#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 -0.83 -0.18 8.00 0.01 -1.26 -5.14 113.70 114.30 1vd0 s SER 2 Ca 0.00 0.80 -0.01 0.00 1.31 0.00 0.00 55.95 58.05 1vd0 s SER 2 Cb 0.00 1.81 0.05 0.00 0.21 0.00 0.00 66.02 68.09 1vd0 s SER 2 CO 0.00 -0.16 -0.03 -0.54 0.41 0.00 0.00 173.24 172.92 1vd0 s LYS 3 N 2.75 1.28 -0.02 12.44 1.02 -1.26 -5.11 119.74 130.84 1vd0 s LYS 3 Ca 0.03 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 1vd0 s LYS 3 Cb -0.10 -2.13 0.07 0.00 -0.52 0.00 0.00 37.83 35.14 1vd0 s LYS 3 CO -0.17 -0.51 0.64 -1.21 -0.92 0.00 0.00 175.35 173.18 1vd0 s GLU 4 N 1.64 1.06 -0.04 1.68 2.02 -1.26 -5.18 118.70 118.62 1vd0 s GLU 4 Ca -0.01 0.12 -0.29 0.00 0.02 0.00 0.00 54.97 54.81 1vd0 s GLU 4 Cb -0.16 0.50 0.10 0.00 0.10 0.00 0.00 34.13 34.66 1vd0 s GLU 4 CO -0.07 -0.35 0.85 -0.08 0.02 0.00 0.00 175.26 175.63 1vd0 s THR 5 N -1.59 0.00 -0.29 3.63 -1.32 -1.26 -5.17 115.64 109.64 1vd0 s THR 5 Ca -0.09 0.00 -0.14 0.00 -1.21 0.00 0.00 61.69 60.25 1vd0 s THR 5 Cb -0.00 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 70.10 1vd0 s THR 5 CO 0.06 0.00 0.76 0.12 -2.21 0.00 0.00 174.62 173.35 1vd0 s PHE 6 N -2.22 -1.05 -0.18 9.09 5.36 -1.26 -5.17 117.98 122.56 1vd0 s PHE 6 Ca -0.00 1.94 -0.22 0.00 -0.96 0.00 0.00 56.93 57.68 1vd0 s PHE 6 Cb -0.01 0.63 0.06 0.00 -0.34 0.00 0.00 43.02 43.36 1vd0 s PHE 6 CO -0.03 -0.52 0.60 -0.08 -1.46 0.00 0.00 175.22 173.73 1vd0 s THR 7 N 2.16 0.00 0.01 0.12 -1.32 -1.26 -5.18 115.64 110.18 1vd0 s THR 7 Ca -0.07 -0.03 -0.09 0.00 -1.21 0.00 0.00 61.69 60.29 1vd0 s THR 7 Cb -0.07 -0.85 0.00 0.00 -1.51 0.00 0.00 72.50 70.07 1vd0 s THR 7 CO -0.19 -0.02 0.17 -2.28 -2.21 0.00 0.00 174.62 170.09 1vd0 s HIS 8 N -0.04 0.03 -0.28 9.09 5.04 -1.26 -5.16 115.29 122.72 1vd0 s HIS 8 Ca -0.03 -0.16 -0.17 0.00 -1.54 0.00 0.00 55.06 53.16 1vd0 s HIS 8 Cb -0.04 -0.04 0.08 0.00 0.04 0.00 0.00 32.58 32.63 1vd0 s HIS 8 CO 0.03 -0.34 0.71 -0.47 -2.34 0.00 0.00 174.74 172.32 1vd0 s TYR 9 N -1.80 -1.01 -0.21 3.88 6.14 -1.26 -5.14 117.35 117.95 1vd0 s TYR 9 Ca -0.11 2.07 -0.19 0.00 0.64 0.00 0.00 57.07 59.48 1vd0 s TYR 9 Cb -0.05 0.58 -0.03 0.00 0.42 0.00 0.00 41.96 42.88 1vd0 s TYR 9 CO -0.00 -0.50 0.55 1.14 0.64 0.00 0.00 175.55 177.38 1vd0 s GLN 10 N 1.45 4.18 -0.29 4.97 -2.07 -1.26 -5.02 119.66 121.62 1vd0 s GLN 10 Ca -0.09 0.45 -0.29 0.00 -1.82 0.00 0.00 55.36 53.62 1vd0 s GLN 10 Cb -0.05 -3.58 -0.02 0.00 -1.09 0.00 0.00 33.01 28.27 1vd0 s GLN 10 CO -0.17 -0.21 1.66 -1.25 -1.32 0.00 0.00 175.29 174.00 1vd0 s PRO 11 N 1.82 3.58 0.00 9.60 0.04 -1.26 -4.99 135.00 143.80 1vd0 s PRO 11 Ca 0.25 1.47 0.03 0.00 0.04 0.00 0.00 61.00 62.79 1vd0 s PRO 11 Cb -0.16 -4.10 -0.01 0.00 0.04 0.00 0.00 34.50 30.28 1vd0 s PRO 11 CO 0.10 -1.55 -0.09 1.14 0.04 0.00 0.00 177.00 176.63 1vd0 s GLN 12 N 5.10 0.73 0.00 4.56 -2.07 -1.26 -5.12 119.66 121.60 1vd0 s GLN 12 Ca 0.73 -0.40 0.00 0.00 -1.82 0.00 0.00 55.36 53.88 1vd0 s GLN 12 Cb -0.22 -0.69 0.00 0.00 -1.09 0.00 0.00 33.01 31.01 1vd0 s GLN 12 CO 0.32 0.18 0.00 0.41 -1.32 0.00 0.00 175.29 174.88 1vd0 n GLY 13 N 2.66 2.42 3.53 2.60 0.00 -1.26 -5.13 105.19 110.02 1vd0 n GLY 13 Ca -0.15 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.79 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 0.00 4.15 0.09 1.61 -0.87 -1.26 -5.11 114.94 113.55 1vd0 s ASN 14 Ca 0.00 -0.46 -0.27 0.00 -1.57 0.00 0.00 52.86 50.56 1vd0 s ASN 14 Cb 0.00 -0.70 -0.06 0.00 -0.02 0.00 0.00 41.25 40.47 1vd0 s ASN 14 CO 0.00 0.18 0.85 -0.55 -2.57 0.00 0.00 177.10 175.01 1vd0 s SER 15 N -2.14 7.36 -0.69 -1.22 0.15 -1.26 -5.02 113.70 110.88 1vd0 s SER 15 Ca 0.19 1.62 -0.10 0.00 0.70 0.00 0.00 55.95 58.36 1vd0 s SER 15 Cb -0.11 -2.52 0.18 0.00 -1.71 0.00 0.00 66.02 61.86 1vd0 s SER 15 CO 0.12 0.01 0.59 -1.81 1.20 0.00 0.00 173.24 173.34 1vd0 s ASP 16 N -0.19 6.11 0.28 5.45 1.01 -1.26 -4.90 116.67 123.17 1vd0 s ASP 16 Ca 0.41 -2.55 0.06 0.00 0.71 0.00 0.00 52.55 51.19 1vd0 s ASP 16 Cb -0.22 -2.08 0.40 0.00 1.01 0.00 0.00 42.92 42.03 1vd0 s ASP 16 CO 0.26 -0.56 1.66 1.55 0.21 0.00 0.00 175.17 178.30 1vd0 h PRO 17 N 7.76 0.23 -7.26 8.23 0.13 -2.01 -3.45 132.00 135.63 1vd0 h PRO 17 Ca -0.01 -0.12 -0.51 0.00 -0.87 0.00 0.00 66.00 64.48 1vd0 h PRO 17 Cb 1.02 0.00 0.13 0.00 0.13 0.00 0.00 31.00 32.29 1vd0 h PRO 17 CO 0.78 0.65 0.34 0.00 -0.23 0.00 0.00 178.00 179.54 1vd0 s ALA 18 N -4.02 2.26 -0.21 -0.56 0.00 -1.26 -4.99 121.76 112.97 1vd0 s ALA 18 Ca -0.04 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.37 1vd0 s ALA 18 Cb 0.13 -3.32 -0.20 0.00 0.00 0.00 0.00 23.12 19.73 1vd0 s ALA 18 CO 0.78 -1.67 -0.02 0.72 0.00 0.00 0.00 175.76 175.57 1vd0 n HIS 19 N -3.09 0.39 -4.57 0.00 8.25 -1.26 -5.01 115.22 109.93 1vd0 n HIS 19 Ca 0.10 0.09 -0.26 0.00 -0.26 0.00 0.00 57.72 57.38 1vd0 n HIS 19 Cb 0.52 -1.05 -0.11 0.00 1.12 0.00 0.00 29.99 30.47 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 -2.53 2.03 0.30 1.59 -4.23 -1.26 -4.07 115.64 107.46 1vd0 s THR 20 Ca -0.29 -2.09 0.01 0.00 -1.18 0.00 0.00 61.69 58.14 1vd0 s THR 20 Cb 0.08 -2.82 -0.03 0.00 1.34 0.00 0.00 72.50 71.07 1vd0 s THR 20 CO 0.67 -0.10 0.48 0.00 -0.54 0.00 0.00 174.62 175.13 1vd0 s ALA 21 N -2.72 3.77 -0.29 3.99 0.00 0.14 -4.90 121.76 121.74 1vd0 s ALA 21 Ca 0.34 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.32 1vd0 s ALA 21 Cb 0.07 -2.01 0.09 0.00 0.00 0.00 0.00 23.12 21.27 1vd0 s ALA 21 CO 0.17 0.12 0.09 0.95 0.00 0.00 0.00 175.76 177.08 1vd0 s THR 22 N -2.16 0.78 0.33 0.00 -4.23 -1.26 -2.71 115.64 106.40 1vd0 s THR 22 Ca 0.38 -1.23 -0.11 0.00 -1.18 0.00 0.00 61.69 59.55 1vd0 s THR 22 Cb -0.10 -1.54 -0.07 0.00 1.34 0.00 0.00 72.50 72.14 1vd0 s THR 22 CO 0.33 -0.60 0.69 0.00 -0.54 0.00 0.00 174.62 174.51 1vd0 s ALA 23 N 1.68 3.41 -2.00 3.99 0.00 -0.69 -4.88 121.76 123.27 1vd0 s ALA 23 Ca 0.08 -0.18 0.10 0.00 0.00 0.00 0.00 51.96 51.96 1vd0 s ALA 23 Cb -0.17 -2.63 0.62 0.00 0.00 0.00 0.00 23.12 20.94 1vd0 s ALA 23 CO -0.23 0.22 1.06 -0.35 0.00 0.00 0.00 175.76 176.45 1vd0 n PRO 24 N -0.76 0.49 -1.51 0.00 -0.04 -1.26 -1.11 135.00 130.80 1vd0 n PRO 24 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1vd0 n PRO 24 Cb 0.53 -1.33 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 -4.78 0.00 0.55 0.00 -1.26 -4.29 105.19 95.39 1vd0 n GLY 25 Ca 0.08 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 1.07 -1.15 3.41 -0.02 0.00 -1.15 -4.77 105.19 102.58 1vd0 n GLY 26 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 -0.29 -0.12 0.99 4.32 -1.24 -4.82 117.00 115.84 1vd0 n LEU 27 Ca 0.00 0.30 0.02 0.00 -0.02 0.00 0.00 56.01 56.30 1vd0 n LEU 27 Cb 0.48 -1.20 0.01 0.00 -1.62 0.00 0.00 43.42 41.09 1vd0 n LEU 27 CO 0.00 -3.56 0.23 -0.24 -1.22 0.00 0.00 177.39 172.60 1vd0 n SER 28 N -1.45 1.02 -3.81 -1.43 2.88 -1.26 -4.10 113.62 105.47 1vd0 n SER 28 Ca 0.06 -1.01 -0.05 0.00 -1.33 0.00 0.00 58.87 56.54 1vd0 n SER 28 Cb 0.54 0.27 -0.02 0.00 -0.75 0.00 0.00 64.21 64.25 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 -0.60 -1.42 0.21 -1.46 0.00 -1.26 -4.73 121.76 112.50 1vd0 s ALA 29 Ca 0.04 -0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.59 1vd0 s ALA 29 Cb 0.03 0.75 -0.09 0.00 0.00 0.00 0.00 23.12 23.81 1vd0 s ALA 29 CO 0.08 -1.04 1.38 -1.59 0.00 0.00 0.00 175.76 174.59 1vd0 s LYS 30 N -3.63 4.33 -0.05 0.00 -2.85 -1.26 -3.30 119.74 112.98 1vd0 s LYS 30 Ca 0.12 2.17 -0.02 0.00 -1.00 0.00 0.00 55.97 57.23 1vd0 s LYS 30 Cb -0.04 -3.16 0.03 0.00 -2.06 0.00 0.00 37.83 32.60 1vd0 s LYS 30 CO 0.05 -0.35 0.11 0.00 0.10 0.00 0.00 175.35 175.25 1vd0 s ALA 31 N 0.21 -0.18 0.84 0.59 0.00 0.90 -4.98 121.76 119.13 1vd0 s ALA 31 Ca 0.59 0.51 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 1vd0 s ALA 31 Cb -0.39 -0.34 0.09 0.00 0.00 0.00 0.00 23.12 22.48 1vd0 s ALA 31 CO 0.39 -0.12 1.09 -1.25 0.00 0.00 0.00 175.76 175.87 1vd0 s PRO 32 N 0.90 1.74 0.43 0.00 0.04 -1.26 -0.73 135.00 136.11 1vd0 s PRO 32 Ca -0.07 0.99 -0.07 0.00 0.04 0.00 0.00 61.00 61.89 1vd0 s PRO 32 Cb -0.09 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.69 1vd0 s PRO 32 CO -0.04 -1.96 0.58 0.00 0.04 0.00 0.00 177.00 175.63 1vd0 n ALA 33 N -3.71 -0.64 -3.45 8.56 0.00 -1.26 -4.57 120.51 115.43 1vd0 n ALA 33 Ca 0.08 -0.77 -0.18 0.00 0.00 0.00 0.00 53.44 52.56 1vd0 n ALA 33 Cb 0.54 -0.03 0.07 0.00 0.00 0.00 0.00 19.45 20.03 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 -2.23 -4.80 -3.65 0.00 2.81 0.35 -4.76 117.12 104.84 1vd0 n MET 34 Ca 0.07 0.79 -0.15 0.00 -1.81 0.00 0.00 57.70 56.60 1vd0 n MET 34 Cb 0.26 -5.62 -0.08 0.00 -0.71 0.00 0.00 33.22 27.07 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 -3.44 0.01 0.19 2.03 -4.23 -1.26 -1.35 115.64 107.60 1vd0 s THR 35 Ca 0.15 -0.08 -0.30 0.00 -1.18 0.00 0.00 61.69 60.28 1vd0 s THR 35 Cb -0.03 -0.82 -0.09 0.00 1.34 0.00 0.00 72.50 72.91 1vd0 s THR 35 CO 0.76 -0.04 1.31 -2.16 -0.54 0.00 0.00 174.62 173.94 1vd0 s PRO 36 N -0.33 4.39 0.41 3.99 0.04 -1.26 -0.49 135.00 141.75 1vd0 s PRO 36 Ca -0.05 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.11 1vd0 s PRO 36 Cb -0.03 -3.20 -0.08 0.00 0.04 0.00 0.00 34.50 31.23 1vd0 s PRO 36 CO 0.04 -0.26 0.03 -0.51 0.04 0.00 0.00 177.00 176.34 1vd0 s LEU 37 N -0.04 2.90 0.16 -3.56 1.43 0.51 -2.79 118.68 117.28 1vd0 s LEU 37 Ca 0.57 -1.34 0.08 0.00 -1.03 0.00 0.00 54.13 52.41 1vd0 s LEU 37 Cb -0.36 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 1vd0 s LEU 37 CO 0.38 -0.47 -0.18 0.00 0.23 0.00 0.00 176.35 176.31 1vd0 s MET 38 N -3.74 1.26 -0.18 1.70 0.23 -0.01 -0.09 119.30 118.48 1vd0 s MET 38 Ca 0.35 -1.39 -0.07 0.00 -1.03 0.00 0.00 55.69 53.55 1vd0 s MET 38 Cb 0.09 -1.32 -0.04 0.00 -1.53 0.00 0.00 34.83 32.04 1vd0 s MET 38 CO 0.18 0.27 0.05 -1.17 -2.03 0.00 0.00 175.02 172.32 1vd0 s LEU 39 N -2.63 3.75 0.00 0.18 1.98 -1.26 -1.41 118.68 119.29 1vd0 s LEU 39 Ca 0.15 0.05 -0.11 0.00 -2.89 0.00 0.00 54.13 51.33 1vd0 s LEU 39 Cb -0.06 -1.94 0.17 0.00 0.66 0.00 0.00 46.19 45.02 1vd0 s LEU 39 CO 0.06 0.17 0.50 -0.67 -1.89 0.00 0.00 176.35 174.52 1vd0 n ASP 40 N 3.55 -2.26 0.00 3.68 2.03 0.70 -4.98 116.55 119.27 1vd0 n ASP 40 Ca -0.17 -0.66 0.00 0.00 0.52 0.00 0.00 54.79 54.49 1vd0 n ASP 40 Cb 0.52 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 1vd0 n ASP 40 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1vd0 n THR 41 N -4.03 0.00 -0.01 5.18 -2.24 -1.26 -4.62 114.28 107.29 1vd0 n THR 41 Ca 0.07 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.64 1vd0 n THR 41 Cb 0.30 -0.97 -0.13 0.00 -2.10 0.00 0.00 70.33 67.42 1vd0 n THR 41 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1vd0 h SER 42 N 0.00 0.31 0.83 3.42 0.87 -1.98 -3.35 113.55 113.66 1vd0 h SER 42 Ca 0.00 -0.81 -0.07 0.00 -1.23 0.00 0.00 61.79 59.68 1vd0 h SER 42 Cb 0.58 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 1vd0 h SER 42 CO 0.00 1.64 -0.31 -1.28 -0.53 0.00 0.00 176.83 176.34 1vd0 h SER 43 N -0.36 0.00 -5.56 6.23 0.87 -2.01 -3.47 113.55 109.25 1vd0 h SER 43 Ca -0.33 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 59.90 1vd0 h SER 43 Cb 1.72 0.00 0.16 0.00 -0.44 0.00 0.00 62.40 63.84 1vd0 h SER 43 CO 0.01 0.31 -0.73 0.54 -0.53 0.00 0.00 176.83 176.44 1vd0 n ARG 44 N -3.51 -6.60 -4.11 2.24 1.74 -1.26 -5.02 116.66 100.15 1vd0 n ARG 44 Ca -0.00 0.82 -0.09 0.00 -0.77 0.00 0.00 57.85 57.81 1vd0 n ARG 44 Cb 0.47 -5.77 -0.10 0.00 -1.02 0.00 0.00 32.46 26.05 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 -5.45 0.89 -0.22 5.56 1.02 -1.26 -4.78 119.74 115.51 1vd0 s LYS 45 Ca 0.08 -1.36 -0.08 0.00 0.02 0.00 0.00 55.97 54.64 1vd0 s LYS 45 Cb -0.03 0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.49 1vd0 s LYS 45 CO 0.71 -0.25 0.08 -1.17 -0.92 0.00 0.00 175.35 173.79 1vd0 s LEU 46 N -3.01 3.67 0.22 3.17 2.96 -1.26 -0.21 118.68 124.21 1vd0 s LEU 46 Ca 0.20 -0.05 0.05 0.00 -0.22 0.00 0.00 54.13 54.10 1vd0 s LEU 46 Cb 0.07 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.75 1vd0 s LEU 46 CO -0.01 0.07 -0.05 0.68 -1.32 0.00 0.00 176.35 175.72 1vd0 s VAL 47 N 1.01 1.26 0.45 1.68 -7.23 -0.50 -2.93 120.40 114.15 1vd0 s VAL 47 Ca 0.04 -2.08 -0.24 0.00 -1.81 0.00 0.00 61.98 57.89 1vd0 s VAL 47 Cb -0.14 -2.24 -0.09 0.00 0.56 0.00 0.00 36.38 34.47 1vd0 s VAL 47 CO 0.03 -0.43 1.27 0.00 -0.31 0.00 0.00 175.10 175.66 1vd0 n ALA 48 N -0.41 1.30 -1.77 1.32 0.00 -1.26 -0.83 120.51 118.87 1vd0 n ALA 48 Ca -0.06 0.22 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 1vd0 n ALA 48 Cb 0.63 -2.28 0.01 0.00 0.00 0.00 0.00 19.45 17.81 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 -1.23 2.57 0.05 0.00 -0.00 -1.12 -4.48 118.94 114.73 1vd0 s TRP 49 Ca 0.63 1.30 -0.18 0.00 -0.00 0.00 0.00 56.10 57.85 1vd0 s TRP 49 Cb -0.48 -3.85 -0.15 0.00 -0.00 0.00 0.00 33.47 28.98 1vd0 s TRP 49 CO 0.56 -2.69 1.30 -0.44 -0.00 0.00 0.00 176.95 175.68 1vd0 h ASP 50 N 2.48 0.58 0.00 5.86 5.19 -1.91 -3.48 116.42 125.14 1vd0 h ASP 50 Ca -0.50 -0.56 0.00 0.00 -0.62 0.00 0.00 57.03 55.34 1vd0 h ASP 50 Cb 1.26 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.60 1vd0 h ASP 50 CO 0.62 1.03 0.00 0.61 -3.12 0.00 0.00 179.24 178.38 1vd0 n GLY 51 N 0.44 2.29 0.44 2.75 0.00 -1.26 -4.71 105.19 105.14 1vd0 n GLY 51 Ca -0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.37 1.11 -1.58 2.61 -2.24 -1.26 -2.97 114.28 109.59 1vd0 n THR 52 Ca 0.00 -0.11 -0.64 0.00 -2.27 0.00 0.00 64.05 61.03 1vd0 n THR 52 Cb 0.00 -1.85 -0.10 0.00 -2.10 0.00 0.00 70.33 66.28 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 -3.90 0.03 -2.50 4.28 -1.04 -1.26 -4.84 114.28 105.04 1vd0 n THR 53 Ca -0.28 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.30 1vd0 n THR 53 Cb 0.63 -0.58 -0.03 0.00 -1.82 0.00 0.00 70.33 68.53 1vd0 n THR 53 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1vd0 s ASP 54 N 4.10 7.10 -0.48 8.00 -4.77 -1.26 -3.00 116.67 126.36 1vd0 s ASP 54 Ca 1.09 1.78 0.00 0.00 -3.30 0.00 0.00 52.55 52.13 1vd0 s ASP 54 Cb -1.45 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 37.82 1vd0 s ASP 54 CO 0.75 -0.53 0.00 0.61 0.70 0.00 0.00 175.17 176.70 1vd0 n GLY 55 N 3.28 0.73 0.09 2.12 0.00 -1.24 -4.92 105.19 105.25 1vd0 n GLY 55 Ca 0.10 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.17 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 0.32 -2.32 4.61 0.00 -1.62 -3.45 119.26 116.79 1vd0 h ALA 56 Ca -0.09 -0.86 -0.54 0.00 0.00 0.00 0.00 54.91 53.42 1vd0 h ALA 56 Cb 0.30 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1vd0 h ALA 56 CO 0.14 1.10 1.15 0.00 0.00 0.00 0.00 179.25 181.63 1vd0 s ALA 57 N -2.80 3.61 -0.09 0.00 0.00 -1.20 -3.96 121.76 117.32 1vd0 s ALA 57 Ca -0.01 1.15 0.07 0.00 0.00 0.00 0.00 51.96 53.16 1vd0 s ALA 57 Cb 0.09 -3.79 -0.10 0.00 0.00 0.00 0.00 23.12 19.32 1vd0 s ALA 57 CO 0.84 -1.46 0.02 1.33 0.00 0.00 0.00 175.76 176.48 1vd0 n VAL 58 N 5.46 0.58 -3.84 0.00 0.24 0.87 -4.36 118.33 117.30 1vd0 n VAL 58 Ca 0.18 -0.35 -0.07 0.00 -2.04 0.00 0.00 64.34 62.07 1vd0 n VAL 58 Cb 0.42 -0.78 -0.01 0.00 -1.47 0.00 0.00 33.84 32.00 1vd0 n VAL 58 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1vd0 s GLY 59 N -4.13 0.03 -0.15 7.63 0.00 -1.24 -4.92 107.32 104.54 1vd0 s GLY 59 Ca -0.05 -0.39 -0.04 0.00 0.00 0.00 0.00 44.72 44.23 1vd0 s GLY 59 CO 0.34 -0.05 -0.01 -0.42 0.00 0.00 0.00 173.10 172.96 1vd0 s ILE 60 N -3.33 4.16 0.17 0.90 1.01 -1.26 -0.36 121.20 122.48 1vd0 s ILE 60 Ca 0.13 -0.27 -0.32 0.00 0.00 0.00 0.00 60.65 60.20 1vd0 s ILE 60 Cb -0.05 -2.83 -0.11 0.00 0.01 0.00 0.00 42.46 39.48 1vd0 s ILE 60 CO 0.08 0.50 1.72 -0.22 0.00 0.00 0.00 174.94 177.02 1vd0 s LEU 61 N 0.22 4.38 -0.10 2.97 0.20 0.35 0.08 118.68 126.78 1vd0 s LEU 61 Ca -0.00 2.76 -0.26 0.00 0.69 0.00 0.00 54.13 57.32 1vd0 s LEU 61 Cb -0.13 -3.59 -0.27 0.00 -0.43 0.00 0.00 46.19 41.77 1vd0 s LEU 61 CO 0.02 -0.95 0.84 0.00 -0.29 0.00 0.00 176.35 175.97 1vd0 h ALA 62 N 7.44 -0.02 -3.24 5.97 0.00 -0.54 0.10 119.26 128.96 1vd0 h ALA 62 Ca -0.44 -0.55 -0.45 0.00 0.00 0.00 0.00 54.91 53.47 1vd0 h ALA 62 Cb 1.21 0.03 -0.38 0.00 0.00 0.00 0.00 17.79 18.65 1vd0 h ALA 62 CO 0.95 0.11 -0.77 0.08 0.00 0.00 0.00 179.25 179.62 1vd0 s VAL 63 N -2.41 0.48 0.20 0.00 1.01 -1.21 -4.51 120.40 113.97 1vd0 s VAL 63 Ca -0.17 0.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.73 1vd0 s VAL 63 Cb -0.01 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 35.66 1vd0 s VAL 63 CO 0.74 0.28 0.12 0.00 0.00 0.00 0.00 175.10 176.23 1vd0 n ALA 64 N 5.11 -2.23 -2.64 5.51 0.00 -1.26 -4.73 120.51 120.27 1vd0 n ALA 64 Ca -0.08 0.12 -0.15 0.00 0.00 0.00 0.00 53.44 53.32 1vd0 n ALA 64 Cb 0.50 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 19.03 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 -0.85 1.09 0.23 0.00 0.00 0.09 -4.84 121.76 117.47 1vd0 s ALA 65 Ca 0.35 -1.67 0.00 0.00 0.00 0.00 0.00 51.96 50.64 1vd0 s ALA 65 Cb -0.41 1.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 1vd0 s ALA 65 CO 0.35 -0.73 0.18 0.16 0.00 0.00 0.00 175.76 175.72 1vd0 s ASP 66 N -3.25 0.48 0.55 0.00 1.47 -1.26 -0.07 116.67 114.59 1vd0 s ASP 66 Ca 0.34 -1.45 0.25 0.00 1.18 0.00 0.00 52.55 52.86 1vd0 s ASP 66 Cb 0.01 0.43 1.49 0.00 -0.34 0.00 0.00 42.92 44.51 1vd0 s ASP 66 CO 0.21 -0.91 2.08 0.06 0.68 0.00 0.00 175.17 177.29 1vd0 h GLN 67 N 2.49 0.00 0.00 2.11 -0.00 -1.70 0.34 115.11 118.35 1vd0 h GLN 67 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.32 1vd0 h GLN 67 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.73 1vd0 h GLN 67 CO 0.49 0.00 0.00 -2.37 -0.00 0.00 0.00 178.83 176.95 1vd0 n THR 68 N -4.16 0.24 -2.24 1.86 5.66 -1.26 -4.63 114.28 109.74 1vd0 n THR 68 Ca 0.03 0.06 -0.41 0.00 -3.05 0.00 0.00 64.05 60.68 1vd0 n THR 68 Cb 0.35 -0.65 -0.03 0.00 -1.55 0.00 0.00 70.33 68.45 1vd0 n THR 68 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1vd0 s SER 69 N -2.63 6.93 0.00 1.09 1.04 0.12 -4.92 113.70 115.32 1vd0 s SER 69 Ca 0.22 2.42 0.22 0.00 0.48 0.00 0.00 55.95 59.29 1vd0 s SER 69 Cb 0.16 -2.62 -0.07 0.00 0.10 0.00 0.00 66.02 63.59 1vd0 s SER 69 CO 0.38 -0.47 1.03 1.07 0.98 0.00 0.00 173.24 176.22 1vd0 n THR 70 N 2.13 0.00 -3.65 2.02 5.66 -1.26 -4.56 114.28 114.62 1vd0 n THR 70 Ca 0.04 -0.12 -0.04 0.00 -3.05 0.00 0.00 64.05 60.88 1vd0 n THR 70 Cb 0.43 1.07 -0.06 0.00 -1.55 0.00 0.00 70.33 70.22 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 -2.75 -0.70 -0.17 1.09 2.01 -1.26 -4.06 115.64 109.80 1vd0 s THR 71 Ca 0.13 0.03 -0.10 0.00 0.31 0.00 0.00 61.69 62.05 1vd0 s THR 71 Cb 0.17 -0.94 -0.05 0.00 0.01 0.00 0.00 72.50 71.69 1vd0 s THR 71 CO 0.72 0.01 0.18 -0.76 -0.69 0.00 0.00 174.62 174.08 1vd0 s LEU 72 N 2.53 4.26 -0.57 4.42 1.43 -0.27 -4.87 118.68 125.62 1vd0 s LEU 72 Ca -0.06 0.36 -0.08 0.00 -1.03 0.00 0.00 54.13 53.32 1vd0 s LEU 72 Cb -0.10 -2.17 0.15 0.00 0.03 0.00 0.00 46.19 44.10 1vd0 s LEU 72 CO -0.18 0.21 0.44 -0.89 0.23 0.00 0.00 176.35 176.16 1vd0 s THR 73 N 0.08 4.31 0.21 5.49 2.01 -1.26 -1.70 115.64 124.78 1vd0 s THR 73 Ca 0.12 -2.22 0.11 0.00 0.31 0.00 0.00 61.69 60.01 1vd0 s THR 73 Cb -0.12 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 1vd0 s THR 73 CO 0.01 -0.85 -0.22 0.72 -0.69 0.00 0.00 174.62 173.59 1vd0 s PHE 74 N 0.78 2.32 1.13 4.92 -0.71 -1.10 0.23 117.98 125.55 1vd0 s PHE 74 Ca 0.11 -0.34 -0.16 0.00 -1.04 0.00 0.00 56.93 55.50 1vd0 s PHE 74 Cb -0.22 -1.12 0.25 0.00 -1.21 0.00 0.00 43.02 40.73 1vd0 s PHE 74 CO -0.03 0.55 1.08 0.71 -1.34 0.00 0.00 175.22 176.19 1vd0 s TYR 75 N -1.86 1.23 -0.05 3.49 2.02 0.11 0.24 117.35 122.54 1vd0 s TYR 75 Ca 0.23 0.80 -0.00 0.00 -0.37 0.00 0.00 57.07 57.73 1vd0 s TYR 75 Cb -0.07 -3.28 -0.03 0.00 -0.40 0.00 0.00 41.96 38.18 1vd0 s TYR 75 CO 0.11 -3.57 -0.05 0.36 -1.57 0.00 0.00 175.55 170.84 1vd0 n LYS 76 N -4.62 0.11 -3.82 -0.62 -0.00 -1.26 -4.11 118.16 103.85 1vd0 n LYS 76 Ca 0.08 0.03 -0.08 0.00 -0.00 0.00 0.00 58.31 58.34 1vd0 n LYS 76 Cb 0.58 -0.99 0.02 0.00 -0.00 0.00 0.00 35.03 34.64 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 -4.67 -0.01 0.00 -5.58 0.01 -1.26 -4.59 113.70 97.60 1vd0 s SER 77 Ca -0.06 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.14 1vd0 s SER 77 Cb 0.02 0.80 0.00 0.00 0.21 0.00 0.00 66.02 67.04 1vd0 s SER 77 CO 0.10 -1.58 0.00 0.61 0.41 0.00 0.00 173.24 172.78 1vd0 n GLY 78 N -0.55 2.60 3.70 3.44 0.00 -1.26 -4.99 105.19 108.13 1vd0 n GLY 78 Ca -0.07 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 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 -2.33 4.86 0.10 2.61 2.01 -1.26 -3.03 115.64 118.61 1vd0 s THR 79 Ca 0.00 1.98 0.08 0.00 0.31 0.00 0.00 61.69 64.06 1vd0 s THR 79 Cb 0.00 -4.28 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 1vd0 s THR 79 CO 0.00 0.11 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.49 1vd0 s PHE 80 N 1.36 1.69 -0.26 4.92 0.40 -1.03 -5.03 117.98 120.02 1vd0 s PHE 80 Ca 0.49 -0.44 -0.27 0.00 -0.60 0.00 0.00 56.93 56.11 1vd0 s PHE 80 Cb -0.20 -0.92 0.01 0.00 0.51 0.00 0.00 43.02 42.42 1vd0 s PHE 80 CO 0.23 0.19 0.95 1.03 0.70 0.00 0.00 175.22 178.32 1vd0 s ARG 81 N -2.00 4.17 0.25 0.44 3.00 -1.26 -3.09 118.95 120.46 1vd0 s ARG 81 Ca 0.06 1.09 0.09 0.00 0.00 0.00 0.00 55.73 56.97 1vd0 s ARG 81 Cb -0.09 -3.67 0.27 0.00 0.00 0.00 0.00 34.95 31.46 1vd0 s ARG 81 CO 0.04 -0.64 1.56 -0.92 0.00 0.00 0.00 175.30 175.34 1vd0 h TYR 82 N 7.70 0.06 -0.00 -0.53 5.03 -1.92 -1.88 116.97 125.44 1vd0 h TYR 82 Ca -0.21 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.07 1vd0 h TYR 82 Cb 1.07 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.34 1vd0 h TYR 82 CO 0.77 0.69 0.00 0.93 -1.32 0.00 0.00 178.16 179.23 1vd0 h GLU 83 N 0.03 0.00 0.00 1.82 5.08 -1.91 -3.06 114.58 116.55 1vd0 h GLU 83 Ca -0.01 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.94 1vd0 h GLU 83 Cb 1.17 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.36 1vd0 h GLU 83 CO 0.09 0.00 -2.24 -3.47 -1.00 0.00 0.00 179.01 172.38 1vd0 n ASP 84 N -3.84 1.94 -4.66 1.42 2.03 -1.13 -4.94 116.55 107.37 1vd0 n ASP 84 Ca -0.03 0.34 -0.63 0.00 0.52 0.00 0.00 54.79 54.99 1vd0 n ASP 84 Cb 0.08 -0.84 -0.09 0.00 -0.72 0.00 0.00 41.12 39.55 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 -4.24 0.12 -2.56 5.18 0.31 -0.72 -4.81 118.33 111.61 1vd0 n VAL 85 Ca -0.49 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.40 1vd0 n VAL 85 Cb 0.85 -0.81 -0.03 0.00 -0.91 0.00 0.00 33.84 32.94 1vd0 n VAL 85 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1vd0 s LEU 86 N 3.78 3.45 0.43 7.52 1.43 -0.46 -4.93 118.68 129.91 1vd0 s LEU 86 Ca 1.05 -1.30 -0.21 0.00 -1.03 0.00 0.00 54.13 52.63 1vd0 s LEU 86 Cb -1.32 -2.57 -0.10 0.00 0.03 0.00 0.00 46.19 42.23 1vd0 s LEU 86 CO 0.73 -1.56 0.98 0.26 0.23 0.00 0.00 176.35 176.98 1vd0 s TRP 87 N 5.12 3.26 0.27 0.29 0.52 -1.26 -4.70 118.94 122.44 1vd0 s TRP 87 Ca 0.45 1.62 -0.29 0.00 0.02 0.00 0.00 56.10 57.89 1vd0 s TRP 87 Cb -0.01 -2.92 -0.10 0.00 -1.15 0.00 0.00 33.47 29.29 1vd0 s TRP 87 CO -0.06 -0.28 1.25 -1.25 0.02 0.00 0.00 176.95 176.63 1vd0 s PRO 88 N -3.08 4.44 0.36 4.98 0.04 -1.26 -4.93 135.00 135.56 1vd0 s PRO 88 Ca 0.62 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.78 1vd0 s PRO 88 Cb -0.12 -3.15 0.76 0.00 0.04 0.00 0.00 34.50 32.03 1vd0 s PRO 88 CO 0.16 -0.11 1.94 1.05 0.04 0.00 0.00 177.00 180.08 1vd0 h GLU 89 N 4.23 0.72 -0.71 4.56 4.11 -1.95 -2.55 114.58 123.00 1vd0 h GLU 89 Ca -0.47 -0.04 0.27 0.00 0.07 0.00 0.00 59.36 59.19 1vd0 h GLU 89 Cb 1.22 -0.16 -0.13 0.00 0.50 0.00 0.00 28.75 30.18 1vd0 h GLU 89 CO 0.70 0.47 0.28 0.00 0.07 0.00 0.00 179.01 180.53 1vd0 n ALA 90 N -2.45 0.62 -2.15 1.06 0.00 -1.26 -4.11 120.51 112.22 1vd0 n ALA 90 Ca 0.12 0.73 -0.42 0.00 0.00 0.00 0.00 53.44 53.87 1vd0 n ALA 90 Cb 0.28 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 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 -5.23 3.62 -0.19 0.00 0.00 -0.96 -4.79 121.76 114.20 1vd0 s ALA 91 Ca -0.07 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.77 1vd0 s ALA 91 Cb 0.23 -3.66 -0.21 0.00 0.00 0.00 0.00 23.12 19.48 1vd0 s ALA 91 CO 0.55 -1.13 0.06 0.43 0.00 0.00 0.00 175.76 175.67 1vd0 n SER 92 N 6.17 1.70 -4.80 0.00 7.64 -1.26 -4.93 113.62 118.15 1vd0 n SER 92 Ca 0.15 0.03 -0.39 0.00 1.01 0.00 0.00 58.87 59.67 1vd0 n SER 92 Cb 0.43 -0.35 -0.06 0.00 -1.01 0.00 0.00 64.21 63.22 1vd0 n SER 92 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1vd0 s ASP 93 N -6.53 7.01 0.52 6.43 2.15 -1.26 -4.96 116.67 120.03 1vd0 s ASP 93 Ca -0.26 1.20 0.31 0.00 0.43 0.00 0.00 52.55 54.23 1vd0 s ASP 93 Cb 0.08 -2.35 1.16 0.00 -0.30 0.00 0.00 42.92 41.50 1vd0 s ASP 93 CO 0.70 0.23 1.91 1.05 -0.17 0.00 0.00 175.17 178.88 1vd0 h GLU 94 N 4.91 0.00 0.00 4.34 4.11 -2.02 -2.79 114.58 123.13 1vd0 h GLU 94 Ca -0.48 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 58.87 1vd0 h GLU 94 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1vd0 h GLU 94 CO 0.65 0.03 -0.77 1.15 0.07 0.00 0.00 179.01 180.14 1vd0 h THR 95 N 0.00 0.38 0.35 -1.06 2.02 -1.97 -2.90 112.91 109.74 1vd0 h THR 95 Ca -0.00 -1.62 -0.02 0.00 0.77 0.00 0.00 66.41 65.55 1vd0 h THR 95 Cb 0.62 2.01 0.00 0.00 -1.74 0.00 0.00 68.15 69.04 1vd0 h THR 95 CO 0.00 0.22 -0.17 0.11 0.37 0.00 0.00 175.52 176.05 1vd0 h LYS 96 N 0.00 -0.46 -0.22 6.66 1.79 -1.89 -2.05 116.57 120.40 1vd0 h LYS 96 Ca -0.05 0.03 -0.17 0.00 -2.18 0.00 0.00 60.65 58.28 1vd0 h LYS 96 Cb 1.27 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 32.02 1vd0 h LYS 96 CO 0.03 -0.15 -0.56 1.57 -1.08 0.00 0.00 179.45 179.26 1vd0 h LYS 97 N -0.76 0.68 0.00 3.15 2.10 -1.71 0.36 116.57 120.38 1vd0 h LYS 97 Ca -0.05 -0.43 -0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1vd0 h LYS 97 Cb 0.51 0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 31.89 1vd0 h LYS 97 CO 0.08 1.05 -0.01 0.00 -2.00 0.00 0.00 179.45 178.57 1vd0 h ARG 98 N 0.52 0.00 -0.05 0.07 2.47 -1.54 -1.65 114.38 114.20 1vd0 h ARG 98 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1vd0 h ARG 98 Cb 1.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.45 1vd0 h ARG 98 CO 0.11 0.01 0.00 2.41 0.56 0.00 0.00 179.97 183.07 1vd0 n THR 99 N -3.23 0.96 0.29 2.04 -1.04 -0.77 -4.66 114.28 107.87 1vd0 n THR 99 Ca -0.02 -0.98 0.18 0.00 -2.04 0.00 0.00 64.05 61.19 1vd0 n THR 99 Cb 0.13 0.52 0.98 0.00 -1.82 0.00 0.00 70.33 70.15 1vd0 n THR 99 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vd0 h ALA 100 N 0.32 1.05 -0.33 2.41 0.00 0.09 0.77 119.26 123.55 1vd0 h ALA 100 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vd0 h ALA 100 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1vd0 h ALA 100 CO 0.00 -0.05 0.00 1.19 0.00 0.00 0.00 179.25 180.39 1vd0 n PHE 101 N -2.80 1.17 -1.65 0.00 3.72 -1.26 -3.21 117.46 113.43 1vd0 n PHE 101 Ca -0.02 -0.41 -0.46 0.00 -0.05 0.00 0.00 57.45 56.51 1vd0 n PHE 101 Cb 0.11 -0.32 -0.04 0.00 -0.94 0.00 0.00 39.48 38.28 1vd0 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vd0 n ALA 102 N 0.37 1.26 0.00 4.37 0.00 0.26 -1.39 120.51 125.39 1vd0 n ALA 102 Ca 0.16 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1vd0 n ALA 102 Cb 0.78 -2.63 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1vd0 n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vd0 n GLY 103 N 4.79 1.88 3.97 0.00 0.00 -1.26 -4.83 105.19 109.73 1vd0 n GLY 103 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.94 4.43 -2.03 2.61 -4.23 -0.48 -4.99 115.64 109.00 1vd0 s THR 104 Ca 0.00 -0.72 0.11 0.00 -1.18 0.00 0.00 61.69 59.90 1vd0 s THR 104 Cb 0.00 -3.59 0.30 0.00 1.34 0.00 0.00 72.50 70.55 1vd0 s THR 104 CO 0.00 -0.32 1.38 0.00 -0.54 0.00 0.00 174.62 175.14 1vd0 n ALA 105 N -1.79 2.54 -2.50 3.99 0.00 -1.26 -4.85 120.51 116.65 1vd0 n ALA 105 Ca -0.02 -0.18 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 1vd0 n ALA 105 Cb 0.57 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.92 4.25 -0.17 0.00 1.01 -1.26 -4.29 121.20 118.82 1vd0 s ILE 106 Ca 0.18 1.62 -0.02 0.00 0.00 0.00 0.00 60.65 62.43 1vd0 s ILE 106 Cb 0.09 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.51 1vd0 s ILE 106 CO 0.14 0.12 -0.10 -0.44 0.00 0.00 0.00 174.94 174.65 1vd0 s SER 107 N 1.07 4.03 0.04 3.58 0.01 -1.17 -4.95 113.70 116.31 1vd0 s SER 107 Ca 0.57 -0.39 0.05 0.00 1.31 0.00 0.00 55.95 57.49 1vd0 s SER 107 Cb -0.27 -1.65 -0.04 0.00 0.21 0.00 0.00 66.02 64.28 1vd0 s SER 107 CO 0.28 0.07 -0.10 -0.51 0.41 0.00 0.00 173.24 173.39 1vd0 s ILE 108 N 0.92 3.38 0.00 1.44 1.10 -1.26 -2.48 121.20 124.30 1vd0 s ILE 108 Ca -0.02 -1.01 0.00 0.00 -0.51 0.00 0.00 60.65 59.11 1vd0 s ILE 108 Cb -0.15 -2.49 0.00 0.00 0.15 0.00 0.00 42.46 39.97 1vd0 s ILE 108 CO -0.00 0.30 0.26 1.33 -2.11 0.00 0.00 174.94 174.71