#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cff s THR 6 N 0.00 3.24 0.45 -5.08 -4.23 -1.26 -5.05 115.64 103.71 3cff s THR 6 Ca 0.00 -1.93 0.11 0.00 -1.18 0.00 0.00 61.69 58.70 3cff s THR 6 Cb 0.00 -2.82 0.23 0.00 1.34 0.00 0.00 72.50 71.25 3cff s THR 6 CO 0.00 -0.33 2.05 -0.33 -0.54 0.00 0.00 174.62 175.46 3cff h GLU 7 N 1.86 0.22 -4.97 3.99 5.08 -2.01 -3.29 114.58 115.47 3cff h GLU 7 Ca -0.44 -0.02 -0.66 0.00 -1.00 0.00 0.00 59.36 57.24 3cff h GLU 7 Cb 1.25 -0.04 -0.28 0.00 0.50 0.00 0.00 28.75 30.18 3cff h GLU 7 CO 0.61 0.22 -0.71 0.99 -1.00 0.00 0.00 179.01 179.12 3cff s THR 8 N -5.07 3.42 -0.14 1.13 2.01 -1.26 -4.08 115.64 111.65 3cff s THR 8 Ca -0.06 -0.55 0.00 0.00 0.31 0.00 0.00 61.69 61.39 3cff s THR 8 Cb 0.17 -2.59 0.02 0.00 0.01 0.00 0.00 72.50 70.10 3cff s THR 8 CO 0.71 0.37 -0.13 -0.32 -0.69 0.00 0.00 174.62 174.55 3cff s MET 9 N 1.47 2.12 0.45 4.92 1.75 -0.11 -4.95 119.30 124.95 3cff s MET 9 Ca 0.05 -0.49 -0.14 0.00 -1.25 0.00 0.00 55.69 53.86 3cff s MET 9 Cb -0.15 -1.96 -0.08 0.00 2.84 0.00 0.00 34.83 35.48 3cff s MET 9 CO -0.03 -0.22 0.87 -1.25 -0.65 0.00 0.00 175.02 173.74 3cff s PRO 10 N 1.47 3.90 0.03 4.11 0.04 -1.26 -1.62 135.00 141.67 3cff s PRO 10 Ca 0.03 0.73 -0.07 0.00 0.04 0.00 0.00 61.00 61.73 3cff s PRO 10 Cb -0.13 -2.27 -0.00 0.00 0.04 0.00 0.00 34.50 32.13 3cff s PRO 10 CO -0.09 -0.12 0.14 -0.59 0.04 0.00 0.00 177.00 176.39 3cff s PHE 11 N -2.43 0.12 0.09 0.56 -0.12 -0.23 -4.95 117.98 111.02 3cff s PHE 11 Ca 0.55 -0.37 0.04 0.00 -0.05 0.00 0.00 56.93 57.11 3cff s PHE 11 Cb -0.10 -0.08 -0.03 0.00 -0.63 0.00 0.00 43.02 42.17 3cff s PHE 11 CO 0.29 -0.39 -0.12 -0.98 -0.05 0.00 0.00 175.22 173.97 3cff s ARG 12 N -2.47 0.86 -0.02 1.99 1.70 -1.26 -1.12 118.95 118.63 3cff s ARG 12 Ca -0.06 -1.09 -0.02 0.00 -0.47 0.00 0.00 55.73 54.08 3cff s ARG 12 Cb -0.02 -0.68 0.00 0.00 -0.57 0.00 0.00 34.95 33.68 3cff s ARG 12 CO -0.04 0.13 0.06 1.41 -1.08 0.00 0.00 175.30 175.78 3cff s MET 13 N -2.39 0.10 -0.03 3.89 -2.45 0.43 -4.97 119.30 113.88 3cff s MET 13 Ca 0.03 0.03 0.06 0.00 -1.25 0.00 0.00 55.69 54.57 3cff s MET 13 Cb -0.06 0.05 -0.01 0.00 1.25 0.00 0.00 34.83 36.05 3cff s MET 13 CO 0.01 -0.01 -0.21 0.95 1.05 0.00 0.00 175.02 176.80 3cff s THR 14 N -0.10 1.72 -0.03 10.11 -4.23 -1.26 -0.29 115.64 121.56 3cff s THR 14 Ca -0.01 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.59 3cff s THR 14 Cb -0.01 -1.44 0.02 0.00 1.34 0.00 0.00 72.50 72.41 3cff s THR 14 CO 0.00 0.49 -0.02 -0.32 -0.54 0.00 0.00 174.62 174.23 3cff s MET 15 N -0.37 0.46 -0.02 3.99 1.75 0.50 -4.98 119.30 120.63 3cff s MET 15 Ca 0.05 -0.02 0.03 0.00 -1.25 0.00 0.00 55.69 54.50 3cff s MET 15 Cb -0.10 -0.56 -0.00 0.00 2.84 0.00 0.00 34.83 37.01 3cff s MET 15 CO 0.00 -0.08 -0.10 -2.00 -0.65 0.00 0.00 175.02 172.20 3cff s GLU 16 N 0.79 0.93 0.21 4.11 2.56 -1.26 0.08 118.70 126.12 3cff s GLU 16 Ca -0.09 -0.33 -0.22 0.00 0.00 0.00 0.00 54.97 54.33 3cff s GLU 16 Cb -0.12 -0.88 0.06 0.00 2.00 0.00 0.00 34.13 35.19 3cff s GLU 16 CO -0.01 0.15 0.93 0.20 -0.56 0.00 0.00 175.26 175.97 3cff s GLY 17 N 0.04 -0.04 -0.06 -1.50 0.00 -0.85 -5.03 107.32 99.88 3cff s GLY 17 Ca -0.01 -0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.55 3cff s GLY 17 CO 0.00 0.59 -0.06 -1.59 0.00 0.00 0.00 173.10 172.03 3cff s THR 18 N -2.93 0.75 -0.12 0.90 2.01 -1.26 -1.50 115.64 113.49 3cff s THR 18 Ca 0.15 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.94 3cff s THR 18 Cb -0.03 -0.76 0.02 0.00 0.01 0.00 0.00 72.50 71.75 3cff s THR 18 CO 0.05 0.29 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.47 3cff s VAL 19 N 1.10 1.26 -1.45 3.82 1.01 -0.31 -4.77 120.40 121.04 3cff s VAL 19 Ca -0.08 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 3cff s VAL 19 Cb -0.14 -1.21 0.09 0.00 0.00 0.00 0.00 36.38 35.12 3cff s VAL 19 CO -0.01 0.40 0.69 0.59 0.00 0.00 0.00 175.10 176.77 3cff n ASN 20 N 4.74 -4.03 0.00 3.32 4.13 -1.26 -0.83 115.26 121.33 3cff n ASN 20 Ca -0.15 -0.61 0.00 0.00 1.68 0.00 0.00 54.58 55.49 3cff n ASN 20 Cb 0.50 -3.29 0.00 0.00 -1.54 0.00 0.00 39.78 35.45 3cff n ASN 20 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3cff n GLY 21 N -1.36 1.52 3.58 7.41 0.00 -1.26 -5.02 105.19 110.05 3cff n GLY 21 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3cff n GLY 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3cff s HIS 22 N -2.92 3.20 0.25 1.61 5.04 -0.01 -5.06 115.29 117.40 3cff s HIS 22 Ca 0.00 0.33 -0.25 0.00 -1.54 0.00 0.00 55.06 53.59 3cff s HIS 22 Cb 0.00 -2.88 -0.09 0.00 0.04 0.00 0.00 32.58 29.65 3cff s HIS 22 CO 0.00 -0.47 0.86 -1.58 -2.34 0.00 0.00 174.74 171.21 3cff s HIS 23 N 2.39 3.80 0.09 3.88 2.46 -1.26 -1.16 115.29 125.49 3cff s HIS 23 Ca 0.20 1.70 -0.16 0.00 0.47 0.00 0.00 55.06 57.27 3cff s HIS 23 Cb -0.15 -2.84 0.03 0.00 -0.13 0.00 0.00 32.58 29.49 3cff s HIS 23 CO 0.12 0.37 0.37 -0.59 -2.47 0.00 0.00 174.74 172.54 3cff s PHE 24 N -1.38 -0.17 0.02 3.88 -0.12 -0.56 -4.17 117.98 115.47 3cff s PHE 24 Ca 0.43 -0.05 0.03 0.00 -0.05 0.00 0.00 56.93 57.29 3cff s PHE 24 Cb -0.21 0.19 -0.01 0.00 -0.63 0.00 0.00 43.02 42.36 3cff s PHE 24 CO 0.26 -0.62 -0.09 0.15 -0.05 0.00 0.00 175.22 174.86 3cff s LYS 25 N -3.27 0.68 0.11 1.99 1.02 -0.24 -2.00 119.74 118.03 3cff s LYS 25 Ca -0.00 -0.51 0.06 0.00 0.02 0.00 0.00 55.97 55.53 3cff s LYS 25 Cb 0.01 -0.62 -0.03 0.00 -0.52 0.00 0.00 37.83 36.67 3cff s LYS 25 CO -0.08 0.16 -0.14 0.00 -0.92 0.00 0.00 175.35 174.36 3cff s THR 27 N -1.83 1.48 0.06 0.00 -4.23 -0.27 -0.37 115.64 110.48 3cff s THR 27 Ca 0.06 -2.14 -0.23 0.00 -1.18 0.00 0.00 61.69 58.20 3cff s THR 27 Cb -0.07 -2.00 0.06 0.00 1.34 0.00 0.00 72.50 71.83 3cff s THR 27 CO 0.03 -0.63 0.54 -0.83 -0.54 0.00 0.00 174.62 173.18 3cff s GLY 28 N -3.26 -0.46 0.01 3.99 0.00 0.60 -0.72 107.32 107.48 3cff s GLY 28 Ca 0.21 0.59 -0.04 0.00 0.00 0.00 0.00 44.72 45.48 3cff s GLY 28 CO 0.05 0.29 0.06 -1.59 0.00 0.00 0.00 173.10 171.91 3cff s LYS 29 N -2.66 0.43 0.04 2.90 -2.85 -0.91 -0.43 119.74 116.26 3cff s LYS 29 Ca -0.04 -0.54 -0.02 0.00 -1.00 0.00 0.00 55.97 54.37 3cff s LYS 29 Cb -0.00 0.17 0.01 0.00 -2.06 0.00 0.00 37.83 35.94 3cff s LYS 29 CO -0.03 -0.09 0.09 0.41 0.10 0.00 0.00 175.35 175.82 3cff n GLY 30 N 1.40 1.72 3.32 0.59 0.00 -0.27 -0.76 105.19 111.19 3cff n GLY 30 Ca -0.23 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.67 3cff n GLY 30 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3cff s GLU 31 N -2.01 1.07 0.19 1.61 -1.05 -0.69 -1.07 118.70 116.75 3cff s GLU 31 Ca 0.02 -0.69 -0.23 0.00 -0.15 0.00 0.00 54.97 53.92 3cff s GLU 31 Cb -0.00 0.47 0.07 0.00 -0.44 0.00 0.00 34.13 34.22 3cff s GLU 31 CO 0.01 -0.42 0.99 0.20 0.95 0.00 0.00 175.26 176.99 3cff s GLY 32 N -2.78 -0.03 -0.48 -3.83 0.00 -0.64 -1.45 107.32 98.11 3cff s GLY 32 Ca 0.03 -0.15 -0.16 0.00 0.00 0.00 0.00 44.72 44.44 3cff s GLY 32 CO -0.12 1.05 0.44 0.21 0.00 0.00 0.00 173.10 174.68 3cff s ASN 33 N -3.16 6.16 0.43 1.64 3.84 -0.17 -0.94 114.94 122.74 3cff s ASN 33 Ca 0.17 -1.31 0.13 0.00 0.21 0.00 0.00 52.86 52.06 3cff s ASN 33 Cb -0.02 -2.20 1.01 0.00 -0.55 0.00 0.00 41.25 39.48 3cff s ASN 33 CO 0.04 -0.70 1.97 -0.65 -2.79 0.00 0.00 177.10 174.97 3cff h PRO 34 N 8.80 0.43 0.00 0.43 0.11 -1.81 0.48 132.00 140.44 3cff h PRO 34 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3cff h PRO 34 Cb 1.11 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3cff h PRO 34 CO 0.91 0.28 -1.22 1.19 -0.21 0.00 0.00 178.00 178.95 3cff n PHE 35 N -4.47 0.42 0.68 0.65 3.01 -1.26 -3.72 117.46 112.76 3cff n PHE 35 Ca 0.10 0.12 0.11 0.00 1.01 0.00 0.00 57.45 58.79 3cff n PHE 35 Cb 0.38 -0.60 -0.04 0.00 -0.01 0.00 0.00 39.48 39.21 3cff n PHE 35 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 3cff n GLU 36 N -2.24 0.21 -1.95 -1.08 2.13 -1.00 -5.01 120.64 111.71 3cff n GLU 36 Ca 0.00 -0.03 -0.06 0.00 0.66 0.00 0.00 57.16 57.73 3cff n GLU 36 Cb 0.50 -1.54 -0.01 0.00 0.27 0.00 0.00 31.44 30.66 3cff n GLU 36 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cff n GLY 37 N 1.41 0.25 3.45 8.31 0.00 0.13 -5.03 105.19 113.71 3cff n GLY 37 Ca 0.02 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 3cff n GLY 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cff s THR 38 N -2.27 2.60 -0.05 2.61 -4.23 -1.14 -5.00 115.64 108.16 3cff s THR 38 Ca 0.00 -1.71 -0.30 0.00 -1.18 0.00 0.00 61.69 58.50 3cff s THR 38 Cb 0.00 -2.21 0.08 0.00 1.34 0.00 0.00 72.50 71.72 3cff s THR 38 CO 0.00 0.03 0.75 0.00 -0.54 0.00 0.00 174.62 174.86 3cff s GLN 39 N -2.31 0.97 0.05 3.99 -2.07 -1.26 -1.00 119.66 118.04 3cff s GLN 39 Ca 0.18 0.14 0.03 0.00 -1.82 0.00 0.00 55.36 53.90 3cff s GLN 39 Cb -0.10 0.46 -0.03 0.00 -1.09 0.00 0.00 33.01 32.25 3cff s GLN 39 CO 0.09 -0.32 -0.10 -0.51 -1.32 0.00 0.00 175.29 173.13 3cff s ASP 40 N -1.38 1.17 0.10 12.60 1.11 -0.53 -5.00 116.67 124.75 3cff s ASP 40 Ca -0.07 -0.58 -0.15 0.00 0.18 0.00 0.00 52.55 51.92 3cff s ASP 40 Cb -0.00 0.01 0.03 0.00 1.07 0.00 0.00 42.92 44.02 3cff s ASP 40 CO 0.05 -0.16 0.37 0.00 1.18 0.00 0.00 175.17 176.61 3cff s MET 41 N -1.68 0.99 -0.10 8.23 0.23 -1.26 -1.70 119.30 124.02 3cff s MET 41 Ca -0.07 -0.66 -0.02 0.00 -1.03 0.00 0.00 55.69 53.91 3cff s MET 41 Cb -0.10 0.43 -0.03 0.00 -1.53 0.00 0.00 34.83 33.60 3cff s MET 41 CO 0.01 -0.37 -0.00 0.15 -2.03 0.00 0.00 175.02 172.78 3cff s LYS 42 N -3.48 3.14 -0.08 3.16 1.02 0.06 -4.97 119.74 118.59 3cff s LYS 42 Ca 0.01 -0.42 0.04 0.00 0.02 0.00 0.00 55.97 55.62 3cff s LYS 42 Cb 0.02 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.49 3cff s LYS 42 CO -0.09 0.61 -0.20 0.42 -0.92 0.00 0.00 175.35 175.17 3cff s ILE 43 N -0.63 1.75 -0.07 2.17 1.09 -1.26 -2.14 121.20 122.10 3cff s ILE 43 Ca 0.10 -0.85 0.05 0.00 -1.10 0.00 0.00 60.65 58.86 3cff s ILE 43 Cb -0.12 -1.52 -0.01 0.00 -1.06 0.00 0.00 42.46 39.75 3cff s ILE 43 CO 0.02 0.49 -0.24 -0.70 -0.10 0.00 0.00 174.94 174.41 3cff s GLU 44 N 0.35 2.73 -0.55 2.79 2.12 0.11 -4.99 118.70 121.26 3cff s GLU 44 Ca -0.15 -0.88 -0.23 0.00 0.36 0.00 0.00 54.97 54.06 3cff s GLU 44 Cb -0.16 -2.23 0.04 0.00 0.26 0.00 0.00 34.13 32.04 3cff s GLU 44 CO 0.06 0.32 0.90 0.08 -0.54 0.00 0.00 175.26 176.08 3cff s VAL 45 N -0.01 4.45 -0.29 3.70 1.01 -1.26 -1.12 120.40 126.88 3cff s VAL 45 Ca -0.08 0.16 0.23 0.00 0.00 0.00 0.00 61.98 62.29 3cff s VAL 45 Cb -0.15 -4.51 -0.09 0.00 0.00 0.00 0.00 36.38 31.63 3cff s VAL 45 CO 0.05 -1.08 0.94 2.30 0.00 0.00 0.00 175.10 177.31 3cff n ILE 46 N 6.11 0.39 -3.88 2.22 -5.35 -0.25 -4.67 119.36 113.93 3cff n ILE 46 Ca 0.00 -0.46 -0.11 0.00 -0.27 0.00 0.00 62.75 61.91 3cff n ILE 46 Cb 0.47 -0.15 -0.12 0.00 -1.74 0.00 0.00 39.64 38.10 3cff n ILE 46 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3cff s GLU 47 N -3.35 0.19 -0.02 6.28 2.02 -1.07 -4.87 118.70 117.88 3cff s GLU 47 Ca -0.01 -0.13 0.00 0.00 0.02 0.00 0.00 54.97 54.85 3cff s GLU 47 Cb 0.12 0.08 0.00 0.00 0.10 0.00 0.00 34.13 34.42 3cff s GLU 47 CO 0.81 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 176.47 3cff n GLY 48 N 2.50 0.47 3.87 -1.39 0.00 -1.26 -1.07 105.19 108.30 3cff n GLY 48 Ca -0.16 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 3cff n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cff s GLY 49 N -2.28 2.06 0.15 -0.02 0.00 -1.26 -3.76 107.32 102.21 3cff s GLY 49 Ca 0.00 -0.13 -0.30 0.00 0.00 0.00 0.00 44.72 44.29 3cff s GLY 49 CO 0.00 0.07 1.17 2.56 0.00 0.00 0.00 173.10 176.90 3cff s PRO 50 N -3.58 4.50 -0.16 2.90 0.04 -1.26 -5.06 135.00 132.37 3cff s PRO 50 Ca 0.52 1.81 -0.38 0.00 0.04 0.00 0.00 61.00 62.99 3cff s PRO 50 Cb -0.10 -3.28 -0.15 0.00 0.04 0.00 0.00 34.50 31.01 3cff s PRO 50 CO 0.27 -0.09 1.67 1.28 0.04 0.00 0.00 177.00 180.17 3cff n LEU 51 N 2.85 2.40 -0.93 -3.56 4.77 -1.25 -4.83 117.00 116.45 3cff n LEU 51 Ca 0.05 1.07 0.02 0.00 -0.03 0.00 0.00 56.01 57.13 3cff n LEU 51 Cb 0.45 -1.19 0.13 0.00 -2.33 0.00 0.00 43.42 40.49 3cff n LEU 51 CO 0.55 -0.51 0.47 -0.81 -1.33 0.00 0.00 177.39 175.77 3cff n PRO 52 N 4.87 2.25 -3.92 3.23 -0.04 -1.26 -4.83 135.00 135.30 3cff n PRO 52 Ca 0.24 -1.04 -0.09 0.00 -0.04 0.00 0.00 63.50 62.56 3cff n PRO 52 Cb 0.17 -1.72 -0.07 0.00 -0.04 0.00 0.00 33.50 31.84 3cff n PRO 52 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3cff s PHE 53 N -1.60 0.30 0.06 0.54 -0.12 -1.26 -5.13 117.98 110.77 3cff s PHE 53 Ca 0.18 -0.68 -0.30 0.00 -0.05 0.00 0.00 56.93 56.07 3cff s PHE 53 Cb 0.14 -0.04 -0.09 0.00 -0.63 0.00 0.00 43.02 42.40 3cff s PHE 53 CO 0.06 -0.68 1.81 0.00 -0.05 0.00 0.00 175.22 176.36 3cff s ALA 54 N -3.93 3.66 0.62 1.99 0.00 -1.26 -4.87 121.76 117.97 3cff s ALA 54 Ca 0.13 1.27 0.34 0.00 0.00 0.00 0.00 51.96 53.71 3cff s ALA 54 Cb 0.04 -3.77 2.00 0.00 0.00 0.00 0.00 23.12 21.38 3cff s ALA 54 CO -0.03 -1.34 2.27 0.35 0.00 0.00 0.00 175.76 177.02 3cff h PHE 55 N 9.32 0.00 -0.96 0.00 3.57 -2.00 -2.93 116.94 123.94 3cff h PHE 55 Ca -0.45 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.28 3cff h PHE 55 Cb 1.21 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.88 3cff h PHE 55 CO 0.86 0.00 0.64 -0.44 -2.23 0.00 0.00 178.31 177.13 3cff h ASP 56 N 0.00 0.38 0.50 0.41 3.32 -2.02 0.89 116.42 119.90 3cff h ASP 56 Ca 0.01 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3cff h ASP 56 Cb 0.06 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3cff h ASP 56 CO -0.00 0.12 0.00 2.30 -1.72 0.00 0.00 179.24 179.94 3cff n ILE 57 N -4.52 0.91 0.74 0.35 -5.35 -1.11 -2.20 119.36 108.19 3cff n ILE 57 Ca 0.21 0.38 0.10 0.00 -0.27 0.00 0.00 62.75 63.18 3cff n ILE 57 Cb 0.79 -1.33 -0.13 0.00 -1.74 0.00 0.00 39.64 37.24 3cff n ILE 57 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3cff n LEU 58 N -2.22 0.74 -0.21 7.28 4.77 0.30 -4.65 117.00 123.01 3cff n LEU 58 Ca 0.01 -0.36 0.02 0.00 -0.03 0.00 0.00 56.01 55.64 3cff n LEU 58 Cb 0.17 -0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.38 3cff n LEU 58 CO 0.16 0.18 0.95 0.28 -1.33 0.00 0.00 177.39 177.64 3cff h SER 59 N 0.00 0.10 0.00 -1.43 0.02 -1.40 -0.93 113.55 109.92 3cff h SER 59 Ca 0.00 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3cff h SER 59 Cb 0.63 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3cff h SER 59 CO 0.00 0.05 0.00 0.35 -1.14 0.00 0.00 176.83 176.09 3cff n THR 60 N -5.08 0.00 0.40 -2.27 -2.24 -1.26 -2.71 114.28 101.12 3cff n THR 60 Ca 0.10 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.92 3cff n THR 60 Cb 0.33 -0.60 -0.00 0.00 -2.10 0.00 0.00 70.33 67.96 3cff n THR 60 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3cff n SER 61 N -0.92 1.10 -0.30 3.42 7.64 -0.36 -5.25 113.62 118.96 3cff n SER 61 Ca 0.13 -1.05 0.15 0.00 1.01 0.00 0.00 58.87 59.10 3cff n SER 61 Cb 0.06 0.50 0.68 0.00 -1.01 0.00 0.00 64.21 64.43 3cff n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03