#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 6.39 0.35 1.62 1.11 -1.26 -4.91 116.67 119.97 1dvv s ASP 2 Ca 0.00 1.68 0.24 0.00 0.18 0.00 0.00 52.55 54.65 1dvv s ASP 2 Cb 0.00 -2.52 1.27 0.00 1.07 0.00 0.00 42.92 42.74 1dvv s ASP 2 CO 0.00 -0.75 1.72 1.55 1.18 0.00 0.00 175.17 178.87 1dvv h PRO 3 N 0.92 0.00 -0.18 8.23 0.13 -2.00 -1.28 132.00 137.82 1dvv h PRO 3 Ca -0.47 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.46 1dvv h PRO 3 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1dvv h PRO 3 CO 0.60 0.00 -0.67 1.49 -0.23 0.00 0.00 178.00 179.19 1dvv h GLU 4 N 0.00 0.69 0.22 0.86 4.22 -1.97 -1.90 114.58 116.70 1dvv h GLU 4 Ca 0.00 -0.50 -0.01 0.00 0.08 0.00 0.00 59.36 58.93 1dvv h GLU 4 Cb 0.01 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1dvv h GLU 4 CO 0.00 1.12 -0.10 0.28 -2.18 0.00 0.00 179.01 178.13 1dvv h VAL 5 N 0.50 0.84 -0.35 0.32 2.07 -1.60 -1.40 116.25 116.63 1dvv h VAL 5 Ca -0.02 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 1dvv h VAL 5 Cb 1.27 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1dvv h VAL 5 CO 0.13 0.07 0.13 0.17 0.02 0.00 0.00 177.57 178.09 1dvv h LEU 6 N -0.44 0.44 -1.62 2.57 8.10 -1.60 -0.16 115.31 122.59 1dvv h LEU 6 Ca -0.03 -0.04 -0.02 0.00 0.11 0.00 0.00 57.88 57.90 1dvv h LEU 6 Cb 0.33 -0.11 -0.00 0.00 -0.44 0.00 0.00 40.66 40.44 1dvv h LEU 6 CO 0.05 0.41 -0.08 0.00 -4.11 0.00 0.00 178.44 174.71 1dvv h ALA 7 N 1.66 1.06 0.00 0.17 0.00 -0.98 -2.42 119.26 118.75 1dvv h ALA 7 Ca 0.12 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1dvv h ALA 7 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1dvv h ALA 7 CO -0.01 0.10 -0.01 0.87 0.00 0.00 0.00 179.25 180.20 1dvv h LYS 8 N 0.00 0.01 0.00 0.00 1.57 0.08 0.10 116.57 118.33 1dvv h LYS 8 Ca -0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1dvv h LYS 8 Cb 0.48 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 1dvv h LYS 8 CO 0.01 0.98 -0.09 -0.91 -0.57 0.00 0.00 179.45 178.86 1dvv h ASN 9 N -0.96 0.00 0.96 0.86 2.35 -1.41 -1.38 115.58 115.99 1dvv h ASN 9 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1dvv h ASN 9 Cb 0.98 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.35 1dvv h ASN 9 CO 0.00 0.09 -0.28 0.29 -1.65 0.00 0.00 177.43 175.89 1dvv n LYS 10 N -3.49 0.14 -0.74 0.81 4.76 -0.92 -4.91 118.16 113.82 1dvv n LYS 10 Ca -0.02 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1dvv n LYS 10 Cb 0.24 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 31.81 1dvv n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1dvv n GLY 11 N 1.41 0.59 0.23 0.72 0.00 -0.52 -4.93 105.19 102.69 1dvv n GLY 11 Ca 0.05 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.75 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 -4.23 1.69 0.04 0.00 2.81 -1.17 -3.25 117.12 113.01 1dvv n MET 13 Ca -0.01 -1.06 -0.20 0.00 -1.81 0.00 0.00 57.70 54.63 1dvv n MET 13 Cb 0.31 -1.30 -0.15 0.00 -0.71 0.00 0.00 33.22 31.37 1dvv n MET 13 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dvv h ALA 14 N 3.75 -0.08 0.00 3.04 0.00 -1.63 -3.38 119.26 120.97 1dvv h ALA 14 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1dvv h ALA 14 Cb 0.42 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1dvv h ALA 14 CO 0.00 0.38 -1.63 0.00 0.00 0.00 0.00 179.25 178.00 1dvv s HIS 16 N -3.18 2.97 -0.15 0.00 4.02 -1.20 -1.51 115.29 116.23 1dvv s HIS 16 Ca -0.04 0.04 -0.05 0.00 1.02 0.00 0.00 55.06 56.03 1dvv s HIS 16 Cb 0.13 -2.59 0.08 0.00 -1.02 0.00 0.00 32.58 29.17 1dvv s HIS 16 CO 0.78 -0.68 0.30 0.00 1.02 0.00 0.00 174.74 176.15 1dvv s ALA 17 N -2.67 -0.68 0.55 -1.40 0.00 -1.26 -4.78 121.76 111.51 1dvv s ALA 17 Ca 0.54 1.00 0.35 0.00 0.00 0.00 0.00 51.96 53.85 1dvv s ALA 17 Cb -0.10 -1.14 1.19 0.00 0.00 0.00 0.00 23.12 23.07 1dvv s ALA 17 CO 0.38 -0.74 1.32 -0.89 0.00 0.00 0.00 175.76 175.83 1dvv n ILE 18 N 5.36 0.00 0.00 0.00 -0.00 -1.26 -1.06 119.36 122.39 1dvv n ILE 18 Ca -0.06 1.27 0.00 0.00 -0.00 0.00 0.00 62.75 63.96 1dvv n ILE 18 Cb 0.50 -2.21 0.00 0.00 -0.00 0.00 0.00 39.64 37.93 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 -3.41 0.00 -3.48 4.38 5.75 -1.26 -2.18 116.55 116.35 1dvv n ASP 19 Ca 0.31 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.80 1dvv n ASP 19 Cb 1.64 0.00 0.24 0.00 -1.03 0.00 0.00 41.12 41.97 1dvv n ASP 19 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1dvv n THR 20 N -1.09 0.00 -3.70 2.12 -2.24 -1.22 -4.65 114.28 103.49 1dvv n THR 20 Ca 0.00 -0.42 -0.29 0.00 -2.27 0.00 0.00 64.05 61.07 1dvv n THR 20 Cb 0.00 -1.20 -0.13 0.00 -2.10 0.00 0.00 70.33 66.90 1dvv n THR 20 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1dvv s LYS 21 N -5.32 1.31 0.00 -0.78 2.20 -1.26 -3.34 119.74 112.55 1dvv s LYS 21 Ca 0.67 -2.06 0.00 0.00 -0.36 0.00 0.00 55.97 54.22 1dvv s LYS 21 Cb -0.07 -2.33 0.00 0.00 -1.51 0.00 0.00 37.83 33.92 1dvv s LYS 21 CO 0.52 -1.18 0.00 -1.33 -0.36 0.00 0.00 175.35 173.00 1dvv n MET 22 N 3.46 0.00 -0.04 4.03 2.81 -1.26 -4.84 117.12 121.28 1dvv n MET 22 Ca 0.10 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.98 1dvv n MET 22 Cb 0.35 0.00 -0.15 0.00 -0.71 0.00 0.00 33.22 32.72 1dvv n MET 22 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1dvv n VAL 23 N 0.00 0.87 -4.60 2.03 0.31 -0.67 -4.97 118.33 111.30 1dvv n VAL 23 Ca 0.00 -0.70 -0.30 0.00 -0.01 0.00 0.00 64.34 63.33 1dvv n VAL 23 Cb 0.00 -0.37 -0.09 0.00 -0.91 0.00 0.00 33.84 32.47 1dvv n VAL 23 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1dvv s GLY 24 N -5.00 2.70 0.19 2.92 0.00 -0.57 -5.02 107.32 102.53 1dvv s GLY 24 Ca -0.08 -1.46 -0.30 0.00 0.00 0.00 0.00 44.72 42.87 1dvv s GLY 24 CO 0.85 -2.11 1.36 2.56 0.00 0.00 0.00 173.10 175.76 1dvv s PRO 25 N -3.82 4.35 0.60 2.90 0.05 -1.26 -4.69 135.00 133.12 1dvv s PRO 25 Ca 0.24 2.11 -0.18 0.00 0.05 0.00 0.00 61.00 63.22 1dvv s PRO 25 Cb 0.05 -3.19 -0.10 0.00 0.05 0.00 0.00 34.50 31.31 1dvv s PRO 25 CO 0.13 -0.33 0.25 0.00 0.05 0.00 0.00 177.00 177.09 1dvv n ALA 26 N 2.93 -2.05 0.28 8.56 0.00 -1.21 -4.55 120.51 124.46 1dvv n ALA 26 Ca 0.08 -0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.30 1dvv n ALA 26 Cb 0.42 -1.66 -0.05 0.00 0.00 0.00 0.00 19.45 18.16 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 -0.02 -0.66 -0.76 0.00 0.05 -1.20 -1.54 116.97 112.84 1dvv h TYR 27 Ca -0.44 -0.02 0.17 0.00 0.05 0.00 0.00 58.73 58.50 1dvv h TYR 27 Cb 1.40 0.22 -0.12 0.00 1.01 0.00 0.00 36.73 39.24 1dvv h TYR 27 CO 0.29 -0.41 0.15 -0.22 -1.05 0.00 0.00 178.16 176.91 1dvv h LYS 28 N -0.75 0.21 -0.58 4.88 3.64 -1.61 0.15 116.57 122.51 1dvv h LYS 28 Ca -0.07 -0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.40 1dvv h LYS 28 Cb 0.54 -0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.23 1dvv h LYS 28 CO 0.12 0.14 0.11 -0.44 -2.27 0.00 0.00 179.45 177.11 1dvv h ASP 29 N 0.22 -0.03 -0.54 4.20 3.32 -1.75 0.16 116.42 122.00 1dvv h ASP 29 Ca 0.43 0.11 0.06 0.00 0.02 0.00 0.00 57.03 57.65 1dvv h ASP 29 Cb 0.77 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 1dvv h ASP 29 CO -0.56 -0.00 0.36 0.58 -1.72 0.00 0.00 179.24 177.90 1dvv h VAL 30 N 0.24 1.00 0.00 -1.35 2.07 0.35 -0.42 116.25 118.14 1dvv h VAL 30 Ca 0.30 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.54 1dvv h VAL 30 Cb 0.45 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1dvv h VAL 30 CO -0.40 0.10 -0.50 0.00 0.02 0.00 0.00 177.57 176.78 1dvv h ALA 31 N 1.70 0.81 0.00 1.67 0.00 -0.31 -2.54 119.26 120.58 1dvv h ALA 31 Ca 0.23 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 1dvv h ALA 31 Cb 0.26 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1dvv h ALA 31 CO -0.06 0.63 -0.60 0.00 0.00 0.00 0.00 179.25 179.22 1dvv h ALA 32 N 1.50 0.83 0.14 0.00 0.00 0.43 0.56 119.26 122.72 1dvv h ALA 32 Ca -0.01 -0.54 -0.33 0.00 0.00 0.00 0.00 54.91 54.03 1dvv h ALA 32 Cb 1.18 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1dvv h ALA 32 CO 0.07 0.75 -1.66 -0.22 0.00 0.00 0.00 179.25 178.18 1dvv h LYS 33 N 0.00 0.29 -0.02 0.00 1.63 -1.39 -3.34 116.57 113.75 1dvv h LYS 33 Ca -0.01 -0.50 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 1dvv h LYS 33 Cb 1.19 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 33.01 1dvv h LYS 33 CO 0.08 1.17 -0.30 0.66 -3.45 0.00 0.00 179.45 177.60 1dvv n TYR 34 N -3.49 0.00 -1.53 1.91 4.01 -0.96 -4.87 117.16 112.23 1dvv n TYR 34 Ca -0.21 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.36 1dvv n TYR 34 Cb 1.06 -0.02 -0.14 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 0.21 0.68 0.00 -0.72 0.00 0.20 -3.52 120.51 117.36 1dvv n ALA 35 Ca 0.11 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1dvv n ALA 35 Cb 0.47 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.02 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 6.24 0.21 3.11 0.00 0.00 -1.26 -5.02 105.19 108.47 1dvv n GLY 36 Ca 0.56 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 0.48 -0.33 1.61 -0.21 -1.23 -5.03 119.66 114.95 1dvv s GLN 37 Ca 0.00 -0.39 -0.01 0.00 0.02 0.00 0.00 55.36 54.98 1dvv s GLN 37 Cb 0.00 0.20 0.23 0.00 1.00 0.00 0.00 33.01 34.44 1dvv s GLN 37 CO 0.00 -0.11 1.99 0.00 -2.12 0.00 0.00 175.29 175.05 1dvv n ALA 38 N 1.47 5.12 0.00 6.09 0.00 -1.26 -4.31 120.51 127.62 1dvv n ALA 38 Ca -0.23 -1.73 0.00 0.00 0.00 0.00 0.00 53.44 51.49 1dvv n ALA 38 Cb 0.56 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 0.25 -0.01 0.13 0.00 0.00 -1.26 -5.07 105.19 99.24 1dvv n GLY 39 Ca 0.31 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.12 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 0.12 -0.82 4.61 0.00 -1.95 -3.28 119.26 117.94 1dvv h ALA 40 Ca 0.00 -1.05 0.01 0.00 0.00 0.00 0.00 54.91 53.88 1dvv h ALA 40 Cb 0.00 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1dvv h ALA 40 CO 0.00 0.83 0.54 0.93 0.00 0.00 0.00 179.25 181.55 1dvv h GLU 41 N -0.16 1.06 -0.21 0.00 3.07 -1.93 0.84 114.58 117.25 1dvv h GLU 41 Ca -0.30 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 1dvv h GLU 41 Cb 1.88 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 29.54 1dvv h GLU 41 CO 0.12 0.70 0.14 0.00 -1.40 0.00 0.00 179.01 178.57 1dvv h ALA 42 N 1.49 0.27 0.00 3.43 0.00 -1.97 -0.56 119.26 121.93 1dvv h ALA 42 Ca 0.31 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1dvv h ALA 42 Cb -0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1dvv h ALA 42 CO -0.07 -0.25 -0.00 -0.92 0.00 0.00 0.00 179.25 178.01 1dvv h TYR 43 N 0.28 0.00 -0.09 0.00 3.20 -1.47 -2.02 116.97 116.86 1dvv h TYR 43 Ca 0.08 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.77 1dvv h TYR 43 Cb -0.02 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 1dvv h TYR 43 CO -0.06 0.00 -0.68 -0.07 -1.64 0.00 0.00 178.16 175.71 1dvv h LEU 44 N 0.00 0.47 -0.34 2.82 3.38 0.46 -0.41 115.31 121.70 1dvv h LEU 44 Ca -0.00 -0.29 -0.19 0.00 0.09 0.00 0.00 57.88 57.49 1dvv h LEU 44 Cb 0.53 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1dvv h LEU 44 CO 0.00 1.01 -0.84 0.00 0.09 0.00 0.00 178.44 178.71 1dvv h ALA 45 N 0.98 0.59 0.00 1.53 0.00 -0.53 -1.42 119.26 120.40 1dvv h ALA 45 Ca -0.02 -0.71 -0.15 0.00 0.00 0.00 0.00 54.91 54.02 1dvv h ALA 45 Cb 1.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1dvv h ALA 45 CO 0.12 0.93 -0.72 0.37 0.00 0.00 0.00 179.25 179.95 1dvv h GLN 46 N 0.08 0.00 0.00 0.00 4.15 -1.23 -2.41 115.11 115.70 1dvv h GLN 46 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1dvv h GLN 46 Cb 1.46 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.15 1dvv h GLN 46 CO 0.12 0.72 -0.56 0.00 -1.93 0.00 0.00 178.83 177.18 1dvv h ARG 47 N 0.00 0.00 0.00 1.69 2.47 -1.02 -3.21 114.38 114.31 1dvv h ARG 47 Ca -0.01 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.47 1dvv h ARG 47 Cb 1.43 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.71 1dvv h ARG 47 CO 0.09 0.00 -1.49 0.82 0.56 0.00 0.00 179.97 179.95 1dvv h ILE 48 N 0.00 0.91 0.00 2.04 2.04 -1.18 0.33 117.51 121.65 1dvv h ILE 48 Ca 0.00 -2.65 -0.02 0.00 1.00 0.00 0.00 64.86 63.19 1dvv h ILE 48 Cb 0.84 2.41 -0.00 0.00 -0.74 0.00 0.00 36.82 39.33 1dvv h ILE 48 CO 0.00 0.52 -0.10 0.50 0.00 0.00 0.00 178.15 179.07 1dvv h LYS 49 N 0.00 0.00 0.00 2.37 3.64 -1.52 -3.10 116.57 117.96 1dvv h LYS 49 Ca -0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1dvv h LYS 49 Cb 1.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 1dvv h LYS 49 CO 0.08 0.08 -0.76 0.09 -2.27 0.00 0.00 179.45 176.67 1dvv n ASN 50 N -3.11 3.79 -1.12 4.20 4.13 -1.21 -3.59 115.26 118.34 1dvv n ASN 50 Ca 0.04 -0.10 0.12 0.00 1.68 0.00 0.00 54.58 56.32 1dvv n ASN 50 Cb 0.56 0.96 -0.05 0.00 -1.54 0.00 0.00 39.78 39.71 1dvv n ASN 50 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1dvv n GLY 51 N 2.09 -1.73 0.00 7.41 0.00 0.12 -3.32 105.19 109.75 1dvv n GLY 51 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 -4.21 0.00 -0.61 1.61 7.64 0.83 -4.68 113.62 114.20 1dvv n SER 52 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1dvv n SER 52 Cb 0.61 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.81 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 -0.80 2.51 -1.48 1.43 0.00 -1.26 -1.18 117.38 116.60 1dvv n GLN 53 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 57.00 56.83 1dvv n GLN 53 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 30.24 30.17 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 5.00 1.63 0.01 2.61 0.00 -1.23 -4.84 105.19 108.36 1dvv n GLY 54 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 1dvv n GLY 54 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1dvv n VAL 55 N -2.43 0.13 -0.01 1.61 0.31 -1.26 -4.92 118.33 111.76 1dvv n VAL 55 Ca -0.17 0.47 -0.01 0.00 -0.01 0.00 0.00 64.34 64.62 1dvv n VAL 55 Cb 0.59 -1.57 -0.01 0.00 -0.91 0.00 0.00 33.84 31.94 1dvv n VAL 55 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1dvv n TRP 56 N -2.63 0.00 -3.20 3.52 7.02 -1.26 -5.11 117.44 115.78 1dvv n TRP 56 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1dvv n TRP 56 Cb 0.04 -0.07 0.00 0.00 -2.42 0.00 0.00 31.31 28.86 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 3.32 3.10 0.24 6.99 0.00 -1.26 -5.00 105.19 112.57 1dvv n GLY 57 Ca -0.03 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 0.58 -3.66 1.61 -0.05 -1.26 -3.58 135.00 128.64 1dvv n PRO 58 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 63.50 63.07 1dvv n PRO 58 Cb 0.00 -1.14 -0.09 0.00 -0.05 0.00 0.00 33.50 32.22 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 -1.53 3.85 0.13 0.52 1.01 -1.26 -4.95 121.20 118.98 1dvv s ILE 59 Ca 0.00 -2.27 -0.31 0.00 0.00 0.00 0.00 60.65 58.07 1dvv s ILE 59 Cb 0.00 -3.55 -0.09 0.00 0.01 0.00 0.00 42.46 38.83 1dvv s ILE 59 CO 0.00 -0.80 1.57 -2.16 0.00 0.00 0.00 174.94 173.55 1dvv s PRO 60 N 0.79 4.22 0.09 2.79 0.05 -1.26 -4.66 135.00 137.03 1dvv s PRO 60 Ca 0.11 2.32 -0.31 0.00 0.05 0.00 0.00 61.00 63.17 1dvv s PRO 60 Cb -0.22 -3.29 -0.07 0.00 0.05 0.00 0.00 34.50 30.97 1dvv s PRO 60 CO -0.03 -0.62 1.40 1.41 0.05 0.00 0.00 177.00 179.21 1dvv s MET 61 N 1.55 4.31 0.17 4.56 1.75 -0.33 -4.59 119.30 126.72 1dvv s MET 61 Ca 0.70 2.07 -0.32 0.00 -1.25 0.00 0.00 55.69 56.89 1dvv s MET 61 Cb -0.42 -3.32 -0.10 0.00 2.84 0.00 0.00 34.83 33.83 1dvv s MET 61 CO 0.31 -0.47 1.57 -1.25 -0.65 0.00 0.00 175.02 174.53 1dvv s PRO 62 N 1.40 4.21 0.60 4.11 0.05 -1.26 -0.12 135.00 144.00 1dvv s PRO 62 Ca 0.65 2.37 -0.19 0.00 0.05 0.00 0.00 61.00 63.87 1dvv s PRO 62 Cb -0.36 -3.15 -0.04 0.00 0.05 0.00 0.00 34.50 31.00 1dvv s PRO 62 CO 0.30 -0.61 1.13 -2.30 0.05 0.00 0.00 177.00 175.57 1dvv n PRO 63 N 3.98 1.11 -4.51 0.56 -0.01 -1.21 -4.57 135.00 130.35 1dvv n PRO 63 Ca 0.14 0.43 -0.25 0.00 -0.01 0.00 0.00 63.50 63.81 1dvv n PRO 63 Cb 0.38 -2.34 -0.10 0.00 -0.01 0.00 0.00 33.50 31.43 1dvv n PRO 63 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 175.50 174.69 1dvv s ASN 64 N -1.21 3.57 -0.31 2.55 0.01 -1.17 -4.90 114.94 113.47 1dvv s ASN 64 Ca 0.77 -1.15 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 1dvv s ASN 64 Cb -0.41 -0.31 0.28 0.00 0.41 0.00 0.00 41.25 41.21 1dvv s ASN 64 CO 0.46 -0.15 1.83 0.00 -1.51 0.00 0.00 177.10 177.72 1dvv n ALA 65 N -0.71 4.83 -2.59 0.60 0.00 -1.26 -4.70 120.51 116.68 1dvv n ALA 65 Ca -0.05 -1.72 -0.43 0.00 0.00 0.00 0.00 53.44 51.24 1dvv n ALA 65 Cb 0.62 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 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 -2.24 4.38 0.65 0.00 -7.23 -1.26 -5.00 120.40 109.70 1dvv s VAL 66 Ca 0.33 0.69 -0.17 0.00 -1.81 0.00 0.00 61.98 61.01 1dvv s VAL 66 Cb 0.26 -4.51 -0.13 0.00 0.56 0.00 0.00 36.38 32.57 1dvv s VAL 66 CO 0.02 -0.97 -0.14 -1.54 -0.31 0.00 0.00 175.10 172.16 1dvv n SER 67 N 7.43 -3.67 -0.25 4.85 3.41 -1.26 -4.11 113.62 120.01 1dvv n SER 67 Ca 0.06 0.54 0.03 0.00 -0.26 0.00 0.00 58.87 59.25 1dvv n SER 67 Cb 0.48 -0.90 0.12 0.00 -0.26 0.00 0.00 64.21 63.65 1dvv n SER 67 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1dvv h ASP 68 N -0.27 -0.50 -0.44 4.04 1.82 -1.94 0.40 116.42 119.52 1dvv h ASP 68 Ca -0.43 0.21 -0.01 0.00 -0.39 0.00 0.00 57.03 56.41 1dvv h ASP 68 Cb 1.40 0.40 -0.02 0.00 0.68 0.00 0.00 39.33 41.78 1dvv h ASP 68 CO 0.38 -0.21 0.26 -0.78 -1.61 0.00 0.00 179.24 177.28 1dvv h ASP 69 N 0.05 0.55 -0.34 2.28 1.82 -1.99 -0.89 116.42 117.89 1dvv h ASP 69 Ca 0.38 -0.03 -0.15 0.00 -0.39 0.00 0.00 57.03 56.84 1dvv h ASP 69 Cb 0.64 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 40.51 1dvv h ASP 69 CO -0.71 0.44 -0.37 -0.33 -1.61 0.00 0.00 179.24 176.67 1dvv h GLU 70 N 0.63 0.85 0.00 0.28 5.08 -0.53 -2.59 114.58 118.30 1dvv h GLU 70 Ca 0.16 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 58.04 1dvv h GLU 70 Cb 0.01 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1dvv h GLU 70 CO -0.03 1.10 -0.09 0.00 -1.00 0.00 0.00 179.01 178.99 1dvv h ALA 71 N 0.74 1.00 -0.21 3.43 0.00 -0.75 -1.88 119.26 121.59 1dvv h ALA 71 Ca 0.05 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1dvv h ALA 71 Cb 0.96 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1dvv h ALA 71 CO 0.09 0.11 -0.26 1.96 0.00 0.00 0.00 179.25 181.15 1dvv h GLN 72 N 0.00 0.55 0.00 0.00 4.20 -0.88 -0.93 115.11 118.05 1dvv h GLN 72 Ca -0.00 -0.31 -0.05 0.00 0.06 0.00 0.00 58.65 58.35 1dvv h GLN 72 Cb 0.68 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 1dvv h GLN 72 CO 0.01 0.91 -0.22 1.15 -0.67 0.00 0.00 178.83 180.01 1dvv h THR 73 N 0.23 0.56 -0.20 -0.54 2.02 -1.26 -2.57 112.91 111.15 1dvv h THR 73 Ca 0.03 -1.07 -0.18 0.00 0.77 0.00 0.00 66.41 65.96 1dvv h THR 73 Cb 0.83 1.73 -0.00 0.00 -1.74 0.00 0.00 68.15 68.96 1dvv h THR 73 CO 0.06 0.21 -0.59 -0.07 0.37 0.00 0.00 175.52 175.50 1dvv h LEU 74 N 0.00 0.73 0.11 2.58 3.38 -0.90 0.86 115.31 122.06 1dvv h LEU 74 Ca -0.00 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1dvv h LEU 74 Cb 0.71 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1dvv h LEU 74 CO 0.03 1.16 -0.05 0.00 0.09 0.00 0.00 178.44 179.67 1dvv h ALA 75 N 0.85 -0.14 0.00 1.53 0.00 -0.80 -0.92 119.26 119.77 1dvv h ALA 75 Ca -0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1dvv h ALA 75 Cb 1.16 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1dvv h ALA 75 CO 0.12 -0.43 -0.07 0.87 0.00 0.00 0.00 179.25 179.73 1dvv h LYS 76 N -0.43 0.00 0.00 0.00 1.57 -1.48 -1.72 116.57 114.51 1dvv h LYS 76 Ca -0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 1dvv h LYS 76 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1dvv h LYS 76 CO 0.02 0.07 -0.36 2.35 -0.57 0.00 0.00 179.45 180.96 1dvv h TRP 77 N 0.00 0.00 0.00 -1.35 7.01 -0.35 -2.94 115.95 118.32 1dvv h TRP 77 Ca -0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1dvv h TRP 77 Cb 0.39 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.45 1dvv h TRP 77 CO 0.00 0.36 -0.19 0.82 -2.79 0.00 0.00 178.44 176.65 1dvv h ILE 78 N 0.00 0.00 -0.90 2.65 2.04 -0.27 0.26 117.51 121.29 1dvv h ILE 78 Ca -0.00 -0.87 0.19 0.00 1.00 0.00 0.00 64.86 65.18 1dvv h ILE 78 Cb 1.18 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.15 1dvv h ILE 78 CO 0.05 0.00 0.44 -0.07 0.00 0.00 0.00 178.15 178.57 1dvv h LEU 79 N -0.87 0.47 0.14 1.44 3.38 -1.61 -2.34 115.31 115.91 1dvv h LEU 79 Ca 0.00 0.13 -0.31 0.00 0.09 0.00 0.00 57.88 57.79 1dvv h LEU 79 Cb 0.19 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1dvv h LEU 79 CO 0.00 0.11 -1.60 0.28 0.09 0.00 0.00 178.44 177.32 1dvv h SER 80 N 0.52 0.45 0.00 -0.43 0.02 -1.68 -3.45 113.55 108.98 1dvv h SER 80 Ca 0.54 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1dvv h SER 80 Cb 0.92 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1dvv h SER 80 CO -0.45 1.70 0.00 0.00 -1.14 0.00 0.00 176.83 176.94 1dvv n GLN 81 N -3.78 0.00 0.00 3.45 1.13 0.90 -5.00 117.38 114.08 1dvv n GLN 81 Ca -0.26 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.80 1dvv n GLN 81 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.32 1dvv n GLN 81 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79