#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fk9 s SER -8 N 0.00 6.34 -0.17 0.41 0.15 -1.26 -4.92 113.70 114.26 2fk9 s SER -8 Ca 0.00 2.74 0.16 0.00 0.70 0.00 0.00 55.95 59.54 2fk9 s SER -8 Cb 0.00 -2.65 0.66 0.00 -1.71 0.00 0.00 66.02 62.32 2fk9 s SER -8 CO 0.00 -0.84 1.57 -1.54 1.20 0.00 0.00 173.24 173.64 2fk9 n SER -7 N 0.24 4.66 -1.97 5.45 3.41 -1.26 -4.55 113.62 119.60 2fk9 n SER -7 Ca 0.03 -2.76 -0.06 0.00 -0.26 0.00 0.00 58.87 55.82 2fk9 n SER -7 Cb 0.43 -0.57 0.30 0.00 -0.26 0.00 0.00 64.21 64.10 2fk9 n SER -7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fk9 n GLY -6 N 0.37 3.74 3.62 5.00 0.00 -1.26 -5.00 105.19 111.66 2fk9 n GLY -6 Ca 0.24 -1.01 -0.50 0.00 0.00 0.00 0.00 46.02 44.75 2fk9 n GLY -6 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fk9 n LEU -5 N -0.23 2.11 -4.64 0.99 4.77 -1.26 -4.92 117.00 113.82 2fk9 n LEU -5 Ca 0.41 1.11 -0.43 0.00 -0.03 0.00 0.00 56.01 57.07 2fk9 n LEU -5 Cb 1.39 -1.27 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2fk9 n LEU -5 CO 0.43 -0.82 1.00 -0.69 -1.33 0.00 0.00 177.39 175.99 2fk9 s VAL -4 N 0.55 4.43 -2.00 4.08 1.01 -1.26 -5.25 120.40 121.96 2fk9 s VAL -4 Ca 0.82 1.66 0.14 0.00 0.00 0.00 0.00 61.98 64.59 2fk9 s VAL -4 Cb -0.86 -4.31 0.40 0.00 0.00 0.00 0.00 36.38 31.61 2fk9 s VAL -4 CO 0.45 -0.42 1.31 -0.81 0.00 0.00 0.00 175.10 175.63 2fk9 n PRO -3 N 6.88 0.64 -0.11 2.72 -0.04 -1.26 -5.16 135.00 138.67 2fk9 n PRO -3 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2fk9 n PRO -3 Cb 0.47 -1.35 0.02 0.00 -0.04 0.00 0.00 33.50 32.60 2fk9 n PRO -3 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2fk9 n THR 5 N -0.85 -0.15 -3.48 0.52 -1.04 -1.26 -5.20 114.28 102.83 2fk9 n THR 5 Ca 0.11 0.68 -0.10 0.00 -2.04 0.00 0.00 64.05 62.70 2fk9 n THR 5 Cb 0.05 -0.91 -0.02 0.00 -1.82 0.00 0.00 70.33 67.63 2fk9 n THR 5 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2fk9 s MET 6 N -5.30 0.98 0.28 -2.82 0.00 -1.26 -5.17 119.30 106.01 2fk9 s MET 6 Ca -0.04 -0.35 0.09 0.00 0.00 0.00 0.00 55.69 55.39 2fk9 s MET 6 Cb 0.06 0.45 -0.04 0.00 0.00 0.00 0.00 34.83 35.30 2fk9 s MET 6 CO 0.21 -0.42 0.08 0.15 0.00 0.00 0.00 175.02 175.04 2fk9 s LYS 7 N -3.29 2.47 -0.13 3.16 -0.14 -1.26 -4.94 119.74 115.61 2fk9 s LYS 7 Ca 0.03 -1.36 -0.14 0.00 -1.36 0.00 0.00 55.97 53.15 2fk9 s LYS 7 Cb -0.01 -2.27 -0.05 0.00 -1.68 0.00 0.00 37.83 33.82 2fk9 s LYS 7 CO -0.10 0.31 0.33 0.12 -0.76 0.00 0.00 175.35 175.25 2fk9 s PHE 8 N -2.30 3.50 -0.15 3.18 5.36 -0.12 -4.75 117.98 122.71 2fk9 s PHE 8 Ca 0.33 0.68 -0.01 0.00 -0.96 0.00 0.00 56.93 56.98 2fk9 s PHE 8 Cb -0.06 -2.35 0.04 0.00 -0.34 0.00 0.00 43.02 40.30 2fk9 s PHE 8 CO 0.22 0.29 -0.06 -0.80 -1.46 0.00 0.00 175.22 173.41 2fk9 s ASN 9 N 0.26 2.59 0.00 6.13 0.01 -1.26 -0.69 114.94 121.98 2fk9 s ASN 9 Ca 0.19 -0.53 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 2fk9 s ASN 9 Cb -0.14 -0.87 0.00 0.00 0.41 0.00 0.00 41.25 40.65 2fk9 s ASN 9 CO 0.06 -0.17 0.00 0.61 -1.51 0.00 0.00 177.10 176.09 2fk9 n GLY 10 N 4.91 -0.73 3.69 0.66 0.00 -0.63 -5.01 105.19 108.08 2fk9 n GLY 10 Ca -0.12 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.53 2fk9 n GLY 10 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2fk9 s TYR 11 N -3.00 3.22 -0.14 1.61 5.04 0.07 0.31 117.35 124.46 2fk9 s TYR 11 Ca 0.00 0.19 -0.00 0.00 -2.44 0.00 0.00 57.07 54.82 2fk9 s TYR 11 Cb 0.00 -1.85 -0.01 0.00 0.35 0.00 0.00 41.96 40.45 2fk9 s TYR 11 CO 0.00 0.44 -0.13 -1.17 -1.34 0.00 0.00 175.55 173.35 2fk9 s LEU 12 N -0.70 2.66 -0.15 6.97 2.96 0.28 -1.43 118.68 129.27 2fk9 s LEU 12 Ca 0.11 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.67 2fk9 s LEU 12 Cb -0.12 -1.60 0.02 0.00 0.50 0.00 0.00 46.19 44.99 2fk9 s LEU 12 CO 0.02 0.15 -0.15 -0.13 -1.32 0.00 0.00 176.35 174.92 2fk9 s ARG 13 N 0.46 2.41 -0.14 1.98 0.52 -0.58 -1.14 118.95 122.46 2fk9 s ARG 13 Ca -0.10 -0.60 0.01 0.00 -0.52 0.00 0.00 55.73 54.52 2fk9 s ARG 13 Cb -0.16 -2.17 0.00 0.00 0.52 0.00 0.00 34.95 33.14 2fk9 s ARG 13 CO 0.05 -0.22 -0.18 0.08 0.02 0.00 0.00 175.30 175.04 2fk9 s VAL 14 N 1.43 2.43 -0.08 3.52 1.01 0.19 -0.73 120.40 128.17 2fk9 s VAL 14 Ca 0.04 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.20 2fk9 s VAL 14 Cb -0.13 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 2fk9 s VAL 14 CO -0.11 0.53 -0.18 -0.13 0.00 0.00 0.00 175.10 175.21 2fk9 s ARG 15 N 0.71 2.84 -0.20 2.72 3.00 0.73 -0.19 118.95 128.56 2fk9 s ARG 15 Ca -0.08 -0.78 -0.04 0.00 0.00 0.00 0.00 55.73 54.82 2fk9 s ARG 15 Cb -0.16 -2.38 -0.02 0.00 0.00 0.00 0.00 34.95 32.40 2fk9 s ARG 15 CO 0.01 0.37 -0.02 0.42 0.00 0.00 0.00 175.30 176.09 2fk9 s ILE 16 N -0.11 3.72 0.00 1.52 -1.09 -0.02 -0.88 121.20 124.34 2fk9 s ILE 16 Ca -0.03 -0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.00 2fk9 s ILE 16 Cb -0.14 -2.68 0.00 0.00 -1.58 0.00 0.00 42.46 38.06 2fk9 s ILE 16 CO 0.04 0.43 0.00 0.61 -1.23 0.00 0.00 174.94 174.79 2fk9 n GLY 17 N 4.39 0.65 3.91 6.18 0.00 0.44 -0.18 105.19 120.58 2fk9 n GLY 17 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 2fk9 n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fk9 s GLU 18 N 1.67 3.55 0.13 1.61 2.02 -1.26 -0.96 118.70 125.45 2fk9 s GLU 18 Ca 0.00 -0.23 0.10 0.00 0.02 0.00 0.00 54.97 54.86 2fk9 s GLU 18 Cb 0.00 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.25 2fk9 s GLU 18 CO 0.00 0.53 -0.20 0.00 0.02 0.00 0.00 175.26 175.61 2fk9 s ALA 19 N -1.58 2.62 0.04 5.21 0.00 0.24 -0.81 121.76 127.48 2fk9 s ALA 19 Ca 0.38 -1.41 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 2fk9 s ALA 19 Cb -0.13 -0.57 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 2fk9 s ALA 19 CO 0.26 0.56 -0.01 0.14 0.00 0.00 0.00 175.76 176.71 2fk9 s VAL 20 N -1.20 0.18 -0.79 0.00 -7.23 -0.45 -3.26 120.40 107.65 2fk9 s VAL 20 Ca 0.18 -1.50 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 2fk9 s VAL 20 Cb -0.10 -1.15 0.00 0.00 0.56 0.00 0.00 36.38 35.69 2fk9 s VAL 20 CO 0.09 -0.83 0.00 0.61 -0.31 0.00 0.00 175.10 174.67 2fk9 n GLY 21 N 0.53 0.69 3.77 2.32 0.00 -1.20 -1.49 105.19 109.81 2fk9 n GLY 21 Ca -0.17 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 44.82 2fk9 n GLY 21 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fk9 s LEU 22 N -1.96 4.15 -0.11 0.99 1.43 -0.93 -3.41 118.68 118.84 2fk9 s LEU 22 Ca 0.00 2.51 -0.00 0.00 -1.03 0.00 0.00 54.13 55.61 2fk9 s LEU 22 Cb 0.00 -4.02 0.02 0.00 0.03 0.00 0.00 46.19 42.23 2fk9 s LEU 22 CO 0.00 -0.85 -0.08 -1.58 0.23 0.00 0.00 176.35 174.06 2fk9 s GLN 23 N -2.37 1.58 0.44 1.70 2.00 -1.26 -4.86 119.66 116.90 2fk9 s GLN 23 Ca 0.59 -0.28 -0.25 0.00 -2.00 0.00 0.00 55.36 53.42 2fk9 s GLN 23 Cb -0.34 -1.60 -0.09 0.00 0.80 0.00 0.00 33.01 31.78 2fk9 s GLN 23 CO 0.43 -0.24 1.29 -2.30 -0.50 0.00 0.00 175.29 173.98 2fk9 n PRO 24 N 4.83 1.92 -1.66 1.67 -0.02 -1.26 -4.93 135.00 135.55 2fk9 n PRO 24 Ca -0.14 0.69 -0.30 0.00 -2.02 0.00 0.00 63.50 61.73 2fk9 n PRO 24 Cb 0.50 -2.43 0.08 0.00 -0.02 0.00 0.00 33.50 31.63 2fk9 n PRO 24 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2fk9 s THR 25 N -1.22 3.17 0.32 3.45 -4.23 -1.26 -4.86 115.64 111.02 2fk9 s THR 25 Ca 0.62 0.38 0.05 0.00 -1.18 0.00 0.00 61.69 61.56 2fk9 s THR 25 Cb -0.49 -3.20 0.30 0.00 1.34 0.00 0.00 72.50 70.45 2fk9 s THR 25 CO 0.57 -0.50 1.87 -0.09 -0.54 0.00 0.00 174.62 175.94 2fk9 h ARG 26 N -0.96 0.83 -0.11 3.99 2.43 -1.98 -0.40 114.38 118.17 2fk9 h ARG 26 Ca -0.46 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.68 2fk9 h ARG 26 Cb 1.27 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 2fk9 h ARG 26 CO 0.61 0.55 -0.00 2.35 -1.51 0.00 0.00 179.97 181.96 2fk9 h TRP 27 N 0.85 -0.01 -0.87 2.20 2.91 -1.98 -1.86 115.95 117.19 2fk9 h TRP 27 Ca 0.44 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.45 2fk9 h TRP 27 Cb 0.51 0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 29.15 2fk9 h TRP 27 CO -0.00 -0.02 0.46 0.77 -1.03 0.00 0.00 178.44 178.62 2fk9 h SER 28 N 0.03 1.11 0.21 2.65 0.02 -1.73 -2.49 113.55 113.35 2fk9 h SER 28 Ca 0.05 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 60.86 2fk9 h SER 28 Cb 0.06 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 2fk9 h SER 28 CO -0.09 0.90 -0.18 -0.07 -1.14 0.00 0.00 176.83 176.25 2fk9 h LEU 29 N 1.23 0.00 -0.03 5.07 3.38 -0.53 0.21 115.31 124.64 2fk9 h LEU 29 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2fk9 h LEU 29 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2fk9 h LEU 29 CO -0.05 0.18 -0.53 0.54 0.09 0.00 0.00 178.44 178.67 2fk9 n ARG 30 N -4.21 0.04 0.00 1.13 5.12 -0.75 -2.61 116.66 115.38 2fk9 n ARG 30 Ca -0.02 -0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.87 2fk9 n ARG 30 Cb 0.25 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 2fk9 n ARG 30 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2fk9 n HIS 31 N -1.46 0.00 -0.14 -1.55 8.25 -0.83 -4.69 115.22 114.80 2fk9 n HIS 31 Ca 0.06 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.62 2fk9 n HIS 31 Cb 0.34 0.00 0.43 0.00 1.12 0.00 0.00 29.99 31.88 2fk9 n HIS 31 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2fk9 h SER 32 N 0.00 0.51 -0.69 0.41 0.87 -1.78 -0.90 113.55 111.97 2fk9 h SER 32 Ca 0.00 0.01 -0.28 0.00 -1.23 0.00 0.00 61.79 60.29 2fk9 h SER 32 Cb 0.00 -0.10 -0.17 0.00 -0.44 0.00 0.00 62.40 61.70 2fk9 h SER 32 CO 0.00 0.31 0.29 0.18 -0.53 0.00 0.00 176.83 177.08 2fk9 n LEU 33 N -4.48 5.67 -4.65 2.23 4.77 0.00 -4.90 117.00 115.64 2fk9 n LEU 33 Ca 0.11 -3.45 -0.42 0.00 -0.03 0.00 0.00 56.01 52.22 2fk9 n LEU 33 Cb 0.34 -0.73 -0.04 0.00 -2.33 0.00 0.00 43.42 40.66 2fk9 n LEU 33 CO 0.33 0.97 0.70 0.12 -1.33 0.00 0.00 177.39 178.19 2fk9 s PHE 34 N -3.13 3.33 -1.38 -1.77 5.36 -0.35 -4.38 117.98 115.66 2fk9 s PHE 34 Ca 0.52 1.22 -0.01 0.00 -0.96 0.00 0.00 56.93 57.70 2fk9 s PHE 34 Cb 0.44 -3.09 0.01 0.00 -0.34 0.00 0.00 43.02 40.03 2fk9 s PHE 34 CO 0.09 -0.40 0.58 1.63 -1.46 0.00 0.00 175.22 175.66 2fk9 n LYS 35 N 5.98 -4.09 0.00 10.12 5.02 -1.26 -4.91 118.16 129.02 2fk9 n LYS 35 Ca 0.07 0.50 0.10 0.00 -2.02 0.00 0.00 58.31 56.96 2fk9 n LYS 35 Cb 0.47 -4.87 -0.01 0.00 -0.02 0.00 0.00 35.03 30.60 2fk9 n LYS 35 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2fk9 n LYS 36 N -4.36 1.31 -0.41 1.97 4.76 -1.26 -4.97 118.16 115.20 2fk9 n LYS 36 Ca -0.28 -0.88 0.00 0.00 -2.87 0.00 0.00 58.31 54.28 2fk9 n LYS 36 Cb 0.67 -1.41 0.00 0.00 -1.84 0.00 0.00 35.03 32.44 2fk9 n LYS 36 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2fk9 n GLY 37 N 1.35 0.92 3.63 0.72 0.00 -1.26 -5.01 105.19 105.53 2fk9 n GLY 37 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 2fk9 n GLY 37 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2fk9 s HIS 38 N -2.93 -0.35 -0.43 1.61 -3.43 -1.26 -5.06 115.29 103.44 2fk9 s HIS 38 Ca 0.00 0.04 0.10 0.00 -0.80 0.00 0.00 55.06 54.40 2fk9 s HIS 38 Cb 0.00 0.62 0.39 0.00 -1.43 0.00 0.00 32.58 32.16 2fk9 s HIS 38 CO 0.00 -0.96 0.92 1.04 -2.00 0.00 0.00 174.74 173.73 2fk9 n GLN 39 N -0.41 2.11 -3.95 -0.38 3.00 -1.26 -4.87 117.38 111.61 2fk9 n GLN 39 Ca -0.10 -3.97 -0.35 0.00 -0.01 0.00 0.00 57.00 52.57 2fk9 n GLN 39 Cb 0.62 -1.85 -0.09 0.00 0.00 0.00 0.00 30.24 28.92 2fk9 n GLN 39 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2fk9 s LEU 40 N -3.09 3.95 0.93 1.08 1.43 -1.26 -4.80 118.68 116.92 2fk9 s LEU 40 Ca 0.41 0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 53.55 2fk9 s LEU 40 Cb 0.37 -1.99 0.15 0.00 0.03 0.00 0.00 46.19 44.74 2fk9 s LEU 40 CO -0.09 0.21 1.09 -0.76 0.23 0.00 0.00 176.35 177.03 2fk9 s LEU 41 N 0.15 2.07 -0.78 1.79 1.43 -1.25 -4.62 118.68 117.47 2fk9 s LEU 41 Ca 0.06 1.48 0.03 0.00 -1.03 0.00 0.00 54.13 54.67 2fk9 s LEU 41 Cb -0.12 -3.82 0.19 0.00 0.03 0.00 0.00 46.19 42.47 2fk9 s LEU 41 CO 0.00 -2.87 0.62 0.47 0.23 0.00 0.00 176.35 174.80 2fk9 n ASP 42 N -4.03 3.50 -4.81 2.29 9.92 -1.26 -1.26 116.55 120.90 2fk9 n ASP 42 Ca 0.07 -3.20 -0.38 0.00 -0.53 0.00 0.00 54.79 50.75 2fk9 n ASP 42 Cb 0.55 -0.86 -0.06 0.00 -0.64 0.00 0.00 41.12 40.11 2fk9 n ASP 42 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2fk9 s PRO 43 N -1.51 4.31 0.21 -0.24 0.04 -1.15 -0.82 135.00 135.84 2fk9 s PRO 43 Ca 0.27 0.89 0.02 0.00 0.04 0.00 0.00 61.00 62.21 2fk9 s PRO 43 Cb -0.04 -3.08 -0.05 0.00 0.04 0.00 0.00 34.50 31.37 2fk9 s PRO 43 CO -0.15 0.51 0.04 1.52 0.04 0.00 0.00 177.00 178.96 2fk9 s TYR 44 N -1.31 1.37 -0.02 0.56 -0.85 -0.40 -1.73 117.35 114.97 2fk9 s TYR 44 Ca 0.37 -1.07 0.07 0.00 -0.52 0.00 0.00 57.07 55.92 2fk9 s TYR 44 Cb -0.19 -0.79 -0.02 0.00 0.38 0.00 0.00 41.96 41.34 2fk9 s TYR 44 CO 0.22 -0.24 -0.23 -1.17 -1.52 0.00 0.00 175.55 172.61 2fk9 s LEU 45 N -3.24 2.04 0.06 -3.49 0.20 -1.26 -0.70 118.68 112.29 2fk9 s LEU 45 Ca 0.30 -0.42 -0.00 0.00 0.69 0.00 0.00 54.13 54.70 2fk9 s LEU 45 Cb 0.07 -1.18 -0.04 0.00 -0.43 0.00 0.00 46.19 44.60 2fk9 s LEU 45 CO 0.08 0.27 0.22 0.42 -0.29 0.00 0.00 176.35 177.05 2fk9 s THR 46 N -0.47 5.38 -0.17 3.68 -4.23 0.09 -0.57 115.64 119.36 2fk9 s THR 46 Ca 0.07 -0.36 0.01 0.00 -1.18 0.00 0.00 61.69 60.23 2fk9 s THR 46 Cb -0.09 -3.63 0.02 0.00 1.34 0.00 0.00 72.50 70.14 2fk9 s THR 46 CO -0.00 0.14 -0.20 -0.69 -0.54 0.00 0.00 174.62 173.33 2fk9 s VAL 47 N -1.51 2.08 0.12 2.29 1.01 0.06 -1.57 120.40 122.89 2fk9 s VAL 47 Ca 0.35 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.46 2fk9 s VAL 47 Cb -0.13 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 2fk9 s VAL 47 CO 0.28 0.54 -0.19 -0.44 0.00 0.00 0.00 175.10 175.29 2fk9 s SER 48 N 1.14 2.42 -0.28 3.32 0.01 -0.16 0.06 113.70 120.22 2fk9 s SER 48 Ca 0.01 -0.74 0.01 0.00 1.31 0.00 0.00 55.95 56.54 2fk9 s SER 48 Cb -0.14 -0.13 0.06 0.00 0.21 0.00 0.00 66.02 66.02 2fk9 s SER 48 CO -0.09 -0.01 -0.06 -0.69 0.41 0.00 0.00 173.24 172.79 2fk9 s VAL 49 N -1.54 2.49 -1.24 3.43 1.01 -0.17 -0.30 120.40 124.07 2fk9 s VAL 49 Ca 0.08 -1.56 -0.24 0.00 0.00 0.00 0.00 61.98 60.26 2fk9 s VAL 49 Cb -0.08 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.86 2fk9 s VAL 49 CO 0.05 -0.07 0.63 0.47 0.00 0.00 0.00 175.10 176.17 2fk9 n ASP 50 N 4.50 -3.65 0.00 3.32 8.00 -0.37 -1.67 116.55 126.68 2fk9 n ASP 50 Ca -0.13 -1.19 0.00 0.00 0.71 0.00 0.00 54.79 54.18 2fk9 n ASP 50 Cb 0.42 -2.30 0.00 0.00 -0.02 0.00 0.00 41.12 39.23 2fk9 n ASP 50 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fk9 n GLN 51 N -4.70 -0.56 -3.81 -1.24 3.00 -1.26 -4.97 117.38 103.84 2fk9 n GLN 51 Ca -0.14 0.14 -0.36 0.00 -0.01 0.00 0.00 57.00 56.62 2fk9 n GLN 51 Cb 0.60 -3.73 -0.12 0.00 0.00 0.00 0.00 30.24 26.98 2fk9 n GLN 51 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2fk9 s VAL 52 N -1.96 4.26 0.14 5.09 1.01 -0.67 -5.07 120.40 123.19 2fk9 s VAL 52 Ca 0.00 -0.19 -0.31 0.00 0.00 0.00 0.00 61.98 61.48 2fk9 s VAL 52 Cb 0.00 -2.98 -0.08 0.00 0.00 0.00 0.00 36.38 33.32 2fk9 s VAL 52 CO 0.00 0.36 1.32 -0.60 0.00 0.00 0.00 175.10 176.18 2fk9 s ARG 53 N 1.49 4.37 -0.00 2.72 3.52 -1.26 -1.00 118.95 128.78 2fk9 s ARG 53 Ca 0.06 2.01 0.02 0.00 -0.13 0.00 0.00 55.73 57.68 2fk9 s ARG 53 Cb -0.15 -3.24 -0.02 0.00 -1.56 0.00 0.00 34.95 29.97 2fk9 s ARG 53 CO 0.03 -0.32 0.09 1.33 -0.81 0.00 0.00 175.30 175.62 2fk9 n VAL 54 N 3.41 0.00 -3.57 7.11 0.24 0.11 -4.92 118.33 120.71 2fk9 n VAL 54 Ca 0.09 -0.43 -0.06 0.00 -2.04 0.00 0.00 64.34 61.89 2fk9 n VAL 54 Cb 0.43 0.98 -0.02 0.00 -1.47 0.00 0.00 33.84 33.76 2fk9 n VAL 54 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2fk9 s GLY 55 N -1.24 -0.40 -0.14 7.63 0.00 -0.87 -4.76 107.32 107.54 2fk9 s GLY 55 Ca 0.01 0.93 -0.07 0.00 0.00 0.00 0.00 44.72 45.59 2fk9 s GLY 55 CO 0.09 0.29 0.32 1.62 0.00 0.00 0.00 173.10 175.42 2fk9 s GLN 56 N -3.02 0.27 0.87 2.90 0.74 -1.26 -0.76 119.66 119.40 2fk9 s GLN 56 Ca 0.07 0.70 -0.12 0.00 0.05 0.00 0.00 55.36 56.07 2fk9 s GLN 56 Cb -0.01 -0.03 0.11 0.00 1.10 0.00 0.00 33.01 34.18 2fk9 s GLN 56 CO -0.06 -0.19 1.10 0.95 -0.55 0.00 0.00 175.29 176.54 2fk9 s THR 57 N 1.64 2.65 0.99 -0.34 -4.23 0.26 -5.00 115.64 111.61 2fk9 s THR 57 Ca -0.07 0.21 -0.11 0.00 -1.18 0.00 0.00 61.69 60.54 2fk9 s THR 57 Cb -0.10 -2.84 0.18 0.00 1.34 0.00 0.00 72.50 71.08 2fk9 s THR 57 CO -0.10 -0.28 1.09 -0.94 -0.54 0.00 0.00 174.62 173.85 2fk9 s SER 58 N -3.70 2.51 -0.16 3.99 1.04 -1.26 -4.61 113.70 111.51 2fk9 s SER 58 Ca 0.63 1.71 -0.15 0.00 0.48 0.00 0.00 55.95 58.62 2fk9 s SER 58 Cb -0.16 -2.34 -0.05 0.00 0.10 0.00 0.00 66.02 63.57 2fk9 s SER 58 CO 0.55 -3.28 0.33 -0.89 0.98 0.00 0.00 173.24 170.93 2fk9 s THR 59 N -2.69 5.28 0.26 2.02 2.01 -1.26 -4.54 115.64 116.72 2fk9 s THR 59 Ca 0.66 0.63 -0.08 0.00 0.31 0.00 0.00 61.69 63.21 2fk9 s THR 59 Cb -0.22 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.56 2fk9 s THR 59 CO 0.60 0.37 0.56 -0.54 -0.69 0.00 0.00 174.62 174.91 2fk9 s LYS 60 N 0.54 3.72 -0.19 4.92 -0.14 -0.71 -4.96 119.74 122.94 2fk9 s LYS 60 Ca 0.18 0.17 -0.09 0.00 -1.36 0.00 0.00 55.97 54.87 2fk9 s LYS 60 Cb -0.13 -2.64 -0.05 0.00 -1.68 0.00 0.00 37.83 33.33 2fk9 s LYS 60 CO 0.05 0.26 0.12 -0.65 -0.76 0.00 0.00 175.35 174.37 2fk9 s GLN 61 N -3.17 4.06 -1.09 1.68 -0.21 -1.26 -2.91 119.66 116.77 2fk9 s GLN 61 Ca 0.46 -0.24 -0.16 0.00 0.02 0.00 0.00 55.36 55.44 2fk9 s GLN 61 Cb -0.11 -3.35 -0.02 0.00 1.00 0.00 0.00 33.01 30.53 2fk9 s GLN 61 CO 0.25 0.35 0.81 1.63 -2.12 0.00 0.00 175.29 176.21 2fk9 n LYS 62 N 3.35 -1.42 -3.70 2.91 4.76 -0.51 -4.97 118.16 118.57 2fk9 n LYS 62 Ca -0.17 0.60 -0.13 0.00 -2.87 0.00 0.00 58.31 55.75 2fk9 n LYS 62 Cb 0.52 -4.47 -0.09 0.00 -1.84 0.00 0.00 35.03 29.15 2fk9 n LYS 62 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2fk9 s THR 63 N -3.40 -0.00 -1.63 -0.18 -1.32 -0.39 -4.87 115.64 103.84 2fk9 s THR 63 Ca 0.43 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 61.11 2fk9 s THR 63 Cb -0.13 -0.71 0.58 0.00 -1.51 0.00 0.00 72.50 70.72 2fk9 s THR 63 CO 0.83 0.00 1.49 0.59 -2.21 0.00 0.00 174.62 175.32 2fk9 n ASN 64 N 2.88 3.83 -3.10 8.08 3.02 -1.26 -3.81 115.26 124.89 2fk9 n ASN 64 Ca -0.14 -2.06 -0.17 0.00 -0.03 0.00 0.00 54.58 52.18 2fk9 n ASN 64 Cb 0.56 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 39.28 2fk9 n ASN 64 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2fk9 n LYS 65 N 1.32 0.94 -2.10 3.52 2.85 -1.26 -2.19 118.16 121.25 2fk9 n LYS 65 Ca 0.22 -3.08 -0.39 0.00 -1.05 0.00 0.00 58.31 54.01 2fk9 n LYS 65 Cb 0.61 -1.54 -0.00 0.00 -0.65 0.00 0.00 35.03 33.45 2fk9 n LYS 65 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2fk9 s PRO 66 N -1.77 3.83 -0.24 -1.58 0.04 -1.20 -4.72 135.00 129.36 2fk9 s PRO 66 Ca 0.36 2.04 -0.06 0.00 0.04 0.00 0.00 61.00 63.39 2fk9 s PRO 66 Cb 0.32 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 2fk9 s PRO 66 CO -0.08 -0.57 0.03 0.99 0.04 0.00 0.00 177.00 177.41 2fk9 s THR 67 N -1.35 3.93 -0.20 1.26 2.01 -1.26 -0.59 115.64 119.44 2fk9 s THR 67 Ca 0.60 -0.35 -0.16 0.00 0.31 0.00 0.00 61.69 62.09 2fk9 s THR 67 Cb -0.35 -2.85 -0.08 0.00 0.01 0.00 0.00 72.50 69.23 2fk9 s THR 67 CO 0.44 0.34 -0.31 -1.22 -0.69 0.00 0.00 174.62 173.18 2fk9 n TYR 68 N 4.87 0.14 -3.87 4.92 4.01 -0.14 -4.99 117.16 122.11 2fk9 n TYR 68 Ca -0.17 0.06 -0.25 0.00 -0.16 0.00 0.00 57.90 57.38 2fk9 n TYR 68 Cb 0.51 -0.67 -0.00 0.00 -0.31 0.00 0.00 39.34 38.87 2fk9 n TYR 68 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2fk9 n ASN 69 N -4.43 -0.98 -4.38 7.72 5.03 0.75 -5.00 115.26 113.97 2fk9 n ASN 69 Ca -0.23 -0.97 -0.28 0.00 0.87 0.00 0.00 54.58 53.97 2fk9 n ASN 69 Cb 0.58 -3.31 -0.13 0.00 -1.02 0.00 0.00 39.78 35.91 2fk9 n ASN 69 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2fk9 s GLU 70 N -6.37 1.39 0.00 3.52 2.02 -0.88 -4.94 118.70 113.45 2fk9 s GLU 70 Ca 0.05 -1.38 0.03 0.00 0.02 0.00 0.00 54.97 53.69 2fk9 s GLU 70 Cb -0.02 -1.80 -0.01 0.00 0.10 0.00 0.00 34.13 32.40 2fk9 s GLU 70 CO 0.87 0.41 -0.09 -1.21 0.02 0.00 0.00 175.26 175.27 2fk9 s GLU 71 N -2.23 0.67 0.03 1.61 2.02 -1.26 -0.84 118.70 118.69 2fk9 s GLU 71 Ca 0.15 -0.36 0.01 0.00 0.02 0.00 0.00 54.97 54.79 2fk9 s GLU 71 Cb -0.09 -0.63 -0.02 0.00 0.10 0.00 0.00 34.13 33.48 2fk9 s GLU 71 CO 0.07 0.17 -0.04 -0.06 0.02 0.00 0.00 175.26 175.41 2fk9 s PHE 72 N -0.33 0.39 0.05 1.61 0.08 0.73 -5.00 117.98 115.50 2fk9 s PHE 72 Ca 0.02 -0.49 -0.02 0.00 0.12 0.00 0.00 56.93 56.55 2fk9 s PHE 72 Cb -0.04 -0.25 -0.03 0.00 -0.57 0.00 0.00 43.02 42.13 2fk9 s PHE 72 CO -0.00 -0.15 0.01 0.00 -0.10 0.00 0.00 175.22 174.99 2fk9 s ALA 74 N -3.20 -1.79 0.12 0.00 0.00 -0.29 -4.99 121.76 111.61 2fk9 s ALA 74 Ca 0.00 1.62 -0.30 0.00 0.00 0.00 0.00 51.96 53.28 2fk9 s ALA 74 Cb 0.03 -0.54 -0.06 0.00 0.00 0.00 0.00 23.12 22.54 2fk9 s ALA 74 CO -0.07 -0.35 1.11 -0.80 0.00 0.00 0.00 175.76 175.64 2fk9 s ASN 75 N -0.55 7.24 -0.08 0.00 0.02 -1.26 -0.56 114.94 119.76 2fk9 s ASN 75 Ca -0.06 2.01 0.04 0.00 -1.02 0.00 0.00 52.86 53.83 2fk9 s ASN 75 Cb -0.02 -2.59 -0.01 0.00 0.02 0.00 0.00 41.25 38.64 2fk9 s ASN 75 CO 0.05 -0.28 -0.20 -0.69 0.02 0.00 0.00 177.10 176.00 2fk9 s VAL 76 N 0.26 2.52 -0.05 1.60 1.01 0.15 -4.93 120.40 120.95 2fk9 s VAL 76 Ca 0.52 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.64 2fk9 s VAL 76 Cb -0.28 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2fk9 s VAL 76 CO 0.32 0.56 -0.14 0.42 0.00 0.00 0.00 175.10 176.27 2fk9 s THR 77 N -0.14 1.23 -1.52 3.92 -4.23 -1.26 -1.60 115.64 112.04 2fk9 s THR 77 Ca -0.03 -0.57 -0.07 0.00 -1.18 0.00 0.00 61.69 59.84 2fk9 s THR 77 Cb -0.14 -1.09 0.06 0.00 1.34 0.00 0.00 72.50 72.67 2fk9 s THR 77 CO 0.04 0.37 0.57 0.47 -0.54 0.00 0.00 174.62 175.52 2fk9 n ASP 78 N 3.46 -1.56 -4.74 3.99 8.00 -1.13 -4.90 116.55 119.68 2fk9 n ASP 78 Ca -0.20 -1.00 -0.41 0.00 0.71 0.00 0.00 54.79 53.89 2fk9 n ASP 78 Cb 0.53 -2.98 -0.05 0.00 -0.02 0.00 0.00 41.12 38.60 2fk9 n ASP 78 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2fk9 s GLY 79 N -3.95 3.01 -0.10 0.44 0.00 0.14 -4.70 107.32 102.16 2fk9 s GLY 79 Ca 0.29 0.55 -0.10 0.00 0.00 0.00 0.00 44.72 45.46 2fk9 s GLY 79 CO 0.90 1.32 -0.21 0.61 0.00 0.00 0.00 173.10 175.73 2fk9 n GLY 80 N 2.03 -0.31 3.31 0.20 0.00 -1.26 -0.94 105.19 108.22 2fk9 n GLY 80 Ca 0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2fk9 n GLY 80 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2fk9 s HIS 81 N -2.44 0.36 -0.14 1.61 -3.43 -1.26 -1.66 115.29 108.33 2fk9 s HIS 81 Ca -0.19 -0.74 -0.03 0.00 -0.80 0.00 0.00 55.06 53.30 2fk9 s HIS 81 Cb 0.05 -0.07 -0.03 0.00 -1.43 0.00 0.00 32.58 31.11 2fk9 s HIS 81 CO 0.27 -0.68 -0.05 -1.17 -2.00 0.00 0.00 174.74 171.10 2fk9 s LEU 82 N -2.95 3.17 -0.11 5.38 2.96 0.30 -1.23 118.68 126.20 2fk9 s LEU 82 Ca 0.15 -0.14 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 2fk9 s LEU 82 Cb 0.04 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.97 2fk9 s LEU 82 CO -0.02 0.20 -0.16 -0.70 -1.32 0.00 0.00 176.35 174.35 2fk9 s GLU 83 N 0.18 3.20 -0.19 1.98 2.12 0.59 -0.62 118.70 125.96 2fk9 s GLU 83 Ca -0.03 -0.74 -0.04 0.00 0.36 0.00 0.00 54.97 54.52 2fk9 s GLU 83 Cb -0.14 -2.51 -0.02 0.00 0.26 0.00 0.00 34.13 31.72 2fk9 s GLU 83 CO 0.03 0.25 -0.04 -0.51 -0.54 0.00 0.00 175.26 174.45 2fk9 s LEU 84 N 0.24 3.05 -0.04 2.70 1.43 0.15 -0.98 118.68 125.23 2fk9 s LEU 84 Ca -0.11 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 2fk9 s LEU 84 Cb -0.16 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.31 2fk9 s LEU 84 CO 0.06 0.07 -0.11 0.00 0.23 0.00 0.00 176.35 176.60 2fk9 s ALA 85 N 0.94 1.12 -0.20 4.21 0.00 -0.61 -0.70 121.76 126.52 2fk9 s ALA 85 Ca -0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 51.96 51.45 2fk9 s ALA 85 Cb -0.15 -0.45 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 2fk9 s ALA 85 CO 0.01 0.15 0.12 0.08 0.00 0.00 0.00 175.76 176.12 2fk9 s VAL 86 N 0.37 5.27 0.20 0.00 1.01 1.00 -0.73 120.40 127.51 2fk9 s VAL 86 Ca -0.08 0.14 0.10 0.00 0.00 0.00 0.00 61.98 62.14 2fk9 s VAL 86 Cb -0.12 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 2fk9 s VAL 86 CO 0.02 0.43 -0.20 -0.36 0.00 0.00 0.00 175.10 174.99 2fk9 s PHE 87 N 0.46 2.07 -0.27 5.22 0.08 0.12 -0.27 117.98 125.40 2fk9 s PHE 87 Ca 0.07 -0.41 -0.12 0.00 0.12 0.00 0.00 56.93 56.59 2fk9 s PHE 87 Cb -0.12 -1.00 -0.05 0.00 -0.57 0.00 0.00 43.02 41.29 2fk9 s PHE 87 CO -0.01 0.46 0.22 -1.58 -0.10 0.00 0.00 175.22 174.21 2fk9 s HIS 88 N -2.04 3.24 -0.26 0.36 5.65 0.51 -1.28 115.29 121.48 2fk9 s HIS 88 Ca 0.20 0.19 -0.29 0.00 0.25 0.00 0.00 55.06 55.42 2fk9 s HIS 88 Cb -0.06 -2.39 -0.01 0.00 -1.18 0.00 0.00 32.58 28.94 2fk9 s HIS 88 CO 0.09 -0.13 1.32 -2.00 -0.65 0.00 0.00 174.74 173.38 2fk9 s GLU 89 N 1.67 3.98 0.47 2.88 2.12 -0.00 -1.50 118.70 128.32 2fk9 s GLU 89 Ca 0.09 1.39 -0.05 0.00 0.36 0.00 0.00 54.97 56.75 2fk9 s GLU 89 Cb -0.15 -3.87 -0.04 0.00 0.26 0.00 0.00 34.13 30.33 2fk9 s GLU 89 CO 0.10 -1.03 0.77 0.95 -0.54 0.00 0.00 175.26 175.50 2fk9 s THR 90 N 4.23 4.92 0.33 -1.70 -4.23 -1.26 -4.70 115.64 113.24 2fk9 s THR 90 Ca 0.57 0.16 0.02 0.00 -1.18 0.00 0.00 61.69 61.27 2fk9 s THR 90 Cb -0.19 -3.87 0.21 0.00 1.34 0.00 0.00 72.50 70.00 2fk9 s THR 90 CO 0.22 -0.83 1.93 -0.65 -0.54 0.00 0.00 174.62 174.75 2fk9 h PRO 91 N 0.26 0.75 -3.15 3.99 0.11 -1.95 -3.45 132.00 128.55 2fk9 h PRO 91 Ca -0.47 -0.10 -0.12 0.00 0.11 0.00 0.00 66.00 65.42 2fk9 h PRO 91 Cb 1.21 -0.14 -0.20 0.00 0.11 0.00 0.00 31.00 31.97 2fk9 h PRO 91 CO 0.62 0.59 -0.33 -0.51 -0.21 0.00 0.00 178.00 178.16 2fk9 s LEU 92 N -9.46 1.03 0.00 2.35 1.43 -1.26 -5.13 118.68 107.63 2fk9 s LEU 92 Ca -0.09 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2fk9 s LEU 92 Cb 0.17 1.12 0.00 0.00 0.03 0.00 0.00 46.19 47.50 2fk9 s LEU 92 CO 0.77 -0.43 0.00 0.61 0.23 0.00 0.00 176.35 177.54 2fk9 n GLY 93 N 1.33 -1.90 3.76 -3.19 0.00 -1.26 -4.88 105.19 99.06 2fk9 n GLY 93 Ca -0.22 -1.39 -0.36 0.00 0.00 0.00 0.00 46.02 44.06 2fk9 n GLY 93 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fk9 s TYR 94 N 0.00 2.54 0.92 1.61 2.02 -1.26 -4.82 117.35 118.37 2fk9 s TYR 94 Ca 0.00 1.53 -0.12 0.00 -0.37 0.00 0.00 57.07 58.11 2fk9 s TYR 94 Cb 0.00 -3.40 0.14 0.00 -0.40 0.00 0.00 41.96 38.30 2fk9 s TYR 94 CO 0.00 -1.90 1.09 -0.51 -1.57 0.00 0.00 175.55 172.66 2fk9 s ASP 95 N -1.64 3.25 -0.13 2.29 1.01 -1.26 -4.67 116.67 115.51 2fk9 s ASP 95 Ca 0.74 1.43 -0.04 0.00 0.71 0.00 0.00 52.55 55.40 2fk9 s ASP 95 Cb -0.28 -2.11 -0.03 0.00 1.01 0.00 0.00 42.92 41.51 2fk9 s ASP 95 CO 0.31 -2.77 0.01 -1.00 0.21 0.00 0.00 175.17 171.92 2fk9 s HIS 96 N -2.93 3.15 0.37 4.23 3.76 -0.56 -4.94 115.29 118.37 2fk9 s HIS 96 Ca 0.64 0.01 -0.28 0.00 -0.15 0.00 0.00 55.06 55.28 2fk9 s HIS 96 Cb -0.18 -1.92 -0.11 0.00 1.11 0.00 0.00 32.58 31.48 2fk9 s HIS 96 CO 0.57 0.24 1.46 0.34 -0.85 0.00 0.00 174.74 176.49 2fk9 n PHE 97 N 2.93 2.87 0.00 1.40 7.35 -1.26 -0.36 117.46 130.39 2fk9 n PHE 97 Ca -0.18 0.46 -0.03 0.00 -0.76 0.00 0.00 57.45 56.94 2fk9 n PHE 97 Cb 0.53 -2.51 -0.01 0.00 0.35 0.00 0.00 39.48 37.83 2fk9 n PHE 97 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2fk9 n VAL 98 N 0.46 1.08 -3.57 -2.13 0.31 0.63 -4.71 118.33 110.40 2fk9 n VAL 98 Ca 0.02 0.24 -0.07 0.00 -0.01 0.00 0.00 64.34 64.52 2fk9 n VAL 98 Cb 0.38 -1.73 -0.02 0.00 -0.91 0.00 0.00 33.84 31.56 2fk9 n VAL 98 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fk9 s ALA 99 N -2.20 -1.79 0.25 3.52 0.00 -1.10 -4.54 121.76 115.91 2fk9 s ALA 99 Ca -0.08 0.79 -0.07 0.00 0.00 0.00 0.00 51.96 52.60 2fk9 s ALA 99 Cb 0.02 0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.59 2fk9 s ALA 99 CO 0.11 -0.78 0.37 0.54 0.00 0.00 0.00 175.76 175.99 2fk9 s ASN 100 N -2.61 0.22 -0.12 0.00 4.22 -0.36 -0.00 114.94 116.29 2fk9 s ASN 100 Ca 0.07 -1.19 -0.07 0.00 -2.14 0.00 0.00 52.86 49.53 2fk9 s ASN 100 Cb -0.01 0.54 0.05 0.00 1.28 0.00 0.00 41.25 43.11 2fk9 s ASN 100 CO -0.06 -1.08 0.29 0.00 -2.04 0.00 0.00 177.10 174.21 2fk9 s THR 102 N 1.14 2.94 -0.24 0.00 2.01 -1.26 -0.67 115.64 119.56 2fk9 s THR 102 Ca -0.08 -0.68 -0.02 0.00 0.31 0.00 0.00 61.69 61.22 2fk9 s THR 102 Cb -0.09 -2.25 0.02 0.00 0.01 0.00 0.00 72.50 70.19 2fk9 s THR 102 CO -0.08 0.51 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.53 2fk9 s LEU 103 N 0.68 3.14 0.24 4.42 1.43 0.21 -4.98 118.68 123.82 2fk9 s LEU 103 Ca -0.06 -0.81 -0.30 0.00 -1.03 0.00 0.00 54.13 51.93 2fk9 s LEU 103 Cb -0.15 -1.67 -0.09 0.00 0.03 0.00 0.00 46.19 44.30 2fk9 s LEU 103 CO 0.02 -0.11 1.36 -1.10 0.23 0.00 0.00 176.35 176.74 2fk9 s GLN 104 N 1.35 4.34 0.32 1.70 -1.52 -1.26 -0.54 119.66 124.05 2fk9 s GLN 104 Ca 0.01 2.17 -0.00 0.00 -1.95 0.00 0.00 55.36 55.59 2fk9 s GLN 104 Cb -0.16 -3.14 0.51 0.00 -0.22 0.00 0.00 33.01 30.00 2fk9 s GLN 104 CO -0.04 -0.30 1.95 0.74 -0.25 0.00 0.00 175.29 177.39 2fk9 h PHE 105 N 4.91 0.90 -0.21 0.91 0.04 -1.65 -1.65 116.94 120.18 2fk9 h PHE 105 Ca -0.46 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.25 2fk9 h PHE 105 Cb 1.22 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 39.06 2fk9 h PHE 105 CO 0.60 0.61 -0.11 1.96 -0.60 0.00 0.00 178.31 180.77 2fk9 h GLN 106 N 0.94 0.34 -0.42 1.51 1.08 -1.92 -0.06 115.11 116.59 2fk9 h GLN 106 Ca 0.24 -0.08 -0.11 0.00 -1.45 0.00 0.00 58.65 57.25 2fk9 h GLN 106 Cb -0.02 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 2fk9 h GLN 106 CO -0.04 0.46 -0.16 0.93 -0.95 0.00 0.00 178.83 179.07 2fk9 h GLU 107 N 0.32 0.84 -0.07 1.46 5.08 -1.72 0.17 114.58 120.66 2fk9 h GLU 107 Ca 0.07 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2fk9 h GLU 107 Cb 0.39 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 2fk9 h GLU 107 CO 0.02 0.98 0.04 -0.07 -1.00 0.00 0.00 179.01 178.99 2fk9 h LEU 108 N 0.66 0.07 -0.78 1.33 3.38 -0.88 -1.45 115.31 117.63 2fk9 h LEU 108 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2fk9 h LEU 108 Cb 0.71 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 2fk9 h LEU 108 CO 0.05 0.05 0.43 -0.07 0.09 0.00 0.00 178.44 178.99 2fk9 h LEU 109 N 0.08 0.98 -1.33 1.67 3.38 -0.87 -1.83 115.31 117.40 2fk9 h LEU 109 Ca 0.03 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2fk9 h LEU 109 Cb -0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2fk9 h LEU 109 CO -0.01 0.80 -0.17 0.03 0.09 0.00 0.00 178.44 179.17 2fk9 h ARG 110 N 1.09 0.24 -0.11 1.13 3.08 -0.81 -2.77 114.38 116.22 2fk9 h ARG 110 Ca 0.28 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.13 2fk9 h ARG 110 Cb 0.04 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.06 2fk9 h ARG 110 CO -0.04 0.41 -0.47 1.15 -1.07 0.00 0.00 179.97 179.95 2fk9 h THR 111 N 0.22 1.37 0.00 2.04 2.02 -0.56 -3.34 112.91 114.66 2fk9 h THR 111 Ca 0.04 -1.79 -0.03 0.00 0.77 0.00 0.00 66.41 65.41 2fk9 h THR 111 Cb 0.44 2.17 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 2fk9 h THR 111 CO 0.03 0.54 -0.47 0.71 0.37 0.00 0.00 175.52 176.70 2fk9 h THR 112 N 0.11 0.17 0.00 3.16 1.35 -1.26 -3.48 112.91 112.95 2fk9 h THR 112 Ca -0.03 -1.26 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 2fk9 h THR 112 Cb 1.10 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 2fk9 h THR 112 CO 0.10 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 2fk9 n GLY 113 N 1.16 3.95 0.19 5.82 0.00 -1.05 -1.44 105.19 113.82 2fk9 n GLY 113 Ca 0.02 0.17 0.14 0.00 0.00 0.00 0.00 46.02 46.34 2fk9 n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fk9 h ALA 114 N -0.96 1.00 -2.49 4.61 0.00 -1.92 -3.43 119.26 116.06 2fk9 h ALA 114 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2fk9 h ALA 114 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2fk9 h ALA 114 CO 0.00 0.00 -0.10 0.45 0.00 0.00 0.00 179.25 179.60 2fk9 s SER 115 N -4.86 6.59 0.00 0.00 0.15 -0.52 -5.01 113.70 110.05 2fk9 s SER 115 Ca 0.03 0.90 0.24 0.00 0.70 0.00 0.00 55.95 57.83 2fk9 s SER 115 Cb 0.09 -2.22 0.39 0.00 -1.71 0.00 0.00 66.02 62.57 2fk9 s SER 115 CO 0.46 -0.11 1.33 0.47 1.20 0.00 0.00 173.24 176.59 2fk9 n ASP 116 N -0.32 0.89 -4.39 5.45 8.00 -1.26 -4.69 116.55 120.24 2fk9 n ASP 116 Ca 0.00 -0.69 -0.33 0.00 0.71 0.00 0.00 54.79 54.48 2fk9 n ASP 116 Cb 0.53 0.38 -0.14 0.00 -0.02 0.00 0.00 41.12 41.86 2fk9 n ASP 116 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2fk9 s THR 117 N -2.81 3.18 -0.15 -3.53 2.01 -1.26 -1.65 115.64 111.44 2fk9 s THR 117 Ca 0.15 -0.61 -0.06 0.00 0.31 0.00 0.00 61.69 61.48 2fk9 s THR 117 Cb 0.18 -2.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 2fk9 s THR 117 CO 0.67 0.52 0.06 0.12 -0.69 0.00 0.00 174.62 175.30 2fk9 s PHE 118 N 0.40 3.30 -0.04 4.92 5.36 0.24 -4.88 117.98 127.28 2fk9 s PHE 118 Ca -0.09 0.20 0.02 0.00 -0.96 0.00 0.00 56.93 56.10 2fk9 s PHE 118 Cb -0.16 -1.98 0.01 0.00 -0.34 0.00 0.00 43.02 40.56 2fk9 s PHE 118 CO 0.05 0.35 -0.10 -1.21 -1.46 0.00 0.00 175.22 172.86 2fk9 s GLU 119 N -0.23 1.21 0.00 10.12 2.02 -1.26 -0.73 118.70 129.83 2fk9 s GLU 119 Ca 0.08 -0.32 0.00 0.00 0.02 0.00 0.00 54.97 54.75 2fk9 s GLU 119 Cb -0.12 -1.08 0.00 0.00 0.10 0.00 0.00 34.13 33.03 2fk9 s GLU 119 CO 0.01 0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.76 2fk9 n GLY 120 N 3.58 0.62 3.74 -1.39 0.00 -0.54 -5.00 105.19 106.20 2fk9 n GLY 120 Ca -0.21 -1.11 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 2fk9 n GLY 120 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2fk9 s TRP 121 N -2.00 3.83 0.03 1.61 0.52 -1.26 -0.99 118.94 120.67 2fk9 s TRP 121 Ca 0.00 1.76 0.08 0.00 0.02 0.00 0.00 56.10 57.95 2fk9 s TRP 121 Cb 0.00 -2.99 -0.03 0.00 -1.15 0.00 0.00 33.47 29.30 2fk9 s TRP 121 CO 0.00 0.27 -0.22 0.14 0.02 0.00 0.00 176.95 177.17 2fk9 s VAL 122 N -0.26 2.50 0.19 4.03 -7.23 0.08 -4.94 120.40 114.78 2fk9 s VAL 122 Ca 0.44 -1.20 -0.30 0.00 -1.81 0.00 0.00 61.98 59.11 2fk9 s VAL 122 Cb -0.23 -2.00 -0.08 0.00 0.56 0.00 0.00 36.38 34.63 2fk9 s VAL 122 CO 0.29 0.40 1.01 -1.81 -0.31 0.00 0.00 175.10 174.68 2fk9 s ASP 123 N -1.19 7.45 0.05 4.85 1.01 -1.26 -1.21 116.67 126.36 2fk9 s ASP 123 Ca 0.13 1.99 -0.10 0.00 0.71 0.00 0.00 52.55 55.28 2fk9 s ASP 123 Cb -0.10 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.17 2fk9 s ASP 123 CO 0.03 -0.05 0.37 -0.76 0.21 0.00 0.00 175.17 174.96 2fk9 s LEU 124 N -0.64 4.37 -0.14 1.23 1.43 0.24 -4.59 118.68 120.58 2fk9 s LEU 124 Ca 0.46 0.76 -0.03 0.00 -1.03 0.00 0.00 54.13 54.29 2fk9 s LEU 124 Cb -0.27 -2.84 -0.03 0.00 0.03 0.00 0.00 46.19 43.08 2fk9 s LEU 124 CO 0.33 0.22 -0.04 -1.61 0.23 0.00 0.00 176.35 175.48 2fk9 s GLU 125 N -1.74 3.49 0.22 1.70 0.41 0.62 -2.37 118.70 121.02 2fk9 s GLU 125 Ca 0.30 -0.52 0.25 0.00 -0.41 0.00 0.00 54.97 54.59 2fk9 s GLU 125 Cb -0.14 -2.85 0.52 0.00 -1.78 0.00 0.00 34.13 29.88 2fk9 s GLU 125 CO 0.17 0.33 1.54 -1.00 -0.49 0.00 0.00 175.26 175.81 2fk9 h PRO 126 N 6.38 0.00 -2.79 0.39 0.13 -1.87 -0.94 132.00 133.30 2fk9 h PRO 126 Ca -0.35 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.68 2fk9 h PRO 126 Cb 1.19 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.11 2fk9 h PRO 126 CO 0.61 0.00 -0.19 -1.21 -0.23 0.00 0.00 178.00 176.98 2fk9 s GLU 127 N -3.16 0.70 0.00 0.86 2.02 -1.00 -5.15 118.70 112.96 2fk9 s GLU 127 Ca 0.08 0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.12 2fk9 s GLU 127 Cb 0.11 0.32 0.00 0.00 0.10 0.00 0.00 34.13 34.66 2fk9 s GLU 127 CO 0.66 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 176.17 2fk9 n GLY 128 N 1.55 1.59 3.22 -1.39 0.00 -1.22 -4.58 105.19 104.36 2fk9 n GLY 128 Ca -0.19 -2.08 -0.11 0.00 0.00 0.00 0.00 46.02 43.63 2fk9 n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fk9 s LYS 129 N -1.83 0.76 0.00 1.61 -2.85 -0.55 -0.59 119.74 116.29 2fk9 s LYS 129 Ca 0.00 -0.55 0.02 0.00 -1.00 0.00 0.00 55.97 54.44 2fk9 s LYS 129 Cb 0.00 0.33 -0.01 0.00 -2.06 0.00 0.00 37.83 36.09 2fk9 s LYS 129 CO 0.00 -0.24 -0.06 0.54 0.10 0.00 0.00 175.35 175.70 2fk9 s VAL 130 N -2.55 0.45 -0.15 1.79 0.11 -0.35 -1.34 120.40 118.37 2fk9 s VAL 130 Ca -0.05 -0.33 -0.18 0.00 -2.93 0.00 0.00 61.98 58.50 2fk9 s VAL 130 Cb -0.01 -0.40 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 2fk9 s VAL 130 CO -0.03 0.07 0.47 0.12 -3.33 0.00 0.00 175.10 172.39 2fk9 s PHE 131 N -0.26 3.46 0.09 1.54 5.36 0.01 -0.74 117.98 127.44 2fk9 s PHE 131 Ca 0.01 0.82 0.04 0.00 -0.96 0.00 0.00 56.93 56.84 2fk9 s PHE 131 Cb -0.03 -2.57 -0.03 0.00 -0.34 0.00 0.00 43.02 40.05 2fk9 s PHE 131 CO -0.00 0.09 -0.12 0.14 -1.46 0.00 0.00 175.22 173.87 2fk9 s VAL 132 N 0.92 1.02 -0.15 3.12 -7.23 -0.16 -0.42 120.40 117.50 2fk9 s VAL 132 Ca 0.24 -1.49 0.00 0.00 -1.81 0.00 0.00 61.98 58.92 2fk9 s VAL 132 Cb -0.15 -1.22 0.03 0.00 0.56 0.00 0.00 36.38 35.60 2fk9 s VAL 132 CO 0.10 -0.41 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.68 2fk9 s VAL 133 N -1.91 1.35 -0.10 1.32 1.01 -0.06 -1.46 120.40 120.54 2fk9 s VAL 133 Ca 0.02 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2fk9 s VAL 133 Cb -0.06 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.98 2fk9 s VAL 133 CO 0.01 0.34 -0.14 -0.63 0.00 0.00 0.00 175.10 174.68 2fk9 s ILE 134 N 1.56 1.40 -0.11 2.22 1.01 0.09 -0.19 121.20 127.18 2fk9 s ILE 134 Ca 0.03 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.12 2fk9 s ILE 134 Cb -0.14 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.04 2fk9 s ILE 134 CO -0.09 0.42 -0.18 -0.89 0.00 0.00 0.00 174.94 174.20 2fk9 s THR 135 N 0.98 2.60 -0.18 2.92 2.01 0.09 -0.59 115.64 123.47 2fk9 s THR 135 Ca -0.07 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.10 2fk9 s THR 135 Cb -0.15 -2.05 0.01 0.00 0.01 0.00 0.00 72.50 70.33 2fk9 s THR 135 CO -0.01 0.54 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.53 2fk9 s LEU 136 N 0.27 2.26 0.00 4.42 1.43 -0.66 -1.53 118.68 124.87 2fk9 s LEU 136 Ca -0.13 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 2fk9 s LEU 136 Cb -0.16 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.54 2fk9 s LEU 136 CO 0.07 0.01 0.38 0.35 0.23 0.00 0.00 176.35 177.39