#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fke s VAL 2 N 0.00 0.81 -0.10 1.61 0.11 -1.26 -1.54 120.40 120.03 2fke s VAL 2 Ca 0.00 -0.48 0.01 0.00 -2.93 0.00 0.00 61.98 58.58 2fke s VAL 2 Cb 0.00 -0.69 -0.02 0.00 -1.53 0.00 0.00 36.38 34.15 2fke s VAL 2 CO 0.00 0.20 -0.14 -1.10 -3.33 0.00 0.00 175.10 170.73 2fke s GLN 3 N -0.32 3.08 -0.20 1.54 -0.21 -0.30 -4.96 119.66 118.29 2fke s GLN 3 Ca 0.03 -0.70 -0.02 0.00 0.02 0.00 0.00 55.36 54.69 2fke s GLN 3 Cb -0.04 -2.53 -0.00 0.00 1.00 0.00 0.00 33.01 31.44 2fke s GLN 3 CO -0.00 0.34 -0.09 0.08 -2.12 0.00 0.00 175.29 173.50 2fke s VAL 4 N 0.01 3.06 -0.18 1.09 1.01 -1.26 -0.99 120.40 123.14 2fke s VAL 4 Ca -0.04 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2fke s VAL 4 Cb -0.14 -2.36 0.02 0.00 0.00 0.00 0.00 36.38 33.89 2fke s VAL 4 CO 0.04 0.46 -0.18 -1.61 0.00 0.00 0.00 175.10 173.81 2fke s GLU 5 N 1.30 3.02 0.05 2.72 2.02 -0.38 -4.98 118.70 122.44 2fke s GLU 5 Ca 0.04 -0.82 -0.30 0.00 0.02 0.00 0.00 54.97 53.91 2fke s GLU 5 Cb -0.14 -2.61 -0.05 0.00 0.10 0.00 0.00 34.13 31.43 2fke s GLU 5 CO -0.04 -0.21 1.07 0.99 0.02 0.00 0.00 175.26 177.09 2fke s THR 6 N 1.31 4.42 -0.23 3.63 2.01 -1.26 -0.64 115.64 124.87 2fke s THR 6 Ca 0.05 1.79 -0.19 0.00 0.31 0.00 0.00 61.69 63.65 2fke s THR 6 Cb -0.13 -4.15 -0.17 0.00 0.01 0.00 0.00 72.50 68.06 2fke s THR 6 CO -0.12 0.17 0.03 -0.38 -0.69 0.00 0.00 174.62 173.63 2fke n ILE 7 N 3.64 1.53 -4.14 1.82 5.41 0.11 -4.94 119.36 122.80 2fke n ILE 7 Ca 0.06 -0.13 -0.16 0.00 1.00 0.00 0.00 62.75 63.52 2fke n ILE 7 Cb 0.49 -2.00 -0.15 0.00 -0.71 0.00 0.00 39.64 37.27 2fke n ILE 7 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2fke s SER 8 N -7.04 0.62 0.54 4.38 0.15 -0.59 -4.97 113.70 106.79 2fke s SER 8 Ca -0.32 -0.09 -0.20 0.00 0.70 0.00 0.00 55.95 56.04 2fke s SER 8 Cb 0.09 -0.12 -0.06 0.00 -1.71 0.00 0.00 66.02 64.22 2fke s SER 8 CO 0.56 0.04 1.13 -2.16 1.20 0.00 0.00 173.24 174.01 2fke s PRO 9 N 0.08 3.39 0.00 5.44 0.04 -1.26 -0.56 135.00 142.13 2fke s PRO 9 Ca -0.00 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.66 2fke s PRO 9 Cb -0.04 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2fke s PRO 9 CO -0.00 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.62 2fke n GLY 10 N 0.18 0.50 0.01 0.56 0.00 -1.26 -4.16 105.19 101.02 2fke n GLY 10 Ca 0.11 -1.86 0.12 0.00 0.00 0.00 0.00 46.02 44.40 2fke n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2fke n ASP 11 N -1.24 0.09 -0.31 1.61 5.75 -0.40 -4.83 116.55 117.21 2fke n ASP 11 Ca 0.00 0.51 -0.04 0.00 -0.01 0.00 0.00 54.79 55.25 2fke n ASP 11 Cb 0.00 -0.53 -0.02 0.00 -1.03 0.00 0.00 41.12 39.54 2fke n ASP 11 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fke n GLY 12 N 1.15 0.57 0.00 6.12 0.00 -1.26 -4.74 105.19 107.02 2fke n GLY 12 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2fke n GLY 12 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2fke n ARG 13 N -1.23 1.09 -3.50 1.61 1.85 -1.26 -5.03 116.66 110.19 2fke n ARG 13 Ca -0.04 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.39 2fke n ARG 13 Cb 0.34 -0.53 -0.07 0.00 -1.05 0.00 0.00 32.46 31.14 2fke n ARG 13 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2fke s THR 14 N -0.92 4.50 0.02 8.89 2.01 -1.26 -5.04 115.64 123.83 2fke s THR 14 Ca 0.00 -1.94 0.01 0.00 0.31 0.00 0.00 61.69 60.07 2fke s THR 14 Cb 0.00 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 2fke s THR 14 CO 0.00 -0.83 0.06 -0.36 -0.69 0.00 0.00 174.62 172.79 2fke s PHE 15 N 1.11 3.20 0.21 4.92 0.40 -1.26 -1.10 117.98 125.47 2fke s PHE 15 Ca 0.08 0.14 -0.31 0.00 -0.60 0.00 0.00 56.93 56.24 2fke s PHE 15 Cb -0.24 -1.69 -0.10 0.00 0.51 0.00 0.00 43.02 41.50 2fke s PHE 15 CO -0.01 0.52 1.54 -2.14 0.70 0.00 0.00 175.22 175.82 2fke s PRO 16 N -1.88 4.21 0.03 0.24 0.02 -1.26 -5.01 135.00 131.35 2fke s PRO 16 Ca 0.24 2.38 0.01 0.00 0.02 0.00 0.00 61.00 63.65 2fke s PRO 16 Cb -0.12 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 2fke s PRO 16 CO 0.15 -0.55 0.08 0.15 -0.33 0.00 0.00 177.00 176.50 2fke s LYS 17 N 0.40 3.00 0.35 5.54 1.02 -1.26 -4.88 119.74 123.91 2fke s LYS 17 Ca 0.66 -0.57 -0.29 0.00 0.02 0.00 0.00 55.97 55.79 2fke s LYS 17 Cb -0.44 -2.81 -0.12 0.00 -0.52 0.00 0.00 37.83 33.95 2fke s LYS 17 CO 0.38 0.61 1.46 0.54 -0.92 0.00 0.00 175.35 177.42 2fke n ARG 18 N 0.87 2.54 -0.42 1.68 1.74 -1.26 -1.20 116.66 120.61 2fke n ARG 18 Ca -0.11 0.89 0.00 0.00 -0.77 0.00 0.00 57.85 57.86 2fke n ARG 18 Cb 0.52 -2.60 0.00 0.00 -1.02 0.00 0.00 32.46 29.36 2fke n ARG 18 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fke n GLY 19 N 0.92 0.93 3.96 -0.13 0.00 -1.08 -4.98 105.19 104.82 2fke n GLY 19 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 2fke n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fke s GLN 20 N -0.47 3.46 -0.23 1.61 -0.21 -0.34 -4.96 119.66 118.52 2fke s GLN 20 Ca 0.00 -0.62 -0.13 0.00 0.02 0.00 0.00 55.36 54.63 2fke s GLN 20 Cb 0.00 -2.82 -0.04 0.00 1.00 0.00 0.00 33.01 31.14 2fke s GLN 20 CO 0.00 0.35 0.28 0.99 -2.12 0.00 0.00 175.29 174.79 2fke s THR 21 N -2.07 5.28 -0.13 -0.19 2.01 0.10 -3.64 115.64 117.00 2fke s THR 21 Ca 0.36 0.44 -0.10 0.00 0.31 0.00 0.00 61.69 62.69 2fke s THR 21 Cb -0.09 -3.61 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2fke s THR 21 CO 0.31 0.29 0.21 0.00 -0.69 0.00 0.00 174.62 174.74 2fke s VAL 23 N -0.39 2.92 0.16 0.00 1.01 -0.43 -1.91 120.40 121.76 2fke s VAL 23 Ca 0.15 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.49 2fke s VAL 23 Cb -0.13 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2fke s VAL 23 CO 0.04 0.47 0.01 0.68 0.00 0.00 0.00 175.10 176.30 2fke s VAL 24 N 1.29 0.53 -0.06 2.92 -7.23 -0.12 -0.52 120.40 117.20 2fke s VAL 24 Ca 0.04 -1.96 0.04 0.00 -1.81 0.00 0.00 61.98 58.29 2fke s VAL 24 Cb -0.14 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.70 2fke s VAL 24 CO -0.05 -0.49 -0.17 -1.00 -0.31 0.00 0.00 175.10 173.08 2fke s HIS 25 N -3.76 2.64 0.07 2.82 3.76 -0.88 -0.35 115.29 119.61 2fke s HIS 25 Ca 0.23 -0.33 -0.07 0.00 -0.15 0.00 0.00 55.06 54.74 2fke s HIS 25 Cb 0.06 -1.64 -0.01 0.00 1.11 0.00 0.00 32.58 32.10 2fke s HIS 25 CO 0.03 0.05 0.15 1.52 -0.85 0.00 0.00 174.74 175.64 2fke s TYR 26 N -0.48 0.20 -0.04 1.40 -0.85 -1.26 -0.27 117.35 116.04 2fke s TYR 26 Ca 0.06 -0.61 0.02 0.00 -0.52 0.00 0.00 57.07 56.02 2fke s TYR 26 Cb -0.12 -0.12 0.01 0.00 0.38 0.00 0.00 41.96 42.12 2fke s TYR 26 CO 0.01 -0.49 -0.09 0.99 -1.52 0.00 0.00 175.55 174.46 2fke s THR 27 N -3.59 0.85 -0.12 -3.49 2.01 -0.55 -1.38 115.64 109.37 2fke s THR 27 Ca 0.03 -0.34 -0.02 0.00 0.31 0.00 0.00 61.69 61.67 2fke s THR 27 Cb 0.04 -0.79 -0.03 0.00 0.01 0.00 0.00 72.50 71.74 2fke s THR 27 CO -0.09 0.28 -0.05 -0.83 -0.69 0.00 0.00 174.62 173.24 2fke s GLY 28 N 0.54 1.71 0.04 4.40 0.00 0.35 -0.73 107.32 113.64 2fke s GLY 28 Ca -0.09 -0.84 -0.02 0.00 0.00 0.00 0.00 44.72 43.76 2fke s GLY 28 CO 0.02 -0.33 0.01 1.06 0.00 0.00 0.00 173.10 173.86 2fke s MET 29 N -0.17 0.57 0.95 2.90 -1.94 0.83 -1.38 119.30 121.06 2fke s MET 29 Ca 0.03 -0.99 -0.15 0.00 -1.71 0.00 0.00 55.69 52.87 2fke s MET 29 Cb -0.13 0.21 0.18 0.00 2.01 0.00 0.00 34.83 37.09 2fke s MET 29 CO 0.03 -0.12 1.25 -0.51 -0.01 0.00 0.00 175.02 175.65 2fke s LEU 30 N -2.47 2.37 0.38 -0.03 1.43 -0.07 -0.69 118.68 119.61 2fke s LEU 30 Ca -0.00 0.50 0.27 0.00 -1.03 0.00 0.00 54.13 53.87 2fke s LEU 30 Cb 0.02 -2.64 1.32 0.00 0.03 0.00 0.00 46.19 44.93 2fke s LEU 30 CO -0.07 -2.68 1.83 -0.33 0.23 0.00 0.00 176.35 175.33 2fke h GLU 31 N -1.60 0.00 -0.26 1.70 4.39 -1.91 -0.84 114.58 116.07 2fke h GLU 31 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 2fke h GLU 31 Cb 1.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 2fke h GLU 31 CO 0.46 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 177.91 2fke n ASP 32 N -2.49 2.38 0.00 1.42 5.75 -1.26 -4.94 116.55 117.41 2fke n ASP 32 Ca -0.00 -1.84 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 2fke n ASP 32 Cb 0.15 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 2fke n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fke n GLY 33 N 1.27 1.14 3.68 6.12 0.00 -0.32 -5.02 105.19 112.06 2fke n GLY 33 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2fke n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fke s LYS 34 N -0.53 4.18 0.14 1.61 1.02 -1.26 -4.69 119.74 120.21 2fke s LYS 34 Ca 0.00 2.37 -0.30 0.00 0.02 0.00 0.00 55.97 58.06 2fke s LYS 34 Cb 0.00 -3.78 -0.07 0.00 -0.52 0.00 0.00 37.83 33.46 2fke s LYS 34 CO 0.00 -0.81 1.12 0.21 -0.92 0.00 0.00 175.35 174.95 2fke s LYS 35 N 3.26 4.55 -0.02 1.68 2.20 -1.26 -0.89 119.74 129.26 2fke s LYS 35 Ca 0.77 1.71 0.05 0.00 -0.36 0.00 0.00 55.97 58.14 2fke s LYS 35 Cb -0.39 -3.31 -0.07 0.00 -1.51 0.00 0.00 37.83 32.55 2fke s LYS 35 CO 0.34 -0.02 0.07 1.97 -0.36 0.00 0.00 175.35 177.35 2fke n PHE 36 N 2.85 0.00 -3.51 4.03 1.16 -0.48 -4.96 117.46 116.55 2fke n PHE 36 Ca 0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.53 2fke n PHE 36 Cb 0.47 -0.16 -0.03 0.00 -1.61 0.00 0.00 39.48 38.15 2fke n PHE 36 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2fke s ASP 37 N -2.98 -0.40 -0.28 5.98 2.15 -1.20 -5.00 116.67 114.93 2fke s ASP 37 Ca -0.02 0.11 -0.20 0.00 0.43 0.00 0.00 52.55 52.87 2fke s ASP 37 Cb 0.03 0.40 0.09 0.00 -0.30 0.00 0.00 42.92 43.14 2fke s ASP 37 CO 0.20 -0.61 0.80 -0.55 -0.17 0.00 0.00 175.17 174.85 2fke s SER 38 N -2.20 -0.74 0.33 -0.34 0.15 -1.26 -0.50 113.70 109.14 2fke s SER 38 Ca 0.03 1.28 0.17 0.00 0.70 0.00 0.00 55.95 58.13 2fke s SER 38 Cb -0.01 1.30 0.31 0.00 -1.71 0.00 0.00 66.02 65.91 2fke s SER 38 CO -0.06 -0.21 1.56 0.77 1.20 0.00 0.00 173.24 176.49 2fke h SER 39 N 5.74 0.00 -0.77 5.45 4.64 -1.52 -3.21 113.55 123.89 2fke h SER 39 Ca -0.29 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.07 2fke h SER 39 Cb 1.19 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.23 2fke h SER 39 CO 0.12 0.42 0.48 0.03 -0.87 0.00 0.00 176.83 177.02 2fke h ARG 40 N 0.00 0.90 -0.82 4.77 3.08 -1.83 -1.95 114.38 118.52 2fke h ARG 40 Ca -0.00 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.04 2fke h ARG 40 Cb 1.19 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.99 2fke h ARG 40 CO 0.05 0.60 0.54 -0.44 -1.07 0.00 0.00 179.97 179.65 2fke h ASP 41 N 0.93 0.83 0.76 7.04 3.32 -1.90 -1.87 116.42 125.53 2fke h ASP 41 Ca 0.32 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 2fke h ASP 41 Cb 0.06 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.43 2fke h ASP 41 CO -0.13 0.55 -0.13 0.54 -1.72 0.00 0.00 179.24 178.35 2fke n ARG 42 N -4.47 0.13 -2.16 3.56 1.74 -0.81 -4.93 116.66 109.71 2fke n ARG 42 Ca 0.12 -0.03 -0.19 0.00 -0.77 0.00 0.00 57.85 56.98 2fke n ARG 42 Cb 0.17 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 2fke n ARG 42 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2fke n ASN 43 N -1.41 -5.45 -3.67 0.55 4.13 -0.70 -4.98 115.26 103.73 2fke n ASN 43 Ca 0.08 0.10 -0.18 0.00 1.68 0.00 0.00 54.58 56.27 2fke n ASN 43 Cb 0.32 -4.53 -0.16 0.00 -1.54 0.00 0.00 39.78 33.87 2fke n ASN 43 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2fke s LYS 44 N -4.62 -0.01 0.71 3.52 2.20 -1.12 -5.06 119.74 115.35 2fke s LYS 44 Ca 0.00 0.49 -0.15 0.00 -0.36 0.00 0.00 55.97 55.95 2fke s LYS 44 Cb 0.00 -0.36 0.03 0.00 -1.51 0.00 0.00 37.83 35.99 2fke s LYS 44 CO 0.00 -0.31 1.18 -1.25 -0.36 0.00 0.00 175.35 174.60 2fke s PRO 45 N 2.24 2.35 -0.13 4.03 0.04 -1.26 -4.66 135.00 137.61 2fke s PRO 45 Ca 0.04 1.65 -0.13 0.00 0.04 0.00 0.00 61.00 62.60 2fke s PRO 45 Cb -0.12 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 2fke s PRO 45 CO -0.05 -1.65 0.28 0.12 0.04 0.00 0.00 177.00 175.74 2fke s PHE 46 N -2.08 3.53 0.01 0.56 5.36 0.53 -4.91 117.98 120.98 2fke s PHE 46 Ca 0.72 0.64 0.08 0.00 -0.96 0.00 0.00 56.93 57.42 2fke s PHE 46 Cb -0.27 -2.26 -0.02 0.00 -0.34 0.00 0.00 43.02 40.14 2fke s PHE 46 CO 0.44 0.40 -0.25 0.15 -1.46 0.00 0.00 175.22 174.50 2fke s LYS 47 N -0.07 1.86 0.19 10.12 1.02 -1.26 -0.95 119.74 130.64 2fke s LYS 47 Ca 0.17 -0.96 -0.20 0.00 0.02 0.00 0.00 55.97 55.00 2fke s LYS 47 Cb -0.13 -1.89 0.05 0.00 -0.52 0.00 0.00 37.83 35.33 2fke s LYS 47 CO 0.05 0.51 0.58 -0.59 -0.92 0.00 0.00 175.35 174.98 2fke s PHE 48 N -0.68 -0.33 -0.01 3.18 -0.71 -0.80 -4.98 117.98 113.66 2fke s PHE 48 Ca 0.10 0.02 0.06 0.00 -1.04 0.00 0.00 56.93 56.08 2fke s PHE 48 Cb -0.10 0.51 -0.03 0.00 -1.21 0.00 0.00 43.02 42.20 2fke s PHE 48 CO 0.00 -0.92 -0.19 -1.64 -1.34 0.00 0.00 175.22 171.13 2fke s MET 49 N -3.82 2.24 0.46 1.99 -1.94 -1.26 0.21 119.30 117.18 2fke s MET 49 Ca 0.05 -0.86 -0.21 0.00 -1.71 0.00 0.00 55.69 52.96 2fke s MET 49 Cb -0.02 -2.21 -0.09 0.00 2.01 0.00 0.00 34.83 34.53 2fke s MET 49 CO -0.07 0.58 1.04 -0.51 -0.01 0.00 0.00 175.02 176.05 2fke s LEU 50 N -0.90 3.93 -0.09 -0.03 1.43 -1.24 -4.17 118.68 117.62 2fke s LEU 50 Ca 0.12 1.94 0.00 0.00 -1.03 0.00 0.00 54.13 55.16 2fke s LEU 50 Cb -0.10 -4.46 0.00 0.00 0.03 0.00 0.00 46.19 41.66 2fke s LEU 50 CO 0.01 -0.68 0.00 0.61 0.23 0.00 0.00 176.35 176.52 2fke n GLY 51 N -0.12 0.46 0.62 -3.19 0.00 -1.26 -2.62 105.19 99.08 2fke n GLY 51 Ca 0.08 -0.88 0.05 0.00 0.00 0.00 0.00 46.02 45.27 2fke n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fke n LYS 52 N -2.94 0.73 -2.67 1.61 5.02 -1.26 -4.99 118.16 113.67 2fke n LYS 52 Ca -0.01 -2.20 -0.14 0.00 -2.02 0.00 0.00 58.31 53.94 2fke n LYS 52 Cb 0.03 -0.94 -0.00 0.00 -0.02 0.00 0.00 35.03 34.10 2fke n LYS 52 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2fke n GLN 53 N -0.56 -2.61 0.11 1.97 6.02 -1.26 -4.85 117.38 116.20 2fke n GLN 53 Ca 0.10 0.51 0.13 0.00 -0.01 0.00 0.00 57.00 57.73 2fke n GLN 53 Cb 0.78 -5.12 0.34 0.00 1.02 0.00 0.00 30.24 27.26 2fke n GLN 53 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2fke h GLU 54 N -0.24 0.00 -4.02 -1.09 5.08 -1.94 -3.47 114.58 108.90 2fke h GLU 54 Ca -0.29 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.95 2fke h GLU 54 Cb 1.21 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.32 2fke h GLU 54 CO 0.35 0.00 -0.44 0.14 -1.00 0.00 0.00 179.01 178.06 2fke s VAL 55 N -3.12 0.11 0.60 3.13 -7.23 -1.26 -5.00 120.40 107.63 2fke s VAL 55 Ca 0.09 -1.49 -0.20 0.00 -1.81 0.00 0.00 61.98 58.58 2fke s VAL 55 Cb 0.12 -1.71 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 2fke s VAL 55 CO 0.63 -0.51 1.32 2.30 -0.31 0.00 0.00 175.10 178.53 2fke n ILE 56 N -0.11 4.43 -0.26 -0.62 -5.35 -1.26 -4.78 119.36 111.42 2fke n ILE 56 Ca -0.10 -0.50 0.15 0.00 -0.27 0.00 0.00 62.75 62.03 2fke n ILE 56 Cb 0.63 -1.57 0.43 0.00 -1.74 0.00 0.00 39.64 37.38 2fke n ILE 56 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 2fke h ARG 57 N 0.95 0.56 -0.80 6.28 9.65 -1.90 -0.22 114.38 128.90 2fke h ARG 57 Ca -0.51 -0.03 0.05 0.00 -1.10 0.00 0.00 59.98 58.39 2fke h ARG 57 Cb 1.32 -0.13 -0.05 0.00 -1.39 0.00 0.00 29.97 29.73 2fke h ARG 57 CO 0.55 0.37 0.52 0.78 2.80 0.00 0.00 179.97 184.99 2fke h GLY 58 N 0.58 1.12 0.70 2.80 0.00 -1.52 -0.35 103.07 106.40 2fke h GLY 58 Ca 0.46 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.32 2fke h GLY 58 CO -0.20 0.28 -0.38 1.49 0.00 0.00 0.00 176.54 177.73 2fke h TRP 59 N 0.91 0.49 -0.85 5.60 4.06 -1.30 0.38 115.95 125.23 2fke h TRP 59 Ca 0.34 -0.23 0.11 0.00 2.06 0.00 0.00 58.89 61.17 2fke h TRP 59 Cb 0.17 -0.07 -0.08 0.00 -1.00 0.00 0.00 29.16 28.18 2fke h TRP 59 CO -0.00 0.99 0.48 1.49 -3.56 0.00 0.00 178.44 177.84 2fke h GLU 60 N -0.14 0.75 0.00 0.49 4.57 -1.02 0.62 114.58 119.85 2fke h GLU 60 Ca -0.03 -0.04 -0.25 0.00 -1.18 0.00 0.00 59.36 57.85 2fke h GLU 60 Cb 1.04 -0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 29.42 2fke h GLU 60 CO 0.08 0.49 -1.45 0.93 -1.18 0.00 0.00 179.01 177.88 2fke h GLU 61 N 0.77 0.00 -0.00 1.92 5.08 -1.10 -3.25 114.58 118.00 2fke h GLU 61 Ca 0.43 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.79 2fke h GLU 61 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2fke h GLU 61 CO -0.28 0.62 -0.00 0.78 -1.00 0.00 0.00 179.01 179.13 2fke h GLY 62 N 3.38 0.00 1.32 -3.84 0.00 -0.53 -3.31 103.07 100.09 2fke h GLY 62 Ca -0.19 -0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 2fke h GLY 62 CO 0.09 0.00 0.31 -2.08 0.00 0.00 0.00 176.54 174.86 2fke h VAL 63 N -0.70 1.20 -0.01 4.60 2.07 -1.07 -2.53 116.25 119.82 2fke h VAL 63 Ca -0.00 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2fke h VAL 63 Cb 0.70 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2fke h VAL 63 CO 0.00 0.24 0.06 0.00 0.02 0.00 0.00 177.57 177.88 2fke h ALA 64 N 1.46 1.16 -0.62 1.67 0.00 -1.64 -1.25 119.26 120.03 2fke h ALA 64 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2fke h ALA 64 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2fke h ALA 64 CO -0.03 -0.06 0.00 1.04 0.00 0.00 0.00 179.25 180.19 2fke n GLN 65 N -3.20 2.76 -4.19 0.00 6.02 -0.95 -4.53 117.38 113.29 2fke n GLN 65 Ca -0.03 -2.36 -0.28 0.00 -0.01 0.00 0.00 57.00 54.32 2fke n GLN 65 Cb 0.13 -1.60 -0.08 0.00 1.02 0.00 0.00 30.24 29.71 2fke n GLN 65 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 2fke s MET 66 N -1.35 2.35 0.22 -1.09 -1.94 -0.47 -5.13 119.30 111.89 2fke s MET 66 Ca 0.43 -1.01 0.08 0.00 -1.71 0.00 0.00 55.69 53.48 2fke s MET 66 Cb 0.24 -2.39 -0.04 0.00 2.01 0.00 0.00 34.83 34.66 2fke s MET 66 CO 0.27 0.49 0.04 -1.54 -0.01 0.00 0.00 175.02 174.27 2fke s SER 67 N -2.55 4.89 0.00 3.03 1.04 -1.26 -4.23 113.70 114.62 2fke s SER 67 Ca 0.25 -0.43 -0.37 0.00 0.48 0.00 0.00 55.95 55.88 2fke s SER 67 Cb -0.10 -1.06 -0.16 0.00 0.10 0.00 0.00 66.02 64.79 2fke s SER 67 CO 0.17 0.04 1.49 0.52 0.98 0.00 0.00 173.24 176.43 2fke n VAL 68 N -0.57 0.10 -0.04 5.02 0.31 -0.26 -1.29 118.33 121.60 2fke n VAL 68 Ca -0.08 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 2fke n VAL 68 Cb 0.57 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 2fke n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2fke n GLY 69 N 3.10 1.02 3.77 2.92 0.00 0.11 -1.27 105.19 114.84 2fke n GLY 69 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2fke n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fke s GLN 70 N -0.65 4.07 -0.14 1.61 0.74 -0.41 -4.49 119.66 120.38 2fke s GLN 70 Ca 0.00 1.73 0.02 0.00 0.05 0.00 0.00 55.36 57.16 2fke s GLN 70 Cb 0.00 -2.62 0.01 0.00 1.10 0.00 0.00 33.01 31.50 2fke s GLN 70 CO 0.00 -0.27 -0.20 0.50 -0.55 0.00 0.00 175.29 174.76 2fke s ARG 71 N -2.37 3.07 0.07 1.67 3.52 0.28 -0.90 118.95 124.28 2fke s ARG 71 Ca 0.58 -0.83 -0.07 0.00 -0.13 0.00 0.00 55.73 55.28 2fke s ARG 71 Cb -0.28 -2.48 -0.01 0.00 -1.56 0.00 0.00 34.95 30.62 2fke s ARG 71 CO 0.35 -0.01 0.13 0.00 -0.81 0.00 0.00 175.30 174.97 2fke s ALA 72 N 0.81 -0.08 -0.27 6.12 0.00 -0.27 0.07 121.76 128.14 2fke s ALA 72 Ca -0.07 -0.67 -0.11 0.00 0.00 0.00 0.00 51.96 51.12 2fke s ALA 72 Cb -0.15 0.38 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 2fke s ALA 72 CO -0.01 -0.43 0.18 0.21 0.00 0.00 0.00 175.76 175.71 2fke s LYS 73 N -3.49 3.96 -0.28 0.00 2.20 0.19 -0.35 119.74 121.97 2fke s LYS 73 Ca 0.02 -0.32 -0.11 0.00 -0.36 0.00 0.00 55.97 55.21 2fke s LYS 73 Cb 0.04 -3.63 -0.05 0.00 -1.51 0.00 0.00 37.83 32.67 2fke s LYS 73 CO -0.09 -0.15 0.19 -0.51 -0.36 0.00 0.00 175.35 174.43 2fke s LEU 74 N 1.66 4.02 -0.22 5.43 1.43 0.15 -1.25 118.68 129.91 2fke s LEU 74 Ca 0.07 -0.01 -0.07 0.00 -1.03 0.00 0.00 54.13 53.10 2fke s LEU 74 Cb -0.16 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 2fke s LEU 74 CO 0.10 -0.04 0.05 -0.89 0.23 0.00 0.00 176.35 175.80 2fke s THR 75 N 1.72 4.37 -0.09 5.49 2.01 -0.16 -1.05 115.64 127.94 2fke s THR 75 Ca 0.07 -0.16 0.04 0.00 0.31 0.00 0.00 61.69 61.94 2fke s THR 75 Cb -0.16 -3.00 0.00 0.00 0.01 0.00 0.00 72.50 69.35 2fke s THR 75 CO 0.11 0.40 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.59 2fke s ILE 76 N 1.07 1.84 0.66 1.82 1.01 0.62 -1.15 121.20 127.08 2fke s ILE 76 Ca 0.04 -0.89 -0.13 0.00 0.00 0.00 0.00 60.65 59.66 2fke s ILE 76 Cb -0.14 -1.60 -0.00 0.00 0.01 0.00 0.00 42.46 40.72 2fke s ILE 76 CO 0.03 0.51 1.07 -0.94 0.00 0.00 0.00 174.94 175.61 2fke s SER 77 N 0.42 5.40 0.30 3.58 1.04 -0.59 -1.30 113.70 122.55 2fke s SER 77 Ca -0.18 1.77 0.01 0.00 0.48 0.00 0.00 55.95 58.03 2fke s SER 77 Cb -0.17 -2.52 0.54 0.00 0.10 0.00 0.00 66.02 63.97 2fke s SER 77 CO 0.08 -1.43 1.89 -0.65 0.98 0.00 0.00 173.24 174.11 2fke h PRO 78 N -0.22 0.98 0.00 4.02 0.11 -1.91 0.30 132.00 135.29 2fke h PRO 78 Ca -0.45 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 2fke h PRO 78 Cb 1.22 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 2fke h PRO 78 CO 0.56 0.65 -0.01 0.22 -0.21 0.00 0.00 178.00 179.21 2fke h ASP 79 N 1.01 0.00 -0.57 -2.05 3.58 -1.91 0.25 116.42 116.73 2fke h ASP 79 Ca 0.42 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.87 2fke h ASP 79 Cb 0.29 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.34 2fke h ASP 79 CO -0.17 0.01 0.00 -1.22 -2.88 0.00 0.00 179.24 174.98 2fke n TYR 80 N -3.14 0.76 0.00 0.28 4.02 0.07 -4.80 117.16 114.35 2fke n TYR 80 Ca -0.01 -0.38 0.00 0.00 -0.01 0.00 0.00 57.90 57.50 2fke n TYR 80 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 2fke n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2fke n ALA 81 N 1.30 0.00 -0.19 -0.72 0.00 0.01 -1.27 120.51 119.64 2fke n ALA 81 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.76 2fke n ALA 81 Cb 0.53 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.27 2fke n ALA 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2fke n TYR 82 N 0.00 0.84 -2.05 0.00 4.01 -1.05 -4.91 117.16 114.00 2fke n TYR 82 Ca 0.00 -0.43 0.00 0.00 -0.16 0.00 0.00 57.90 57.31 2fke n TYR 82 Cb 0.00 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2fke n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fke n GLY 83 N 1.58 1.93 0.15 2.72 0.00 0.68 -0.87 105.19 111.39 2fke n GLY 83 Ca 0.23 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 46.05 2fke n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fke h ALA 84 N -0.41 1.00 0.05 4.61 0.00 -1.94 0.05 119.26 122.63 2fke h ALA 84 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2fke h ALA 84 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2fke h ALA 84 CO 0.00 0.00 -0.64 1.15 0.00 0.00 0.00 179.25 179.76 2fke h THR 85 N 0.00 1.44 0.00 0.00 2.02 -1.83 -3.38 112.91 111.16 2fke h THR 85 Ca 0.00 -2.37 0.00 0.00 0.77 0.00 0.00 66.41 64.81 2fke h THR 85 Cb 0.50 3.02 0.00 0.00 -1.74 0.00 0.00 68.15 69.93 2fke h THR 85 CO 0.00 0.59 0.00 0.61 0.37 0.00 0.00 175.52 177.09 2fke n GLY 86 N 1.61 -1.79 3.01 2.16 0.00 -0.05 -4.06 105.19 106.08 2fke n GLY 86 Ca -0.17 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 43.96 2fke n GLY 86 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2fke s HIS 87 N 0.00 2.09 -0.16 1.61 2.46 -0.24 -4.89 115.29 116.16 2fke s HIS 87 Ca 0.00 -1.15 -0.40 0.00 0.47 0.00 0.00 55.06 53.98 2fke s HIS 87 Cb 0.00 -1.55 -0.17 0.00 -0.13 0.00 0.00 32.58 30.73 2fke s HIS 87 CO 0.00 -0.63 1.50 -0.35 -2.47 0.00 0.00 174.74 172.78 2fke n PRO 88 N 4.72 0.80 -1.63 2.88 -0.04 -1.26 -1.15 135.00 139.32 2fke n PRO 88 Ca -0.17 0.29 -0.19 0.00 -0.04 0.00 0.00 63.50 63.40 2fke n PRO 88 Cb 0.50 -1.91 -0.07 0.00 -0.04 0.00 0.00 33.50 31.98 2fke n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fke n GLY 89 N 3.25 1.57 1.26 0.55 0.00 -1.26 -4.71 105.19 105.85 2fke n GLY 89 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2fke n GLY 89 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2fke n ILE 90 N -2.63 0.00 -4.72 -0.61 2.08 -0.65 -5.10 119.36 107.72 2fke n ILE 90 Ca -0.19 0.00 -0.29 0.00 0.56 0.00 0.00 62.75 62.84 2fke n ILE 90 Cb 0.61 -0.30 -0.17 0.00 -0.75 0.00 0.00 39.64 39.04 2fke n ILE 90 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 2fke s ILE 91 N -1.63 1.58 0.84 1.39 1.01 -0.30 -4.97 121.20 119.12 2fke s ILE 91 Ca 0.00 -0.72 -0.12 0.00 0.00 0.00 0.00 60.65 59.81 2fke s ILE 91 Cb 0.00 -1.41 0.10 0.00 0.01 0.00 0.00 42.46 41.16 2fke s ILE 91 CO 0.00 0.45 1.12 -2.16 0.00 0.00 0.00 174.94 174.36 2fke s PRO 92 N 0.70 1.71 0.48 2.79 0.04 -1.26 -1.08 135.00 138.37 2fke s PRO 92 Ca -0.13 0.42 -0.24 0.00 0.04 0.00 0.00 61.00 61.10 2fke s PRO 92 Cb -0.16 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 2fke s PRO 92 CO 0.03 -1.83 1.27 -2.30 0.04 0.00 0.00 177.00 174.21 2fke n PRO 93 N -3.54 1.76 -3.57 0.56 -0.02 -1.26 -3.52 135.00 125.42 2fke n PRO 93 Ca 0.07 0.64 -0.22 0.00 -2.02 0.00 0.00 63.50 61.97 2fke n PRO 93 Cb 0.58 -2.42 0.08 0.00 -0.02 0.00 0.00 33.50 31.72 2fke n PRO 93 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2fke n HIS 94 N -0.61 -2.54 -3.65 6.00 8.25 0.00 -4.93 115.22 117.76 2fke n HIS 94 Ca 0.08 0.97 -0.36 0.00 -0.26 0.00 0.00 57.72 58.16 2fke n HIS 94 Cb 0.42 -4.94 -0.08 0.00 1.12 0.00 0.00 29.99 26.51 2fke n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2fke s ALA 95 N -3.35 3.64 0.07 -1.41 0.00 -1.23 -4.89 121.76 114.59 2fke s ALA 95 Ca 0.35 -0.60 -0.26 0.00 0.00 0.00 0.00 51.96 51.44 2fke s ALA 95 Cb -0.16 -2.27 -0.06 0.00 0.00 0.00 0.00 23.12 20.64 2fke s ALA 95 CO 0.74 0.11 0.82 0.99 0.00 0.00 0.00 175.76 178.42 2fke s THR 96 N 0.45 4.65 -0.01 0.00 2.01 -1.26 -3.93 115.64 117.54 2fke s THR 96 Ca 0.11 1.76 0.01 0.00 0.31 0.00 0.00 61.69 63.88 2fke s THR 96 Cb -0.12 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 2fke s THR 96 CO 0.01 0.36 0.02 -0.76 -0.69 0.00 0.00 174.62 173.55 2fke s LEU 97 N -0.10 3.59 -0.14 4.42 1.43 -0.42 -3.90 118.68 123.56 2fke s LEU 97 Ca 0.41 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2fke s LEU 97 Cb -0.21 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 43.98 2fke s LEU 97 CO 0.25 0.29 -0.19 -0.69 0.23 0.00 0.00 176.35 176.24 2fke s VAL 98 N -1.08 2.35 -0.05 -1.59 1.01 0.13 -0.27 120.40 120.90 2fke s VAL 98 Ca 0.19 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.34 2fke s VAL 98 Cb -0.12 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 2fke s VAL 98 CO 0.10 0.54 -0.21 -0.36 0.00 0.00 0.00 175.10 175.16 2fke s PHE 99 N 0.76 2.08 -0.31 5.22 0.40 -0.21 -0.12 117.98 125.80 2fke s PHE 99 Ca -0.07 -0.59 -0.14 0.00 -0.60 0.00 0.00 56.93 55.52 2fke s PHE 99 Cb -0.16 -1.38 -0.03 0.00 0.51 0.00 0.00 43.02 41.97 2fke s PHE 99 CO 0.00 -0.18 0.32 0.34 0.70 0.00 0.00 175.22 176.40 2fke s ASP 100 N -0.10 6.16 -0.02 1.36 -1.08 0.09 -0.67 116.67 122.40 2fke s ASP 100 Ca -0.03 -0.05 0.06 0.00 -0.52 0.00 0.00 52.55 52.01 2fke s ASP 100 Cb -0.12 -2.18 -0.01 0.00 -1.46 0.00 0.00 42.92 39.14 2fke s ASP 100 CO 0.03 -0.23 -0.21 -0.69 0.52 0.00 0.00 175.17 174.59 2fke s VAL 101 N 1.96 1.69 -0.13 1.11 1.01 0.53 -1.48 120.40 125.09 2fke s VAL 101 Ca 0.11 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.21 2fke s VAL 101 Cb -0.16 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.81 2fke s VAL 101 CO 0.11 0.48 -0.21 -0.70 0.00 0.00 0.00 175.10 174.78 2fke s GLU 102 N -0.40 3.10 -0.56 2.72 2.12 0.62 -1.11 118.70 125.19 2fke s GLU 102 Ca 0.06 -0.83 -0.22 0.00 0.36 0.00 0.00 54.97 54.33 2fke s GLU 102 Cb -0.09 -2.44 0.05 0.00 0.26 0.00 0.00 34.13 31.92 2fke s GLU 102 CO -0.00 0.08 0.86 -1.17 -0.54 0.00 0.00 175.26 174.49 2fke s LEU 103 N 0.60 4.40 -0.06 2.70 2.96 -0.08 -2.07 118.68 127.13 2fke s LEU 103 Ca -0.12 -0.63 -0.24 0.00 -0.22 0.00 0.00 54.13 52.93 2fke s LEU 103 Cb -0.16 -2.65 -0.28 0.00 0.50 0.00 0.00 46.19 43.60 2fke s LEU 103 CO 0.03 -1.18 0.92 -0.07 -1.32 0.00 0.00 176.35 174.73 2fke h LEU 104 N 10.70 0.33 -7.28 -0.68 3.38 -1.12 0.31 115.31 120.95 2fke h LEU 104 Ca -0.27 -0.91 0.12 0.00 0.09 0.00 0.00 57.88 56.91 2fke h LEU 104 Cb 1.08 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 41.60 2fke h LEU 104 CO 1.07 1.21 0.44 -1.59 0.09 0.00 0.00 178.44 179.67 2fke s LYS 105 N -2.61 1.05 -0.08 1.13 -2.85 -1.16 -4.52 119.74 110.70 2fke s LYS 105 Ca -0.15 -0.48 0.04 0.00 -1.00 0.00 0.00 55.97 54.38 2fke s LYS 105 Cb 0.00 0.42 -0.01 0.00 -2.06 0.00 0.00 37.83 36.19 2fke s LYS 105 CO 0.78 -0.47 -0.20 -0.51 0.10 0.00 0.00 175.35 175.05 2fke s LEU 106 N -2.69 2.34 0.00 2.77 1.43 -1.26 -1.32 118.68 119.94 2fke s LEU 106 Ca 0.07 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 2fke s LEU 106 Cb -0.01 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.74 2fke s LEU 106 CO -0.05 0.23 0.00 -1.84 0.23 0.00 0.00 176.35 174.92