#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvv s ASP 2 N 0.00 6.61 0.32 1.62 1.11 -1.26 -4.92 116.67 120.15 1dvv s ASP 2 Ca 0.00 1.36 0.23 0.00 0.18 0.00 0.00 52.55 54.31 1dvv s ASP 2 Cb 0.00 -2.42 1.18 0.00 1.07 0.00 0.00 42.92 42.76 1dvv s ASP 2 CO 0.00 -0.45 1.69 -2.65 1.18 0.00 0.00 175.17 174.94 1dvv n PRO 3 N -1.28 0.15 -0.03 8.23 -0.02 -1.26 -1.57 135.00 139.22 1dvv n PRO 3 Ca 0.04 0.61 -0.16 0.00 -2.02 0.00 0.00 63.50 61.98 1dvv n PRO 3 Cb 0.54 -1.96 -0.05 0.00 -0.02 0.00 0.00 33.50 32.01 1dvv n PRO 3 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1dvv h GLU 4 N 0.00 0.79 0.37 -0.52 4.81 -1.97 0.12 114.58 118.17 1dvv h GLU 4 Ca 0.00 -0.59 -0.02 0.00 -0.13 0.00 0.00 59.36 58.62 1dvv h GLU 4 Cb 0.06 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1dvv h GLU 4 CO 0.00 1.21 -0.18 0.28 -0.73 0.00 0.00 179.01 179.59 1dvv h VAL 5 N 0.56 0.61 0.00 0.32 2.07 -1.67 -2.27 116.25 115.86 1dvv h VAL 5 Ca -0.03 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 1dvv h VAL 5 Cb 1.32 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1dvv h VAL 5 CO 0.14 0.08 -0.18 0.17 0.02 0.00 0.00 177.57 177.81 1dvv h LEU 6 N -0.77 0.00 -0.77 2.57 8.10 -1.62 -2.24 115.31 120.58 1dvv h LEU 6 Ca -0.05 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 57.81 1dvv h LEU 6 Cb 0.52 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.73 1dvv h LEU 6 CO 0.08 0.18 -0.48 0.00 -4.11 0.00 0.00 178.44 174.11 1dvv h ALA 7 N 1.82 0.95 0.15 0.17 0.00 -0.59 -2.70 119.26 119.07 1dvv h ALA 7 Ca -0.00 -0.46 -0.33 0.00 0.00 0.00 0.00 54.91 54.12 1dvv h ALA 7 Cb 0.57 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1dvv h ALA 7 CO 0.02 0.65 -1.62 -0.22 0.00 0.00 0.00 179.25 178.08 1dvv h LYS 8 N 0.27 0.32 -0.52 0.00 3.64 -1.12 0.39 116.57 119.55 1dvv h LYS 8 Ca 0.01 -0.55 -0.01 0.00 -1.27 0.00 0.00 60.65 58.83 1dvv h LYS 8 Cb 0.94 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 1dvv h LYS 8 CO 0.08 1.21 0.28 -0.91 -2.27 0.00 0.00 179.45 177.84 1dvv h ASN 9 N 0.09 0.64 0.77 4.20 -0.26 -1.42 -1.48 115.58 118.13 1dvv h ASN 9 Ca -0.29 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.41 1dvv h ASN 9 Cb 2.06 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 39.16 1dvv h ASN 9 CO 0.17 0.52 -0.28 0.29 -1.06 0.00 0.00 177.43 177.08 1dvv n LYS 10 N -4.40 0.03 -0.35 0.81 4.01 -1.02 -4.91 118.16 112.34 1dvv n LYS 10 Ca 0.05 0.01 0.00 0.00 -0.51 0.00 0.00 58.31 57.86 1dvv n LYS 10 Cb 0.10 -1.52 0.00 0.00 -0.51 0.00 0.00 35.03 33.10 1dvv n LYS 10 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1dvv n GLY 11 N 1.48 0.82 0.30 0.72 0.00 -0.56 -4.96 105.19 103.00 1dvv n GLY 11 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1dvv n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dvv n MET 13 N -4.34 1.52 0.01 0.00 2.81 -1.03 -2.88 117.12 113.20 1dvv n MET 13 Ca 0.04 -0.75 -0.20 0.00 -1.81 0.00 0.00 57.70 54.97 1dvv n MET 13 Cb 0.16 -1.20 -0.14 0.00 -0.71 0.00 0.00 33.22 31.34 1dvv n MET 13 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dvv n ALA 14 N 0.11 0.91 -0.02 3.04 0.00 -0.53 -4.46 120.51 119.57 1dvv n ALA 14 Ca 0.07 -0.58 0.05 0.00 0.00 0.00 0.00 53.44 52.98 1dvv n ALA 14 Cb 0.20 -0.71 -0.12 0.00 0.00 0.00 0.00 19.45 18.81 1dvv n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dvv s HIS 16 N -2.96 3.02 -0.11 0.00 4.02 -1.14 -1.50 115.29 116.62 1dvv s HIS 16 Ca -0.06 0.00 -0.04 0.00 1.02 0.00 0.00 55.06 55.98 1dvv s HIS 16 Cb 0.09 -2.45 0.06 0.00 -1.02 0.00 0.00 32.58 29.26 1dvv s HIS 16 CO 0.64 -0.52 0.21 0.00 1.02 0.00 0.00 174.74 176.09 1dvv s ALA 17 N -2.56 -0.36 0.61 -1.40 0.00 -1.26 -4.80 121.76 112.00 1dvv s ALA 17 Ca 0.52 0.75 0.27 0.00 0.00 0.00 0.00 51.96 53.49 1dvv s ALA 17 Cb -0.10 -0.91 0.91 0.00 0.00 0.00 0.00 23.12 23.02 1dvv s ALA 17 CO 0.37 -0.60 1.30 -0.89 0.00 0.00 0.00 175.76 175.93 1dvv n ILE 18 N 5.33 0.00 0.00 0.00 5.41 -1.26 -1.32 119.36 127.51 1dvv n ILE 18 Ca -0.06 1.26 0.00 0.00 1.00 0.00 0.00 62.75 64.95 1dvv n ILE 18 Cb 0.50 -2.26 0.00 0.00 -0.71 0.00 0.00 39.64 37.17 1dvv n ILE 18 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1dvv n ASP 19 N -3.24 0.00 -4.78 4.38 5.68 -1.26 -1.43 116.55 115.90 1dvv n ASP 19 Ca 0.23 0.00 -0.33 0.00 -0.50 0.00 0.00 54.79 54.19 1dvv n ASP 19 Cb 1.54 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 41.55 1dvv n ASP 19 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1dvv s THR 20 N -1.00 3.32 -0.62 2.12 -4.23 -1.23 -4.63 115.64 109.37 1dvv s THR 20 Ca 0.00 0.66 -0.16 0.00 -1.18 0.00 0.00 61.69 61.00 1dvv s THR 20 Cb 0.00 -3.18 0.14 0.00 1.34 0.00 0.00 72.50 70.80 1dvv s THR 20 CO 0.00 -0.34 0.63 -0.54 -0.54 0.00 0.00 174.62 173.83 1dvv s LYS 21 N -3.92 3.15 0.00 3.99 1.02 -1.26 -3.77 119.74 118.95 1dvv s LYS 21 Ca 0.68 -1.77 0.00 0.00 0.02 0.00 0.00 55.97 54.89 1dvv s LYS 21 Cb -0.20 -4.34 0.00 0.00 -0.52 0.00 0.00 37.83 32.77 1dvv s LYS 21 CO 0.38 -1.39 0.00 -1.33 -0.92 0.00 0.00 175.35 172.09 1dvv n MET 22 N 5.30 0.00 0.09 1.68 2.81 -1.26 -4.90 117.12 120.83 1dvv n MET 22 Ca -0.06 0.00 -0.03 0.00 -1.81 0.00 0.00 57.70 55.80 1dvv n MET 22 Cb 0.42 0.00 0.17 0.00 -0.71 0.00 0.00 33.22 33.11 1dvv n MET 22 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1dvv h VAL 23 N 0.00 1.35 -1.33 2.03 2.07 -1.65 -3.45 116.25 115.27 1dvv h VAL 23 Ca 0.00 -1.74 -0.63 0.00 0.82 0.00 0.00 66.70 65.14 1dvv h VAL 23 Cb 0.00 1.84 -0.13 0.00 -1.52 0.00 0.00 31.29 31.48 1dvv h VAL 23 CO 0.00 0.52 -0.57 -0.83 0.02 0.00 0.00 177.57 176.71 1dvv s GLY 24 N -4.27 2.66 0.17 2.17 0.00 -0.56 -5.01 107.32 102.49 1dvv s GLY 24 Ca -0.04 -1.57 -0.31 0.00 0.00 0.00 0.00 44.72 42.79 1dvv s GLY 24 CO 0.78 -2.10 1.46 2.56 0.00 0.00 0.00 173.10 175.80 1dvv s PRO 25 N -3.78 4.27 0.68 2.90 0.05 -1.26 -4.68 135.00 133.18 1dvv s PRO 25 Ca 0.24 2.23 -0.17 0.00 0.05 0.00 0.00 61.00 63.36 1dvv s PRO 25 Cb 0.07 -3.17 -0.08 0.00 0.05 0.00 0.00 34.50 31.36 1dvv s PRO 25 CO 0.12 -0.48 0.23 0.00 0.05 0.00 0.00 177.00 176.92 1dvv n ALA 26 N 3.45 -2.27 0.04 8.56 0.00 -1.25 -4.62 120.51 124.43 1dvv n ALA 26 Ca 0.11 -0.21 -0.13 0.00 0.00 0.00 0.00 53.44 53.21 1dvv n ALA 26 Cb 0.40 -1.67 -0.09 0.00 0.00 0.00 0.00 19.45 18.10 1dvv n ALA 26 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1dvv h TYR 27 N -0.27 -0.10 -0.31 0.00 0.05 -1.29 -2.05 116.97 113.00 1dvv h TYR 27 Ca -0.44 -0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.40 1dvv h TYR 27 Cb 1.37 0.03 -0.06 0.00 1.01 0.00 0.00 36.73 39.09 1dvv h TYR 27 CO 0.30 0.24 -0.07 0.87 -1.05 0.00 0.00 178.16 178.45 1dvv h LYS 28 N -0.44 0.01 -0.77 4.88 1.57 -1.43 -0.87 116.57 119.52 1dvv h LYS 28 Ca -0.01 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.88 1dvv h LYS 28 Cb 0.38 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.61 1dvv h LYS 28 CO 0.02 0.01 0.39 -0.44 -0.57 0.00 0.00 179.45 178.86 1dvv h ASP 29 N 0.01 0.50 -0.99 0.86 5.19 -1.79 -0.06 116.42 120.13 1dvv h ASP 29 Ca 0.15 0.07 0.14 0.00 -0.62 0.00 0.00 57.03 56.77 1dvv h ASP 29 Cb 0.23 -0.01 -0.09 0.00 0.18 0.00 0.00 39.33 39.64 1dvv h ASP 29 CO -0.31 0.25 0.62 0.58 -3.12 0.00 0.00 179.24 177.26 1dvv h VAL 30 N 0.62 0.87 0.00 -1.35 2.07 -0.42 0.45 116.25 118.50 1dvv h VAL 30 Ca 0.40 -0.31 -0.12 0.00 0.82 0.00 0.00 66.70 67.49 1dvv h VAL 30 Cb 0.48 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1dvv h VAL 30 CO -0.31 0.17 -0.55 0.00 0.02 0.00 0.00 177.57 176.90 1dvv h ALA 31 N 1.57 0.94 0.00 1.67 0.00 -0.66 -2.03 119.26 120.75 1dvv h ALA 31 Ca 0.50 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1dvv h ALA 31 Cb 0.60 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1dvv h ALA 31 CO -0.28 0.69 -0.42 0.00 0.00 0.00 0.00 179.25 179.24 1dvv h ALA 32 N 1.45 1.06 0.09 0.00 0.00 -0.23 0.11 119.26 121.74 1dvv h ALA 32 Ca -0.01 -0.38 -0.33 0.00 0.00 0.00 0.00 54.91 54.19 1dvv h ALA 32 Cb 1.07 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1dvv h ALA 32 CO 0.07 0.53 -1.79 1.17 0.00 0.00 0.00 179.25 179.23 1dvv n LYS 33 N -3.69 0.71 -0.01 0.00 4.81 -0.89 -4.09 118.16 115.00 1dvv n LYS 33 Ca -0.01 0.35 0.14 0.00 -0.87 0.00 0.00 58.31 57.92 1dvv n LYS 33 Cb 0.51 -1.72 0.56 0.00 0.02 0.00 0.00 35.03 34.39 1dvv n LYS 33 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1dvv n TYR 34 N -3.76 0.04 -1.68 5.64 4.01 -0.78 -4.89 117.16 115.74 1dvv n TYR 34 Ca -0.32 -0.02 -0.48 0.00 -0.16 0.00 0.00 57.90 56.93 1dvv n TYR 34 Cb 0.94 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.93 1dvv n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dvv n ALA 35 N 0.01 1.00 0.00 -0.72 0.00 0.39 -1.98 120.51 119.20 1dvv n ALA 35 Ca 0.19 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1dvv n ALA 35 Cb 0.31 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.29 1dvv n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvv n GLY 36 N 4.18 1.26 3.83 0.00 0.00 -1.26 -5.03 105.19 108.16 1dvv n GLY 36 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 1dvv n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dvv s GLN 37 N -0.40 4.02 -0.61 1.61 -1.52 -0.84 -4.97 119.66 116.96 1dvv s GLN 37 Ca 0.00 0.53 -0.05 0.00 -1.95 0.00 0.00 55.36 53.89 1dvv s GLN 37 Cb 0.00 -3.16 -0.04 0.00 -0.22 0.00 0.00 33.01 29.59 1dvv s GLN 37 CO 0.00 0.63 2.97 0.00 -0.25 0.00 0.00 175.29 178.64 1dvv n ALA 38 N 1.55 6.62 0.00 6.09 0.00 -1.26 -4.21 120.51 129.30 1dvv n ALA 38 Ca -0.11 -2.94 0.00 0.00 0.00 0.00 0.00 53.44 50.39 1dvv n ALA 38 Cb 0.52 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1dvv n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvv n GLY 39 N 1.79 0.81 0.22 0.00 0.00 -1.26 -5.03 105.19 101.73 1dvv n GLY 39 Ca 0.53 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.66 1dvv n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dvv h ALA 40 N 0.00 0.96 0.00 4.61 0.00 -1.93 -2.93 119.26 119.97 1dvv h ALA 40 Ca 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1dvv h ALA 40 Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1dvv h ALA 40 CO 0.00 0.22 -0.52 1.05 0.00 0.00 0.00 179.25 180.00 1dvv h GLU 41 N 0.00 0.00 0.23 0.00 4.11 -1.94 -0.58 114.58 116.40 1dvv h GLU 41 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1dvv h GLU 41 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1dvv h GLU 41 CO 0.02 0.52 -0.11 0.00 0.07 0.00 0.00 179.01 179.51 1dvv h ALA 42 N 1.48 -0.31 0.00 1.06 0.00 -1.91 0.85 119.26 120.44 1dvv h ALA 42 Ca -0.01 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1dvv h ALA 42 Cb 0.96 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1dvv h ALA 42 CO 0.07 -0.54 -0.43 -0.92 0.00 0.00 0.00 179.25 177.43 1dvv h TYR 43 N -0.57 0.00 0.00 0.00 5.03 -1.62 -1.41 116.97 118.39 1dvv h TYR 43 Ca -0.03 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.22 1dvv h TYR 43 Cb 0.42 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.69 1dvv h TYR 43 CO 0.01 0.43 -0.27 -0.07 -1.32 0.00 0.00 178.16 176.94 1dvv h LEU 44 N 0.00 0.00 -0.22 2.82 3.38 -0.89 -0.33 115.31 120.07 1dvv h LEU 44 Ca -0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 1dvv h LEU 44 Cb 0.83 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.59 1dvv h LEU 44 CO 0.06 0.27 -0.74 0.00 0.09 0.00 0.00 178.44 178.11 1dvv h ALA 45 N 1.73 0.38 0.00 1.53 0.00 0.28 0.17 119.26 123.35 1dvv h ALA 45 Ca -0.00 -0.59 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 1dvv h ALA 45 Cb 0.64 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1dvv h ALA 45 CO 0.04 0.69 -0.27 0.37 0.00 0.00 0.00 179.25 180.08 1dvv h GLN 46 N 0.52 0.00 0.00 0.00 4.15 -1.08 -2.51 115.11 116.18 1dvv h GLN 46 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1dvv h GLN 46 Cb 1.36 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.05 1dvv h GLN 46 CO 0.15 0.27 -0.89 0.54 -1.93 0.00 0.00 178.83 176.97 1dvv n ARG 47 N -3.23 0.46 0.02 1.69 5.12 -0.17 -3.07 116.66 117.49 1dvv n ARG 47 Ca 0.02 0.09 -0.09 0.00 -1.93 0.00 0.00 57.85 55.94 1dvv n ARG 47 Cb 0.58 -1.75 -0.13 0.00 -1.16 0.00 0.00 32.46 30.00 1dvv n ARG 47 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 1dvv h ILE 48 N 0.00 1.23 0.00 0.55 2.04 -0.53 0.37 117.51 121.17 1dvv h ILE 48 Ca 0.00 -3.00 0.00 0.00 1.00 0.00 0.00 64.86 62.86 1dvv h ILE 48 Cb 0.88 2.64 0.00 0.00 -0.74 0.00 0.00 36.82 39.60 1dvv h ILE 48 CO 0.00 0.73 -0.42 1.17 0.00 0.00 0.00 178.15 179.64 1dvv n LYS 49 N -3.23 0.12 0.00 2.37 4.81 -0.96 -3.60 118.16 117.67 1dvv n LYS 49 Ca -0.10 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 1dvv n LYS 49 Cb 1.01 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 34.47 1dvv n LYS 49 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1dvv n ASN 50 N -1.76 1.57 -1.22 3.14 3.02 -1.17 -3.68 115.26 115.16 1dvv n ASN 50 Ca 0.05 -0.32 0.14 0.00 -0.03 0.00 0.00 54.58 54.42 1dvv n ASN 50 Cb 0.38 0.95 -0.05 0.00 -0.61 0.00 0.00 39.78 40.44 1dvv n ASN 50 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dvv n GLY 51 N 1.42 -1.99 0.00 7.41 0.00 0.13 -3.70 105.19 108.45 1dvv n GLY 51 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1dvv n GLY 51 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dvv n SER 52 N -4.26 0.00 -3.16 1.61 7.64 0.02 -4.76 113.62 110.72 1dvv n SER 52 Ca -0.03 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.76 1dvv n SER 52 Cb 0.64 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.85 1dvv n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dvv n GLN 53 N -0.56 1.02 -1.00 1.43 0.00 -1.26 -1.33 117.38 115.69 1dvv n GLN 53 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 57.00 55.67 1dvv n GLN 53 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 30.24 30.28 1dvv n GLN 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1dvv n GLY 54 N 2.26 0.18 0.10 2.61 0.00 -1.23 -4.82 105.19 104.29 1dvv n GLY 54 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 1dvv n GLY 54 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dvv h VAL 55 N 0.00 0.83 0.00 1.61 2.07 -1.95 -3.45 116.25 115.36 1dvv h VAL 55 Ca 0.00 -2.07 0.00 0.00 0.82 0.00 0.00 66.70 65.45 1dvv h VAL 55 Cb 0.64 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1dvv h VAL 55 CO 0.00 0.28 -0.54 0.79 0.02 0.00 0.00 177.57 178.12 1dvv n TRP 56 N -4.45 0.00 -2.92 1.57 7.02 -1.26 -5.14 117.44 112.26 1dvv n TRP 56 Ca -0.30 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.18 1dvv n TRP 56 Cb 0.64 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.53 1dvv n TRP 56 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1dvv n GLY 57 N 2.29 1.85 0.00 6.99 0.00 -1.26 -4.99 105.19 110.07 1dvv n GLY 57 Ca 0.00 -0.87 0.04 0.00 0.00 0.00 0.00 46.02 45.19 1dvv n GLY 57 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dvv n PRO 58 N 0.00 0.49 -3.62 1.61 -0.05 -1.26 -3.49 135.00 128.68 1dvv n PRO 58 Ca 0.00 0.00 -0.37 0.00 -0.05 0.00 0.00 63.50 63.08 1dvv n PRO 58 Cb 0.00 -1.25 -0.06 0.00 -0.05 0.00 0.00 33.50 32.14 1dvv n PRO 58 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 1dvv s ILE 59 N -2.00 4.40 0.94 0.52 1.01 -1.26 -4.97 121.20 119.84 1dvv s ILE 59 Ca 0.12 -3.56 -0.11 0.00 0.00 0.00 0.00 60.65 57.10 1dvv s ILE 59 Cb 0.05 -3.75 0.14 0.00 0.01 0.00 0.00 42.46 38.91 1dvv s ILE 59 CO 0.09 -1.05 1.01 -2.65 0.00 0.00 0.00 174.94 172.34 1dvv n PRO 60 N 2.70 -0.54 -3.59 2.79 -0.01 -1.26 -4.90 135.00 130.18 1dvv n PRO 60 Ca 0.18 -0.10 -0.36 0.00 -0.01 0.00 0.00 63.50 63.21 1dvv n PRO 60 Cb 0.38 -2.28 -0.07 0.00 -0.01 0.00 0.00 33.50 31.52 1dvv n PRO 60 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 175.50 176.90 1dvv s MET 61 N -4.45 4.18 0.18 -0.52 1.75 -0.44 -4.80 119.30 115.20 1dvv s MET 61 Ca 0.65 0.04 -0.31 0.00 -1.25 0.00 0.00 55.69 54.83 1dvv s MET 61 Cb -0.23 -3.40 -0.09 0.00 2.84 0.00 0.00 34.83 33.95 1dvv s MET 61 CO 0.60 0.31 1.41 -1.25 -0.65 0.00 0.00 175.02 175.43 1dvv s PRO 62 N 0.28 4.31 0.37 4.11 0.05 -1.26 -0.80 135.00 142.06 1dvv s PRO 62 Ca 0.15 2.17 -0.28 0.00 0.05 0.00 0.00 61.00 63.09 1dvv s PRO 62 Cb -0.13 -3.19 -0.11 0.00 0.05 0.00 0.00 34.50 31.12 1dvv s PRO 62 CO 0.03 -0.41 1.45 -0.35 0.05 0.00 0.00 177.00 177.77 1dvv n PRO 63 N 3.23 2.56 -4.26 0.56 -0.04 -1.24 -4.54 135.00 131.27 1dvv n PRO 63 Ca 0.09 0.90 -0.24 0.00 -0.04 0.00 0.00 63.50 64.21 1dvv n PRO 63 Cb 0.41 -2.60 -0.08 0.00 -0.04 0.00 0.00 33.50 31.20 1dvv n PRO 63 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1dvv s ASN 64 N -0.16 4.32 -0.33 3.54 0.01 -1.24 -4.90 114.94 116.19 1dvv s ASN 64 Ca 0.54 -0.96 -0.01 0.00 -0.71 0.00 0.00 52.86 51.72 1dvv s ASN 64 Cb -0.50 -0.57 0.25 0.00 0.41 0.00 0.00 41.25 40.85 1dvv s ASN 64 CO 0.63 -0.30 1.93 0.00 -1.51 0.00 0.00 177.10 177.86 1dvv n ALA 65 N -1.04 5.04 -2.20 0.60 0.00 -1.26 -4.69 120.51 116.97 1dvv n ALA 65 Ca -0.04 -1.77 -0.43 0.00 0.00 0.00 0.00 53.44 51.21 1dvv n ALA 65 Cb 0.62 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 1dvv n ALA 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1dvv s VAL 66 N -2.39 3.85 1.09 0.00 -7.23 -1.26 -4.99 120.40 109.47 1dvv s VAL 66 Ca 0.33 0.98 -0.15 0.00 -1.81 0.00 0.00 61.98 61.33 1dvv s VAL 66 Cb 0.26 -3.80 0.20 0.00 0.56 0.00 0.00 36.38 33.60 1dvv s VAL 66 CO 0.01 -0.27 0.40 -1.20 -0.31 0.00 0.00 175.10 173.73 1dvv n SER 67 N 7.83 -3.14 0.48 4.85 7.64 -1.26 -4.27 113.62 125.74 1dvv n SER 67 Ca 0.17 -0.45 -0.20 0.00 1.01 0.00 0.00 58.87 59.41 1dvv n SER 67 Cb 0.45 -0.82 -0.09 0.00 -1.01 0.00 0.00 64.21 62.74 1dvv n SER 67 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1dvv h ASP 68 N -2.81 -1.03 0.00 6.43 5.19 -1.99 -1.17 116.42 121.04 1dvv h ASP 68 Ca -0.29 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.15 1dvv h ASP 68 Cb 0.89 0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.67 1dvv h ASP 68 CO 0.18 -0.72 0.01 -0.90 -3.12 0.00 0.00 179.24 174.70 1dvv n ASP 69 N -5.60 0.40 0.00 6.45 5.68 -1.26 -1.74 116.55 120.48 1dvv n ASP 69 Ca -0.16 0.68 -0.19 0.00 -0.50 0.00 0.00 54.79 54.62 1dvv n ASP 69 Cb 0.48 -0.73 -0.14 0.00 -1.14 0.00 0.00 41.12 39.59 1dvv n ASP 69 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1dvv h GLU 70 N 0.00 0.19 0.00 0.11 4.39 -1.53 -2.42 114.58 115.32 1dvv h GLU 70 Ca 0.00 -0.33 -0.04 0.00 0.34 0.00 0.00 59.36 59.33 1dvv h GLU 70 Cb 0.03 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 1dvv h GLU 70 CO 0.00 1.16 -0.20 0.00 -1.16 0.00 0.00 179.01 178.81 1dvv h ALA 71 N -0.02 1.00 0.01 3.43 0.00 -0.53 0.57 119.26 123.73 1dvv h ALA 71 Ca -0.17 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 1dvv h ALA 71 Cb 1.50 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.27 1dvv h ALA 71 CO 0.07 0.25 -0.60 0.37 0.00 0.00 0.00 179.25 179.33 1dvv h GLN 72 N 0.00 0.40 0.00 0.00 4.15 -1.42 -1.67 115.11 116.57 1dvv h GLN 72 Ca -0.00 -0.44 -0.03 0.00 0.77 0.00 0.00 58.65 58.95 1dvv h GLN 72 Cb 0.75 0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.56 1dvv h GLN 72 CO 0.03 1.11 -0.15 1.15 -1.93 0.00 0.00 178.83 179.03 1dvv h THR 73 N -0.13 0.32 -0.02 2.39 2.02 -1.31 -2.11 112.91 114.08 1dvv h THR 73 Ca -0.08 -1.09 -0.26 0.00 0.77 0.00 0.00 66.41 65.76 1dvv h THR 73 Cb 1.32 1.85 0.02 0.00 -1.74 0.00 0.00 68.15 69.60 1dvv h THR 73 CO 0.12 0.15 -0.99 -0.07 0.37 0.00 0.00 175.52 175.10 1dvv h LEU 74 N 0.00 0.88 -0.16 2.58 3.38 -0.82 -0.46 115.31 120.71 1dvv h LEU 74 Ca -0.00 -0.68 -0.13 0.00 0.09 0.00 0.00 57.88 57.16 1dvv h LEU 74 Cb 0.84 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1dvv h LEU 74 CO 0.02 1.48 -0.41 0.00 0.09 0.00 0.00 178.44 179.62 1dvv h ALA 75 N 0.47 0.26 -0.05 1.53 0.00 -1.19 -2.44 119.26 117.83 1dvv h ALA 75 Ca -0.11 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.27 1dvv h ALA 75 Cb 1.64 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1dvv h ALA 75 CO 0.19 0.37 -0.26 0.87 0.00 0.00 0.00 179.25 180.42 1dvv h LYS 76 N 0.20 0.09 -0.33 0.00 1.57 -1.44 -2.60 116.57 114.06 1dvv h LYS 76 Ca -0.01 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1dvv h LYS 76 Cb 1.02 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 1dvv h LYS 76 CO 0.09 0.35 -0.02 2.35 -0.57 0.00 0.00 179.45 181.65 1dvv h TRP 77 N 0.08 0.66 -0.27 -1.35 7.01 -0.92 0.20 115.95 121.37 1dvv h TRP 77 Ca 0.01 -0.12 -0.00 0.00 2.11 0.00 0.00 58.89 60.89 1dvv h TRP 77 Cb 0.52 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.39 1dvv h TRP 77 CO 0.00 0.73 0.15 0.82 -2.79 0.00 0.00 178.44 177.36 1dvv h ILE 78 N 0.40 1.12 0.00 2.65 2.04 -1.15 -0.39 117.51 122.19 1dvv h ILE 78 Ca 0.09 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1dvv h ILE 78 Cb 0.48 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1dvv h ILE 78 CO 0.02 0.12 0.00 0.18 0.00 0.00 0.00 178.15 178.47 1dvv n LEU 79 N -4.84 0.42 0.11 1.44 4.32 -1.01 -2.58 117.00 114.87 1dvv n LEU 79 Ca -0.02 0.58 0.12 0.00 -0.02 0.00 0.00 56.01 56.66 1dvv n LEU 79 Cb 0.07 -0.48 0.01 0.00 -1.62 0.00 0.00 43.42 41.39 1dvv n LEU 79 CO 0.35 -0.30 0.05 0.28 -1.22 0.00 0.00 177.39 176.55 1dvv h SER 80 N 0.00 0.00 -1.73 -1.43 0.02 0.59 -3.35 113.55 107.65 1dvv h SER 80 Ca 0.00 -0.00 0.50 0.00 -0.84 0.00 0.00 61.79 61.45 1dvv h SER 80 Cb 0.45 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.92 1dvv h SER 80 CO 0.00 0.00 1.35 1.56 -1.14 0.00 0.00 176.83 178.60 1dvv h GLN 81 N 0.00 0.00 0.00 3.45 7.50 -0.85 -3.50 115.11 121.71 1dvv h GLN 81 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1dvv h GLN 81 Cb 1.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.53 1dvv h GLN 81 CO 0.00 0.00 0.00 1.17 -1.50 0.00 0.00 178.83 178.50