#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 2.05 -0.40 1.43 5.65 -1.26 -4.80 115.29 117.96 1hae s HIS 2 Ca 0.00 -0.08 -0.22 0.00 0.25 0.00 0.00 55.06 55.01 1hae s HIS 2 Cb 0.00 -3.04 0.01 0.00 -1.18 0.00 0.00 32.58 28.37 1hae s HIS 2 CO 0.00 -1.55 0.73 -0.51 -0.65 0.00 0.00 174.74 172.76 1hae s LEU 3 N -5.12 4.25 0.06 8.88 2.01 -1.26 -3.87 118.68 123.63 1hae s LEU 3 Ca 0.64 0.05 0.05 0.00 0.01 0.00 0.00 54.13 54.89 1hae s LEU 3 Cb -0.07 -2.90 -0.04 0.00 0.01 0.00 0.00 46.19 43.19 1hae s LEU 3 CO 0.44 -0.76 -0.07 0.68 1.01 0.00 0.00 176.35 177.64 1hae s VAL 4 N 3.02 3.57 0.20 -1.59 -7.23 -0.93 -4.88 120.40 112.56 1hae s VAL 4 Ca 0.28 -1.01 -0.31 0.00 -1.81 0.00 0.00 61.98 59.12 1hae s VAL 4 Cb -0.13 -2.62 -0.11 0.00 0.56 0.00 0.00 36.38 34.08 1hae s VAL 4 CO 0.18 0.24 1.58 -0.54 -0.31 0.00 0.00 175.10 176.26 1hae s LYS 5 N -1.86 4.19 0.30 4.82 1.02 -1.26 -0.85 119.74 126.10 1hae s LYS 5 Ca 0.20 2.43 -0.29 0.00 0.02 0.00 0.00 55.97 58.33 1hae s LYS 5 Cb -0.11 -3.12 -0.13 0.00 -0.52 0.00 0.00 37.83 33.95 1hae s LYS 5 CO 0.12 -0.61 1.20 0.00 -0.92 0.00 0.00 175.35 175.14 1hae s ALA 7 N -0.91 1.23 0.53 0.00 0.00 -1.26 -4.39 121.76 116.96 1hae s ALA 7 Ca 0.59 0.30 0.20 0.00 0.00 0.00 0.00 51.96 53.04 1hae s ALA 7 Cb -0.64 -3.34 1.37 0.00 0.00 0.00 0.00 23.12 20.52 1hae s ALA 7 CO 0.59 -2.75 2.13 1.05 0.00 0.00 0.00 175.76 176.78 1hae h GLU 8 N -1.85 0.00 0.00 0.00 4.11 -1.99 0.48 114.58 115.33 1hae h GLU 8 Ca -0.48 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.90 1hae h GLU 8 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1hae h GLU 8 CO 0.47 0.00 -0.26 0.87 0.07 0.00 0.00 179.01 180.16 1hae h LYS 9 N 0.00 0.00 0.00 1.06 1.79 -2.03 -3.27 116.57 114.12 1hae h LYS 9 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1hae h LYS 9 Cb 0.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1hae h LYS 9 CO -0.00 0.26 -1.26 0.39 -1.08 0.00 0.00 179.45 177.77 1hae n GLU 10 N -3.73 1.23 0.30 3.15 1.02 0.46 -4.58 120.64 118.49 1hae n GLU 10 Ca -0.01 -0.08 0.17 0.00 -0.02 0.00 0.00 57.16 57.22 1hae n GLU 10 Cb 0.37 -1.26 0.95 0.00 -0.02 0.00 0.00 31.44 31.48 1hae n GLU 10 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1hae h LYS 11 N 0.00 0.00 0.00 3.49 2.10 -0.24 -0.39 116.57 121.53 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 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 1hae h LYS 11 CO 0.00 0.03 0.00 0.25 -2.00 0.00 0.00 179.45 177.73 1hae n THR 12 N -3.54 0.53 -0.21 0.07 -2.24 -1.26 -3.73 114.28 103.90 1hae n THR 12 Ca -0.03 -0.12 0.31 0.00 -2.27 0.00 0.00 64.05 61.94 1hae n THR 12 Cb 0.13 -0.68 0.73 0.00 -2.10 0.00 0.00 70.33 68.41 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 0.00 -4.19 4.78 3.57 -1.37 -3.38 116.94 116.35 1hae h PHE 13 Ca 0.00 0.00 -0.50 0.00 3.53 0.00 0.00 57.97 61.00 1hae h PHE 13 Cb 0.61 0.00 -0.28 0.00 2.79 0.00 0.00 35.95 39.07 1hae h PHE 13 CO 0.00 0.00 -0.82 0.00 -2.23 0.00 0.00 178.31 175.26 1hae n VAL 15 N 2.46 0.00 -3.84 0.00 0.24 -0.80 -4.67 118.33 111.71 1hae n VAL 15 Ca -0.15 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 61.90 1hae n VAL 15 Cb 0.55 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.93 1hae n VAL 15 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1hae n ASN 16 N -0.92 -1.81 0.00 -1.34 3.02 -1.26 -1.44 115.26 111.51 1hae n ASN 16 Ca 0.00 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1hae n ASN 16 Cb 0.00 -3.68 0.00 0.00 -0.61 0.00 0.00 39.78 35.49 1hae n ASN 16 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hae n GLY 17 N -1.70 0.42 3.64 7.41 0.00 -1.26 -4.40 105.19 109.31 1hae n GLY 17 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.00 1.45 -0.32 -0.02 0.00 -0.52 -4.64 107.32 101.27 1hae s GLY 18 Ca 0.00 0.36 -0.29 0.00 0.00 0.00 0.00 44.72 44.79 1hae s GLY 18 CO 0.00 2.68 1.08 1.85 0.00 0.00 0.00 173.10 178.71 1hae s GLU 19 N 4.03 4.06 -0.03 2.90 -6.30 -0.84 -4.48 118.70 118.05 1hae s GLU 19 Ca 0.60 1.08 -0.27 0.00 -2.50 0.00 0.00 54.97 53.88 1hae s GLU 19 Cb -0.21 -3.74 -0.03 0.00 0.00 0.00 0.00 34.13 30.14 1hae s GLU 19 CO 0.22 -0.91 0.87 0.00 0.02 0.00 0.00 175.26 175.46 1hae s PHE 21 N 0.93 1.80 -0.02 0.00 0.40 -0.17 -1.59 117.98 119.33 1hae s PHE 21 Ca 0.46 -0.66 -0.03 0.00 -0.60 0.00 0.00 56.93 56.10 1hae s PHE 21 Cb -0.20 -0.95 0.00 0.00 0.51 0.00 0.00 43.02 42.39 1hae s PHE 21 CO 0.24 0.29 0.08 1.41 0.70 0.00 0.00 175.22 177.94 1hae s MET 22 N -3.70 0.19 -0.68 0.44 1.75 -0.03 -1.20 119.30 116.06 1hae s MET 22 Ca 0.26 -0.06 -0.21 0.00 -1.25 0.00 0.00 55.69 54.43 1hae s MET 22 Cb 0.02 0.08 0.08 0.00 2.84 0.00 0.00 34.83 37.86 1hae s MET 22 CO 0.09 -0.03 0.94 0.08 -0.65 0.00 0.00 175.02 175.45 1hae s VAL 23 N -0.38 4.47 0.00 10.11 1.01 -0.32 -2.19 120.40 133.10 1hae s VAL 23 Ca -0.04 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1hae s VAL 23 Cb -0.03 -4.66 0.00 0.00 0.00 0.00 0.00 36.38 31.69 1hae s VAL 23 CO 0.00 -1.41 1.74 2.29 0.00 0.00 0.00 175.10 177.72 1hae n LYS 24 N 7.30 0.92 -2.44 2.72 0.00 -1.25 -4.37 118.16 121.06 1hae n LYS 24 Ca -0.01 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.98 1hae n LYS 24 Cb 0.45 -1.04 -0.04 0.00 -0.00 0.00 0.00 35.03 34.41 1hae n LYS 24 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1hae s ASP 25 N 1.88 6.63 0.23 -5.58 2.15 -1.26 -4.85 116.67 115.86 1hae s ASP 25 Ca 0.00 1.60 -0.04 0.00 0.43 0.00 0.00 52.55 54.53 1hae s ASP 25 Cb 0.00 -2.51 0.23 0.00 -0.30 0.00 0.00 42.92 40.33 1hae s ASP 25 CO 0.00 -0.58 1.69 0.25 -0.17 0.00 0.00 175.17 176.36 1hae h LEU 26 N 1.02 0.84 -3.67 -1.34 5.85 -1.99 -3.29 115.31 112.73 1hae h LEU 26 Ca -0.47 -0.24 -0.34 0.00 0.84 0.00 0.00 57.88 57.67 1hae h LEU 26 Cb 1.19 -0.23 -0.14 0.00 0.37 0.00 0.00 40.66 41.85 1hae h LEU 26 CO 0.61 0.94 0.37 -1.20 -0.34 0.00 0.00 178.44 178.83 1hae n SER 27 N -4.18 6.40 -3.62 1.25 7.64 -1.26 -4.79 113.62 115.06 1hae n SER 27 Ca 0.02 -3.05 -0.07 0.00 1.01 0.00 0.00 58.87 56.78 1hae n SER 27 Cb 0.35 -1.11 -0.06 0.00 -1.01 0.00 0.00 64.21 62.39 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 0.33 -0.27 -0.03 6.43 6.03 -1.24 -5.10 114.94 121.10 1hae s ASN 28 Ca 0.36 0.39 -0.19 0.00 -1.03 0.00 0.00 52.86 52.39 1hae s ASN 28 Cb 0.26 0.35 -0.12 0.00 -3.03 0.00 0.00 41.25 38.71 1hae s ASN 28 CO -0.05 -0.18 0.83 1.55 -2.03 0.00 0.00 177.10 177.22 1hae h PRO 29 N 2.93 -0.45 0.00 3.55 0.13 -1.87 -3.44 132.00 132.85 1hae h PRO 29 Ca -0.20 0.03 -0.18 0.00 -0.87 0.00 0.00 66.00 64.78 1hae h PRO 29 Cb 1.18 0.10 -0.14 0.00 0.13 0.00 0.00 31.00 32.27 1hae h PRO 29 CO 0.22 -0.17 -0.35 0.43 -0.23 0.00 0.00 178.00 177.90 1hae n SER 30 N -5.10 -2.37 -4.59 1.44 7.64 -1.26 -5.01 113.62 104.37 1hae n SER 30 Ca -0.08 -2.94 -0.42 0.00 1.01 0.00 0.00 58.87 56.44 1hae n SER 30 Cb 0.25 1.56 -0.03 0.00 -1.01 0.00 0.00 64.21 64.99 1hae n SER 30 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hae s ARG 31 N 0.47 3.27 0.33 1.43 0.52 -1.26 -4.94 118.95 118.77 1hae s ARG 31 Ca 0.29 1.05 -0.08 0.00 -0.52 0.00 0.00 55.73 56.47 1hae s ARG 31 Cb 0.24 -4.18 -0.06 0.00 0.52 0.00 0.00 34.95 31.47 1hae s ARG 31 CO -0.18 -1.95 0.64 0.71 0.02 0.00 0.00 175.30 174.55 1hae s TYR 32 N 6.82 3.47 -0.20 -0.53 2.02 -1.26 -1.18 117.35 126.49 1hae s TYR 32 Ca 0.70 0.83 -0.04 0.00 -0.37 0.00 0.00 57.07 58.19 1hae s TYR 32 Cb -0.17 -2.26 0.10 0.00 -0.40 0.00 0.00 41.96 39.23 1hae s TYR 32 CO 0.30 0.07 0.32 -1.17 -1.57 0.00 0.00 175.55 173.50 1hae s LEU 33 N -3.61 -0.44 -0.21 -1.29 0.20 -0.34 -4.95 118.68 108.04 1hae s LEU 33 Ca 0.47 0.36 -0.04 0.00 0.69 0.00 0.00 54.13 55.61 1hae s LEU 33 Cb -0.11 0.89 -0.02 0.00 -0.43 0.00 0.00 46.19 46.53 1hae s LEU 33 CO 0.30 -0.28 -0.02 0.00 -0.29 0.00 0.00 176.35 176.05 1hae s LYS 35 N 1.21 3.72 0.59 0.00 1.02 -0.17 -4.89 119.74 121.22 1hae s LYS 35 Ca 0.03 -1.53 -0.14 0.00 0.02 0.00 0.00 55.97 54.35 1hae s LYS 35 Cb -0.14 -5.32 -0.05 0.00 -0.52 0.00 0.00 37.83 31.80 1hae s LYS 35 CO -0.00 -2.13 1.02 0.00 -0.92 0.00 0.00 175.35 173.33 1hae s GLN 37 N -4.53 2.93 -0.04 0.00 -1.52 -1.26 -4.95 119.66 110.30 1hae s GLN 37 Ca 0.59 1.09 -0.36 0.00 -1.95 0.00 0.00 55.36 54.72 1hae s GLN 37 Cb -0.12 -1.99 -0.14 0.00 -0.22 0.00 0.00 33.01 30.54 1hae s GLN 37 CO 0.42 -1.11 1.68 -2.30 -0.25 0.00 0.00 175.29 173.73 1hae n PRO 38 N -2.83 1.76 -1.55 2.91 -0.02 -1.26 -3.43 135.00 130.58 1hae n PRO 38 Ca 0.08 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1hae n PRO 38 Cb 0.53 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 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 3.78 0.56 2.99 -1.23 0.00 -1.26 -4.97 105.19 105.06 1hae n GLY 39 Ca 0.21 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.53 0.20 0.23 1.61 0.08 -1.22 -1.02 117.98 115.33 1hae s PHE 40 Ca 0.00 -0.41 -0.08 0.00 0.12 0.00 0.00 56.93 56.56 1hae s PHE 40 Cb 0.00 -0.15 -0.02 0.00 -0.57 0.00 0.00 43.02 42.28 1hae s PHE 40 CO 0.00 -0.19 0.33 -0.08 -0.10 0.00 0.00 175.22 175.19 1hae s THR 41 N -1.30 0.00 0.00 0.64 -1.32 0.10 -4.88 115.64 108.88 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 -0.09 -2.34 0.00 0.00 -1.51 0.00 0.00 72.50 68.57 1hae s THR 41 CO -0.01 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 1hae n GLY 42 N -0.34 2.17 0.36 6.08 0.00 -1.26 -1.99 105.19 110.21 1hae n GLY 42 Ca -0.00 -1.88 0.09 0.00 0.00 0.00 0.00 46.02 44.23 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 1.60 -0.47 4.61 0.00 -2.01 -1.20 119.26 121.79 1hae h ALA 43 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1hae h ALA 43 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1hae h ALA 43 CO 0.00 0.13 0.00 0.54 0.00 0.00 0.00 179.25 179.92 1hae n ARG 44 N -4.64 2.57 -3.80 0.00 1.74 -1.26 -4.92 116.66 106.35 1hae n ARG 44 Ca 0.20 -2.39 -0.25 0.00 -0.77 0.00 0.00 57.85 54.64 1hae n ARG 44 Cb 0.42 -1.53 0.03 0.00 -1.02 0.00 0.00 32.46 30.35 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 -1.94 0.86 -3.56 0.00 1.35 -1.78 -3.40 112.91 104.44 1hae h THR 46 Ca -0.60 -2.56 -0.62 0.00 -0.55 0.00 0.00 66.41 62.07 1hae h THR 46 Cb 1.37 2.60 -0.13 0.00 -1.73 0.00 0.00 68.15 70.26 1hae h THR 46 CO 0.61 0.79 0.26 -1.61 -0.25 0.00 0.00 175.52 175.32 1hae s GLU 47 N -2.59 3.66 0.42 4.72 2.02 -0.84 -4.95 118.70 121.14 1hae s GLU 47 Ca -0.14 0.12 -0.24 0.00 0.02 0.00 0.00 54.97 54.72 1hae s GLU 47 Cb 0.07 -3.83 -0.08 0.00 0.10 0.00 0.00 34.13 30.39 1hae s GLU 47 CO 0.82 -0.84 1.18 0.54 0.02 0.00 0.00 175.26 176.98 1hae s ASN 48 N 1.86 6.38 0.00 -0.19 4.22 -1.26 -0.72 114.94 125.23 1hae s ASN 48 Ca 0.28 2.35 -0.04 0.00 -2.14 0.00 0.00 52.86 53.31 1hae s ASN 48 Cb -0.14 -2.61 -0.01 0.00 1.28 0.00 0.00 41.25 39.78 1hae s ASN 48 CO 0.17 -0.78 0.06 0.68 -2.04 0.00 0.00 177.10 175.19 1hae s VAL 49 N -1.45 0.08 -0.22 3.54 -7.23 -0.19 -4.88 120.40 110.05 1hae s VAL 49 Ca 0.59 -0.66 -0.25 0.00 -1.81 0.00 0.00 61.98 59.85 1hae s VAL 49 Cb -0.30 -0.31 -0.00 0.00 0.56 0.00 0.00 36.38 36.32 1hae s VAL 49 CO 0.38 -0.36 0.86 -2.16 -0.31 0.00 0.00 175.10 173.51 1hae s PRO 50 N -1.17 4.22 -0.06 4.82 0.04 -1.26 -4.35 135.00 137.23 1hae s PRO 50 Ca -0.13 1.02 0.02 0.00 0.04 0.00 0.00 61.00 61.95 1hae s PRO 50 Cb -0.07 -3.63 -0.05 0.00 0.04 0.00 0.00 34.50 30.79 1hae s PRO 50 CO 0.00 -0.49 -0.03 0.00 0.04 0.00 0.00 177.00 176.52 1hae n MET 51 N 5.89 1.12 -0.06 4.56 0.00 -1.26 -4.58 117.12 122.79 1hae n MET 51 Ca 0.06 0.02 -0.09 0.00 0.00 0.00 0.00 57.70 57.70 1hae n MET 51 Cb 0.48 -1.13 -0.02 0.00 0.00 0.00 0.00 33.22 32.55 1hae n MET 51 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1hae h LYS 52 N 0.00 0.24 -1.29 3.17 1.63 -1.99 -1.79 116.57 116.53 1hae h LYS 52 Ca -0.14 -0.01 -0.44 0.00 -0.85 0.00 0.00 60.65 59.21 1hae h LYS 52 Cb 1.25 -0.05 -0.19 0.00 -0.60 0.00 0.00 32.23 32.63 1hae h LYS 52 CO -0.01 0.16 0.56 1.33 -3.45 0.00 0.00 179.45 178.04 1hae n VAL 53 N -5.00 3.00 0.00 2.00 0.24 -1.26 -3.93 118.33 113.38 1hae n VAL 53 Ca -0.02 -2.00 0.00 0.00 -2.04 0.00 0.00 64.34 60.29 1hae n VAL 53 Cb 0.07 -1.19 0.00 0.00 -1.47 0.00 0.00 33.84 31.25 1hae n VAL 53 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1hae n GLN 54 N -0.17 0.00 0.23 7.34 -0.06 -0.75 -4.74 117.38 119.22 1hae n GLN 54 Ca 0.42 0.00 0.15 0.00 -2.00 0.00 0.00 57.00 55.57 1hae n GLN 54 Cb 0.70 -0.34 0.80 0.00 -4.06 0.00 0.00 30.24 27.34 1hae n GLN 54 CO 0.00 0.00 0.00 -2.95 -0.20 0.00 0.00 177.06 173.91 1hae h ASN 55 N 0.00 0.00 -0.86 1.69 -1.07 -1.48 -2.29 115.58 111.58 1hae h ASN 55 Ca 0.00 0.00 0.07 0.00 0.07 0.00 0.00 56.30 56.44 1hae h ASN 55 Cb 0.42 0.00 -0.07 0.00 -2.07 0.00 0.00 38.32 36.61 1hae h ASN 55 CO 0.00 0.00 0.52 1.56 0.07 0.00 0.00 177.43 179.58 1hae h GLN 56 N 0.00 0.89 -0.52 4.14 1.08 -1.85 -0.02 115.11 118.83 1hae h GLN 56 Ca 0.00 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.11 1hae h GLN 56 Cb 0.07 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 1hae h GLN 56 CO 0.00 0.59 0.16 1.49 -0.95 0.00 0.00 178.83 180.12 1hae h GLU 57 N 0.92 0.80 -0.31 1.46 4.57 -1.76 -1.39 114.58 118.87 1hae h GLU 57 Ca 0.39 -0.17 -0.04 0.00 -1.18 0.00 0.00 59.36 58.35 1hae h GLU 57 Cb 0.25 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1hae h GLU 57 CO -0.20 0.74 0.02 0.87 -1.18 0.00 0.00 179.01 179.26 1hae h LYS 58 N 0.70 0.53 -1.05 1.92 6.56 -1.59 -2.83 116.57 120.82 1hae h LYS 58 Ca 0.17 -0.16 -0.19 0.00 -1.06 0.00 0.00 60.65 59.41 1hae h LYS 58 Cb 0.27 -0.05 -0.11 0.00 -0.57 0.00 0.00 32.23 31.77 1hae h LYS 58 CO -0.01 0.65 0.24 0.00 -2.06 0.00 0.00 179.45 178.28 1hae n ALA 59 N -2.35 3.70 0.05 3.86 0.00 -0.06 -4.26 120.51 121.44 1hae n ALA 59 Ca -0.02 -1.04 -0.03 0.00 0.00 0.00 0.00 53.44 52.34 1hae n ALA 59 Cb 0.24 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 1hae n ALA 59 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1hae h GLU 60 N 0.43 -0.21 -1.22 0.00 4.81 -0.99 -3.47 114.58 113.94 1hae h GLU 60 Ca 0.23 0.01 0.24 0.00 -0.13 0.00 0.00 59.36 59.71 1hae h GLU 60 Cb 1.61 0.05 -0.24 0.00 0.63 0.00 0.00 28.75 30.80 1hae h GLU 60 CO 0.41 -0.14 0.88 -2.00 -0.73 0.00 0.00 179.01 177.43 1hae s GLU 61 N -2.24 0.17 -1.43 1.92 -6.30 -1.26 -5.06 118.70 104.50 1hae s GLU 61 Ca -0.03 -0.01 -0.14 0.00 -2.50 0.00 0.00 54.97 52.28 1hae s GLU 61 Cb 0.00 0.08 0.03 0.00 0.00 0.00 0.00 34.13 34.25 1hae s GLU 61 CO 0.09 -0.06 2.20 1.28 0.02 0.00 0.00 175.26 178.79 1hae n LEU 62 N 0.29 6.70 -0.41 2.70 4.77 -1.26 -4.96 117.00 124.82 1hae n LEU 62 Ca 0.00 -4.09 0.14 0.00 -0.03 0.00 0.00 56.01 52.03 1hae n LEU 62 Cb 0.58 -1.65 0.58 0.00 -2.33 0.00 0.00 43.42 40.61 1hae n LEU 62 CO 0.09 1.02 0.90 0.00 -1.33 0.00 0.00 177.39 178.07