#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fm8 n GLN 2 N 0.00 1.74 0.09 2.12 -0.06 -1.26 -3.95 117.38 116.07 2fm8 n GLN 2 Ca 0.00 -0.72 0.12 0.00 -2.00 0.00 0.00 57.00 54.40 2fm8 n GLN 2 Cb 0.00 -1.25 0.20 0.00 -4.06 0.00 0.00 30.24 25.13 2fm8 n GLN 2 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 2fm8 h HIS 3 N 1.58 0.00 -2.71 3.69 2.76 -2.07 -3.48 115.15 114.93 2fm8 h HIS 3 Ca 0.00 0.00 -0.54 0.00 -2.20 0.00 0.00 60.37 57.63 2fm8 h HIS 3 Cb 0.51 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.48 2fm8 h HIS 3 CO 0.00 0.00 1.00 -1.17 -1.30 0.00 0.00 177.93 176.46 2fm8 s LEU 4 N -4.62 4.34 -0.34 0.26 2.96 -1.25 -4.99 118.68 115.03 2fm8 s LEU 4 Ca 0.06 2.32 -0.07 0.00 -0.22 0.00 0.00 54.13 56.22 2fm8 s LEU 4 Cb 0.12 -3.55 0.04 0.00 0.50 0.00 0.00 46.19 43.30 2fm8 s LEU 4 CO 0.70 -0.86 0.11 -0.62 -1.32 0.00 0.00 176.35 174.35 2fm8 s ASP 5 N 2.63 5.34 0.23 3.68 -1.08 -1.26 -4.97 116.67 121.24 2fm8 s ASP 5 Ca 0.72 -1.14 -0.03 0.00 -0.52 0.00 0.00 52.55 51.58 2fm8 s ASP 5 Cb -0.36 -1.88 0.25 0.00 -1.46 0.00 0.00 42.92 39.47 2fm8 s ASP 5 CO 0.30 -0.33 1.66 -0.29 0.52 0.00 0.00 175.17 177.02 2fm8 h ILE 6 N 6.16 1.27 -0.54 4.11 6.09 -1.99 -2.00 117.51 130.62 2fm8 h ILE 6 Ca -0.23 -1.31 0.05 0.00 -1.37 0.00 0.00 64.86 61.99 2fm8 h ILE 6 Cb 1.08 1.24 -0.05 0.00 0.47 0.00 0.00 36.82 39.57 2fm8 h ILE 6 CO 0.61 0.43 0.27 0.00 -3.07 0.00 0.00 178.15 176.39 2fm8 h ALA 7 N 1.14 0.69 -0.11 0.18 0.00 -1.98 -1.48 119.26 117.69 2fm8 h ALA 7 Ca 0.09 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 2fm8 h ALA 7 Cb 0.71 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2fm8 h ALA 7 CO 0.05 -0.07 -0.49 0.93 0.00 0.00 0.00 179.25 179.67 2fm8 h GLU 8 N 0.53 0.29 -0.46 0.00 4.39 -1.94 -1.76 114.58 115.62 2fm8 h GLU 8 Ca 0.24 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.66 2fm8 h GLU 8 Cb 0.15 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 2fm8 h GLU 8 CO -0.17 0.72 -0.18 1.25 -1.16 0.00 0.00 179.01 179.48 2fm8 h LEU 9 N 0.23 0.90 -0.26 1.33 5.85 -0.94 0.98 115.31 123.40 2fm8 h LEU 9 Ca 0.01 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 2fm8 h LEU 9 Cb 0.95 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 2fm8 h LEU 9 CO 0.08 1.06 -0.04 0.58 -0.34 0.00 0.00 178.44 179.78 2fm8 h VAL 10 N 0.78 1.28 -0.19 1.05 2.07 -1.24 -0.14 116.25 119.86 2fm8 h VAL 10 Ca 0.11 -1.03 0.03 0.00 0.82 0.00 0.00 66.70 66.64 2fm8 h VAL 10 Cb 0.72 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 2fm8 h VAL 10 CO 0.06 0.32 -0.01 0.03 0.02 0.00 0.00 177.57 177.99 2fm8 h ARG 11 N 0.25 0.05 -0.49 1.57 3.08 -1.10 -0.79 114.38 116.94 2fm8 h ARG 11 Ca 0.07 -0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.17 2fm8 h ARG 11 Cb 0.50 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.49 2fm8 h ARG 11 CO 0.02 0.03 0.20 1.03 -1.07 0.00 0.00 179.97 180.19 2fm8 h SER 12 N 0.05 0.24 -0.77 7.04 0.87 -0.72 0.07 113.55 120.33 2fm8 h SER 12 Ca 0.09 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 2fm8 h SER 12 Cb 0.11 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 2fm8 h SER 12 CO -0.16 0.17 0.31 0.00 -0.53 0.00 0.00 176.83 176.63 2fm8 h ALA 13 N 1.31 1.08 -0.11 6.23 0.00 -0.55 -1.52 119.26 125.69 2fm8 h ALA 13 Ca 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2fm8 h ALA 13 Cb 0.21 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2fm8 h ALA 13 CO -0.21 0.66 0.04 -0.07 0.00 0.00 0.00 179.25 179.66 2fm8 h LEU 14 N 1.13 0.16 -0.42 0.00 3.38 -0.76 -2.92 115.31 115.88 2fm8 h LEU 14 Ca 0.26 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.11 2fm8 h LEU 14 Cb 0.21 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 2fm8 h LEU 14 CO -0.02 0.31 0.06 -0.33 0.09 0.00 0.00 178.44 178.55 2fm8 h GLU 15 N -0.00 0.18 0.00 1.13 5.08 -0.59 -0.20 114.58 120.17 2fm8 h GLU 15 Ca 0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2fm8 h GLU 15 Cb 0.21 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2fm8 h GLU 15 CO -0.00 0.12 0.00 1.55 -1.00 0.00 0.00 179.01 179.68 2fm8 n VAL 16 N -5.13 0.48 0.82 3.13 3.14 -0.61 -1.18 118.33 118.98 2fm8 n VAL 16 Ca 0.03 0.12 0.12 0.00 -2.96 0.00 0.00 64.34 61.65 2fm8 n VAL 16 Cb 0.21 -0.74 0.27 0.00 -1.06 0.00 0.00 33.84 32.52 2fm8 n VAL 16 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2fm8 n SER 17 N -1.50 2.67 0.00 6.55 7.64 -0.61 -4.94 113.62 123.43 2fm8 n SER 17 Ca 0.05 -1.87 0.00 0.00 1.01 0.00 0.00 58.87 58.07 2fm8 n SER 17 Cb 0.26 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2fm8 n SER 17 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fm8 n GLY 18 N 1.34 0.47 4.02 0.23 0.00 -0.32 -5.06 105.19 105.86 2fm8 n GLY 18 Ca 0.17 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 45.05 2fm8 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fm8 n ASP 20 N -2.23 0.00 -1.23 0.00 2.03 -1.26 -4.23 116.55 109.62 2fm8 n ASP 20 Ca 0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.45 2fm8 n ASP 20 Cb 0.61 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 2fm8 n ASP 20 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2fm8 n SER 31 N 0.00 -2.97 -4.30 1.67 7.64 -1.26 -4.66 113.62 109.75 2fm8 n SER 31 Ca 0.00 0.47 -0.52 0.00 1.01 0.00 0.00 58.87 59.83 2fm8 n SER 31 Cb 0.00 -2.74 -0.05 0.00 -1.01 0.00 0.00 64.21 60.41 2fm8 n SER 31 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2fm8 n THR 32 N -1.20 0.90 -3.26 0.44 -1.04 -1.26 -4.92 114.28 103.94 2fm8 n THR 32 Ca 0.00 -0.23 -0.39 0.00 -2.04 0.00 0.00 64.05 61.39 2fm8 n THR 32 Cb 0.03 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.47 2fm8 n THR 32 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2fm8 s ILE 33 N -0.45 5.11 -0.44 12.58 1.01 0.13 -4.94 121.20 134.21 2fm8 s ILE 33 Ca 0.76 0.91 -0.18 0.00 0.00 0.00 0.00 60.65 62.13 2fm8 s ILE 33 Cb -1.07 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 37.60 2fm8 s ILE 33 CO 0.55 0.17 0.51 -0.69 0.00 0.00 0.00 174.94 175.48 2fm8 s VAL 34 N 1.73 4.99 -0.50 2.92 1.01 -1.26 -0.10 120.40 129.19 2fm8 s VAL 34 Ca 0.23 -0.26 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 2fm8 s VAL 34 Cb -0.15 -4.12 0.06 0.00 0.00 0.00 0.00 36.38 32.17 2fm8 s VAL 34 CO 0.09 -0.52 0.56 -0.22 0.00 0.00 0.00 175.10 175.01 2fm8 s LEU 35 N 2.37 5.19 -0.38 3.92 2.96 0.23 -4.97 118.68 128.00 2fm8 s LEU 35 Ca 0.15 -1.06 0.03 0.00 -0.22 0.00 0.00 54.13 53.03 2fm8 s LEU 35 Cb -0.17 -2.36 0.11 0.00 0.50 0.00 0.00 46.19 44.27 2fm8 s LEU 35 CO 0.15 -0.83 0.11 -0.62 -1.32 0.00 0.00 176.35 173.84 2fm8 s ASP 36 N 2.70 4.74 0.31 3.68 2.15 -1.26 -1.90 116.67 127.10 2fm8 s ASP 36 Ca 0.12 -2.31 0.07 0.00 0.43 0.00 0.00 52.55 50.86 2fm8 s ASP 36 Cb -0.21 -1.65 -0.03 0.00 -0.30 0.00 0.00 42.92 40.73 2fm8 s ASP 36 CO 0.10 -0.37 0.27 -0.76 -0.17 0.00 0.00 175.17 174.24 2fm8 s LEU 37 N 0.70 3.71 0.23 -1.34 1.43 -1.26 -5.05 118.68 117.09 2fm8 s LEU 37 Ca 0.12 -0.39 -0.32 0.00 -1.03 0.00 0.00 54.13 52.52 2fm8 s LEU 37 Cb -0.21 -2.30 -0.12 0.00 0.03 0.00 0.00 46.19 43.59 2fm8 s LEU 37 CO -0.06 -0.25 1.66 0.33 0.23 0.00 0.00 176.35 178.25 2fm8 n PHE 38 N -1.33 2.70 -1.53 0.29 7.35 -1.26 -2.52 117.46 121.17 2fm8 n PHE 38 Ca -0.04 0.15 -0.18 0.00 -0.76 0.00 0.00 57.45 56.62 2fm8 n PHE 38 Cb 0.59 -2.63 -0.08 0.00 0.35 0.00 0.00 39.48 37.71 2fm8 n PHE 38 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2fm8 n ALA 39 N 3.29 -0.28 -2.60 3.13 0.00 -1.26 -4.97 120.51 117.82 2fm8 n ALA 39 Ca 0.14 0.29 -0.22 0.00 0.00 0.00 0.00 53.44 53.66 2fm8 n ALA 39 Cb 0.34 -1.97 -0.13 0.00 0.00 0.00 0.00 19.45 17.69 2fm8 n ALA 39 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fm8 s LEU 40 N -4.17 2.23 0.70 0.00 1.43 -1.05 -5.14 118.68 112.69 2fm8 s LEU 40 Ca 0.00 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.39 2fm8 s LEU 40 Cb 0.00 -0.73 0.02 0.00 0.03 0.00 0.00 46.19 45.51 2fm8 s LEU 40 CO 0.00 0.04 1.10 -2.16 0.23 0.00 0.00 176.35 175.56 2fm8 s PRO 41 N -1.52 2.60 0.21 1.29 0.04 -1.26 -4.39 135.00 131.97 2fm8 s PRO 41 Ca 0.03 1.28 -0.30 0.00 0.04 0.00 0.00 61.00 62.05 2fm8 s PRO 41 Cb -0.09 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 2fm8 s PRO 41 CO 0.02 -1.39 1.32 -1.12 0.04 0.00 0.00 177.00 175.87 2fm8 s SER 42 N -2.96 6.88 0.19 6.66 0.01 -1.26 -4.65 113.70 118.57 2fm8 s SER 42 Ca 0.64 2.43 0.05 0.00 1.31 0.00 0.00 55.95 60.38 2fm8 s SER 42 Cb -0.19 -2.61 -0.05 0.00 0.21 0.00 0.00 66.02 63.38 2fm8 s SER 42 CO 0.48 -0.54 -0.08 0.27 0.41 0.00 0.00 173.24 173.78 2fm8 s ILE 43 N 0.06 1.29 -0.02 1.44 -4.36 -0.80 -4.77 121.20 114.03 2fm8 s ILE 43 Ca 0.56 -2.09 0.07 0.00 -0.26 0.00 0.00 60.65 58.93 2fm8 s ILE 43 Cb -0.37 -2.05 -0.02 0.00 1.25 0.00 0.00 42.46 41.27 2fm8 s ILE 43 CO 0.39 -0.58 -0.22 0.00 0.24 0.00 0.00 174.94 174.77 2fm8 s ILE 45 N -0.67 1.23 0.03 0.00 1.01 0.86 -1.12 121.20 122.53 2fm8 s ILE 45 Ca 0.11 -0.47 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 2fm8 s ILE 45 Cb -0.10 -1.16 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 2fm8 s ILE 45 CO -0.00 0.39 0.03 -0.94 0.00 0.00 0.00 174.94 174.42 2fm8 s SER 46 N 1.14 0.23 -0.19 3.58 1.04 -0.70 0.19 113.70 118.98 2fm8 s SER 46 Ca -0.05 -0.54 -0.08 0.00 0.48 0.00 0.00 55.95 55.77 2fm8 s SER 46 Cb -0.14 0.17 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 2fm8 s SER 46 CO -0.03 -0.42 0.07 -0.69 0.98 0.00 0.00 173.24 173.15 2fm8 s VAL 47 N -2.16 4.76 -0.07 5.02 1.01 -1.26 -0.99 120.40 126.72 2fm8 s VAL 47 Ca -0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 2fm8 s VAL 47 Cb -0.04 -3.16 0.03 0.00 0.00 0.00 0.00 36.38 33.21 2fm8 s VAL 47 CO -0.03 0.44 0.05 -0.75 0.00 0.00 0.00 175.10 174.82 2fm8 s LYS 48 N 0.53 0.07 -1.44 2.72 2.20 0.92 -4.91 119.74 119.84 2fm8 s LYS 48 Ca 0.03 0.25 -0.07 0.00 -0.36 0.00 0.00 55.97 55.82 2fm8 s LYS 48 Cb -0.13 -0.81 0.05 0.00 -1.51 0.00 0.00 37.83 35.43 2fm8 s LYS 48 CO 0.01 -0.38 0.82 -0.25 -0.36 0.00 0.00 175.35 175.19 2fm8 n ASP 49 N 5.27 -2.97 0.00 1.43 10.43 -1.26 -0.40 116.55 129.05 2fm8 n ASP 49 Ca -0.04 -0.82 0.00 0.00 2.57 0.00 0.00 54.79 56.50 2fm8 n ASP 49 Cb 0.50 -3.87 0.00 0.00 1.84 0.00 0.00 41.12 39.58 2fm8 n ASP 49 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2fm8 n ASP 50 N -2.93 0.00 -4.80 -2.24 8.00 -1.26 -5.02 116.55 108.30 2fm8 n ASP 50 Ca -0.12 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.00 2fm8 n ASP 50 Cb 0.60 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.60 2fm8 n ASP 50 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2fm8 s ASP 51 N -3.53 6.71 -0.22 -2.24 1.01 0.47 -5.08 116.67 113.79 2fm8 s ASP 51 Ca 0.00 0.84 -0.07 0.00 0.71 0.00 0.00 52.55 54.03 2fm8 s ASP 51 Cb 0.00 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 2fm8 s ASP 51 CO 0.00 0.24 0.07 -0.69 0.21 0.00 0.00 175.17 175.00 2fm8 s VAL 52 N -0.55 4.56 -0.03 -1.27 1.01 -1.26 -0.06 120.40 122.80 2fm8 s VAL 52 Ca 0.23 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.15 2fm8 s VAL 52 Cb -0.16 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2fm8 s VAL 52 CO 0.11 0.38 -0.13 0.26 0.00 0.00 0.00 175.10 175.72 2fm8 s TRP 53 N 1.09 2.72 -0.08 5.22 0.52 -0.16 -0.38 118.94 127.88 2fm8 s TRP 53 Ca 0.04 -0.14 0.04 0.00 0.02 0.00 0.00 56.10 56.07 2fm8 s TRP 53 Cb -0.14 -1.61 -0.01 0.00 -1.15 0.00 0.00 33.47 30.56 2fm8 s TRP 53 CO 0.03 0.24 -0.22 0.42 0.02 0.00 0.00 176.95 177.44 2fm8 s ILE 54 N -0.81 2.31 0.25 2.03 1.01 -0.39 -1.71 121.20 123.89 2fm8 s ILE 54 Ca 0.13 -0.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.64 2fm8 s ILE 54 Cb -0.11 -1.88 0.02 0.00 0.01 0.00 0.00 42.46 40.50 2fm8 s ILE 54 CO 0.02 0.56 0.61 -1.66 0.00 0.00 0.00 174.94 174.47 2fm8 s TRP 55 N -0.03 -0.04 -0.04 3.97 -2.14 -0.28 0.04 118.94 120.42 2fm8 s TRP 55 Ca -0.07 -0.36 -0.26 0.00 2.66 0.00 0.00 56.10 58.08 2fm8 s TRP 55 Cb -0.15 0.49 0.06 0.00 -3.10 0.00 0.00 33.47 30.77 2fm8 s TRP 55 CO 0.05 -1.08 0.57 0.00 -2.66 0.00 0.00 176.95 173.83 2fm8 s ALA 56 N -3.93 -1.49 0.48 2.67 0.00 -0.83 -0.46 121.76 118.21 2fm8 s ALA 56 Ca 0.13 1.04 -0.18 0.00 0.00 0.00 0.00 51.96 52.95 2fm8 s ALA 56 Cb -0.03 0.02 -0.09 0.00 0.00 0.00 0.00 23.12 23.01 2fm8 s ALA 56 CO 0.04 -0.34 0.97 -0.65 0.00 0.00 0.00 175.76 175.78 2fm8 s GLN 57 N -1.22 4.05 0.00 0.00 -0.21 -1.26 -1.36 119.66 119.66 2fm8 s GLN 57 Ca -0.12 1.00 0.07 0.00 0.02 0.00 0.00 55.36 56.34 2fm8 s GLN 57 Cb -0.02 -2.16 0.15 0.00 1.00 0.00 0.00 33.01 31.98 2fm8 s GLN 57 CO 0.08 -0.17 0.99 1.28 -2.12 0.00 0.00 175.29 175.35 2fm8 n LEU 58 N -1.22 2.22 0.00 2.90 4.77 0.30 -4.90 117.00 121.06 2fm8 n LEU 58 Ca 0.07 -1.58 0.00 0.00 -0.03 0.00 0.00 56.01 54.46 2fm8 n LEU 58 Cb 0.54 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2fm8 n LEU 58 CO 0.43 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2fm8 n GLY 59 N 0.29 3.24 0.35 -0.72 0.00 -1.26 -4.62 105.19 102.47 2fm8 n GLY 59 Ca 0.06 -1.95 0.13 0.00 0.00 0.00 0.00 46.02 44.26 2fm8 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fm8 h ALA 60 N 0.00 1.64 -0.22 4.61 0.00 -1.98 -2.24 119.26 121.06 2fm8 h ALA 60 Ca 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2fm8 h ALA 60 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2fm8 h ALA 60 CO 0.00 -0.08 -0.01 -0.40 0.00 0.00 0.00 179.25 178.76 2fm8 n ASP 61 N -4.80 3.50 0.16 0.00 5.75 -1.26 -4.68 116.55 115.22 2fm8 n ASP 61 Ca 0.23 -3.09 0.04 0.00 -0.01 0.00 0.00 54.79 51.96 2fm8 n ASP 61 Cb 0.58 -0.53 0.46 0.00 -1.03 0.00 0.00 41.12 40.59 2fm8 n ASP 61 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2fm8 h SER 62 N 1.42 0.14 0.60 -1.12 4.64 -1.66 -0.69 113.55 116.88 2fm8 h SER 62 Ca 0.02 -0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 2fm8 h SER 62 Cb 1.38 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.43 2fm8 h SER 62 CO 0.20 0.27 -0.27 0.24 -0.87 0.00 0.00 176.83 176.40 2fm8 h MET 63 N 0.15 0.00 0.06 4.77 2.86 -1.81 -0.78 114.93 120.18 2fm8 h MET 63 Ca 0.03 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.49 2fm8 h MET 63 Cb 0.29 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.97 2fm8 h MET 63 CO 0.02 0.27 -0.73 0.28 1.06 0.00 0.00 176.91 177.80 2fm8 h VAL 64 N 0.00 1.44 -0.02 -2.22 2.07 -1.50 -3.27 116.25 112.76 2fm8 h VAL 64 Ca -0.00 -2.26 -0.12 0.00 0.82 0.00 0.00 66.70 65.14 2fm8 h VAL 64 Cb 0.64 2.80 -0.02 0.00 -1.52 0.00 0.00 31.29 33.19 2fm8 h VAL 64 CO 0.03 0.65 -0.54 0.58 0.02 0.00 0.00 177.57 178.32 2fm8 h VAL 65 N -0.16 1.38 -0.37 2.57 2.07 -1.33 -2.66 116.25 117.76 2fm8 h VAL 65 Ca -0.11 -1.84 0.08 0.00 0.82 0.00 0.00 66.70 65.65 2fm8 h VAL 65 Cb 1.47 1.97 -0.07 0.00 -1.52 0.00 0.00 31.29 33.14 2fm8 h VAL 65 CO 0.14 0.53 -0.11 0.25 0.02 0.00 0.00 177.57 178.40 2fm8 h LEU 66 N 0.04 -0.40 -0.55 2.57 5.85 -1.23 0.14 115.31 121.73 2fm8 h LEU 66 Ca -0.00 0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.86 2fm8 h LEU 66 Cb 0.96 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 2fm8 h LEU 66 CO 0.07 -0.14 0.33 -0.61 -0.34 0.00 0.00 178.44 177.75 2fm8 h GLN 67 N -0.03 0.64 -0.28 1.25 4.15 -1.53 0.58 115.11 119.89 2fm8 h GLN 67 Ca 0.18 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.49 2fm8 h GLN 67 Cb 0.30 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 2fm8 h GLN 67 CO -0.40 0.42 -0.15 0.37 -1.93 0.00 0.00 178.83 177.15 2fm8 h GLN 68 N 0.66 0.49 0.00 1.69 4.15 -1.13 -3.31 115.11 117.65 2fm8 h GLN 68 Ca 0.22 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.45 2fm8 h GLN 68 Cb 0.03 -0.05 -0.10 0.00 0.21 0.00 0.00 27.48 27.57 2fm8 h GLN 68 CO -0.10 0.63 -0.63 0.54 -1.93 0.00 0.00 178.83 177.34 2fm8 n ARG 69 N -4.19 1.17 -0.18 1.69 1.74 0.43 -4.87 116.66 112.45 2fm8 n ARG 69 Ca 0.00 -2.95 -0.01 0.00 -0.77 0.00 0.00 57.85 54.13 2fm8 n ARG 69 Cb 0.34 -1.20 0.09 0.00 -1.02 0.00 0.00 32.46 30.67 2fm8 n ARG 69 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2fm8 h ALA 70 N 0.97 0.63 0.22 7.54 0.00 -0.97 -0.99 119.26 126.66 2fm8 h ALA 70 Ca -0.06 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2fm8 h ALA 70 Cb 1.23 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2fm8 h ALA 70 CO 0.03 -0.32 -0.10 -0.92 0.00 0.00 0.00 179.25 177.93 2fm8 h TYR 71 N 0.23 -0.27 -0.66 0.00 3.20 -1.89 0.24 116.97 117.81 2fm8 h TYR 71 Ca 0.29 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.21 2fm8 h TYR 71 Cb 0.42 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.73 2fm8 h TYR 71 CO -0.26 -0.09 0.36 0.93 -1.64 0.00 0.00 178.16 177.47 2fm8 h GLU 72 N -0.40 0.65 -0.30 1.82 3.07 -1.89 0.12 114.58 117.65 2fm8 h GLU 72 Ca -0.03 -0.04 -0.09 0.00 -0.50 0.00 0.00 59.36 58.70 2fm8 h GLU 72 Cb 0.30 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 2fm8 h GLU 72 CO 0.05 0.43 -0.16 0.82 -1.40 0.00 0.00 179.01 178.75 2fm8 h ILE 73 N 0.67 1.29 -0.88 3.13 2.04 -0.86 -2.75 117.51 120.15 2fm8 h ILE 73 Ca 0.30 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 2fm8 h ILE 73 Cb 0.20 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.70 2fm8 h ILE 73 CO -0.19 0.41 0.51 0.25 0.00 0.00 0.00 178.15 179.13 2fm8 h LEU 74 N 0.40 1.07 -1.39 1.44 5.85 0.10 -2.06 115.31 120.72 2fm8 h LEU 74 Ca 0.07 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.72 2fm8 h LEU 74 Cb 0.69 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 2fm8 h LEU 74 CO 0.05 0.84 0.42 0.24 -0.34 0.00 0.00 178.44 179.64 2fm8 h MET 75 N 1.22 0.82 -0.27 1.25 2.86 -0.66 -0.75 114.93 119.39 2fm8 h MET 75 Ca 0.31 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.80 2fm8 h MET 75 Cb -0.02 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.45 2fm8 h MET 75 CO -0.06 0.54 -0.25 1.15 1.06 0.00 0.00 176.91 179.36 2fm8 h THR 76 N 0.84 1.31 -0.75 2.22 2.02 -1.17 -2.82 112.91 114.55 2fm8 h THR 76 Ca 0.24 -1.41 0.07 0.00 0.77 0.00 0.00 66.41 66.08 2fm8 h THR 76 Cb -0.07 1.61 -0.06 0.00 -1.74 0.00 0.00 68.15 67.89 2fm8 h THR 76 CO -0.05 0.45 0.43 0.40 0.37 0.00 0.00 175.52 177.11 2fm8 h ILE 77 N 0.38 0.96 0.00 3.11 2.04 -0.98 -2.09 117.51 120.93 2fm8 h ILE 77 Ca 0.05 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2fm8 h ILE 77 Cb 0.81 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 2fm8 h ILE 77 CO 0.06 0.14 0.00 0.23 0.00 0.00 0.00 178.15 178.58 2fm8 n MET 78 N -4.74 0.09 0.12 2.37 2.81 -0.32 -1.96 117.12 115.48 2fm8 n MET 78 Ca 0.11 0.39 0.12 0.00 -1.81 0.00 0.00 57.70 56.51 2fm8 n MET 78 Cb 0.20 -1.69 0.45 0.00 -0.71 0.00 0.00 33.22 31.48 2fm8 n MET 78 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2fm8 n GLU 79 N -1.86 0.23 0.00 0.03 -0.58 -0.79 -5.01 120.64 112.66 2fm8 n GLU 79 Ca 0.02 0.32 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 2fm8 n GLU 79 Cb 0.16 -1.84 0.00 0.00 -0.57 0.00 0.00 31.44 29.19 2fm8 n GLU 79 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2fm8 n GLY 80 N 0.65 -0.09 3.16 0.62 0.00 -0.83 -5.00 105.19 103.69 2fm8 n GLY 80 Ca 0.04 -1.86 -0.04 0.00 0.00 0.00 0.00 46.02 44.15 2fm8 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fm8 h HIS 82 N 8.10 0.00 -0.01 0.00 3.86 -1.95 -2.85 115.15 122.30 2fm8 h HIS 82 Ca -0.19 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2fm8 h HIS 82 Cb 1.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.61 2fm8 h HIS 82 CO 0.16 0.19 -0.14 1.97 0.86 0.00 0.00 177.93 180.96 2fm8 n PHE 83 N -4.00 0.00 -3.38 2.45 1.16 -1.26 -4.89 117.46 107.54 2fm8 n PHE 83 Ca -0.02 0.00 -0.35 0.00 -1.87 0.00 0.00 57.45 55.21 2fm8 n PHE 83 Cb 0.27 -0.04 -0.06 0.00 -1.61 0.00 0.00 39.48 38.04 2fm8 n PHE 83 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2fm8 s ALA 84 N -2.23 3.59 0.22 1.98 0.00 -1.08 -1.34 121.76 122.91 2fm8 s ALA 84 Ca 0.30 -0.16 -0.32 0.00 0.00 0.00 0.00 51.96 51.78 2fm8 s ALA 84 Cb 0.20 -2.49 -0.13 0.00 0.00 0.00 0.00 23.12 20.69 2fm8 s ALA 84 CO 0.42 0.47 1.46 0.54 0.00 0.00 0.00 175.76 178.65 2fm8 n ARG 85 N 0.78 2.08 -0.29 0.00 5.12 0.10 -1.48 116.66 122.97 2fm8 n ARG 85 Ca -0.05 0.74 0.00 0.00 -1.93 0.00 0.00 57.85 56.61 2fm8 n ARG 85 Cb 0.52 -2.44 0.00 0.00 -1.16 0.00 0.00 32.46 29.38 2fm8 n ARG 85 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2fm8 n GLY 86 N 2.51 1.95 2.14 -0.13 0.00 -1.26 -3.91 105.19 106.49 2fm8 n GLY 86 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 2fm8 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fm8 n GLY 87 N -2.00 0.58 3.11 -0.02 0.00 -0.55 -5.02 105.19 101.30 2fm8 n GLY 87 Ca 0.00 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 2fm8 n GLY 87 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fm8 s GLN 88 N -1.64 0.27 0.63 1.61 0.74 -1.25 -0.69 119.66 119.33 2fm8 s GLN 88 Ca 0.00 0.46 -0.16 0.00 0.05 0.00 0.00 55.36 55.71 2fm8 s GLN 88 Cb 0.00 0.03 -0.02 0.00 1.10 0.00 0.00 33.01 34.12 2fm8 s GLN 88 CO 0.00 -0.10 1.10 -0.51 -0.55 0.00 0.00 175.29 175.23 2fm8 s LEU 89 N 0.68 3.47 0.13 3.68 1.43 -1.26 -4.77 118.68 122.05 2fm8 s LEU 89 Ca -0.04 1.98 0.09 0.00 -1.03 0.00 0.00 54.13 55.12 2fm8 s LEU 89 Cb -0.06 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.57 2fm8 s LEU 89 CO -0.04 -1.46 -0.14 -0.76 0.23 0.00 0.00 176.35 174.18 2fm8 s LEU 90 N -4.62 2.85 -0.14 1.79 1.43 0.46 -4.97 118.68 115.47 2fm8 s LEU 90 Ca 0.67 -0.54 -0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2fm8 s LEU 90 Cb -0.20 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 2fm8 s LEU 90 CO 0.38 0.15 0.06 -0.76 0.23 0.00 0.00 176.35 176.42 2fm8 s LEU 91 N -2.37 3.87 0.00 1.79 1.43 -1.26 -0.26 118.68 121.88 2fm8 s LEU 91 Ca 0.21 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 2fm8 s LEU 91 Cb -0.10 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.17 2fm8 s LEU 91 CO 0.12 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.60 2fm8 n GLY 92 N 2.80 5.02 3.02 -3.19 0.00 -0.38 -4.96 105.19 107.50 2fm8 n GLY 92 Ca -0.18 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 43.99 2fm8 n GLY 92 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fm8 s GLU 93 N -0.54 0.17 -0.06 1.61 2.12 -1.26 -1.03 118.70 119.71 2fm8 s GLU 93 Ca 0.00 0.49 -0.03 0.00 0.36 0.00 0.00 54.97 55.79 2fm8 s GLU 93 Cb 0.00 -0.14 0.03 0.00 0.26 0.00 0.00 34.13 34.28 2fm8 s GLU 93 CO 0.00 -0.17 0.13 -1.14 -0.54 0.00 0.00 175.26 173.55 2fm8 s GLN 94 N 1.25 0.10 -1.31 4.30 0.74 0.01 -4.87 119.66 119.87 2fm8 s GLN 94 Ca -0.09 0.30 -0.05 0.00 0.05 0.00 0.00 55.36 55.56 2fm8 s GLN 94 Cb -0.11 -0.10 0.03 0.00 1.10 0.00 0.00 33.01 33.93 2fm8 s GLN 94 CO -0.08 -0.12 0.37 0.09 -0.55 0.00 0.00 175.29 175.01 2fm8 n ASN 95 N 3.82 -4.45 0.00 6.67 3.02 -1.26 -0.99 115.26 122.07 2fm8 n ASN 95 Ca -0.22 -0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.13 2fm8 n ASN 95 Cb 0.54 -3.68 0.00 0.00 -0.61 0.00 0.00 39.78 36.03 2fm8 n ASN 95 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fm8 n GLY 96 N -1.16 0.74 3.59 7.41 0.00 -1.26 -5.03 105.19 109.48 2fm8 n GLY 96 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 2fm8 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fm8 s GLU 97 N -0.01 2.40 0.36 1.61 2.02 -0.16 -4.58 118.70 120.33 2fm8 s GLU 97 Ca 0.00 -0.83 -0.28 0.00 0.02 0.00 0.00 54.97 53.87 2fm8 s GLU 97 Cb 0.00 -2.43 -0.11 0.00 0.10 0.00 0.00 34.13 31.70 2fm8 s GLU 97 CO 0.00 0.57 1.45 -1.17 0.02 0.00 0.00 175.26 176.13 2fm8 s LEU 98 N -1.71 4.35 0.09 1.80 2.96 -1.26 -0.81 118.68 124.09 2fm8 s LEU 98 Ca 0.19 2.95 0.08 0.00 -0.22 0.00 0.00 54.13 57.13 2fm8 s LEU 98 Cb -0.11 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 2fm8 s LEU 98 CO 0.10 -0.79 -0.19 0.42 -1.32 0.00 0.00 176.35 174.57 2fm8 s THR 99 N -1.01 2.74 -0.20 3.68 -4.23 -0.20 -0.54 115.64 115.88 2fm8 s THR 99 Ca 0.53 -1.41 -0.08 0.00 -1.18 0.00 0.00 61.69 59.55 2fm8 s THR 99 Cb -0.45 -2.21 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 2fm8 s THR 99 CO 0.59 0.19 0.08 -0.22 -0.54 0.00 0.00 174.62 174.72 2fm8 s LEU 100 N -1.86 3.82 -0.01 4.79 2.96 -0.46 -1.25 118.68 126.67 2fm8 s LEU 100 Ca 0.16 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.16 2fm8 s LEU 100 Cb -0.10 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2fm8 s LEU 100 CO 0.08 0.13 -0.12 -0.54 -1.32 0.00 0.00 176.35 174.57 2fm8 s LYS 101 N 0.67 1.03 -0.17 1.98 1.02 0.65 -1.97 119.74 122.94 2fm8 s LYS 101 Ca 0.04 -0.43 0.01 0.00 0.02 0.00 0.00 55.97 55.61 2fm8 s LYS 101 Cb -0.13 -0.98 0.02 0.00 -0.52 0.00 0.00 37.83 36.21 2fm8 s LYS 101 CO 0.02 0.25 -0.20 0.00 -0.92 0.00 0.00 175.35 174.49 2fm8 s ALA 102 N -0.22 2.28 -0.50 5.17 0.00 0.11 -0.41 121.76 128.20 2fm8 s ALA 102 Ca 0.03 -1.17 -0.27 0.00 0.00 0.00 0.00 51.96 50.56 2fm8 s ALA 102 Cb -0.05 -1.13 0.03 0.00 0.00 0.00 0.00 23.12 21.97 2fm8 s ALA 102 CO -0.00 -0.28 1.02 -1.17 0.00 0.00 0.00 175.76 175.33 2fm8 s LEU 103 N 1.19 3.84 -0.02 0.00 2.96 -1.26 -1.26 118.68 124.13 2fm8 s LEU 103 Ca 0.02 0.12 -0.30 0.00 -0.22 0.00 0.00 54.13 53.75 2fm8 s LEU 103 Cb -0.14 -3.22 -0.05 0.00 0.50 0.00 0.00 46.19 43.29 2fm8 s LEU 103 CO -0.10 -1.20 1.34 -0.69 -1.32 0.00 0.00 176.35 174.38 2fm8 s VAL 104 N 4.15 3.88 0.30 1.68 1.01 0.49 0.02 120.40 131.94 2fm8 s VAL 104 Ca 0.40 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 63.32 2fm8 s VAL 104 Cb -0.09 -3.80 -0.11 0.00 0.00 0.00 0.00 36.38 32.38 2fm8 s VAL 104 CO 0.26 -0.01 1.47 -2.28 0.00 0.00 0.00 175.10 174.54 2fm8 s HIS 105 N 2.41 2.85 0.57 5.22 2.46 -0.45 -4.66 115.29 123.70 2fm8 s HIS 105 Ca 0.61 1.07 0.27 0.00 0.47 0.00 0.00 55.06 57.48 2fm8 s HIS 105 Cb -0.29 -3.91 1.53 0.00 -0.13 0.00 0.00 32.58 29.78 2fm8 s HIS 105 CO 0.25 -2.84 2.02 -1.35 -2.47 0.00 0.00 174.74 170.35 2fm8 h PRO 106 N 4.21 0.00 -0.06 2.88 0.11 -1.93 0.71 132.00 137.92 2fm8 h PRO 106 Ca -0.48 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.65 2fm8 h PRO 106 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2fm8 h PRO 106 CO 0.73 0.00 0.16 -0.44 -0.21 0.00 0.00 178.00 178.24 2fm8 h ASP 107 N 0.00 0.00 -0.55 -2.05 3.32 -1.95 -1.35 116.42 113.84 2fm8 h ASP 107 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2fm8 h ASP 107 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 2fm8 h ASP 107 CO -0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 2fm8 n PHE 108 N -3.26 1.24 0.05 4.55 3.72 0.24 -4.29 117.46 119.71 2fm8 n PHE 108 Ca -0.01 -0.63 0.03 0.00 -0.05 0.00 0.00 57.45 56.79 2fm8 n PHE 108 Cb 0.24 -0.21 0.06 0.00 -0.94 0.00 0.00 39.48 38.63 2fm8 n PHE 108 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2fm8 n LEU 109 N 0.82 2.09 0.14 4.37 4.77 -0.51 -2.99 117.00 125.69 2fm8 n LEU 109 Ca 0.23 -1.59 0.01 0.00 -0.03 0.00 0.00 56.01 54.63 2fm8 n LEU 109 Cb 0.81 -0.07 0.17 0.00 -2.33 0.00 0.00 43.42 42.00 2fm8 n LEU 109 CO 0.20 0.50 0.50 0.77 -1.33 0.00 0.00 177.39 178.03 2fm8 h SER 110 N 1.12 0.00 -5.36 -1.43 4.64 -1.75 -3.48 113.55 107.30 2fm8 h SER 110 Ca 0.00 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.48 2fm8 h SER 110 Cb 0.47 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.51 2fm8 h SER 110 CO 0.00 0.58 0.53 1.51 -0.87 0.00 0.00 176.83 178.58 2fm8 s ASP 111 N -6.65 -0.06 0.33 4.97 1.47 -1.26 -5.06 116.67 110.41 2fm8 s ASP 111 Ca 0.00 -0.61 0.04 0.00 1.18 0.00 0.00 52.55 53.16 2fm8 s ASP 111 Cb 0.11 0.52 0.58 0.00 -0.34 0.00 0.00 42.92 43.79 2fm8 s ASP 111 CO 0.74 -1.01 1.86 1.23 0.68 0.00 0.00 175.17 178.68 2fm8 h GLY 112 N 2.00 0.58 0.73 2.12 0.00 -1.86 -0.69 103.07 105.95 2fm8 h GLY 112 Ca -0.27 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 2fm8 h GLY 112 CO 0.32 0.33 -0.09 0.83 0.00 0.00 0.00 176.54 177.93 2fm8 h GLU 113 N 0.52 -0.25 -0.52 4.80 4.39 -1.92 -1.03 114.58 120.57 2fm8 h GLU 113 Ca 0.11 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.87 2fm8 h GLU 113 Cb 0.35 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.01 2fm8 h GLU 113 CO 0.01 0.04 0.26 0.87 -1.16 0.00 0.00 179.01 179.03 2fm8 h LYS 114 N -0.54 0.50 -0.22 2.33 1.79 -1.85 -2.66 116.57 115.91 2fm8 h LYS 114 Ca -0.03 -0.03 -0.11 0.00 -2.18 0.00 0.00 60.65 58.30 2fm8 h LYS 114 Cb 0.40 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2fm8 h LYS 114 CO 0.04 0.33 -0.34 0.35 -1.08 0.00 0.00 179.45 178.75 2fm8 h PHE 115 N 0.51 0.54 -0.33 -1.35 3.57 -1.02 -2.25 116.94 116.62 2fm8 h PHE 115 Ca 0.23 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 2fm8 h PHE 115 Cb 0.14 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 2fm8 h PHE 115 CO -0.10 0.75 0.13 0.66 -2.23 0.00 0.00 178.31 177.52 2fm8 h SER 116 N 0.40 0.41 -0.49 0.41 4.64 -0.97 0.17 113.55 118.12 2fm8 h SER 116 Ca 0.05 -0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.21 2fm8 h SER 116 Cb 0.78 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 2fm8 h SER 116 CO 0.06 0.37 -0.17 0.74 -0.87 0.00 0.00 176.83 176.97 2fm8 h THR 117 N 0.46 1.27 -0.31 2.95 2.02 -1.08 0.40 112.91 118.62 2fm8 h THR 117 Ca 0.11 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 65.96 2fm8 h THR 117 Cb 0.09 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 2fm8 h THR 117 CO -0.01 0.46 0.17 0.00 0.37 0.00 0.00 175.52 176.51 2fm8 h ALA 118 N 0.88 0.40 0.31 6.16 0.00 -1.00 -0.27 119.26 125.73 2fm8 h ALA 118 Ca 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2fm8 h ALA 118 Cb 0.74 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2fm8 h ALA 118 CO 0.06 -0.07 -0.15 -0.07 0.00 0.00 0.00 179.25 179.02 2fm8 h LEU 119 N 0.38 -0.35 -0.66 0.00 3.38 -0.79 0.28 115.31 117.56 2fm8 h LEU 119 Ca 0.11 -0.09 0.13 0.00 0.09 0.00 0.00 57.88 58.12 2fm8 h LEU 119 Cb 0.06 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 40.81 2fm8 h LEU 119 CO -0.02 -0.12 0.15 0.78 0.09 0.00 0.00 178.44 179.32 2fm8 h ASN 120 N -0.57 0.01 -0.71 -0.43 2.35 -0.25 -1.12 115.58 114.86 2fm8 h ASN 120 Ca -0.04 0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.82 2fm8 h ASN 120 Cb 0.41 0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.92 2fm8 h ASN 120 CO 0.07 -0.00 0.38 1.23 -1.65 0.00 0.00 177.43 177.46 2fm8 h GLY 121 N 0.27 1.07 0.98 2.83 0.00 -0.85 -1.99 103.07 105.38 2fm8 h GLY 121 Ca 0.35 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.20 2fm8 h GLY 121 CO -0.44 0.47 0.13 -2.75 0.00 0.00 0.00 176.54 173.94 2fm8 h PHE 122 N 0.98 0.24 -0.81 5.60 3.57 -0.05 -1.48 116.94 125.00 2fm8 h PHE 122 Ca 0.25 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 2fm8 h PHE 122 Cb 0.05 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 2fm8 h PHE 122 CO -0.00 0.15 0.53 1.88 -2.23 0.00 0.00 178.31 178.64 2fm8 h TYR 123 N 0.26 0.99 0.09 0.41 -1.99 -0.97 0.20 116.97 115.96 2fm8 h TYR 123 Ca 0.08 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.83 2fm8 h TYR 123 Cb -0.02 -0.33 0.00 0.00 2.00 0.00 0.00 36.73 38.38 2fm8 h TYR 123 CO -0.07 0.61 -0.04 -0.91 -0.00 0.00 0.00 178.16 177.74 2fm8 h ASN 124 N 1.06 -0.10 -0.92 3.88 2.35 -1.04 -1.38 115.58 119.42 2fm8 h ASN 124 Ca 0.30 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2fm8 h ASN 124 Cb -0.07 0.03 -0.05 0.00 0.05 0.00 0.00 38.32 38.29 2fm8 h ASN 124 CO -0.08 0.13 0.58 1.88 -1.65 0.00 0.00 177.43 178.30 2fm8 h TYR 125 N -0.34 1.20 -0.94 1.19 0.05 -1.03 -2.53 116.97 114.57 2fm8 h TYR 125 Ca -0.01 0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 2fm8 h TYR 125 Cb 0.29 -0.40 -0.05 0.00 1.01 0.00 0.00 36.73 37.58 2fm8 h TYR 125 CO -0.00 0.78 0.58 1.25 -1.05 0.00 0.00 178.16 179.72 2fm8 h LEU 126 N 1.27 1.11 -0.59 3.88 5.85 -0.48 -0.84 115.31 125.49 2fm8 h LEU 126 Ca 0.33 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 2fm8 h LEU 126 Cb -0.09 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.63 2fm8 h LEU 126 CO -0.07 0.83 0.33 -0.08 -0.34 0.00 0.00 178.44 179.11 2fm8 h GLU 127 N 1.28 0.83 -0.39 1.25 4.57 -0.92 0.70 114.58 121.89 2fm8 h GLU 127 Ca 0.34 -0.10 0.04 0.00 -1.18 0.00 0.00 59.36 58.46 2fm8 h GLU 127 Cb -0.09 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.30 2fm8 h GLU 127 CO -0.07 0.63 0.16 0.28 -1.18 0.00 0.00 179.01 178.84 2fm8 h VAL 128 N 0.80 0.92 -0.20 0.32 2.07 -1.00 -2.09 116.25 117.07 2fm8 h VAL 128 Ca 0.21 -0.11 -0.13 0.00 0.82 0.00 0.00 66.70 67.48 2fm8 h VAL 128 Cb 0.05 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 2fm8 h VAL 128 CO -0.03 0.06 -0.43 -0.26 0.02 0.00 0.00 177.57 176.92 2fm8 h PHE 129 N 0.33 0.58 -0.61 1.57 0.04 -0.97 -2.36 116.94 115.52 2fm8 h PHE 129 Ca 0.18 -0.17 0.02 0.00 2.80 0.00 0.00 57.97 60.79 2fm8 h PHE 129 Cb 0.13 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.12 2fm8 h PHE 129 CO -0.13 0.84 0.39 0.77 -0.60 0.00 0.00 178.31 179.57 2fm8 h SER 130 N 0.39 0.65 -0.47 2.17 0.02 -0.61 -2.03 113.55 113.67 2fm8 h SER 130 Ca 0.03 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2fm8 h SER 130 Cb 0.92 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 2fm8 h SER 130 CO 0.08 0.46 0.16 0.03 -1.14 0.00 0.00 176.83 176.41 2fm8 h ARG 131 N 0.77 0.79 0.00 3.45 3.08 -1.21 -2.24 114.38 119.02 2fm8 h ARG 131 Ca 0.24 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2fm8 h ARG 131 Cb -0.02 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.90 2fm8 h ARG 131 CO -0.08 0.69 0.00 0.77 -1.07 0.00 0.00 179.97 180.28 2fm8 h SER 132 N 0.77 0.00 -0.02 7.04 0.02 -0.85 -3.15 113.55 117.37 2fm8 h SER 132 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2fm8 h SER 132 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2fm8 h SER 132 CO -0.01 0.00 -0.00 0.18 -1.14 0.00 0.00 176.83 175.86 2fm8 n LEU 133 N -2.98 2.01 -4.72 5.07 4.77 -0.88 -4.99 117.00 115.29 2fm8 n LEU 133 Ca -0.01 -1.00 -0.42 0.00 -0.03 0.00 0.00 56.01 54.56 2fm8 n LEU 133 Cb 0.20 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2fm8 n LEU 133 CO 0.23 0.38 0.82 -0.04 -1.33 0.00 0.00 177.39 177.45 2fm8 s MET 134 N -1.03 4.51 0.00 3.23 -1.94 -1.00 -4.90 119.30 118.18 2fm8 s MET 134 Ca 0.14 1.70 0.00 0.00 -1.71 0.00 0.00 55.69 55.82 2fm8 s MET 134 Cb 0.10 -3.33 0.00 0.00 2.01 0.00 0.00 34.83 33.61 2fm8 s MET 134 CO 0.15 -0.10 0.01 2.89 -0.01 0.00 0.00 175.02 177.97