#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fse s HIS 5 N 0.00 3.61 0.00 4.31 3.76 -1.26 -5.05 115.29 120.66 2fse s HIS 5 Ca 0.00 1.27 0.01 0.00 -0.15 0.00 0.00 55.06 56.19 2fse s HIS 5 Cb 0.00 -2.70 -0.00 0.00 1.11 0.00 0.00 32.58 30.99 2fse s HIS 5 CO 0.00 -0.63 -0.02 0.08 -0.85 0.00 0.00 174.74 173.32 2fse s VAL 6 N -3.09 0.17 -0.04 -0.90 1.01 -1.26 -4.98 120.40 111.30 2fse s VAL 6 Ca 0.55 -0.24 0.07 0.00 0.00 0.00 0.00 61.98 62.36 2fse s VAL 6 Cb -0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 36.38 36.08 2fse s VAL 6 CO 0.51 -0.04 -0.25 -0.63 0.00 0.00 0.00 175.10 174.69 2fse s ILE 7 N -0.28 2.02 -0.06 2.22 1.01 -1.26 -0.60 121.20 124.25 2fse s ILE 7 Ca -0.02 -1.06 -0.01 0.00 0.00 0.00 0.00 60.65 59.56 2fse s ILE 7 Cb -0.02 -1.70 0.03 0.00 0.01 0.00 0.00 42.46 40.77 2fse s ILE 7 CO -0.00 0.57 0.02 -0.63 0.00 0.00 0.00 174.94 174.89 2fse s ILE 8 N -0.30 0.23 -0.90 2.92 1.01 0.16 -4.94 121.20 119.38 2fse s ILE 8 Ca 0.01 0.19 -0.18 0.00 0.00 0.00 0.00 60.65 60.67 2fse s ILE 8 Cb -0.12 -0.40 0.14 0.00 0.01 0.00 0.00 42.46 42.09 2fse s ILE 8 CO 0.02 0.22 1.06 -1.58 0.00 0.00 0.00 174.94 174.66 2fse s GLN 9 N 1.87 3.58 -0.21 2.79 0.74 -1.26 0.11 119.66 127.29 2fse s GLN 9 Ca 0.03 -1.86 -0.14 0.00 0.05 0.00 0.00 55.36 53.44 2fse s GLN 9 Cb -0.12 -4.81 -0.04 0.00 1.10 0.00 0.00 33.01 29.13 2fse s GLN 9 CO -0.04 -1.69 0.30 0.00 -0.55 0.00 0.00 175.29 173.31 2fse s ALA 10 N 2.27 3.58 0.01 1.58 0.00 0.26 -4.93 121.76 124.53 2fse s ALA 10 Ca 0.30 -0.63 0.01 0.00 0.00 0.00 0.00 51.96 51.64 2fse s ALA 10 Cb -0.06 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.56 2fse s ALA 10 CO -0.09 -0.20 -0.05 -1.83 0.00 0.00 0.00 175.76 173.60 2fse s GLU 11 N 1.08 0.36 0.01 0.00 -1.05 -1.26 -1.07 118.70 116.76 2fse s GLU 11 Ca 0.15 -0.28 -0.05 0.00 -0.15 0.00 0.00 54.97 54.63 2fse s GLU 11 Cb -0.14 -0.28 -0.01 0.00 -0.44 0.00 0.00 34.13 33.27 2fse s GLU 11 CO 0.06 0.07 0.09 -0.59 0.95 0.00 0.00 175.26 175.84 2fse s PHE 12 N -0.42 0.11 -0.00 4.83 -0.12 -0.49 -5.01 117.98 116.88 2fse s PHE 12 Ca -0.02 -0.26 0.01 0.00 -0.05 0.00 0.00 56.93 56.61 2fse s PHE 12 Cb -0.04 -0.09 -0.00 0.00 -0.63 0.00 0.00 43.02 42.26 2fse s PHE 12 CO -0.00 -0.26 -0.03 -0.47 -0.05 0.00 0.00 175.22 174.41 2fse s TYR 13 N -1.43 0.22 -0.05 3.49 5.04 -1.26 -0.99 117.35 122.37 2fse s TYR 13 Ca -0.15 -0.06 -0.04 0.00 -2.44 0.00 0.00 57.07 54.38 2fse s TYR 13 Cb -0.08 -0.14 0.01 0.00 0.35 0.00 0.00 41.96 42.10 2fse s TYR 13 CO 0.01 -0.01 0.12 -0.48 -1.34 0.00 0.00 175.55 173.85 2fse s LEU 14 N -0.11 1.48 0.21 6.97 2.34 -1.03 -4.98 118.68 123.56 2fse s LEU 14 Ca 0.00 0.25 0.07 0.00 0.06 0.00 0.00 54.13 54.51 2fse s LEU 14 Cb -0.01 0.41 -0.04 0.00 -0.56 0.00 0.00 46.19 45.99 2fse s LEU 14 CO -0.00 -0.05 0.06 0.20 -1.06 0.00 0.00 176.35 175.50 2fse s ASN 15 N 0.14 4.98 0.25 1.48 0.01 -1.26 0.38 114.94 120.92 2fse s ASN 15 Ca -0.01 -0.38 0.12 0.00 -0.71 0.00 0.00 52.86 51.88 2fse s ASN 15 Cb -0.02 -1.12 0.23 0.00 0.41 0.00 0.00 41.25 40.75 2fse s ASN 15 CO -0.00 0.04 1.52 -0.65 -1.51 0.00 0.00 177.10 176.50 2fse h PRO 16 N 2.26 0.00 -0.86 -0.60 0.11 -2.02 -3.45 132.00 127.45 2fse h PRO 16 Ca -0.47 0.00 0.31 0.00 0.11 0.00 0.00 66.00 65.95 2fse h PRO 16 Cb 1.22 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.23 2fse h PRO 16 CO 0.60 0.66 0.53 -0.25 -0.21 0.00 0.00 178.00 179.33 2fse n ASP 17 N -3.54 0.17 -2.87 -2.05 8.00 -1.25 -4.74 116.55 110.27 2fse n ASP 17 Ca -0.00 0.99 -0.20 0.00 0.71 0.00 0.00 54.79 56.29 2fse n ASP 17 Cb 0.70 -0.49 0.05 0.00 -0.02 0.00 0.00 41.12 41.36 2fse n ASP 17 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fse n GLN 18 N -4.18 -5.27 -3.26 -1.24 6.02 0.16 -4.96 117.38 104.65 2fse n GLN 18 Ca 0.27 0.78 -0.40 0.00 -0.01 0.00 0.00 57.00 57.64 2fse n GLN 18 Cb 1.01 -5.45 -0.08 0.00 1.02 0.00 0.00 30.24 26.74 2fse n GLN 18 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2fse s SER 19 N -2.93 6.41 0.00 1.08 0.01 -1.11 -4.93 113.70 112.23 2fse s SER 19 Ca 0.35 0.49 0.06 0.00 1.31 0.00 0.00 55.95 58.17 2fse s SER 19 Cb -0.16 -2.27 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 2fse s SER 19 CO 0.44 -0.27 -0.18 -0.83 0.41 0.00 0.00 173.24 172.81 2fse s GLY 20 N 1.56 1.52 -0.04 3.44 0.00 -1.26 -2.47 107.32 110.06 2fse s GLY 20 Ca 0.20 -1.11 -0.04 0.00 0.00 0.00 0.00 44.72 43.76 2fse s GLY 20 CO 0.09 -0.96 0.12 1.85 0.00 0.00 0.00 173.10 174.20 2fse s GLU 21 N -1.10 0.18 -0.06 2.90 2.12 -0.16 -4.90 118.70 117.67 2fse s GLU 21 Ca 0.13 0.11 -0.01 0.00 0.36 0.00 0.00 54.97 55.56 2fse s GLU 21 Cb -0.10 0.08 0.03 0.00 0.26 0.00 0.00 34.13 34.40 2fse s GLU 21 CO 0.03 -0.03 0.01 0.12 -0.54 0.00 0.00 175.26 174.86 2fse s PHE 22 N -0.09 0.49 0.12 5.30 2.19 -1.26 -1.40 117.98 123.34 2fse s PHE 22 Ca -0.02 -0.05 -0.13 0.00 0.33 0.00 0.00 56.93 57.06 2fse s PHE 22 Cb -0.02 -0.68 0.02 0.00 -1.31 0.00 0.00 43.02 41.03 2fse s PHE 22 CO 0.00 -0.27 0.33 0.00 1.83 0.00 0.00 175.22 177.11 2fse s MET 23 N 1.89 1.01 -0.13 10.12 0.23 -0.24 -1.62 119.30 130.56 2fse s MET 23 Ca 0.03 -0.81 -0.03 0.00 -1.03 0.00 0.00 55.69 53.85 2fse s MET 23 Cb -0.12 0.43 -0.03 0.00 -1.53 0.00 0.00 34.83 33.57 2fse s MET 23 CO -0.04 -0.37 -0.04 -0.06 -2.03 0.00 0.00 175.02 172.48 2fse s PHE 24 N -3.83 3.03 -0.01 3.16 0.40 -0.23 -0.58 117.98 119.92 2fse s PHE 24 Ca 0.04 -0.19 0.06 0.00 -0.60 0.00 0.00 56.93 56.25 2fse s PHE 24 Cb 0.03 -1.90 -0.02 0.00 0.51 0.00 0.00 43.02 41.64 2fse s PHE 24 CO -0.11 0.09 -0.20 0.34 0.70 0.00 0.00 175.22 176.03 2fse s ASP 25 N 0.02 2.39 -0.18 1.36 -1.08 0.12 0.02 116.67 119.32 2fse s ASP 25 Ca 0.01 -0.39 -0.01 0.00 -0.52 0.00 0.00 52.55 51.64 2fse s ASP 25 Cb -0.13 -0.26 0.05 0.00 -1.46 0.00 0.00 42.92 41.12 2fse s ASP 25 CO 0.03 0.24 -0.03 0.12 0.52 0.00 0.00 175.17 176.05 2fse s PHE 26 N -0.52 1.60 -1.44 -5.34 5.36 0.17 0.36 117.98 118.16 2fse s PHE 26 Ca 0.08 -1.10 0.00 0.00 -0.96 0.00 0.00 56.93 54.95 2fse s PHE 26 Cb -0.08 -1.26 0.00 0.00 -0.34 0.00 0.00 43.02 41.34 2fse s PHE 26 CO -0.00 -0.63 0.00 -0.25 -1.46 0.00 0.00 175.22 172.88 2fse n ASP 27 N 4.90 -4.01 0.00 6.13 9.92 0.23 -2.15 116.55 131.57 2fse n ASP 27 Ca -0.11 0.29 0.00 0.00 -0.53 0.00 0.00 54.79 54.44 2fse n ASP 27 Cb 0.47 -3.59 0.00 0.00 -0.64 0.00 0.00 41.12 37.36 2fse n ASP 27 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2fse n GLY 28 N -0.46 1.29 3.91 0.44 0.00 -1.26 -5.01 105.19 104.10 2fse n GLY 28 Ca -0.15 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 2fse n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fse s ASP 29 N -0.64 6.17 0.05 1.61 1.01 -0.91 -5.02 116.67 118.94 2fse s ASP 29 Ca 0.00 0.14 -0.25 0.00 0.71 0.00 0.00 52.55 53.15 2fse s ASP 29 Cb 0.00 -1.83 -0.05 0.00 1.01 0.00 0.00 42.92 42.05 2fse s ASP 29 CO 0.00 0.09 0.77 -1.83 0.21 0.00 0.00 175.17 174.41 2fse s GLU 30 N -3.00 4.50 -0.11 8.23 -1.05 -1.26 0.41 118.70 126.43 2fse s GLU 30 Ca 0.34 1.08 -0.20 0.00 -0.15 0.00 0.00 54.97 56.04 2fse s GLU 30 Cb -0.11 -3.36 -0.27 0.00 -0.44 0.00 0.00 34.13 29.94 2fse s GLU 30 CO 0.27 0.28 0.62 0.82 0.95 0.00 0.00 175.26 178.21 2fse h ILE 31 N 4.11 1.23 -1.76 1.83 2.04 -0.76 -3.41 117.51 120.79 2fse h ILE 31 Ca -0.44 -2.40 0.27 0.00 1.00 0.00 0.00 64.86 63.29 2fse h ILE 31 Cb 1.21 2.86 -0.11 0.00 -0.74 0.00 0.00 36.82 40.04 2fse h ILE 31 CO 0.71 0.64 0.71 0.72 0.00 0.00 0.00 178.15 180.93 2fse s PHE 32 N -2.42 -0.08 0.08 1.37 -0.12 -1.23 -2.19 117.98 113.41 2fse s PHE 32 Ca -0.19 -0.09 -0.04 0.00 -0.05 0.00 0.00 56.93 56.55 2fse s PHE 32 Cb 0.03 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 42.97 2fse s PHE 32 CO 0.75 -0.47 0.07 -3.38 -0.05 0.00 0.00 175.22 172.14 2fse s HIS 33 N -2.73 0.47 -0.30 3.49 -3.43 -0.96 -1.07 115.29 110.76 2fse s HIS 33 Ca 0.13 -0.95 -0.12 0.00 -0.80 0.00 0.00 55.06 53.33 2fse s HIS 33 Cb 0.03 -0.29 -0.04 0.00 -1.43 0.00 0.00 32.58 30.85 2fse s HIS 33 CO -0.02 -0.48 0.22 0.08 -2.00 0.00 0.00 174.74 172.55 2fse s VAL 34 N -3.93 5.29 -0.27 -5.38 1.01 -0.64 -0.48 120.40 115.99 2fse s VAL 34 Ca 0.10 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 2fse s VAL 34 Cb 0.07 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 2fse s VAL 34 CO -0.07 0.15 1.50 -0.62 0.00 0.00 0.00 175.10 176.06 2fse s ASP 35 N 1.74 6.44 0.02 3.32 -1.08 0.30 -4.65 116.67 122.76 2fse s ASP 35 Ca 0.07 1.38 -0.14 0.00 -0.52 0.00 0.00 52.55 53.34 2fse s ASP 35 Cb -0.16 -2.54 -0.08 0.00 -1.46 0.00 0.00 42.92 38.68 2fse s ASP 35 CO 0.11 -1.25 1.18 0.24 0.52 0.00 0.00 175.17 175.97 2fse h MET 36 N 10.40 -0.50 -0.50 4.34 2.86 -1.91 0.21 114.93 129.84 2fse h MET 36 Ca -0.31 0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.42 2fse h MET 36 Cb 1.13 0.11 -0.07 0.00 0.06 0.00 0.00 31.60 32.83 2fse h MET 36 CO 1.02 -0.33 -0.39 0.00 1.06 0.00 0.00 176.91 178.27 2fse h ALA 37 N -1.75 -0.48 0.00 6.32 0.00 -1.96 1.01 119.26 122.40 2fse h ALA 37 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fse h ALA 37 Cb 0.39 1.14 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2fse h ALA 37 CO 0.09 -0.72 0.00 1.63 0.00 0.00 0.00 179.25 180.24 2fse n LYS 38 N -4.52 0.03 -1.98 0.00 5.02 -1.24 -4.83 118.16 110.63 2fse n LYS 38 Ca -0.00 0.38 -0.17 0.00 -2.02 0.00 0.00 58.31 56.50 2fse n LYS 38 Cb 0.20 -1.57 -0.04 0.00 -0.02 0.00 0.00 35.03 33.61 2fse n LYS 38 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2fse n LYS 39 N -1.62 -1.68 -3.23 1.97 4.81 0.35 -4.93 118.16 113.84 2fse n LYS 39 Ca 0.02 0.89 -0.14 0.00 -0.87 0.00 0.00 58.31 58.20 2fse n LYS 39 Cb 0.10 -5.37 -0.03 0.00 0.02 0.00 0.00 35.03 29.75 2fse n LYS 39 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 2fse n GLU 40 N -2.53 1.22 -4.12 1.64 0.28 -0.42 -4.60 120.64 112.11 2fse n GLU 40 Ca -0.18 -1.71 -0.35 0.00 -0.16 0.00 0.00 57.16 54.75 2fse n GLU 40 Cb 0.60 0.60 -0.09 0.00 1.43 0.00 0.00 31.44 33.98 2fse n GLU 40 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2fse s THR 41 N -1.99 4.78 -0.22 3.84 2.01 -1.26 0.11 115.64 122.91 2fse s THR 41 Ca 0.03 -0.06 0.02 0.00 0.31 0.00 0.00 61.69 61.99 2fse s THR 41 Cb 0.00 -3.08 0.04 0.00 0.01 0.00 0.00 72.50 69.47 2fse s THR 41 CO 0.02 0.56 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.68 2fse s VAL 42 N -0.52 2.01 0.08 3.82 1.01 0.37 -4.86 120.40 122.30 2fse s VAL 42 Ca 0.10 -1.25 -0.27 0.00 0.00 0.00 0.00 61.98 60.57 2fse s VAL 42 Cb -0.12 -2.00 -0.06 0.00 0.00 0.00 0.00 36.38 34.20 2fse s VAL 42 CO 0.02 0.22 0.84 0.26 0.00 0.00 0.00 175.10 176.44 2fse s TRP 43 N 1.23 3.77 0.41 5.22 0.52 -1.26 -2.28 118.94 126.56 2fse s TRP 43 Ca -0.02 1.61 0.08 0.00 0.02 0.00 0.00 56.10 57.78 2fse s TRP 43 Cb -0.17 -2.91 0.86 0.00 -1.15 0.00 0.00 33.47 30.11 2fse s TRP 43 CO -0.09 0.26 2.04 -0.09 0.02 0.00 0.00 176.95 179.10 2fse h ARG 44 N 5.56 0.48 -4.12 4.98 9.65 -1.68 -3.39 114.38 125.87 2fse h ARG 44 Ca -0.44 -0.04 -0.51 0.00 -1.10 0.00 0.00 59.98 57.90 2fse h ARG 44 Cb 1.21 -0.10 -0.37 0.00 -1.39 0.00 0.00 29.97 29.31 2fse h ARG 44 CO 0.71 0.35 -0.80 -0.51 2.80 0.00 0.00 179.97 182.53 2fse s LEU 45 N -9.38 1.06 0.47 3.80 1.43 -1.26 -5.02 118.68 109.77 2fse s LEU 45 Ca -0.08 -0.26 0.30 0.00 -1.03 0.00 0.00 54.13 53.07 2fse s LEU 45 Cb 0.17 -0.76 1.39 0.00 0.03 0.00 0.00 46.19 47.02 2fse s LEU 45 CO 0.73 -0.13 1.71 -0.33 0.23 0.00 0.00 176.35 178.56 2fse h GLU 46 N 8.20 0.15 -0.87 1.70 4.39 -2.00 0.24 114.58 126.39 2fse h GLU 46 Ca -0.28 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.49 2fse h GLU 46 Cb 1.13 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 29.68 2fse h GLU 46 CO 0.38 0.10 0.53 1.05 -1.16 0.00 0.00 179.01 179.91 2fse h GLU 47 N 0.15 0.90 -0.87 2.33 4.11 -1.95 -2.22 114.58 117.03 2fse h GLU 47 Ca 0.70 -0.05 0.21 0.00 0.07 0.00 0.00 59.36 60.29 2fse h GLU 47 Cb 2.29 -0.20 -0.13 0.00 0.50 0.00 0.00 28.75 31.21 2fse h GLU 47 CO -0.23 0.60 0.34 0.74 0.07 0.00 0.00 179.01 180.53 2fse h PHE 48 N 0.93 0.56 -0.24 2.06 0.04 -0.92 -1.71 116.94 117.65 2fse h PHE 48 Ca 0.40 0.04 0.05 0.00 2.80 0.00 0.00 57.97 61.26 2fse h PHE 48 Cb 0.27 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.26 2fse h PHE 48 CO -0.04 -0.08 -0.04 0.78 -0.60 0.00 0.00 178.31 178.33 2fse h GLY 49 N 0.35 0.19 1.94 -1.45 0.00 -1.51 1.33 103.07 103.92 2fse h GLY 49 Ca 0.54 0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.94 2fse h GLY 49 CO -0.55 -0.08 0.03 3.21 0.00 0.00 0.00 176.54 179.15 2fse h ARG 50 N 0.02 0.00 0.03 4.80 3.08 -1.39 -2.35 114.38 118.57 2fse h ARG 50 Ca 0.12 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.85 2fse h ARG 50 Cb 0.17 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 2fse h ARG 50 CO -0.24 0.00 -1.88 1.19 -1.07 0.00 0.00 179.97 177.98 2fse n PHE 51 N -3.67 0.95 -4.21 3.04 3.72 0.50 -5.04 117.46 112.74 2fse n PHE 51 Ca -0.03 0.29 -0.11 0.00 -0.05 0.00 0.00 57.45 57.55 2fse n PHE 51 Cb 0.11 -1.16 -0.03 0.00 -0.94 0.00 0.00 39.48 37.46 2fse n PHE 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fse n ALA 52 N -2.72 0.29 -3.48 4.37 0.00 0.43 -5.09 120.51 114.31 2fse n ALA 52 Ca -0.23 -0.97 -0.16 0.00 0.00 0.00 0.00 53.44 52.07 2fse n ALA 52 Cb 1.06 0.68 -0.05 0.00 0.00 0.00 0.00 19.45 21.14 2fse n ALA 52 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2fse s SER 53 N -2.17 -0.62 -0.19 0.00 1.04 -1.26 -4.63 113.70 105.87 2fse s SER 53 Ca 0.12 0.51 -0.09 0.00 0.48 0.00 0.00 55.95 56.96 2fse s SER 53 Cb 0.01 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.74 2fse s SER 53 CO 0.08 -0.70 0.45 0.12 0.98 0.00 0.00 173.24 174.18 2fse s PHE 54 N -1.86 -0.73 -0.75 5.02 5.36 -1.26 -5.09 117.98 118.66 2fse s PHE 54 Ca -0.08 1.48 -0.26 0.00 -0.96 0.00 0.00 56.93 57.11 2fse s PHE 54 Cb -0.00 0.34 0.01 0.00 -0.34 0.00 0.00 43.02 43.03 2fse s PHE 54 CO 0.04 -0.41 1.53 -2.00 -1.46 0.00 0.00 175.22 172.92 2fse s GLU 55 N 1.78 3.02 0.27 10.12 2.12 -1.26 -4.81 118.70 129.94 2fse s GLU 55 Ca -0.08 -0.11 -0.04 0.00 0.36 0.00 0.00 54.97 55.11 2fse s GLU 55 Cb -0.09 -4.47 0.36 0.00 0.26 0.00 0.00 34.13 30.20 2fse s GLU 55 CO -0.14 -2.43 1.92 0.00 -0.54 0.00 0.00 175.26 174.07 2fse h ALA 56 N 11.58 1.36 -1.04 6.30 0.00 -1.92 -3.06 119.26 132.48 2fse h ALA 56 Ca -0.18 -0.05 0.27 0.00 0.00 0.00 0.00 54.91 54.95 2fse h ALA 56 Cb 1.07 -0.35 -0.10 0.00 0.00 0.00 0.00 17.79 18.41 2fse h ALA 56 CO 1.28 0.55 0.67 1.96 0.00 0.00 0.00 179.25 183.70 2fse h GLN 57 N 1.24 0.39 0.00 0.00 4.20 -1.89 0.15 115.11 119.20 2fse h GLN 57 Ca 0.38 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 59.03 2fse h GLN 57 Cb -0.03 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 2fse h GLN 57 CO -0.11 0.26 -0.15 0.78 -0.67 0.00 0.00 178.83 178.94 2fse h GLY 58 N 0.41 0.00 0.74 3.46 0.00 -1.96 -2.78 103.07 102.94 2fse h GLY 58 Ca 0.61 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.90 2fse h GLY 58 CO -0.32 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.16 2fse h ALA 59 N 1.85 0.19 -1.00 3.60 0.00 -0.86 -2.97 119.26 120.07 2fse h ALA 59 Ca -0.00 -0.25 0.26 0.00 0.00 0.00 0.00 54.91 54.91 2fse h ALA 59 Cb 0.45 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 2fse h ALA 59 CO 0.02 -0.03 0.67 -0.07 0.00 0.00 0.00 179.25 179.84 2fse h LEU 60 N -0.05 0.34 0.89 0.00 3.38 -1.46 -1.75 115.31 116.66 2fse h LEU 60 Ca 0.03 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2fse h LEU 60 Cb 0.51 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.26 2fse h LEU 60 CO 0.02 0.09 -0.43 0.00 0.09 0.00 0.00 178.44 178.21 2fse h ALA 61 N 1.58 -1.26 -0.70 1.53 0.00 -1.53 -2.68 119.26 116.20 2fse h ALA 61 Ca 0.54 -0.26 0.15 0.00 0.00 0.00 0.00 54.91 55.34 2fse h ALA 61 Cb 1.51 0.46 -0.13 0.00 0.00 0.00 0.00 17.79 19.64 2fse h ALA 61 CO -0.20 -1.17 -0.05 -0.91 0.00 0.00 0.00 179.25 176.91 2fse h ASN 62 N -1.25 -0.43 -0.97 0.00 4.21 -1.37 0.29 115.58 116.07 2fse h ASN 62 Ca -0.12 0.19 0.09 0.00 1.21 0.00 0.00 56.30 57.67 2fse h ASN 62 Cb 0.91 0.36 -0.07 0.00 -1.12 0.00 0.00 38.32 38.40 2fse h ASN 62 CO 0.20 -0.18 0.62 0.40 -1.29 0.00 0.00 177.43 177.18 2fse h ILE 63 N 0.07 1.01 0.31 2.81 2.04 -1.48 0.46 117.51 122.73 2fse h ILE 63 Ca 0.37 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2fse h ILE 63 Cb 0.61 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2fse h ILE 63 CO -0.65 0.19 -0.15 0.00 0.00 0.00 0.00 178.15 177.54 2fse h ALA 64 N 1.51 -0.41 -0.96 1.87 0.00 -0.10 0.69 119.26 121.86 2fse h ALA 64 Ca 0.44 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.28 2fse h ALA 64 Cb 0.33 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2fse h ALA 64 CO -0.20 -0.72 0.63 0.28 0.00 0.00 0.00 179.25 179.25 2fse h VAL 65 N -0.44 1.18 0.14 0.00 2.07 -0.64 -1.84 116.25 116.73 2fse h VAL 65 Ca -0.04 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2fse h VAL 65 Cb 0.33 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2fse h VAL 65 CO 0.07 0.23 -0.13 0.44 0.02 0.00 0.00 177.57 178.19 2fse h ASP 66 N 1.24 -0.35 -0.98 0.57 5.19 0.70 0.75 116.42 123.54 2fse h ASP 66 Ca 0.38 0.03 0.20 0.00 -0.62 0.00 0.00 57.03 57.02 2fse h ASP 66 Cb -0.03 0.12 -0.11 0.00 0.18 0.00 0.00 39.33 39.50 2fse h ASP 66 CO -0.11 -0.21 0.57 0.50 -3.12 0.00 0.00 179.24 176.87 2fse h LYS 67 N -0.30 0.65 0.00 3.56 3.64 0.12 0.36 116.57 124.61 2fse h LYS 67 Ca 0.00 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2fse h LYS 67 Cb 0.28 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2fse h LYS 67 CO -0.03 0.43 -0.12 0.00 -2.27 0.00 0.00 179.45 177.46 2fse h ALA 68 N 1.66 0.01 -0.81 5.00 0.00 -0.90 -2.39 119.26 121.84 2fse h ALA 68 Ca 0.58 -0.44 0.22 0.00 0.00 0.00 0.00 54.91 55.27 2fse h ALA 68 Cb 0.96 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 2fse h ALA 68 CO -0.42 -0.01 0.57 -0.91 0.00 0.00 0.00 179.25 178.49 2fse h ASN 69 N -0.70 0.10 0.40 0.00 2.35 0.17 0.37 115.58 118.28 2fse h ASN 69 Ca -0.02 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2fse h ASN 69 Cb 0.92 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.29 2fse h ASN 69 CO 0.02 0.04 -0.19 0.25 -1.65 0.00 0.00 177.43 175.90 2fse h LEU 70 N 0.10 -0.46 -1.24 1.61 5.85 -0.30 -2.09 115.31 118.78 2fse h LEU 70 Ca 0.40 0.02 0.34 0.00 0.84 0.00 0.00 57.88 59.48 2fse h LEU 70 Cb 1.41 0.12 -0.13 0.00 0.37 0.00 0.00 40.66 42.44 2fse h LEU 70 CO -0.05 -0.12 0.69 -0.33 -0.34 0.00 0.00 178.44 178.30 2fse h GLU 71 N -0.97 0.25 -0.04 1.25 5.08 -0.55 0.94 114.58 120.55 2fse h GLU 71 Ca -0.06 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2fse h GLU 71 Cb 0.42 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 2fse h GLU 71 CO 0.09 0.17 0.00 0.82 -1.00 0.00 0.00 179.01 179.09 2fse h ILE 72 N 0.26 1.24 -0.47 3.13 2.04 -0.26 -3.06 117.51 120.39 2fse h ILE 72 Ca 0.73 -0.73 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 2fse h ILE 72 Cb 1.93 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 39.65 2fse h ILE 72 CO -0.46 0.20 -0.18 0.24 0.00 0.00 0.00 178.15 177.95 2fse h MET 73 N -0.21 0.93 -0.02 2.37 2.86 0.76 -2.37 114.93 119.25 2fse h MET 73 Ca 0.01 -0.37 0.01 0.00 -2.06 0.00 0.00 59.70 57.29 2fse h MET 73 Cb 0.31 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 2fse h MET 73 CO 0.00 1.03 0.38 1.15 1.06 0.00 0.00 176.91 180.53 2fse h THR 74 N 0.82 0.02 0.00 2.22 2.02 0.63 -2.93 112.91 115.68 2fse h THR 74 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 2fse h THR 74 Cb 0.73 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2fse h THR 74 CO 0.06 0.00 -0.56 1.17 0.37 0.00 0.00 175.52 176.56 2fse n LYS 75 N -2.91 0.44 0.00 6.66 4.81 -0.90 -2.84 118.16 123.42 2fse n LYS 75 Ca -0.01 0.46 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 2fse n LYS 75 Cb 0.43 -1.61 0.00 0.00 0.02 0.00 0.00 35.03 33.87 2fse n LYS 75 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2fse n ARG 76 N -4.49 0.73 0.00 1.64 1.85 -1.12 -1.41 116.66 113.86 2fse n ARG 76 Ca -0.08 0.00 0.06 0.00 -1.00 0.00 0.00 57.85 56.83 2fse n ARG 76 Cb 0.29 -1.30 -0.02 0.00 -1.05 0.00 0.00 32.46 30.39 2fse n ARG 76 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2fse n SER 77 N 0.28 1.12 -2.30 2.89 3.41 -1.12 -4.95 113.62 112.95 2fse n SER 77 Ca 0.00 -1.06 -0.12 0.00 -0.26 0.00 0.00 58.87 57.43 2fse n SER 77 Cb 0.23 0.60 0.05 0.00 -0.26 0.00 0.00 64.21 64.84 2fse n SER 77 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2fse n ASN 78 N -0.48 -3.28 -3.16 4.04 5.15 -0.50 -3.15 115.26 113.88 2fse n ASN 78 Ca 0.04 -0.32 -0.20 0.00 -0.60 0.00 0.00 54.58 53.50 2fse n ASN 78 Cb 0.23 -3.07 -0.01 0.00 -0.53 0.00 0.00 39.78 36.40 2fse n ASN 78 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2fse n TYR 79 N -3.35 -1.71 -1.62 1.20 4.02 -1.13 -4.84 117.16 109.73 2fse n TYR 79 Ca -0.08 0.34 -0.43 0.00 -0.01 0.00 0.00 57.90 57.72 2fse n TYR 79 Cb 0.56 -2.65 -0.03 0.00 -0.02 0.00 0.00 39.34 37.20 2fse n TYR 79 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 2fse n THR 80 N -3.69 0.50 -1.90 -0.72 -1.04 -1.19 -4.93 114.28 101.32 2fse n THR 80 Ca -0.03 -0.33 -0.30 0.00 -2.04 0.00 0.00 64.05 61.35 2fse n THR 80 Cb 0.55 -2.41 0.05 0.00 -1.82 0.00 0.00 70.33 66.69 2fse n THR 80 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2fse s PRO 81 N 5.61 2.86 0.26 -2.82 0.04 -1.26 -5.02 135.00 134.67 2fse s PRO 81 Ca 0.97 0.45 -0.29 0.00 0.04 0.00 0.00 61.00 62.16 2fse s PRO 81 Cb -0.41 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 32.01 2fse s PRO 81 CO 0.39 -1.03 1.30 -1.50 0.04 0.00 0.00 177.00 176.20 2fse s ILE 82 N -3.35 2.99 -0.45 0.56 1.10 -1.26 -4.99 121.20 115.80 2fse s ILE 82 Ca 0.58 0.90 -0.18 0.00 -0.51 0.00 0.00 60.65 61.44 2fse s ILE 82 Cb -0.11 -3.57 0.03 0.00 0.15 0.00 0.00 42.46 38.96 2fse s ILE 82 CO 0.52 0.18 0.53 -0.89 -2.11 0.00 0.00 174.94 173.16 2fse s THR 83 N -0.52 4.98 0.41 4.00 2.01 -1.26 -5.04 115.64 120.23 2fse s THR 83 Ca 0.53 -0.30 -0.24 0.00 0.31 0.00 0.00 61.69 61.99 2fse s THR 83 Cb -0.38 -4.14 -0.11 0.00 0.01 0.00 0.00 72.50 67.88 2fse s THR 83 CO 0.45 -0.56 0.83 0.59 -0.69 0.00 0.00 174.62 175.24 2fse n ASN 84 N 5.87 0.40 -3.96 3.53 3.02 -1.26 -4.85 115.26 118.01 2fse n ASN 84 Ca -0.06 0.99 -0.28 0.00 -0.03 0.00 0.00 54.58 55.20 2fse n ASN 84 Cb 0.47 -1.25 -0.17 0.00 -0.61 0.00 0.00 39.78 38.22 2fse n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2fse s VAL 85 N -1.33 1.26 0.36 2.41 1.01 0.57 -4.91 120.40 119.77 2fse s VAL 85 Ca 0.63 -0.44 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 2fse s VAL 85 Cb -0.59 -1.23 -0.11 0.00 0.00 0.00 0.00 36.38 34.45 2fse s VAL 85 CO 0.57 0.41 1.46 0.00 0.00 0.00 0.00 175.10 177.53 2fse n ALA 86 N 4.86 2.14 -2.59 5.51 0.00 -1.26 -2.68 120.51 126.49 2fse n ALA 86 Ca -0.14 0.35 -0.39 0.00 0.00 0.00 0.00 53.44 53.26 2fse n ALA 86 Cb 0.50 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.51 2fse n ALA 86 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2fse s PRO 87 N -1.85 4.34 -0.04 0.00 0.04 -1.26 -4.46 135.00 131.77 2fse s PRO 87 Ca 0.55 0.70 -0.26 0.00 0.04 0.00 0.00 61.00 62.03 2fse s PRO 87 Cb -0.50 -3.38 -0.03 0.00 0.04 0.00 0.00 34.50 30.62 2fse s PRO 87 CO 0.62 0.26 0.82 -2.00 0.04 0.00 0.00 177.00 176.74 2fse s GLU 88 N 0.19 4.49 0.03 4.56 2.12 -0.05 -4.89 118.70 125.14 2fse s GLU 88 Ca 0.31 1.11 0.08 0.00 0.36 0.00 0.00 54.97 56.84 2fse s GLU 88 Cb -0.17 -3.45 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 2fse s GLU 88 CO 0.16 0.02 -0.25 0.08 -0.54 0.00 0.00 175.26 174.73 2fse s VAL 89 N 0.87 2.01 0.15 3.70 1.01 -1.26 -1.10 120.40 125.79 2fse s VAL 89 Ca 0.44 -1.26 -0.15 0.00 0.00 0.00 0.00 61.98 61.01 2fse s VAL 89 Cb -0.19 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.51 2fse s VAL 89 CO 0.22 0.40 0.41 0.42 0.00 0.00 0.00 175.10 176.55 2fse s THR 90 N -0.73 0.06 -0.03 3.92 -4.23 -0.81 -4.96 115.64 108.85 2fse s THR 90 Ca 0.10 -0.81 0.02 0.00 -1.18 0.00 0.00 61.69 59.83 2fse s THR 90 Cb -0.10 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.32 2fse s THR 90 CO 0.01 -0.27 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.05 2fse s VAL 91 N -3.86 0.76 0.12 2.29 1.01 -1.26 -0.28 120.40 119.18 2fse s VAL 91 Ca 0.07 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.61 2fse s VAL 91 Cb 0.01 -0.68 0.00 0.00 0.00 0.00 0.00 36.38 35.71 2fse s VAL 91 CO -0.07 0.24 0.26 -0.76 0.00 0.00 0.00 175.10 174.78 2fse s LEU 92 N 0.25 1.08 0.08 3.92 1.43 -0.27 -4.97 118.68 120.19 2fse s LEU 92 Ca -0.04 -0.64 -0.06 0.00 -1.03 0.00 0.00 54.13 52.36 2fse s LEU 92 Cb -0.09 1.26 -0.05 0.00 0.03 0.00 0.00 46.19 47.34 2fse s LEU 92 CO 0.01 -0.80 0.32 -0.94 0.23 0.00 0.00 176.35 175.16 2fse s SER 93 N -2.88 6.50 0.31 2.29 1.04 -1.26 0.20 113.70 119.90 2fse s SER 93 Ca 0.08 0.57 0.01 0.00 0.48 0.00 0.00 55.95 57.09 2fse s SER 93 Cb 0.04 -2.09 0.50 0.00 0.10 0.00 0.00 66.02 64.57 2fse s SER 93 CO -0.08 0.15 1.87 -0.09 0.98 0.00 0.00 173.24 176.07 2fse h ARG 94 N 3.39 0.71 -4.51 4.02 2.43 -0.71 -3.45 114.38 116.27 2fse h ARG 94 Ca -0.48 -0.13 -0.21 0.00 -0.81 0.00 0.00 59.98 58.35 2fse h ARG 94 Cb 1.18 -0.11 -0.15 0.00 -0.42 0.00 0.00 29.97 30.47 2fse h ARG 94 CO 0.70 0.65 -0.65 -1.12 -1.51 0.00 0.00 179.97 178.04 2fse s SER 95 N -6.63 0.53 0.37 -3.80 0.01 -1.26 -5.06 113.70 97.86 2fse s SER 95 Ca -0.09 -1.19 -0.28 0.00 1.31 0.00 0.00 55.95 55.70 2fse s SER 95 Cb 0.16 0.25 -0.11 0.00 0.21 0.00 0.00 66.02 66.52 2fse s SER 95 CO 0.78 -0.69 1.45 -0.81 0.41 0.00 0.00 173.24 174.39 2fse n PRO 96 N -0.12 2.56 -3.30 12.44 -0.04 -1.26 -4.87 135.00 140.41 2fse n PRO 96 Ca -0.06 0.90 -0.38 0.00 -0.04 0.00 0.00 63.50 63.92 2fse n PRO 96 Cb 0.63 -2.60 -0.06 0.00 -0.04 0.00 0.00 33.50 31.43 2fse n PRO 96 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2fse s VAL 97 N -1.06 5.13 -0.03 0.52 -7.23 -1.26 -5.05 120.40 111.42 2fse s VAL 97 Ca 0.54 1.00 0.02 0.00 -1.81 0.00 0.00 61.98 61.74 2fse s VAL 97 Cb -0.50 -3.83 0.01 0.00 0.56 0.00 0.00 36.38 32.62 2fse s VAL 97 CO 0.63 0.36 -0.08 0.20 -0.31 0.00 0.00 175.10 175.90 2fse s ASN 98 N 0.36 1.12 0.20 4.85 0.01 -1.26 -5.07 114.94 115.15 2fse s ASN 98 Ca 0.27 -0.17 -0.32 0.00 -0.71 0.00 0.00 52.86 51.92 2fse s ASN 98 Cb -0.16 -0.38 -0.14 0.00 0.41 0.00 0.00 41.25 40.98 2fse s ASN 98 CO 0.12 0.03 1.34 0.18 -1.51 0.00 0.00 177.10 177.26 2fse n LEU 99 N 3.53 2.48 0.00 0.60 4.77 -1.26 -0.86 117.00 126.25 2fse n LEU 99 Ca -0.20 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.91 2fse n LEU 99 Cb 0.53 -1.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 2fse n LEU 99 CO 0.24 -0.77 0.00 0.61 -1.33 0.00 0.00 177.39 176.14 2fse n GLY 100 N 2.30 1.82 3.30 -0.72 0.00 -1.15 -4.97 105.19 105.76 2fse n GLY 100 Ca 0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.71 2fse n GLY 100 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fse s GLU 101 N -0.04 2.91 0.17 1.61 2.56 -0.04 -4.98 118.70 120.89 2fse s GLU 101 Ca 0.00 -1.69 -0.32 0.00 0.00 0.00 0.00 54.97 52.97 2fse s GLU 101 Cb 0.00 -4.23 -0.17 0.00 2.00 0.00 0.00 34.13 31.73 2fse s GLU 101 CO 0.00 -1.29 0.91 -2.30 -0.56 0.00 0.00 175.26 172.03 2fse n PRO 102 N 5.20 0.62 -2.64 4.30 -0.02 -1.26 -4.49 135.00 136.71 2fse n PRO 102 Ca -0.13 0.22 -0.06 0.00 -2.02 0.00 0.00 63.50 61.51 2fse n PRO 102 Cb 0.40 -1.53 -0.02 0.00 -0.02 0.00 0.00 33.50 32.33 2fse n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2fse n ASN 103 N 1.79 -0.33 -3.87 2.55 2.85 0.05 -5.01 115.26 113.29 2fse n ASN 103 Ca 0.16 -1.72 -0.17 0.00 -0.11 0.00 0.00 54.58 52.74 2fse n ASN 103 Cb 0.23 0.70 -0.16 0.00 1.24 0.00 0.00 39.78 41.79 2fse n ASN 103 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2fse s ILE 104 N -2.50 0.30 -0.11 -1.44 1.01 -1.26 -1.76 121.20 115.43 2fse s ILE 104 Ca 0.12 -0.04 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 2fse s ILE 104 Cb 0.00 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 42.09 2fse s ILE 104 CO 0.09 0.15 0.35 -0.76 0.00 0.00 0.00 174.94 174.77 2fse s LEU 105 N 0.65 4.31 -0.00 2.97 1.43 -0.17 0.09 118.68 127.96 2fse s LEU 105 Ca -0.07 0.68 0.03 0.00 -1.03 0.00 0.00 54.13 53.73 2fse s LEU 105 Cb -0.10 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 2fse s LEU 105 CO -0.01 0.14 -0.06 -0.63 0.23 0.00 0.00 176.35 176.02 2fse s ILE 106 N 0.10 3.70 -0.23 -0.59 1.01 0.52 -1.56 121.20 124.15 2fse s ILE 106 Ca 0.20 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 60.12 2fse s ILE 106 Cb -0.14 -2.61 0.06 0.00 0.01 0.00 0.00 42.46 39.78 2fse s ILE 106 CO 0.07 0.41 -0.04 0.00 0.00 0.00 0.00 174.94 175.38 2fse s PHE 108 N 1.43 3.18 -0.42 0.00 0.40 0.61 -2.51 117.98 120.67 2fse s PHE 108 Ca -0.05 0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 56.49 2fse s PHE 108 Cb -0.19 -3.01 0.06 0.00 0.51 0.00 0.00 43.02 40.40 2fse s PHE 108 CO -0.07 -0.55 0.28 0.42 0.70 0.00 0.00 175.22 176.00 2fse s ILE 109 N 2.54 4.59 0.06 0.64 1.01 0.00 -1.93 121.20 128.11 2fse s ILE 109 Ca 0.22 -1.14 0.06 0.00 0.00 0.00 0.00 60.65 59.78 2fse s ILE 109 Cb -0.15 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 2fse s ILE 109 CO 0.13 -0.44 -0.16 -0.62 0.00 0.00 0.00 174.94 173.86 2fse s ASP 110 N 2.05 1.89 -0.70 3.58 2.15 -0.26 -0.39 116.67 124.99 2fse s ASP 110 Ca 0.03 -0.53 -0.00 0.00 0.43 0.00 0.00 52.55 52.47 2fse s ASP 110 Cb -0.22 -0.11 0.00 0.00 -0.30 0.00 0.00 42.92 42.29 2fse s ASP 110 CO 0.05 0.03 0.59 0.29 -0.17 0.00 0.00 175.17 175.95 2fse n LYS 111 N 1.64 -3.90 -4.53 4.34 5.02 -0.98 -0.87 118.16 118.87 2fse n LYS 111 Ca -0.19 0.50 -0.26 0.00 -2.02 0.00 0.00 58.31 56.34 2fse n LYS 111 Cb 0.54 -4.47 -0.08 0.00 -0.02 0.00 0.00 35.03 30.99 2fse n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2fse s PHE 112 N -3.21 1.82 -0.27 2.13 -0.12 -1.09 -4.53 117.98 112.70 2fse s PHE 112 Ca 0.00 -1.20 -0.27 0.00 -0.05 0.00 0.00 56.93 55.41 2fse s PHE 112 Cb -0.00 -1.23 0.18 0.00 -0.63 0.00 0.00 43.02 41.34 2fse s PHE 112 CO 0.43 -0.20 1.32 0.45 -0.05 0.00 0.00 175.22 177.17 2fse s SER 113 N -3.62 -0.12 0.91 1.98 0.15 -1.09 0.11 113.70 112.02 2fse s SER 113 Ca 0.23 0.18 -0.12 0.00 0.70 0.00 0.00 55.95 56.94 2fse s SER 113 Cb 0.03 0.16 0.14 0.00 -1.71 0.00 0.00 66.02 64.64 2fse s SER 113 CO 0.13 -0.08 1.10 -2.16 1.20 0.00 0.00 173.24 173.44 2fse s PRO 114 N -0.54 1.15 -1.00 5.44 0.04 -1.26 -0.32 135.00 138.51 2fse s PRO 114 Ca 0.07 0.65 -0.12 0.00 0.04 0.00 0.00 61.00 61.64 2fse s PRO 114 Cb -0.03 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.63 2fse s PRO 114 CO -0.09 -2.27 2.16 -0.35 0.04 0.00 0.00 177.00 176.48 2fse n PRO 115 N -3.88 2.17 -3.72 0.56 -0.04 -1.26 -4.70 135.00 124.13 2fse n PRO 115 Ca 0.06 -1.76 -0.12 0.00 -0.04 0.00 0.00 63.50 61.64 2fse n PRO 115 Cb 0.56 -2.71 -0.13 0.00 -0.04 0.00 0.00 33.50 31.19 2fse n PRO 115 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2fse s VAL 116 N 3.72 -0.07 0.18 0.52 1.01 -1.26 -4.98 120.40 119.52 2fse s VAL 116 Ca 0.49 0.15 -0.23 0.00 0.00 0.00 0.00 61.98 62.38 2fse s VAL 116 Cb 0.13 -0.43 0.06 0.00 0.00 0.00 0.00 36.38 36.13 2fse s VAL 116 CO 0.00 0.06 0.66 0.54 0.00 0.00 0.00 175.10 176.37 2fse s VAL 117 N 1.38 0.00 -0.18 2.92 0.11 -1.26 -4.83 120.40 118.54 2fse s VAL 117 Ca -0.09 -0.27 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 2fse s VAL 117 Cb -0.10 -1.28 0.04 0.00 -1.53 0.00 0.00 36.38 33.51 2fse s VAL 117 CO -0.09 0.00 -0.11 0.20 -3.33 0.00 0.00 175.10 171.77 2fse s ASN 118 N -2.78 3.10 0.09 3.54 0.02 -1.01 -5.02 114.94 112.88 2fse s ASN 118 Ca 0.04 -0.73 0.09 0.00 -1.02 0.00 0.00 52.86 51.23 2fse s ASN 118 Cb -0.02 -1.17 -0.04 0.00 0.02 0.00 0.00 41.25 40.04 2fse s ASN 118 CO -0.07 -0.12 -0.19 -0.69 0.02 0.00 0.00 177.10 176.04 2fse s VAL 119 N 1.46 2.76 -0.15 1.60 1.01 -1.26 -1.01 120.40 124.81 2fse s VAL 119 Ca 0.01 -1.43 -0.13 0.00 0.00 0.00 0.00 61.98 60.43 2fse s VAL 119 Cb -0.15 -2.23 0.04 0.00 0.00 0.00 0.00 36.38 34.04 2fse s VAL 119 CO -0.09 0.18 0.40 -0.89 0.00 0.00 0.00 175.10 174.70 2fse s THR 120 N -1.06 -0.00 -0.09 3.92 2.01 -0.61 -5.00 115.64 114.81 2fse s THR 120 Ca 0.16 0.01 -0.07 0.00 0.31 0.00 0.00 61.69 62.11 2fse s THR 120 Cb -0.10 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 2fse s THR 120 CO 0.08 0.01 0.17 0.26 -0.69 0.00 0.00 174.62 174.45 2fse s TRP 121 N 0.36 3.60 -0.09 4.92 0.52 -1.26 -0.59 118.94 126.40 2fse s TRP 121 Ca -0.01 0.54 0.01 0.00 0.02 0.00 0.00 56.10 56.66 2fse s TRP 121 Cb -0.04 -1.95 0.02 0.00 -1.15 0.00 0.00 33.47 30.35 2fse s TRP 121 CO -0.01 0.71 -0.10 -0.51 0.02 0.00 0.00 176.95 177.06 2fse s LEU 122 N -1.21 1.44 -0.34 2.99 1.43 0.20 -0.07 118.68 123.12 2fse s LEU 122 Ca 0.18 -0.30 -0.03 0.00 -1.03 0.00 0.00 54.13 52.96 2fse s LEU 122 Cb -0.12 -0.82 0.06 0.00 0.03 0.00 0.00 46.19 45.34 2fse s LEU 122 CO 0.08 -0.04 0.08 -0.60 0.23 0.00 0.00 176.35 176.10 2fse s ARG 123 N 1.12 2.35 -1.28 1.70 3.52 0.15 -0.66 118.95 125.84 2fse s ARG 123 Ca -0.06 -1.40 -0.08 0.00 -0.13 0.00 0.00 55.73 54.05 2fse s ARG 123 Cb -0.14 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 29.91 2fse s ARG 123 CO -0.02 -0.76 1.12 0.09 -0.81 0.00 0.00 175.30 174.93 2fse n ASN 124 N 4.65 -6.05 0.00 -2.12 3.02 0.66 -2.55 115.26 112.87 2fse n ASN 124 Ca -0.10 -0.51 0.00 0.00 -0.03 0.00 0.00 54.58 53.94 2fse n ASN 124 Cb 0.43 -4.81 0.00 0.00 -0.61 0.00 0.00 39.78 34.79 2fse n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fse n GLY 125 N -1.91 2.75 3.80 7.41 0.00 -1.26 -5.03 105.19 110.94 2fse n GLY 125 Ca 0.00 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 2fse n GLY 125 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fse s ARG 126 N 0.00 4.31 0.29 1.61 0.52 -1.06 -4.97 118.95 119.66 2fse s ARG 126 Ca 0.00 0.86 -0.29 0.00 -0.52 0.00 0.00 55.73 55.77 2fse s ARG 126 Cb 0.00 -3.25 -0.11 0.00 0.52 0.00 0.00 34.95 32.11 2fse s ARG 126 CO 0.00 0.60 1.48 -2.14 0.02 0.00 0.00 175.30 175.26 2fse s PRO 127 N -1.04 4.21 -0.10 3.54 0.02 -1.26 0.30 135.00 140.66 2fse s PRO 127 Ca 0.31 2.42 -0.10 0.00 0.02 0.00 0.00 61.00 63.65 2fse s PRO 127 Cb -0.20 -3.05 -0.05 0.00 0.02 0.00 0.00 34.50 31.22 2fse s PRO 127 CO 0.21 -0.48 0.23 0.08 -0.33 0.00 0.00 177.00 176.71 2fse s VAL 128 N -0.33 5.35 -0.00 3.83 1.01 0.90 -4.81 120.40 126.34 2fse s VAL 128 Ca 0.58 0.41 0.01 0.00 0.00 0.00 0.00 61.98 62.98 2fse s VAL 128 Cb -0.44 -3.52 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2fse s VAL 128 CO 0.49 0.56 0.01 0.41 0.00 0.00 0.00 175.10 176.58 2fse n THR 129 N 2.27 0.03 -4.08 3.92 -1.04 -1.26 -4.56 114.28 109.56 2fse n THR 129 Ca -0.17 -0.03 -0.29 0.00 -2.04 0.00 0.00 64.05 61.52 2fse n THR 129 Cb 0.54 -0.18 -0.07 0.00 -1.82 0.00 0.00 70.33 68.81 2fse n THR 129 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2fse s GLU 130 N -2.05 2.80 -0.69 -2.82 8.01 -1.26 -4.60 118.70 118.10 2fse s GLU 130 Ca -0.00 -0.79 -0.00 0.00 0.01 0.00 0.00 54.97 54.19 2fse s GLU 130 Cb 0.00 -2.65 0.00 0.00 -4.31 0.00 0.00 34.13 27.17 2fse s GLU 130 CO 0.04 0.53 0.57 0.41 0.01 0.00 0.00 175.26 176.82 2fse n GLY 131 N 0.22 -0.01 3.10 -1.39 0.00 -1.26 -4.83 105.19 101.02 2fse n GLY 131 Ca -0.09 -0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 2fse n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fse s VAL 132 N -3.20 0.04 0.17 1.61 -7.23 -1.26 -1.56 120.40 108.97 2fse s VAL 132 Ca 0.02 -0.34 0.01 0.00 -1.81 0.00 0.00 61.98 59.86 2fse s VAL 132 Cb -0.01 -0.37 -0.00 0.00 0.56 0.00 0.00 36.38 36.55 2fse s VAL 132 CO 0.41 -0.19 0.19 -1.54 -0.31 0.00 0.00 175.10 173.67 2fse n SER 133 N 2.17 -0.52 -1.53 4.85 3.41 -0.54 -5.00 113.62 116.46 2fse n SER 133 Ca -0.18 -1.98 -0.01 0.00 -0.26 0.00 0.00 58.87 56.45 2fse n SER 133 Cb 0.57 1.04 0.00 0.00 -0.26 0.00 0.00 64.21 65.57 2fse n SER 133 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2fse n GLU 134 N -0.29 0.15 -4.11 4.33 0.28 -1.26 -1.80 120.64 117.94 2fse n GLU 134 Ca 0.02 -0.34 -0.14 0.00 -0.16 0.00 0.00 57.16 56.54 2fse n GLU 134 Cb 0.29 0.46 -0.12 0.00 1.43 0.00 0.00 31.44 33.49 2fse n GLU 134 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2fse s THR 135 N -2.45 0.64 1.15 3.84 -4.23 -0.98 -4.98 115.64 108.63 2fse s THR 135 Ca 0.05 -1.02 -0.19 0.00 -1.18 0.00 0.00 61.69 59.35 2fse s THR 135 Cb -0.01 -0.67 0.30 0.00 1.34 0.00 0.00 72.50 73.46 2fse s THR 135 CO 0.01 -0.28 0.72 1.33 -0.54 0.00 0.00 174.62 175.86 2fse n VAL 136 N 1.62 0.00 -2.41 2.29 0.24 -1.26 -4.54 118.33 114.27 2fse n VAL 136 Ca -0.21 -0.05 -0.43 0.00 -2.04 0.00 0.00 64.34 61.60 2fse n VAL 136 Cb 0.55 -0.84 -0.02 0.00 -1.47 0.00 0.00 33.84 32.05 2fse n VAL 136 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2fse s PHE 137 N -1.98 2.59 0.15 6.34 0.08 -1.26 -4.70 117.98 119.21 2fse s PHE 137 Ca 0.54 0.79 -0.20 0.00 0.12 0.00 0.00 56.93 58.18 2fse s PHE 137 Cb -0.09 -4.07 -0.08 0.00 -0.57 0.00 0.00 43.02 38.21 2fse s PHE 137 CO 0.45 -1.78 0.67 -0.51 -0.10 0.00 0.00 175.22 173.95 2fse s LEU 138 N 4.74 4.47 0.80 -0.37 1.43 0.30 -4.85 118.68 125.20 2fse s LEU 138 Ca 0.57 1.39 -0.12 0.00 -1.03 0.00 0.00 54.13 54.95 2fse s LEU 138 Cb -0.15 -3.26 0.07 0.00 0.03 0.00 0.00 46.19 42.88 2fse s LEU 138 CO 0.27 0.16 1.10 -2.16 0.23 0.00 0.00 176.35 175.95 2fse s PRO 139 N -1.49 2.02 -0.01 1.29 0.04 -1.26 0.14 135.00 135.73 2fse s PRO 139 Ca 0.36 0.57 -0.04 0.00 0.04 0.00 0.00 61.00 61.93 2fse s PRO 139 Cb -0.19 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2fse s PRO 139 CO 0.22 -1.65 0.09 0.50 0.04 0.00 0.00 177.00 176.20 2fse s ARG 140 N -5.20 0.31 0.58 4.56 3.52 -1.00 -4.55 118.95 117.16 2fse s ARG 140 Ca 0.61 -0.23 0.31 0.00 -0.13 0.00 0.00 55.73 56.29 2fse s ARG 140 Cb -0.14 0.13 1.42 0.00 -1.56 0.00 0.00 34.95 34.79 2fse s ARG 140 CO 0.54 -0.06 1.78 -0.44 -0.81 0.00 0.00 175.30 176.30 2fse h ASP 141 N 5.01 0.00 -0.15 -2.12 3.32 -1.98 0.27 116.42 120.76 2fse h ASP 141 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 2fse h ASP 141 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2fse h ASP 141 CO 0.42 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.04 2fse n ASP 142 N -3.80 1.23 -0.03 6.45 5.68 -1.26 -4.91 116.55 119.91 2fse n ASP 142 Ca 0.16 -1.72 -0.00 0.00 -0.50 0.00 0.00 54.79 52.72 2fse n ASP 142 Cb 0.98 -0.10 -0.00 0.00 -1.14 0.00 0.00 41.12 40.86 2fse n ASP 142 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2fse n HIS 143 N 0.06 0.00 -2.92 2.11 8.25 0.93 -5.04 115.22 118.62 2fse n HIS 143 Ca 0.14 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.54 2fse n HIS 143 Cb 0.24 -0.30 0.02 0.00 1.12 0.00 0.00 29.99 31.08 2fse n HIS 143 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2fse n LEU 144 N -0.04 0.00 -4.41 2.41 4.77 -1.25 -4.89 117.00 113.59 2fse n LEU 144 Ca -0.00 -0.64 -0.25 0.00 -0.03 0.00 0.00 56.01 55.08 2fse n LEU 144 Cb 0.04 -0.12 -0.11 0.00 -2.33 0.00 0.00 43.42 40.90 2fse n LEU 144 CO 0.01 -0.57 -0.51 -0.36 -1.33 0.00 0.00 177.39 174.63 2fse s PHE 145 N -0.04 2.16 -0.01 -1.77 0.40 0.12 -2.39 117.98 116.46 2fse s PHE 145 Ca 0.16 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.17 2fse s PHE 145 Cb -0.01 -1.05 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 2fse s PHE 145 CO 0.10 0.49 -0.21 0.50 0.70 0.00 0.00 175.22 176.81 2fse s ARG 146 N -2.87 1.63 0.00 0.44 3.52 0.38 -2.32 118.95 119.74 2fse s ARG 146 Ca 0.21 -0.76 0.00 0.00 -0.13 0.00 0.00 55.73 55.05 2fse s ARG 146 Cb -0.07 -1.60 -0.00 0.00 -1.56 0.00 0.00 34.95 31.72 2fse s ARG 146 CO 0.10 0.44 -0.00 0.21 -0.81 0.00 0.00 175.30 175.23 2fse s LYS 147 N -0.58 0.03 0.11 5.12 2.47 0.47 0.11 119.74 127.48 2fse s LYS 147 Ca 0.08 -0.04 0.09 0.00 -1.56 0.00 0.00 55.97 54.54 2fse s LYS 147 Cb -0.08 -0.01 -0.04 0.00 -1.46 0.00 0.00 37.83 36.24 2fse s LYS 147 CO -0.00 0.00 -0.24 -0.06 0.16 0.00 0.00 175.35 175.21 2fse s PHE 148 N -0.08 2.05 0.03 4.03 0.40 -1.26 -0.82 117.98 122.33 2fse s PHE 148 Ca -0.01 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 2fse s PHE 148 Cb -0.01 -1.13 -0.02 0.00 0.51 0.00 0.00 43.02 42.38 2fse s PHE 148 CO -0.00 0.25 -0.06 -1.01 0.70 0.00 0.00 175.22 175.10 2fse s HIS 149 N -1.07 0.49 -0.03 0.36 3.76 -1.04 -2.33 115.29 115.42 2fse s HIS 149 Ca 0.10 -0.45 0.01 0.00 -0.15 0.00 0.00 55.06 54.57 2fse s HIS 149 Cb -0.10 -0.31 0.01 0.00 1.11 0.00 0.00 32.58 33.30 2fse s HIS 149 CO 0.05 -0.11 -0.05 0.71 -0.85 0.00 0.00 174.74 174.49 2fse s TYR 150 N -1.24 0.66 0.03 1.40 1.51 -0.75 -2.17 117.35 116.79 2fse s TYR 150 Ca -0.11 -0.16 0.09 0.00 -1.01 0.00 0.00 57.07 55.88 2fse s TYR 150 Cb -0.09 -0.55 -0.03 0.00 -0.11 0.00 0.00 41.96 41.18 2fse s TYR 150 CO -0.00 -0.12 -0.25 -1.17 -1.11 0.00 0.00 175.55 172.89 2fse s LEU 151 N 0.57 2.21 -0.16 -1.29 2.96 -0.60 -1.47 118.68 120.89 2fse s LEU 151 Ca -0.07 -0.54 -0.02 0.00 -0.22 0.00 0.00 54.13 53.27 2fse s LEU 151 Cb -0.11 -1.33 -0.02 0.00 0.50 0.00 0.00 46.19 45.23 2fse s LEU 151 CO -0.00 0.27 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.34 2fse s THR 152 N -0.78 3.49 0.28 3.68 2.01 -0.60 -1.00 115.64 122.72 2fse s THR 152 Ca 0.12 -0.49 0.02 0.00 0.31 0.00 0.00 61.69 61.64 2fse s THR 152 Cb -0.10 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.86 2fse s THR 152 CO 0.02 0.49 0.26 0.72 -0.69 0.00 0.00 174.62 175.41 2fse s PHE 153 N 0.60 1.38 -0.51 4.92 -0.71 -0.72 -4.95 117.98 118.00 2fse s PHE 153 Ca -0.04 -1.47 0.03 0.00 -1.04 0.00 0.00 56.93 54.41 2fse s PHE 153 Cb -0.15 -0.54 0.14 0.00 -1.21 0.00 0.00 43.02 41.27 2fse s PHE 153 CO 0.03 -0.82 0.30 -1.17 -1.34 0.00 0.00 175.22 172.21 2fse s LEU 154 N -3.26 3.43 0.01 -1.99 2.96 -1.26 -0.77 118.68 117.80 2fse s LEU 154 Ca 0.38 -3.00 -0.12 0.00 -0.22 0.00 0.00 54.13 51.17 2fse s LEU 154 Cb 0.04 -1.27 -0.06 0.00 0.50 0.00 0.00 46.19 45.40 2fse s LEU 154 CO 0.20 -0.22 0.32 -2.65 -1.32 0.00 0.00 176.35 172.69 2fse n PRO 155 N 3.07 0.00 -3.78 0.98 -0.02 -1.26 -4.65 135.00 129.34 2fse n PRO 155 Ca 0.11 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.48 2fse n PRO 155 Cb 0.35 -0.46 -0.08 0.00 -0.02 0.00 0.00 33.50 33.29 2fse n PRO 155 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2fse s SER 156 N -0.04 -0.10 0.13 2.55 0.15 -1.26 -2.96 113.70 112.18 2fse s SER 156 Ca 0.28 -0.17 -0.09 0.00 0.70 0.00 0.00 55.95 56.67 2fse s SER 156 Cb -0.40 0.33 -0.06 0.00 -1.71 0.00 0.00 66.02 64.18 2fse s SER 156 CO 0.18 -0.56 1.37 0.71 1.20 0.00 0.00 173.24 176.15 2fse h THR 157 N 3.43 1.30 -0.04 6.45 1.35 -1.99 -3.31 112.91 120.10 2fse h THR 157 Ca -0.31 -1.95 -0.18 0.00 -0.55 0.00 0.00 66.41 63.41 2fse h THR 157 Cb 1.19 1.92 0.01 0.00 -1.73 0.00 0.00 68.15 69.55 2fse h THR 157 CO 0.45 0.61 -0.69 0.44 -0.25 0.00 0.00 175.52 176.08 2fse h ASP 158 N 0.49 0.69 -4.04 5.36 3.32 -2.01 -3.46 116.42 116.77 2fse h ASP 158 Ca -0.03 -0.71 -0.56 0.00 0.02 0.00 0.00 57.03 55.75 2fse h ASP 158 Cb 1.31 -0.21 0.17 0.00 0.22 0.00 0.00 39.33 40.82 2fse h ASP 158 CO 0.14 1.30 0.41 0.47 -1.72 0.00 0.00 179.24 179.84 2fse n ASP 159 N -4.11 1.64 -3.64 6.45 8.00 -1.25 -5.01 116.55 118.62 2fse n ASP 159 Ca -0.10 0.77 -0.14 0.00 0.71 0.00 0.00 54.79 56.04 2fse n ASP 159 Cb 0.71 -1.52 -0.06 0.00 -0.02 0.00 0.00 41.12 40.22 2fse n ASP 159 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2fse s PHE 160 N -1.55 -0.33 0.29 1.24 -0.12 -1.26 -4.72 117.98 111.52 2fse s PHE 160 Ca 0.80 0.39 0.02 0.00 -0.05 0.00 0.00 56.93 58.10 2fse s PHE 160 Cb -0.37 0.25 -0.06 0.00 -0.63 0.00 0.00 43.02 42.22 2fse s PHE 160 CO 0.43 -0.56 0.08 0.71 -0.05 0.00 0.00 175.22 175.83 2fse s TYR 161 N -2.14 1.75 -0.18 3.49 1.51 -0.56 -0.24 117.35 120.97 2fse s TYR 161 Ca -0.07 -1.08 -0.16 0.00 -1.01 0.00 0.00 57.07 54.76 2fse s TYR 161 Cb -0.01 -1.08 0.05 0.00 -0.11 0.00 0.00 41.96 40.80 2fse s TYR 161 CO 0.00 -0.17 0.48 -0.51 -1.11 0.00 0.00 175.55 174.24 2fse s ASP 162 N -3.40 -0.52 -0.38 2.29 1.01 0.16 -2.22 116.67 113.61 2fse s ASP 162 Ca 0.37 0.98 -0.05 0.00 0.71 0.00 0.00 52.55 54.56 2fse s ASP 162 Cb 0.08 0.97 0.08 0.00 1.01 0.00 0.00 42.92 45.06 2fse s ASP 162 CO 0.15 -0.17 0.17 0.00 0.21 0.00 0.00 175.17 175.52 2fse s GLU 164 N 1.30 4.21 -0.07 0.00 2.12 0.24 -2.84 118.70 123.65 2fse s GLU 164 Ca 0.02 0.72 0.05 0.00 0.36 0.00 0.00 54.97 56.12 2fse s GLU 164 Cb -0.22 -3.59 -0.00 0.00 0.26 0.00 0.00 34.13 30.57 2fse s GLU 164 CO -0.00 -0.31 -0.21 0.08 -0.54 0.00 0.00 175.26 174.28 2fse s VAL 165 N 2.15 1.75 0.14 3.70 1.01 0.15 -1.57 120.40 127.72 2fse s VAL 165 Ca 0.31 -0.87 0.10 0.00 0.00 0.00 0.00 61.98 61.52 2fse s VAL 165 Cb -0.16 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2fse s VAL 165 CO 0.10 0.49 -0.22 -0.62 0.00 0.00 0.00 175.10 174.85 2fse s ASP 166 N 0.13 3.59 -0.29 3.32 -1.08 -0.18 0.22 116.67 122.39 2fse s ASP 166 Ca -0.09 -0.69 -0.20 0.00 -0.52 0.00 0.00 52.55 51.05 2fse s ASP 166 Cb -0.14 -0.37 0.16 0.00 -1.46 0.00 0.00 42.92 41.10 2fse s ASP 166 CO 0.05 0.17 1.11 -2.28 0.52 0.00 0.00 175.17 174.73 2fse s HIS 167 N -1.21 -0.39 0.53 -5.34 5.65 -1.26 -2.42 115.29 110.85 2fse s HIS 167 Ca 0.17 0.83 0.43 0.00 0.25 0.00 0.00 55.06 56.75 2fse s HIS 167 Cb -0.10 0.32 1.64 0.00 -1.18 0.00 0.00 32.58 33.26 2fse s HIS 167 CO 0.08 -0.19 1.62 -1.49 -0.65 0.00 0.00 174.74 174.12 2fse h TRP 168 N 4.93 0.13 0.00 3.88 6.55 -1.95 -0.15 115.95 129.35 2fse h TRP 168 Ca -0.28 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.57 2fse h TRP 168 Cb 1.18 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 29.45 2fse h TRP 168 CO 0.20 -0.05 0.00 0.41 -1.05 0.00 0.00 178.44 177.94 2fse n GLY 169 N -1.80 -0.04 3.29 1.49 0.00 -1.26 -4.76 105.19 102.10 2fse n GLY 169 Ca 0.40 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.25 2fse n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fse s LEU 170 N -0.62 2.51 -0.13 0.99 1.43 -0.07 -4.28 118.68 118.51 2fse s LEU 170 Ca 0.00 -0.97 -0.15 0.00 -1.03 0.00 0.00 54.13 51.99 2fse s LEU 170 Cb 0.00 -0.53 -0.13 0.00 0.03 0.00 0.00 46.19 45.56 2fse s LEU 170 CO 0.00 -0.22 0.36 -0.33 0.23 0.00 0.00 176.35 176.39 2fse h GLU 171 N 2.88 0.00 -6.36 1.70 5.08 -1.86 -3.47 114.58 112.55 2fse h GLU 171 Ca -0.38 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.36 2fse h GLU 171 Cb 1.20 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.20 2fse h GLU 171 CO 0.60 0.51 -0.85 -1.21 -1.00 0.00 0.00 179.01 177.05 2fse s GLU 172 N -1.93 1.48 0.51 2.33 0.41 -1.26 -5.11 118.70 115.14 2fse s GLU 172 Ca -0.11 -1.05 -0.17 0.00 -0.41 0.00 0.00 54.97 53.24 2fse s GLU 172 Cb -0.01 -1.67 -0.14 0.00 -1.78 0.00 0.00 34.13 30.53 2fse s GLU 172 CO 0.36 0.42 -0.17 -2.30 -0.49 0.00 0.00 175.26 173.08 2fse n PRO 173 N 1.67 0.00 -3.51 0.39 -0.02 -1.26 -4.92 135.00 127.35 2fse n PRO 173 Ca -0.17 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 60.93 2fse n PRO 173 Cb 0.53 -0.94 -0.06 0.00 -0.02 0.00 0.00 33.50 33.01 2fse n PRO 173 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2fse s LEU 174 N 4.93 4.36 -0.37 2.45 2.96 0.61 -4.91 118.68 128.71 2fse s LEU 174 Ca 0.52 0.76 0.01 0.00 -0.22 0.00 0.00 54.13 55.20 2fse s LEU 174 Cb -0.44 -2.50 0.11 0.00 0.50 0.00 0.00 46.19 43.86 2fse s LEU 174 CO 0.63 0.21 0.15 -0.60 -1.32 0.00 0.00 176.35 175.42 2fse s ARG 175 N -0.31 1.12 0.00 1.98 3.52 -1.26 0.35 118.95 124.34 2fse s ARG 175 Ca 0.21 -1.62 -0.18 0.00 -0.13 0.00 0.00 55.73 54.01 2fse s ARG 175 Cb -0.15 -2.40 -0.06 0.00 -1.56 0.00 0.00 34.95 30.79 2fse s ARG 175 CO 0.09 -1.05 0.51 0.15 -0.81 0.00 0.00 175.30 174.19 2fse s LYS 176 N 0.95 4.16 0.33 5.12 -0.14 -1.13 -4.95 119.74 124.08 2fse s LYS 176 Ca 0.13 0.59 0.07 0.00 -1.36 0.00 0.00 55.97 55.40 2fse s LYS 176 Cb -0.21 -3.29 -0.02 0.00 -1.68 0.00 0.00 37.83 32.64 2fse s LYS 176 CO -0.12 0.52 0.39 -1.58 -0.76 0.00 0.00 175.35 173.81 2fse s HIS 177 N -0.63 3.06 -0.28 3.18 2.46 -1.26 -1.73 115.29 120.09 2fse s HIS 177 Ca 0.27 -0.23 -0.22 0.00 0.47 0.00 0.00 55.06 55.35 2fse s HIS 177 Cb -0.18 -1.88 0.12 0.00 -0.13 0.00 0.00 32.58 30.51 2fse s HIS 177 CO 0.15 0.10 0.94 -0.46 -2.47 0.00 0.00 174.74 173.01 2fse s TRP 178 N -2.21 -0.60 -0.12 3.88 -0.00 -0.94 -4.86 118.94 114.10 2fse s TRP 178 Ca 0.43 1.35 -0.29 0.00 -0.00 0.00 0.00 56.10 57.58 2fse s TRP 178 Cb -0.08 0.37 0.08 0.00 -0.00 0.00 0.00 33.47 33.84 2fse s TRP 178 CO 0.29 -0.29 0.74 -1.83 -0.00 0.00 0.00 176.95 175.86 2fse s GLU 179 N 0.65 0.94 -0.55 5.86 -1.05 -1.26 -1.50 118.70 121.79 2fse s GLU 179 Ca -0.01 0.41 -0.15 0.00 -0.15 0.00 0.00 54.97 55.06 2fse s GLU 179 Cb -0.05 0.45 -0.13 0.00 -0.44 0.00 0.00 34.13 33.96 2fse s GLU 179 CO -0.09 -0.26 1.43 0.34 0.95 0.00 0.00 175.26 177.64 2fse n PHE 180 N 1.30 0.26 -0.96 4.83 7.35 -1.26 -5.09 117.46 123.88 2fse n PHE 180 Ca -0.17 0.17 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 2fse n PHE 180 Cb 0.57 -1.13 0.00 0.00 0.35 0.00 0.00 39.48 39.26 2fse n PHE 180 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39