 -0.12 0.00 -1.00 0.00 0.00 55.97 55.62 1vd0 s LYS 45 Cb -0.15 -2.86 -0.05 0.00 -2.06 0.00 0.00 37.83 32.71 1vd0 s LYS 45 CO 0.37 0.44 0.22 -1.17 0.10 0.00 0.00 175.35 175.31 1vd0 s LEU 46 N -2.14 4.15 0.09 2.77 2.96 -1.26 -0.19 118.68 125.06 1vd0 s LEU 46 Ca 0.40 0.25 0.02 0.00 -0.22 0.00 0.00 54.13 54.59 1vd0 s LEU 46 Cb -0.14 -2.22 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 1vd0 s LEU 46 CO 0.19 0.05 -0.07 0.68 -1.32 0.00 0.00 176.35 175.89 1vd0 s VAL 47 N 0.97 0.72 0.27 1.68 -7.23 -0.38 -2.99 120.40 113.42 1vd0 s VAL 47 Ca 0.11 -1.82 -0.29 0.00 -1.81 0.00 0.00 61.98 58.16 1vd0 s VAL 47 Cb -0.13 -1.55 -0.14 0.00 0.56 0.00 0.00 36.38 35.12 1vd0 s VAL 47 CO 0.04 -0.79 1.08 0.00 -0.31 0.00 0.00 175.10 175.12 1vd0 n ALA 48 N 0.16 -0.17 -1.71 1.32 0.00 -1.26 -0.29 120.51 118.57 1vd0 n ALA 48 Ca -0.13 0.40 -0.40 0.00 0.00 0.00 0.00 53.44 53.31 1vd0 n ALA 48 Cb 0.60 -2.05 0.02 0.00 0.00 0.00 0.00 19.45 18.02 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 0.60 2.11 -0.08 0.00 -0.00 -1.12 -4.48 117.44 114.47 1vd0 n TRP 49 Ca 0.11 0.48 -0.12 0.00 -0.00 0.00 0.00 57.50 57.96 1vd0 n TRP 49 Cb 0.31 -2.37 -0.05 0.00 -0.00 0.00 0.00 31.31 29.20 1vd0 n TRP 49 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 177.69 177.91 1vd0 h ASP 50 N 1.91 0.51 0.00 5.87 1.82 -1.91 -3.48 116.42 121.14 1vd0 h ASP 50 Ca -0.49 -0.41 0.00 0.00 -0.39 0.00 0.00 57.03 55.75 1vd0 h ASP 50 Cb 1.30 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 41.17 1vd0 h ASP 50 CO 0.59 0.81 0.00 0.61 -1.61 0.00 0.00 179.24 179.64 1vd0 n GLY 51 N -0.03 2.04 0.42 -0.78 0.00 -1.26 -4.89 105.19 100.69 1vd0 n GLY 51 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.29 1.13 -1.50 2.61 -2.24 -1.26 -3.04 114.28 109.69 1vd0 n THR 52 Ca 0.00 -0.13 -0.58 0.00 -2.27 0.00 0.00 64.05 61.07 1vd0 n THR 52 Cb 0.00 -1.85 -0.09 0.00 -2.10 0.00 0.00 70.33 66.30 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 -3.92 0.00 -2.64 4.28 -1.04 -1.26 -4.84 114.28 104.86 1vd0 n THR 53 Ca -0.29 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.30 1vd0 n THR 53 Cb 0.65 -0.40 -0.03 0.00 -1.82 0.00 0.00 70.33 68.72 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 2.39 7.33 -1.51 8.00 -4.77 -1.26 -3.37 116.67 123.47 1vd0 s ASP 54 Ca 0.90 1.80 0.00 0.00 -3.30 0.00 0.00 52.55 51.95 1vd0 s ASP 54 Cb -1.28 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 37.97 1vd0 s ASP 54 CO 0.69 -0.26 0.00 0.61 0.70 0.00 0.00 175.17 176.91 1vd0 n GLY 55 N 2.77 -0.20 0.10 2.12 0.00 -1.25 -4.88 105.19 103.85 1vd0 n GLY 55 Ca 0.06 -0.16 0.03 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 h ALA 56 N 0.76 0.62 -2.21 4.61 0.00 -1.63 -3.46 119.26 117.97 1vd0 h ALA 56 Ca -0.41 -0.61 -0.55 0.00 0.00 0.00 0.00 54.91 53.34 1vd0 h ALA 56 Cb 1.29 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 1vd0 h ALA 56 CO 0.49 0.67 1.16 0.00 0.00 0.00 0.00 179.25 181.57 1vd0 s ALA 57 N -3.03 3.46 -0.22 0.00 0.00 -1.04 -4.24 121.76 116.70 1vd0 s ALA 57 Ca -0.02 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.84 1vd0 s ALA 57 Cb 0.09 -3.81 -0.14 0.00 0.00 0.00 0.00 23.12 19.25 1vd0 s ALA 57 CO 0.80 -1.67 -0.20 1.33 0.00 0.00 0.00 175.76 176.03 1vd0 n VAL 58 N 5.88 1.24 -3.89 0.00 0.24 -0.11 -4.19 118.33 117.51 1vd0 n VAL 58 Ca 0.19 -0.46 -0.11 0.00 -2.04 0.00 0.00 64.34 61.91 1vd0 n VAL 58 Cb 0.43 -1.29 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 1vd0 n VAL 58 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vd0 n GLY 59 N 2.42 1.43 3.26 7.63 0.00 -1.25 -4.92 105.19 113.77 1vd0 n GLY 59 Ca -0.39 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 1vd0 n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vd0 s ILE 60 N -2.39 2.63 0.06 -0.61 1.01 -1.26 -0.46 121.20 120.16 1vd0 s ILE 60 Ca 0.21 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.77 1vd0 s ILE 60 Cb -0.03 -2.10 -0.08 0.00 0.01 0.00 0.00 42.46 40.25 1vd0 s ILE 60 CO 0.15 0.52 1.71 -0.22 0.00 0.00 0.00 174.94 177.11 1vd0 s LEU 61 N 0.76 4.37 -0.06 2.97 0.20 -0.02 -0.85 118.68 126.05 1vd0 s LEU 61 Ca -0.06 2.51 -0.25 0.00 0.69 0.00 0.00 54.13 57.02 1vd0 s LEU 61 Cb -0.15 -3.56 -0.25 0.00 -0.43 0.00 0.00 46.19 41.80 1vd0 s LEU 61 CO 0.01 -0.93 0.99 0.00 -0.29 0.00 0.00 176.35 176.13 1vd0 h ALA 62 N 8.79 0.02 -3.42 5.97 0.00 -1.59 0.53 119.26 129.55 1vd0 h ALA 62 Ca -0.43 -0.49 -0.67 0.00 0.00 0.00 0.00 54.91 53.31 1vd0 h ALA 62 Cb 1.20 0.02 -0.33 0.00 0.00 0.00 0.00 17.79 18.69 1vd0 h ALA 62 CO 0.94 0.11 -0.88 0.08 0.00 0.00 0.00 179.25 179.50 1vd0 s VAL 63 N -2.96 2.01 0.72 0.00 1.01 -1.23 -4.28 120.40 115.67 1vd0 s VAL 63 Ca -0.16 -1.00 -0.17 0.00 0.00 0.00 0.00 61.98 60.66 1vd0 s VAL 63 Cb 0.00 -1.73 -0.09 0.00 0.00 0.00 0.00 36.38 34.57 1vd0 s VAL 63 CO 0.74 0.55 0.11 0.00 0.00 0.00 0.00 175.10 176.50 1vd0 n ALA 64 N 3.47 -2.69 -3.15 5.51 0.00 -1.26 -4.66 120.51 117.72 1vd0 n ALA 64 Ca -0.19 -0.28 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 1vd0 n ALA 64 Cb 0.53 -1.60 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 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 -1.97 0.21 0.27 0.00 0.00 -0.12 -4.85 121.76 115.31 1vd0 s ALA 65 Ca 0.58 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 51.36 1vd0 s ALA 65 Cb -0.35 1.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.77 1vd0 s ALA 65 CO 0.65 -0.85 0.23 0.16 0.00 0.00 0.00 175.76 175.95 1vd0 s ASP 66 N -3.15 0.84 0.59 0.00 1.47 -1.26 -0.13 116.67 115.03 1vd0 s ASP 66 Ca 0.25 -1.54 0.29 0.00 1.18 0.00 0.00 52.55 52.74 1vd0 s ASP 66 Cb -0.01 0.48 1.77 0.00 -0.34 0.00 0.00 42.92 44.81 1vd0 s ASP 66 CO 0.16 -0.97 2.20 0.06 0.68 0.00 0.00 175.17 177.30 1vd0 h GLN 67 N 2.37 0.00 -0.00 2.11 -0.00 -1.71 0.23 115.11 118.11 1vd0 h GLN 67 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.35 1vd0 h GLN 67 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.72 1vd0 h GLN 67 CO 0.44 0.00 -0.01 -2.37 -0.00 0.00 0.00 178.83 176.89 1vd0 n THR 68 N -3.83 0.00 -2.20 1.86 5.66 -1.26 -4.56 114.28 109.95 1vd0 n THR 68 Ca -0.01 -0.02 -0.41 0.00 -3.05 0.00 0.00 64.05 60.56 1vd0 n THR 68 Cb 0.16 -0.42 -0.03 0.00 -1.55 0.00 0.00 70.33 68.50 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 -2.31 6.87 0.09 1.09 0.15 0.82 -4.92 113.70 115.49 1vd0 s SER 69 Ca 0.37 2.47 0.23 0.00 0.70 0.00 0.00 55.95 59.71 1vd0 s SER 69 Cb 0.21 -2.62 0.06 0.00 -1.71 0.00 0.00 66.02 61.96 1vd0 s SER 69 CO 0.42 -0.52 1.03 0.41 1.20 0.00 0.00 173.24 175.78 1vd0 n THR 70 N 2.23 0.28 -3.65 6.45 -1.04 -1.26 -4.57 114.28 112.72 1vd0 n THR 70 Ca 0.05 -0.33 -0.13 0.00 -2.04 0.00 0.00 64.05 61.60 1vd0 n THR 70 Cb 0.42 0.03 -0.08 0.00 -1.82 0.00 0.00 70.33 68.88 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 -3.25 -0.00 -0.12 12.58 2.01 -1.26 -3.70 115.64 121.90 1vd0 s THR 71 Ca 0.02 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.00 1vd0 s THR 71 Cb 0.13 -0.93 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1vd0 s THR 71 CO 0.79 0.00 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.94 1vd0 s LEU 72 N 0.49 3.36 -0.49 4.42 1.43 -0.21 -4.80 118.68 122.89 1vd0 s LEU 72 Ca -0.01 -0.02 -0.05 0.00 -1.03 0.00 0.00 54.13 53.02 1vd0 s LEU 72 Cb -0.05 -1.79 0.13 0.00 0.03 0.00 0.00 46.19 44.51 1vd0 s LEU 72 CO -0.01 0.27 0.31 -0.89 0.23 0.00 0.00 176.35 176.26 1vd0 s THR 73 N -0.21 3.71 0.36 5.49 2.01 -1.26 -1.71 115.64 124.03 1vd0 s THR 73 Ca 0.04 -2.19 0.08 0.00 0.31 0.00 0.00 61.69 59.93 1vd0 s THR 73 Cb -0.13 -3.48 -0.07 0.00 0.01 0.00 0.00 72.50 68.84 1vd0 s THR 73 CO 0.02 -0.77 -0.04 0.72 -0.69 0.00 0.00 174.62 173.87 1vd0 s PHE 74 N 0.91 2.39 1.01 4.92 -0.71 -0.98 -1.49 117.98 124.02 1vd0 s PHE 74 Ca 0.10 -0.62 -0.17 0.00 -1.04 0.00 0.00 56.93 55.20 1vd0 s PHE 74 Cb -0.23 -1.52 0.24 0.00 -1.21 0.00 0.00 43.02 40.30 1vd0 s PHE 74 CO -0.03 0.47 1.22 0.66 -1.34 0.00 0.00 175.22 176.19 1vd0 n TYR 75 N -0.84 -3.96 0.00 3.49 4.02 -0.03 0.03 117.16 119.87 1vd0 n TYR 75 Ca -0.05 -1.08 0.00 0.00 -0.01 0.00 0.00 57.90 56.76 1vd0 n TYR 75 Cb 0.65 -1.02 0.00 0.00 -0.02 0.00 0.00 39.34 38.95 1vd0 n TYR 75 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 1vd0 n LYS 76 N -3.99 1.42 -3.81 -0.72 -0.00 -1.26 -4.20 118.16 105.61 1vd0 n LYS 76 Ca 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.43 1vd0 n LYS 76 Cb 0.56 -0.72 0.00 0.00 -0.00 0.00 0.00 35.03 34.87 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 -2.21 -0.10 0.00 -5.58 0.01 -1.26 -4.44 113.70 100.12 1vd0 s SER 77 Ca 0.00 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.67 1vd0 s SER 77 Cb 0.00 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.77 1vd0 s SER 77 CO 0.00 -1.04 0.00 0.61 0.41 0.00 0.00 173.24 173.22 1vd0 n GLY 78 N -0.55 1.34 3.49 3.44 0.00 -1.26 -4.96 105.19 106.69 1vd0 n GLY 78 Ca -0.05 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.28 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 -1.26 4.89 0.08 2.61 2.01 -1.26 -1.49 115.64 121.22 1vd0 s THR 79 Ca 0.00 -0.12 0.05 0.00 0.31 0.00 0.00 61.69 61.93 1vd0 s THR 79 Cb 0.00 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.28 1vd0 s THR 79 CO 0.00 -0.61 -0.03 -0.36 -0.69 0.00 0.00 174.62 172.93 1vd0 s PHE 80 N 2.64 2.92 -0.07 4.92 0.40 -0.54 -5.02 117.98 123.23 1vd0 s PHE 80 Ca 0.19 -0.05 -0.28 0.00 -0.60 0.00 0.00 56.93 56.19 1vd0 s PHE 80 Cb -0.16 -1.53 -0.02 0.00 0.51 0.00 0.00 43.02 41.82 1vd0 s PHE 80 CO 0.16 0.45 0.90 1.03 0.70 0.00 0.00 175.22 178.46 1vd0 s ARG 81 N -2.13 4.45 -0.05 0.44 3.00 -1.26 -2.87 118.95 120.54 1vd0 s ARG 81 Ca 0.23 1.22 -0.26 0.00 0.00 0.00 0.00 55.73 56.92 1vd0 s ARG 81 Cb -0.11 -3.50 -0.21 0.00 0.00 0.00 0.00 34.95 31.12 1vd0 s ARG 81 CO 0.15 -0.14 1.15 -0.92 0.00 0.00 0.00 175.30 175.54 1vd0 h TYR 82 N 6.97 0.03 -0.46 -0.53 5.03 -1.91 -2.33 116.97 123.76 1vd0 h TYR 82 Ca -0.36 -0.01 0.13 0.00 2.58 0.00 0.00 58.73 61.07 1vd0 h TYR 82 Cb 1.18 -0.01 -0.02 0.00 1.55 0.00 0.00 36.73 39.44 1vd0 h TYR 82 CO 0.69 0.63 0.68 0.93 -1.32 0.00 0.00 178.16 179.77 1vd0 h GLU 83 N -0.58 0.00 0.00 1.82 5.08 -1.93 -1.36 114.58 117.62 1vd0 h GLU 83 Ca -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1vd0 h GLU 83 Cb 0.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1vd0 h GLU 83 CO 0.00 0.00 -0.74 -0.44 -1.00 0.00 0.00 179.01 176.83 1vd0 h ASP 84 N 0.00 0.00 -1.57 1.42 3.32 -1.95 -3.47 116.42 114.17 1vd0 h ASP 84 Ca 0.22 -0.24 -0.72 0.00 0.02 0.00 0.00 57.03 56.31 1vd0 h ASP 84 Cb 1.59 0.00 0.03 0.00 0.22 0.00 0.00 39.33 41.17 1vd0 h ASP 84 CO -0.00 1.03 0.69 0.52 -1.72 0.00 0.00 179.24 179.76 1vd0 n VAL 85 N -4.56 0.16 -2.87 -1.35 0.31 -0.51 -4.86 118.33 104.65 1vd0 n VAL 85 Ca -0.17 -0.03 -0.43 0.00 -0.01 0.00 0.00 64.34 63.70 1vd0 n VAL 85 Cb 0.42 -1.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.33 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 2.17 4.82 0.48 7.52 1.43 -0.16 -4.93 118.68 130.01 1vd0 s LEU 86 Ca 0.93 -2.08 -0.20 0.00 -1.03 0.00 0.00 54.13 51.74 1vd0 s LEU 86 Cb -1.04 -2.43 -0.09 0.00 0.03 0.00 0.00 46.19 42.66 1vd0 s LEU 86 CO 0.58 -1.09 1.03 0.26 0.23 0.00 0.00 176.35 177.36 1vd0 s TRP 87 N 2.90 3.04 0.25 0.29 0.52 -1.26 -4.70 118.94 119.98 1vd0 s TRP 87 Ca 0.36 1.58 -0.30 0.00 0.02 0.00 0.00 56.10 57.77 1vd0 s TRP 87 Cb -0.04 -3.04 -0.09 0.00 -1.15 0.00 0.00 33.47 29.15 1vd0 s TRP 87 CO -0.08 -0.74 1.27 -1.25 0.02 0.00 0.00 176.95 176.17 1vd0 s PRO 88 N -3.21 4.43 0.41 4.98 0.04 -1.26 -4.93 135.00 135.46 1vd0 s PRO 88 Ca 0.66 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.82 1vd0 s PRO 88 Cb -0.16 -3.16 0.85 0.00 0.04 0.00 0.00 34.50 32.08 1vd0 s PRO 88 CO 0.19 -0.15 2.04 1.05 0.04 0.00 0.00 177.00 180.18 1vd0 h GLU 89 N 4.57 0.56 -0.70 4.56 4.11 -1.94 -2.87 114.58 122.87 1vd0 h GLU 89 Ca -0.46 -0.03 0.21 0.00 0.07 0.00 0.00 59.36 59.14 1vd0 h GLU 89 Cb 1.22 -0.13 -0.13 0.00 0.50 0.00 0.00 28.75 30.21 1vd0 h GLU 89 CO 0.72 0.37 0.07 0.00 0.07 0.00 0.00 179.01 180.24 1vd0 n ALA 90 N -2.48 0.41 -2.24 1.06 0.00 -1.26 -3.71 120.51 112.29 1vd0 n ALA 90 Ca 0.04 0.74 -0.41 0.00 0.00 0.00 0.00 53.44 53.82 1vd0 n ALA 90 Cb 0.10 -0.57 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 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 -5.52 2.66 -0.67 0.00 0.00 -1.08 -4.82 121.76 112.33 1vd0 s ALA 91 Ca -0.09 -0.51 0.25 0.00 0.00 0.00 0.00 51.96 51.62 1vd0 s ALA 91 Cb 0.21 -4.14 0.52 0.00 0.00 0.00 0.00 23.12 19.71 1vd0 s ALA 91 CO 0.54 -3.11 1.50 0.77 0.00 0.00 0.00 175.76 175.46 1vd0 h SER 92 N 12.32 0.00 -3.55 0.00 0.02 -1.89 -3.43 113.55 117.02 1vd0 h SER 92 Ca -0.28 -0.12 -0.70 0.00 -0.84 0.00 0.00 61.79 59.85 1vd0 h SER 92 Cb 1.12 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.47 1vd0 h SER 92 CO 1.16 0.06 -0.35 -0.62 -1.14 0.00 0.00 176.83 175.94 1vd0 s ASP 93 N -4.41 6.14 0.56 3.07 -1.08 -1.26 -4.94 116.67 114.75 1vd0 s ASP 93 Ca 0.08 -0.72 0.31 0.00 -0.52 0.00 0.00 52.55 51.69 1vd0 s ASP 93 Cb 0.13 -2.18 1.47 0.00 -1.46 0.00 0.00 42.92 40.87 1vd0 s ASP 93 CO 0.67 -0.46 1.88 1.05 0.52 0.00 0.00 175.17 178.83 1vd0 h GLU 94 N 8.63 0.00 -0.43 4.34 4.11 -2.02 0.16 114.58 129.36 1vd0 h GLU 94 Ca -0.28 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.04 1vd0 h GLU 94 Cb 1.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1vd0 h GLU 94 CO 0.74 0.00 -0.17 1.15 0.07 0.00 0.00 179.01 180.80 1vd0 h THR 95 N 0.00 1.28 -0.27 -1.06 2.02 -1.97 -3.21 112.91 109.70 1vd0 h THR 95 Ca 0.36 -1.31 0.05 0.00 0.77 0.00 0.00 66.41 66.29 1vd0 h THR 95 Cb 1.57 1.20 -0.08 0.00 -1.74 0.00 0.00 68.15 69.10 1vd0 h THR 95 CO -0.00 0.44 -0.45 0.50 0.37 0.00 0.00 175.52 176.38 1vd0 h LYS 96 N 0.71 -0.42 -0.65 6.66 3.64 -1.06 0.76 116.57 126.21 1vd0 h LYS 96 Ca 0.10 0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.65 1vd0 h LYS 96 Cb 0.73 0.09 -0.11 0.00 -0.41 0.00 0.00 32.23 32.53 1vd0 h LYS 96 CO 0.06 -0.28 -0.03 0.87 -2.27 0.00 0.00 179.45 177.80 1vd0 h LYS 97 N -0.43 0.08 0.00 1.90 6.56 -1.59 1.09 116.57 124.18 1vd0 h LYS 97 Ca 0.09 -0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.66 1vd0 h LYS 97 Cb 0.62 -0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 32.25 1vd0 h LYS 97 CO -0.49 0.06 -0.08 0.00 -2.06 0.00 0.00 179.45 176.87 1vd0 h ARG 98 N 0.09 0.00 -0.54 3.15 2.47 -1.22 -2.62 114.38 115.71 1vd0 h ARG 98 Ca 0.34 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.06 1vd0 h ARG 98 Cb 0.55 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 1vd0 h ARG 98 CO -0.59 0.08 0.00 2.41 0.56 0.00 0.00 179.97 182.44 1vd0 n THR 99 N -3.19 0.73 0.10 2.04 -1.04 0.25 -4.27 114.28 108.90 1vd0 n THR 99 Ca 0.01 -0.87 -0.03 0.00 -2.04 0.00 0.00 64.05 61.12 1vd0 n THR 99 Cb 0.38 0.76 0.04 0.00 -1.82 0.00 0.00 70.33 69.69 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 4.29 0.67 -0.50 2.41 0.00 0.13 -3.12 119.26 123.13 1vd0 h ALA 100 Ca 0.00 -0.70 -0.17 0.00 0.00 0.00 0.00 54.91 54.03 1vd0 h ALA 100 Cb 0.98 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.54 1vd0 h ALA 100 CO 0.00 0.97 0.22 1.19 0.00 0.00 0.00 179.25 181.63 1vd0 n PHE 101 N -3.54 1.64 -2.01 0.00 3.72 -1.26 -2.49 117.46 113.52 1vd0 n PHE 101 Ca -0.00 -0.93 -0.42 0.00 -0.05 0.00 0.00 57.45 56.05 1vd0 n PHE 101 Cb 0.77 -0.53 -0.03 0.00 -0.94 0.00 0.00 39.48 38.75 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 -2.09 3.50 0.00 4.37 0.00 -1.18 -2.38 121.76 123.99 1vd0 s ALA 102 Ca 0.35 0.83 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1vd0 s ALA 102 Cb 0.28 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.62 1vd0 s ALA 102 CO 0.08 -1.58 0.00 0.41 0.00 0.00 0.00 175.76 174.67 1vd0 n GLY 103 N 4.32 1.76 3.99 0.00 0.00 -1.26 -4.91 105.19 109.09 1vd0 n GLY 103 Ca 0.18 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.86 2.86 -1.13 2.61 -4.23 -1.00 -5.00 115.64 107.89 1vd0 s THR 104 Ca 0.00 -0.81 0.12 0.00 -1.18 0.00 0.00 61.69 59.82 1vd0 s THR 104 Cb 0.00 -3.02 0.51 0.00 1.34 0.00 0.00 72.50 71.33 1vd0 s THR 104 CO 0.00 -0.01 1.35 0.00 -0.54 0.00 0.00 174.62 175.42 1vd0 n ALA 105 N -2.11 3.01 -2.18 3.99 0.00 -1.26 -4.92 120.51 117.03 1vd0 n ALA 105 Ca 0.08 -1.11 -0.41 0.00 0.00 0.00 0.00 53.44 51.99 1vd0 n ALA 105 Cb 0.59 -1.03 -0.04 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 -1.83 4.30 -0.07 0.00 1.01 -1.26 -4.13 121.20 119.23 1vd0 s ILE 106 Ca 0.35 1.95 0.04 0.00 0.00 0.00 0.00 60.65 62.99 1vd0 s ILE 106 Cb 0.24 -4.25 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 1vd0 s ILE 106 CO 0.16 0.32 -0.17 -0.55 0.00 0.00 0.00 174.94 174.70 1vd0 s SER 107 N -0.10 3.75 -0.15 3.58 0.15 -0.55 -4.93 113.70 115.44 1vd0 s SER 107 Ca 0.47 -0.31 -0.02 0.00 0.70 0.00 0.00 55.95 56.80 1vd0 s SER 107 Cb -0.25 -0.96 0.05 0.00 -1.71 0.00 0.00 66.02 63.14 1vd0 s SER 107 CO 0.31 0.29 0.01 -0.51 1.20 0.00 0.00 173.24 174.53 1vd0 s ILE 108 N -0.38 0.63 0.00 6.45 1.10 -1.26 -1.46 121.20 126.27 1vd0 s ILE 108 Ca 0.04 -0.40 0.00 0.00 -0.51 0.00 0.00 60.65 59.78 1vd0 s ILE 108 Cb -0.12 -0.96 0.00 0.00 0.15 0.00 0.00 42.46 41.52 1vd0 s ILE 108 CO 0.02 -0.01 0.49 0.55 -2.11 0.00 0.00 174.94 173.89