#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fak s ASP -7 N 0.00 6.52 0.58 6.43 3.68 -1.26 -4.89 116.67 127.73 2fak s ASP -7 Ca 0.00 0.17 0.32 0.00 2.13 0.00 0.00 52.55 55.18 2fak s ASP -7 Cb 0.00 -2.49 1.34 0.00 -1.45 0.00 0.00 42.92 40.32 2fak s ASP -7 CO 0.00 -1.18 1.64 -0.65 0.13 0.00 0.00 175.17 175.11 2fak h PRO -6 N 9.20 0.00 -0.03 4.34 0.11 -2.02 0.62 132.00 144.22 2fak h PRO -6 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2fak h PRO -6 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2fak h PRO -6 CO 1.08 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.30 2fak n SER -5 N -3.67 1.04 -0.04 -2.05 7.64 -1.26 -3.56 113.62 111.72 2fak n SER -5 Ca 0.21 -1.39 0.01 0.00 1.01 0.00 0.00 58.87 58.71 2fak n SER -5 Cb 1.23 -0.01 0.02 0.00 -1.01 0.00 0.00 64.21 64.44 2fak n SER -5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2fak n SER -4 N -0.17 1.37 -0.05 6.43 7.64 0.21 -4.59 113.62 124.47 2fak n SER -4 Ca 0.20 -1.84 -0.15 0.00 1.01 0.00 0.00 58.87 58.08 2fak n SER -4 Cb 0.27 -0.06 -0.13 0.00 -1.01 0.00 0.00 64.21 63.28 2fak n SER -4 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2fak h ILE -3 N 1.23 1.74 0.00 0.44 2.04 -1.63 -3.40 117.51 117.92 2fak h ILE -3 Ca 0.00 -2.38 -0.16 0.00 1.00 0.00 0.00 64.86 63.32 2fak h ILE -3 Cb 0.75 3.35 -0.03 0.00 -0.74 0.00 0.00 36.82 40.15 2fak h ILE -3 CO 0.00 0.63 -1.84 0.59 0.00 0.00 0.00 178.15 177.52 2fak n ASN -2 N -4.53 0.36 -0.80 1.72 5.03 -1.26 -1.63 115.26 114.15 2fak n ASN -2 Ca -0.11 0.15 0.10 0.00 0.87 0.00 0.00 54.58 55.60 2fak n ASN -2 Cb 0.54 0.97 -0.03 0.00 -1.02 0.00 0.00 39.78 40.24 2fak n ASN -2 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2fak n GLY -1 N 1.44 -2.09 0.00 7.41 0.00 -1.26 -1.74 105.19 108.95 2fak n GLY -1 Ca -0.14 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.58 2fak n GLY -1 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fak n GLY 1 N -3.25 3.85 3.12 -0.02 0.00 -1.14 -4.69 105.19 103.06 2fak n GLY 1 Ca -0.01 -1.68 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 2fak n GLY 1 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2fak s ILE 2 N -2.38 0.20 -0.08 -0.61 -4.36 -1.26 -1.70 121.20 111.02 2fak s ILE 2 Ca 0.00 -1.86 -0.13 0.00 -0.26 0.00 0.00 60.65 58.39 2fak s ILE 2 Cb 0.00 -1.76 0.03 0.00 1.25 0.00 0.00 42.46 41.98 2fak s ILE 2 CO 0.00 -0.76 0.34 -0.69 0.24 0.00 0.00 174.94 174.07 2fak s VAL 3 N -3.95 0.03 -0.12 8.37 1.01 -0.42 -2.81 120.40 122.50 2fak s VAL 3 Ca 0.15 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.81 2fak s VAL 3 Cb 0.08 -0.55 0.04 0.00 0.00 0.00 0.00 36.38 35.94 2fak s VAL 3 CO -0.04 -0.12 0.32 0.54 0.00 0.00 0.00 175.10 175.80 2fak s VAL 4 N -0.50 -0.01 -0.01 2.92 0.11 -0.25 -1.47 120.40 121.20 2fak s VAL 4 Ca -0.06 0.02 0.05 0.00 -2.93 0.00 0.00 61.98 59.06 2fak s VAL 4 Cb -0.04 -0.46 -0.01 0.00 -1.53 0.00 0.00 36.38 34.34 2fak s VAL 4 CO 0.02 0.01 -0.15 0.00 -3.33 0.00 0.00 175.10 171.65 2fak s ALA 5 N 0.39 1.25 0.08 1.54 0.00 -0.40 -0.39 121.76 124.22 2fak s ALA 5 Ca -0.02 -0.67 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2fak s ALA 5 Cb -0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 2fak s ALA 5 CO -0.02 0.30 -0.09 -1.64 0.00 0.00 0.00 175.76 174.32 2fak s MET 6 N -0.43 0.73 0.02 0.00 -1.94 0.25 -1.23 119.30 116.69 2fak s MET 6 Ca 0.05 -1.04 0.03 0.00 -1.71 0.00 0.00 55.69 53.03 2fak s MET 6 Cb -0.06 -0.39 -0.04 0.00 2.01 0.00 0.00 34.83 36.35 2fak s MET 6 CO -0.00 0.06 -0.05 0.95 -0.01 0.00 0.00 175.02 175.96 2fak s THR 7 N -2.23 3.77 0.00 2.05 -4.23 -0.69 -1.01 115.64 113.31 2fak s THR 7 Ca 0.01 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 2fak s THR 7 Cb -0.04 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 71.13 2fak s THR 7 CO -0.01 0.35 0.00 0.61 -0.54 0.00 0.00 174.62 175.03 2fak n GLY 8 N 1.39 4.20 3.60 3.99 0.00 0.28 -4.60 105.19 114.05 2fak n GLY 8 Ca -0.15 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 2fak n GLY 8 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fak s LYS 9 N -1.68 3.29 -1.61 1.61 2.47 0.43 -3.00 119.74 121.25 2fak s LYS 9 Ca 0.00 1.36 0.00 0.00 -1.56 0.00 0.00 55.97 55.77 2fak s LYS 9 Cb 0.00 -4.21 0.00 0.00 -1.46 0.00 0.00 37.83 32.16 2fak s LYS 9 CO 0.00 -1.92 0.00 -0.25 0.16 0.00 0.00 175.35 173.34 2fak n ASP 10 N 10.44 -4.76 -3.72 1.43 9.92 -1.26 -4.67 116.55 123.94 2fak n ASP 10 Ca 0.23 0.23 -0.10 0.00 -0.53 0.00 0.00 54.79 54.62 2fak n ASP 10 Cb 0.47 -4.12 -0.05 0.00 -0.64 0.00 0.00 41.12 36.78 2fak n ASP 10 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fak s VAL 12 N -3.85 0.15 0.03 0.00 -7.23 -0.53 -0.55 120.40 108.41 2fak s VAL 12 Ca 0.07 -0.97 0.03 0.00 -1.81 0.00 0.00 61.98 59.29 2fak s VAL 12 Cb 0.01 -0.36 -0.02 0.00 0.56 0.00 0.00 36.38 36.58 2fak s VAL 12 CO -0.07 -0.52 -0.09 0.00 -0.31 0.00 0.00 175.10 174.11 2fak s ALA 13 N -1.60 0.73 -0.04 1.32 0.00 -0.18 0.22 121.76 122.22 2fak s ALA 13 Ca -0.14 -0.64 -0.01 0.00 0.00 0.00 0.00 51.96 51.17 2fak s ALA 13 Cb -0.09 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.99 2fak s ALA 13 CO -0.01 0.09 0.08 -1.50 0.00 0.00 0.00 175.76 174.42 2fak s ILE 14 N -0.86 -0.06 0.15 0.00 2.07 -0.65 -0.58 121.20 121.27 2fak s ILE 14 Ca -0.03 0.20 0.03 0.00 -1.41 0.00 0.00 60.65 59.44 2fak s ILE 14 Cb -0.07 -0.14 -0.05 0.00 0.13 0.00 0.00 42.46 42.33 2fak s ILE 14 CO 0.01 0.08 -0.05 0.00 -1.91 0.00 0.00 174.94 173.06 2fak s ALA 15 N 1.10 1.38 0.14 1.50 0.00 0.47 -1.02 121.76 125.33 2fak s ALA 15 Ca -0.09 -1.52 -0.18 0.00 0.00 0.00 0.00 51.96 50.17 2fak s ALA 15 Cb -0.12 0.26 0.04 0.00 0.00 0.00 0.00 23.12 23.30 2fak s ALA 15 CO -0.04 -0.20 0.46 0.00 0.00 0.00 0.00 175.76 175.98 2fak n ASP 17 N -0.27 0.49 0.00 0.00 3.85 -1.12 -1.40 116.55 118.09 2fak n ASP 17 Ca -0.16 -1.63 0.00 0.00 -0.71 0.00 0.00 54.79 52.29 2fak n ASP 17 Cb 0.64 -0.77 0.00 0.00 -1.35 0.00 0.00 41.12 39.64 2fak n ASP 17 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 2fak n LEU 18 N 0.00 1.41 -4.79 -2.12 4.77 -0.52 -4.50 117.00 111.25 2fak n LEU 18 Ca 0.15 -1.41 -0.36 0.00 -0.03 0.00 0.00 56.01 54.36 2fak n LEU 18 Cb 0.51 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2fak n LEU 18 CO 0.36 0.35 0.74 -0.60 -1.33 0.00 0.00 177.39 176.91 2fak s ARG 19 N -0.44 4.00 -0.20 3.23 3.52 -0.96 -1.58 118.95 126.52 2fak s ARG 19 Ca 0.00 1.49 -0.04 0.00 -0.13 0.00 0.00 55.73 57.05 2fak s ARG 19 Cb 0.00 -2.38 0.09 0.00 -1.56 0.00 0.00 34.95 31.10 2fak s ARG 19 CO 0.00 -0.28 0.20 -1.17 -0.81 0.00 0.00 175.30 173.24 2fak s LEU 20 N -2.95 -0.02 0.00 -0.88 1.98 -0.62 -4.67 118.68 111.51 2fak s LEU 20 Ca 0.61 -0.34 0.01 0.00 -2.89 0.00 0.00 54.13 51.52 2fak s LEU 20 Cb -0.21 0.26 0.01 0.00 0.66 0.00 0.00 46.19 46.91 2fak s LEU 20 CO 0.26 -0.34 0.07 0.61 -1.89 0.00 0.00 176.35 175.06 2fak n GLY 21 N 5.31 3.54 2.43 7.98 0.00 -0.71 -1.08 105.19 122.66 2fak n GLY 21 Ca -0.06 -2.28 -0.26 0.00 0.00 0.00 0.00 46.02 43.43 2fak n GLY 21 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fak s SER 22 N -2.57 1.48 1.64 1.61 0.15 0.63 -4.16 113.70 112.49 2fak s SER 22 Ca 0.05 -2.83 0.00 0.00 0.70 0.00 0.00 55.95 53.87 2fak s SER 22 Cb -0.00 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2fak s SER 22 CO 0.03 -0.19 0.00 0.00 1.20 0.00 0.00 173.24 174.29 2fak n GLN 23 N 3.06 0.00 0.14 5.44 1.13 -0.65 -2.39 117.38 124.11 2fak n GLN 23 Ca 0.26 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.32 2fak n GLN 23 Cb 0.47 0.00 0.27 0.00 0.11 0.00 0.00 30.24 31.08 2fak n GLN 23 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2fak h SER 24 N 0.00 0.11 -2.90 1.08 4.64 -1.97 -3.44 113.55 111.08 2fak h SER 24 Ca 0.00 -0.05 -0.56 0.00 -0.47 0.00 0.00 61.79 60.71 2fak h SER 24 Cb 0.00 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2fak h SER 24 CO 0.00 0.53 0.90 -0.22 -0.87 0.00 0.00 176.83 177.17 2fak s LEU 25 N -8.12 4.21 0.17 5.97 2.96 -1.01 -5.01 118.68 117.85 2fak s LEU 25 Ca -0.03 1.78 -0.30 0.00 -0.22 0.00 0.00 54.13 55.36 2fak s LEU 25 Cb 0.14 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 43.21 2fak s LEU 25 CO 0.75 -0.76 1.06 -0.83 -1.32 0.00 0.00 176.35 175.25 2fak s GLY 26 N 2.07 2.90 -0.07 7.98 0.00 -1.26 -0.27 107.32 118.67 2fak s GLY 26 Ca 0.57 0.75 0.00 0.00 0.00 0.00 0.00 44.72 46.04 2fak s GLY 26 CO 0.17 1.58 -0.06 -0.62 0.00 0.00 0.00 173.10 174.18 2fak n VAL 27 N 2.42 0.38 -3.90 1.40 0.31 -0.24 -4.90 118.33 113.81 2fak n VAL 27 Ca 0.02 -0.14 -0.11 0.00 -0.01 0.00 0.00 64.34 64.10 2fak n VAL 27 Cb 0.47 -0.80 -0.12 0.00 -0.91 0.00 0.00 33.84 32.48 2fak n VAL 27 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2fak s SER 28 N -4.72 0.06 -0.11 4.52 0.15 -0.46 -5.00 113.70 108.13 2fak s SER 28 Ca -0.09 -0.17 0.14 0.00 0.70 0.00 0.00 55.95 56.53 2fak s SER 28 Cb 0.02 0.15 0.34 0.00 -1.71 0.00 0.00 66.02 64.82 2fak s SER 28 CO 0.15 -0.21 1.25 -0.46 1.20 0.00 0.00 173.24 175.17 2fak n ASN 29 N 2.12 2.98 -0.23 5.45 2.04 -1.26 -1.59 115.26 124.77 2fak n ASN 29 Ca -0.19 -2.70 0.04 0.00 -0.44 0.00 0.00 54.58 51.28 2fak n ASN 29 Cb 0.57 -0.37 0.05 0.00 -2.53 0.00 0.00 39.78 37.50 2fak n ASN 29 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 2fak n LYS 30 N -0.60 0.81 -2.62 -3.83 5.02 -1.15 -4.74 118.16 111.05 2fak n LYS 30 Ca 0.15 -1.61 -0.41 0.00 -2.02 0.00 0.00 58.31 54.41 2fak n LYS 30 Cb 0.64 -0.94 -0.03 0.00 -0.02 0.00 0.00 35.03 34.68 2fak n LYS 30 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2fak s PHE 31 N -1.22 2.57 0.24 2.13 5.36 -0.61 -4.98 117.98 121.46 2fak s PHE 31 Ca 0.12 -0.76 -0.30 0.00 -0.96 0.00 0.00 56.93 55.03 2fak s PHE 31 Cb 0.11 -4.62 -0.09 0.00 -0.34 0.00 0.00 43.02 38.08 2fak s PHE 31 CO 0.01 -1.90 1.01 -1.21 -1.46 0.00 0.00 175.22 171.68 2fak s GLU 32 N 4.79 4.75 0.00 10.12 2.02 -1.26 -4.44 118.70 134.67 2fak s GLU 32 Ca 0.41 1.62 0.13 0.00 0.02 0.00 0.00 54.97 57.15 2fak s GLU 32 Cb -0.03 -3.26 0.29 0.00 0.10 0.00 0.00 34.13 31.24 2fak s GLU 32 CO -0.05 0.35 1.20 1.63 0.02 0.00 0.00 175.26 178.41 2fak n LYS 33 N 1.57 2.28 -4.71 1.61 5.02 -1.26 -4.94 118.16 117.72 2fak n LYS 33 Ca -0.01 -1.91 -0.33 0.00 -2.02 0.00 0.00 58.31 54.04 2fak n LYS 33 Cb 0.46 -1.30 -0.14 0.00 -0.02 0.00 0.00 35.03 34.03 2fak n LYS 33 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2fak s ILE 34 N -1.03 3.11 0.33 -0.18 1.01 -1.26 -0.48 121.20 122.69 2fak s ILE 34 Ca 0.24 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.29 2fak s ILE 34 Cb 0.14 -2.31 -0.06 0.00 0.01 0.00 0.00 42.46 40.23 2fak s ILE 34 CO 0.18 0.52 0.06 -0.36 0.00 0.00 0.00 174.94 175.34 2fak s PHE 35 N 0.40 1.99 -0.11 3.97 0.40 0.19 -4.97 117.98 119.86 2fak s PHE 35 Ca -0.10 -0.95 -0.17 0.00 -0.60 0.00 0.00 56.93 55.11 2fak s PHE 35 Cb -0.16 -1.30 0.04 0.00 0.51 0.00 0.00 43.02 42.11 2fak s PHE 35 CO 0.05 0.02 0.44 -3.38 0.70 0.00 0.00 175.22 173.05 2fak s HIS 36 N -3.27 -0.43 -0.22 0.36 -3.43 -1.26 0.12 115.29 107.16 2fak s HIS 36 Ca 0.36 0.94 0.01 0.00 -0.80 0.00 0.00 55.06 55.57 2fak s HIS 36 Cb 0.09 0.18 0.05 0.00 -1.43 0.00 0.00 32.58 31.47 2fak s HIS 36 CO 0.16 -0.32 -0.08 0.71 -2.00 0.00 0.00 174.74 173.20 2fak s TYR 38 N -0.36 2.53 0.00 0.38 2.02 0.70 -4.96 117.35 117.67 2fak s TYR 38 Ca -0.05 -1.77 0.00 0.00 -0.37 0.00 0.00 57.07 54.88 2fak s TYR 38 Cb -0.03 -1.65 0.00 0.00 -0.40 0.00 0.00 41.96 39.87 2fak s TYR 38 CO 0.03 -0.78 0.00 0.41 -1.57 0.00 0.00 175.55 173.64 2fak n GLY 39 N 4.64 2.42 1.39 0.71 0.00 -1.26 -1.27 105.19 111.83 2fak n GLY 39 Ca -0.13 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.59 2fak n GLY 39 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2fak n HIS 40 N 13.35 1.30 -4.04 1.61 1.44 -1.26 -4.89 115.22 122.73 2fak n HIS 40 Ca 0.00 -0.50 -0.34 0.00 -2.01 0.00 0.00 57.72 54.86 2fak n HIS 40 Cb 0.00 -0.25 -0.10 0.00 0.12 0.00 0.00 29.99 29.77 2fak n HIS 40 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2fak s VAL 41 N -1.89 4.73 -0.08 0.61 1.01 -0.39 -4.44 120.40 119.95 2fak s VAL 41 Ca 0.42 -0.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.34 2fak s VAL 41 Cb 0.28 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 2fak s VAL 41 CO 0.19 0.47 -0.04 -0.36 0.00 0.00 0.00 175.10 175.36 2fak s PHE 42 N 0.29 3.03 -0.08 5.22 0.40 0.25 -0.21 117.98 126.87 2fak s PHE 42 Ca 0.03 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.44 2fak s PHE 42 Cb -0.12 -1.75 0.02 0.00 0.51 0.00 0.00 43.02 41.67 2fak s PHE 42 CO 0.00 0.36 -0.08 -1.17 0.70 0.00 0.00 175.22 175.04 2fak s LEU 43 N -0.77 1.30 0.03 -0.37 2.96 0.12 -1.04 118.68 120.91 2fak s LEU 43 Ca 0.12 -0.24 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 2fak s LEU 43 Cb -0.11 -0.71 -0.04 0.00 0.50 0.00 0.00 46.19 45.83 2fak s LEU 43 CO 0.02 -0.06 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.15 2fak s GLY 44 N 1.23 1.87 -0.12 7.98 0.00 0.13 0.57 107.32 118.98 2fak s GLY 44 Ca -0.05 -1.01 -0.04 0.00 0.00 0.00 0.00 44.72 43.63 2fak s GLY 44 CO -0.02 -0.90 0.14 -0.42 0.00 0.00 0.00 173.10 171.89 2fak s ILE 45 N -1.14 -0.20 0.35 0.90 1.01 0.37 -1.19 121.20 121.29 2fak s ILE 45 Ca 0.21 0.13 0.07 0.00 0.00 0.00 0.00 60.65 61.06 2fak s ILE 45 Cb -0.12 -0.42 -0.01 0.00 0.01 0.00 0.00 42.46 41.92 2fak s ILE 45 CO 0.12 -0.03 0.43 0.42 0.00 0.00 0.00 174.94 175.88 2fak s THR 46 N 2.24 3.76 -0.74 2.92 -4.23 -1.24 -4.83 115.64 113.51 2fak s THR 46 Ca 0.04 -1.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.45 2fak s THR 46 Cb -0.14 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.41 2fak s THR 46 CO -0.07 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 2fak n GLY 47 N -1.60 0.49 3.66 3.99 0.00 -1.26 -0.43 105.19 110.04 2fak n GLY 47 Ca 0.01 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 2fak n GLY 47 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fak s LEU 48 N 0.00 4.31 0.28 0.99 2.96 -0.12 -4.60 118.68 122.50 2fak s LEU 48 Ca 0.00 2.25 0.02 0.00 -0.22 0.00 0.00 54.13 56.18 2fak s LEU 48 Cb 0.00 -3.53 0.66 0.00 0.50 0.00 0.00 46.19 43.82 2fak s LEU 48 CO 0.00 -0.95 1.72 0.00 -1.32 0.00 0.00 176.35 175.80 2fak h ALA 49 N 9.67 1.38 -0.49 5.97 0.00 -1.90 0.17 119.26 134.07 2fak h ALA 49 Ca -0.40 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2fak h ALA 49 Cb 1.18 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2fak h ALA 49 CO 0.95 -0.26 0.24 0.00 0.00 0.00 0.00 179.25 180.19 2fak h THR 50 N 0.47 1.16 0.07 0.00 1.03 -1.99 -0.10 112.91 113.56 2fak h THR 50 Ca 0.52 -0.45 -0.26 0.00 -0.01 0.00 0.00 66.41 66.22 2fak h THR 50 Cb 0.92 0.53 0.01 0.00 -1.07 0.00 0.00 68.15 68.54 2fak h THR 50 CO -0.47 0.19 -1.11 0.44 -0.01 0.00 0.00 175.52 174.55 2fak h ASP 51 N 0.68 0.54 -0.61 0.00 3.45 -1.41 0.02 116.42 119.09 2fak h ASP 51 Ca 0.17 -0.49 0.04 0.00 0.43 0.00 0.00 57.03 57.17 2fak h ASP 51 Cb 0.06 -0.17 -0.04 0.00 -0.56 0.00 0.00 39.33 38.62 2fak h ASP 51 CO -0.02 1.33 0.36 0.58 -1.57 0.00 0.00 179.24 179.91 2fak h VAL 52 N 0.17 1.03 -0.16 -1.35 2.07 -0.48 0.35 116.25 117.89 2fak h VAL 52 Ca -0.12 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.12 2fak h VAL 52 Cb 1.79 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2fak h VAL 52 CO 0.19 0.13 -0.06 0.74 0.02 0.00 0.00 177.57 178.58 2fak h THR 53 N 0.69 1.30 -0.34 2.57 2.02 -0.98 -2.42 112.91 115.76 2fak h THR 53 Ca 0.25 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 2fak h THR 53 Cb 0.07 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 2fak h THR 53 CO -0.13 0.32 0.19 0.74 0.37 0.00 0.00 175.52 177.02 2fak h THR 54 N 0.01 1.13 -0.85 3.16 2.02 -0.64 -2.36 112.91 115.38 2fak h THR 54 Ca 0.04 -0.33 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 2fak h THR 54 Cb 0.52 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.63 2fak h THR 54 CO 0.02 0.13 0.41 -0.07 0.37 0.00 0.00 175.52 176.38 2fak h LEU 55 N 0.43 1.12 -0.80 2.58 3.38 -0.31 -0.86 115.31 120.85 2fak h LEU 55 Ca 0.12 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2fak h LEU 55 Cb 0.04 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 2fak h LEU 55 CO -0.02 0.94 0.42 -1.13 0.09 0.00 0.00 178.44 178.74 2fak h ASN 56 N 1.22 1.01 -0.20 -0.43 -1.24 -1.27 0.05 115.58 114.72 2fak h ASN 56 Ca 0.29 -0.11 -0.07 0.00 0.71 0.00 0.00 56.30 57.12 2fak h ASN 56 Cb 0.12 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 38.89 2fak h ASN 56 CO -0.04 0.83 -0.11 -0.33 -1.29 0.00 0.00 177.43 176.49 2fak h GLU 57 N 1.11 0.57 -0.18 6.67 5.08 -0.94 -1.63 114.58 125.26 2fak h GLU 57 Ca 0.28 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2fak h GLU 57 Cb 0.06 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2fak h GLU 57 CO -0.04 0.68 -0.06 1.98 -1.00 0.00 0.00 179.01 180.56 2fak h MET 58 N 0.53 0.35 0.00 2.33 4.05 -0.29 -2.46 114.93 119.44 2fak h MET 58 Ca 0.10 -0.14 -0.07 0.00 -0.28 0.00 0.00 59.70 59.30 2fak h MET 58 Cb 0.50 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 2fak h MET 58 CO 0.03 0.64 -0.34 0.74 0.23 0.00 0.00 176.91 178.21 2fak h PHE 59 N 0.05 0.00 0.35 1.39 0.05 -0.91 -0.21 116.94 117.66 2fak h PHE 59 Ca 0.04 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.82 2fak h PHE 59 Cb 0.52 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.47 2fak h PHE 59 CO 0.06 0.34 -0.17 -0.09 -0.18 0.00 0.00 178.31 178.27 2fak h ARG 60 N 0.00 -0.45 -0.50 1.51 2.43 -1.26 -0.19 114.38 115.92 2fak h ARG 60 Ca -0.00 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.30 2fak h ARG 60 Cb 0.80 0.10 -0.10 0.00 -0.42 0.00 0.00 29.97 30.36 2fak h ARG 60 CO 0.04 -0.16 -0.16 -0.92 -1.51 0.00 0.00 179.97 177.26 2fak h TYR 61 N -0.72 -0.36 -0.31 2.20 5.03 -1.21 -0.43 116.97 121.18 2fak h TYR 61 Ca -0.05 0.05 -0.08 0.00 2.58 0.00 0.00 58.73 61.23 2fak h TYR 61 Cb 0.49 0.23 -0.01 0.00 1.55 0.00 0.00 36.73 39.00 2fak h TYR 61 CO 0.01 -0.25 -0.12 0.87 -1.32 0.00 0.00 178.16 177.35 2fak h LYS 62 N -0.04 0.62 0.00 1.82 1.57 -0.96 -2.91 116.57 116.67 2fak h LYS 62 Ca 0.24 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2fak h LYS 62 Cb 0.40 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2fak h LYS 62 CO -0.53 0.83 -0.15 1.79 -0.57 0.00 0.00 179.45 180.81 2fak h THR 63 N 0.38 0.45 -0.04 -0.16 1.35 -0.75 -1.43 112.91 112.71 2fak h THR 63 Ca 0.07 -0.82 -0.01 0.00 -0.55 0.00 0.00 66.41 65.10 2fak h THR 63 Cb 0.63 1.58 -0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2fak h THR 63 CO 0.04 0.15 -0.02 0.78 -0.25 0.00 0.00 175.52 176.22 2fak h ASN 64 N 0.00 0.10 0.48 5.36 2.35 -0.96 -1.59 115.58 121.31 2fak h ASN 64 Ca -0.00 -0.41 -0.08 0.00 -0.55 0.00 0.00 56.30 55.25 2fak h ASN 64 Cb 0.57 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 2fak h ASN 64 CO 0.02 0.49 -0.39 -0.07 -1.65 0.00 0.00 177.43 175.83 2fak h LEU 65 N -0.30 0.00 -0.58 1.61 3.38 -1.36 -1.97 115.31 116.09 2fak h LEU 65 Ca 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2fak h LEU 65 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2fak h LEU 65 CO 0.01 0.39 0.10 0.22 0.09 0.00 0.00 178.44 179.24 2fak h TYR 66 N 0.00 1.03 -0.38 1.13 5.03 -1.08 -2.01 116.97 120.68 2fak h TYR 66 Ca -0.00 -0.14 -0.09 0.00 2.58 0.00 0.00 58.73 61.08 2fak h TYR 66 Cb 0.73 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 38.72 2fak h TYR 66 CO 0.00 0.89 -0.10 -0.22 -1.32 0.00 0.00 178.16 177.41 2fak h LYS 67 N 0.87 0.75 -0.08 1.82 3.64 -0.94 0.86 116.57 123.48 2fak h LYS 67 Ca 0.18 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2fak h LYS 67 Cb 0.42 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2fak h LYS 67 CO 0.01 0.89 0.05 -0.07 -2.27 0.00 0.00 179.45 178.07 2fak h LEU 68 N 0.55 0.10 0.00 5.20 3.38 -1.12 0.38 115.31 123.80 2fak h LEU 68 Ca 0.10 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.83 2fak h LEU 68 Cb 0.62 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 2fak h LEU 68 CO 0.04 0.07 -1.52 0.29 0.09 0.00 0.00 178.44 177.41 2fak n LYS 69 N -4.53 0.55 0.18 1.13 5.02 -0.78 -4.43 118.16 115.30 2fak n LYS 69 Ca -0.02 0.39 0.02 0.00 -2.02 0.00 0.00 58.31 56.69 2fak n LYS 69 Cb 0.08 -1.59 0.36 0.00 -0.02 0.00 0.00 35.03 33.86 2fak n LYS 69 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2fak h GLU 70 N -1.00 0.02 -3.89 1.97 4.39 -0.89 -3.47 114.58 111.71 2fak h GLU 70 Ca -0.35 -0.01 -0.26 0.00 0.34 0.00 0.00 59.36 59.08 2fak h GLU 70 Cb 1.22 -0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.94 2fak h GLU 70 CO -0.21 0.37 -0.43 0.39 -1.16 0.00 0.00 179.01 177.97 2fak n GLU 71 N -4.11 -4.72 -3.50 2.33 1.02 0.13 -5.00 120.64 106.79 2fak n GLU 71 Ca -0.02 0.56 -0.11 0.00 -0.02 0.00 0.00 57.16 57.57 2fak n GLU 71 Cb 0.39 -4.74 -0.03 0.00 -0.02 0.00 0.00 31.44 27.05 2fak n GLU 71 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2fak s ARG 72 N -5.72 0.90 0.33 3.49 1.70 -1.23 -5.06 118.95 113.36 2fak s ARG 72 Ca 0.34 -0.19 -0.26 0.00 -0.47 0.00 0.00 55.73 55.15 2fak s ARG 72 Cb -0.15 0.42 -0.10 0.00 -0.57 0.00 0.00 34.95 34.55 2fak s ARG 72 CO 0.42 -0.36 0.96 0.00 -1.08 0.00 0.00 175.30 175.23 2fak s ALA 73 N -2.67 3.20 0.55 7.88 0.00 -1.26 -4.19 121.76 125.28 2fak s ALA 73 Ca 0.01 0.55 -0.21 0.00 0.00 0.00 0.00 51.96 52.32 2fak s ALA 73 Cb -0.01 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 2fak s ALA 73 CO -0.06 0.12 1.27 -1.50 0.00 0.00 0.00 175.76 175.60 2fak s ILE 74 N -1.62 2.42 0.30 0.00 2.07 -1.26 -5.02 121.20 118.08 2fak s ILE 74 Ca 0.51 0.29 0.03 0.00 -1.41 0.00 0.00 60.65 60.07 2fak s ILE 74 Cb -0.19 -3.14 -0.03 0.00 0.13 0.00 0.00 42.46 39.23 2fak s ILE 74 CO 0.24 -0.02 0.46 -1.61 -1.91 0.00 0.00 174.94 172.10 2fak s GLU 75 N -3.03 3.44 0.15 3.50 0.41 -1.26 -4.73 118.70 117.18 2fak s GLU 75 Ca 0.73 -0.57 -0.24 0.00 -0.41 0.00 0.00 54.97 54.48 2fak s GLU 75 Cb -0.35 -2.77 0.02 0.00 -1.78 0.00 0.00 34.13 29.24 2fak s GLU 75 CO 0.40 0.27 1.61 -1.35 -0.49 0.00 0.00 175.26 175.70 2fak h PRO 76 N 0.95 -0.30 -0.51 0.39 0.11 -1.93 0.35 132.00 131.05 2fak h PRO 76 Ca -0.51 0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.70 2fak h PRO 76 Cb 1.23 0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.34 2fak h PRO 76 CO 0.61 -0.20 0.16 0.93 -0.21 0.00 0.00 178.00 179.29 2fak h GLU 77 N -0.31 0.32 -0.40 1.05 3.07 -1.97 -0.23 114.58 116.11 2fak h GLU 77 Ca 0.13 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 58.91 2fak h GLU 77 Cb 0.52 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 2fak h GLU 77 CO -0.42 0.21 0.02 1.15 -1.40 0.00 0.00 179.01 178.57 2fak h THR 78 N 0.33 1.26 -0.53 1.13 2.02 -1.86 -2.91 112.91 112.35 2fak h THR 78 Ca 0.25 -0.97 0.01 0.00 0.77 0.00 0.00 66.41 66.46 2fak h THR 78 Cb 0.29 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 2fak h THR 78 CO -0.27 0.33 0.35 0.15 0.37 0.00 0.00 175.52 176.45 2fak h PHE 79 N 0.52 0.66 -0.79 3.16 3.57 -0.51 -1.28 116.94 122.27 2fak h PHE 79 Ca 0.11 0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.77 2fak h PHE 79 Cb 0.45 -0.22 -0.09 0.00 2.79 0.00 0.00 35.95 38.87 2fak h PHE 79 CO 0.03 0.42 0.37 1.15 -2.23 0.00 0.00 178.31 178.05 2fak h THR 80 N 0.71 0.71 -0.33 4.41 2.02 -0.92 0.39 112.91 119.91 2fak h THR 80 Ca 0.19 -0.19 -0.10 0.00 0.77 0.00 0.00 66.41 67.09 2fak h THR 80 Cb -0.08 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.43 2fak h THR 80 CO -0.04 0.10 -0.20 1.56 0.37 0.00 0.00 175.52 177.30 2fak h GLN 81 N 0.55 0.62 -0.51 6.66 1.08 -1.17 -1.31 115.11 121.03 2fak h GLN 81 Ca 0.43 -0.23 -0.12 0.00 -1.45 0.00 0.00 58.65 57.29 2fak h GLN 81 Cb 0.61 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 2fak h GLN 81 CO -0.37 0.78 -0.15 1.25 -0.95 0.00 0.00 178.83 179.39 2fak h LEU 82 N 0.55 1.01 -0.28 1.46 5.85 0.53 -1.71 115.31 122.72 2fak h LEU 82 Ca 0.08 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 2fak h LEU 82 Cb 0.65 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2fak h LEU 82 CO 0.05 1.15 0.11 0.58 -0.34 0.00 0.00 178.44 179.99 2fak h VAL 83 N 0.86 1.17 0.31 1.05 2.07 -0.14 -1.72 116.25 119.86 2fak h VAL 83 Ca 0.12 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 2fak h VAL 83 Cb 0.73 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 2fak h VAL 83 CO 0.06 0.18 -0.27 -1.28 0.02 0.00 0.00 177.57 176.27 2fak h SER 84 N 0.30 -0.73 0.06 0.57 0.87 -1.10 -0.77 113.55 112.75 2fak h SER 84 Ca 0.09 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.67 2fak h SER 84 Cb 0.17 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 2fak h SER 84 CO -0.01 -0.40 -0.14 0.77 -0.53 0.00 0.00 176.83 176.51 2fak h SER 85 N -0.60 0.18 -0.43 6.23 4.64 -1.31 -1.24 113.55 121.01 2fak h SER 85 Ca -0.02 -0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.12 2fak h SER 85 Cb 0.54 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2fak h SER 85 CO -0.04 0.34 -0.29 0.28 -0.87 0.00 0.00 176.83 176.25 2fak h SER 86 N 0.18 1.01 -0.16 4.97 0.02 -0.97 -2.36 113.55 116.25 2fak h SER 86 Ca 0.04 -0.42 -0.04 0.00 -0.84 0.00 0.00 61.79 60.53 2fak h SER 86 Cb 0.37 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 2fak h SER 86 CO 0.02 1.22 -0.05 -0.07 -1.14 0.00 0.00 176.83 176.81 2fak h LEU 87 N 0.81 0.32 -2.36 5.07 3.38 -0.66 -3.11 115.31 118.76 2fak h LEU 87 Ca 0.09 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 2fak h LEU 87 Cb 0.88 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 2fak h LEU 87 CO 0.08 0.63 -0.03 0.22 0.09 0.00 0.00 178.44 179.42 2fak h TYR 88 N -0.00 0.00 0.00 1.13 3.20 -1.12 -1.11 116.97 119.07 2fak h TYR 88 Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2fak h TYR 88 Cb 0.50 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.77 2fak h TYR 88 CO 0.06 0.03 0.00 1.49 -1.64 0.00 0.00 178.16 178.10 2fak h GLU 89 N 0.00 0.00 -0.44 1.82 4.81 -1.34 0.86 114.58 120.29 2fak h GLU 89 Ca -0.00 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 2fak h GLU 89 Cb 0.10 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.39 2fak h GLU 89 CO 0.00 0.00 0.07 0.54 -0.73 0.00 0.00 179.01 178.90 2fak n ARG 90 N -3.07 2.57 -0.27 1.92 5.12 -0.42 -4.82 116.66 117.69 2fak n ARG 90 Ca -0.02 -3.04 0.09 0.00 -1.93 0.00 0.00 57.85 52.96 2fak n ARG 90 Cb 0.16 -1.93 0.19 0.00 -1.16 0.00 0.00 32.46 29.72 2fak n ARG 90 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2fak n ARG 91 N -0.75 -0.06 -1.47 5.56 3.00 0.30 -0.67 116.66 122.56 2fak n ARG 91 Ca 0.33 1.18 -0.33 0.00 -0.00 0.00 0.00 57.85 59.03 2fak n ARG 91 Cb 1.10 -1.83 0.07 0.00 0.00 0.00 0.00 32.46 31.80 2fak n ARG 91 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2fak n PHE 92 N -5.14 3.13 0.00 -0.14 3.01 -1.26 -4.29 117.46 112.76 2fak n PHE 92 Ca 0.16 -2.86 0.00 0.00 1.01 0.00 0.00 57.45 55.76 2fak n PHE 92 Cb 0.53 -1.23 0.00 0.00 -0.01 0.00 0.00 39.48 38.78 2fak n PHE 92 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2fak n GLY 93 N -0.88 -0.94 3.71 1.37 0.00 0.15 -5.18 105.19 103.42 2fak n GLY 93 Ca 0.59 0.39 -0.30 0.00 0.00 0.00 0.00 46.02 46.69 2fak n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fak s PRO 94 N 0.00 1.35 0.05 1.61 0.04 0.04 -4.84 135.00 133.25 2fak s PRO 94 Ca 0.00 1.08 -0.26 0.00 0.04 0.00 0.00 61.00 61.86 2fak s PRO 94 Cb 0.00 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.69 2fak s PRO 94 CO 0.00 -2.25 0.81 0.71 0.04 0.00 0.00 177.00 176.31 2fak s TYR 95 N -2.83 3.74 -1.27 0.56 1.51 -1.26 -4.96 117.35 112.84 2fak s TYR 95 Ca 0.64 1.54 -0.14 0.00 -1.01 0.00 0.00 57.07 58.10 2fak s TYR 95 Cb -0.19 -2.88 0.13 0.00 -0.11 0.00 0.00 41.96 38.91 2fak s TYR 95 CO 0.57 0.24 1.68 1.19 -1.11 0.00 0.00 175.55 178.12 2fak n PHE 96 N 2.91 4.35 -4.24 2.71 3.72 -1.26 -4.72 117.46 120.92 2fak n PHE 96 Ca -0.01 -3.08 -0.13 0.00 -0.05 0.00 0.00 57.45 54.17 2fak n PHE 96 Cb 0.50 -2.28 -0.10 0.00 -0.94 0.00 0.00 39.48 36.66 2fak n PHE 96 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2fak s VAL 97 N 2.11 0.33 -0.50 -4.37 -7.23 -1.26 -0.95 120.40 108.53 2fak s VAL 97 Ca 0.45 -1.98 0.06 0.00 -1.81 0.00 0.00 61.98 58.70 2fak s VAL 97 Cb 0.03 -2.40 0.21 0.00 0.56 0.00 0.00 36.38 34.78 2fak s VAL 97 CO 0.01 -0.16 0.51 0.61 -0.31 0.00 0.00 175.10 175.76 2fak n GLY 98 N -0.30 3.23 3.62 2.32 0.00 0.43 -3.67 105.19 110.81 2fak n GLY 98 Ca -0.01 -1.90 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 2fak n GLY 98 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2fak n PRO 99 N 1.82 0.48 -3.73 1.61 -0.02 -1.26 -3.62 135.00 130.29 2fak n PRO 99 Ca 0.25 0.22 -0.12 0.00 -2.02 0.00 0.00 63.50 61.83 2fak n PRO 99 Cb 0.46 -2.25 -0.13 0.00 -0.02 0.00 0.00 33.50 31.56 2fak n PRO 99 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2fak s VAL 100 N -1.84 -0.05 -0.08 -1.45 1.01 -0.34 -2.19 120.40 115.45 2fak s VAL 100 Ca 0.73 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.89 2fak s VAL 100 Cb -0.34 -0.38 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 2fak s VAL 100 CO 0.50 0.06 -0.16 -0.69 0.00 0.00 0.00 175.10 174.82 2fak s VAL 101 N 1.30 2.87 0.00 2.92 1.01 0.23 -0.70 120.40 128.03 2fak s VAL 101 Ca -0.09 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.13 2fak s VAL 101 Cb -0.10 -2.14 -0.00 0.00 0.00 0.00 0.00 36.38 34.13 2fak s VAL 101 CO -0.08 0.56 -0.01 0.00 0.00 0.00 0.00 175.10 175.57 2fak s ALA 102 N -0.20 0.03 0.00 5.51 0.00 -0.20 -0.42 121.76 126.47 2fak s ALA 102 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2fak s ALA 102 Cb -0.13 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.00 2fak s ALA 102 CO 0.03 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.19 2fak n GLY 103 N 2.91 0.84 3.37 0.00 0.00 0.00 -0.58 105.19 111.73 2fak n GLY 103 Ca -0.13 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 2fak n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fak s ILE 104 N -2.00 3.01 -0.17 -0.61 -1.09 -1.26 -0.10 121.20 118.98 2fak s ILE 104 Ca 0.00 -0.68 -0.29 0.00 -2.23 0.00 0.00 60.65 57.45 2fak s ILE 104 Cb 0.00 -2.25 -0.04 0.00 -1.58 0.00 0.00 42.46 38.59 2fak s ILE 104 CO 0.00 0.53 1.70 0.21 -1.23 0.00 0.00 174.94 176.15 2fak s ASN 105 N 0.26 6.37 0.56 3.58 3.84 -0.71 -4.82 114.94 124.02 2fak s ASN 105 Ca -0.10 1.85 0.35 0.00 0.21 0.00 0.00 52.86 55.17 2fak s ASN 105 Cb -0.16 -2.53 1.89 0.00 -0.55 0.00 0.00 41.25 39.90 2fak s ASN 105 CO 0.05 -1.23 2.06 0.77 -2.79 0.00 0.00 177.10 175.96 2fak h SER 10 N 10.83 0.00 0.00 -4.21 4.64 -1.94 1.03 113.55 123.90 2fak h SER 10 Ca -0.37 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.65 2fak h SER 10 Cb 1.17 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.20 2fak h SER 10 CO 0.98 0.00 -2.14 1.17 -0.87 0.00 0.00 176.83 175.97 2fak n LYS 10 N -2.77 1.17 0.00 4.77 4.81 -1.26 -4.54 118.16 120.34 2fak n LYS 10 Ca -0.02 0.01 0.08 0.00 -0.87 0.00 0.00 58.31 57.51 2fak n LYS 10 Cb 0.12 -1.42 -0.07 0.00 0.02 0.00 0.00 35.03 33.68 2fak n LYS 10 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2fak n SER 10 N -2.70 0.92 0.00 3.14 3.41 -1.10 -4.97 113.62 112.33 2fak n SER 10 Ca -0.29 -0.96 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 2fak n SER 10 Cb 1.01 0.90 0.00 0.00 -0.26 0.00 0.00 64.21 65.86 2fak n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fak n GLY 106 N 1.34 0.23 3.70 5.00 0.00 0.35 -4.94 105.19 110.87 2fak n GLY 106 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2fak n GLY 106 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fak s LYS 107 N -0.78 4.30 0.38 1.61 2.20 -1.25 -4.60 119.74 121.60 2fak s LYS 107 Ca 0.00 2.01 -0.27 0.00 -0.36 0.00 0.00 55.97 57.35 2fak s LYS 107 Cb 0.00 -3.45 -0.09 0.00 -1.51 0.00 0.00 37.83 32.77 2fak s LYS 107 CO 0.00 -0.52 1.31 -2.14 -0.36 0.00 0.00 175.35 173.64 2fak s PRO 108 N 1.91 4.10 -0.02 4.03 0.02 -1.26 -1.73 135.00 142.05 2fak s PRO 108 Ca 0.64 2.20 -0.02 0.00 0.02 0.00 0.00 61.00 63.85 2fak s PRO 108 Cb -0.34 -2.87 0.01 0.00 0.02 0.00 0.00 34.50 31.33 2fak s PRO 108 CO 0.28 -0.39 0.06 0.12 -0.33 0.00 0.00 177.00 176.74 2fak s PHE 109 N -1.22 -0.05 0.02 6.54 5.36 0.85 -4.93 117.98 124.55 2fak s PHE 109 Ca 0.54 0.17 -0.07 0.00 -0.96 0.00 0.00 56.93 56.61 2fak s PHE 109 Cb -0.39 -0.03 -0.00 0.00 -0.34 0.00 0.00 43.02 42.25 2fak s PHE 109 CO 0.51 -0.05 0.14 0.96 -1.46 0.00 0.00 175.22 175.31 2fak s ILE 110 N 0.32 0.10 -0.07 3.12 -4.36 -1.26 -0.82 121.20 118.24 2fak s ILE 110 Ca -0.02 -0.84 -0.30 0.00 -0.26 0.00 0.00 60.65 59.23 2fak s ILE 110 Cb -0.04 -0.64 0.09 0.00 1.25 0.00 0.00 42.46 43.12 2fak s ILE 110 CO -0.01 -0.46 0.78 0.00 0.24 0.00 0.00 174.94 175.49 2fak s ALA 111 N -1.93 -1.81 0.28 2.27 0.00 0.44 -4.41 121.76 116.59 2fak s ALA 111 Ca -0.10 1.32 0.06 0.00 0.00 0.00 0.00 51.96 53.24 2fak s ALA 111 Cb -0.05 -0.13 -0.06 0.00 0.00 0.00 0.00 23.12 22.89 2fak s ALA 111 CO -0.01 -0.40 -0.04 0.20 0.00 0.00 0.00 175.76 175.51 2fak s GLY 112 N -1.35 1.81 0.09 0.00 0.00 -0.28 0.77 107.32 108.37 2fak s GLY 112 Ca -0.06 -1.90 -0.03 0.00 0.00 0.00 0.00 44.72 42.72 2fak s GLY 112 CO 0.05 -1.82 0.07 -1.36 0.00 0.00 0.00 173.10 170.04 2fak s PHE 113 N -3.09 0.50 0.66 1.90 0.08 -0.93 0.27 117.98 117.37 2fak s PHE 113 Ca 0.30 -0.97 0.04 0.00 0.12 0.00 0.00 56.93 56.42 2fak s PHE 113 Cb 0.05 -0.31 0.11 0.00 -0.57 0.00 0.00 43.02 42.30 2fak s PHE 113 CO 0.12 -0.48 0.91 0.16 -0.10 0.00 0.00 175.22 175.83 2fak s ASP 114 N -2.94 4.66 0.25 1.36 3.84 -1.00 -4.11 116.67 118.72 2fak s ASP 114 Ca 0.11 -0.60 0.21 0.00 -0.00 0.00 0.00 52.55 52.27 2fak s ASP 114 Cb 0.07 0.16 0.96 0.00 -1.38 0.00 0.00 42.92 42.73 2fak s ASP 114 CO -0.07 -1.65 1.63 0.00 -0.00 0.00 0.00 175.17 175.08 2fak n LEU 115 N -2.58 0.54 -0.95 2.11 -0.00 -1.24 -1.98 117.00 112.90 2fak n LEU 115 Ca 0.16 0.68 0.08 0.00 -0.00 0.00 0.00 56.01 56.92 2fak n LEU 115 Cb 0.61 -0.66 0.24 0.00 -0.00 0.00 0.00 43.42 43.60 2fak n LEU 115 CO 0.41 -0.68 0.70 2.30 -0.00 0.00 0.00 177.39 180.12 2fak n ILE 116 N -2.15 1.55 0.00 1.47 -5.35 -1.26 -4.27 119.36 109.35 2fak n ILE 116 Ca 0.01 -1.29 0.00 0.00 -0.27 0.00 0.00 62.75 61.20 2fak n ILE 116 Cb 0.14 0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.24 2fak n ILE 116 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2fak n GLY 117 N 0.41 1.22 3.69 3.28 0.00 -0.84 -2.92 105.19 110.03 2fak n GLY 117 Ca 0.18 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.70 2fak n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fak s ILE 119 N 3.85 4.90 -0.36 0.00 1.01 -1.26 -2.39 121.20 126.95 2fak s ILE 119 Ca 0.93 1.62 -0.10 0.00 0.00 0.00 0.00 60.65 63.11 2fak s ILE 119 Cb -0.76 -4.13 0.03 0.00 0.01 0.00 0.00 42.46 37.61 2fak s ILE 119 CO 0.53 0.06 0.18 -0.62 0.00 0.00 0.00 174.94 175.09 2fak s ASP 120 N 1.12 5.61 -0.86 3.58 3.68 0.14 -4.98 116.67 124.95 2fak s ASP 120 Ca 0.39 -1.01 -0.00 0.00 2.13 0.00 0.00 52.55 54.06 2fak s ASP 120 Cb -0.17 -1.98 0.22 0.00 -1.45 0.00 0.00 42.92 39.54 2fak s ASP 120 CO 0.14 -0.36 0.77 1.21 0.13 0.00 0.00 175.17 177.05 2fak n GLU 121 N 4.95 2.58 -2.86 4.34 2.13 -1.26 -1.12 120.64 129.40 2fak n GLU 121 Ca -0.12 -4.50 -0.29 0.00 0.66 0.00 0.00 57.16 52.91 2fak n GLU 121 Cb 0.46 -2.38 -0.02 0.00 0.27 0.00 0.00 31.44 29.76 2fak n GLU 121 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2fak s ALA 122 N -1.55 3.40 -0.06 4.31 0.00 -1.26 -5.02 121.76 121.58 2fak s ALA 122 Ca 0.28 -0.34 -0.02 0.00 0.00 0.00 0.00 51.96 51.89 2fak s ALA 122 Cb -0.04 -2.62 -0.26 0.00 0.00 0.00 0.00 23.12 20.20 2fak s ALA 122 CO -0.12 -0.08 0.60 1.57 0.00 0.00 0.00 175.76 177.74 2fak h LYS 12 N 1.01 0.21 0.00 0.00 2.10 -1.97 -3.43 116.57 114.50 2fak h LYS 12 Ca -0.47 -0.37 0.00 0.00 -2.00 0.00 0.00 60.65 57.81 2fak h LYS 12 Cb 1.19 0.14 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 2fak h LYS 12 CO 0.63 1.03 0.00 -0.40 -2.00 0.00 0.00 179.45 178.72 2fak n ASP 123 N -3.39 0.00 -3.87 7.07 5.68 -1.26 -4.37 116.55 116.41 2fak n ASP 123 Ca -0.23 0.40 -0.09 0.00 -0.50 0.00 0.00 54.79 54.37 2fak n ASP 123 Cb 1.05 -0.33 -0.07 0.00 -1.14 0.00 0.00 41.12 40.63 2fak n ASP 123 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 2fak s PHE 124 N -0.90 0.19 -0.02 2.11 -0.12 -1.26 -1.70 117.98 116.29 2fak s PHE 124 Ca 0.00 -0.58 0.02 0.00 -0.05 0.00 0.00 56.93 56.32 2fak s PHE 124 Cb 0.00 0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.41 2fak s PHE 124 CO 0.00 -0.67 -0.06 0.42 -0.05 0.00 0.00 175.22 174.86 2fak s ILE 125 N -3.90 0.54 0.15 -4.49 1.09 -0.37 -4.80 121.20 109.42 2fak s ILE 125 Ca 0.10 -0.24 0.07 0.00 -1.10 0.00 0.00 60.65 59.49 2fak s ILE 125 Cb 0.03 -0.49 -0.04 0.00 -1.06 0.00 0.00 42.46 40.91 2fak s ILE 125 CO -0.06 0.18 -0.16 0.68 -0.10 0.00 0.00 174.94 175.48 2fak s VAL 126 N 0.18 1.59 -0.06 2.92 -7.23 -1.26 -1.27 120.40 115.27 2fak s VAL 126 Ca -0.02 -1.86 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 2fak s VAL 126 Cb -0.07 -1.73 0.07 0.00 0.56 0.00 0.00 36.38 35.21 2fak s VAL 126 CO -0.00 -0.39 0.66 -0.55 -0.31 0.00 0.00 175.10 174.51 2fak s SER 127 N -2.63 -0.64 0.00 4.85 0.15 -0.54 -5.00 113.70 109.89 2fak s SER 127 Ca 0.13 0.73 0.00 0.00 0.70 0.00 0.00 55.95 57.51 2fak s SER 127 Cb -0.05 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 2fak s SER 127 CO 0.05 -0.58 0.00 0.61 1.20 0.00 0.00 173.24 174.52 2fak n GLY 128 N 1.05 0.84 0.04 9.45 0.00 -1.26 -1.29 105.19 114.02 2fak n GLY 128 Ca -0.19 -2.32 0.08 0.00 0.00 0.00 0.00 46.02 43.59 2fak n GLY 128 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fak n THR 129 N -0.95 1.08 -1.90 2.61 -2.24 -0.69 -2.20 114.28 110.00 2fak n THR 129 Ca 0.00 0.30 -0.03 0.00 -2.27 0.00 0.00 64.05 62.05 2fak n THR 129 Cb 0.00 -1.15 0.12 0.00 -2.10 0.00 0.00 70.33 67.21 2fak n THR 129 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fak n ALA 130 N -1.59 3.84 0.17 6.98 0.00 -1.26 -4.82 120.51 123.82 2fak n ALA 130 Ca 0.02 -3.30 0.04 0.00 0.00 0.00 0.00 53.44 50.21 2fak n ALA 130 Cb 0.16 -0.42 0.47 0.00 0.00 0.00 0.00 19.45 19.66 2fak n ALA 130 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2fak h SER 131 N 1.44 0.13 -0.17 0.00 4.64 -1.70 -0.66 113.55 117.22 2fak h SER 131 Ca 0.07 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 2fak h SER 131 Cb 1.28 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2fak h SER 131 CO 0.24 0.25 -0.07 0.44 -0.87 0.00 0.00 176.83 176.82 2fak h ASP 132 N 0.14 0.35 -0.73 4.97 3.45 -1.87 -0.98 116.42 121.76 2fak h ASP 132 Ca 0.03 -0.40 -0.00 0.00 0.43 0.00 0.00 57.03 57.09 2fak h ASP 132 Cb 0.26 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 38.90 2fak h ASP 132 CO 0.01 0.67 0.44 1.56 -1.57 0.00 0.00 179.24 180.35 2fak h GLN 133 N 0.03 0.98 -0.88 3.56 7.50 -1.83 -1.77 115.11 122.69 2fak h GLN 133 Ca 0.04 -0.09 0.01 0.00 0.50 0.00 0.00 58.65 59.12 2fak h GLN 133 Cb 0.53 -0.21 -0.05 0.00 0.05 0.00 0.00 27.48 27.81 2fak h GLN 133 CO 0.02 0.70 0.58 -0.07 -1.50 0.00 0.00 178.83 178.56 2fak h LEU 134 N 0.99 1.00 -0.86 1.46 3.38 -0.98 -0.51 115.31 119.79 2fak h LEU 134 Ca 0.26 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 2fak h LEU 134 Cb -0.04 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 2fak h LEU 134 CO -0.05 0.72 0.40 -0.26 0.09 0.00 0.00 178.44 179.33 2fak h PHE 135 N 1.18 1.23 -0.32 1.13 0.04 -0.61 0.44 116.94 120.02 2fak h PHE 135 Ca 0.33 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.98 2fak h PHE 135 Cb -0.11 -0.38 -0.01 0.00 2.20 0.00 0.00 35.95 37.65 2fak h PHE 135 CO -0.01 0.89 0.00 0.78 -0.60 0.00 0.00 178.31 179.37 2fak h GLY 136 N 1.21 0.61 0.83 -1.45 0.00 -0.69 -0.83 103.07 102.75 2fak h GLY 136 Ca 0.29 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 2fak h GLY 136 CO -0.03 0.41 -0.40 -0.33 0.00 0.00 0.00 176.54 176.19 2fak h MET 137 N 0.37 -1.07 -0.65 4.80 2.86 -0.79 -2.80 114.93 117.66 2fak h MET 137 Ca 0.09 0.07 0.13 0.00 -2.06 0.00 0.00 59.70 57.93 2fak h MET 137 Cb 0.44 0.24 -0.10 0.00 0.06 0.00 0.00 31.60 32.25 2fak h MET 137 CO 0.02 -0.71 0.13 0.00 1.06 0.00 0.00 176.91 177.41 2fak h GLU 139 N 0.25 0.45 0.03 0.00 4.57 -1.14 -0.66 114.58 118.09 2fak h GLU 139 Ca 0.35 -0.03 -0.20 0.00 -1.18 0.00 0.00 59.36 58.30 2fak h GLU 139 Cb 0.55 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 2fak h GLU 139 CO -0.45 0.30 -1.07 0.77 -1.18 0.00 0.00 179.01 177.38 2fak h SER 140 N 0.47 0.09 1.23 1.04 0.02 -0.92 -3.40 113.55 112.09 2fak h SER 140 Ca 0.13 -0.70 -0.07 0.00 -0.84 0.00 0.00 61.79 60.31 2fak h SER 140 Cb -0.04 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 2fak h SER 140 CO -0.03 1.43 -0.36 -0.07 -1.14 0.00 0.00 176.83 176.67 2fak h LEU 141 N -0.82 0.00 -9.67 5.07 3.38 -0.60 -3.46 115.31 109.21 2fak h LEU 141 Ca -0.27 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.19 2fak h LEU 141 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2fak h LEU 141 CO -0.10 0.36 0.39 -0.47 0.09 0.00 0.00 178.44 178.70 2fak s TYR 142 N -3.31 3.81 0.01 1.13 5.04 -0.26 -5.02 117.35 118.76 2fak s TYR 142 Ca 0.02 1.79 -0.04 0.00 -2.44 0.00 0.00 57.07 56.41 2fak s TYR 142 Cb 0.09 -3.09 -0.01 0.00 0.35 0.00 0.00 41.96 39.30 2fak s TYR 142 CO 0.69 0.08 0.05 -1.83 -1.34 0.00 0.00 175.55 173.20 2fak s GLU 143 N -0.58 0.40 0.88 4.97 -1.05 -1.26 -4.97 118.70 117.08 2fak s GLU 143 Ca 0.45 -0.51 -0.11 0.00 -0.15 0.00 0.00 54.97 54.65 2fak s GLU 143 Cb -0.26 0.16 0.12 0.00 -0.44 0.00 0.00 34.13 33.70 2fak s GLU 143 CO 0.32 -0.08 1.10 -2.14 0.95 0.00 0.00 175.26 175.41 2fak s PRO 144 N -1.44 1.40 -1.15 -4.83 0.02 -1.26 -4.22 135.00 123.52 2fak s PRO 144 Ca -0.15 1.14 0.00 0.00 0.02 0.00 0.00 61.00 62.01 2fak s PRO 144 Cb -0.09 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.63 2fak s PRO 144 CO 0.00 -2.23 0.00 0.09 -0.33 0.00 0.00 177.00 174.53 2fak n ASN 145 N -3.92 -3.71 -4.75 2.53 4.13 -1.26 -4.94 115.26 103.33 2fak n ASN 145 Ca 0.09 0.23 -0.39 0.00 1.68 0.00 0.00 54.58 56.19 2fak n ASN 145 Cb 0.53 -3.26 0.03 0.00 -1.54 0.00 0.00 39.78 35.55 2fak n ASN 145 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2fak s LEU 146 N -4.94 3.92 0.60 3.41 1.43 -1.26 -3.78 118.68 118.06 2fak s LEU 146 Ca 0.00 2.78 -0.13 0.00 -1.03 0.00 0.00 54.13 55.76 2fak s LEU 146 Cb 0.00 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 41.99 2fak s LEU 146 CO 0.00 -1.45 1.02 -1.61 0.23 0.00 0.00 176.35 174.54 2fak s GLU 147 N -2.79 3.57 0.22 1.70 0.41 -1.26 -0.42 118.70 120.13 2fak s GLU 147 Ca 0.69 0.88 -0.19 0.00 -0.41 0.00 0.00 54.97 55.94 2fak s GLU 147 Cb -0.41 -2.08 0.20 0.00 -1.78 0.00 0.00 34.13 30.07 2fak s GLU 147 CO 0.49 -0.59 1.56 -1.35 -0.49 0.00 0.00 175.26 174.88 2fak h PRO 148 N 0.03 -0.03 -0.21 0.39 0.11 -1.93 0.37 132.00 130.73 2fak h PRO 148 Ca -0.45 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.67 2fak h PRO 148 Cb 1.19 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2fak h PRO 148 CO 0.61 -0.02 0.14 0.93 -0.21 0.00 0.00 178.00 179.45 2fak h GLU 149 N -0.03 0.24 0.00 1.05 3.07 -2.00 -1.38 114.58 115.53 2fak h GLU 149 Ca 0.32 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 59.16 2fak h GLU 149 Cb 0.58 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 2fak h GLU 149 CO -0.94 0.16 -0.00 -0.44 -1.40 0.00 0.00 179.01 176.39 2fak h ASP 150 N 0.25 -0.00 -0.91 1.42 3.45 -1.11 -3.25 116.42 116.27 2fak h ASP 150 Ca 0.08 -0.85 0.19 0.00 0.43 0.00 0.00 57.03 56.89 2fak h ASP 150 Cb 0.03 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 38.72 2fak h ASP 150 CO -0.02 0.92 0.60 0.25 -1.57 0.00 0.00 179.24 179.42 2fak h LEU 151 N -1.00 0.48 -0.89 1.55 5.85 -0.19 0.84 115.31 121.95 2fak h LEU 151 Ca -0.00 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2fak h LEU 151 Cb 0.85 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.80 2fak h LEU 151 CO 0.00 0.20 0.52 0.15 -0.34 0.00 0.00 178.44 178.97 2fak h PHE 152 N 0.48 1.18 -0.49 1.25 3.57 -1.33 0.12 116.94 121.72 2fak h PHE 152 Ca 0.48 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.85 2fak h PHE 152 Cb 1.09 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 2fak h PHE 152 CO -0.00 0.80 -0.16 0.93 -2.23 0.00 0.00 178.31 177.64 2fak h GLU 153 N 1.23 0.97 0.06 1.11 4.39 -0.89 -2.22 114.58 119.22 2fak h GLU 153 Ca 0.32 -0.39 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 2fak h GLU 153 Cb -0.03 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2fak h GLU 153 CO -0.06 1.06 -0.03 1.15 -1.16 0.00 0.00 179.01 179.98 2fak h THR 154 N 0.83 1.21 -0.93 1.13 2.02 -1.00 -1.82 112.91 114.34 2fak h THR 154 Ca 0.12 -1.01 0.04 0.00 0.77 0.00 0.00 66.41 66.33 2fak h THR 154 Cb 0.73 1.86 -0.06 0.00 -1.74 0.00 0.00 68.15 68.95 2fak h THR 154 CO 0.06 0.25 0.60 -0.29 0.37 0.00 0.00 175.52 176.51 2fak h ILE 155 N -0.55 1.14 -0.40 3.11 6.09 -0.83 -1.60 117.51 124.48 2fak h ILE 155 Ca -0.01 -0.40 -0.07 0.00 -1.37 0.00 0.00 64.86 63.01 2fak h ILE 155 Cb 0.47 -0.12 -0.01 0.00 0.47 0.00 0.00 36.82 37.63 2fak h ILE 155 CO 0.01 0.21 -0.03 0.28 -3.07 0.00 0.00 178.15 175.55 2fak h SER 156 N 1.16 0.72 0.54 2.19 0.02 -1.39 -0.92 113.55 115.87 2fak h SER 156 Ca 0.38 -0.33 -0.08 0.00 -0.84 0.00 0.00 61.79 60.92 2fak h SER 156 Cb 0.03 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2fak h SER 156 CO -0.13 0.87 -0.37 1.56 -1.14 0.00 0.00 176.83 177.62 2fak h GLN 157 N 0.54 0.00 -0.01 3.45 1.08 -1.12 -0.44 115.11 118.61 2fak h GLN 157 Ca 0.11 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.30 2fak h GLN 157 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2fak h GLN 157 CO 0.03 0.37 -0.03 0.00 -0.95 0.00 0.00 178.83 178.25 2fak h ALA 158 N 1.63 0.02 0.06 3.87 0.00 -1.02 -2.71 119.26 121.12 2fak h ALA 158 Ca -0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2fak h ALA 158 Cb 0.74 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2fak h ALA 158 CO 0.05 -0.17 -0.03 1.25 0.00 0.00 0.00 179.25 180.35 2fak h LEU 159 N -0.53 -0.07 0.10 0.00 5.85 -1.02 -2.69 115.31 116.95 2fak h LEU 159 Ca 0.00 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.63 2fak h LEU 159 Cb 0.61 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 2fak h LEU 159 CO 0.01 0.05 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.97 2fak h LEU 160 N -0.19 -0.31 -1.17 2.25 4.07 -1.18 -1.46 115.31 117.32 2fak h LEU 160 Ca -0.01 0.03 -0.08 0.00 0.08 0.00 0.00 57.88 57.91 2fak h LEU 160 Cb 0.16 0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 2fak h LEU 160 CO 0.01 -0.18 -0.37 0.78 -1.08 0.00 0.00 178.44 177.61 2fak h ASN 161 N -0.25 0.00 0.19 -0.43 2.35 -1.54 -2.15 115.58 113.75 2fak h ASN 161 Ca 0.01 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.49 2fak h ASN 161 Cb 0.25 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.63 2fak h ASN 161 CO -0.04 0.37 -1.10 0.00 -1.65 0.00 0.00 177.43 175.01 2fak h ALA 162 N 1.63 0.15 -0.07 -0.83 0.00 -1.40 -3.26 119.26 115.48 2fak h ALA 162 Ca -0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 54.91 54.10 2fak h ALA 162 Cb 0.76 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2fak h ALA 162 CO 0.05 0.75 -0.27 0.00 0.00 0.00 0.00 179.25 179.77 2fak h ALA 163 N 0.48 1.42 0.00 0.00 0.00 -0.98 -2.56 119.26 117.62 2fak h ALA 163 Ca -0.14 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2fak h ALA 163 Cb 1.76 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2fak h ALA 163 CO 0.20 0.42 0.00 -0.25 0.00 0.00 0.00 179.25 179.62 2fak n ASP 164 N -4.17 0.00 0.00 0.00 10.43 -0.83 -2.24 116.55 119.73 2fak n ASP 164 Ca -0.01 -1.57 0.00 0.00 2.57 0.00 0.00 54.79 55.78 2fak n ASP 164 Cb 0.35 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.31 2fak n ASP 164 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2fak n ARG 165 N -0.71 0.68 -4.46 -1.24 5.12 -0.97 -4.97 116.66 110.11 2fak n ARG 165 Ca 0.10 -0.92 -0.33 0.00 -1.93 0.00 0.00 57.85 54.78 2fak n ARG 165 Cb 0.05 -0.99 -0.16 0.00 -1.16 0.00 0.00 32.46 30.19 2fak n ARG 165 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2fak s ASP 166 N -0.42 3.12 0.39 0.55 3.68 -0.95 -5.01 116.67 118.02 2fak s ASP 166 Ca 0.00 -0.62 0.08 0.00 2.13 0.00 0.00 52.55 54.14 2fak s ASP 166 Cb 0.00 -1.46 0.78 0.00 -1.45 0.00 0.00 42.92 40.79 2fak s ASP 166 CO 0.00 0.05 1.94 0.00 0.13 0.00 0.00 175.17 177.29 2fak h ALA 167 N 7.56 1.53 -0.51 3.66 0.00 -1.94 -2.98 119.26 126.59 2fak h ALA 167 Ca -0.38 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2fak h ALA 167 Cb 1.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2fak h ALA 167 CO 0.59 0.34 0.00 1.28 0.00 0.00 0.00 179.25 181.46 2fak n LEU 168 N -4.32 2.80 -4.45 0.00 4.77 -1.26 -4.93 117.00 109.61 2fak n LEU 168 Ca 0.00 -1.39 -0.22 0.00 -0.03 0.00 0.00 56.01 54.37 2fak n LEU 168 Cb 0.23 -0.34 -0.10 0.00 -2.33 0.00 0.00 43.42 40.87 2fak n LEU 168 CO 0.38 0.69 -0.42 -0.44 -1.33 0.00 0.00 177.39 176.27 2fak s SER 169 N -1.04 3.18 0.00 -1.43 0.01 -1.13 -2.87 113.70 110.43 2fak s SER 169 Ca 0.35 -1.11 0.00 0.00 1.31 0.00 0.00 55.95 56.51 2fak s SER 169 Cb 0.18 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.17 2fak s SER 169 CO 0.24 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.34 2fak n GLY 170 N -0.60 0.09 2.75 3.44 0.00 -1.26 -4.82 105.19 104.80 2fak n GLY 170 Ca -0.06 -1.89 -0.21 0.00 0.00 0.00 0.00 46.02 43.86 2fak n GLY 170 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2fak n TRP 171 N 0.08 -1.54 0.00 1.61 7.02 -1.26 -2.26 117.44 121.10 2fak n TRP 171 Ca 0.00 0.27 0.00 0.00 -1.02 0.00 0.00 57.50 56.75 2fak n TRP 171 Cb 0.00 -4.03 0.00 0.00 -2.42 0.00 0.00 31.31 24.86 2fak n TRP 171 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2fak n GLY 172 N -1.24 2.70 3.43 6.99 0.00 -1.26 -4.42 105.19 111.38 2fak n GLY 172 Ca -0.16 -2.01 -0.15 0.00 0.00 0.00 0.00 46.02 43.70 2fak n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fak s ALA 173 N -2.65 -1.48 -0.01 4.61 0.00 -1.26 -1.44 121.76 119.52 2fak s ALA 173 Ca 0.00 0.78 0.01 0.00 0.00 0.00 0.00 51.96 52.75 2fak s ALA 173 Cb 0.00 0.35 0.01 0.00 0.00 0.00 0.00 23.12 23.47 2fak s ALA 173 CO 0.00 -0.50 -0.04 0.54 0.00 0.00 0.00 175.76 175.76 2fak s VAL 174 N -2.26 0.34 -0.07 0.00 0.11 -0.49 -1.47 120.40 116.56 2fak s VAL 174 Ca -0.06 -0.13 0.03 0.00 -2.93 0.00 0.00 61.98 58.89 2fak s VAL 174 Cb -0.01 -0.33 0.01 0.00 -1.53 0.00 0.00 36.38 34.52 2fak s VAL 174 CO 0.00 0.12 -0.17 -0.69 -3.33 0.00 0.00 175.10 171.03 2fak s VAL 175 N 0.23 1.51 -0.19 2.04 1.01 0.12 -2.09 120.40 123.03 2fak s VAL 175 Ca -0.02 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 2fak s VAL 175 Cb -0.06 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 2fak s VAL 175 CO -0.00 0.44 0.03 -0.31 0.00 0.00 0.00 175.10 175.25 2fak s TYR 176 N 0.42 3.11 -0.30 5.22 2.02 -0.19 -0.76 117.35 126.88 2fak s TYR 176 Ca -0.14 -0.24 -0.06 0.00 -0.37 0.00 0.00 57.07 56.26 2fak s TYR 176 Cb -0.16 -2.08 0.02 0.00 -0.40 0.00 0.00 41.96 39.34 2fak s TYR 176 CO 0.05 -0.09 0.07 0.42 -1.57 0.00 0.00 175.55 174.43 2fak s ILE 177 N 0.78 3.81 -0.10 2.71 -1.09 0.18 -1.64 121.20 125.85 2fak s ILE 177 Ca 0.02 -0.83 -0.02 0.00 -2.23 0.00 0.00 60.65 57.59 2fak s ILE 177 Cb -0.14 -3.01 -0.03 0.00 -1.58 0.00 0.00 42.46 37.70 2fak s ILE 177 CO 0.02 0.03 -0.00 -0.63 -1.23 0.00 0.00 174.94 173.13 2fak s ILE 178 N 1.46 4.27 0.18 2.92 1.09 0.13 -1.63 121.20 129.63 2fak s ILE 178 Ca 0.01 -0.26 0.00 0.00 -1.10 0.00 0.00 60.65 59.31 2fak s ILE 178 Cb -0.18 -2.81 -0.04 0.00 -1.06 0.00 0.00 42.46 38.37 2fak s ILE 178 CO 0.02 0.59 0.06 -0.54 -0.10 0.00 0.00 174.94 174.97 2fak s LYS 179 N -0.68 1.13 0.47 2.79 1.02 -0.62 -1.45 119.74 122.39 2fak s LYS 179 Ca 0.11 -1.57 0.24 0.00 0.02 0.00 0.00 55.97 54.76 2fak s LYS 179 Cb -0.12 0.00 1.26 0.00 -0.52 0.00 0.00 37.83 38.45 2fak s LYS 179 CO 0.02 -0.26 1.86 0.87 -0.92 0.00 0.00 175.35 176.93 2fak h LYS 181 N 2.67 0.22 0.00 1.68 1.79 -1.94 -3.22 116.57 117.77 2fak h LYS 181 Ca -0.36 -0.01 -0.14 0.00 -2.18 0.00 0.00 60.65 57.95 2fak h LYS 181 Cb 1.22 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.79 2fak h LYS 181 CO 0.59 0.15 -1.58 -0.40 -1.08 0.00 0.00 179.45 177.13 2fak n ASP 182 N -4.42 2.84 -3.93 0.86 5.75 -1.26 -5.06 116.55 111.33 2fak n ASP 182 Ca 0.20 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.88 2fak n ASP 182 Cb 0.83 0.78 -0.09 0.00 -1.03 0.00 0.00 41.12 41.61 2fak n ASP 182 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 2fak s GLU 183 N -2.25 0.65 -0.10 0.11 -1.05 -1.22 -5.14 118.70 109.69 2fak s GLU 183 Ca -0.04 -0.83 0.00 0.00 -0.15 0.00 0.00 54.97 53.94 2fak s GLU 183 Cb 0.03 0.25 0.02 0.00 -0.44 0.00 0.00 34.13 34.00 2fak s GLU 183 CO 0.36 -0.17 -0.08 0.08 0.95 0.00 0.00 175.26 176.40 2fak s VAL 184 N -2.99 1.02 -0.09 1.83 1.01 -1.26 -1.59 120.40 118.34 2fak s VAL 184 Ca -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.64 2fak s VAL 184 Cb 0.01 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2fak s VAL 184 CO -0.06 0.36 -0.00 -0.69 0.00 0.00 0.00 175.10 174.71 2fak s VAL 185 N 1.52 4.30 -0.16 2.92 1.01 -0.64 -4.96 120.40 124.38 2fak s VAL 185 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2fak s VAL 185 Cb -0.13 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.48 2fak s VAL 185 CO -0.06 0.60 -0.10 -0.75 0.00 0.00 0.00 175.10 174.79 2fak s LYS 186 N -0.86 1.95 -0.02 2.72 2.20 -1.26 -0.64 119.74 123.83 2fak s LYS 186 Ca 0.13 -0.59 0.06 0.00 -0.36 0.00 0.00 55.97 55.21 2fak s LYS 186 Cb -0.11 -2.10 -0.03 0.00 -1.51 0.00 0.00 37.83 34.08 2fak s LYS 186 CO 0.02 -0.33 -0.18 1.03 -0.36 0.00 0.00 175.35 175.53 2fak s ARG 187 N 1.52 2.28 -0.20 4.03 0.52 0.06 -4.94 118.95 122.23 2fak s ARG 187 Ca 0.02 -0.83 -0.11 0.00 -0.52 0.00 0.00 55.73 54.29 2fak s ARG 187 Cb -0.14 -2.24 -0.05 0.00 0.52 0.00 0.00 34.95 33.04 2fak s ARG 187 CO -0.09 0.59 0.17 0.71 0.02 0.00 0.00 175.30 176.70 2fak s TYR 188 N -0.76 3.40 0.38 -0.53 1.51 -1.26 0.14 117.35 120.23 2fak s TYR 188 Ca 0.12 0.37 -0.04 0.00 -1.01 0.00 0.00 57.07 56.50 2fak s TYR 188 Cb -0.10 -2.23 -0.04 0.00 -0.11 0.00 0.00 41.96 39.47 2fak s TYR 188 CO 0.01 0.22 0.66 -0.51 -1.11 0.00 0.00 175.55 174.82 2fak s LEU 189 N 0.56 3.88 -0.25 -1.29 1.43 -0.55 -5.00 118.68 117.46 2fak s LEU 189 Ca 0.10 0.77 -0.08 0.00 -1.03 0.00 0.00 54.13 53.88 2fak s LEU 189 Cb -0.12 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 2fak s LEU 189 CO 0.01 -0.37 0.10 -0.75 0.23 0.00 0.00 176.35 175.57 2fak s LYS 190 N -4.18 3.79 0.27 1.70 2.20 -1.26 -4.21 119.74 118.05 2fak s LYS 190 Ca 0.45 -0.41 -0.00 0.00 -0.36 0.00 0.00 55.97 55.65 2fak s LYS 190 Cb -0.10 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.80 2fak s LYS 190 CO 0.37 -0.10 0.27 0.00 -0.36 0.00 0.00 175.35 175.52 2fak s MET 191 N 1.43 1.52 0.79 4.03 0.23 -1.26 -5.08 119.30 120.95 2fak s MET 191 Ca 0.06 -1.72 -0.15 0.00 -1.03 0.00 0.00 55.69 52.84 2fak s MET 191 Cb -0.15 0.34 -0.00 0.00 -1.53 0.00 0.00 34.83 33.48 2fak s MET 191 CO 0.05 -0.56 0.62 0.54 -2.03 0.00 0.00 175.02 173.64 2fak n ARG 192 N -0.43 0.17 -1.28 3.16 1.74 -1.26 -4.83 116.66 113.93 2fak n ARG 192 Ca 0.03 0.11 -0.05 0.00 -0.77 0.00 0.00 57.85 57.17 2fak n ARG 192 Cb 0.64 -1.95 0.12 0.00 -1.02 0.00 0.00 32.46 30.25 2fak n ARG 192 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2fak n GLN 193 N -1.36 2.23 0.00 5.56 1.13 -1.26 -4.20 117.38 119.48 2fak n GLN 193 Ca 0.10 -3.55 0.00 0.00 -1.94 0.00 0.00 57.00 51.61 2fak n GLN 193 Cb 0.51 -1.75 0.00 0.00 0.11 0.00 0.00 30.24 29.10 2fak n GLN 193 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22