#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hae s HIS 2 N 0.00 0.74 -0.57 0.66 5.65 -0.96 -4.99 115.29 115.82 1hae s HIS 2 Ca 0.00 -0.19 -0.22 0.00 0.25 0.00 0.00 55.06 54.90 1hae s HIS 2 Cb 0.00 -0.60 0.06 0.00 -1.18 0.00 0.00 32.58 30.85 1hae s HIS 2 CO 0.00 -0.14 0.87 -0.51 -0.65 0.00 0.00 174.74 174.31 1hae s LEU 3 N 0.57 4.42 -0.12 8.88 1.02 -1.26 -0.59 118.68 131.60 1hae s LEU 3 Ca -0.08 -0.69 -0.10 0.00 0.02 0.00 0.00 54.13 53.28 1hae s LEU 3 Cb -0.11 -2.61 -0.05 0.00 0.02 0.00 0.00 46.19 43.44 1hae s LEU 3 CO 0.00 -1.21 0.20 0.68 0.02 0.00 0.00 176.35 176.05 1hae s VAL 4 N 3.64 5.38 0.11 -1.59 -7.23 -0.73 -4.82 120.40 115.16 1hae s VAL 4 Ca 0.24 0.36 -0.31 0.00 -1.81 0.00 0.00 61.98 60.46 1hae s VAL 4 Cb -0.16 -3.50 -0.10 0.00 0.56 0.00 0.00 36.38 33.19 1hae s VAL 4 CO 0.15 0.55 1.75 -0.75 -0.31 0.00 0.00 175.10 176.48 1hae s LYS 5 N -0.56 4.16 0.17 4.82 2.36 -1.26 -0.55 119.74 128.87 1hae s LYS 5 Ca 0.15 2.49 -0.33 0.00 -2.55 0.00 0.00 55.97 55.73 1hae s LYS 5 Cb -0.13 -3.56 -0.15 0.00 -1.05 0.00 0.00 37.83 32.94 1hae s LYS 5 CO 0.04 -0.79 1.26 0.00 1.55 0.00 0.00 175.35 177.42 1hae s ALA 7 N 0.03 1.14 0.60 0.00 0.00 -1.26 -4.25 121.76 118.02 1hae s ALA 7 Ca 0.75 0.30 0.29 0.00 0.00 0.00 0.00 51.96 53.30 1hae s ALA 7 Cb -0.83 -3.35 1.60 0.00 0.00 0.00 0.00 23.12 20.55 1hae s ALA 7 CO 0.50 -2.82 2.01 1.05 0.00 0.00 0.00 175.76 176.49 1hae h GLU 8 N -1.90 0.00 -0.51 0.00 9.09 -1.99 0.32 114.58 119.59 1hae h GLU 8 Ca -0.48 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 58.85 1hae h GLU 8 Cb 1.28 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.36 1hae h GLU 8 CO 0.47 0.00 0.01 0.87 0.05 0.00 0.00 179.01 180.40 1hae h LYS 9 N 0.00 0.85 -0.01 1.06 1.79 -2.03 -3.31 116.57 114.92 1hae h LYS 9 Ca 0.13 -0.23 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 1hae h LYS 9 Cb 0.76 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 1hae h LYS 9 CO -0.00 0.85 -0.04 0.39 -1.08 0.00 0.00 179.45 179.57 1hae n GLU 10 N -4.21 0.82 0.23 3.15 -0.58 0.50 -4.50 120.64 116.05 1hae n GLU 10 Ca 0.03 -1.07 0.13 0.00 -0.42 0.00 0.00 57.16 55.83 1hae n GLU 10 Cb 0.31 -1.19 0.77 0.00 -0.57 0.00 0.00 31.44 30.75 1hae n GLU 10 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1hae h LYS 11 N 2.01 0.00 0.00 3.49 2.10 -0.61 -0.95 116.57 122.61 1hae h LYS 11 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1hae h LYS 11 Cb 0.45 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 1hae h LYS 11 CO 0.00 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 177.70 1hae n THR 12 N -4.18 0.53 -0.24 0.07 -2.24 -1.26 -3.79 114.28 103.18 1hae n THR 12 Ca -0.01 -0.17 0.30 0.00 -2.27 0.00 0.00 64.05 61.90 1hae n THR 12 Cb 0.18 -0.65 0.70 0.00 -2.10 0.00 0.00 70.33 68.47 1hae n THR 12 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1hae h PHE 13 N 0.00 0.09 -3.17 4.78 3.57 -1.46 -3.33 116.94 117.43 1hae h PHE 13 Ca 0.00 0.00 -0.60 0.00 3.53 0.00 0.00 57.97 60.91 1hae h PHE 13 Cb 0.65 -0.03 -0.36 0.00 2.79 0.00 0.00 35.95 39.00 1hae h PHE 13 CO 0.00 0.01 -0.83 0.00 -2.23 0.00 0.00 178.31 175.27 1hae n VAL 15 N 4.78 0.00 -1.24 0.00 0.24 -0.99 -3.94 118.33 117.18 1hae n VAL 15 Ca -0.16 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.03 1hae n VAL 15 Cb 0.49 -1.52 -0.04 0.00 -1.47 0.00 0.00 33.84 31.30 1hae n VAL 15 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1hae n ASN 16 N -0.62 -4.80 -1.30 -1.34 0.23 -1.26 -0.98 115.26 105.19 1hae n ASN 16 Ca 0.00 0.26 -0.07 0.00 -0.53 0.00 0.00 54.58 54.24 1hae n ASN 16 Cb 0.00 -3.71 0.02 0.00 -2.08 0.00 0.00 39.78 34.01 1hae n ASN 16 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hae n GLY 17 N 0.15 0.38 3.77 4.83 0.00 -1.26 -4.80 105.19 108.26 1hae n GLY 17 Ca -0.10 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.09 1hae n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hae s GLY 18 N -3.00 2.96 -0.85 -0.02 0.00 -0.15 -4.76 107.32 101.50 1hae s GLY 18 Ca 0.14 0.83 -0.25 0.00 0.00 0.00 0.00 44.72 45.44 1hae s GLY 18 CO 0.17 1.37 1.32 -0.54 0.00 0.00 0.00 173.10 175.42 1hae s GLU 19 N -1.81 3.35 0.05 2.90 8.01 -0.91 -4.83 118.70 125.46 1hae s GLU 19 Ca 0.49 -0.65 -0.30 0.00 0.01 0.00 0.00 54.97 54.52 1hae s GLU 19 Cb -0.28 -4.65 -0.04 0.00 -4.31 0.00 0.00 34.13 24.84 1hae s GLU 19 CO 0.36 -2.14 1.03 0.00 0.01 0.00 0.00 175.26 174.52 1hae s PHE 21 N 0.71 1.58 -0.08 0.00 0.40 -0.10 -1.50 117.98 119.00 1hae s PHE 21 Ca 0.52 -0.69 0.02 0.00 -0.60 0.00 0.00 56.93 56.18 1hae s PHE 21 Cb -0.24 -0.80 0.01 0.00 0.51 0.00 0.00 43.02 42.50 1hae s PHE 21 CO 0.29 0.21 -0.15 1.41 0.70 0.00 0.00 175.22 177.68 1hae s MET 22 N -3.72 2.02 -0.94 0.44 1.75 0.28 -1.23 119.30 117.91 1hae s MET 22 Ca 0.22 -0.52 -0.24 0.00 -1.25 0.00 0.00 55.69 53.91 1hae s MET 22 Cb 0.02 -1.64 0.01 0.00 2.84 0.00 0.00 34.83 36.06 1hae s MET 22 CO 0.06 0.04 1.62 0.08 -0.65 0.00 0.00 175.02 176.16 1hae s VAL 23 N 0.66 3.72 -0.56 10.11 1.01 -0.10 -1.77 120.40 133.48 1hae s VAL 23 Ca -0.14 -0.48 -0.27 0.00 0.00 0.00 0.00 61.98 61.09 1hae s VAL 23 Cb -0.16 -4.65 -0.03 0.00 0.00 0.00 0.00 36.38 31.55 1hae s VAL 23 CO 0.04 -1.56 1.91 -0.75 0.00 0.00 0.00 175.10 174.74 1hae s LYS 24 N 5.81 2.68 -0.12 2.72 2.36 0.24 -4.54 119.74 128.88 1hae s LYS 24 Ca 0.54 0.82 -0.15 0.00 -2.55 0.00 0.00 55.97 54.62 1hae s LYS 24 Cb -0.04 -4.38 0.04 0.00 -1.05 0.00 0.00 37.83 32.40 1hae s LYS 24 CO -0.03 -2.66 0.41 0.34 1.55 0.00 0.00 175.35 174.96 1hae s ASP 25 N 8.24 -0.40 -0.15 1.43 -1.08 -1.26 -1.62 116.67 121.83 1hae s ASP 25 Ca 0.72 0.68 -0.03 0.00 -0.52 0.00 0.00 52.55 53.39 1hae s ASP 25 Cb -0.14 0.72 -0.07 0.00 -1.46 0.00 0.00 42.92 41.97 1hae s ASP 25 CO 0.23 -0.23 2.85 0.18 0.52 0.00 0.00 175.17 178.72 1hae n LEU 26 N 2.41 5.72 -0.60 -1.34 4.32 -1.26 -3.31 117.00 122.94 1hae n LEU 26 Ca -0.15 -3.23 -0.00 0.00 -0.02 0.00 0.00 56.01 52.61 1hae n LEU 26 Cb 0.57 -1.26 -0.00 0.00 -1.62 0.00 0.00 43.42 41.10 1hae n LEU 26 CO 0.15 1.49 0.24 -1.20 -1.22 0.00 0.00 177.39 176.86 1hae n SER 27 N 1.61 -0.01 -3.57 -1.43 7.64 -1.26 -5.12 113.62 111.49 1hae n SER 27 Ca 0.33 -1.55 -0.14 0.00 1.01 0.00 0.00 58.87 58.52 1hae n SER 27 Cb 0.70 -0.08 -0.06 0.00 -1.01 0.00 0.00 64.21 63.76 1hae n SER 27 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1hae s ASN 28 N -0.61 -0.53 0.07 6.43 6.03 -1.21 -5.08 114.94 120.04 1hae s ASN 28 Ca 0.02 0.68 -0.37 0.00 -1.03 0.00 0.00 52.86 52.16 1hae s ASN 28 Cb 0.02 0.57 -0.20 0.00 -3.03 0.00 0.00 41.25 38.61 1hae s ASN 28 CO -0.01 -0.42 1.57 -0.65 -2.03 0.00 0.00 177.10 175.56 1hae h PRO 29 N 3.14 -1.21 0.00 3.55 0.11 -1.94 -3.44 132.00 132.20 1hae h PRO 29 Ca -0.24 0.08 -0.15 0.00 0.11 0.00 0.00 66.00 65.80 1hae h PRO 29 Cb 1.15 0.28 -0.12 0.00 0.11 0.00 0.00 31.00 32.42 1hae h PRO 29 CO 0.30 -0.81 -0.09 -1.13 -0.21 0.00 0.00 178.00 176.05 1hae n SER 30 N -5.64 -1.58 -4.67 -2.05 3.41 -1.26 -5.02 113.62 96.81 1hae n SER 30 Ca -0.16 -2.43 -0.42 0.00 -0.26 0.00 0.00 58.87 55.60 1hae n SER 30 Cb 0.51 1.37 -0.03 0.00 -0.26 0.00 0.00 64.21 65.81 1hae n SER 30 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1hae s ARG 31 N 0.12 4.16 0.25 4.33 0.52 -1.26 -4.85 118.95 122.22 1hae s ARG 31 Ca 0.20 2.42 -0.07 0.00 -0.52 0.00 0.00 55.73 57.75 1hae s ARG 31 Cb 0.28 -3.99 -0.06 0.00 0.52 0.00 0.00 34.95 31.70 1hae s ARG 31 CO -0.14 -0.88 0.54 0.71 0.02 0.00 0.00 175.30 175.55 1hae s TYR 32 N 3.97 3.45 -0.11 -0.53 2.02 -1.26 -0.92 117.35 123.98 1hae s TYR 32 Ca 0.80 0.74 -0.03 0.00 -0.37 0.00 0.00 57.07 58.21 1hae s TYR 32 Cb -0.39 -2.16 0.05 0.00 -0.40 0.00 0.00 41.96 39.06 1hae s TYR 32 CO 0.35 0.23 0.15 -1.17 -1.57 0.00 0.00 175.55 173.55 1hae s LEU 33 N -3.16 -0.01 -0.14 -1.29 1.98 -0.36 -4.90 118.68 110.80 1hae s LEU 33 Ca 0.45 0.12 0.01 0.00 -2.89 0.00 0.00 54.13 51.81 1hae s LEU 33 Cb -0.11 0.19 -0.01 0.00 0.66 0.00 0.00 46.19 46.92 1hae s LEU 33 CO 0.26 -0.27 -0.16 0.00 -1.89 0.00 0.00 176.35 174.29 1hae n LYS 35 N 3.74 3.25 -1.16 0.00 4.76 0.05 -4.92 118.16 123.88 1hae n LYS 35 Ca -0.19 -3.26 -0.31 0.00 -2.87 0.00 0.00 58.31 51.69 1hae n LYS 35 Cb 0.52 -3.18 0.12 0.00 -1.84 0.00 0.00 35.03 30.65 1hae n LYS 35 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hae s GLN 37 N -4.87 3.21 -0.14 0.00 -1.52 -1.26 -4.89 119.66 110.18 1hae s GLN 37 Ca 0.63 0.98 -0.34 0.00 -1.95 0.00 0.00 55.36 54.68 1hae s GLN 37 Cb -0.18 -2.02 -0.11 0.00 -0.22 0.00 0.00 33.01 30.47 1hae s GLN 37 CO 0.57 -0.89 1.95 -2.30 -0.25 0.00 0.00 175.29 174.38 1hae n PRO 38 N -2.69 2.03 -0.62 2.91 -0.02 -1.26 -3.40 135.00 131.94 1hae n PRO 38 Ca 0.07 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1hae n PRO 38 Cb 0.53 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1hae n PRO 38 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hae n GLY 39 N 4.80 0.58 3.03 -1.23 0.00 -1.26 -4.98 105.19 106.13 1hae n GLY 39 Ca 0.26 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 1hae n GLY 39 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hae s PHE 40 N -1.73 0.15 0.26 1.61 0.08 -1.22 -1.22 117.98 115.91 1hae s PHE 40 Ca 0.00 -0.32 -0.06 0.00 0.12 0.00 0.00 56.93 56.68 1hae s PHE 40 Cb 0.00 -0.12 -0.01 0.00 -0.57 0.00 0.00 43.02 42.32 1hae s PHE 40 CO 0.00 -0.22 0.37 -0.08 -0.10 0.00 0.00 175.22 175.19 1hae s THR 41 N -1.31 0.00 0.00 0.64 -1.32 -0.04 -4.89 115.64 108.72 1hae s THR 41 Ca -0.14 -1.66 0.00 0.00 -1.21 0.00 0.00 61.69 58.68 1hae s THR 41 Cb -0.08 -2.42 0.00 0.00 -1.51 0.00 0.00 72.50 68.49 1hae s THR 41 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 1hae n GLY 42 N -0.41 1.88 0.23 6.08 0.00 -1.26 -1.86 105.19 109.85 1hae n GLY 42 Ca 0.00 -1.93 -0.00 0.00 0.00 0.00 0.00 46.02 44.09 1hae n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hae h ALA 43 N 0.00 0.72 -0.71 4.61 0.00 -2.01 -1.26 119.26 120.61 1hae h ALA 43 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1hae h ALA 43 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1hae h ALA 43 CO 0.00 -0.25 0.00 0.54 0.00 0.00 0.00 179.25 179.54 1hae n ARG 44 N -5.06 3.20 -3.20 0.00 1.74 -1.26 -4.93 116.66 107.16 1hae n ARG 44 Ca 0.08 -2.78 -0.23 0.00 -0.77 0.00 0.00 57.85 54.15 1hae n ARG 44 Cb 0.28 -1.72 0.03 0.00 -1.02 0.00 0.00 32.46 30.03 1hae n ARG 44 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hae h THR 46 N -1.45 0.68 -3.42 0.00 1.35 -1.79 -3.41 112.91 104.88 1hae h THR 46 Ca -0.51 -2.08 -0.63 0.00 -0.55 0.00 0.00 66.41 62.64 1hae h THR 46 Cb 1.35 2.23 -0.13 0.00 -1.73 0.00 0.00 68.15 69.87 1hae h THR 46 CO 0.57 0.39 0.38 -1.61 -0.25 0.00 0.00 175.52 175.00 1hae s GLU 47 N -2.96 3.34 0.36 4.72 2.02 -0.78 -4.94 118.70 120.46 1hae s GLU 47 Ca 0.01 -0.28 -0.28 0.00 0.02 0.00 0.00 54.97 54.45 1hae s GLU 47 Cb 0.08 -4.00 -0.10 0.00 0.10 0.00 0.00 34.13 30.21 1hae s GLU 47 CO 0.77 -1.26 1.33 0.54 0.02 0.00 0.00 175.26 176.66 1hae s ASN 48 N 2.46 6.58 0.03 -0.19 4.22 -1.26 -0.86 114.94 125.91 1hae s ASN 48 Ca 0.28 2.73 -0.03 0.00 -2.14 0.00 0.00 52.86 53.69 1hae s ASN 48 Cb -0.13 -2.65 -0.02 0.00 1.28 0.00 0.00 41.25 39.73 1hae s ASN 48 CO 0.20 -0.67 0.04 0.68 -2.04 0.00 0.00 177.10 175.30 1hae s VAL 49 N -1.17 0.13 -0.66 3.54 -7.23 -0.36 -4.89 120.40 109.76 1hae s VAL 49 Ca 0.52 -1.07 0.25 0.00 -1.81 0.00 0.00 61.98 59.87 1hae s VAL 49 Cb -0.40 -0.69 0.27 0.00 0.56 0.00 0.00 36.38 36.12 1hae s VAL 49 CO 0.53 -0.59 1.76 -0.81 -0.31 0.00 0.00 175.10 175.68 1hae n PRO 50 N 1.07 0.22 -3.12 4.82 -0.04 -1.26 -4.33 135.00 132.37 1hae n PRO 50 Ca -0.21 0.28 -0.14 0.00 -0.04 0.00 0.00 63.50 63.40 1hae n PRO 50 Cb 0.57 -1.81 0.07 0.00 -0.04 0.00 0.00 33.50 32.29 1hae n PRO 50 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 1hae n MET 51 N -2.21 -5.18 -3.66 0.54 1.56 -1.26 -4.91 117.12 101.99 1hae n MET 51 Ca 0.04 0.65 -0.01 0.00 -0.27 0.00 0.00 57.70 58.11 1hae n MET 51 Cb 0.35 -5.08 -0.01 0.00 2.15 0.00 0.00 33.22 30.63 1hae n MET 51 CO 0.00 0.00 0.00 0.21 -0.73 0.00 0.00 175.97 175.45 1hae s LYS 52 N -5.14 0.69 -0.31 2.12 2.20 -1.26 -5.11 119.74 112.93 1hae s LYS 52 Ca 0.05 -0.37 -0.18 0.00 -0.36 0.00 0.00 55.97 55.11 1hae s LYS 52 Cb -0.02 0.24 -0.02 0.00 -1.51 0.00 0.00 37.83 36.52 1hae s LYS 52 CO 0.56 -0.31 0.51 0.08 -0.36 0.00 0.00 175.35 175.83 1hae s VAL 53 N -2.75 5.04 -1.11 4.02 1.01 -1.26 -4.98 120.40 120.36 1hae s VAL 53 Ca 0.13 0.61 -0.25 0.00 0.00 0.00 0.00 61.98 62.47 1hae s VAL 53 Cb 0.02 -3.90 -0.16 0.00 0.00 0.00 0.00 36.38 32.35 1hae s VAL 53 CO -0.02 -0.07 2.04 -1.10 0.00 0.00 0.00 175.10 175.96 1hae s GLN 54 N 2.36 1.79 0.00 2.72 -0.21 -1.26 -2.21 119.66 122.86 1hae s GLN 54 Ca 0.20 -0.71 0.00 0.00 0.02 0.00 0.00 55.36 54.87 1hae s GLN 54 Cb -0.15 -5.09 0.00 0.00 1.00 0.00 0.00 33.01 28.77 1hae s GLN 54 CO 0.11 -4.76 0.00 0.27 -2.12 0.00 0.00 175.29 168.79 1hae n ASN 55 N 17.23 0.00 0.25 5.90 0.23 -1.26 -5.00 115.26 132.60 1hae n ASN 55 Ca 0.43 0.00 0.18 0.00 -0.53 0.00 0.00 54.58 54.66 1hae n ASN 55 Cb 0.47 0.00 0.85 0.00 -2.08 0.00 0.00 39.78 39.02 1hae n ASN 55 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1hae h GLN 56 N 0.00 0.00 -0.88 -3.83 1.08 -1.81 0.34 115.11 110.01 1hae h GLN 56 Ca 0.00 0.00 0.17 0.00 -1.45 0.00 0.00 58.65 57.37 1hae h GLN 56 Cb 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 27.33 1hae h GLN 56 CO 0.00 0.00 0.45 0.93 -0.95 0.00 0.00 178.83 179.26 1hae h GLU 57 N 0.00 0.58 0.00 1.46 4.39 -1.95 -3.17 114.58 115.89 1hae h GLU 57 Ca 0.07 -0.03 -0.21 0.00 0.34 0.00 0.00 59.36 59.52 1hae h GLU 57 Cb 0.64 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.13 1hae h GLU 57 CO -0.00 0.38 -1.54 1.63 -1.16 0.00 0.00 179.01 178.32 1hae n LYS 58 N -4.89 0.55 0.00 2.33 4.01 -0.46 -5.00 118.16 114.70 1hae n LYS 58 Ca 0.19 0.34 0.00 0.00 -0.51 0.00 0.00 58.31 58.33 1hae n LYS 58 Cb 0.50 -1.54 0.00 0.00 -0.51 0.00 0.00 35.03 33.47 1hae n LYS 58 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1hae n ALA 59 N -4.09 0.00 0.33 7.82 0.00 -0.02 -4.56 120.51 120.00 1hae n ALA 59 Ca -0.31 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.32 1hae n ALA 59 Cb 0.64 0.00 1.01 0.00 0.00 0.00 0.00 19.45 21.10 1hae n ALA 59 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1hae h GLU 60 N 0.00 0.00 -0.37 0.00 5.08 -1.90 -1.57 114.58 115.82 1hae h GLU 60 Ca 0.00 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 1hae h GLU 60 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1hae h GLU 60 CO 0.00 0.00 0.26 1.05 -1.00 0.00 0.00 179.01 179.32 1hae h GLU 61 N 0.00 0.02 0.14 2.33 4.11 -1.89 -1.99 114.58 117.30 1hae h GLU 61 Ca 0.00 -0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1hae h GLU 61 Cb 0.33 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1hae h GLU 61 CO 0.00 0.01 -0.07 -0.07 0.07 0.00 0.00 179.01 178.95 1hae h LEU 62 N 0.02 -0.16 0.00 3.06 3.38 -1.66 -3.54 115.31 116.41 1hae h LEU 62 Ca 0.17 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1hae h LEU 62 Cb 0.67 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1hae h LEU 62 CO -0.00 0.21 0.00 -1.22 0.09 0.00 0.00 178.44 177.52