#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 5.88 0.34 4.31 2.15 -1.26 -4.90 116.67 123.19 1dvv s ASP 2 Ca 0.00 1.66 0.23 0.00 0.43 0.00 0.00 52.55 54.87 1dvv s ASP 2 Cb 0.00 -2.51 1.23 0.00 -0.30 0.00 0.00 42.92 41.34 1dvv s ASP 2 CO 0.00 -1.10 1.71 1.55 -0.17 0.00 0.00 175.17 177.16 1dvv h PRO 3 N 0.09 0.00 0.02 4.34 0.13 -2.00 -0.64 132.00 133.95 1dvv h PRO 3 Ca -0.46 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.46 1dvv h PRO 3 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1dvv h PRO 3 CO 0.59 0.00 -0.94 1.49 -0.23 0.00 0.00 178.00 178.90 1dvv h GLU 4 N 0.00 0.20 -0.08 0.86 4.81 -1.97 -1.39 114.58 117.01 1dvv h GLU 4 Ca 0.00 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 1dvv h GLU 4 Cb 0.04 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 1dvv h GLU 4 CO 0.00 1.00 -0.00 0.28 -0.73 0.00 0.00 179.01 179.56 1dvv h VAL 5 N 0.10 1.26 -0.02 0.32 2.07 -1.47 -2.31 116.25 116.19 1dvv h VAL 5 Ca -0.06 -0.81 -0.10 0.00 0.82 0.00 0.00 66.70 66.56 1dvv h VAL 5 Cb 1.60 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 1dvv h VAL 5 CO 0.15 0.22 -0.46 0.17 0.02 0.00 0.00 177.57 177.67 1dvv h LEU 6 N -0.16 0.06 0.41 2.57 8.10 -1.61 -2.79 115.31 121.89 1dvv h LEU 6 Ca 0.02 -0.03 -0.01 0.00 0.11 0.00 0.00 57.88 57.97 1dvv h LEU 6 Cb 0.35 -0.02 -0.01 0.00 -0.44 0.00 0.00 40.66 40.55 1dvv h LEU 6 CO 0.00 0.51 -0.28 0.00 -4.11 0.00 0.00 178.44 174.57 1dvv h ALA 7 N 1.49 -0.67 -0.68 0.17 0.00 -1.01 -1.90 119.26 116.65 1dvv h ALA 7 Ca -0.00 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1dvv h ALA 7 Cb 0.83 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 1dvv h ALA 7 CO 0.06 -0.90 0.39 -0.22 0.00 0.00 0.00 179.25 178.59 1dvv h LYS 8 N -0.67 0.71 -0.46 0.00 3.11 -1.37 0.21 116.57 118.10 1dvv h LYS 8 Ca -0.04 -0.04 0.13 0.00 -2.81 0.00 0.00 60.65 57.89 1dvv h LYS 8 Cb 0.57 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.62 1dvv h LYS 8 CO 0.02 0.47 0.34 -0.91 -2.81 0.00 0.00 179.45 176.56 1dvv h ASN 9 N 0.73 0.00 0.82 4.20 -0.26 -1.17 0.57 115.58 120.47 1dvv h ASN 9 Ca 0.30 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.97 1dvv h ASN 9 Cb 0.16 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1dvv h ASN 9 CO -0.17 0.00 -1.23 0.29 -1.06 0.00 0.00 177.43 175.26 1dvv n LYS 10 N -4.31 0.61 0.00 0.81 4.76 -0.12 -4.95 118.16 114.96 1dvv n LYS 10 Ca 0.08 0.14 0.00 0.00 -2.87 0.00 0.00 58.31 55.67 1dvv n LYS 10 Cb 0.55 -1.80 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 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 1.27 1.09 0.26 0.72 0.00 0.19 -4.99 105.19 103.75 1dvv n GLY 11 Ca -0.04 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.93 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 -4.17 1.17 0.02 0.00 2.81 -1.26 -2.77 117.12 112.92 1dvv n MET 13 Ca 0.01 -0.26 -0.21 0.00 -1.81 0.00 0.00 57.70 55.42 1dvv n MET 13 Cb 0.36 -1.20 -0.14 0.00 -0.71 0.00 0.00 33.22 31.53 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 3.44 0.12 0.00 3.04 0.00 -1.77 -3.39 119.26 120.71 1dvv h ALA 14 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.90 1dvv h ALA 14 Cb 0.11 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1dvv h ALA 14 CO 0.00 0.74 -1.73 0.00 0.00 0.00 0.00 179.25 178.26 1dvv s HIS 16 N -3.28 2.95 -0.13 0.00 4.02 -1.11 -1.53 115.29 116.20 1dvv s HIS 16 Ca -0.05 -0.32 -0.05 0.00 1.02 0.00 0.00 55.06 55.67 1dvv s HIS 16 Cb 0.13 -2.14 0.06 0.00 -1.02 0.00 0.00 32.58 29.61 1dvv s HIS 16 CO 0.83 -0.17 0.27 0.00 1.02 0.00 0.00 174.74 176.69 1dvv s ALA 17 N -2.28 -0.61 0.51 -1.40 0.00 -1.26 -4.75 121.76 111.98 1dvv s ALA 17 Ca 0.49 1.00 0.35 0.00 0.00 0.00 0.00 51.96 53.81 1dvv s ALA 17 Cb -0.09 -0.94 1.21 0.00 0.00 0.00 0.00 23.12 23.31 1dvv s ALA 17 CO 0.31 -0.53 1.27 -0.89 0.00 0.00 0.00 175.76 175.92 1dvv n ILE 18 N 5.04 0.00 0.00 0.00 -0.00 -1.26 -0.95 119.36 122.19 1dvv n ILE 18 Ca -0.12 1.22 0.00 0.00 -0.00 0.00 0.00 62.75 63.85 1dvv n ILE 18 Cb 0.51 -2.09 0.00 0.00 -0.00 0.00 0.00 39.64 38.05 1dvv n ILE 18 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 1dvv n ASP 19 N -3.39 0.00 -4.77 4.38 9.92 -1.26 -1.91 116.55 119.52 1dvv n ASP 19 Ca 0.31 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 54.24 1dvv n ASP 19 Cb 1.59 0.00 0.04 0.00 -0.64 0.00 0.00 41.12 42.12 1dvv n ASP 19 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1dvv s THR 20 N -1.00 3.22 -0.24 -3.53 -4.23 -1.24 -4.59 115.64 104.03 1dvv s THR 20 Ca 0.00 0.58 -0.14 0.00 -1.18 0.00 0.00 61.69 60.96 1dvv s THR 20 Cb 0.00 -3.11 -0.04 0.00 1.34 0.00 0.00 72.50 70.69 1dvv s THR 20 CO 0.00 -0.33 0.32 -0.54 -0.54 0.00 0.00 174.62 173.52 1dvv s LYS 21 N -4.02 4.07 0.00 3.99 3.01 -1.26 -4.09 119.74 121.44 1dvv s LYS 21 Ca 0.68 -0.01 0.00 0.00 -1.01 0.00 0.00 55.97 55.62 1dvv s LYS 21 Cb -0.21 -3.59 0.00 0.00 -1.01 0.00 0.00 37.83 33.02 1dvv s LYS 21 CO 0.40 -0.12 0.00 -1.33 0.51 0.00 0.00 175.35 174.81 1dvv n MET 22 N 4.81 0.00 -0.05 1.68 2.81 -1.26 -5.00 117.12 120.11 1dvv n MET 22 Ca -0.10 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.63 1dvv n MET 22 Cb 0.51 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 32.88 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 1.61 -4.70 2.03 0.31 -0.58 -4.98 118.33 112.01 1dvv n VAL 23 Ca 0.00 -0.70 -0.31 0.00 -0.01 0.00 0.00 64.34 63.32 1dvv n VAL 23 Cb 0.00 -1.31 -0.08 0.00 -0.91 0.00 0.00 33.84 31.54 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 -5.71 2.93 0.18 2.92 0.00 -0.60 -5.00 107.32 102.04 1dvv s GLY 24 Ca -0.20 -0.60 -0.30 0.00 0.00 0.00 0.00 44.72 43.61 1dvv s GLY 24 CO 0.75 -2.12 1.34 2.56 0.00 0.00 0.00 173.10 175.63 1dvv s PRO 25 N -3.83 4.36 0.56 2.90 0.05 -1.26 -4.70 135.00 133.08 1dvv s PRO 25 Ca 0.10 2.07 -0.18 0.00 0.05 0.00 0.00 61.00 63.05 1dvv s PRO 25 Cb 0.02 -3.20 -0.13 0.00 0.05 0.00 0.00 34.50 31.23 1dvv s PRO 25 CO 0.06 -0.31 -0.01 0.00 0.05 0.00 0.00 177.00 176.79 1dvv n ALA 26 N 2.98 -2.78 0.37 8.56 0.00 -1.26 -4.61 120.51 123.77 1dvv n ALA 26 Ca 0.08 -0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.24 1dvv n ALA 26 Cb 0.42 -1.50 -0.09 0.00 0.00 0.00 0.00 19.45 18.29 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 -0.05 -0.85 -0.49 0.00 0.05 -1.12 -1.16 116.97 113.35 1dvv h TYR 27 Ca -0.42 -0.02 0.10 0.00 0.05 0.00 0.00 58.73 58.44 1dvv h TYR 27 Cb 1.42 0.28 -0.09 0.00 1.01 0.00 0.00 36.73 39.35 1dvv h TYR 27 CO 0.25 -0.52 -0.11 -0.22 -1.05 0.00 0.00 178.16 176.52 1dvv h LYS 28 N -0.95 0.01 -0.89 4.88 3.11 -1.50 0.11 116.57 121.34 1dvv h LYS 28 Ca -0.09 -0.00 0.13 0.00 -2.81 0.00 0.00 60.65 57.88 1dvv h LYS 28 Cb 0.71 -0.00 -0.09 0.00 -1.00 0.00 0.00 32.23 31.85 1dvv h LYS 28 CO 0.15 0.01 0.50 -0.44 -2.81 0.00 0.00 179.45 176.87 1dvv h ASP 29 N 0.01 0.67 -0.83 4.20 3.32 -1.74 -0.23 116.42 121.82 1dvv h ASP 29 Ca 0.24 0.07 0.12 0.00 0.02 0.00 0.00 57.03 57.48 1dvv h ASP 29 Cb 0.37 -0.05 -0.08 0.00 0.22 0.00 0.00 39.33 39.79 1dvv h ASP 29 CO -0.50 0.32 0.46 0.58 -1.72 0.00 0.00 179.24 178.38 1dvv h VAL 30 N 0.75 0.84 0.00 -1.35 2.07 0.51 0.20 116.25 119.26 1dvv h VAL 30 Ca 0.47 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.69 1dvv h VAL 30 Cb 0.57 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1dvv h VAL 30 CO -0.32 0.13 -0.23 0.00 0.02 0.00 0.00 177.57 177.17 1dvv h ALA 31 N 1.50 0.96 -0.24 1.67 0.00 -0.76 -2.49 119.26 119.89 1dvv h ALA 31 Ca 0.42 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1dvv h ALA 31 Cb 0.48 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1dvv h ALA 31 CO -0.29 0.29 -0.22 0.00 0.00 0.00 0.00 179.25 179.03 1dvv h ALA 32 N 1.77 1.19 0.00 0.00 0.00 0.36 0.16 119.26 122.74 1dvv h ALA 32 Ca -0.00 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 1dvv h ALA 32 Cb 0.86 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1dvv h ALA 32 CO 0.03 0.52 -0.89 -0.22 0.00 0.00 0.00 179.25 178.69 1dvv h LYS 33 N 0.39 0.00 0.00 0.00 3.64 -1.34 -3.33 116.57 115.94 1dvv h LYS 33 Ca 0.06 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1dvv h LYS 33 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1dvv h LYS 33 CO 0.04 1.00 0.00 0.66 -2.27 0.00 0.00 179.45 178.88 1dvv n TYR 34 N -4.48 0.00 -1.69 1.91 4.01 -0.95 -4.82 117.16 111.13 1dvv n TYR 34 Ca -0.26 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.05 1dvv n TYR 34 Cb 0.62 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.62 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 -0.94 2.20 0.00 -0.72 0.00 0.58 -3.17 120.51 118.46 1dvv n ALA 35 Ca 0.17 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.96 1dvv n ALA 35 Cb 0.08 -2.54 0.00 0.00 0.00 0.00 0.00 19.45 16.99 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 4.08 1.92 3.43 0.00 0.00 -1.26 -5.03 105.19 108.32 1dvv n GLY 36 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.55 2.52 -0.32 1.61 -1.52 -1.19 -5.01 119.66 115.19 1dvv s GLN 37 Ca 0.00 -0.75 -0.01 0.00 -1.95 0.00 0.00 55.36 52.65 1dvv s GLN 37 Cb 0.00 -2.33 0.19 0.00 -0.22 0.00 0.00 33.01 30.65 1dvv s GLN 37 CO 0.00 0.56 2.12 0.00 -0.25 0.00 0.00 175.29 177.72 1dvv n ALA 38 N 2.48 5.26 0.00 6.09 0.00 -1.26 -4.29 120.51 128.78 1dvv n ALA 38 Ca -0.17 -1.78 0.00 0.00 0.00 0.00 0.00 53.44 51.49 1dvv n ALA 38 Cb 0.52 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.44 -0.69 0.11 0.00 0.00 -1.26 -5.04 105.19 98.75 1dvv n GLY 39 Ca 0.32 0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.62 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 0.64 -0.01 4.61 0.00 -1.94 -3.32 119.26 119.25 1dvv h ALA 40 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.71 1dvv h ALA 40 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1dvv h ALA 40 CO 0.00 0.00 -0.87 0.93 0.00 0.00 0.00 179.25 179.31 1dvv h GLU 41 N 0.00 0.27 0.05 0.00 5.08 -1.94 -0.14 114.58 117.89 1dvv h GLU 41 Ca 0.00 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1dvv h GLU 41 Cb 0.86 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1dvv h GLU 41 CO 0.00 0.98 -0.02 0.00 -1.00 0.00 0.00 179.01 178.97 1dvv h ALA 42 N 0.92 -0.06 -0.05 3.43 0.00 -1.93 0.11 119.26 121.67 1dvv h ALA 42 Ca -0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 1dvv h ALA 42 Cb 1.49 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1dvv h ALA 42 CO 0.14 -0.38 -0.53 -0.92 0.00 0.00 0.00 179.25 177.56 1dvv h TYR 43 N -0.37 0.19 0.00 0.00 3.20 -1.66 -1.83 116.97 116.49 1dvv h TYR 43 Ca -0.01 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.75 1dvv h TYR 43 Cb 0.34 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1dvv h TYR 43 CO 0.03 0.65 -0.26 -0.07 -1.64 0.00 0.00 178.16 176.87 1dvv h LEU 44 N 0.12 0.00 -0.30 2.82 3.38 -0.86 -1.59 115.31 118.88 1dvv h LEU 44 Ca 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 1dvv h LEU 44 Cb 0.97 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1dvv h LEU 44 CO 0.08 0.26 -0.86 0.00 0.09 0.00 0.00 178.44 178.01 1dvv h ALA 45 N 1.74 0.52 -0.02 1.53 0.00 0.04 -0.98 119.26 122.09 1dvv h ALA 45 Ca -0.00 -0.70 -0.22 0.00 0.00 0.00 0.00 54.91 53.98 1dvv h ALA 45 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1dvv h ALA 45 CO 0.03 0.88 -0.91 1.96 0.00 0.00 0.00 179.25 181.21 1dvv h GLN 46 N 0.14 0.47 0.00 0.00 4.20 -0.88 -2.24 115.11 116.80 1dvv h GLN 46 Ca -0.05 -0.47 0.00 0.00 0.06 0.00 0.00 58.65 58.19 1dvv h GLN 46 Cb 1.48 0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.39 1dvv h GLN 46 CO 0.14 1.12 -0.17 0.00 -0.67 0.00 0.00 178.83 179.24 1dvv h ARG 47 N 0.28 0.00 0.00 1.46 2.47 -1.33 -2.85 114.38 114.40 1dvv h ARG 47 Ca -0.08 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.40 1dvv h ARG 47 Cb 1.54 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.82 1dvv h ARG 47 CO 0.16 0.00 -1.38 0.82 0.56 0.00 0.00 179.97 180.13 1dvv h ILE 48 N 0.00 1.16 0.00 2.04 2.04 -1.10 1.08 117.51 122.73 1dvv h ILE 48 Ca 0.00 -2.92 0.00 0.00 1.00 0.00 0.00 64.86 62.94 1dvv h ILE 48 Cb 0.79 2.56 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 1dvv h ILE 48 CO 0.00 0.66 -0.43 0.50 0.00 0.00 0.00 178.15 178.88 1dvv h LYS 49 N 0.00 0.00 0.00 2.37 3.64 -1.41 -3.29 116.57 117.88 1dvv h LYS 49 Ca -0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1dvv h LYS 49 Cb 1.88 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.70 1dvv h LYS 49 CO 0.10 0.00 0.00 -1.71 -2.27 0.00 0.00 179.45 175.57 1dvv n ASN 50 N -2.58 0.66 -0.66 4.20 5.15 -1.08 -3.62 115.26 117.32 1dvv n ASN 50 Ca 0.03 -1.00 0.04 0.00 -0.60 0.00 0.00 54.58 53.06 1dvv n ASN 50 Cb 0.49 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.74 1dvv n ASN 50 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dvv n GLY 51 N 0.00 -0.73 0.00 8.20 0.00 0.37 -4.03 105.19 109.01 1dvv n GLY 51 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1dvv n GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dvv n SER 52 N -3.79 0.00 -0.96 1.61 3.41 -0.70 -4.80 113.62 108.39 1dvv n SER 52 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1dvv n SER 52 Cb 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1dvv n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dvv n GLN 53 N -0.63 2.34 -1.33 4.33 10.64 -1.26 -1.21 117.38 130.26 1dvv n GLN 53 Ca 0.00 0.00 -0.13 0.00 -1.83 0.00 0.00 57.00 55.04 1dvv n GLN 53 Cb 0.00 0.00 -0.05 0.00 -0.86 0.00 0.00 30.24 29.33 1dvv n GLN 53 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1dvv n GLY 54 N 5.00 1.20 0.01 2.61 0.00 -1.23 -4.79 105.19 107.99 1dvv n GLY 54 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.87 0.11 -0.06 1.61 0.31 -1.26 -4.87 118.33 112.30 1dvv n VAL 55 Ca -0.13 0.48 -0.08 0.00 -0.01 0.00 0.00 64.34 64.60 1dvv n VAL 55 Cb 0.45 -1.57 -0.06 0.00 -0.91 0.00 0.00 33.84 31.75 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 -2.53 0.00 -3.52 3.52 7.02 -1.26 -5.09 117.44 115.57 1dvv n TRP 56 Ca -0.01 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.43 1dvv n TRP 56 Cb 0.03 -0.48 0.00 0.00 -2.42 0.00 0.00 31.31 28.44 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 2.86 2.09 0.00 6.99 0.00 -1.26 -5.00 105.19 110.87 1dvv n GLY 57 Ca -0.21 -1.28 0.01 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.23 0.50 -3.55 1.61 -0.05 -1.26 -3.50 135.00 128.53 1dvv n PRO 58 Ca -0.02 0.00 -0.39 0.00 -0.05 0.00 0.00 63.50 63.04 1dvv n PRO 58 Cb 0.24 -1.09 -0.05 0.00 -0.05 0.00 0.00 33.50 32.55 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 4.79 0.50 0.52 1.01 -1.26 -4.91 121.20 119.85 1dvv s ILE 59 Ca 0.04 -3.53 -0.22 0.00 0.00 0.00 0.00 60.65 56.94 1dvv s ILE 59 Cb 0.02 -3.96 -0.08 0.00 0.01 0.00 0.00 42.46 38.46 1dvv s ILE 59 CO 0.03 -1.08 1.10 -2.65 0.00 0.00 0.00 174.94 172.35 1dvv n PRO 60 N 2.70 1.39 -2.47 2.79 -0.01 -1.26 -4.89 135.00 133.25 1dvv n PRO 60 Ca 0.20 0.51 -0.42 0.00 -0.01 0.00 0.00 63.50 63.78 1dvv n PRO 60 Cb 0.38 -2.24 -0.03 0.00 -0.01 0.00 0.00 33.50 31.60 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 -2.41 4.50 0.11 -0.52 1.75 -0.35 -4.74 119.30 117.65 1dvv s MET 61 Ca 0.68 1.73 -0.31 0.00 -1.25 0.00 0.00 55.69 56.54 1dvv s MET 61 Cb -0.48 -3.32 -0.08 0.00 2.84 0.00 0.00 34.83 33.78 1dvv s MET 61 CO 0.53 -0.11 1.46 -1.25 -0.65 0.00 0.00 175.02 175.00 1dvv s PRO 62 N 0.45 4.28 0.24 4.11 0.05 -1.26 -1.71 135.00 141.16 1dvv s PRO 62 Ca 0.54 2.16 -0.31 0.00 0.05 0.00 0.00 61.00 63.45 1dvv s PRO 62 Cb -0.29 -3.28 -0.13 0.00 0.05 0.00 0.00 34.50 30.85 1dvv s PRO 62 CO 0.32 -0.52 1.51 -0.35 0.05 0.00 0.00 177.00 178.01 1dvv n PRO 63 N 4.23 2.31 -3.10 0.56 -0.04 -1.26 -4.54 135.00 133.16 1dvv n PRO 63 Ca 0.13 0.82 -0.19 0.00 -0.04 0.00 0.00 63.50 64.22 1dvv n PRO 63 Cb 0.41 -2.55 0.02 0.00 -0.04 0.00 0.00 33.50 31.35 1dvv n PRO 63 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1dvv n ASN 64 N 2.44 2.16 -2.09 3.54 3.02 -1.24 -4.90 115.26 118.20 1dvv n ASN 64 Ca 0.12 -2.44 -0.26 0.00 -0.03 0.00 0.00 54.58 51.97 1dvv n ASN 64 Cb 0.33 -0.16 0.12 0.00 -0.61 0.00 0.00 39.78 39.46 1dvv n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dvv n ALA 65 N -2.22 5.67 -2.74 5.41 0.00 -1.26 -4.72 120.51 120.66 1dvv n ALA 65 Ca -0.13 -3.29 -0.43 0.00 0.00 0.00 0.00 53.44 49.59 1dvv n ALA 65 Cb 0.51 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.56 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 -4.10 4.35 0.86 0.00 -7.23 -1.26 -5.01 120.40 108.01 1dvv s VAL 66 Ca 0.58 -0.01 -0.16 0.00 -1.81 0.00 0.00 61.98 60.58 1dvv s VAL 66 Cb 0.47 -4.61 -0.10 0.00 0.56 0.00 0.00 36.38 32.70 1dvv s VAL 66 CO 0.03 -1.28 -0.29 -0.24 -0.31 0.00 0.00 175.10 173.02 1dvv n SER 67 N 7.60 -4.27 -0.31 4.85 2.88 -1.26 -3.94 113.62 119.17 1dvv n SER 67 Ca -0.01 0.35 0.09 0.00 -1.33 0.00 0.00 58.87 57.98 1dvv n SER 67 Cb 0.47 -0.91 0.21 0.00 -0.75 0.00 0.00 64.21 63.22 1dvv n SER 67 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1dvv h ASP 68 N -0.81 -0.49 -0.87 -3.46 3.32 -1.95 0.54 116.42 112.69 1dvv h ASP 68 Ca -0.44 0.25 0.02 0.00 0.02 0.00 0.00 57.03 56.89 1dvv h ASP 68 Cb 1.33 0.45 -0.05 0.00 0.22 0.00 0.00 39.33 41.28 1dvv h ASP 68 CO 0.31 -0.28 0.57 -0.78 -1.72 0.00 0.00 179.24 177.34 1dvv h ASP 69 N 0.05 0.96 -0.54 6.45 3.58 -1.97 -1.64 116.42 123.31 1dvv h ASP 69 Ca 0.51 -0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.85 1dvv h ASP 69 Cb 0.95 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.75 1dvv h ASP 69 CO -0.83 0.67 0.00 -0.33 -2.88 0.00 0.00 179.24 175.87 1dvv h GLU 70 N 1.13 0.98 0.00 0.28 5.08 -0.21 -2.03 114.58 119.81 1dvv h GLU 70 Ca 0.34 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1dvv h GLU 70 Cb -0.05 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.11 1dvv h GLU 70 CO -0.10 0.97 0.00 0.00 -1.00 0.00 0.00 179.01 178.88 1dvv h ALA 71 N 1.09 1.00 -0.02 3.43 0.00 -0.72 -1.13 119.26 122.91 1dvv h ALA 71 Ca 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1dvv h ALA 71 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1dvv h ALA 71 CO 0.03 0.00 -0.07 0.37 0.00 0.00 0.00 179.25 179.58 1dvv h GLN 72 N 0.00 0.08 0.00 0.00 4.15 -0.59 -0.81 115.11 117.94 1dvv h GLN 72 Ca 0.00 -0.06 -0.07 0.00 0.77 0.00 0.00 58.65 59.29 1dvv h GLN 72 Cb 0.52 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 1dvv h GLN 72 CO 0.00 0.71 -0.33 1.15 -1.93 0.00 0.00 178.83 178.44 1dvv h THR 73 N -0.54 1.03 -0.25 2.39 2.02 -1.33 -2.10 112.91 114.13 1dvv h THR 73 Ca -0.00 -1.20 -0.13 0.00 0.77 0.00 0.00 66.41 65.84 1dvv h THR 73 Cb 0.73 1.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.82 1dvv h THR 73 CO 0.01 0.32 -0.40 -0.07 0.37 0.00 0.00 175.52 175.75 1dvv h LEU 74 N 0.00 0.62 0.22 2.58 3.38 -1.10 -0.47 115.31 120.54 1dvv h LEU 74 Ca -0.00 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1dvv h LEU 74 Cb 0.66 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1dvv h LEU 74 CO 0.04 0.96 -0.10 0.00 0.09 0.00 0.00 178.44 179.42 1dvv h ALA 75 N 1.07 -0.29 0.00 1.53 0.00 -0.50 -1.77 119.26 119.30 1dvv h ALA 75 Ca 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1dvv h ALA 75 Cb 0.91 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1dvv h ALA 75 CO 0.08 -0.48 -0.04 0.87 0.00 0.00 0.00 179.25 179.68 1dvv h LYS 76 N -0.67 0.00 -0.13 0.00 1.57 -1.41 -0.91 116.57 115.01 1dvv h LYS 76 Ca -0.03 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 1dvv h LYS 76 Cb 0.47 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1dvv h LYS 76 CO 0.05 0.04 -0.62 2.35 -0.57 0.00 0.00 179.45 180.70 1dvv h TRP 77 N 0.00 0.60 -0.06 -1.35 7.01 -0.73 -2.24 115.95 119.18 1dvv h TRP 77 Ca -0.00 -0.23 -0.24 0.00 2.11 0.00 0.00 58.89 60.53 1dvv h TRP 77 Cb 0.13 -0.11 0.01 0.00 -2.10 0.00 0.00 29.16 27.10 1dvv h TRP 77 CO 0.00 0.96 -0.91 0.82 -2.79 0.00 0.00 178.44 176.52 1dvv h ILE 78 N 0.35 1.30 0.00 2.65 2.04 -0.30 -2.96 117.51 120.58 1dvv h ILE 78 Ca -0.01 -2.16 0.00 0.00 1.00 0.00 0.00 64.86 63.69 1dvv h ILE 78 Cb 1.16 2.22 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 1dvv h ILE 78 CO 0.11 0.67 0.00 0.18 0.00 0.00 0.00 178.15 179.11 1dvv n LEU 79 N -3.87 0.31 0.04 1.44 4.77 -0.82 -2.87 117.00 116.00 1dvv n LEU 79 Ca -0.09 0.55 0.03 0.00 -0.03 0.00 0.00 56.01 56.48 1dvv n LEU 79 Cb 0.81 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 41.34 1dvv n LEU 79 CO 0.54 -0.25 -0.32 -1.54 -1.33 0.00 0.00 177.39 174.48 1dvv n SER 80 N -1.81 0.73 -4.68 -1.43 3.41 -0.85 -4.89 113.62 104.10 1dvv n SER 80 Ca 0.04 0.31 -0.46 0.00 -0.26 0.00 0.00 58.87 58.50 1dvv n SER 80 Cb 0.27 0.44 -0.04 0.00 -0.26 0.00 0.00 64.21 64.62 1dvv n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dvv n GLN 81 N -2.78 2.24 0.00 4.33 1.13 -1.13 -5.03 117.38 116.15 1dvv n GLN 81 Ca -0.09 0.81 0.00 0.00 -1.94 0.00 0.00 57.00 55.79 1dvv n GLN 81 Cb 0.77 -2.63 0.00 0.00 0.11 0.00 0.00 30.24 28.49 1dvv n GLN 81 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79