#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 4.47 -1.14 -5.08 -4.23 -1.26 -4.95 115.64 103.45 3cff s THR 6 Ca 0.00 1.34 0.10 0.00 -1.18 0.00 0.00 61.69 61.95 3cff s THR 6 Cb 0.00 -3.63 0.12 0.00 1.34 0.00 0.00 72.50 70.33 3cff s THR 6 CO 0.00 -0.39 1.30 -0.62 -0.54 0.00 0.00 174.62 174.37 3cff n GLU 7 N -0.83 0.05 -3.83 3.99 1.02 -1.26 -4.09 120.64 115.70 3cff n GLU 7 Ca 0.06 0.28 -0.23 0.00 -0.02 0.00 0.00 57.16 57.25 3cff n GLU 7 Cb 0.54 -1.50 -0.17 0.00 -0.02 0.00 0.00 31.44 30.29 3cff n GLU 7 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3cff s THR 8 N -2.86 0.48 -0.09 2.62 2.01 -1.26 -4.24 115.64 112.30 3cff s THR 8 Ca 0.07 0.04 0.02 0.00 0.31 0.00 0.00 61.69 62.13 3cff s THR 8 Cb 0.07 -0.61 0.01 0.00 0.01 0.00 0.00 72.50 71.98 3cff s THR 8 CO 0.18 0.27 -0.16 -0.32 -0.69 0.00 0.00 174.62 173.90 3cff s MET 9 N 1.84 2.22 0.43 4.92 0.00 0.15 -4.96 119.30 123.90 3cff s MET 9 Ca 0.04 -0.58 -0.07 0.00 0.00 0.00 0.00 55.69 55.08 3cff s MET 9 Cb -0.12 -1.81 -0.05 0.00 0.00 0.00 0.00 34.83 32.85 3cff s MET 9 CO -0.05 0.02 0.74 -1.25 0.00 0.00 0.00 175.02 174.49 3cff s PRO 10 N 0.73 3.63 0.04 4.11 0.04 -1.26 -1.25 135.00 141.03 3cff s PRO 10 Ca -0.12 0.24 -0.06 0.00 0.04 0.00 0.00 61.00 61.11 3cff s PRO 10 Cb -0.16 -2.42 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 3cff s PRO 10 CO 0.03 -0.09 0.10 -0.59 0.04 0.00 0.00 177.00 176.49 3cff s PHE 11 N -2.53 0.20 0.06 0.56 -0.12 0.29 -4.94 117.98 111.50 3cff s PHE 11 Ca 0.48 -0.50 0.05 0.00 -0.05 0.00 0.00 56.93 56.90 3cff s PHE 11 Cb -0.10 -0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.12 3cff s PHE 11 CO 0.38 -0.37 -0.13 -0.98 -0.05 0.00 0.00 175.22 174.07 3cff s ARG 12 N -2.63 0.79 0.00 1.99 1.70 -1.26 -1.19 118.95 118.35 3cff s ARG 12 Ca -0.05 -0.88 0.02 0.00 -0.47 0.00 0.00 55.73 54.35 3cff s ARG 12 Cb -0.01 -0.77 -0.01 0.00 -0.57 0.00 0.00 34.95 33.59 3cff s ARG 12 CO -0.05 0.17 -0.05 1.41 -1.08 0.00 0.00 175.30 175.71 3cff s MET 13 N -1.57 0.41 -0.03 3.89 1.75 -0.10 -4.97 119.30 118.67 3cff s MET 13 Ca -0.02 -0.26 0.05 0.00 -1.25 0.00 0.00 55.69 54.21 3cff s MET 13 Cb -0.09 -0.36 -0.01 0.00 2.84 0.00 0.00 34.83 37.21 3cff s MET 13 CO 0.02 0.09 -0.17 0.95 -0.65 0.00 0.00 175.02 175.26 3cff s THR 14 N -0.30 1.38 -0.03 10.11 -4.23 -1.26 -0.78 115.64 120.52 3cff s THR 14 Ca 0.00 -0.72 -0.00 0.00 -1.18 0.00 0.00 61.69 59.79 3cff s THR 14 Cb -0.03 -1.16 0.03 0.00 1.34 0.00 0.00 72.50 72.68 3cff s THR 14 CO -0.00 0.39 0.02 -0.32 -0.54 0.00 0.00 174.62 174.17 3cff s MET 15 N -0.21 0.15 -0.04 3.99 0.00 0.29 -5.00 119.30 118.48 3cff s MET 15 Ca 0.02 0.18 0.02 0.00 0.00 0.00 0.00 55.69 55.91 3cff s MET 15 Cb -0.09 -0.47 0.01 0.00 0.00 0.00 0.00 34.83 34.28 3cff s MET 15 CO 0.00 -0.20 -0.09 -1.83 0.00 0.00 0.00 175.02 172.91 3cff s GLU 16 N 1.37 1.09 0.24 4.11 1.03 -1.26 0.19 118.70 125.47 3cff s GLU 16 Ca -0.05 -0.28 -0.19 0.00 0.03 0.00 0.00 54.97 54.48 3cff s GLU 16 Cb -0.13 -0.99 0.02 0.00 -0.80 0.00 0.00 34.13 32.23 3cff s GLU 16 CO -0.03 0.05 0.61 0.20 -1.33 0.00 0.00 175.26 174.76 3cff s GLY 17 N 0.46 -0.00 -0.06 -3.83 0.00 -0.70 -5.03 107.32 98.16 3cff s GLY 17 Ca -0.08 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.32 3cff s GLY 17 CO 0.01 -0.23 -0.07 -1.59 0.00 0.00 0.00 173.10 171.23 3cff s THR 18 N -3.91 0.75 -0.12 0.90 2.01 -1.26 -0.81 115.64 113.19 3cff s THR 18 Ca 0.12 -0.23 -0.00 0.00 0.31 0.00 0.00 61.69 61.89 3cff s THR 18 Cb -0.03 -0.74 0.03 0.00 0.01 0.00 0.00 72.50 71.76 3cff s THR 18 CO 0.03 0.28 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.47 3cff s VAL 19 N 0.98 1.12 -1.55 3.82 1.01 -0.29 -4.80 120.40 120.69 3cff s VAL 19 Ca -0.10 -0.38 -0.14 0.00 0.00 0.00 0.00 61.98 61.36 3cff s VAL 19 Cb -0.14 -1.14 0.09 0.00 0.00 0.00 0.00 36.38 35.19 3cff s VAL 19 CO 0.00 0.35 0.97 0.59 0.00 0.00 0.00 175.10 177.01 3cff n ASN 20 N 4.91 -4.74 0.00 3.32 4.13 -1.26 -1.30 115.26 120.32 3cff n ASN 20 Ca -0.13 -0.79 0.00 0.00 1.68 0.00 0.00 54.58 55.34 3cff n ASN 20 Cb 0.50 -3.79 0.00 0.00 -1.54 0.00 0.00 39.78 34.95 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 -1.66 2.20 3.59 7.41 0.00 -1.26 -5.02 105.19 110.44 3cff n GLY 21 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3cff n GLY 21 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3cff s HIS 22 N -2.35 3.16 0.22 1.61 3.76 -0.42 -5.05 115.29 116.21 3cff s HIS 22 Ca 0.00 0.58 -0.23 0.00 -0.15 0.00 0.00 55.06 55.26 3cff s HIS 22 Cb 0.00 -3.23 -0.08 0.00 1.11 0.00 0.00 32.58 30.38 3cff s HIS 22 CO 0.00 -0.63 0.78 -1.58 -0.85 0.00 0.00 174.74 172.47 3cff s HIS 23 N 2.90 3.77 0.16 1.40 2.46 -1.26 -1.13 115.29 123.58 3cff s HIS 23 Ca 0.29 1.56 -0.16 0.00 0.47 0.00 0.00 55.06 57.22 3cff s HIS 23 Cb -0.14 -2.73 0.03 0.00 -0.13 0.00 0.00 32.58 29.61 3cff s HIS 23 CO 0.14 0.39 0.45 -0.59 -2.47 0.00 0.00 174.74 172.67 3cff s PHE 24 N -1.38 -0.11 -0.01 3.88 -0.12 0.01 -4.24 117.98 116.01 3cff s PHE 24 Ca 0.41 -0.22 -0.01 0.00 -0.05 0.00 0.00 56.93 57.06 3cff s PHE 24 Cb -0.20 0.30 0.00 0.00 -0.63 0.00 0.00 43.02 42.49 3cff s PHE 24 CO 0.24 -0.81 0.03 0.15 -0.05 0.00 0.00 175.22 174.77 3cff s LYS 25 N -3.85 0.07 0.07 1.99 1.02 -0.17 -1.72 119.74 117.15 3cff s LYS 25 Ca 0.07 -0.02 0.05 0.00 0.02 0.00 0.00 55.97 56.09 3cff s LYS 25 Cb 0.01 0.03 -0.03 0.00 -0.52 0.00 0.00 37.83 37.31 3cff s LYS 25 CO -0.06 -0.01 -0.14 0.00 -0.92 0.00 0.00 175.35 174.22 3cff s THR 27 N -1.42 2.36 -0.00 0.00 -4.23 -0.34 -0.55 115.64 111.46 3cff s THR 27 Ca -0.01 -2.26 -0.12 0.00 -1.18 0.00 0.00 61.69 58.11 3cff s THR 27 Cb -0.09 -2.21 0.02 0.00 1.34 0.00 0.00 72.50 71.55 3cff s THR 27 CO 0.02 -0.33 0.25 -0.83 -0.54 0.00 0.00 174.62 173.19 3cff s GLY 28 N -3.22 -0.08 -0.06 3.99 0.00 0.04 -0.86 107.32 107.13 3cff s GLY 28 Ca 0.26 0.13 -0.03 0.00 0.00 0.00 0.00 44.72 45.08 3cff s GLY 28 CO 0.13 -0.05 0.15 0.54 0.00 0.00 0.00 173.10 173.86 3cff s LYS 29 N -1.47 0.11 0.33 2.90 1.02 -0.37 -0.92 119.74 121.33 3cff s LYS 29 Ca -0.13 0.35 -0.10 0.00 0.02 0.00 0.00 55.97 56.11 3cff s LYS 29 Cb -0.06 -0.14 0.04 0.00 -0.52 0.00 0.00 37.83 37.15 3cff s LYS 29 CO 0.03 -0.14 0.61 0.41 -0.92 0.00 0.00 175.35 175.34 3cff n GLY 30 N 4.03 1.42 3.27 -3.33 0.00 -0.33 -0.17 105.19 110.08 3cff n GLY 30 Ca -0.24 -1.32 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 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 -2.25 0.94 0.33 1.61 -1.05 -0.59 -0.54 118.70 117.15 3cff s GLU 31 Ca 0.17 -0.72 -0.18 0.00 -0.15 0.00 0.00 54.97 54.09 3cff s GLU 31 Cb -0.03 0.41 0.04 0.00 -0.44 0.00 0.00 34.13 34.10 3cff s GLU 31 CO 0.13 -0.34 0.76 0.20 0.95 0.00 0.00 175.26 176.96 3cff s GLY 32 N -2.63 0.14 -0.52 -3.83 0.00 -0.38 -1.44 107.32 98.67 3cff s GLY 32 Ca 0.01 -0.53 -0.16 0.00 0.00 0.00 0.00 44.72 44.04 3cff s GLY 32 CO -0.09 -0.20 0.48 0.21 0.00 0.00 0.00 173.10 173.50 3cff s ASN 33 N -3.00 6.17 0.31 1.64 3.84 0.40 -0.68 114.94 123.63 3cff s ASN 33 Ca 0.13 -1.54 0.01 0.00 0.21 0.00 0.00 52.86 51.67 3cff s ASN 33 Cb -0.06 -2.21 0.51 0.00 -0.55 0.00 0.00 41.25 38.94 3cff s ASN 33 CO 0.09 -0.80 1.87 1.55 -2.79 0.00 0.00 177.10 177.03 3cff h PRO 34 N 8.86 0.72 0.00 0.43 0.13 -1.80 0.66 132.00 141.00 3cff h PRO 34 Ca -0.29 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 64.71 3cff h PRO 34 Cb 1.10 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 3cff h PRO 34 CO 0.98 0.65 -0.45 0.74 -0.23 0.00 0.00 178.00 179.68 3cff h PHE 35 N 0.70 0.00 -0.00 1.56 -1.00 -1.89 -3.25 116.94 113.06 3cff h PHE 35 Ca 0.16 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.94 3cff h PHE 35 Cb 0.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.80 3cff h PHE 35 CO 0.01 0.00 -0.65 0.39 -1.61 0.00 0.00 178.31 176.45 3cff n GLU 36 N -2.91 0.40 -2.31 1.51 -0.58 -1.05 -5.00 120.64 110.70 3cff n GLU 36 Ca 0.02 -0.30 -0.10 0.00 -0.42 0.00 0.00 57.16 56.36 3cff n GLU 36 Cb 0.54 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 3cff n GLU 36 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3cff n GLY 37 N 1.46 -0.00 3.33 0.62 0.00 0.19 -5.03 105.19 105.75 3cff n GLY 37 Ca 0.07 -0.43 -0.26 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.60 1.95 0.00 2.61 -4.23 -1.00 -5.01 115.64 107.37 3cff s THR 38 Ca 0.04 -1.61 -0.29 0.00 -1.18 0.00 0.00 61.69 58.65 3cff s THR 38 Cb -0.02 -1.74 0.07 0.00 1.34 0.00 0.00 72.50 72.15 3cff s THR 38 CO 0.05 0.03 0.66 0.00 -0.54 0.00 0.00 174.62 174.82 3cff s GLN 39 N -1.92 1.11 0.02 3.99 -2.07 -1.26 -0.46 119.66 119.07 3cff s GLN 39 Ca 0.10 0.06 0.02 0.00 -1.82 0.00 0.00 55.36 53.72 3cff s GLN 39 Cb -0.10 0.52 -0.01 0.00 -1.09 0.00 0.00 33.01 32.33 3cff s GLN 39 CO 0.05 -0.39 -0.07 -0.51 -1.32 0.00 0.00 175.29 173.05 3cff s ASP 40 N -1.61 0.78 0.08 12.60 1.11 -0.52 -4.99 116.67 124.12 3cff s ASP 40 Ca -0.08 -0.32 -0.14 0.00 0.18 0.00 0.00 52.55 52.20 3cff s ASP 40 Cb -0.00 -0.02 0.02 0.00 1.07 0.00 0.00 42.92 43.98 3cff s ASP 40 CO 0.04 -0.06 0.32 0.00 1.18 0.00 0.00 175.17 176.65 3cff s MET 41 N -0.83 0.91 -0.09 8.23 0.23 -1.26 -1.54 119.30 124.94 3cff s MET 41 Ca -0.03 -0.66 -0.01 0.00 -1.03 0.00 0.00 55.69 53.95 3cff s MET 41 Cb -0.06 0.39 -0.03 0.00 -1.53 0.00 0.00 34.83 33.60 3cff s MET 41 CO 0.00 -0.31 -0.02 0.15 -2.03 0.00 0.00 175.02 172.80 3cff s LYS 42 N -3.23 3.04 -0.08 3.16 1.02 0.76 -4.96 119.74 119.45 3cff s LYS 42 Ca -0.00 -0.47 0.04 0.00 0.02 0.00 0.00 55.97 55.56 3cff s LYS 42 Cb 0.01 -2.76 0.00 0.00 -0.52 0.00 0.00 37.83 34.57 3cff s LYS 42 CO -0.08 0.61 -0.20 0.42 -0.92 0.00 0.00 175.35 175.19 3cff s ILE 43 N -0.64 1.70 -0.08 2.17 1.09 -1.26 -1.24 121.20 122.94 3cff s ILE 43 Ca 0.10 -0.83 0.04 0.00 -1.10 0.00 0.00 60.65 58.87 3cff s ILE 43 Cb -0.12 -1.48 0.00 0.00 -1.06 0.00 0.00 42.46 39.80 3cff s ILE 43 CO 0.02 0.48 -0.22 -0.70 -0.10 0.00 0.00 174.94 174.42 3cff s GLU 44 N 0.33 2.67 -0.53 2.79 2.12 -0.04 -5.00 118.70 121.04 3cff s GLU 44 Ca -0.14 -0.79 -0.28 0.00 0.36 0.00 0.00 54.97 54.12 3cff s GLU 44 Cb -0.16 -2.09 0.03 0.00 0.26 0.00 0.00 34.13 32.18 3cff s GLU 44 CO 0.06 0.19 1.14 0.08 -0.54 0.00 0.00 175.26 176.19 3cff s VAL 45 N 0.30 4.14 -0.70 3.70 1.01 -1.26 -1.20 120.40 126.38 3cff s VAL 45 Ca -0.15 0.97 0.22 0.00 0.00 0.00 0.00 61.98 63.02 3cff s VAL 45 Cb -0.17 -4.65 -0.20 0.00 0.00 0.00 0.00 36.38 31.36 3cff s VAL 45 CO 0.07 -1.17 0.89 2.30 0.00 0.00 0.00 175.10 177.19 3cff n ILE 46 N 6.69 0.05 -3.76 2.22 -5.35 -0.08 -4.73 119.36 114.40 3cff n ILE 46 Ca 0.09 -0.17 -0.13 0.00 -0.27 0.00 0.00 62.75 62.28 3cff n ILE 46 Cb 0.49 0.53 -0.11 0.00 -1.74 0.00 0.00 39.64 38.81 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 -3.16 0.36 0.00 6.28 2.02 -1.04 -4.90 118.70 118.27 3cff s GLU 47 Ca 0.04 0.45 0.00 0.00 0.02 0.00 0.00 54.97 55.48 3cff s GLU 47 Cb 0.15 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.54 3cff s GLU 47 CO 0.85 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 176.48 3cff n GLY 48 N 3.02 0.43 3.93 -1.39 0.00 -1.26 -0.99 105.19 108.92 3cff n GLY 48 Ca -0.14 -0.75 -0.26 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.68 1.46 0.28 -0.02 0.00 -1.26 -3.89 107.32 101.21 3cff s GLY 49 Ca 0.00 -0.73 -0.29 0.00 0.00 0.00 0.00 44.72 43.70 3cff s GLY 49 CO 0.00 -0.63 1.25 2.56 0.00 0.00 0.00 173.10 176.29 3cff s PRO 50 N -4.34 4.44 0.05 2.90 0.04 -1.26 -5.05 135.00 131.78 3cff s PRO 50 Ca 0.43 2.06 -0.35 0.00 0.04 0.00 0.00 61.00 63.18 3cff s PRO 50 Cb -0.10 -3.14 -0.14 0.00 0.04 0.00 0.00 34.50 31.16 3cff s PRO 50 CO 0.38 -0.10 1.62 1.28 0.04 0.00 0.00 177.00 180.22 3cff n LEU 51 N 1.43 2.85 -1.00 -3.56 4.77 -1.25 -4.85 117.00 115.38 3cff n LEU 51 Ca 0.01 1.06 0.01 0.00 -0.03 0.00 0.00 56.01 57.07 3cff n LEU 51 Cb 0.43 -1.35 0.12 0.00 -2.33 0.00 0.00 43.42 40.29 3cff n LEU 51 CO 0.57 -0.39 0.49 -0.81 -1.33 0.00 0.00 177.39 175.92 3cff n PRO 52 N 4.18 2.15 -3.76 3.23 -0.04 -1.26 -4.85 135.00 134.65 3cff n PRO 52 Ca 0.19 -1.00 -0.10 0.00 -0.04 0.00 0.00 63.50 62.55 3cff n PRO 52 Cb 0.26 -1.70 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 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 -1.50 0.00 0.07 0.54 -0.12 -1.26 -5.12 117.98 110.58 3cff s PHE 53 Ca 0.18 -0.36 -0.32 0.00 -0.05 0.00 0.00 56.93 56.37 3cff s PHE 53 Cb 0.14 0.14 -0.11 0.00 -0.63 0.00 0.00 43.02 42.55 3cff s PHE 53 CO 0.05 -0.69 1.81 0.00 -0.05 0.00 0.00 175.22 176.34 3cff n ALA 54 N -0.19 1.62 0.27 1.99 0.00 -1.26 -4.86 120.51 118.08 3cff n ALA 54 Ca -0.14 0.32 0.11 0.00 0.00 0.00 0.00 53.44 53.74 3cff n ALA 54 Cb 0.63 -2.53 0.74 0.00 0.00 0.00 0.00 19.45 18.29 3cff n ALA 54 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3cff h PHE 55 N 8.38 0.00 -1.17 0.00 3.57 -2.00 -2.97 116.94 122.76 3cff h PHE 55 Ca -0.47 0.00 0.33 0.00 3.53 0.00 0.00 57.97 61.36 3cff h PHE 55 Cb 1.24 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 39.89 3cff h PHE 55 CO 0.80 0.02 0.77 -0.44 -2.23 0.00 0.00 178.31 177.23 3cff h ASP 56 N 0.00 0.29 0.50 0.41 3.32 -2.02 0.33 116.42 119.26 3cff h ASP 56 Ca -0.00 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3cff h ASP 56 Cb 0.05 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3cff h ASP 56 CO 0.00 -0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.82 3cff n ILE 57 N -4.54 0.97 0.57 0.35 -5.35 -1.12 -2.25 119.36 108.00 3cff n ILE 57 Ca 0.29 0.35 0.11 0.00 -0.27 0.00 0.00 62.75 63.23 3cff n ILE 57 Cb 1.13 -1.27 -0.11 0.00 -1.74 0.00 0.00 39.64 37.64 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 -2.08 0.58 -0.25 7.28 4.77 0.12 -4.63 117.00 122.79 3cff n LEU 58 Ca 0.01 -0.24 0.05 0.00 -0.03 0.00 0.00 56.01 55.80 3cff n LEU 58 Cb 0.17 -0.02 0.18 0.00 -2.33 0.00 0.00 43.42 41.42 3cff n LEU 58 CO 0.15 0.13 1.01 0.28 -1.33 0.00 0.00 177.39 177.63 3cff h SER 59 N 0.00 0.27 0.09 -1.43 0.02 -1.40 0.34 113.55 111.44 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 0.72 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.34 3cff h SER 59 CO 0.00 0.11 0.00 0.35 -1.14 0.00 0.00 176.83 176.15 3cff n THR 60 N -5.00 0.06 0.61 -2.27 -2.24 -1.26 -2.69 114.28 101.49 3cff n THR 60 Ca 0.14 0.02 0.06 0.00 -2.27 0.00 0.00 64.05 61.99 3cff n THR 60 Cb 0.40 -0.65 -0.07 0.00 -2.10 0.00 0.00 70.33 67.92 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 -1.06 0.67 0.00 3.42 7.64 0.10 -5.25 113.62 119.14 3cff n SER 61 Ca 0.16 -0.84 0.13 0.00 1.01 0.00 0.00 58.87 59.34 3cff n SER 61 Cb 0.10 0.96 0.78 0.00 -1.01 0.00 0.00 64.21 65.05 3cff n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03