#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 -0.47 -0.06 2.02 -4.36 -1.26 -5.12 121.20 111.96 1dvd s ILE 7 Ca 0.00 -1.57 -0.30 0.00 -0.26 0.00 0.00 60.65 58.53 1dvd s ILE 7 Cb 0.00 -0.50 -0.03 0.00 1.25 0.00 0.00 42.46 43.18 1dvd s ILE 7 CO 0.00 -0.49 1.07 -2.16 0.24 0.00 0.00 174.94 173.60 1dvd s PRO 8 N 0.65 4.43 0.00 0.37 0.04 -1.26 -4.96 135.00 134.26 1dvd s PRO 8 Ca 0.30 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.85 1dvd s PRO 8 Cb 0.00 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 31.03 1dvd s PRO 8 CO -0.10 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.05 1dvd n GLY 9 N 3.15 0.59 0.58 0.56 0.00 -1.26 -4.86 105.19 103.95 1dvd n GLY 9 Ca 0.09 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 0.00 -3.71 3.69 -0.02 0.00 -1.26 -4.76 105.19 99.14 1dvd n GLY 10 Ca 0.00 -0.91 -0.64 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.60 1.18 0.00 0.99 4.32 -1.26 -4.93 117.00 116.70 1dvd n LEU 11 Ca 0.00 1.16 -0.19 0.00 -0.02 0.00 0.00 56.01 56.97 1dvd n LEU 11 Cb 0.00 -0.94 0.05 0.00 -1.62 0.00 0.00 43.42 40.91 1dvd n LEU 11 CO 0.00 -0.98 0.27 -0.24 -1.22 0.00 0.00 177.39 175.22 1dvd n SER 12 N 3.69 2.02 -4.74 -1.43 2.88 -1.26 -5.04 113.62 109.74 1dvd n SER 12 Ca 0.28 -2.44 -0.42 0.00 -1.33 0.00 0.00 58.87 54.96 1dvd n SER 12 Cb 0.01 -0.31 -0.02 0.00 -0.75 0.00 0.00 64.21 63.14 1dvd n SER 12 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1dvd n GLU 13 N -2.03 2.62 -1.23 -1.46 -0.58 -1.26 -4.72 120.64 111.98 1dvd n GLU 13 Ca 0.11 0.93 -0.57 0.00 -0.42 0.00 0.00 57.16 57.21 1dvd n GLU 13 Cb 0.54 -2.70 -0.12 0.00 -0.57 0.00 0.00 31.44 28.59 1dvd n GLU 13 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1dvd n ALA 14 N 2.14 0.22 -2.69 0.62 0.00 -1.26 -4.84 120.51 114.70 1dvd n ALA 14 Ca 0.09 0.15 -0.42 0.00 0.00 0.00 0.00 53.44 53.26 1dvd n ALA 14 Cb 0.36 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.75 1dvd n ALA 14 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1dvd s LYS 15 N 6.01 4.55 0.13 0.00 3.01 -0.99 -4.79 119.74 127.66 1dvd s LYS 15 Ca 1.17 1.44 -0.31 0.00 -1.01 0.00 0.00 55.97 57.27 1dvd s LYS 15 Cb -1.44 -3.46 -0.09 0.00 -1.01 0.00 0.00 37.83 31.84 1dvd s LYS 15 CO 0.63 -0.07 1.53 -1.25 0.51 0.00 0.00 175.35 176.69 1dvd s PRO 16 N 1.05 4.24 1.01 -1.68 0.04 -1.26 -0.60 135.00 137.80 1dvd s PRO 16 Ca 0.52 2.26 -0.20 0.00 0.04 0.00 0.00 61.00 63.63 1dvd s PRO 16 Cb -0.22 -3.28 -0.11 0.00 0.04 0.00 0.00 34.50 30.94 1dvd s PRO 16 CO 0.28 -0.58 -0.75 0.00 0.04 0.00 0.00 177.00 175.99 1dvd n ALA 17 N 4.31 -5.00 -3.00 8.56 0.00 -0.63 -4.81 120.51 119.94 1dvd n ALA 17 Ca 0.14 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.63 1dvd n ALA 17 Cb 0.40 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -3.17 0.00 0.33 0.00 -2.24 -1.26 -4.92 114.28 103.02 1dvd n THR 18 Ca -0.00 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.93 1dvd n THR 18 Cb 0.62 0.00 0.56 0.00 -2.10 0.00 0.00 70.33 69.41 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 0.11 -0.78 0.13 -1.97 -1.60 132.00 127.89 1dvd h PRO 19 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.91 1dvd h PRO 19 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1dvd h PRO 19 CO 0.00 0.00 -1.05 1.49 -0.23 0.00 0.00 178.00 178.21 1dvd h GLU 20 N 0.00 0.23 0.31 0.86 4.81 -1.97 -1.62 114.58 117.19 1dvd h GLU 20 Ca 0.00 -0.40 -0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1dvd h GLU 20 Cb 0.53 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1dvd h GLU 20 CO 0.00 1.19 -0.24 0.82 -0.73 0.00 0.00 179.01 180.05 1dvd h ILE 21 N -0.43 0.48 0.00 2.32 1.08 -1.90 0.29 117.51 119.36 1dvd h ILE 21 Ca -0.22 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1dvd h ILE 21 Cb 1.63 0.48 -0.00 0.00 -3.07 0.00 0.00 36.82 35.86 1dvd h ILE 21 CO 0.08 0.00 -0.00 -0.61 -0.69 0.00 0.00 178.15 176.93 1dvd h GLN 22 N -0.56 0.00 -0.10 2.37 5.75 -1.41 -0.37 115.11 120.80 1dvd h GLN 22 Ca -0.02 0.00 -0.20 0.00 -0.15 0.00 0.00 58.65 58.28 1dvd h GLN 22 Cb 0.49 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.04 1dvd h GLN 22 CO -0.01 0.00 -0.77 1.49 -2.65 0.00 0.00 178.83 176.89 1dvd h GLU 23 N 0.00 0.55 0.05 1.69 4.22 0.53 0.56 114.58 122.18 1dvd h GLU 23 Ca -0.00 -0.46 -0.00 0.00 0.08 0.00 0.00 59.36 58.98 1dvd h GLU 23 Cb 0.02 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1dvd h GLU 23 CO 0.00 1.08 -0.03 0.82 -2.18 0.00 0.00 179.01 178.71 1dvd h ILE 24 N 0.37 1.14 -0.65 2.32 2.04 0.45 0.13 117.51 123.31 1dvd h ILE 24 Ca -0.04 -0.67 -0.07 0.00 1.00 0.00 0.00 64.86 65.08 1dvd h ILE 24 Cb 1.37 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 39.00 1dvd h ILE 24 CO 0.14 0.17 0.12 1.62 0.00 0.00 0.00 178.15 180.20 1dvd h VAL 25 N -0.37 1.26 0.00 1.67 3.04 -1.49 -0.74 116.25 119.62 1dvd h VAL 25 Ca -0.01 -1.00 0.00 0.00 -1.01 0.00 0.00 66.70 64.69 1dvd h VAL 25 Cb 0.33 0.66 0.00 0.00 -2.01 0.00 0.00 31.29 30.27 1dvd h VAL 25 CO 0.01 0.37 0.00 -0.78 -1.01 0.00 0.00 177.57 176.17 1dvd h ASP 26 N 0.98 0.00 0.89 3.17 3.58 -0.78 0.39 116.42 124.65 1dvd h ASP 26 Ca 0.20 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.65 1dvd h ASP 26 Cb 0.41 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.46 1dvd h ASP 26 CO 0.01 0.00 -0.88 0.50 -2.88 0.00 0.00 179.24 175.99 1dvd h LYS 27 N 0.00 0.00 -0.00 0.28 3.64 0.41 -3.34 116.57 117.56 1dvd h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1dvd h LYS 27 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1dvd h LYS 27 CO 0.00 0.00 -0.58 1.33 -2.27 0.00 0.00 179.45 177.93 1dvd n VAL 28 N -2.41 0.00 -0.27 2.00 0.24 -0.40 -4.51 118.33 112.99 1dvd n VAL 28 Ca 0.01 -0.21 0.08 0.00 -2.04 0.00 0.00 64.34 62.18 1dvd n VAL 28 Cb 0.50 1.02 0.20 0.00 -1.47 0.00 0.00 33.84 34.09 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 0.20 0.18 0.00 7.34 3.64 -0.39 1.18 116.57 128.72 1dvd h LYS 29 Ca 0.00 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 1dvd h LYS 29 Cb 0.33 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1dvd h LYS 29 CO 0.00 0.12 -0.68 -1.00 -2.27 0.00 0.00 179.45 175.62 1dvd h PRO 30 N 0.19 0.00 -0.00 1.90 0.13 -1.83 -2.15 132.00 130.24 1dvd h PRO 30 Ca 0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.58 1dvd h PRO 30 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1dvd h PRO 30 CO -0.61 0.68 -0.02 1.04 -0.23 0.00 0.00 178.00 178.86 1dvd n GLN 31 N -3.72 0.86 -0.07 0.86 6.02 0.20 -2.92 117.38 118.62 1dvd n GLN 31 Ca -0.01 -0.12 -0.21 0.00 -0.01 0.00 0.00 57.00 56.66 1dvd n GLN 31 Cb 0.67 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 30.31 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 -0.97 2.69 0.20 1.08 4.77 0.35 -3.05 117.00 122.06 1dvd n LEU 32 Ca 0.20 0.08 0.08 0.00 -0.03 0.00 0.00 56.01 56.34 1dvd n LEU 32 Cb 0.19 -1.00 0.29 0.00 -2.33 0.00 0.00 43.42 40.57 1dvd n LEU 32 CO 0.20 0.83 0.70 -0.33 -1.33 0.00 0.00 177.39 177.47 1dvd h GLU 33 N -0.11 0.00 0.00 3.23 5.08 -1.53 -1.59 114.58 119.66 1dvd h GLU 33 Ca -0.51 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.75 1dvd h GLU 33 Cb 1.90 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.13 1dvd h GLU 33 CO -0.04 0.28 -1.28 -1.91 -1.00 0.00 0.00 179.01 175.06 1dvd n GLU 34 N -3.29 0.62 0.00 2.33 2.13 -1.15 -0.75 120.64 120.53 1dvd n GLU 34 Ca 0.01 0.18 0.11 0.00 0.66 0.00 0.00 57.16 58.12 1dvd n GLU 34 Cb 0.54 -1.81 0.06 0.00 0.27 0.00 0.00 31.44 30.50 1dvd n GLU 34 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1dvd n LYS 35 N -2.80 0.77 0.00 5.31 3.00 -1.17 -4.46 118.16 118.80 1dvd n LYS 35 Ca -0.06 -0.60 0.00 0.00 -0.00 0.00 0.00 58.31 57.65 1dvd n LYS 35 Cb 0.73 -1.49 0.00 0.00 0.00 0.00 0.00 35.03 34.27 1dvd n LYS 35 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1dvd n THR 36 N -0.59 0.00 -0.80 3.15 5.66 -0.60 -5.04 114.28 116.05 1dvd n THR 36 Ca 0.08 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.08 1dvd n THR 36 Cb 0.40 -0.60 0.00 0.00 -1.55 0.00 0.00 70.33 68.58 1dvd n THR 36 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1dvd n ASN 37 N -1.47 -0.40 -3.91 1.09 6.94 0.07 -5.04 115.26 112.54 1dvd n ASN 37 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 54.58 54.38 1dvd n ASN 37 Cb 0.31 -0.20 -0.00 0.00 -2.36 0.00 0.00 39.78 37.53 1dvd n ASN 37 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1dvd n GLU 38 N -1.00 0.95 -0.03 -3.83 -0.58 -1.15 -5.02 120.64 109.99 1dvd n GLU 38 Ca 0.00 -2.33 0.01 0.00 -0.42 0.00 0.00 57.16 54.42 1dvd n GLU 38 Cb 0.20 0.26 -0.09 0.00 -0.57 0.00 0.00 31.44 31.24 1dvd n GLU 38 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1dvd n THR 39 N -1.36 0.34 0.00 2.62 -1.04 -1.26 -4.44 114.28 109.15 1dvd n THR 39 Ca -0.02 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.63 1dvd n THR 39 Cb 0.42 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.74 1dvd n THR 39 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1dvd n TYR 40 N -2.14 -0.21 -3.24 -1.42 4.01 -1.26 -4.92 117.16 107.98 1dvd n TYR 40 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 1dvd n TYR 40 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 1dvd n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dvd n GLY 43 N 0.00 -0.56 3.62 2.72 0.00 -1.26 -5.06 105.19 104.64 1dvd n GLY 43 Ca 0.00 -0.72 -0.60 0.00 0.00 0.00 0.00 46.02 44.70 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 0.37 -3.59 1.61 4.76 -1.26 -4.69 118.16 115.37 1dvd n LYS 44 Ca 0.00 0.13 -0.38 0.00 -2.87 0.00 0.00 58.31 55.19 1dvd n LYS 44 Cb 0.00 -1.69 -0.06 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 1.43 5.70 -0.95 -0.35 1.43 -1.25 -1.23 118.68 123.46 1dvd s LEU 45 Ca 0.95 -3.50 -0.25 0.00 -1.03 0.00 0.00 54.13 50.29 1dvd s LEU 45 Cb -1.25 -1.96 -0.13 0.00 0.03 0.00 0.00 46.19 42.88 1dvd s LEU 45 CO 0.63 -0.25 2.15 -1.61 0.23 0.00 0.00 176.35 177.50 1dvd s GLU 46 N -1.04 1.87 0.50 1.70 2.02 -0.37 -4.52 118.70 118.86 1dvd s GLU 46 Ca 0.26 -0.19 -0.19 0.00 0.02 0.00 0.00 54.97 54.87 1dvd s GLU 46 Cb -0.10 -4.97 -0.14 0.00 0.10 0.00 0.00 34.13 29.02 1dvd s GLU 46 CO -0.10 -4.38 0.06 0.00 0.02 0.00 0.00 175.26 170.86 1dvd n ALA 47 N 17.11 -2.61 0.00 5.21 0.00 -1.26 -1.50 120.51 137.47 1dvd n ALA 47 Ca 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1dvd n ALA 47 Cb 0.45 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 18.39 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 -1.45 0.00 -3.95 0.00 0.31 0.20 -4.71 118.33 108.73 1dvd n VAL 48 Ca 0.09 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.33 1dvd n VAL 48 Cb 0.46 -0.70 -0.05 0.00 -0.91 0.00 0.00 33.84 32.64 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 -1.81 1.51 -0.21 5.55 -0.21 -1.04 -1.60 119.66 121.86 1dvd s GLN 49 Ca 0.00 -1.17 -0.27 0.00 0.02 0.00 0.00 55.36 53.94 1dvd s GLN 49 Cb 0.00 0.48 0.11 0.00 1.00 0.00 0.00 33.01 34.60 1dvd s GLN 49 CO 0.00 -0.63 0.93 1.52 -2.12 0.00 0.00 175.29 174.98 1dvd s TYR 50 N -3.99 -0.51 0.35 0.91 1.13 0.24 -0.24 117.35 115.24 1dvd s TYR 50 Ca 0.19 1.10 0.08 0.00 -1.41 0.00 0.00 57.07 57.03 1dvd s TYR 50 Cb -0.01 0.38 -0.03 0.00 -1.10 0.00 0.00 41.96 41.20 1dvd s TYR 50 CO 0.07 -0.34 0.22 0.15 -2.51 0.00 0.00 175.55 173.14 1dvd s LYS 51 N -0.37 2.52 -0.05 -3.49 -0.14 0.16 -2.34 119.74 116.03 1dvd s LYS 51 Ca -0.01 -1.46 -0.06 0.00 -1.36 0.00 0.00 55.97 53.08 1dvd s LYS 51 Cb -0.03 -2.30 0.01 0.00 -1.68 0.00 0.00 37.83 33.83 1dvd s LYS 51 CO -0.00 0.07 0.16 0.95 -0.76 0.00 0.00 175.35 175.76 1dvd s THR 52 N -2.39 0.01 0.31 2.17 -4.23 -1.26 -1.38 115.64 108.88 1dvd s THR 52 Ca 0.40 -0.12 0.10 0.00 -1.18 0.00 0.00 61.69 60.89 1dvd s THR 52 Cb -0.04 -0.27 -0.05 0.00 1.34 0.00 0.00 72.50 73.48 1dvd s THR 52 CO 0.25 -0.07 -0.07 -1.10 -0.54 0.00 0.00 174.62 173.09 1dvd s GLN 53 N -0.17 1.94 -0.07 3.99 -1.52 -1.25 -4.38 119.66 118.21 1dvd s GLN 53 Ca -0.03 -1.75 0.04 0.00 -1.95 0.00 0.00 55.36 51.68 1dvd s GLN 53 Cb -0.02 -1.87 -0.01 0.00 -0.22 0.00 0.00 33.01 30.88 1dvd s GLN 53 CO 0.00 0.22 -0.20 0.54 -0.25 0.00 0.00 175.29 175.60 1dvd s VAL 54 N -2.51 2.47 0.00 1.09 0.11 -1.26 -1.72 120.40 118.57 1dvd s VAL 54 Ca 0.32 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 1dvd s VAL 54 Cb -0.02 -1.94 0.00 0.00 -1.53 0.00 0.00 36.38 32.89 1dvd s VAL 54 CO 0.18 0.57 0.00 1.33 -3.33 0.00 0.00 175.10 173.84 1dvd n VAL 55 N 2.93 0.00 -1.25 2.04 0.24 -1.26 -4.90 118.33 116.13 1dvd n VAL 55 Ca -0.18 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.90 1dvd n VAL 55 Cb 0.52 0.00 0.18 0.00 -1.47 0.00 0.00 33.84 33.07 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 5.53 0.00 2.33 0.00 -1.26 -4.90 120.51 119.21 1dvd n ALA 56 Ca 0.00 -2.93 0.00 0.00 0.00 0.00 0.00 53.44 50.51 1dvd n ALA 56 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.05 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 -1.14 -0.48 3.64 0.00 0.00 -1.26 -4.35 105.19 101.59 1dvd n GLY 57 Ca 0.58 0.11 -0.04 0.00 0.00 0.00 0.00 46.02 46.66 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 -0.39 0.25 2.61 2.01 -1.25 -4.60 115.64 114.27 1dvd s THR 58 Ca 0.00 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.96 1dvd s THR 58 Cb 0.00 -1.00 0.06 0.00 0.01 0.00 0.00 72.50 71.57 1dvd s THR 58 CO 0.00 0.00 0.31 0.59 -0.69 0.00 0.00 174.62 174.83 1dvd n ASN 59 N 4.74 -0.23 -3.74 3.53 3.02 -0.70 -2.28 115.26 119.60 1dvd n ASN 59 Ca -0.17 -1.03 -0.12 0.00 -0.03 0.00 0.00 54.58 53.24 1dvd n ASN 59 Cb 0.55 -0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.40 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 -1.66 -0.14 -0.18 3.10 1.51 0.95 -3.83 117.35 117.10 1dvd s TYR 60 Ca 0.18 0.04 -0.11 0.00 -1.01 0.00 0.00 57.07 56.17 1dvd s TYR 60 Cb -0.01 0.11 0.06 0.00 -0.11 0.00 0.00 41.96 42.02 1dvd s TYR 60 CO 0.13 -0.50 0.45 0.71 -1.11 0.00 0.00 175.55 175.23 1dvd s TYR 61 N -2.42 -0.66 -0.14 2.71 2.02 -0.48 -2.23 117.35 116.16 1dvd s TYR 61 Ca -0.06 1.39 -0.04 0.00 -0.37 0.00 0.00 57.07 57.99 1dvd s TYR 61 Cb -0.01 0.31 0.07 0.00 -0.40 0.00 0.00 41.96 41.92 1dvd s TYR 61 CO -0.02 -0.36 0.25 0.42 -1.57 0.00 0.00 175.55 174.27 1dvd s ILE 62 N 1.34 -0.39 -0.65 2.71 1.01 0.47 0.37 121.20 126.06 1dvd s ILE 62 Ca -0.09 0.23 -0.27 0.00 0.00 0.00 0.00 60.65 60.52 1dvd s ILE 62 Cb -0.08 -0.46 0.02 0.00 0.01 0.00 0.00 42.46 41.95 1dvd s ILE 62 CO -0.13 0.08 1.40 -0.75 0.00 0.00 0.00 174.94 175.54 1dvd s LYS 63 N 2.40 3.18 -0.08 2.79 2.47 0.67 -1.33 119.74 129.83 1dvd s LYS 63 Ca 0.02 0.16 0.01 0.00 -1.56 0.00 0.00 55.97 54.60 1dvd s LYS 63 Cb -0.13 -4.18 -0.03 0.00 -1.46 0.00 0.00 37.83 32.04 1dvd s LYS 63 CO -0.09 -2.12 -0.09 0.08 0.16 0.00 0.00 175.35 173.29 1dvd s VAL 64 N 6.25 3.49 0.07 4.02 1.01 -0.97 -0.63 120.40 133.64 1dvd s VAL 64 Ca 0.46 -0.55 -0.31 0.00 0.00 0.00 0.00 61.98 61.58 1dvd s VAL 64 Cb -0.10 -2.43 -0.07 0.00 0.00 0.00 0.00 36.38 33.79 1dvd s VAL 64 CO 0.20 0.58 1.47 -0.13 0.00 0.00 0.00 175.10 177.22 1dvd s ARG 65 N -0.54 4.27 -0.01 2.72 0.52 -0.56 -1.40 118.95 123.94 1dvd s ARG 65 Ca 0.08 2.12 -0.00 0.00 -0.52 0.00 0.00 55.73 57.41 1dvd s ARG 65 Cb -0.12 -3.42 0.01 0.00 0.52 0.00 0.00 34.95 31.95 1dvd s ARG 65 CO 0.02 -0.56 1.68 0.00 0.02 0.00 0.00 175.30 176.46 1dvd n ALA 66 N 4.76 3.56 -0.17 2.13 0.00 0.27 -1.23 120.51 129.82 1dvd n ALA 66 Ca 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1dvd n ALA 66 Cb 0.42 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 1.12 1.63 1.89 0.00 0.00 -0.37 -4.48 105.19 104.98 1dvd n GLY 67 Ca 0.01 0.14 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 1dvd n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dvd n ASP 68 N 3.37 5.23 0.00 1.61 9.92 -1.26 -4.75 116.55 130.66 1dvd n ASP 68 Ca 0.00 -2.46 0.00 0.00 -0.53 0.00 0.00 54.79 51.80 1dvd n ASP 68 Cb 0.00 -1.34 0.00 0.00 -0.64 0.00 0.00 41.12 39.14 1dvd n ASP 68 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1dvd n ASN 92 N 2.27 0.00 -4.77 -2.24 2.85 -1.26 -4.96 115.26 107.15 1dvd n ASN 92 Ca 0.33 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.42 1dvd n ASN 92 Cb 0.82 0.00 -0.00 0.00 1.24 0.00 0.00 39.78 41.84 1dvd n ASN 92 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1dvd s LYS 93 N 0.00 3.79 0.43 1.20 1.02 -1.26 -4.70 119.74 120.22 1dvd s LYS 93 Ca 0.00 2.00 0.07 0.00 0.02 0.00 0.00 55.97 58.06 1dvd s LYS 93 Cb 0.00 -2.56 -0.02 0.00 -0.52 0.00 0.00 37.83 34.73 1dvd s LYS 93 CO 0.00 -0.59 0.34 0.71 -0.92 0.00 0.00 175.35 174.90 1dvd s TYR 94 N -1.38 2.57 -0.23 3.18 2.02 -1.22 0.95 117.35 123.25 1dvd s TYR 94 Ca 0.61 -0.55 -0.12 0.00 -0.37 0.00 0.00 57.07 56.65 1dvd s TYR 94 Cb -0.34 -2.11 0.08 0.00 -0.40 0.00 0.00 41.96 39.19 1dvd s TYR 94 CO 0.43 -0.10 0.55 -1.64 -1.57 0.00 0.00 175.55 173.21 1dvd s MET 95 N -4.10 0.53 0.26 -0.62 -1.94 -0.49 -1.82 119.30 111.11 1dvd s MET 95 Ca 0.46 1.06 -0.30 0.00 -1.71 0.00 0.00 55.69 55.20 1dvd s MET 95 Cb -0.02 0.17 -0.09 0.00 2.01 0.00 0.00 34.83 36.90 1dvd s MET 95 CO 0.26 -0.17 1.01 -1.01 -0.01 0.00 0.00 175.02 175.10 1dvd s HIS 96 N 1.78 3.81 -0.10 -0.03 3.76 -0.26 -2.30 115.29 121.94 1dvd s HIS 96 Ca -0.09 1.82 0.03 0.00 -0.15 0.00 0.00 55.06 56.67 1dvd s HIS 96 Cb -0.08 -3.11 0.01 0.00 1.11 0.00 0.00 32.58 30.51 1dvd s HIS 96 CO -0.16 0.01 -0.19 -1.17 -0.85 0.00 0.00 174.74 172.38 1dvd s LEU 97 N -1.28 1.91 -0.16 0.89 1.98 -0.44 -1.27 118.68 120.30 1dvd s LEU 97 Ca 0.43 -0.48 -0.02 0.00 -2.89 0.00 0.00 54.13 51.17 1dvd s LEU 97 Cb -0.29 -1.22 -0.01 0.00 0.66 0.00 0.00 46.19 45.33 1dvd s LEU 97 CO 0.36 0.08 -0.10 -0.75 -1.89 0.00 0.00 176.35 174.06 1dvd s LYS 98 N 0.67 3.41 0.21 1.98 2.20 -0.71 -0.40 119.74 127.10 1dvd s LYS 98 Ca -0.12 -0.65 0.02 0.00 -0.36 0.00 0.00 55.97 54.86 1dvd s LYS 98 Cb -0.16 -2.77 -0.05 0.00 -1.51 0.00 0.00 37.83 33.33 1dvd s LYS 98 CO 0.03 0.09 0.02 0.08 -0.36 0.00 0.00 175.35 175.21 1dvd s VAL 99 N 0.70 0.77 -0.04 4.02 1.01 -0.95 0.12 120.40 126.03 1dvd s VAL 99 Ca -0.05 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 59.95 1dvd s VAL 99 Cb -0.15 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 33.92 1dvd s VAL 99 CO 0.02 -0.31 -0.10 0.12 0.00 0.00 0.00 175.10 174.83 1dvd s PHE 100 N -3.60 1.16 0.03 5.22 2.19 -0.86 -0.04 117.98 122.08 1dvd s PHE 100 Ca 0.29 -0.36 0.04 0.00 0.33 0.00 0.00 56.93 57.23 1dvd s PHE 100 Cb 0.06 -0.86 -0.04 0.00 -1.31 0.00 0.00 43.02 40.88 1dvd s PHE 100 CO 0.08 -0.18 -0.05 -1.59 1.83 0.00 0.00 175.22 175.30 1dvd s LYS 101 N 0.47 2.53 -0.41 10.12 0.00 -0.97 -2.33 119.74 129.16 1dvd s LYS 101 Ca -0.09 -0.76 -0.13 0.00 0.00 0.00 0.00 55.97 54.99 1dvd s LYS 101 Cb -0.12 -2.51 0.04 0.00 0.00 0.00 0.00 37.83 35.24 1dvd s LYS 101 CO 0.02 0.58 0.27 -1.54 0.00 0.00 0.00 175.35 174.69 1dvd s SER 102 N -1.66 5.93 0.47 0.03 1.04 -1.26 -3.76 113.70 114.49 1dvd s SER 102 Ca 0.19 -1.05 0.26 0.00 0.48 0.00 0.00 55.95 55.83 1dvd s SER 102 Cb -0.11 -2.09 0.90 0.00 0.10 0.00 0.00 66.02 64.82 1dvd s SER 102 CO 0.10 -0.46 1.81 0.17 0.98 0.00 0.00 173.24 175.84 1dvd h LEU 102 N 8.55 0.00 -8.82 2.42 8.10 -1.92 -3.43 115.31 120.21 1dvd h LEU 102 Ca -0.26 0.00 -0.58 0.00 0.11 0.00 0.00 57.88 57.15 1dvd h LEU 102 Cb 1.11 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 41.25 1dvd h LEU 102 CO 0.73 0.13 0.77 -2.16 -4.11 0.00 0.00 178.44 173.80 1dvd s PRO 103 N -3.52 3.85 0.00 0.17 0.04 -1.26 -4.73 135.00 129.53 1dvd s PRO 103 Ca 0.02 0.68 0.00 0.00 0.04 0.00 0.00 61.00 61.75 1dvd s PRO 103 Cb 0.09 -3.83 0.00 0.00 0.04 0.00 0.00 34.50 30.80 1dvd s PRO 103 CO 0.62 -1.09 0.00 0.41 0.04 0.00 0.00 177.00 176.98 1dvd n GLY 104 N 4.42 0.26 0.00 0.56 0.00 -1.26 -5.01 105.19 104.15 1dvd n GLY 104 Ca 0.10 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 1.69 -1.71 1.61 6.02 -1.26 -5.01 117.38 118.72 1dvd n GLN 105 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 1dvd n GLN 105 Cb 0.00 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.19 1dvd n GLN 105 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1dvd s ASN 105 N 0.36 4.15 0.88 1.08 2.47 -1.26 -4.91 114.94 117.72 1dvd s ASN 105 Ca 0.00 -0.37 -0.09 0.00 0.42 0.00 0.00 52.86 52.82 1dvd s ASN 105 Cb 0.00 -2.56 0.18 0.00 -1.45 0.00 0.00 41.25 37.42 1dvd s ASN 105 CO 0.00 -3.73 1.10 -0.62 -3.72 0.00 0.00 177.10 170.13 1dvd n GLU 106 N 8.70 -0.73 -2.52 0.43 1.02 -1.26 -4.96 120.64 121.31 1dvd n GLU 106 Ca 0.44 -2.15 -0.41 0.00 -0.02 0.00 0.00 57.16 55.02 1dvd n GLU 106 Cb 0.45 -1.00 -0.03 0.00 -0.02 0.00 0.00 31.44 30.84 1dvd n GLU 106 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1dvd s ASP 107 N -5.19 6.14 0.91 1.62 1.01 -1.26 -4.95 116.67 114.95 1dvd s ASP 107 Ca 0.66 -0.36 -0.10 0.00 0.71 0.00 0.00 52.55 53.47 1dvd s ASP 107 Cb -0.02 -2.56 0.15 0.00 1.01 0.00 0.00 42.92 41.50 1dvd s ASP 107 CO 0.45 -1.84 0.35 0.18 0.21 0.00 0.00 175.17 174.53 1dvd n LEU 108 N 9.48 0.00 -4.16 1.23 4.32 -1.26 -4.97 117.00 121.64 1dvd n LEU 108 Ca 0.04 -0.35 -0.10 0.00 -0.02 0.00 0.00 56.01 55.58 1dvd n LEU 108 Cb 0.49 -0.56 -0.10 0.00 -1.62 0.00 0.00 43.42 41.63 1dvd n LEU 108 CO 0.71 -2.14 -0.34 0.54 -1.22 0.00 0.00 177.39 174.93 1dvd s VAL 109 N -1.63 0.43 -0.82 4.08 0.11 -0.98 -4.94 120.40 116.64 1dvd s VAL 109 Ca 0.27 -1.91 -0.12 0.00 -2.93 0.00 0.00 61.98 57.29 1dvd s VAL 109 Cb -0.05 -1.84 0.22 0.00 -1.53 0.00 0.00 36.38 33.17 1dvd s VAL 109 CO 0.23 -0.70 0.74 -0.22 -3.33 0.00 0.00 175.10 171.82 1dvd s LEU 110 N -3.05 6.46 0.55 2.54 2.96 -1.26 -2.03 118.68 124.84 1dvd s LEU 110 Ca 0.17 -2.82 0.33 0.00 -0.22 0.00 0.00 54.13 51.58 1dvd s LEU 110 Cb 0.07 -2.15 1.44 0.00 0.50 0.00 0.00 46.19 46.05 1dvd s LEU 110 CO -0.02 -0.51 2.02 0.71 -1.32 0.00 0.00 176.35 177.23 1dvd h THR 111 N 4.75 0.16 -0.14 3.68 1.35 0.69 -3.47 112.91 119.92 1dvd h THR 111 Ca 0.10 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1dvd h THR 111 Cb 1.01 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1dvd h THR 111 CO 0.77 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 176.70 1dvd n GLY 112 N -0.17 0.69 0.00 5.82 0.00 -0.58 -4.94 105.19 106.01 1dvd n GLY 112 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -3.27 1.61 0.18 -1.26 -1.74 117.16 112.69 1dvd n TYR 113 Ca 0.00 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 1dvd n TYR 113 Cb 0.00 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 38.88 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 -0.35 3.09 0.78 -3.48 -1.52 -0.40 -4.87 119.66 112.92 1dvd s GLN 114 Ca 0.00 -0.87 -0.12 0.00 -1.95 0.00 0.00 55.36 52.42 1dvd s GLN 114 Cb 0.00 -4.03 0.06 0.00 -0.22 0.00 0.00 33.01 28.82 1dvd s GLN 114 CO 0.00 -1.00 1.12 0.54 -0.25 0.00 0.00 175.29 175.70 1dvd s VAL 115 N 2.25 2.90 -1.49 1.09 0.11 -1.26 -1.11 120.40 122.89 1dvd s VAL 115 Ca 0.12 0.33 -0.18 0.00 -2.93 0.00 0.00 61.98 59.33 1dvd s VAL 115 Cb -0.19 -2.73 0.17 0.00 -1.53 0.00 0.00 36.38 32.10 1dvd s VAL 115 CO 0.12 -0.34 0.52 -0.67 -3.33 0.00 0.00 175.10 171.40 1dvd n ASP 115 N -3.35 -2.08 -2.02 3.54 -0.08 -1.18 -4.85 116.55 106.53 1dvd n ASP 115 Ca 0.11 -0.84 0.00 0.00 -1.51 0.00 0.00 54.79 52.55 1dvd n ASP 115 Cb 0.52 -1.80 0.00 0.00 2.34 0.00 0.00 41.12 42.18 1dvd n ASP 115 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1dvd n LYS 116 N -3.81 0.08 -3.20 -0.67 3.00 -0.75 -4.81 118.16 108.00 1dvd n LYS 116 Ca 0.08 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.29 1dvd n LYS 116 Cb 0.47 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.48 1dvd n LYS 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1dvd n ASN 117 N -2.93 -0.88 -0.02 3.14 3.02 -1.26 -3.39 115.26 112.93 1dvd n ASN 117 Ca 0.00 -2.28 -0.16 0.00 -0.03 0.00 0.00 54.58 52.12 1dvd n ASN 117 Cb 0.00 1.66 -0.10 0.00 -0.61 0.00 0.00 39.78 40.73 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 0.29 -0.59 3.52 3.64 -1.98 -2.96 116.57 118.49 1dvd h LYS 118 Ca -0.18 -0.27 0.17 0.00 -1.27 0.00 0.00 60.65 59.10 1dvd h LYS 118 Cb 0.79 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 1dvd h LYS 118 CO 0.25 0.95 0.75 0.22 -2.27 0.00 0.00 179.45 179.34 1dvd h ASP 119 N -0.28 0.00 -0.43 4.20 3.58 -2.04 -2.62 116.42 118.83 1dvd h ASP 119 Ca -0.04 0.00 -0.71 0.00 0.42 0.00 0.00 57.03 56.70 1dvd h ASP 119 Cb 1.05 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.04 1dvd h ASP 119 CO 0.07 0.00 3.02 -0.67 -2.88 0.00 0.00 179.24 178.78 1dvd n ASP 120 N -3.40 5.94 -4.57 2.28 -0.08 -1.12 -4.92 116.55 110.68 1dvd n ASP 120 Ca 0.12 -2.86 -0.39 0.00 -1.51 0.00 0.00 54.79 50.15 1dvd n ASP 120 Cb 0.95 -1.56 -0.03 0.00 2.34 0.00 0.00 41.12 42.83 1dvd n ASP 120 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1dvd s GLU 121 N 1.80 2.48 -0.32 -0.67 2.12 -0.99 -4.67 118.70 118.45 1dvd s GLU 121 Ca 0.52 1.51 -0.09 0.00 0.36 0.00 0.00 54.97 57.28 1dvd s GLU 121 Cb 0.15 -4.49 -0.08 0.00 0.26 0.00 0.00 34.13 29.97 1dvd s GLU 121 CO -0.06 -2.85 0.83 1.28 -0.54 0.00 0.00 175.26 173.92 1dvd n LEU 122 N 14.24 -0.01 -0.12 2.70 4.32 -1.26 -4.69 117.00 132.18 1dvd n LEU 122 Ca 0.33 0.02 0.06 0.00 -0.02 0.00 0.00 56.01 56.40 1dvd n LEU 122 Cb 0.52 -0.27 -0.04 0.00 -1.62 0.00 0.00 43.42 42.00 1dvd n LEU 122 CO 0.69 -0.27 0.08 1.07 -1.22 0.00 0.00 177.39 177.74 1dvd n THR 123 N 2.28 0.00 0.00 -5.08 5.66 -1.26 -4.77 114.28 111.11 1dvd n THR 123 Ca 0.21 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1dvd n THR 123 Cb 0.02 1.06 0.00 0.00 -1.55 0.00 0.00 70.33 69.86 1dvd n THR 123 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1dvd n GLY 124 N 1.20 -0.10 0.94 1.09 0.00 -1.26 -5.02 105.19 102.03 1dvd n GLY 124 Ca 0.04 0.75 0.12 0.00 0.00 0.00 0.00 46.02 46.93 1dvd n GLY 124 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65