#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvd s ILE 7 N 0.00 2.86 0.00 1.12 -1.09 -1.26 -4.99 121.20 117.84 1dvd s ILE 7 Ca 0.00 0.83 0.00 0.00 -2.23 0.00 0.00 60.65 59.25 1dvd s ILE 7 Cb 0.00 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 1dvd s ILE 7 CO 0.00 0.18 0.01 -0.81 -1.23 0.00 0.00 174.94 173.09 1dvd n PRO 8 N 1.21 0.00 -0.05 2.79 -0.04 -1.26 -4.97 135.00 132.68 1dvd n PRO 8 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1dvd n PRO 8 Cb 0.42 -0.23 0.00 0.00 -0.04 0.00 0.00 33.50 33.65 1dvd n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dvd n GLY 9 N 2.65 0.45 0.00 0.55 0.00 -1.26 -4.87 105.19 102.71 1dvd n GLY 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1dvd n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dvd n GLY 10 N -2.00 -1.17 3.78 -0.02 0.00 -1.26 -4.60 105.19 99.92 1dvd n GLY 10 Ca 0.00 -1.59 -0.27 0.00 0.00 0.00 0.00 46.02 44.16 1dvd n GLY 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dvd n LEU 11 N 0.00 -1.85 0.00 0.99 4.77 -0.57 -4.92 117.00 115.42 1dvd n LEU 11 Ca 0.00 -0.90 -0.14 0.00 -0.03 0.00 0.00 56.01 54.94 1dvd n LEU 11 Cb 0.00 -1.59 0.03 0.00 -2.33 0.00 0.00 43.42 39.53 1dvd n LEU 11 CO 0.00 0.37 0.18 -0.24 -1.33 0.00 0.00 177.39 176.37 1dvd n SER 12 N -2.37 1.64 -3.47 -1.43 2.88 -1.26 -5.01 113.62 104.60 1dvd n SER 12 Ca -0.30 -2.09 -0.16 0.00 -1.33 0.00 0.00 58.87 54.99 1dvd n SER 12 Cb 0.70 -0.20 0.15 0.00 -0.75 0.00 0.00 64.21 64.11 1dvd n SER 12 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1dvd n GLU 13 N -1.67 -1.57 -2.62 -1.46 2.13 -1.26 -4.77 120.64 109.42 1dvd n GLU 13 Ca 0.07 -0.75 -0.42 0.00 0.66 0.00 0.00 57.16 56.72 1dvd n GLU 13 Cb 0.40 -1.46 -0.03 0.00 0.27 0.00 0.00 31.44 30.63 1dvd n GLU 13 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1dvd s ALA 14 N -2.06 2.98 0.13 4.31 0.00 -1.26 -4.69 121.76 121.18 1dvd s ALA 14 Ca 0.35 -1.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.01 1dvd s ALA 14 Cb -0.06 -4.03 -0.07 0.00 0.00 0.00 0.00 23.12 18.96 1dvd s ALA 14 CO 0.29 -2.73 1.14 0.15 0.00 0.00 0.00 175.76 174.61 1dvd s LYS 15 N 4.92 4.52 0.14 0.00 -0.14 -0.79 -4.73 119.74 123.66 1dvd s LYS 15 Ca 0.39 1.75 -0.31 0.00 -1.36 0.00 0.00 55.97 56.44 1dvd s LYS 15 Cb -0.08 -3.30 -0.09 0.00 -1.68 0.00 0.00 37.83 32.68 1dvd s LYS 15 CO 0.22 -0.07 1.45 -1.25 -0.76 0.00 0.00 175.35 174.94 1dvd s PRO 16 N 0.20 4.29 1.01 -1.68 0.04 -1.26 -0.45 135.00 137.15 1dvd s PRO 16 Ca 0.53 2.17 -0.25 0.00 0.04 0.00 0.00 61.00 63.49 1dvd s PRO 16 Cb -0.30 -3.21 -0.17 0.00 0.04 0.00 0.00 34.50 30.86 1dvd s PRO 16 CO 0.33 -0.49 -1.29 0.00 0.04 0.00 0.00 177.00 175.59 1dvd n ALA 17 N 3.89 -5.62 -3.00 8.56 0.00 -0.52 -4.80 120.51 119.02 1dvd n ALA 17 Ca 0.12 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.32 1dvd n ALA 17 Cb 0.41 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1dvd n ALA 17 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1dvd n THR 18 N -3.35 0.00 0.30 0.00 -2.24 -1.26 -4.94 114.28 102.78 1dvd n THR 18 Ca -0.02 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.91 1dvd n THR 18 Cb 0.71 0.00 0.51 0.00 -2.10 0.00 0.00 70.33 69.45 1dvd n THR 18 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1dvd h PRO 19 N 0.00 0.00 0.09 -0.78 0.13 -1.97 -1.35 132.00 128.12 1dvd h PRO 19 Ca 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.94 1dvd h PRO 19 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1dvd h PRO 19 CO 0.00 0.00 -0.92 0.93 -0.23 0.00 0.00 178.00 177.78 1dvd h GLU 20 N 0.00 0.19 0.28 0.86 4.39 -1.98 -1.73 114.58 116.60 1dvd h GLU 20 Ca 0.00 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.37 1dvd h GLU 20 Cb 0.64 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 1dvd h GLU 20 CO 0.00 1.16 -0.22 0.82 -1.16 0.00 0.00 179.01 179.60 1dvd h ILE 21 N -0.54 0.53 -0.02 3.13 1.08 -1.90 0.19 117.51 119.98 1dvd h ILE 21 Ca -0.20 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.28 1dvd h ILE 21 Cb 1.53 0.53 -0.00 0.00 -3.07 0.00 0.00 36.82 35.80 1dvd h ILE 21 CO 0.05 0.00 0.06 -0.61 -0.69 0.00 0.00 178.15 176.96 1dvd h GLN 22 N -0.51 0.00 -0.04 2.37 5.75 -1.36 -0.96 115.11 120.35 1dvd h GLN 22 Ca -0.02 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 58.26 1dvd h GLN 22 Cb 0.45 0.00 0.02 0.00 1.07 0.00 0.00 27.48 29.02 1dvd h GLN 22 CO -0.01 0.00 -0.84 1.49 -2.65 0.00 0.00 178.83 176.82 1dvd h GLU 23 N 0.00 0.64 0.00 1.69 4.81 0.28 0.39 114.58 122.40 1dvd h GLU 23 Ca 0.01 -0.63 -0.00 0.00 -0.13 0.00 0.00 59.36 58.60 1dvd h GLU 23 Cb 0.12 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.67 1dvd h GLU 23 CO -0.00 1.24 -0.00 0.82 -0.73 0.00 0.00 179.01 180.34 1dvd h ILE 24 N 0.29 1.02 -0.63 2.32 2.04 0.18 0.95 117.51 123.67 1dvd h ILE 24 Ca -0.09 -0.06 -0.07 0.00 1.00 0.00 0.00 64.86 65.64 1dvd h ILE 24 Cb 1.50 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 1dvd h ILE 24 CO 0.17 0.02 0.12 1.62 0.00 0.00 0.00 178.15 180.07 1dvd h VAL 25 N -0.03 1.26 0.00 1.67 3.04 -1.49 0.94 116.25 121.65 1dvd h VAL 25 Ca -0.00 -0.99 0.00 0.00 -1.01 0.00 0.00 66.70 64.70 1dvd h VAL 25 Cb 0.03 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 29.99 1dvd h VAL 25 CO 0.00 0.37 0.00 -0.67 -1.01 0.00 0.00 177.57 176.26 1dvd n ASP 26 N -4.28 0.48 0.00 3.17 -0.08 0.13 0.01 116.55 115.98 1dvd n ASP 26 Ca 0.04 0.61 0.11 0.00 -1.51 0.00 0.00 54.79 54.03 1dvd n ASP 26 Cb 0.27 -0.71 0.01 0.00 2.34 0.00 0.00 41.12 43.03 1dvd n ASP 26 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1dvd n LYS 27 N -2.02 0.08 0.00 -0.67 4.76 0.33 -4.26 118.16 116.38 1dvd n LYS 27 Ca 0.03 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1dvd n LYS 27 Cb 0.24 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 1dvd n LYS 27 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1dvd n VAL 28 N -1.62 0.00 -0.26 -0.18 0.24 -0.00 -4.74 118.33 111.77 1dvd n VAL 28 Ca 0.04 -0.45 0.07 0.00 -2.04 0.00 0.00 64.34 61.96 1dvd n VAL 28 Cb 0.36 1.05 0.21 0.00 -1.47 0.00 0.00 33.84 33.99 1dvd n VAL 28 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1dvd h LYS 29 N 0.00 0.23 -0.13 7.34 3.64 -0.60 0.27 116.57 127.32 1dvd h LYS 29 Ca 0.00 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.18 1dvd h LYS 29 Cb 0.03 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1dvd h LYS 29 CO 0.00 0.15 -0.69 -1.00 -2.27 0.00 0.00 179.45 175.64 1dvd h PRO 30 N 0.24 0.57 0.00 1.90 0.13 -1.86 -0.92 132.00 132.06 1dvd h PRO 30 Ca 0.45 -0.44 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1dvd h PRO 30 Cb 0.82 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1dvd h PRO 30 CO -0.57 1.06 0.00 1.04 -0.23 0.00 0.00 178.00 179.30 1dvd n GLN 31 N -3.90 0.15 -0.11 0.86 6.02 -0.01 -2.67 117.38 117.73 1dvd n GLN 31 Ca -0.05 0.16 -0.13 0.00 -0.01 0.00 0.00 57.00 56.96 1dvd n GLN 31 Cb 0.69 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 30.32 1dvd n GLN 31 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1dvd n LEU 32 N -1.37 1.45 -0.14 1.08 4.77 0.74 -3.26 117.00 120.28 1dvd n LEU 32 Ca 0.07 -0.07 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 1dvd n LEU 32 Cb 0.16 -0.18 0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1dvd n LEU 32 CO 0.14 0.69 0.84 -0.33 -1.33 0.00 0.00 177.39 177.41 1dvd h GLU 33 N 0.00 0.10 0.09 3.23 5.08 -0.96 -2.57 114.58 119.55 1dvd h GLU 33 Ca -0.54 -0.01 -0.26 0.00 -1.00 0.00 0.00 59.36 57.55 1dvd h GLU 33 Cb 2.03 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.25 1dvd h GLU 33 CO -0.03 0.06 -1.36 0.93 -1.00 0.00 0.00 179.01 177.61 1dvd h GLU 34 N 0.10 0.19 -1.20 2.33 3.07 -1.73 -1.52 114.58 115.82 1dvd h GLU 34 Ca 0.22 -0.33 0.35 0.00 -0.50 0.00 0.00 59.36 59.10 1dvd h GLU 34 Cb 0.32 0.12 -0.05 0.00 -0.84 0.00 0.00 28.75 28.31 1dvd h GLU 34 CO -0.38 1.16 1.12 0.87 -1.40 0.00 0.00 179.01 180.39 1dvd h LYS 35 N -0.42 0.00 0.00 2.33 1.79 -1.52 -3.10 116.57 115.65 1dvd h LYS 35 Ca -0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 1dvd h LYS 35 Cb 1.67 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.32 1dvd h LYS 35 CO 0.01 0.00 0.00 0.25 -1.08 0.00 0.00 179.45 178.63 1dvd n THR 36 N -3.59 0.00 0.00 -0.16 -2.24 -0.98 -5.06 114.28 102.26 1dvd n THR 36 Ca 0.27 0.29 0.00 0.00 -2.27 0.00 0.00 64.05 62.33 1dvd n THR 36 Cb 1.50 -1.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1dvd n THR 36 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1dvd n ASN 37 N -2.21 0.00 -2.65 3.42 0.23 -1.07 -5.12 115.26 107.86 1dvd n ASN 37 Ca 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 54.58 54.00 1dvd n ASN 37 Cb 0.00 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 37.72 1dvd n ASN 37 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1dvd n GLU 38 N 0.00 0.72 -4.44 -3.83 0.28 -0.60 -5.04 120.64 107.74 1dvd n GLU 38 Ca 0.00 -1.50 -0.33 0.00 -0.16 0.00 0.00 57.16 55.16 1dvd n GLU 38 Cb 0.00 1.94 -0.15 0.00 1.43 0.00 0.00 31.44 34.66 1dvd n GLU 38 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1dvd s THR 39 N -2.22 2.89 0.41 3.84 2.01 -1.26 -4.23 115.64 117.08 1dvd s THR 39 Ca 0.16 -0.69 0.08 0.00 0.31 0.00 0.00 61.69 61.55 1dvd s THR 39 Cb -0.03 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.23 1dvd s THR 39 CO 0.07 0.50 0.47 -0.31 -0.69 0.00 0.00 174.62 174.66 1dvd s TYR 40 N 0.85 2.79 0.00 4.92 1.51 -1.26 -5.07 117.35 121.09 1dvd s TYR 40 Ca -0.04 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.60 1dvd s TYR 40 Cb -0.15 -2.25 0.00 0.00 -0.11 0.00 0.00 41.96 39.45 1dvd s TYR 40 CO -0.00 -0.25 0.00 0.41 -1.11 0.00 0.00 175.55 174.60 1dvd n GLY 43 N -1.69 5.37 3.73 0.71 0.00 -1.26 -5.03 105.19 107.01 1dvd n GLY 43 Ca 0.05 -1.53 -0.64 0.00 0.00 0.00 0.00 46.02 43.90 1dvd n GLY 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dvd n LYS 44 N 0.00 0.43 -3.32 1.61 4.76 -1.26 -4.66 118.16 115.73 1dvd n LYS 44 Ca 0.00 0.16 -0.46 0.00 -2.87 0.00 0.00 58.31 55.14 1dvd n LYS 44 Cb 0.00 -1.73 -0.01 0.00 -1.84 0.00 0.00 35.03 31.45 1dvd n LYS 44 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1dvd s LEU 45 N 3.28 6.55 -1.02 -0.35 1.43 -1.25 -1.79 118.68 125.53 1dvd s LEU 45 Ca 1.03 -3.00 -0.26 0.00 -1.03 0.00 0.00 54.13 50.87 1dvd s LEU 45 Cb -1.34 -2.22 -0.20 0.00 0.03 0.00 0.00 46.19 42.47 1dvd s LEU 45 CO 0.76 -0.49 2.17 -0.70 0.23 0.00 0.00 176.35 178.32 1dvd s GLU 46 N -0.25 1.36 -0.35 1.70 -6.30 -0.58 -4.53 118.70 109.76 1dvd s GLU 46 Ca 0.23 -0.25 -0.40 0.00 -2.50 0.00 0.00 54.97 52.05 1dvd s GLU 46 Cb -0.10 -4.95 -0.15 0.00 0.00 0.00 0.00 34.13 28.93 1dvd s GLU 46 CO -0.09 -5.15 1.94 0.00 0.02 0.00 0.00 175.26 171.99 1dvd n ALA 47 N 19.10 0.23 -0.09 6.30 0.00 -1.26 -1.36 120.51 143.42 1dvd n ALA 47 Ca 0.43 0.22 -0.23 0.00 0.00 0.00 0.00 53.44 53.86 1dvd n ALA 47 Cb 0.46 -2.29 -0.12 0.00 0.00 0.00 0.00 19.45 17.50 1dvd n ALA 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1dvd n VAL 48 N 5.70 1.58 -4.11 0.00 0.31 -0.36 -4.33 118.33 117.12 1dvd n VAL 48 Ca 0.36 -0.34 -0.13 0.00 -0.01 0.00 0.00 64.34 64.22 1dvd n VAL 48 Cb 0.12 -1.84 -0.06 0.00 -0.91 0.00 0.00 33.84 31.15 1dvd n VAL 48 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1dvd s GLN 49 N -2.47 1.59 -0.28 5.55 -0.21 -1.09 -1.44 119.66 121.31 1dvd s GLN 49 Ca -0.31 -1.59 -0.23 0.00 0.02 0.00 0.00 55.36 53.25 1dvd s GLN 49 Cb 0.09 0.39 0.13 0.00 1.00 0.00 0.00 33.01 34.62 1dvd s GLN 49 CO 0.61 -0.62 1.03 1.52 -2.12 0.00 0.00 175.29 175.70 1dvd s TYR 50 N -3.69 -0.49 -0.17 0.91 1.13 0.41 -0.87 117.35 114.58 1dvd s TYR 50 Ca 0.31 1.15 -0.06 0.00 -1.41 0.00 0.00 57.07 57.06 1dvd s TYR 50 Cb 0.02 0.37 -0.03 0.00 -1.10 0.00 0.00 41.96 41.21 1dvd s TYR 50 CO 0.15 -0.24 0.02 0.15 -2.51 0.00 0.00 175.55 173.12 1dvd s LYS 51 N 0.43 3.81 0.37 -3.49 1.02 0.10 -1.89 119.74 120.10 1dvd s LYS 51 Ca 0.01 -0.42 -0.05 0.00 0.02 0.00 0.00 55.97 55.53 1dvd s LYS 51 Cb -0.05 -3.07 0.08 0.00 -0.52 0.00 0.00 37.83 34.28 1dvd s LYS 51 CO -0.08 0.28 0.51 0.25 -0.92 0.00 0.00 175.35 175.39 1dvd n THR 52 N 3.46 0.00 -3.53 2.17 -2.24 -1.26 -0.17 114.28 112.70 1dvd n THR 52 Ca -0.17 -0.47 -0.13 0.00 -2.27 0.00 0.00 64.05 61.01 1dvd n THR 52 Cb 0.52 -1.64 -0.05 0.00 -2.10 0.00 0.00 70.33 67.07 1dvd n THR 52 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1dvd s GLN 53 N -4.01 0.85 -0.01 -0.78 -0.44 -1.24 -1.51 119.66 112.51 1dvd s GLN 53 Ca 0.30 0.08 0.06 0.00 -2.50 0.00 0.00 55.36 53.30 1dvd s GLN 53 Cb -0.01 0.40 -0.01 0.00 -1.64 0.00 0.00 33.01 31.74 1dvd s GLN 53 CO 0.21 -0.29 -0.19 0.54 0.50 0.00 0.00 175.29 176.06 1dvd s VAL 54 N -1.61 1.46 0.00 1.34 0.11 -1.26 -2.68 120.40 117.76 1dvd s VAL 54 Ca -0.04 -0.80 0.00 0.00 -2.93 0.00 0.00 61.98 58.21 1dvd s VAL 54 Cb -0.00 -1.22 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 1dvd s VAL 54 CO 0.02 0.41 0.00 1.33 -3.33 0.00 0.00 175.10 173.53 1dvd n VAL 55 N 2.61 0.00 -1.33 2.04 0.24 -1.26 -4.88 118.33 115.75 1dvd n VAL 55 Ca -0.15 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 61.98 1dvd n VAL 55 Cb 0.54 0.00 0.18 0.00 -1.47 0.00 0.00 33.84 33.09 1dvd n VAL 55 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1dvd n ALA 56 N -3.00 5.15 0.00 2.33 0.00 -1.26 -4.91 120.51 118.83 1dvd n ALA 56 Ca 0.00 -3.03 0.00 0.00 0.00 0.00 0.00 53.44 50.41 1dvd n ALA 56 Cb 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1dvd n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvd n GLY 57 N -1.13 -0.89 3.22 0.00 0.00 -1.26 -4.55 105.19 100.58 1dvd n GLY 57 Ca 0.50 0.34 0.04 0.00 0.00 0.00 0.00 46.02 46.89 1dvd n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dvd s THR 58 N 0.00 -0.64 0.00 2.61 2.01 -1.22 -4.64 115.64 113.77 1dvd s THR 58 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1dvd s THR 58 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1dvd s THR 58 CO 0.00 0.00 0.00 0.59 -0.69 0.00 0.00 174.62 174.52 1dvd n ASN 59 N 5.38 -0.45 -3.56 3.53 3.02 -1.09 -1.88 115.26 120.20 1dvd n ASN 59 Ca -0.06 -0.37 -0.11 0.00 -0.03 0.00 0.00 54.58 54.02 1dvd n ASN 59 Cb 0.52 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.66 1dvd n ASN 59 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1dvd s TYR 60 N -0.60 -0.32 -0.07 3.10 1.51 0.16 -3.72 117.35 117.41 1dvd s TYR 60 Ca 0.00 0.04 -0.05 0.00 -1.01 0.00 0.00 57.07 56.05 1dvd s TYR 60 Cb 0.00 0.37 0.03 0.00 -0.11 0.00 0.00 41.96 42.25 1dvd s TYR 60 CO 0.00 -0.76 0.17 0.71 -1.11 0.00 0.00 175.55 174.55 1dvd s TYR 61 N -3.79 -0.20 -0.18 2.71 2.02 0.75 -2.30 117.35 116.37 1dvd s TYR 61 Ca 0.03 0.51 -0.08 0.00 -0.37 0.00 0.00 57.07 57.15 1dvd s TYR 61 Cb 0.01 0.01 0.07 0.00 -0.40 0.00 0.00 41.96 41.65 1dvd s TYR 61 CO -0.12 -0.14 0.40 0.42 -1.57 0.00 0.00 175.55 174.54 1dvd s ILE 62 N 0.66 -0.31 -0.85 2.71 1.01 0.60 0.03 121.20 125.07 1dvd s ILE 62 Ca -0.05 0.14 -0.17 0.00 0.00 0.00 0.00 60.65 60.57 1dvd s ILE 62 Cb -0.06 -0.62 0.17 0.00 0.01 0.00 0.00 42.46 41.95 1dvd s ILE 62 CO -0.03 0.06 0.92 -0.54 0.00 0.00 0.00 174.94 175.35 1dvd s LYS 63 N 1.96 3.53 -0.09 2.79 1.02 -0.05 -0.22 119.74 128.69 1dvd s LYS 63 Ca -0.06 -2.01 -0.08 0.00 0.02 0.00 0.00 55.97 53.85 1dvd s LYS 63 Cb -0.10 -4.63 -0.04 0.00 -0.52 0.00 0.00 37.83 32.54 1dvd s LYS 63 CO -0.12 -1.54 0.19 0.14 -0.92 0.00 0.00 175.35 173.10 1dvd s VAL 64 N 1.61 5.42 0.29 3.17 -7.23 -1.00 -1.23 120.40 121.43 1dvd s VAL 64 Ca 0.24 0.30 -0.29 0.00 -1.81 0.00 0.00 61.98 60.42 1dvd s VAL 64 Cb -0.09 -3.46 -0.10 0.00 0.56 0.00 0.00 36.38 33.28 1dvd s VAL 64 CO -0.07 0.59 1.30 -0.60 -0.31 0.00 0.00 175.10 176.01 1dvd s ARG 65 N -1.10 4.38 -0.32 4.82 3.52 -0.46 -1.24 118.95 128.55 1dvd s ARG 65 Ca 0.17 2.15 -0.03 0.00 -0.13 0.00 0.00 55.73 57.89 1dvd s ARG 65 Cb -0.13 -3.11 0.05 0.00 -1.56 0.00 0.00 34.95 30.20 1dvd s ARG 65 CO 0.07 -0.18 2.65 0.00 -0.81 0.00 0.00 175.30 177.03 1dvd n ALA 66 N 1.39 5.94 -0.06 6.12 0.00 -0.70 -1.52 120.51 131.68 1dvd n ALA 66 Ca 0.02 -2.32 0.00 0.00 0.00 0.00 0.00 53.44 51.14 1dvd n ALA 66 Cb 0.42 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 17.98 1dvd n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvd n GLY 67 N 1.00 2.23 0.00 0.00 0.00 -0.74 -4.54 105.19 103.15 1dvd n GLY 67 Ca 0.40 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1dvd n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dvd n ASP 68 N 4.50 0.00 -0.10 1.61 2.03 -1.26 -4.81 116.55 118.53 1dvd n ASP 68 Ca 0.00 0.00 0.15 0.00 0.52 0.00 0.00 54.79 55.46 1dvd n ASP 68 Cb 0.00 0.00 0.70 0.00 -0.72 0.00 0.00 41.12 41.10 1dvd n ASP 68 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1dvd n ASN 92 N 0.00 0.36 -3.93 1.67 4.13 -1.26 -4.85 115.26 111.39 1dvd n ASN 92 Ca 0.00 -0.64 -0.30 0.00 1.68 0.00 0.00 54.58 55.32 1dvd n ASN 92 Cb 0.00 -0.09 0.22 0.00 -1.54 0.00 0.00 39.78 38.36 1dvd n ASN 92 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1dvd s LYS 93 N -2.37 -0.32 0.19 3.52 2.47 -1.26 -4.90 119.74 117.07 1dvd s LYS 93 Ca 0.33 -0.29 -0.12 0.00 -1.56 0.00 0.00 55.97 54.33 1dvd s LYS 93 Cb 0.21 -1.72 0.00 0.00 -1.46 0.00 0.00 37.83 34.86 1dvd s LYS 93 CO 0.44 -3.07 0.39 0.71 0.16 0.00 0.00 175.35 173.98 1dvd s TYR 94 N -3.50 0.23 -0.11 4.03 1.51 -1.24 -1.71 117.35 116.56 1dvd s TYR 94 Ca 0.73 -0.59 -0.05 0.00 -1.01 0.00 0.00 57.07 56.15 1dvd s TYR 94 Cb -0.06 0.12 0.05 0.00 -0.11 0.00 0.00 41.96 41.97 1dvd s TYR 94 CO 0.54 -0.83 0.24 1.41 -1.11 0.00 0.00 175.55 175.81 1dvd s MET 95 N -3.95 0.17 0.51 -0.62 1.75 -0.37 -1.62 119.30 115.18 1dvd s MET 95 Ca 0.16 0.60 -0.19 0.00 -1.25 0.00 0.00 55.69 55.01 1dvd s MET 95 Cb 0.01 -0.10 -0.07 0.00 2.84 0.00 0.00 34.83 37.51 1dvd s MET 95 CO 0.01 -0.21 1.04 -1.01 -0.65 0.00 0.00 175.02 174.20 1dvd s HIS 96 N 1.71 3.00 -0.02 4.11 3.76 -0.19 -2.38 115.29 125.28 1dvd s HIS 96 Ca -0.05 1.56 0.00 0.00 -0.15 0.00 0.00 55.06 56.42 1dvd s HIS 96 Cb -0.11 -3.05 0.02 0.00 1.11 0.00 0.00 32.58 30.55 1dvd s HIS 96 CO -0.08 -0.91 -0.00 -1.17 -0.85 0.00 0.00 174.74 171.72 1dvd s LEU 97 N -3.76 1.47 -0.17 0.89 2.96 0.70 -1.66 118.68 119.11 1dvd s LEU 97 Ca 0.66 -0.02 -0.01 0.00 -0.22 0.00 0.00 54.13 54.55 1dvd s LEU 97 Cb -0.16 -0.15 -0.00 0.00 0.50 0.00 0.00 46.19 46.38 1dvd s LEU 97 CO 0.25 -0.06 -0.13 -0.75 -1.32 0.00 0.00 176.35 174.33 1dvd s LYS 98 N 0.62 3.24 0.26 1.98 2.36 -0.56 -0.29 119.74 127.37 1dvd s LYS 98 Ca -0.06 -0.72 0.04 0.00 -2.55 0.00 0.00 55.97 52.68 1dvd s LYS 98 Cb -0.09 -2.70 -0.06 0.00 -1.05 0.00 0.00 37.83 33.94 1dvd s LYS 98 CO -0.01 -0.03 0.00 0.08 1.55 0.00 0.00 175.35 176.94 1dvd s VAL 99 N 0.96 1.18 -0.03 4.02 1.01 -0.97 0.41 120.40 126.98 1dvd s VAL 99 Ca -0.02 -2.04 0.03 0.00 0.00 0.00 0.00 61.98 59.94 1dvd s VAL 99 Cb -0.15 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.76 1dvd s VAL 99 CO -0.02 -0.24 -0.11 0.12 0.00 0.00 0.00 175.10 174.86 1dvd s PHE 100 N -3.32 1.09 -0.40 5.22 5.36 -0.77 0.36 117.98 125.52 1dvd s PHE 100 Ca 0.31 -0.28 -0.12 0.00 -0.96 0.00 0.00 56.93 55.88 1dvd s PHE 100 Cb 0.06 -0.76 0.04 0.00 -0.34 0.00 0.00 43.02 42.02 1dvd s PHE 100 CO 0.11 -0.11 0.26 0.21 -1.46 0.00 0.00 175.22 174.24 1dvd s LYS 101 N 0.14 2.85 -0.86 10.12 2.20 -0.79 -2.01 119.74 131.39 1dvd s LYS 101 Ca -0.03 -1.15 -0.11 0.00 -0.36 0.00 0.00 55.97 54.33 1dvd s LYS 101 Cb -0.09 -3.86 0.22 0.00 -1.51 0.00 0.00 37.83 32.60 1dvd s LYS 101 CO 0.01 -0.79 0.79 -1.54 -0.36 0.00 0.00 175.35 173.46 1dvd s SER 102 N 1.79 6.61 0.24 1.43 1.04 -1.26 -3.38 113.70 120.17 1dvd s SER 102 Ca 0.03 -2.96 -0.10 0.00 0.48 0.00 0.00 55.95 53.41 1dvd s SER 102 Cb -0.20 -2.14 0.37 0.00 0.10 0.00 0.00 66.02 64.15 1dvd s SER 102 CO 0.07 -0.46 1.61 -0.07 0.98 0.00 0.00 173.24 175.37 1dvd h LEU 102 N 7.34 -0.59-10.46 2.42 4.07 -1.95 -3.40 115.31 112.73 1dvd h LEU 102 Ca 0.11 0.22 -0.49 0.00 0.08 0.00 0.00 57.88 57.80 1dvd h LEU 102 Cb 0.98 0.44 0.09 0.00 1.08 0.00 0.00 40.66 43.25 1dvd h LEU 102 CO 0.80 -0.24 0.39 -2.16 -1.08 0.00 0.00 178.44 176.15 1dvd s PRO 103 N -6.19 2.57 0.00 1.13 0.04 -1.26 -4.76 135.00 126.53 1dvd s PRO 103 Ca -0.14 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.40 1dvd s PRO 103 Cb 0.22 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.78 1dvd s PRO 103 CO 0.75 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.96 1dvd n GLY 104 N -2.73 0.81 1.95 0.56 0.00 -1.26 -4.92 105.19 99.59 1dvd n GLY 104 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1dvd n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dvd n GLN 105 N 0.00 -1.91 -2.06 1.61 6.02 -1.26 -3.82 117.38 115.96 1dvd n GLN 105 Ca 0.00 1.26 -0.27 0.00 -0.01 0.00 0.00 57.00 57.98 1dvd n GLN 105 Cb 0.00 -2.33 -0.05 0.00 1.02 0.00 0.00 30.24 28.87 1dvd n GLN 105 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1dvd s ASN 105 N -5.46 5.12 0.32 1.08 0.01 -1.26 -4.89 114.94 109.86 1dvd s ASN 105 Ca 0.00 -1.08 0.00 0.00 -0.71 0.00 0.00 52.86 51.07 1dvd s ASN 105 Cb 0.00 -2.57 -0.00 0.00 0.41 0.00 0.00 41.25 39.09 1dvd s ASN 105 CO 0.00 -2.86 0.00 -0.62 -1.51 0.00 0.00 177.10 172.12 1dvd n GLU 106 N 8.63 1.20 -4.64 -0.60 -0.58 -1.25 -5.17 120.64 118.23 1dvd n GLU 106 Ca 0.42 -2.36 -0.29 0.00 -0.42 0.00 0.00 57.16 54.51 1dvd n GLU 106 Cb 0.47 0.65 -0.08 0.00 -0.57 0.00 0.00 31.44 31.91 1dvd n GLU 106 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1dvd s ASP 107 N -2.78 3.50 0.92 1.62 1.01 -1.26 -5.05 116.67 114.63 1dvd s ASP 107 Ca 0.01 -1.60 -0.05 0.00 0.71 0.00 0.00 52.55 51.61 1dvd s ASP 107 Cb 0.00 0.35 0.08 0.00 1.01 0.00 0.00 42.92 44.36 1dvd s ASP 107 CO 0.00 -0.81 0.17 0.18 0.21 0.00 0.00 175.17 174.93 1dvd n LEU 108 N -1.06 0.00 -4.00 1.23 4.32 -1.26 -4.75 117.00 111.48 1dvd n LEU 108 Ca -0.12 -0.18 -0.09 0.00 -0.02 0.00 0.00 56.01 55.60 1dvd n LEU 108 Cb 0.66 -0.23 -0.08 0.00 -1.62 0.00 0.00 43.42 42.16 1dvd n LEU 108 CO 0.39 -1.72 -0.10 0.54 -1.22 0.00 0.00 177.39 175.27 1dvd s VAL 109 N -1.12 0.09 -0.88 4.08 0.11 -0.85 -4.91 120.40 116.92 1dvd s VAL 109 Ca 0.13 -1.50 -0.10 0.00 -2.93 0.00 0.00 61.98 57.58 1dvd s VAL 109 Cb -0.02 -1.83 0.23 0.00 -1.53 0.00 0.00 36.38 33.23 1dvd s VAL 109 CO 0.11 -0.40 0.82 -0.22 -3.33 0.00 0.00 175.10 172.08 1dvd s LEU 110 N -2.97 6.38 0.32 2.54 2.96 -1.26 -1.84 118.68 124.80 1dvd s LEU 110 Ca 0.17 -3.02 0.12 0.00 -0.22 0.00 0.00 54.13 51.18 1dvd s LEU 110 Cb 0.05 -2.14 0.52 0.00 0.50 0.00 0.00 46.19 45.11 1dvd s LEU 110 CO -0.01 -0.44 1.70 0.71 -1.32 0.00 0.00 176.35 176.99 1dvd h THR 111 N 4.50 1.35 -0.99 3.68 1.35 -0.32 -3.47 112.91 119.00 1dvd h THR 111 Ca 0.12 -1.76 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 1dvd h THR 111 Cb 0.97 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.34 1dvd h THR 111 CO 0.82 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 177.20 1dvd n GLY 112 N -0.04 2.10 0.00 5.82 0.00 -0.49 -4.96 105.19 107.62 1dvd n GLY 112 Ca -0.01 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1dvd n GLY 112 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1dvd n TYR 113 N 0.00 0.00 -3.24 1.61 0.18 -1.26 -1.49 117.16 112.95 1dvd n TYR 113 Ca 0.00 0.00 -0.45 0.00 1.88 0.00 0.00 57.90 59.33 1dvd n TYR 113 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 1dvd n TYR 113 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1dvd s GLN 114 N -0.47 3.03 0.78 -3.48 -1.52 -0.66 -4.90 119.66 112.43 1dvd s GLN 114 Ca 0.00 -1.38 -0.11 0.00 -1.95 0.00 0.00 55.36 51.92 1dvd s GLN 114 Cb 0.00 -4.22 0.06 0.00 -0.22 0.00 0.00 33.01 28.64 1dvd s GLN 114 CO 0.00 -1.30 1.10 0.54 -0.25 0.00 0.00 175.29 175.38 1dvd s VAL 115 N 2.10 3.10 -0.91 1.09 0.11 -1.26 -1.03 120.40 123.60 1dvd s VAL 115 Ca 0.08 0.38 -0.03 0.00 -2.93 0.00 0.00 61.98 59.48 1dvd s VAL 115 Cb -0.25 -2.80 0.02 0.00 -1.53 0.00 0.00 36.38 31.82 1dvd s VAL 115 CO 0.06 -0.45 0.12 -0.67 -3.33 0.00 0.00 175.10 170.84 1dvd n ASP 115 N -3.49 -3.26 -4.55 3.54 -0.08 -1.25 -4.86 116.55 102.60 1dvd n ASP 115 Ca 0.10 0.10 -0.41 0.00 -1.51 0.00 0.00 54.79 53.06 1dvd n ASP 115 Cb 0.53 -2.78 -0.08 0.00 2.34 0.00 0.00 41.12 41.12 1dvd n ASP 115 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1dvd s LYS 116 N -5.28 3.56 0.00 -0.67 3.01 -0.64 -4.88 119.74 114.84 1dvd s LYS 116 Ca 0.11 -0.22 0.00 0.00 -1.01 0.00 0.00 55.97 54.84 1dvd s LYS 116 Cb -0.06 -3.83 0.00 0.00 -1.01 0.00 0.00 37.83 32.94 1dvd s LYS 116 CO 0.13 -0.67 0.00 0.09 0.51 0.00 0.00 175.35 175.41 1dvd n ASN 117 N 5.74 -1.00 0.00 2.83 3.02 -1.26 -2.59 115.26 122.01 1dvd n ASN 117 Ca -0.05 -0.42 -0.17 0.00 -0.03 0.00 0.00 54.58 53.91 1dvd n ASN 117 Cb 0.49 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.55 1dvd n ASN 117 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1dvd h LYS 118 N 0.00 0.39 -0.10 3.52 3.64 -1.92 -3.09 116.57 119.01 1dvd h LYS 118 Ca 0.00 -0.42 0.03 0.00 -1.27 0.00 0.00 60.65 58.98 1dvd h LYS 118 Cb 0.00 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1dvd h LYS 118 CO 0.00 1.09 0.48 0.22 -2.27 0.00 0.00 179.45 178.97 1dvd h ASP 119 N -0.13 0.00 -3.07 4.20 1.82 -2.02 -3.39 116.42 113.83 1dvd h ASP 119 Ca -0.07 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.03 1dvd h ASP 119 Cb 1.30 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.31 1dvd h ASP 119 CO 0.11 0.00 0.69 -0.62 -1.61 0.00 0.00 179.24 177.82 1dvd s ASP 120 N -4.32 6.98 -0.06 2.28 -1.08 -1.17 -5.00 116.67 114.30 1dvd s ASP 120 Ca -0.03 2.01 -0.15 0.00 -0.52 0.00 0.00 52.55 53.86 1dvd s ASP 120 Cb 0.09 -2.57 -0.05 0.00 -1.46 0.00 0.00 42.92 38.93 1dvd s ASP 120 CO 0.28 -0.59 0.40 -0.70 0.52 0.00 0.00 175.17 175.08 1dvd s GLU 121 N 1.76 4.05 0.39 4.34 2.12 -1.26 -4.93 118.70 125.17 1dvd s GLU 121 Ca 0.60 0.35 0.09 0.00 0.36 0.00 0.00 54.97 56.38 1dvd s GLU 121 Cb -0.29 -3.30 0.78 0.00 0.26 0.00 0.00 34.13 31.58 1dvd s GLU 121 CO 0.26 0.50 1.92 -0.07 -0.54 0.00 0.00 175.26 177.33 1dvd h LEU 122 N 5.49 0.23 0.00 2.70 4.07 -1.94 -3.47 115.31 122.39 1dvd h LEU 122 Ca -0.48 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1dvd h LEU 122 Cb 1.20 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.88 1dvd h LEU 122 CO 0.67 0.38 0.00 0.35 -1.08 0.00 0.00 178.44 178.76 1dvd n THR 123 N -4.28 0.00 -1.68 0.22 -2.24 -1.26 -3.12 114.28 101.92 1dvd n THR 123 Ca -0.01 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.61 1dvd n THR 123 Cb 0.26 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.42 1dvd n THR 123 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1dvd s GLY 124 N -0.77 -0.62 0.00 3.38 0.00 -1.26 -5.08 107.32 102.96 1dvd s GLY 124 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.70 1dvd s GLY 124 CO 0.00 4.07 0.39 0.33 0.00 0.00 0.00 173.10 177.90