#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fsa n THR 7 N 0.00 0.38 -2.06 5.18 -2.24 -1.26 -4.79 114.28 109.49 2fsa n THR 7 Ca 0.00 -0.69 -0.41 0.00 -2.27 0.00 0.00 64.05 60.68 2fsa n THR 7 Cb 0.00 1.01 -0.02 0.00 -2.10 0.00 0.00 70.33 69.22 2fsa n THR 7 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2fsa s LYS 8 N -1.18 4.31 -0.37 -0.78 2.20 -1.26 -4.93 119.74 117.73 2fsa s LYS 8 Ca 0.23 2.27 -0.18 0.00 -0.36 0.00 0.00 55.97 57.94 2fsa s LYS 8 Cb 0.14 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.40 2fsa s LYS 8 CO 0.20 -0.28 0.52 -0.51 -0.36 0.00 0.00 175.35 174.92 2fsa s LEU 9 N -1.50 4.43 0.58 5.43 1.43 -1.26 -4.26 118.68 123.53 2fsa s LEU 9 Ca 0.52 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2fsa s LEU 9 Cb -0.41 -2.58 0.05 0.00 0.03 0.00 0.00 46.19 43.29 2fsa s LEU 9 CO 0.52 -0.53 0.80 -0.31 0.23 0.00 0.00 176.35 177.06 2fsa s TYR 10 N 2.42 2.51 0.29 0.29 2.02 0.44 -4.62 117.35 120.70 2fsa s TYR 10 Ca 0.18 -0.14 0.00 0.00 -0.37 0.00 0.00 57.07 56.75 2fsa s TYR 10 Cb -0.15 -2.74 0.00 0.00 -0.40 0.00 0.00 41.96 38.67 2fsa s TYR 10 CO 0.14 -1.02 0.00 0.00 -1.57 0.00 0.00 175.55 173.10 2fsa h ILE 12 N -1.16 0.97 0.00 0.00 3.07 -1.96 -2.98 117.51 115.46 2fsa h ILE 12 Ca 0.03 -1.98 0.00 0.00 1.55 0.00 0.00 64.86 64.45 2fsa h ILE 12 Cb 1.14 2.21 0.00 0.00 -0.27 0.00 0.00 36.82 39.90 2fsa h ILE 12 CO 0.01 0.48 0.00 0.00 -1.05 0.00 0.00 178.15 177.59 2fsa n LYS 14 N -1.38 -1.39 -4.26 0.00 4.76 -0.87 -5.03 118.16 109.98 2fsa n LYS 14 Ca 0.09 0.91 -0.16 0.00 -2.87 0.00 0.00 58.31 56.28 2fsa n LYS 14 Cb 0.23 -4.28 -0.10 0.00 -1.84 0.00 0.00 35.03 29.03 2fsa n LYS 14 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2fsa s THR 15 N -3.18 1.32 0.74 -0.18 -4.23 -0.84 -4.77 115.64 104.50 2fsa s THR 15 Ca 0.19 -1.95 -0.13 0.00 -1.18 0.00 0.00 61.69 58.62 2fsa s THR 15 Cb -0.06 -1.75 0.04 0.00 1.34 0.00 0.00 72.50 72.07 2fsa s THR 15 CO 0.83 -0.59 1.14 -2.84 -0.54 0.00 0.00 174.62 172.61 2fsa s PRO 16 N -3.30 2.26 0.22 3.99 0.02 -1.26 -0.42 135.00 136.51 2fsa s PRO 16 Ca 0.14 1.46 -0.32 0.00 0.02 0.00 0.00 61.00 62.30 2fsa s PRO 16 Cb -0.01 -1.88 -0.12 0.00 0.02 0.00 0.00 34.50 32.51 2fsa s PRO 16 CO 0.03 -1.68 1.68 0.98 -0.33 0.00 0.00 177.00 177.68 2fsa n TYR 17 N -2.99 2.70 -3.94 6.54 9.36 -1.26 -4.85 117.16 122.72 2fsa n TYR 17 Ca 0.11 0.10 -0.33 0.00 3.32 0.00 0.00 57.90 61.10 2fsa n TYR 17 Cb 0.52 -2.65 -0.14 0.00 -0.63 0.00 0.00 39.34 36.44 2fsa n TYR 17 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2fsa s ASP 18 N 1.03 4.86 0.65 2.98 -1.08 -1.26 -4.99 116.67 118.86 2fsa s ASP 18 Ca 0.74 -1.81 0.32 0.00 -0.52 0.00 0.00 52.55 51.28 2fsa s ASP 18 Cb -0.53 -1.68 1.74 0.00 -1.46 0.00 0.00 42.92 40.99 2fsa s ASP 18 CO 0.35 -0.36 2.00 -0.33 0.52 0.00 0.00 175.17 177.36 2fsa h GLU 19 N 7.83 0.00 0.00 4.34 5.08 -2.04 -0.58 114.58 129.21 2fsa h GLU 19 Ca -0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2fsa h GLU 19 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2fsa h GLU 19 CO 0.56 0.00 -0.19 -1.13 -1.00 0.00 0.00 179.01 177.24 2fsa n SER 20 N -3.12 0.24 -4.85 1.42 3.41 -1.26 -4.89 113.62 104.58 2fsa n SER 20 Ca -0.01 0.23 -0.29 0.00 -0.26 0.00 0.00 58.87 58.55 2fsa n SER 20 Cb 0.36 -0.23 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 2fsa n SER 20 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2fsa s LYS 21 N -3.01 3.14 -0.06 4.33 1.02 -0.23 -5.09 119.74 119.83 2fsa s LYS 21 Ca 0.13 -0.63 -0.27 0.00 0.02 0.00 0.00 55.97 55.22 2fsa s LYS 21 Cb 0.18 -2.85 -0.03 0.00 -0.52 0.00 0.00 37.83 34.62 2fsa s LYS 21 CO 0.60 0.56 0.85 0.12 -0.92 0.00 0.00 175.35 176.56 2fsa s PHE 22 N -1.53 3.57 0.10 3.18 5.36 -1.26 -4.93 117.98 122.47 2fsa s PHE 22 Ca 0.32 1.45 0.08 0.00 -0.96 0.00 0.00 56.93 57.82 2fsa s PHE 22 Cb -0.12 -2.99 -0.03 0.00 -0.34 0.00 0.00 43.02 39.53 2fsa s PHE 22 CO 0.25 -0.04 -0.21 0.71 -1.46 0.00 0.00 175.22 174.47 2fsa s TYR 23 N 1.23 1.80 -0.02 10.12 1.51 -1.26 -1.32 117.35 129.40 2fsa s TYR 23 Ca 0.44 -0.41 0.06 0.00 -1.01 0.00 0.00 57.07 56.15 2fsa s TYR 23 Cb -0.19 -0.99 -0.01 0.00 -0.11 0.00 0.00 41.96 40.65 2fsa s TYR 23 CO 0.21 0.19 -0.20 -1.50 -1.11 0.00 0.00 175.55 173.14 2fsa s ILE 24 N -1.12 1.63 -0.04 2.71 2.07 0.51 -4.88 121.20 122.08 2fsa s ILE 24 Ca 0.07 -0.87 -0.14 0.00 -1.41 0.00 0.00 60.65 58.30 2fsa s ILE 24 Cb -0.10 -1.36 -0.05 0.00 0.13 0.00 0.00 42.46 41.08 2fsa s ILE 24 CO 0.04 0.46 0.36 -0.83 -1.91 0.00 0.00 174.94 173.06 2fsa s GLY 25 N -0.37 2.39 -0.19 1.50 0.00 -1.26 -1.22 107.32 108.18 2fsa s GLY 25 Ca 0.05 -0.31 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 2fsa s GLY 25 CO 0.00 0.13 0.60 0.00 0.00 0.00 0.00 173.10 173.82 2fsa n ASP 27 N 4.83 0.74 -0.07 0.00 8.00 -0.27 -0.22 116.55 129.56 2fsa n ASP 27 Ca -0.03 0.64 -0.09 0.00 0.71 0.00 0.00 54.79 56.02 2fsa n ASP 27 Cb 0.50 -0.81 -0.07 0.00 -0.02 0.00 0.00 41.12 40.72 2fsa n ASP 27 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2fsa h ARG 28 N 0.00 0.00 0.00 -1.24 9.65 -1.93 -3.40 114.38 117.47 2fsa h ARG 28 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2fsa h ARG 28 Cb 0.49 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.07 2fsa h ARG 28 CO 0.00 0.51 -1.20 0.00 2.80 0.00 0.00 179.97 182.08 2fsa n GLN 30 N -1.81 -0.94 -2.49 0.00 1.13 0.69 -5.01 117.38 108.95 2fsa n GLN 30 Ca 0.02 0.95 -0.23 0.00 -1.94 0.00 0.00 57.00 55.80 2fsa n GLN 30 Cb 0.42 -5.03 0.06 0.00 0.11 0.00 0.00 30.24 25.80 2fsa n GLN 30 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2fsa s ASN 31 N -2.82 4.90 -0.02 1.08 3.84 -1.25 -4.83 114.94 115.83 2fsa s ASN 31 Ca 0.00 0.05 0.08 0.00 0.21 0.00 0.00 52.86 53.20 2fsa s ASN 31 Cb 0.00 -0.75 -0.02 0.00 -0.55 0.00 0.00 41.25 39.94 2fsa s ASN 31 CO 0.00 -1.46 -0.26 0.26 -2.79 0.00 0.00 177.10 172.86 2fsa s TRP 32 N -3.00 2.30 0.01 0.43 0.52 -1.26 -1.87 118.94 116.07 2fsa s TRP 32 Ca 0.60 -0.44 0.06 0.00 0.02 0.00 0.00 56.10 56.34 2fsa s TRP 32 Cb -0.09 -1.48 -0.02 0.00 -1.15 0.00 0.00 33.47 30.73 2fsa s TRP 32 CO 0.42 -0.04 -0.17 0.71 0.02 0.00 0.00 176.95 177.88 2fsa s TYR 33 N -0.59 1.55 0.22 -1.98 1.51 -0.36 -0.28 117.35 117.41 2fsa s TYR 33 Ca 0.10 -0.32 -0.31 0.00 -1.01 0.00 0.00 57.07 55.53 2fsa s TYR 33 Cb -0.10 -0.96 -0.10 0.00 -0.11 0.00 0.00 41.96 40.68 2fsa s TYR 33 CO -0.01 0.01 1.51 -1.01 -1.11 0.00 0.00 175.55 174.94 2fsa s HIS 34 N -0.56 3.02 0.24 2.71 3.76 -1.26 -0.36 115.29 122.83 2fsa s HIS 34 Ca 0.06 0.84 -0.04 0.00 -0.15 0.00 0.00 55.06 55.76 2fsa s HIS 34 Cb -0.07 -3.88 0.44 0.00 1.11 0.00 0.00 32.58 30.18 2fsa s HIS 34 CO 0.00 -3.06 1.73 0.78 -0.85 0.00 0.00 174.74 173.35 2fsa h GLY 35 N 5.77 1.13 1.38 -2.22 0.00 -1.42 -1.45 103.07 106.27 2fsa h GLY 35 Ca -0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 2fsa h GLY 35 CO 0.84 -0.08 0.25 -0.09 0.00 0.00 0.00 176.54 177.46 2fsa h ARG 36 N 0.46 0.80 0.00 4.80 2.43 -1.84 0.16 114.38 121.19 2fsa h ARG 36 Ca 0.41 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.43 2fsa h ARG 36 Cb 0.60 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 2fsa h ARG 36 CO -0.39 0.63 -0.17 0.00 -1.51 0.00 0.00 179.97 178.54 2fsa n VAL 38 N -3.41 1.21 -1.87 0.00 0.24 -0.98 -5.00 118.33 108.53 2fsa n VAL 38 Ca -0.00 -1.19 -0.09 0.00 -2.04 0.00 0.00 64.34 61.01 2fsa n VAL 38 Cb 0.36 0.36 -0.02 0.00 -1.47 0.00 0.00 33.84 33.08 2fsa n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fsa n GLY 39 N -0.06 0.36 3.43 7.63 0.00 -0.44 -4.93 105.19 111.17 2fsa n GLY 39 Ca 0.09 -0.54 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 2fsa n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fsa s ILE 40 N -2.42 3.55 0.11 -0.61 -1.09 0.44 -5.00 121.20 116.18 2fsa s ILE 40 Ca 0.00 -0.48 -0.14 0.00 -2.23 0.00 0.00 60.65 57.80 2fsa s ILE 40 Cb 0.00 -2.54 -0.07 0.00 -1.58 0.00 0.00 42.46 38.27 2fsa s ILE 40 CO 0.00 0.49 0.52 -0.76 -1.23 0.00 0.00 174.94 173.96 2fsa s LEU 41 N 0.50 4.38 0.26 2.97 1.43 -1.26 -3.98 118.68 122.97 2fsa s LEU 41 Ca -0.05 1.05 -0.02 0.00 -1.03 0.00 0.00 54.13 54.08 2fsa s LEU 41 Cb -0.15 -3.09 0.46 0.00 0.03 0.00 0.00 46.19 43.44 2fsa s LEU 41 CO 0.03 0.16 1.81 -0.61 0.23 0.00 0.00 176.35 177.98 2fsa h GLN 42 N 3.86 0.80 -0.35 1.70 4.15 -1.98 0.97 115.11 124.26 2fsa h GLN 42 Ca -0.49 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 58.81 2fsa h GLN 42 Cb 1.20 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.69 2fsa h GLN 42 CO 0.65 0.53 -0.08 0.66 -1.93 0.00 0.00 178.83 178.66 2fsa h SER 43 N 0.83 0.57 -0.55 -0.69 4.64 -2.03 -2.85 113.55 113.47 2fsa h SER 43 Ca 0.43 -0.14 -0.11 0.00 -0.47 0.00 0.00 61.79 61.50 2fsa h SER 43 Cb 0.44 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 2fsa h SER 43 CO -0.27 0.69 -0.09 -0.08 -0.87 0.00 0.00 176.83 176.21 2fsa h GLU 44 N 0.55 1.04 -0.56 4.77 4.81 -1.30 -3.06 114.58 120.82 2fsa h GLU 44 Ca 0.11 -0.37 0.15 0.00 -0.13 0.00 0.00 59.36 59.11 2fsa h GLU 44 Cb 0.47 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 2fsa h GLU 44 CO 0.02 1.06 0.40 0.00 -0.73 0.00 0.00 179.01 179.77 2fsa h ALA 45 N 0.96 2.42 -0.58 2.92 0.00 -0.73 -1.11 119.26 123.13 2fsa h ALA 45 Ca 0.15 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.12 2fsa h ALA 45 Cb 0.66 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2fsa h ALA 45 CO 0.05 -0.58 0.39 0.93 0.00 0.00 0.00 179.25 180.04 2fsa h GLU 46 N 0.08 0.46 -0.08 0.00 5.08 -1.59 -1.44 114.58 117.09 2fsa h GLU 46 Ca 0.27 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2fsa h GLU 46 Cb 0.96 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2fsa h GLU 46 CO -0.02 0.31 0.00 1.28 -1.00 0.00 0.00 179.01 179.57 2fsa n LEU 47 N -4.47 1.45 -4.76 1.33 4.77 -0.42 -4.87 117.00 110.02 2fsa n LEU 47 Ca 0.09 -0.55 -0.36 0.00 -0.03 0.00 0.00 56.01 55.16 2fsa n LEU 47 Cb 0.30 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.27 2fsa n LEU 47 CO 0.34 0.27 -0.13 -0.63 -1.33 0.00 0.00 177.39 175.91 2fsa s ILE 48 N -1.90 5.39 0.00 -0.08 1.01 -0.54 -5.05 121.20 120.03 2fsa s ILE 48 Ca 0.35 0.30 0.00 0.00 0.00 0.00 0.00 60.65 61.30 2fsa s ILE 48 Cb 0.19 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 39.16 2fsa s ILE 48 CO 0.30 0.46 0.00 -0.67 0.00 0.00 0.00 174.94 175.03 2fsa n ASP 49 N 3.21 0.00 -4.76 3.58 -0.08 -1.26 -4.91 116.55 112.32 2fsa n ASP 49 Ca -0.16 0.00 -0.39 0.00 -1.51 0.00 0.00 54.79 52.73 2fsa n ASP 49 Cb 0.52 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.93 2fsa n ASP 49 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2fsa s GLU 50 N 0.12 4.41 -0.08 -0.67 2.12 -1.26 -5.06 118.70 118.28 2fsa s GLU 50 Ca 0.00 0.93 0.02 0.00 0.36 0.00 0.00 54.97 56.28 2fsa s GLU 50 Cb 0.00 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 31.04 2fsa s GLU 50 CO 0.00 0.38 -0.15 -0.47 -0.54 0.00 0.00 175.26 174.48 2fsa s TYR 51 N -0.32 2.73 -0.13 5.30 5.04 -1.26 -5.04 117.35 123.66 2fsa s TYR 51 Ca 0.35 -0.41 0.00 0.00 -2.44 0.00 0.00 57.07 54.57 2fsa s TYR 51 Cb -0.20 -1.72 0.02 0.00 0.35 0.00 0.00 41.96 40.41 2fsa s TYR 51 CO 0.21 -0.02 -0.13 0.08 -1.34 0.00 0.00 175.55 174.36 2fsa s VAL 52 N -0.22 1.41 0.89 3.14 1.01 -1.26 -1.11 120.40 124.25 2fsa s VAL 52 Ca 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 2fsa s VAL 52 Cb -0.13 -1.33 0.12 0.00 0.00 0.00 0.00 36.38 35.04 2fsa s VAL 52 CO 0.03 0.43 1.10 0.00 0.00 0.00 0.00 175.10 176.66 2fsa h PRO 54 N -1.60 0.48 -0.60 0.00 0.11 -1.98 0.23 132.00 128.63 2fsa h PRO 54 Ca -0.47 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 2fsa h PRO 54 Cb 1.27 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2fsa h PRO 54 CO 0.50 0.32 0.09 1.96 -0.21 0.00 0.00 178.00 180.66 2fsa h GLN 55 N 0.49 1.01 -0.43 1.05 4.20 -1.99 0.12 115.11 119.56 2fsa h GLN 55 Ca 0.35 -0.28 -0.14 0.00 0.06 0.00 0.00 58.65 58.64 2fsa h GLN 55 Cb 0.43 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2fsa h GLN 55 CO -0.31 0.95 -0.29 0.00 -0.67 0.00 0.00 178.83 178.51 2fsa h GLN 57 N 0.79 0.70 -0.39 0.00 5.75 -0.72 0.24 115.11 121.48 2fsa h GLN 57 Ca 0.09 -0.14 -0.07 0.00 -0.15 0.00 0.00 58.65 58.37 2fsa h GLN 57 Cb 0.86 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.30 2fsa h GLN 57 CO 0.08 0.66 -0.04 1.03 -2.65 0.00 0.00 178.83 177.91 2fsa h SER 58 N 0.67 0.71 -0.59 -0.69 0.87 -0.70 -1.22 113.55 112.59 2fsa h SER 58 Ca 0.15 -0.33 -0.05 0.00 -1.23 0.00 0.00 61.79 60.32 2fsa h SER 58 Cb 0.30 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 2fsa h SER 58 CO 0.00 0.87 0.17 0.74 -0.53 0.00 0.00 176.83 178.08 2fsa h THR 59 N 0.52 1.25 -0.75 2.23 2.02 -0.75 -1.36 112.91 116.07 2fsa h THR 59 Ca 0.10 -0.86 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 2fsa h THR 59 Cb 0.54 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 2fsa h THR 59 CO 0.03 0.32 0.32 -0.33 0.37 0.00 0.00 175.52 176.23 2fsa h GLU 60 N 0.84 1.11 -0.50 6.66 5.08 -0.83 -2.70 114.58 124.23 2fsa h GLU 60 Ca 0.19 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 2fsa h GLU 60 Cb 0.31 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2fsa h GLU 60 CO -0.00 0.88 0.09 -0.44 -1.00 0.00 0.00 179.01 178.53 2fsa h ASP 61 N 1.09 0.80 0.00 1.42 3.32 -0.84 -2.79 116.42 119.41 2fsa h ASP 61 Ca 0.26 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2fsa h ASP 61 Cb 0.17 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.51 2fsa h ASP 61 CO -0.03 0.85 0.00 0.00 -1.72 0.00 0.00 179.24 178.34 2fsa n ALA 62 N -2.40 2.41 0.00 3.45 0.00 -0.55 -4.58 120.51 118.84 2fsa n ALA 62 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2fsa n ALA 62 Cb 0.25 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.41 2fsa n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2fsa n THR 64 N 1.33 0.00 1.05 0.00 -2.24 -1.05 -4.45 114.28 108.91 2fsa n THR 64 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 2fsa n THR 64 Cb 0.25 0.00 0.45 0.00 -2.10 0.00 0.00 70.33 68.92 2fsa n THR 64 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2fsa n VAL 65 N 0.00 0.00 0.19 2.28 0.24 -1.26 -4.03 118.33 115.74 2fsa n VAL 65 Ca 0.00 -0.01 0.09 0.00 -2.04 0.00 0.00 64.34 62.38 2fsa n VAL 65 Cb 0.00 -0.10 -0.13 0.00 -1.47 0.00 0.00 33.84 32.14 2fsa n VAL 65 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2fsa n LEU 66 N -1.43 0.20 -4.81 1.34 4.77 -1.26 -1.31 117.00 114.50 2fsa n LEU 66 Ca 0.07 -0.12 -0.32 0.00 -0.03 0.00 0.00 56.01 55.62 2fsa n LEU 66 Cb 0.33 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 2fsa n LEU 66 CO 0.30 0.05 0.71 0.42 -1.33 0.00 0.00 177.39 177.55 2fsa s THR 67 N -3.14 3.88 0.44 -5.08 -4.23 -1.26 -4.90 115.64 101.35 2fsa s THR 67 Ca -0.04 0.80 -0.25 0.00 -1.18 0.00 0.00 61.69 61.02 2fsa s THR 67 Cb 0.12 -3.38 -0.09 0.00 1.34 0.00 0.00 72.50 70.49 2fsa s THR 67 CO 0.76 -0.61 1.41 -2.65 -0.54 0.00 0.00 174.62 172.99 2fsa n PRO 68 N -2.38 2.23 -2.72 3.99 -0.02 -1.26 -4.32 135.00 130.52 2fsa n PRO 68 Ca 0.08 0.79 -0.41 0.00 -2.02 0.00 0.00 63.50 61.94 2fsa n PRO 68 Cb 0.53 -2.59 -0.04 0.00 -0.02 0.00 0.00 33.50 31.38 2fsa n PRO 68 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2fsa s LEU 69 N -2.47 4.45 0.58 2.45 1.43 -0.71 -4.98 118.68 119.42 2fsa s LEU 69 Ca 0.61 1.74 0.04 0.00 -1.03 0.00 0.00 54.13 55.48 2fsa s LEU 69 Cb -0.46 -3.58 0.07 0.00 0.03 0.00 0.00 46.19 42.25 2fsa s LEU 69 CO 0.58 -0.14 0.81 0.42 0.23 0.00 0.00 176.35 178.24 2fsa s THR 70 N 0.41 2.44 0.34 5.49 -4.23 -1.26 -4.93 115.64 113.91 2fsa s THR 70 Ca 0.49 -0.79 0.05 0.00 -1.18 0.00 0.00 61.69 60.26 2fsa s THR 70 Cb -0.22 -2.65 0.17 0.00 1.34 0.00 0.00 72.50 71.13 2fsa s THR 70 CO 0.29 0.00 1.89 -0.33 -0.54 0.00 0.00 174.62 175.93 2fsa h GLU 71 N 0.03 0.52 -0.50 3.99 4.39 -1.99 -0.38 114.58 120.63 2fsa h GLU 71 Ca -0.37 -0.10 -0.12 0.00 0.34 0.00 0.00 59.36 59.11 2fsa h GLU 71 Cb 1.28 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 2fsa h GLU 71 CO 0.44 0.53 -0.16 0.87 -1.16 0.00 0.00 179.01 179.54 2fsa h LYS 72 N 0.50 0.98 -0.82 2.33 1.79 -2.00 -2.05 116.57 117.31 2fsa h LYS 72 Ca 0.11 -0.39 -0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2fsa h LYS 72 Cb 0.29 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.85 2fsa h LYS 72 CO 0.01 1.06 0.51 -0.44 -1.08 0.00 0.00 179.45 179.51 2fsa h ASP 73 N 0.86 0.97 -0.03 0.86 3.32 -1.68 -1.96 116.42 118.77 2fsa h ASP 73 Ca 0.12 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 2fsa h ASP 73 Cb 0.72 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2fsa h ASP 73 CO 0.06 0.74 -0.14 1.88 -1.72 0.00 0.00 179.24 180.05 2fsa h TYR 74 N 1.12 0.36 -0.17 4.55 -1.99 -0.76 0.34 116.97 120.42 2fsa h TYR 74 Ca 0.30 -0.05 -0.09 0.00 2.00 0.00 0.00 58.73 60.89 2fsa h TYR 74 Cb -0.07 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.54 2fsa h TYR 74 CO -0.01 0.48 -0.30 0.93 -0.00 0.00 0.00 178.16 179.26 2fsa h GLU 75 N 0.32 0.34 -0.35 4.88 5.08 -0.79 -2.19 114.58 121.88 2fsa h GLU 75 Ca 0.06 -0.13 -0.16 0.00 -1.00 0.00 0.00 59.36 58.13 2fsa h GLU 75 Cb 0.44 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 2fsa h GLU 75 CO 0.03 0.61 -0.41 0.78 -1.00 0.00 0.00 179.01 179.02 2fsa h GLY 76 N 1.06 0.98 1.02 -3.84 0.00 -0.49 -2.47 103.07 99.33 2fsa h GLY 76 Ca 0.04 -1.03 -0.02 0.00 0.00 0.00 0.00 47.33 46.32 2fsa h GLY 76 CO 0.05 0.93 0.48 1.41 0.00 0.00 0.00 176.54 179.41 2fsa h LEU 77 N 0.70 1.08 -0.76 3.11 3.38 -0.67 0.13 115.31 122.28 2fsa h LEU 77 Ca 0.05 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2fsa h LEU 77 Cb 1.00 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 2fsa h LEU 77 CO 0.10 0.87 0.19 0.50 0.09 0.00 0.00 178.44 180.19 2fsa h LYS 78 N 1.21 1.13 -0.51 1.13 3.64 -1.35 -0.06 116.57 121.76 2fsa h LYS 78 Ca 0.31 -0.26 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 2fsa h LYS 78 Cb 0.02 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 2fsa h LYS 78 CO -0.05 0.98 0.13 -0.09 -2.27 0.00 0.00 179.45 178.15 2fsa h ARG 79 N 1.07 0.81 -0.25 1.90 2.43 -0.89 -1.06 114.38 118.40 2fsa h ARG 79 Ca 0.23 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 2fsa h ARG 79 Cb 0.35 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2fsa h ARG 79 CO -0.00 0.78 0.02 0.28 -1.51 0.00 0.00 179.97 179.54 2fsa h VAL 80 N 0.70 1.24 -0.39 0.20 2.07 -0.70 -1.91 116.25 117.47 2fsa h VAL 80 Ca 0.16 -0.82 0.03 0.00 0.82 0.00 0.00 66.70 66.88 2fsa h VAL 80 Cb 0.33 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2fsa h VAL 80 CO 0.00 0.26 0.20 -0.07 0.02 0.00 0.00 177.57 177.98 2fsa h LEU 81 N 0.21 0.31 -1.23 2.57 3.38 -0.90 -1.93 115.31 117.72 2fsa h LEU 81 Ca 0.07 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2fsa h LEU 81 Cb 0.36 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2fsa h LEU 81 CO 0.01 0.22 0.16 0.03 0.09 0.00 0.00 178.44 178.95 2fsa h ARG 82 N 0.41 0.70 -0.20 1.13 3.08 -1.10 0.19 114.38 118.58 2fsa h ARG 82 Ca 0.16 -0.11 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 2fsa h ARG 82 Cb 0.05 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2fsa h ARG 82 CO -0.10 0.60 -0.29 0.66 -1.07 0.00 0.00 179.97 179.77 2fsa h SER 83 N 0.69 0.40 -0.19 7.04 4.64 -0.86 -1.83 113.55 123.44 2fsa h SER 83 Ca 0.16 -0.14 -0.10 0.00 -0.47 0.00 0.00 61.79 61.24 2fsa h SER 83 Cb 0.19 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2fsa h SER 83 CO -0.01 0.68 -0.26 -0.07 -0.87 0.00 0.00 176.83 176.30 2fsa h LEU 84 N 0.35 0.56 -1.92 5.97 -0.00 -0.62 -2.82 115.31 116.83 2fsa h LEU 84 Ca 0.05 -0.51 -0.02 0.00 -0.00 0.00 0.00 57.88 57.40 2fsa h LEU 84 Cb 0.69 -0.16 -0.00 0.00 -0.00 0.00 0.00 40.66 41.19 2fsa h LEU 84 CO 0.05 0.96 -0.09 1.56 -0.00 0.00 0.00 178.44 180.93 2fsa h GLN 85 N 0.18 0.00 -0.01 1.13 4.20 -0.76 -1.99 115.11 117.86 2fsa h GLN 85 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2fsa h GLN 85 Cb 0.83 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2fsa h GLN 85 CO 0.06 0.09 -0.25 0.00 -0.67 0.00 0.00 178.83 178.06 2fsa n ALA 86 N -2.46 3.06 -1.76 3.87 0.00 -0.71 -4.87 120.51 117.63 2fsa n ALA 86 Ca -0.03 -0.41 -0.40 0.00 0.00 0.00 0.00 53.44 52.60 2fsa n ALA 86 Cb 0.17 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 2fsa n ALA 86 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2fsa s HIS 87 N -2.47 3.29 0.00 0.00 5.04 -0.75 -4.98 115.29 115.41 2fsa s HIS 87 Ca 0.25 1.56 0.00 0.00 -1.54 0.00 0.00 55.06 55.33 2fsa s HIS 87 Cb 0.19 -3.47 0.00 0.00 0.04 0.00 0.00 32.58 29.34 2fsa s HIS 87 CO 0.51 -1.22 0.00 1.63 -2.34 0.00 0.00 174.74 173.32 2fsa n LYS 88 N 0.89 0.00 -0.01 2.88 5.02 -1.26 -4.31 118.16 121.36 2fsa n LYS 88 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2fsa n LYS 88 Cb 0.44 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 2fsa n LYS 88 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fsa n ALA 90 N 1.22 0.00 -0.29 7.82 0.00 -1.26 -4.97 120.51 123.03 2fsa n ALA 90 Ca 0.00 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.70 2fsa n ALA 90 Cb 0.00 -0.34 0.60 0.00 0.00 0.00 0.00 19.45 19.71 2fsa n ALA 90 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2fsa h TRP 91 N 0.00 0.39 0.00 0.00 5.08 -1.90 -0.45 115.95 119.07 2fsa h TRP 91 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 2fsa h TRP 91 Cb 0.00 -0.11 0.00 0.00 -3.00 0.00 0.00 29.16 26.05 2fsa h TRP 91 CO 0.00 0.05 0.00 -2.30 -1.28 0.00 0.00 178.44 174.91 2fsa n PRO 92 N -4.45 0.15 -0.09 0.12 -0.02 -1.26 -3.68 135.00 125.76 2fsa n PRO 92 Ca 0.23 0.24 0.03 0.00 -2.02 0.00 0.00 63.50 61.98 2fsa n PRO 92 Cb 0.95 -1.71 0.08 0.00 -0.02 0.00 0.00 33.50 32.79 2fsa n PRO 92 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2fsa n PHE 93 N -1.98 0.23 -0.04 6.00 3.72 -0.19 -4.72 117.46 120.49 2fsa n PHE 93 Ca 0.04 -0.46 -0.05 0.00 -0.05 0.00 0.00 57.45 56.94 2fsa n PHE 93 Cb 0.31 -0.03 0.15 0.00 -0.94 0.00 0.00 39.48 38.97 2fsa n PHE 93 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2fsa h LEU 94 N 1.13 0.63 -8.62 4.37 3.38 -1.61 -0.45 115.31 114.15 2fsa h LEU 94 Ca 0.00 -0.21 -0.27 0.00 0.09 0.00 0.00 57.88 57.49 2fsa h LEU 94 Cb 0.60 -0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.03 2fsa h LEU 94 CO 0.00 0.84 -0.65 -1.61 0.09 0.00 0.00 178.44 177.11 2fsa s GLU 95 N -4.59 1.10 0.46 1.13 0.41 -1.26 -2.01 118.70 113.94 2fsa s GLU 95 Ca -0.08 -1.54 -0.23 0.00 -0.41 0.00 0.00 54.97 52.71 2fsa s GLU 95 Cb 0.14 -0.14 -0.09 0.00 -1.78 0.00 0.00 34.13 32.26 2fsa s GLU 95 CO 0.81 -0.18 1.13 -2.30 -0.49 0.00 0.00 175.26 174.22 2fsa n PRO 96 N -0.23 1.51 -1.97 0.39 -0.02 -1.26 -4.87 135.00 128.54 2fsa n PRO 96 Ca -0.05 0.55 -0.41 0.00 -2.02 0.00 0.00 63.50 61.56 2fsa n PRO 96 Cb 0.64 -2.23 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 2fsa n PRO 96 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2fsa s VAL 97 N -1.29 2.53 -0.21 -1.45 1.01 -1.26 -4.97 120.40 114.76 2fsa s VAL 97 Ca 0.65 0.46 -0.22 0.00 0.00 0.00 0.00 61.98 62.87 2fsa s VAL 97 Cb -0.50 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2fsa s VAL 97 CO 0.55 0.08 0.71 -0.62 0.00 0.00 0.00 175.10 175.82 2fsa s ASP 98 N 0.23 6.75 0.42 3.32 -1.08 -1.26 -4.94 116.67 120.11 2fsa s ASP 98 Ca 0.58 0.92 0.20 0.00 -0.52 0.00 0.00 52.55 53.73 2fsa s ASP 98 Cb -0.43 -2.39 1.15 0.00 -1.46 0.00 0.00 42.92 39.80 2fsa s ASP 98 CO 0.47 -0.37 1.79 -0.65 0.52 0.00 0.00 175.17 176.93 2fsa h PRO 99 N 7.57 0.34 0.00 4.34 0.11 -1.94 0.26 132.00 142.69 2fsa h PRO 99 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2fsa h PRO 99 Cb 1.13 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2fsa h PRO 99 CO 0.81 0.23 0.00 -0.91 -0.21 0.00 0.00 178.00 177.91 2fsa h ASN 100 N 0.35 0.00 0.03 -2.05 2.35 -2.02 -2.72 115.58 111.52 2fsa h ASN 100 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 2fsa h ASN 100 Cb 1.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.89 2fsa h ASN 100 CO -0.24 0.00 -1.59 0.47 -1.65 0.00 0.00 177.43 174.42 2fsa n ASP 101 N -2.93 0.39 -3.60 5.81 8.00 0.88 -4.82 116.55 120.28 2fsa n ASP 101 Ca 0.00 -0.37 -0.29 0.00 0.71 0.00 0.00 54.79 54.84 2fsa n ASP 101 Cb 0.24 1.58 -0.15 0.00 -0.02 0.00 0.00 41.12 42.77 2fsa n ASP 101 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fsa s ALA 102 N -3.32 0.95 0.05 2.24 0.00 -0.91 -5.02 121.76 115.75 2fsa s ALA 102 Ca -0.02 -1.33 -0.36 0.00 0.00 0.00 0.00 51.96 50.26 2fsa s ALA 102 Cb 0.15 -1.48 -0.15 0.00 0.00 0.00 0.00 23.12 21.64 2fsa s ALA 102 CO 0.89 -1.68 1.52 -2.30 0.00 0.00 0.00 175.76 174.19 2fsa n PRO 103 N 5.06 1.59 -2.79 0.00 -0.02 -1.25 -2.08 135.00 135.49 2fsa n PRO 103 Ca -0.04 0.57 -0.12 0.00 -2.02 0.00 0.00 63.50 61.89 2fsa n PRO 103 Cb 0.42 -2.28 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 2fsa n PRO 103 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2fsa n ASP 104 N 3.57 -2.70 -0.05 2.55 2.03 -1.26 -4.85 116.55 115.82 2fsa n ASP 104 Ca 0.19 0.09 -0.08 0.00 0.52 0.00 0.00 54.79 55.52 2fsa n ASP 104 Cb 0.23 -2.34 -0.02 0.00 -0.72 0.00 0.00 41.12 38.27 2fsa n ASP 104 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2fsa h TYR 105 N -0.26 -0.20 0.00 -0.67 3.20 -1.75 -0.88 116.97 116.41 2fsa h TYR 105 Ca -0.24 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.66 2fsa h TYR 105 Cb 1.17 0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.56 2fsa h TYR 105 CO 0.77 -0.14 0.00 0.66 -1.64 0.00 0.00 178.16 177.81 2fsa n TYR 106 N -5.25 0.00 0.63 -3.82 4.01 -1.26 -0.47 117.16 111.00 2fsa n TYR 106 Ca -0.01 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.84 2fsa n TYR 106 Cb 0.17 -0.21 0.01 0.00 -0.31 0.00 0.00 39.34 38.99 2fsa n TYR 106 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fsa n GLY 107 N 0.39 -1.17 0.10 2.72 0.00 -0.38 -4.32 105.19 102.53 2fsa n GLY 107 Ca 0.11 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.55 2fsa n GLY 107 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2fsa n VAL 108 N -1.87 1.16 -3.49 1.61 0.31 -0.54 -4.91 118.33 110.60 2fsa n VAL 108 Ca 0.02 -0.45 -0.42 0.00 -0.01 0.00 0.00 64.34 63.48 2fsa n VAL 108 Cb 0.42 -1.21 -0.10 0.00 -0.91 0.00 0.00 33.84 32.04 2fsa n VAL 108 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2fsa s ILE 109 N -2.41 5.10 -0.17 2.52 -1.09 0.38 -4.95 121.20 120.58 2fsa s ILE 109 Ca -0.27 -0.70 0.15 0.00 -2.23 0.00 0.00 60.65 57.60 2fsa s ILE 109 Cb 0.07 -3.84 0.07 0.00 -1.58 0.00 0.00 42.46 37.18 2fsa s ILE 109 CO 0.47 -0.29 1.44 0.11 -1.23 0.00 0.00 174.94 175.44 2fsa h LYS 110 N 8.58 0.00 -2.59 2.79 6.56 -1.87 -3.40 116.57 126.64 2fsa h LYS 110 Ca -0.27 0.00 -0.60 0.00 -1.06 0.00 0.00 60.65 58.72 2fsa h LYS 110 Cb 1.12 0.00 -0.40 0.00 -0.57 0.00 0.00 32.23 32.37 2fsa h LYS 110 CO 0.71 0.48 -0.78 0.39 -2.06 0.00 0.00 179.45 178.20 2fsa n GLU 111 N -3.22 1.21 -0.82 3.15 1.02 -1.26 -5.17 120.64 115.55 2fsa n GLU 111 Ca 0.02 -3.90 -0.30 0.00 -0.02 0.00 0.00 57.16 52.96 2fsa n GLU 111 Cb 0.73 -1.94 0.25 0.00 -0.02 0.00 0.00 31.44 30.45 2fsa n GLU 111 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2fsa s PRO 112 N -1.02 -1.46 0.00 3.49 0.04 -1.26 -4.94 135.00 129.85 2fsa s PRO 112 Ca 0.31 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.53 2fsa s PRO 112 Cb 0.04 -1.55 0.00 0.00 0.04 0.00 0.00 34.50 33.03 2fsa s PRO 112 CO -0.15 -3.92 0.00 -0.40 0.04 0.00 0.00 177.00 172.56 2fsa n ASP 114 N -4.96 0.00 0.20 6.66 5.75 -1.26 -5.06 116.55 117.88 2fsa n ASP 114 Ca 0.10 0.00 0.03 0.00 -0.01 0.00 0.00 54.79 54.92 2fsa n ASP 114 Cb 0.59 0.00 0.41 0.00 -1.03 0.00 0.00 41.12 41.08 2fsa n ASP 114 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2fsa h LEU 115 N 0.00 0.01 -0.51 -2.12 3.38 -1.21 -2.79 115.31 112.07 2fsa h LEU 115 Ca 0.00 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2fsa h LEU 115 Cb 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2fsa h LEU 115 CO 0.00 0.31 -0.38 0.00 0.09 0.00 0.00 178.44 178.46 2fsa h ALA 116 N 1.69 0.69 0.00 1.53 0.00 -1.62 -0.37 119.26 121.18 2fsa h ALA 116 Ca -0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2fsa h ALA 116 Cb 0.54 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2fsa h ALA 116 CO 0.04 0.67 0.00 2.41 0.00 0.00 0.00 179.25 182.37 2fsa n THR 117 N -4.05 0.27 0.00 0.00 -1.04 -1.05 -1.88 114.28 106.52 2fsa n THR 117 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2fsa n THR 117 Cb 0.53 -0.55 0.00 0.00 -1.82 0.00 0.00 70.33 68.49 2fsa n THR 117 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2fsa n GLU 119 N 0.68 0.00 -0.18 -2.82 2.13 -0.15 -1.48 120.64 118.81 2fsa n GLU 119 Ca 0.00 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.72 2fsa n GLU 119 Cb 0.16 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.88 2fsa n GLU 119 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2fsa h GLU 120 N 0.00 1.04 -0.55 5.31 4.22 -1.64 -1.03 114.58 121.92 2fsa h GLU 120 Ca 0.00 -0.39 -0.09 0.00 0.08 0.00 0.00 59.36 58.95 2fsa h GLU 120 Cb 0.00 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2fsa h GLU 120 CO 0.00 1.08 -0.03 0.00 -2.18 0.00 0.00 179.01 177.89 2fsa h ARG 121 N 0.92 0.97 -0.41 1.92 3.08 -1.54 -2.00 114.38 117.32 2fsa h ARG 121 Ca 0.14 -0.31 -0.03 0.00 0.07 0.00 0.00 59.98 59.85 2fsa h ARG 121 Cb 0.70 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 2fsa h ARG 121 CO 0.05 0.97 0.12 0.28 -1.07 0.00 0.00 179.97 180.32 2fsa h VAL 122 N 0.88 1.22 -0.85 2.04 2.07 -1.79 0.40 116.25 120.22 2fsa h VAL 122 Ca 0.16 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 67.01 2fsa h VAL 122 Cb 0.56 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 2fsa h VAL 122 CO 0.03 0.26 0.52 -0.61 0.02 0.00 0.00 177.57 177.79 2fsa h GLN 123 N 0.52 0.91 -0.68 1.57 4.15 -0.87 -1.68 115.11 119.03 2fsa h GLN 123 Ca 0.13 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.50 2fsa h GLN 123 Cb 0.27 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.76 2fsa h GLN 123 CO -0.00 0.60 0.00 2.89 -1.93 0.00 0.00 178.83 180.39 2fsa n ARG 124 N -4.64 3.95 -3.94 1.69 1.85 -0.78 -4.93 116.66 109.87 2fsa n ARG 124 Ca 0.13 -2.39 -0.26 0.00 -1.00 0.00 0.00 57.85 54.32 2fsa n ARG 124 Cb 0.20 -2.08 -0.01 0.00 -1.05 0.00 0.00 32.46 29.52 2fsa n ARG 124 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2fsa n ARG 125 N 0.48 -3.79 0.10 2.89 5.12 -0.63 -4.88 116.66 115.95 2fsa n ARG 125 Ca 0.21 0.46 -0.04 0.00 -1.93 0.00 0.00 57.85 56.55 2fsa n ARG 125 Cb 0.97 -4.81 0.15 0.00 -1.16 0.00 0.00 32.46 27.60 2fsa n ARG 125 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 2fsa h TYR 126 N -1.82 0.20 -3.44 -1.55 5.03 -1.17 -3.44 116.97 110.78 2fsa h TYR 126 Ca -0.62 -0.08 -0.54 0.00 2.58 0.00 0.00 58.73 60.07 2fsa h TYR 126 Cb 1.37 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 39.58 2fsa h TYR 126 CO 0.51 0.71 0.14 0.71 -1.32 0.00 0.00 178.16 178.92 2fsa s TYR 127 N -3.73 3.79 -0.10 -3.82 2.02 -1.26 -4.95 117.35 109.30 2fsa s TYR 127 Ca -0.03 1.50 0.10 0.00 -0.37 0.00 0.00 57.07 58.27 2fsa s TYR 127 Cb 0.12 -2.77 -0.15 0.00 -0.40 0.00 0.00 41.96 38.76 2fsa s TYR 127 CO 0.78 0.38 0.26 0.39 -1.57 0.00 0.00 175.55 175.79 2fsa n GLU 128 N 2.35 0.92 -3.99 -0.62 1.02 -1.26 -4.85 120.64 114.21 2fsa n GLU 128 Ca -0.04 -0.08 -0.10 0.00 -0.02 0.00 0.00 57.16 56.92 2fsa n GLU 128 Cb 0.50 -1.19 -0.11 0.00 -0.02 0.00 0.00 31.44 30.61 2fsa n GLU 128 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2fsa s LYS 129 N -2.57 0.33 0.48 3.49 1.02 -1.26 -1.74 119.74 119.48 2fsa s LYS 129 Ca -0.02 -0.61 0.13 0.00 0.02 0.00 0.00 55.97 55.48 2fsa s LYS 129 Cb 0.07 0.04 1.10 0.00 -0.52 0.00 0.00 37.83 38.52 2fsa s LYS 129 CO 0.42 -0.03 2.10 1.25 -0.92 0.00 0.00 175.35 178.17 2fsa h LEU 130 N 4.69 0.17 -1.84 3.17 5.85 -1.71 -2.00 115.31 123.63 2fsa h LEU 130 Ca -0.32 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.44 2fsa h LEU 130 Cb 1.21 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2fsa h LEU 130 CO 0.41 0.14 0.21 0.00 -0.34 0.00 0.00 178.44 178.87 2fsa h THR 131 N 0.19 0.95 -0.15 1.05 1.03 -1.54 -0.50 112.91 113.94 2fsa h THR 131 Ca 0.05 -0.07 -0.20 0.00 -0.01 0.00 0.00 66.41 66.19 2fsa h THR 131 Cb 0.01 0.73 0.00 0.00 -1.07 0.00 0.00 68.15 67.82 2fsa h THR 131 CO -0.01 0.04 -0.70 -0.33 -0.01 0.00 0.00 175.52 174.51 2fsa h GLU 132 N 0.20 0.63 -0.18 0.00 5.08 -1.64 -0.87 114.58 117.80 2fsa h GLU 132 Ca 0.14 -0.48 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 2fsa h GLU 132 Cb 0.30 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2fsa h GLU 132 CO -0.02 1.10 -0.03 0.35 -1.00 0.00 0.00 179.01 179.41 2fsa h PHE 133 N 0.45 0.36 -0.67 4.33 3.57 -1.38 -2.38 116.94 121.23 2fsa h PHE 133 Ca -0.03 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.38 2fsa h PHE 133 Cb 1.29 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.91 2fsa h PHE 133 CO 0.06 0.57 0.35 0.28 -2.23 0.00 0.00 178.31 177.35 2fsa h VAL 134 N 0.05 1.21 -0.60 1.41 2.07 -1.10 -2.73 116.25 116.56 2fsa h VAL 134 Ca 0.05 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 2fsa h VAL 134 Cb 0.45 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2fsa h VAL 134 CO 0.01 0.23 0.25 0.00 0.02 0.00 0.00 177.57 178.08 2fsa h ALA 135 N 1.45 0.77 0.00 1.67 0.00 -0.96 -0.01 119.26 122.18 2fsa h ALA 135 Ca 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2fsa h ALA 135 Cb 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2fsa h ALA 135 CO -0.04 0.38 0.00 -0.25 0.00 0.00 0.00 179.25 179.34 2fsa n ASP 136 N -4.48 0.54 0.00 0.00 8.00 -0.91 -1.48 116.55 118.22 2fsa n ASP 136 Ca 0.04 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.97 2fsa n ASP 136 Cb 0.16 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 2fsa n ASP 136 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2fsa n THR 138 N 0.58 0.00 -0.29 -3.53 -1.04 -0.02 -2.20 114.28 107.79 2fsa n THR 138 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 2fsa n THR 138 Cb 0.10 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.68 2fsa n THR 138 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2fsa h LYS 139 N 0.00 1.16 -0.28 -2.82 3.64 -1.51 0.50 116.57 117.27 2fsa h LYS 139 Ca 0.00 -0.20 0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2fsa h LYS 139 Cb 0.00 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 2fsa h LYS 139 CO 0.00 0.93 0.11 0.82 -2.27 0.00 0.00 179.45 179.04 2fsa h ILE 140 N 1.13 0.95 -0.23 2.00 2.04 -1.73 0.88 117.51 122.56 2fsa h ILE 140 Ca 0.27 -0.08 -0.19 0.00 1.00 0.00 0.00 64.86 65.85 2fsa h ILE 140 Cb 0.18 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2fsa h ILE 140 CO -0.03 0.04 -0.61 -0.26 0.00 0.00 0.00 178.15 177.30 2fsa h PHE 141 N 0.24 1.00 -0.40 1.37 0.04 -1.80 -2.58 116.94 114.82 2fsa h PHE 141 Ca 0.12 -0.38 -0.12 0.00 2.80 0.00 0.00 57.97 60.39 2fsa h PHE 141 Cb 0.07 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.03 2fsa h PHE 141 CO -0.12 1.19 -0.22 -0.44 -0.60 0.00 0.00 178.31 178.12 2fsa h ASP 142 N 0.59 0.82 -0.57 2.17 3.32 -0.76 -1.85 116.42 120.13 2fsa h ASP 142 Ca -0.00 -0.30 -0.03 0.00 0.02 0.00 0.00 57.03 56.72 2fsa h ASP 142 Cb 1.21 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 2fsa h ASP 142 CO 0.13 1.01 0.23 0.78 -1.72 0.00 0.00 179.24 179.67 2fsa h ASN 143 N 0.70 0.80 -0.33 6.45 2.35 -0.81 -1.68 115.58 123.06 2fsa h ASN 143 Ca 0.10 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2fsa h ASN 143 Cb 0.74 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 2fsa h ASN 143 CO 0.06 0.75 0.15 0.00 -1.65 0.00 0.00 177.43 176.74 2fsa h ARG 145 N 0.39 0.00 0.15 0.00 3.08 -1.23 -0.60 114.38 116.17 2fsa h ARG 145 Ca 0.11 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.81 2fsa h ARG 145 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2fsa h ARG 145 CO -0.01 0.00 -1.84 -0.92 -1.07 0.00 0.00 179.97 176.13 2fsa h TYR 146 N 0.00 0.57 0.21 3.04 3.20 -0.88 -3.39 116.97 119.73 2fsa h TYR 146 Ca 0.00 -0.42 -0.32 0.00 3.14 0.00 0.00 58.73 61.13 2fsa h TYR 146 Cb 0.46 -0.02 0.03 0.00 1.54 0.00 0.00 36.73 38.74 2fsa h TYR 146 CO 0.00 1.68 -1.40 -0.92 -1.64 0.00 0.00 178.16 175.88 2fsa h TYR 147 N 0.09 0.84 -2.83 -3.82 3.20 -1.13 -3.46 116.97 109.84 2fsa h TYR 147 Ca -0.37 -0.61 -0.64 0.00 3.14 0.00 0.00 58.73 60.26 2fsa h TYR 147 Cb 2.06 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 40.25 2fsa h TYR 147 CO 0.09 1.47 -0.46 -0.80 -1.64 0.00 0.00 178.16 176.82 2fsa s ASN 148 N -7.45 6.41 0.63 -2.11 -0.87 -0.24 -5.09 114.94 106.22 2fsa s ASN 148 Ca -0.07 0.41 -0.18 0.00 -1.57 0.00 0.00 52.86 51.45 2fsa s ASN 148 Cb 0.05 -2.03 -0.02 0.00 -0.02 0.00 0.00 41.25 39.24 2fsa s ASN 148 CO 0.93 0.26 1.20 -2.16 -2.57 0.00 0.00 177.10 174.76 2fsa s PRO 149 N -1.87 2.77 0.44 -0.60 0.04 -1.26 -4.68 135.00 129.84 2fsa s PRO 149 Ca 0.27 1.76 0.29 0.00 0.04 0.00 0.00 61.00 63.36 2fsa s PRO 149 Cb -0.13 -1.91 1.58 0.00 0.04 0.00 0.00 34.50 34.08 2fsa s PRO 149 CO 0.17 -1.35 1.89 0.66 0.04 0.00 0.00 177.00 178.41 2fsa h SER 150 N 0.53 0.00 -0.50 6.66 4.64 -1.97 -2.14 113.55 120.76 2fsa h SER 150 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2fsa h SER 150 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2fsa h SER 150 CO 0.54 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.60 2fsa n ASP 151 N -2.53 3.38 -4.86 4.97 5.75 -1.26 -4.75 116.55 117.25 2fsa n ASP 151 Ca -0.02 -1.97 -0.33 0.00 -0.01 0.00 0.00 54.79 52.46 2fsa n ASP 151 Cb 0.06 -0.33 -0.06 0.00 -1.03 0.00 0.00 41.12 39.76 2fsa n ASP 151 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2fsa s SER 152 N -1.05 6.75 0.52 -1.12 1.04 -0.81 -4.97 113.70 114.06 2fsa s SER 152 Ca 0.35 1.13 0.19 0.00 0.48 0.00 0.00 55.95 58.11 2fsa s SER 152 Cb 0.19 -2.31 1.34 0.00 0.10 0.00 0.00 66.02 65.33 2fsa s SER 152 CO 0.25 -0.10 2.13 1.55 0.98 0.00 0.00 173.24 178.04 2fsa h PRO 153 N 2.61 0.00 -0.47 4.02 0.13 -1.93 -1.95 132.00 134.41 2fsa h PRO 153 Ca -0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2fsa h PRO 153 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2fsa h PRO 153 CO 0.67 0.06 0.29 0.74 -0.23 0.00 0.00 178.00 179.52 2fsa h PHE 154 N 0.00 0.61 -0.55 1.56 0.04 -1.93 0.17 116.94 116.84 2fsa h PHE 154 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 2fsa h PHE 154 Cb 0.11 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.03 2fsa h PHE 154 CO 0.00 0.42 0.33 -0.92 -0.60 0.00 0.00 178.31 177.54 2fsa h TYR 155 N 0.62 0.72 -0.55 -0.55 5.03 -1.60 -2.36 116.97 118.29 2fsa h TYR 155 Ca 0.17 -0.00 -0.07 0.00 2.58 0.00 0.00 58.73 61.41 2fsa h TYR 155 Cb -0.02 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 38.00 2fsa h TYR 155 CO -0.03 0.49 0.07 1.96 -1.32 0.00 0.00 178.16 179.33 2fsa h GLN 156 N 0.74 0.89 -0.67 1.82 1.08 -0.99 -2.13 115.11 115.84 2fsa h GLN 156 Ca 0.20 -0.22 0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2fsa h GLN 156 Cb -0.02 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.27 2fsa h GLN 156 CO -0.04 0.84 0.44 0.00 -0.95 0.00 0.00 178.83 179.12 2fsa h ALA 158 N 1.58 0.67 -0.46 0.00 0.00 -0.92 -0.76 119.26 119.36 2fsa h ALA 158 Ca 0.24 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2fsa h ALA 158 Cb -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2fsa h ALA 158 CO -0.05 0.54 0.21 0.93 0.00 0.00 0.00 179.25 180.88 2fsa h GLU 159 N 0.77 0.67 -0.03 0.00 4.39 -0.71 -1.37 114.58 118.31 2fsa h GLU 159 Ca 0.13 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2fsa h GLU 159 Cb 0.62 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2fsa h GLU 159 CO 0.04 0.59 0.00 0.28 -1.16 0.00 0.00 179.01 178.76 2fsa h VAL 160 N 0.60 1.23 -0.51 3.13 2.07 -0.96 -2.69 116.25 119.11 2fsa h VAL 160 Ca 0.16 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 2fsa h VAL 160 Cb 0.15 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 2fsa h VAL 160 CO -0.02 0.18 0.11 -0.07 0.02 0.00 0.00 177.57 177.79 2fsa h LEU 161 N -0.23 0.74 -0.65 2.57 3.38 -1.10 -1.01 115.31 119.01 2fsa h LEU 161 Ca 0.01 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 2fsa h LEU 161 Cb 0.29 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2fsa h LEU 161 CO 0.00 0.74 -0.20 -0.08 0.09 0.00 0.00 178.44 178.99 2fsa h GLU 162 N 0.76 0.84 -0.57 1.13 4.81 -1.26 0.22 114.58 120.52 2fsa h GLU 162 Ca 0.17 -0.33 -0.06 0.00 -0.13 0.00 0.00 59.36 59.00 2fsa h GLU 162 Cb 0.30 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 2fsa h GLU 162 CO 0.00 0.97 0.12 1.03 -0.73 0.00 0.00 179.01 180.39 2fsa h SER 163 N 0.74 0.89 -0.45 1.04 0.87 -1.14 -0.82 113.55 114.68 2fsa h SER 163 Ca 0.10 -0.25 -0.04 0.00 -1.23 0.00 0.00 61.79 60.38 2fsa h SER 163 Cb 0.73 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 2fsa h SER 163 CO 0.06 0.91 0.13 0.15 -0.53 0.00 0.00 176.83 177.54 2fsa h PHE 164 N 0.84 0.74 -0.22 2.24 3.57 -0.88 -2.87 116.94 120.35 2fsa h PHE 164 Ca 0.18 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 2fsa h PHE 164 Cb 0.38 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2fsa h PHE 164 CO 0.03 0.68 0.14 0.35 -2.23 0.00 0.00 178.31 177.27 2fsa h PHE 165 N 0.60 0.29 -0.74 0.41 3.57 -0.27 -1.16 116.94 119.64 2fsa h PHE 165 Ca 0.14 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.72 2fsa h PHE 165 Cb 0.29 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 38.88 2fsa h PHE 165 CO 0.02 0.21 0.41 0.28 -2.23 0.00 0.00 178.31 177.00 2fsa h VAL 166 N 0.28 0.94 -0.53 1.41 2.07 -1.11 -1.38 116.25 117.93 2fsa h VAL 166 Ca 0.08 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.24 2fsa h VAL 166 Cb 0.00 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 2fsa h VAL 166 CO -0.02 0.13 -0.08 -0.61 0.02 0.00 0.00 177.57 177.02 2fsa h GLN 167 N 0.73 1.00 -0.00 1.57 5.75 -1.28 -2.88 115.11 120.00 2fsa h GLN 167 Ca 0.34 -0.36 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 2fsa h GLN 167 Cb 0.26 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 28.74 2fsa h GLN 167 CO -0.21 1.04 -0.02 0.87 -2.65 0.00 0.00 178.83 177.85 2fsa h LYS 168 N 0.87 0.00 0.00 1.69 1.79 -0.26 -2.19 116.57 118.47 2fsa h LYS 168 Ca 0.14 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2fsa h LYS 168 Cb 0.64 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2fsa h LYS 168 CO 0.04 0.03 -0.20 -0.11 -1.08 0.00 0.00 179.45 178.13 2fsa n LEU 169 N -4.51 0.59 -4.70 2.94 7.94 -0.61 -4.81 117.00 113.84 2fsa n LEU 169 Ca -0.03 0.42 -0.44 0.00 -1.11 0.00 0.00 56.01 54.85 2fsa n LEU 169 Cb 0.11 -0.32 -0.03 0.00 0.53 0.00 0.00 43.42 43.71 2fsa n LEU 169 CO 0.34 -0.08 1.26 0.29 -1.11 0.00 0.00 177.39 178.09 2fsa n LYS 170 N -2.00 2.48 -2.58 1.96 5.02 -0.83 -1.71 118.16 120.51 2fsa n LYS 170 Ca 0.05 0.89 -0.19 0.00 -2.02 0.00 0.00 58.31 57.05 2fsa n LYS 170 Cb 0.41 -2.69 0.01 0.00 -0.02 0.00 0.00 35.03 32.73 2fsa n LYS 170 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fsa n GLY 171 N 3.40 -0.38 0.09 0.72 0.00 -1.26 -4.93 105.19 102.83 2fsa n GLY 171 Ca 0.15 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 2fsa n GLY 171 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2fsa h PHE 172 N -0.50 -0.11 -0.01 1.61 3.57 -1.64 -3.55 116.94 116.31 2fsa h PHE 172 Ca -0.45 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.05 2fsa h PHE 172 Cb 1.32 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.10 2fsa h PHE 172 CO 0.48 0.24 0.00 1.63 -2.23 0.00 0.00 178.31 178.43