#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 -1.18 0.47 1.09 0.01 -1.26 -5.17 113.70 107.66 1vd0 s SER 2 Ca 0.00 0.74 0.03 0.00 1.31 0.00 0.00 55.95 58.03 1vd0 s SER 2 Cb 0.00 1.99 -0.03 0.00 0.21 0.00 0.00 66.02 68.20 1vd0 s SER 2 CO 0.00 -0.22 0.03 -0.54 0.41 0.00 0.00 173.24 172.91 1vd0 s LYS 3 N 2.88 2.10 0.08 12.44 3.01 -1.26 -5.17 119.74 133.82 1vd0 s LYS 3 Ca 0.16 -2.31 -0.19 0.00 -1.01 0.00 0.00 55.97 52.62 1vd0 s LYS 3 Cb -0.14 -1.38 0.04 0.00 -1.01 0.00 0.00 37.83 35.35 1vd0 s LYS 3 CO -0.19 -0.33 0.46 -1.83 0.51 0.00 0.00 175.35 173.97 1vd0 s GLU 4 N -3.83 1.03 -0.29 1.68 -1.05 -1.26 -5.17 118.70 109.81 1vd0 s GLU 4 Ca 0.14 -0.43 -0.24 0.00 -0.15 0.00 0.00 54.97 54.29 1vd0 s GLU 4 Cb 0.03 0.46 0.16 0.00 -0.44 0.00 0.00 34.13 34.34 1vd0 s GLU 4 CO 0.07 -0.39 1.21 0.99 0.95 0.00 0.00 175.26 178.10 1vd0 s THR 5 N -2.96 0.00 -0.30 1.83 2.01 -1.26 -5.17 115.64 109.79 1vd0 s THR 5 Ca -0.02 0.00 -0.17 0.00 0.31 0.00 0.00 61.69 61.81 1vd0 s THR 5 Cb 0.00 -1.00 0.18 0.00 0.01 0.00 0.00 72.50 71.69 1vd0 s THR 5 CO -0.06 0.00 1.15 0.12 -0.69 0.00 0.00 174.62 175.15 1vd0 s PHE 6 N 0.30 -0.29 -0.29 4.92 5.36 -1.26 -5.17 117.98 121.55 1vd0 s PHE 6 Ca 0.03 0.55 -0.15 0.00 -0.96 0.00 0.00 56.93 56.40 1vd0 s PHE 6 Cb -0.05 0.18 0.12 0.00 -0.34 0.00 0.00 43.02 42.93 1vd0 s PHE 6 CO -0.11 -0.15 0.82 -0.08 -1.46 0.00 0.00 175.22 174.25 1vd0 s THR 7 N 1.60 -0.14 0.25 0.12 -1.32 -1.26 -5.18 115.64 109.71 1vd0 s THR 7 Ca -0.05 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.34 1vd0 s THR 7 Cb -0.03 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.95 1vd0 s THR 7 CO -0.14 0.00 0.40 -1.38 -2.21 0.00 0.00 174.62 171.29 1vd0 s HIS 8 N 1.71 0.65 -0.26 9.09 -3.43 -1.26 -5.18 115.29 116.61 1vd0 s HIS 8 Ca -0.09 -0.96 -0.27 0.00 -0.80 0.00 0.00 55.06 52.94 1vd0 s HIS 8 Cb -0.05 -0.02 0.17 0.00 -1.43 0.00 0.00 32.58 31.24 1vd0 s HIS 8 CO -0.18 -0.93 1.26 1.52 -2.00 0.00 0.00 174.74 174.41 1vd0 s TYR 9 N -3.90 -0.18 0.08 0.38 1.13 -1.26 -5.19 117.35 108.41 1vd0 s TYR 9 Ca 0.27 0.38 -0.26 0.00 -1.41 0.00 0.00 57.07 56.06 1vd0 s TYR 9 Cb 0.01 0.46 0.08 0.00 -1.10 0.00 0.00 41.96 41.41 1vd0 s TYR 9 CO 0.11 -0.13 0.70 -0.65 -2.51 0.00 0.00 175.55 173.08 1vd0 s GLN 10 N -0.50 1.11 0.62 -3.49 -0.21 -1.26 -5.17 119.66 110.76 1vd0 s GLN 10 Ca 0.05 -0.33 -0.16 0.00 0.02 0.00 0.00 55.36 54.94 1vd0 s GLN 10 Cb -0.03 0.51 -0.02 0.00 1.00 0.00 0.00 33.01 34.48 1vd0 s GLN 10 CO -0.08 -0.47 1.12 -1.25 -2.12 0.00 0.00 175.29 172.49 1vd0 s PRO 11 N -3.23 2.98 -0.26 2.91 0.04 -1.26 -4.93 135.00 131.25 1vd0 s PRO 11 Ca 0.01 1.46 -0.01 0.00 0.04 0.00 0.00 61.00 62.49 1vd0 s PRO 11 Cb -0.01 -1.97 0.13 0.00 0.04 0.00 0.00 34.50 32.69 1vd0 s PRO 11 CO -0.09 -1.12 2.21 0.94 0.04 0.00 0.00 177.00 178.98 1vd0 n GLN 12 N -2.07 1.76 -1.71 4.56 -0.06 -1.26 -4.95 117.38 113.65 1vd0 n GLN 12 Ca 0.11 -1.37 0.00 0.00 -2.00 0.00 0.00 57.00 53.73 1vd0 n GLN 12 Cb 0.52 -1.60 0.00 0.00 -4.06 0.00 0.00 30.24 25.09 1vd0 n GLN 12 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1vd0 n GLY 13 N 0.74 -4.72 2.68 1.69 0.00 -1.26 -5.00 105.19 99.32 1vd0 n GLY 13 Ca 0.28 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.41 1vd0 n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vd0 s ASN 14 N -3.70 1.94 -0.18 1.61 2.20 -1.26 -5.13 114.94 110.42 1vd0 s ASN 14 Ca 0.00 -0.51 -0.29 0.00 -0.94 0.00 0.00 52.86 51.12 1vd0 s ASN 14 Cb 0.00 0.12 0.13 0.00 -2.00 0.00 0.00 41.25 39.50 1vd0 s ASN 14 CO 0.00 -0.35 1.00 -0.55 -2.94 0.00 0.00 177.10 174.26 1vd0 s SER 15 N 2.25 -0.39 0.06 3.54 0.15 -1.26 -4.52 113.70 113.53 1vd0 s SER 15 Ca 0.06 0.50 0.04 0.00 0.70 0.00 0.00 55.95 57.24 1vd0 s SER 15 Cb -0.16 0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 64.53 1vd0 s SER 15 CO -0.16 -0.31 -0.01 -1.81 1.20 0.00 0.00 173.24 172.15 1vd0 s ASP 16 N -0.84 4.99 0.00 5.45 1.11 -1.22 -5.00 116.67 121.16 1vd0 s ASP 16 Ca -0.01 -0.14 0.15 0.00 0.18 0.00 0.00 52.55 52.74 1vd0 s ASP 16 Cb -0.01 -1.21 0.86 0.00 1.07 0.00 0.00 42.92 43.63 1vd0 s ASP 16 CO 0.00 0.21 1.37 -0.81 1.18 0.00 0.00 175.17 177.12 1vd0 n PRO 17 N 0.89 0.38 -0.58 8.23 -0.04 -1.26 -3.57 135.00 139.04 1vd0 n PRO 17 Ca -0.12 0.06 -0.06 0.00 -0.04 0.00 0.00 63.50 63.33 1vd0 n PRO 17 Cb 0.52 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.50 1vd0 n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vd0 n ALA 18 N -1.11 4.21 -4.52 0.55 0.00 -1.26 -4.79 120.51 113.59 1vd0 n ALA 18 Ca 0.10 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.51 1vd0 n ALA 18 Cb 0.08 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.31 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 0.92 -1.17 -4.10 0.00 8.25 -1.23 -4.90 115.22 112.99 1vd0 n HIS 19 Ca 0.11 0.68 -0.14 0.00 -0.26 0.00 0.00 57.72 58.11 1vd0 n HIS 19 Cb 0.56 -1.96 -0.13 0.00 1.12 0.00 0.00 29.99 29.58 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 -3.37 0.42 0.34 1.59 -4.23 -1.25 -2.98 115.64 106.16 1vd0 s THR 20 Ca 0.75 -0.57 0.03 0.00 -1.18 0.00 0.00 61.69 60.72 1vd0 s THR 20 Cb -0.44 -0.42 -0.02 0.00 1.34 0.00 0.00 72.50 72.96 1vd0 s THR 20 CO 1.03 -0.11 0.51 0.00 -0.54 0.00 0.00 174.62 175.50 1vd0 s ALA 21 N -0.65 3.92 -0.24 3.99 0.00 0.23 -3.43 121.76 125.57 1vd0 s ALA 21 Ca -0.04 -1.17 0.01 0.00 0.00 0.00 0.00 51.96 50.76 1vd0 s ALA 21 Cb -0.05 -1.90 0.06 0.00 0.00 0.00 0.00 23.12 21.23 1vd0 s ALA 21 CO 0.00 -0.04 -0.04 0.95 0.00 0.00 0.00 175.76 176.63 1vd0 s THR 22 N -2.25 1.54 0.26 0.00 -4.23 -1.26 -1.98 115.64 107.72 1vd0 s THR 22 Ca 0.42 -1.29 -0.05 0.00 -1.18 0.00 0.00 61.69 59.58 1vd0 s THR 22 Cb -0.09 -1.84 -0.05 0.00 1.34 0.00 0.00 72.50 71.85 1vd0 s THR 22 CO 0.33 -0.16 0.53 0.00 -0.54 0.00 0.00 174.62 174.78 1vd0 s ALA 23 N 1.38 3.64 -2.00 3.99 0.00 -0.68 -4.89 121.76 123.20 1vd0 s ALA 23 Ca -0.04 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.44 1vd0 s ALA 23 Cb -0.19 -2.29 0.31 0.00 0.00 0.00 0.00 23.12 20.96 1vd0 s ALA 23 CO -0.07 0.33 0.77 -0.35 0.00 0.00 0.00 175.76 176.44 1vd0 n PRO 24 N -0.71 0.49 -2.12 0.00 -0.04 -1.26 -1.53 135.00 129.82 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 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.83 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 -5.12 0.10 0.55 0.00 -1.24 -4.39 105.19 95.09 1vd0 n GLY 25 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 1.95 -2.21 3.54 -0.02 0.00 -0.97 -4.79 105.19 102.70 1vd0 n GLY 26 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 1.56 -0.00 0.99 4.77 -1.24 -4.84 117.00 118.24 1vd0 n LEU 27 Ca 0.00 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1vd0 n LEU 27 Cb 0.54 -1.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 1vd0 n LEU 27 CO 0.00 -2.90 0.46 -0.24 -1.33 0.00 0.00 177.39 173.38 1vd0 n SER 28 N -2.72 1.82 -3.67 -1.43 2.88 -1.26 -4.28 113.62 104.97 1vd0 n SER 28 Ca 0.09 -1.82 -0.01 0.00 -1.33 0.00 0.00 58.87 55.81 1vd0 n SER 28 Cb 0.53 -0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.98 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 -0.82 -1.98 0.17 -1.46 0.00 -1.26 -4.81 121.76 111.60 1vd0 s ALA 29 Ca 0.00 0.38 -0.34 0.00 0.00 0.00 0.00 51.96 52.01 1vd0 s ALA 29 Cb 0.00 0.51 -0.14 0.00 0.00 0.00 0.00 23.12 23.49 1vd0 s ALA 29 CO 0.00 -1.06 1.46 1.63 0.00 0.00 0.00 175.76 177.79 1vd0 n LYS 30 N -0.51 1.86 -3.97 0.00 5.02 -1.26 -3.20 118.16 116.10 1vd0 n LYS 30 Ca -0.07 0.67 -0.25 0.00 -2.02 0.00 0.00 58.31 56.63 1vd0 n LYS 30 Cb 0.62 -2.36 -0.17 0.00 -0.02 0.00 0.00 35.03 33.09 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 0.49 1.17 0.55 7.82 0.00 0.76 -4.97 121.76 127.58 1vd0 s ALA 31 Ca 0.77 -0.43 -0.19 0.00 0.00 0.00 0.00 51.96 52.10 1vd0 s ALA 31 Cb -0.74 -0.82 -0.06 0.00 0.00 0.00 0.00 23.12 21.51 1vd0 s ALA 31 CO 0.44 -0.34 1.13 -1.25 0.00 0.00 0.00 175.76 175.73 1vd0 s PRO 32 N 1.59 3.35 0.87 0.00 0.04 -1.26 -1.30 135.00 138.29 1vd0 s PRO 32 Ca 0.02 1.61 -0.13 0.00 0.04 0.00 0.00 61.00 62.53 1vd0 s PRO 32 Cb -0.13 -2.00 0.13 0.00 0.04 0.00 0.00 34.50 32.54 1vd0 s PRO 32 CO -0.06 -0.85 1.23 0.00 0.04 0.00 0.00 177.00 177.36 1vd0 s ALA 33 N -1.78 2.51 -1.12 8.56 0.00 -1.26 -4.44 121.76 124.22 1vd0 s ALA 33 Ca 0.73 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.76 1vd0 s ALA 33 Cb -0.24 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 1vd0 s ALA 33 CO 0.27 -1.98 0.95 -1.33 0.00 0.00 0.00 175.76 173.67 1vd0 n MET 34 N -3.49 -5.39 -3.60 0.00 2.81 0.19 -4.65 117.12 103.00 1vd0 n MET 34 Ca 0.11 0.82 -0.16 0.00 -1.81 0.00 0.00 57.70 56.67 1vd0 n MET 34 Cb 0.60 -5.74 -0.07 0.00 -0.71 0.00 0.00 33.22 27.31 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 0.02 0.44 2.03 -4.23 -1.24 -0.12 115.64 109.19 1vd0 s THR 35 Ca 0.11 -0.18 -0.24 0.00 -1.18 0.00 0.00 61.69 60.20 1vd0 s THR 35 Cb -0.01 -0.89 -0.08 0.00 1.34 0.00 0.00 72.50 72.86 1vd0 s THR 35 CO 0.71 -0.10 1.17 -2.16 -0.54 0.00 0.00 174.62 173.70 1vd0 s PRO 36 N -1.48 3.83 0.18 3.99 0.04 -1.26 -0.25 135.00 140.06 1vd0 s PRO 36 Ca -0.11 1.81 0.04 0.00 0.04 0.00 0.00 61.00 62.78 1vd0 s PRO 36 Cb -0.02 -2.48 -0.05 0.00 0.04 0.00 0.00 34.50 32.00 1vd0 s PRO 36 CO 0.06 -0.50 -0.05 -0.51 0.04 0.00 0.00 177.00 176.04 1vd0 s LEU 37 N -2.88 2.34 -0.03 -3.56 1.43 0.19 -2.64 118.68 113.52 1vd0 s LEU 37 Ca 0.62 -1.12 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 1vd0 s LEU 37 Cb -0.29 -0.27 -0.03 0.00 0.03 0.00 0.00 46.19 45.63 1vd0 s LEU 37 CO 0.36 -0.44 -0.12 0.00 0.23 0.00 0.00 176.35 176.38 1vd0 s MET 38 N -3.82 2.51 -0.24 1.70 0.23 0.15 0.01 119.30 119.85 1vd0 s MET 38 Ca 0.22 -0.70 -0.08 0.00 -1.03 0.00 0.00 55.69 54.11 1vd0 s MET 38 Cb 0.04 -2.42 -0.03 0.00 -1.53 0.00 0.00 34.83 30.89 1vd0 s MET 38 CO 0.04 0.62 0.08 -1.17 -2.03 0.00 0.00 175.02 172.56 1vd0 s LEU 39 N -0.94 3.55 0.74 0.18 0.20 -1.26 -0.81 118.68 120.34 1vd0 s LEU 39 Ca 0.13 -0.14 -0.13 0.00 0.69 0.00 0.00 54.13 54.68 1vd0 s LEU 39 Cb -0.11 -1.94 0.05 0.00 -0.43 0.00 0.00 46.19 43.75 1vd0 s LEU 39 CO 0.02 0.01 1.13 -0.62 -0.29 0.00 0.00 176.35 176.60 1vd0 s ASP 40 N 1.37 4.42 -0.20 3.68 -1.08 0.23 -4.96 116.67 120.13 1vd0 s ASP 40 Ca 0.05 2.06 0.07 0.00 -0.52 0.00 0.00 52.55 54.21 1vd0 s ASP 40 Cb -0.15 -2.55 -0.17 0.00 -1.46 0.00 0.00 42.92 38.59 1vd0 s ASP 40 CO 0.04 -2.10 -0.09 0.41 0.52 0.00 0.00 175.17 173.95 1vd0 n THR 41 N -3.06 1.21 -0.09 1.71 -1.04 -1.26 -3.90 114.28 107.85 1vd0 n THR 41 Ca 0.11 -0.57 -0.22 0.00 -2.04 0.00 0.00 64.05 61.33 1vd0 n THR 41 Cb 0.52 -0.98 -0.12 0.00 -1.82 0.00 0.00 70.33 67.93 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 0.03 1.03 8.00 0.02 -1.98 -3.36 113.55 117.30 1vd0 h SER 42 Ca -0.47 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 59.91 1vd0 h SER 42 Cb 1.87 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.40 1vd0 h SER 42 CO -0.03 1.50 0.00 0.28 -1.14 0.00 0.00 176.83 177.43 1vd0 h SER 43 N -0.92 0.00 -6.15 3.07 0.02 -2.00 -3.46 113.55 104.11 1vd0 h SER 43 Ca -0.34 0.00 -0.44 0.00 -0.84 0.00 0.00 61.79 60.18 1vd0 h SER 43 Cb 1.35 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.92 1vd0 h SER 43 CO -0.18 0.00 -0.81 0.54 -1.14 0.00 0.00 176.83 175.24 1vd0 n ARG 44 N -2.90 -5.04 -4.03 3.45 1.74 -1.25 -4.99 116.66 103.64 1vd0 n ARG 44 Ca 0.01 0.61 -0.08 0.00 -0.77 0.00 0.00 57.85 57.62 1vd0 n ARG 44 Cb 0.31 -5.24 -0.11 0.00 -1.02 0.00 0.00 32.46 26.40 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 -6.16 0.44 -0.20 5.56 1.02 -1.26 -4.83 119.74 114.31 1vd0 s LYS 45 Ca 0.17 -0.86 -0.12 0.00 0.02 0.00 0.00 55.97 55.18 1vd0 s LYS 45 Cb -0.09 0.14 -0.05 0.00 -0.52 0.00 0.00 37.83 37.31 1vd0 s LYS 45 CO 0.82 -0.07 0.20 -1.17 -0.92 0.00 0.00 175.35 174.21 1vd0 s LEU 46 N -2.06 4.19 0.07 3.17 2.96 -1.26 -0.60 118.68 125.14 1vd0 s LEU 46 Ca -0.06 0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1vd0 s LEU 46 Cb -0.03 -2.19 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 1vd0 s LEU 46 CO -0.05 0.11 -0.07 0.68 -1.32 0.00 0.00 176.35 175.71 1vd0 s VAL 47 N 0.66 0.58 0.42 1.68 -7.23 0.01 -2.30 120.40 114.22 1vd0 s VAL 47 Ca 0.11 -1.60 -0.24 0.00 -1.81 0.00 0.00 61.98 58.44 1vd0 s VAL 47 Cb -0.12 -1.26 -0.11 0.00 0.56 0.00 0.00 36.38 35.45 1vd0 s VAL 47 CO 0.02 -0.71 0.88 0.00 -0.31 0.00 0.00 175.10 174.98 1vd0 n ALA 48 N 0.53 -0.33 -1.75 1.32 0.00 -1.26 0.34 120.51 119.36 1vd0 n ALA 48 Ca -0.16 0.22 -0.36 0.00 0.00 0.00 0.00 53.44 53.13 1vd0 n ALA 48 Cb 0.59 -1.99 0.03 0.00 0.00 0.00 0.00 19.45 18.07 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 -1.32 2.42 0.05 0.00 -0.00 -1.08 -4.25 118.94 114.76 1vd0 s TRP 49 Ca 0.63 1.50 -0.18 0.00 -0.00 0.00 0.00 56.10 58.06 1vd0 s TRP 49 Cb -0.58 -3.50 -0.16 0.00 -0.00 0.00 0.00 33.47 29.23 1vd0 s TRP 49 CO 0.57 -2.22 1.28 0.22 -0.00 0.00 0.00 176.95 176.80 1vd0 h ASP 50 N 1.03 0.56 0.00 5.86 1.82 -1.90 -3.47 116.42 120.32 1vd0 h ASP 50 Ca -0.50 -0.58 0.00 0.00 -0.39 0.00 0.00 57.03 55.55 1vd0 h ASP 50 Cb 1.29 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 41.14 1vd0 h ASP 50 CO 0.56 1.04 0.00 0.61 -1.61 0.00 0.00 179.24 179.84 1vd0 n GLY 51 N 0.51 2.24 0.14 -0.78 0.00 -1.26 -4.45 105.19 101.59 1vd0 n GLY 51 Ca -0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.48 1.52 -1.67 2.61 -2.24 -1.26 -2.77 114.28 109.99 1vd0 n THR 52 Ca 0.00 -0.43 -0.39 0.00 -2.27 0.00 0.00 64.05 60.96 1vd0 n THR 52 Cb 0.00 -1.77 -0.03 0.00 -2.10 0.00 0.00 70.33 66.43 1vd0 n THR 52 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1vd0 s THR 53 N -2.51 3.09 0.14 4.28 2.01 -1.26 -4.93 115.64 116.45 1vd0 s THR 53 Ca -0.38 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 61.39 1vd0 s THR 53 Cb 0.14 -3.18 -0.07 0.00 0.01 0.00 0.00 72.50 69.39 1vd0 s THR 53 CO 0.51 -0.16 1.17 1.51 -0.69 0.00 0.00 174.62 176.97 1vd0 s ASP 54 N 10.22 7.13 0.00 3.53 -4.77 -1.26 -2.87 116.67 128.65 1vd0 s ASP 54 Ca 0.93 2.12 0.00 0.00 -3.30 0.00 0.00 52.55 52.30 1vd0 s ASP 54 Cb -0.21 -2.60 0.00 0.00 -1.09 0.00 0.00 42.92 39.03 1vd0 s ASP 54 CO 0.28 -0.37 0.00 0.61 0.70 0.00 0.00 175.17 176.39 1vd0 n GLY 55 N 2.53 1.12 0.15 2.12 0.00 -1.16 -4.90 105.19 105.06 1vd0 n GLY 55 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 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 0.98 -2.64 4.61 0.00 -1.64 -3.44 119.26 117.13 1vd0 h ALA 56 Ca 0.00 -0.54 -0.55 0.00 0.00 0.00 0.00 54.91 53.82 1vd0 h ALA 56 Cb 0.00 -0.09 0.08 0.00 0.00 0.00 0.00 17.79 17.78 1vd0 h ALA 56 CO 0.00 0.73 0.80 0.00 0.00 0.00 0.00 179.25 180.78 1vd0 n ALA 57 N -2.44 2.10 0.00 0.00 0.00 -1.14 -4.23 120.51 114.81 1vd0 n ALA 57 Ca -0.02 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1vd0 n ALA 57 Cb 0.60 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.64 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 2.05 0.00 -3.88 0.00 0.24 0.10 -4.61 118.33 112.23 1vd0 n VAL 58 Ca 0.09 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.32 1vd0 n VAL 58 Cb 0.35 -0.61 -0.03 0.00 -1.47 0.00 0.00 33.84 32.08 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 -3.42 0.05 -0.20 7.63 0.00 -1.22 -4.91 107.32 105.25 1vd0 s GLY 59 Ca 0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 44.72 44.25 1vd0 s GLY 59 CO 0.00 -0.22 -0.03 -0.42 0.00 0.00 0.00 173.10 172.43 1vd0 s ILE 60 N -3.94 3.65 0.13 0.90 1.01 -1.26 0.55 121.20 122.24 1vd0 s ILE 60 Ca 0.14 -0.42 -0.31 0.00 0.00 0.00 0.00 60.65 60.06 1vd0 s ILE 60 Cb -0.04 -2.64 -0.11 0.00 0.01 0.00 0.00 42.46 39.68 1vd0 s ILE 60 CO 0.07 0.44 1.83 -0.22 0.00 0.00 0.00 174.94 177.06 1vd0 s LEU 61 N 1.06 4.40 -0.08 2.97 0.20 0.66 -0.13 118.68 127.75 1vd0 s LEU 61 Ca 0.01 2.79 -0.26 0.00 0.69 0.00 0.00 54.13 57.36 1vd0 s LEU 61 Cb -0.15 -3.57 -0.24 0.00 -0.43 0.00 0.00 46.19 41.80 1vd0 s LEU 61 CO 0.01 -1.01 0.96 0.00 -0.29 0.00 0.00 176.35 176.01 1vd0 h ALA 62 N 8.44 0.01 -3.89 5.97 0.00 -1.30 0.54 119.26 129.03 1vd0 h ALA 62 Ca -0.46 -0.46 -0.69 0.00 0.00 0.00 0.00 54.91 53.30 1vd0 h ALA 62 Cb 1.22 0.01 -0.32 0.00 0.00 0.00 0.00 17.79 18.70 1vd0 h ALA 62 CO 0.95 0.02 -0.88 0.08 0.00 0.00 0.00 179.25 179.41 1vd0 s VAL 63 N -2.91 2.05 0.25 0.00 1.01 -1.23 -4.23 120.40 115.35 1vd0 s VAL 63 Ca -0.17 -1.06 -0.29 0.00 0.00 0.00 0.00 61.98 60.47 1vd0 s VAL 63 Cb -0.01 -1.74 -0.15 0.00 0.00 0.00 0.00 36.38 34.49 1vd0 s VAL 63 CO 0.72 0.57 0.97 0.00 0.00 0.00 0.00 175.10 177.35 1vd0 n ALA 64 N 3.05 -0.71 -2.28 5.51 0.00 -1.26 -4.68 120.51 120.14 1vd0 n ALA 64 Ca -0.18 0.41 -0.18 0.00 0.00 0.00 0.00 53.44 53.50 1vd0 n ALA 64 Cb 0.52 -1.96 -0.09 0.00 0.00 0.00 0.00 19.45 17.92 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 -0.89 1.76 0.30 0.00 0.00 -0.42 -4.87 121.76 117.64 1vd0 s ALA 65 Ca 0.62 -1.92 0.01 0.00 0.00 0.00 0.00 51.96 50.67 1vd0 s ALA 65 Cb -0.76 1.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.73 1vd0 s ALA 65 CO 0.58 -0.62 0.33 0.16 0.00 0.00 0.00 175.76 176.21 1vd0 s ASP 66 N -3.33 1.01 0.61 0.00 1.47 -1.26 -0.17 116.67 114.99 1vd0 s ASP 66 Ca 0.39 -1.54 0.31 0.00 1.18 0.00 0.00 52.55 52.89 1vd0 s ASP 66 Cb 0.04 0.56 1.81 0.00 -0.34 0.00 0.00 42.92 44.99 1vd0 s ASP 66 CO 0.22 -1.10 2.16 0.06 0.68 0.00 0.00 175.17 177.19 1vd0 h GLN 67 N 2.23 0.00 -0.00 2.11 -0.00 -1.73 0.35 115.11 118.07 1vd0 h GLN 67 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.37 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 0.40 0.00 0.00 -2.37 -0.00 0.00 0.00 178.83 176.86 1vd0 n THR 68 N -3.62 0.00 -2.64 1.86 5.66 -1.26 -4.68 114.28 109.60 1vd0 n THR 68 Ca -0.00 -0.04 -0.41 0.00 -3.05 0.00 0.00 64.05 60.54 1vd0 n THR 68 Cb 0.24 -0.35 -0.04 0.00 -1.55 0.00 0.00 70.33 68.64 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 -1.99 7.36 -0.01 1.09 0.15 0.12 -4.93 113.70 115.48 1vd0 s SER 69 Ca 0.46 1.84 0.18 0.00 0.70 0.00 0.00 55.95 59.13 1vd0 s SER 69 Cb 0.22 -2.58 -0.24 0.00 -1.71 0.00 0.00 66.02 61.70 1vd0 s SER 69 CO 0.36 -0.21 0.53 1.07 1.20 0.00 0.00 173.24 176.19 1vd0 n THR 70 N 3.19 0.00 -3.38 6.45 5.66 -1.26 -4.46 114.28 120.48 1vd0 n THR 70 Ca 0.04 -0.28 -0.13 0.00 -3.05 0.00 0.00 64.05 60.64 1vd0 n THR 70 Cb 0.49 0.46 -0.09 0.00 -1.55 0.00 0.00 70.33 69.64 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 -2.98 -0.51 0.01 1.09 2.01 -1.26 -3.59 115.64 110.42 1vd0 s THR 71 Ca -0.01 -0.25 -0.13 0.00 0.31 0.00 0.00 61.69 61.61 1vd0 s THR 71 Cb 0.12 -0.88 -0.06 0.00 0.01 0.00 0.00 72.50 71.69 1vd0 s THR 71 CO 0.72 -0.27 0.39 -0.76 -0.69 0.00 0.00 174.62 174.02 1vd0 s LEU 72 N 2.46 4.44 -0.56 4.42 1.02 -0.58 -4.91 118.68 124.98 1vd0 s LEU 72 Ca 0.10 0.90 -0.05 0.00 0.02 0.00 0.00 54.13 55.11 1vd0 s LEU 72 Cb -0.14 -2.64 0.14 0.00 0.02 0.00 0.00 46.19 43.57 1vd0 s LEU 72 CO -0.23 0.30 0.38 -0.89 0.02 0.00 0.00 176.35 175.93 1vd0 s THR 73 N -1.15 3.81 0.22 5.49 2.01 -1.26 -1.69 115.64 123.08 1vd0 s THR 73 Ca 0.25 -2.49 0.09 0.00 0.31 0.00 0.00 61.69 59.85 1vd0 s THR 73 Cb -0.16 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 1vd0 s THR 73 CO 0.14 -0.82 -0.00 0.72 -0.69 0.00 0.00 174.62 173.97 1vd0 s PHE 74 N 0.51 2.77 1.16 4.92 -0.71 -0.84 -0.82 117.98 124.97 1vd0 s PHE 74 Ca 0.13 -0.18 -0.19 0.00 -1.04 0.00 0.00 56.93 55.64 1vd0 s PHE 74 Cb -0.21 -1.28 0.29 0.00 -1.21 0.00 0.00 43.02 40.61 1vd0 s PHE 74 CO -0.04 0.56 0.95 0.66 -1.34 0.00 0.00 175.22 176.02 1vd0 n TYR 75 N -0.52 -3.78 0.00 3.49 4.02 0.81 0.78 117.16 121.96 1vd0 n TYR 75 Ca -0.08 -0.87 0.00 0.00 -0.01 0.00 0.00 57.90 56.94 1vd0 n TYR 75 Cb 0.57 -1.06 0.00 0.00 -0.02 0.00 0.00 39.34 38.84 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 -4.73 0.50 -3.74 -0.72 -0.00 -1.16 -4.18 118.16 104.13 1vd0 n LYS 76 Ca 0.14 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.42 1vd0 n LYS 76 Cb 0.54 -0.86 -0.01 0.00 -0.00 0.00 0.00 35.03 34.70 1vd0 n LYS 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1vd0 s SER 77 N -3.49 -0.14 0.00 -5.58 0.15 -1.26 -4.48 113.70 98.90 1vd0 s SER 77 Ca 0.00 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1vd0 s SER 77 Cb 0.00 0.43 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 1vd0 s SER 77 CO 0.00 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.24 1vd0 n GLY 78 N -0.49 3.43 3.61 9.45 0.00 -1.25 -4.97 105.19 114.98 1vd0 n GLY 78 Ca -0.06 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.55 4.58 0.13 2.61 2.01 -1.25 -2.78 115.64 118.39 1vd0 s THR 79 Ca 0.00 1.34 0.07 0.00 0.31 0.00 0.00 61.69 63.41 1vd0 s THR 79 Cb 0.00 -4.34 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 1vd0 s THR 79 CO 0.00 -0.50 -0.05 -0.36 -0.69 0.00 0.00 174.62 173.02 1vd0 s PHE 80 N 3.49 2.82 -0.36 4.92 0.08 -0.97 -5.01 117.98 122.95 1vd0 s PHE 80 Ca 0.40 -0.13 -0.29 0.00 0.12 0.00 0.00 56.93 57.03 1vd0 s PHE 80 Cb -0.12 -1.43 0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1vd0 s PHE 80 CO 0.17 0.47 1.31 1.03 -0.10 0.00 0.00 175.22 178.11 1vd0 s ARG 81 N -2.48 3.78 0.40 0.44 1.81 -1.26 -3.24 118.95 118.41 1vd0 s ARG 81 Ca 0.24 1.06 0.08 0.00 -1.72 0.00 0.00 55.73 55.40 1vd0 s ARG 81 Cb -0.11 -3.93 0.87 0.00 -0.45 0.00 0.00 34.95 31.33 1vd0 s ARG 81 CO 0.16 -1.29 2.01 -0.92 -0.68 0.00 0.00 175.30 174.57 1vd0 h TYR 82 N 9.72 0.57 0.00 -0.53 5.03 -1.85 0.21 116.97 130.13 1vd0 h TYR 82 Ca -0.26 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.06 1vd0 h TYR 82 Cb 1.09 -0.19 0.00 0.00 1.55 0.00 0.00 36.73 39.18 1vd0 h TYR 82 CO 0.92 0.32 0.00 0.39 -1.32 0.00 0.00 178.16 178.47 1vd0 n GLU 83 N -4.47 0.02 -0.14 1.82 1.02 -1.26 -3.42 120.64 114.20 1vd0 n GLU 83 Ca 0.07 0.18 -0.29 0.00 -0.02 0.00 0.00 57.16 57.10 1vd0 n GLU 83 Cb 0.20 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.01 1vd0 n GLU 83 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1vd0 n ASP 84 N -1.49 1.95 -4.71 1.62 -0.08 0.60 -4.96 116.55 109.48 1vd0 n ASP 84 Ca 0.05 0.32 -0.43 0.00 -1.51 0.00 0.00 54.79 53.22 1vd0 n ASP 84 Cb 0.21 -0.81 -0.02 0.00 2.34 0.00 0.00 41.12 42.85 1vd0 n ASP 84 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 1vd0 n VAL 85 N -4.21 1.33 -3.21 5.18 3.14 -0.40 -4.92 118.33 115.24 1vd0 n VAL 85 Ca -0.53 -0.33 -0.45 0.00 -2.96 0.00 0.00 64.34 60.08 1vd0 n VAL 85 Cb 0.88 -1.70 -0.00 0.00 -1.06 0.00 0.00 33.84 31.95 1vd0 n VAL 85 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1vd0 s LEU 86 N -0.57 5.91 0.69 6.55 1.98 0.83 -4.94 118.68 129.13 1vd0 s LEU 86 Ca 0.62 -3.42 -0.16 0.00 -2.89 0.00 0.00 54.13 48.28 1vd0 s LEU 86 Cb -0.56 -2.27 0.02 0.00 0.66 0.00 0.00 46.19 44.03 1vd0 s LEU 86 CO 0.54 -0.43 1.22 0.26 -1.89 0.00 0.00 176.35 176.05 1vd0 s TRP 87 N -0.35 2.11 0.29 5.38 0.52 -1.26 -4.66 118.94 120.96 1vd0 s TRP 87 Ca 0.35 1.56 -0.29 0.00 0.02 0.00 0.00 56.10 57.74 1vd0 s TRP 87 Cb -0.08 -3.52 -0.10 0.00 -1.15 0.00 0.00 33.47 28.63 1vd0 s TRP 87 CO -0.05 -2.61 1.24 -1.25 0.02 0.00 0.00 176.95 174.29 1vd0 s PRO 88 N -3.72 4.45 0.30 4.98 0.04 -1.26 -4.93 135.00 134.87 1vd0 s PRO 88 Ca 0.76 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.90 1vd0 s PRO 88 Cb -0.31 -3.13 0.66 0.00 0.04 0.00 0.00 34.50 31.76 1vd0 s PRO 88 CO 0.42 -0.07 1.82 1.05 0.04 0.00 0.00 177.00 180.26 1vd0 h GLU 89 N 3.91 0.84 -0.96 4.56 4.11 -1.93 -1.89 114.58 123.22 1vd0 h GLU 89 Ca -0.47 -0.05 0.33 0.00 0.07 0.00 0.00 59.36 59.24 1vd0 h GLU 89 Cb 1.22 -0.19 -0.10 0.00 0.50 0.00 0.00 28.75 30.18 1vd0 h GLU 89 CO 0.68 0.56 0.62 0.00 0.07 0.00 0.00 179.01 180.94 1vd0 n ALA 90 N -2.36 0.96 -2.48 1.06 0.00 -1.26 -3.79 120.51 112.63 1vd0 n ALA 90 Ca 0.20 0.61 -0.43 0.00 0.00 0.00 0.00 53.44 53.82 1vd0 n ALA 90 Cb 0.45 -0.74 -0.02 0.00 0.00 0.00 0.00 19.45 19.14 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 -4.75 3.03 0.05 0.00 0.00 -0.71 -4.47 121.76 114.91 1vd0 s ALA 91 Ca -0.05 -0.47 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 1vd0 s ALA 91 Cb 0.22 -3.97 -0.28 0.00 0.00 0.00 0.00 23.12 19.08 1vd0 s ALA 91 CO 0.57 -2.49 1.11 0.66 0.00 0.00 0.00 175.76 175.61 1vd0 h SER 92 N 10.06 0.87 -3.32 0.00 4.64 -1.84 -3.44 113.55 120.52 1vd0 h SER 92 Ca -0.25 -0.81 -0.58 0.00 -0.47 0.00 0.00 61.79 59.68 1vd0 h SER 92 Cb 1.08 -0.27 -0.08 0.00 -0.31 0.00 0.00 62.40 62.82 1vd0 h SER 92 CO 1.13 1.59 -0.12 -0.62 -0.87 0.00 0.00 176.83 177.94 1vd0 s ASP 93 N -7.38 6.71 0.40 4.97 2.15 -1.26 -4.95 116.67 117.31 1vd0 s ASP 93 Ca -0.10 0.85 0.28 0.00 0.43 0.00 0.00 52.55 54.01 1vd0 s ASP 93 Cb 0.06 -2.29 1.08 0.00 -0.30 0.00 0.00 42.92 41.46 1vd0 s ASP 93 CO 0.93 0.01 1.83 1.05 -0.17 0.00 0.00 175.17 178.81 1vd0 h GLU 94 N 6.64 0.00 0.00 4.34 4.11 -2.01 -2.64 114.58 125.02 1vd0 h GLU 94 Ca -0.41 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.99 1vd0 h GLU 94 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1vd0 h GLU 94 CO 0.75 0.00 -0.75 1.15 0.07 0.00 0.00 179.01 180.23 1vd0 h THR 95 N 0.00 0.09 0.13 -1.06 2.02 -1.98 -3.22 112.91 108.88 1vd0 h THR 95 Ca 0.00 -1.15 -0.29 0.00 0.77 0.00 0.00 66.41 65.74 1vd0 h THR 95 Cb 0.51 1.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 1vd0 h THR 95 CO 0.00 0.05 -1.35 0.11 0.37 0.00 0.00 175.52 174.70 1vd0 h LYS 96 N 0.00 0.27 -0.25 6.66 1.57 -1.89 -3.17 116.57 119.76 1vd0 h LYS 96 Ca -0.02 -0.45 -0.09 0.00 -1.87 0.00 0.00 60.65 58.21 1vd0 h LYS 96 Cb 1.07 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 1vd0 h LYS 96 CO 0.01 1.18 -0.22 1.57 -0.57 0.00 0.00 179.45 181.42 1vd0 h LYS 97 N 0.07 0.58 -0.92 3.15 2.10 -1.64 -2.31 116.57 117.61 1vd0 h LYS 97 Ca -0.18 -0.30 0.02 0.00 -2.00 0.00 0.00 60.65 58.20 1vd0 h LYS 97 Cb 1.99 0.01 -0.05 0.00 -0.90 0.00 0.00 32.23 33.28 1vd0 h LYS 97 CO 0.19 0.89 0.60 0.07 -2.00 0.00 0.00 179.45 179.19 1vd0 h ARG 98 N 0.29 1.15 -0.07 0.07 0.11 -1.68 -0.19 114.38 114.07 1vd0 h ARG 98 Ca 0.04 -0.07 0.00 0.00 0.10 0.00 0.00 59.98 60.05 1vd0 h ARG 98 Cb 0.77 -0.26 0.00 0.00 1.11 0.00 0.00 29.97 31.58 1vd0 h ARG 98 CO 0.06 0.76 0.00 0.25 0.10 0.00 0.00 179.97 181.14 1vd0 n THR 99 N -4.48 0.09 0.22 0.08 -2.24 -1.19 -3.94 114.28 102.81 1vd0 n THR 99 Ca 0.11 -0.14 0.12 0.00 -2.27 0.00 0.00 64.05 61.87 1vd0 n THR 99 Cb 0.06 -0.02 0.66 0.00 -2.10 0.00 0.00 70.33 68.93 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 3.76 1.13 -0.77 6.98 0.00 -0.43 0.13 119.26 130.06 1vd0 h ALA 100 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 1vd0 h ALA 100 Cb 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 17.79 17.78 1vd0 h ALA 100 CO 0.00 -0.13 0.44 1.19 0.00 0.00 0.00 179.25 180.75 1vd0 n PHE 101 N -2.44 2.43 -1.78 0.00 3.72 -1.25 -2.87 117.46 115.26 1vd0 n PHE 101 Ca -0.02 -1.42 -0.38 0.00 -0.05 0.00 0.00 57.45 55.58 1vd0 n PHE 101 Cb 0.20 -0.76 -0.03 0.00 -0.94 0.00 0.00 39.48 37.95 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 -2.73 2.03 0.00 4.37 0.00 0.44 -2.05 121.76 123.82 1vd0 s ALA 102 Ca 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.31 1vd0 s ALA 102 Cb 0.39 -4.28 0.00 0.00 0.00 0.00 0.00 23.12 19.24 1vd0 s ALA 102 CO 0.10 -3.96 0.00 0.41 0.00 0.00 0.00 175.76 172.32 1vd0 n GLY 103 N 5.82 2.50 3.95 0.00 0.00 -1.26 -4.72 105.19 111.48 1vd0 n GLY 103 Ca 0.29 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.24 2.13 -2.03 2.61 -4.23 -0.87 -4.97 115.64 108.03 1vd0 s THR 104 Ca 0.00 -0.27 0.12 0.00 -1.18 0.00 0.00 61.69 60.36 1vd0 s THR 104 Cb 0.00 -2.86 0.32 0.00 1.34 0.00 0.00 72.50 71.31 1vd0 s THR 104 CO 0.00 0.00 1.29 0.00 -0.54 0.00 0.00 174.62 175.37 1vd0 n ALA 105 N -3.20 2.45 -2.69 3.99 0.00 -1.26 -4.88 120.51 114.92 1vd0 n ALA 105 Ca 0.13 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 1vd0 n ALA 105 Cb 0.60 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 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 -1.57 4.86 -0.04 0.00 1.01 -1.26 -3.90 121.20 120.30 1vd0 s ILE 106 Ca 0.24 1.88 0.04 0.00 0.00 0.00 0.00 60.65 62.82 1vd0 s ILE 106 Cb 0.13 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 1vd0 s ILE 106 CO 0.17 0.08 -0.15 -0.44 0.00 0.00 0.00 174.94 174.60 1vd0 s SER 107 N 1.05 3.97 -0.04 3.58 0.01 -1.12 -4.87 113.70 116.27 1vd0 s SER 107 Ca 0.46 -0.23 0.04 0.00 1.31 0.00 0.00 55.95 57.53 1vd0 s SER 107 Cb -0.19 -0.80 -0.00 0.00 0.21 0.00 0.00 66.02 65.24 1vd0 s SER 107 CO 0.19 0.34 -0.16 -0.51 0.41 0.00 0.00 173.24 173.50 1vd0 s ILE 108 N -0.75 1.38 0.00 1.44 1.10 -1.26 -2.29 121.20 120.82 1vd0 s ILE 108 Ca 0.12 -0.69 0.00 0.00 -0.51 0.00 0.00 60.65 59.57 1vd0 s ILE 108 Cb -0.11 -1.19 0.00 0.00 0.15 0.00 0.00 42.46 41.32 1vd0 s ILE 108 CO 0.01 0.40 0.45 1.33 -2.11 0.00 0.00 174.94 175.02