#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fr8 s VAL 31 N 0.00 4.76 -0.35 0.44 1.01 -1.26 -4.14 120.40 120.85 2fr8 s VAL 31 Ca 0.00 1.56 -0.09 0.00 0.00 0.00 0.00 61.98 63.45 2fr8 s VAL 31 Cb 0.00 -4.20 0.03 0.00 0.00 0.00 0.00 36.38 32.21 2fr8 s VAL 31 CO 0.00 -0.19 0.15 -0.54 0.00 0.00 0.00 175.10 174.52 2fr8 s LYS 32 N 3.04 2.77 0.22 2.72 1.02 -1.26 -5.05 119.74 123.19 2fr8 s LYS 32 Ca 0.37 -1.10 0.00 0.00 0.02 0.00 0.00 55.97 55.27 2fr8 s LYS 32 Cb -0.14 -3.59 -0.04 0.00 -0.52 0.00 0.00 37.83 33.54 2fr8 s LYS 32 CO 0.10 -0.66 0.40 0.00 -0.92 0.00 0.00 175.35 174.26 2fr8 s ALA 33 N 1.49 3.84 0.28 5.17 0.00 -1.26 -0.35 121.76 130.93 2fr8 s ALA 33 Ca 0.01 -0.91 -0.08 0.00 0.00 0.00 0.00 51.96 50.98 2fr8 s ALA 33 Cb -0.19 -1.96 -0.00 0.00 0.00 0.00 0.00 23.12 20.97 2fr8 s ALA 33 CO 0.05 0.36 0.44 0.20 0.00 0.00 0.00 175.76 176.81 2fr8 s GLY 34 N -3.38 0.98 0.44 0.00 0.00 0.45 -4.81 107.32 100.98 2fr8 s GLY 34 Ca 0.38 -1.20 0.06 0.00 0.00 0.00 0.00 44.72 43.95 2fr8 s GLY 34 CO 0.30 -0.85 0.03 -1.35 0.00 0.00 0.00 173.10 171.23 2fr8 s SER 35 N -3.11 4.00 0.30 1.64 1.04 -1.26 -4.29 113.70 112.01 2fr8 s SER 35 Ca 0.27 -1.41 0.01 0.00 0.48 0.00 0.00 55.95 55.30 2fr8 s SER 35 Cb 0.00 -0.17 0.49 0.00 0.10 0.00 0.00 66.02 66.44 2fr8 s SER 35 CO 0.13 -0.57 1.85 0.00 0.98 0.00 0.00 173.24 175.64 2fr8 h ALA 36 N 1.63 1.28 -0.54 5.32 0.00 -1.93 0.30 119.26 125.32 2fr8 h ALA 36 Ca -0.44 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.16 2fr8 h ALA 36 Cb 1.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2fr8 h ALA 36 CO 0.78 0.50 -0.11 0.93 0.00 0.00 0.00 179.25 181.35 2fr8 h GLU 37 N 0.69 1.03 0.00 0.00 3.07 -1.94 -2.26 114.58 115.17 2fr8 h GLU 37 Ca 0.15 -0.38 0.00 0.00 -0.50 0.00 0.00 59.36 58.63 2fr8 h GLU 37 Cb 0.29 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 2fr8 h GLU 37 CO 0.00 1.07 -0.67 -0.40 -1.40 0.00 0.00 179.01 177.61 2fr8 n ASP 38 N -4.14 0.60 0.15 1.42 5.68 -1.14 -3.57 116.55 115.54 2fr8 n ASP 38 Ca 0.02 -0.28 0.00 0.00 -0.50 0.00 0.00 54.79 54.02 2fr8 n ASP 38 Cb 0.40 0.42 0.21 0.00 -1.14 0.00 0.00 41.12 41.01 2fr8 n ASP 38 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2fr8 h ALA 39 N 2.86 0.99 0.00 2.12 0.00 -0.23 -3.18 119.26 121.81 2fr8 h ALA 39 Ca 0.00 -0.51 -0.15 0.00 0.00 0.00 0.00 54.91 54.25 2fr8 h ALA 39 Cb 0.57 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2fr8 h ALA 39 CO 0.00 0.71 -0.70 0.00 0.00 0.00 0.00 179.25 179.26 2fr8 h ALA 40 N 1.43 0.69 0.00 0.00 0.00 -1.46 -3.11 119.26 116.81 2fr8 h ALA 40 Ca -0.01 -0.64 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 2fr8 h ALA 40 Cb 1.05 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2fr8 h ALA 40 CO 0.07 0.87 -0.07 0.74 0.00 0.00 0.00 179.25 180.86 2fr8 h PHE 41 N 0.00 0.00 0.08 0.00 0.04 -1.60 -2.62 116.94 112.84 2fr8 h PHE 41 Ca -0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 2fr8 h PHE 41 Cb 1.37 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.52 2fr8 h PHE 41 CO 0.00 0.07 -0.04 0.82 -0.60 0.00 0.00 178.31 178.56 2fr8 h ILE 42 N 0.00 0.00 0.00 -0.55 1.08 -1.62 -3.20 117.51 113.22 2fr8 h ILE 42 Ca -0.00 -0.58 -0.07 0.00 -0.39 0.00 0.00 64.86 63.81 2fr8 h ILE 42 Cb 0.17 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.91 2fr8 h ILE 42 CO 0.01 0.00 -0.36 0.24 -0.69 0.00 0.00 178.15 177.35 2fr8 h MET 43 N -0.69 0.00 -0.66 2.37 2.86 -1.62 -0.78 114.93 116.41 2fr8 h MET 43 Ca -0.01 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.57 2fr8 h MET 43 Cb 0.08 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 2fr8 h MET 43 CO 0.02 0.36 0.18 0.87 1.06 0.00 0.00 176.91 179.40 2fr8 h LYS 44 N 0.00 1.03 -2.17 1.72 1.79 -1.65 -3.15 116.57 114.14 2fr8 h LYS 44 Ca -0.00 -0.22 -0.72 0.00 -2.18 0.00 0.00 60.65 57.52 2fr8 h LYS 44 Cb 0.68 -0.15 -0.23 0.00 -1.58 0.00 0.00 32.23 30.95 2fr8 h LYS 44 CO 0.05 0.89 1.13 0.09 -1.08 0.00 0.00 179.45 180.53 2fr8 n ASN 45 N -4.25 7.35 -4.09 0.86 3.02 -0.31 -4.90 115.26 112.94 2fr8 n ASN 45 Ca 0.05 -3.56 -0.11 0.00 -0.03 0.00 0.00 54.58 50.93 2fr8 n ASN 45 Cb 0.23 -1.18 -0.11 0.00 -0.61 0.00 0.00 39.78 38.12 2fr8 n ASN 45 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fr8 s ALA 46 N -3.24 0.62 -0.06 5.41 0.00 -1.15 -4.90 121.76 118.44 2fr8 s ALA 46 Ca 0.50 -0.99 0.16 0.00 0.00 0.00 0.00 51.96 51.63 2fr8 s ALA 46 Cb 0.32 0.13 -0.24 0.00 0.00 0.00 0.00 23.12 23.32 2fr8 s ALA 46 CO -0.25 -0.16 0.29 0.45 0.00 0.00 0.00 175.76 176.09 2fr8 n SER 47 N 0.82 1.18 -3.68 0.00 2.88 -1.26 -4.69 113.62 108.87 2fr8 n SER 47 Ca -0.18 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.25 2fr8 n SER 47 Cb 0.58 1.54 -0.11 0.00 -0.75 0.00 0.00 64.21 65.46 2fr8 n SER 47 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2fr8 s LYS 48 N -2.96 0.30 -0.02 -1.46 2.20 -1.26 -1.29 119.74 115.26 2fr8 s LYS 48 Ca -0.07 0.84 0.06 0.00 -0.36 0.00 0.00 55.97 56.44 2fr8 s LYS 48 Cb 0.09 0.09 -0.01 0.00 -1.51 0.00 0.00 37.83 36.49 2fr8 s LYS 48 CO 0.68 -0.22 -0.18 0.08 -0.36 0.00 0.00 175.35 175.35 2fr8 s VAL 49 N 2.02 1.44 -0.16 4.02 1.01 0.34 -2.58 120.40 126.48 2fr8 s VAL 49 Ca -0.05 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2fr8 s VAL 49 Cb -0.11 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 35.10 2fr8 s VAL 49 CO -0.11 0.41 -0.19 0.27 0.00 0.00 0.00 175.10 175.47 2fr8 s ILE 50 N -0.40 1.92 -0.01 2.22 -5.25 -1.02 -2.31 121.20 116.36 2fr8 s ILE 50 Ca 0.06 -0.87 -0.26 0.00 -0.99 0.00 0.00 60.65 58.60 2fr8 s ILE 50 Cb -0.07 -1.74 -0.04 0.00 2.95 0.00 0.00 42.46 43.55 2fr8 s ILE 50 CO -0.01 0.52 0.80 -0.63 -1.79 0.00 0.00 174.94 173.83 2fr8 s ILE 51 N 1.23 4.87 -0.41 8.37 1.01 0.58 -2.14 121.20 134.71 2fr8 s ILE 51 Ca 0.02 1.68 0.04 0.00 0.00 0.00 0.00 60.65 62.38 2fr8 s ILE 51 Cb -0.14 -4.14 0.11 0.00 0.01 0.00 0.00 42.46 38.31 2fr8 s ILE 51 CO -0.10 0.27 0.14 -0.69 0.00 0.00 0.00 174.94 174.56 2fr8 s VAL 52 N 0.52 2.28 0.05 2.92 1.01 0.05 0.80 120.40 128.02 2fr8 s VAL 52 Ca 0.42 -2.67 -0.17 0.00 0.00 0.00 0.00 61.98 59.55 2fr8 s VAL 52 Cb -0.20 -2.64 -0.06 0.00 0.00 0.00 0.00 36.38 33.48 2fr8 s VAL 52 CO 0.23 -0.69 0.50 -2.16 0.00 0.00 0.00 175.10 172.98 2fr8 s PRO 53 N 0.47 4.08 0.00 2.72 0.04 -1.26 -0.71 135.00 140.34 2fr8 s PRO 53 Ca 0.13 0.60 0.00 0.00 0.04 0.00 0.00 61.00 61.78 2fr8 s PRO 53 Cb -0.22 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2fr8 s PRO 53 CO -0.06 0.66 0.00 0.41 0.04 0.00 0.00 177.00 178.05 2fr8 n GLY 54 N 1.74 5.34 0.35 0.56 0.00 -0.01 -4.78 105.19 108.38 2fr8 n GLY 54 Ca -0.12 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.08 2fr8 n GLY 54 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2fr8 h TYR 55 N 0.49 0.95 -0.03 1.61 3.20 -1.80 -2.00 116.97 119.38 2fr8 h TYR 55 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 2fr8 h TYR 55 Cb 0.00 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 37.95 2fr8 h TYR 55 CO 0.00 0.60 0.00 0.78 -1.64 0.00 0.00 178.16 177.90 2fr8 h GLY 56 N 1.02 0.05 1.54 1.82 0.00 -1.42 -0.86 103.07 105.21 2fr8 h GLY 56 Ca 0.27 -0.02 -0.11 0.00 0.00 0.00 0.00 47.33 47.48 2fr8 h GLY 56 CO -0.06 0.02 -0.28 1.98 0.00 0.00 0.00 176.54 178.20 2fr8 h MET 57 N 0.04 0.53 -0.13 4.80 1.85 -1.52 -2.47 114.93 118.04 2fr8 h MET 57 Ca 0.01 -0.22 -0.13 0.00 -0.61 0.00 0.00 59.70 58.75 2fr8 h MET 57 Cb 0.03 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.04 2fr8 h MET 57 CO 0.00 0.76 -0.45 0.00 -0.40 0.00 0.00 176.91 176.83 2fr8 h ALA 58 N 1.24 0.22 -0.97 0.39 0.00 -1.23 -1.59 119.26 117.33 2fr8 h ALA 58 Ca 0.06 -0.48 0.02 0.00 0.00 0.00 0.00 54.91 54.51 2fr8 h ALA 58 Cb 0.73 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 2fr8 h ALA 58 CO 0.06 0.36 0.64 0.28 0.00 0.00 0.00 179.25 180.59 2fr8 h VAL 59 N 0.13 1.22 0.00 0.00 2.07 -1.16 -1.97 116.25 116.55 2fr8 h VAL 59 Ca -0.02 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2fr8 h VAL 59 Cb 1.08 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2fr8 h VAL 59 CO 0.09 0.23 -0.10 0.00 0.02 0.00 0.00 177.57 177.82 2fr8 n ALA 60 N -2.38 2.47 -3.71 1.67 0.00 -0.94 -4.94 120.51 112.69 2fr8 n ALA 60 Ca 0.12 -0.11 -0.22 0.00 0.00 0.00 0.00 53.44 53.24 2fr8 n ALA 60 Cb 0.05 -1.41 0.03 0.00 0.00 0.00 0.00 19.45 18.12 2fr8 n ALA 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fr8 n GLN 61 N -1.85 -4.92 -0.72 0.00 1.13 -0.74 -4.51 117.38 105.77 2fr8 n GLN 61 Ca 0.06 0.62 -0.03 0.00 -1.94 0.00 0.00 57.00 55.71 2fr8 n GLN 61 Cb 0.38 -5.18 0.23 0.00 0.11 0.00 0.00 30.24 25.78 2fr8 n GLN 61 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2fr8 n ALA 62 N -4.28 3.91 -0.01 -1.58 0.00 -0.64 -4.53 120.51 113.39 2fr8 n ALA 62 Ca -0.29 -1.60 -0.13 0.00 0.00 0.00 0.00 53.44 51.41 2fr8 n ALA 62 Cb 0.67 -1.17 -0.14 0.00 0.00 0.00 0.00 19.45 18.81 2fr8 n ALA 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fr8 n GLN 63 N 0.06 0.68 0.01 0.00 3.00 -1.26 -2.14 117.38 117.73 2fr8 n GLN 63 Ca 0.28 0.29 -0.05 0.00 -0.01 0.00 0.00 57.00 57.51 2fr8 n GLN 63 Cb 1.07 -1.77 0.17 0.00 0.00 0.00 0.00 30.24 29.71 2fr8 n GLN 63 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2fr8 h HIS 64 N 0.03 0.56 -0.02 1.08 3.86 -1.90 -1.19 115.15 117.58 2fr8 h HIS 64 Ca -0.33 -0.14 -0.18 0.00 -1.16 0.00 0.00 60.37 58.55 2fr8 h HIS 64 Cb 2.02 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 30.35 2fr8 h HIS 64 CO 0.03 0.76 -0.80 0.00 0.86 0.00 0.00 177.93 178.78 2fr8 h ALA 65 N 1.23 0.61 0.07 2.45 0.00 -1.89 -2.38 119.26 119.36 2fr8 h ALA 65 Ca 0.05 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2fr8 h ALA 65 Cb 0.77 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2fr8 h ALA 65 CO 0.06 0.87 -0.03 1.25 0.00 0.00 0.00 179.25 181.39 2fr8 h LEU 66 N 0.12 -0.08 -1.09 0.00 5.85 -1.19 0.13 115.31 119.05 2fr8 h LEU 66 Ca -0.03 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.51 2fr8 h LEU 66 Cb 1.39 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.38 2fr8 h LEU 66 CO 0.12 0.22 0.61 -0.09 -0.34 0.00 0.00 178.44 178.97 2fr8 h ARG 67 N -0.39 0.99 -0.48 1.25 1.12 -1.30 -1.12 114.38 114.45 2fr8 h ARG 67 Ca -0.01 -0.06 -0.06 0.00 -1.11 0.00 0.00 59.98 58.75 2fr8 h ARG 67 Cb 0.34 -0.22 -0.02 0.00 -0.01 0.00 0.00 29.97 30.06 2fr8 h ARG 67 CO 0.02 0.65 0.08 0.93 -3.11 0.00 0.00 179.97 178.54 2fr8 h GLU 68 N 1.02 0.79 -0.84 0.20 4.39 -1.13 -2.40 114.58 116.59 2fr8 h GLU 68 Ca 0.43 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.93 2fr8 h GLU 68 Cb 0.33 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 2fr8 h GLU 68 CO -0.19 0.79 0.53 1.98 -1.16 0.00 0.00 179.01 180.96 2fr8 h MET 69 N 0.66 1.13 0.36 2.33 4.05 -0.26 -2.98 114.93 120.22 2fr8 h MET 69 Ca 0.15 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.46 2fr8 h MET 69 Cb 0.38 -0.25 0.00 0.00 -0.80 0.00 0.00 31.60 30.94 2fr8 h MET 69 CO 0.01 0.77 -0.17 0.00 0.23 0.00 0.00 176.91 177.74 2fr8 h ALA 70 N 1.43 -0.48 0.00 0.39 0.00 -0.89 -3.06 119.26 116.65 2fr8 h ALA 70 Ca 0.31 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2fr8 h ALA 70 Cb -0.09 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2fr8 h ALA 70 CO -0.06 -0.65 -0.01 0.38 0.00 0.00 0.00 179.25 178.91 2fr8 h ASP 71 N -0.73 0.00 -0.42 0.00 3.04 -1.50 -1.39 116.42 115.42 2fr8 h ASP 71 Ca -0.05 0.00 0.01 0.00 -3.24 0.00 0.00 57.03 53.75 2fr8 h ASP 71 Cb 0.50 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.77 2fr8 h ASP 71 CO 0.08 0.01 0.26 0.58 -2.04 0.00 0.00 179.24 178.13 2fr8 h VAL 72 N 0.00 1.06 -0.12 4.15 2.07 -1.50 -2.39 116.25 119.52 2fr8 h VAL 72 Ca -0.00 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 2fr8 h VAL 72 Cb 0.49 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2fr8 h VAL 72 CO 0.00 0.10 -0.09 -0.07 0.02 0.00 0.00 177.57 177.52 2fr8 h LEU 73 N 0.52 0.30 -1.48 2.57 3.38 -1.19 -2.93 115.31 116.49 2fr8 h LEU 73 Ca 0.16 -0.46 0.10 0.00 0.09 0.00 0.00 57.88 57.78 2fr8 h LEU 73 Cb -0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 2fr8 h LEU 73 CO -0.06 0.69 0.47 0.50 0.09 0.00 0.00 178.44 180.13 2fr8 h LYS 74 N -0.09 0.57 0.00 1.13 3.64 -1.39 0.29 116.57 120.71 2fr8 h LYS 74 Ca 0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2fr8 h LYS 74 Cb 0.59 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2fr8 h LYS 74 CO 0.02 0.37 0.00 -0.22 -2.27 0.00 0.00 179.45 177.36 2fr8 h LYS 75 N 0.58 0.00 -0.06 1.90 3.64 -1.36 -2.79 116.57 118.48 2fr8 h LYS 75 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2fr8 h LYS 75 Cb 0.52 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2fr8 h LYS 75 CO -0.11 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.46 2fr8 n GLU 76 N -2.52 2.33 0.00 1.90 -0.58 0.94 -4.98 120.64 117.73 2fr8 n GLU 76 Ca 0.02 -1.96 0.00 0.00 -0.42 0.00 0.00 57.16 54.80 2fr8 n GLU 76 Cb 0.26 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 2fr8 n GLU 76 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2fr8 n GLY 77 N 1.36 0.96 3.76 0.62 0.00 -0.71 -5.06 105.19 106.11 2fr8 n GLY 77 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2fr8 n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fr8 s VAL 78 N -2.25 2.19 -0.17 1.61 1.01 -0.81 -4.95 120.40 117.04 2fr8 s VAL 78 Ca 0.00 0.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 2fr8 s VAL 78 Cb 0.00 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 2fr8 s VAL 78 CO 0.00 0.01 0.55 -0.70 0.00 0.00 0.00 175.10 174.95 2fr8 s GLU 79 N -2.73 4.25 -0.01 2.72 2.12 -0.41 -4.07 118.70 120.56 2fr8 s GLU 79 Ca 0.67 0.50 0.05 0.00 0.36 0.00 0.00 54.97 56.56 2fr8 s GLU 79 Cb -0.40 -3.53 -0.01 0.00 0.26 0.00 0.00 34.13 30.45 2fr8 s GLU 79 CO 0.49 -0.09 -0.18 0.08 -0.54 0.00 0.00 175.26 175.03 2fr8 s VAL 80 N 1.41 1.40 0.10 3.70 1.01 -1.25 0.13 120.40 126.90 2fr8 s VAL 80 Ca 0.26 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 61.28 2fr8 s VAL 80 Cb -0.16 -1.17 0.05 0.00 0.00 0.00 0.00 36.38 35.10 2fr8 s VAL 80 CO 0.10 0.39 0.47 -0.44 0.00 0.00 0.00 175.10 175.62 2fr8 s SER 81 N -0.44 -0.36 -0.18 3.32 0.01 -0.98 -4.95 113.70 110.11 2fr8 s SER 81 Ca 0.07 -0.09 -0.01 0.00 1.31 0.00 0.00 55.95 57.22 2fr8 s SER 81 Cb -0.07 0.50 0.00 0.00 0.21 0.00 0.00 66.02 66.66 2fr8 s SER 81 CO -0.01 -0.82 -0.13 -0.31 0.41 0.00 0.00 173.24 172.38 2fr8 s TYR 82 N -3.31 2.84 -0.66 2.43 1.51 0.10 0.22 117.35 120.48 2fr8 s TYR 82 Ca -0.00 -1.17 -0.18 0.00 -1.01 0.00 0.00 57.07 54.71 2fr8 s TYR 82 Cb 0.00 -1.97 0.13 0.00 -0.11 0.00 0.00 41.96 40.01 2fr8 s TYR 82 CO -0.09 -0.59 0.74 0.00 -1.11 0.00 0.00 175.55 174.51 2fr8 s ALA 83 N 1.17 3.53 -0.30 3.71 0.00 0.24 -1.72 121.76 128.38 2fr8 s ALA 83 Ca 0.01 -2.48 -0.19 0.00 0.00 0.00 0.00 51.96 49.31 2fr8 s ALA 83 Cb -0.14 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.40 2fr8 s ALA 83 CO -0.05 -2.38 0.56 0.42 0.00 0.00 0.00 175.76 174.31 2fr8 s ILE 84 N 2.23 5.00 0.29 0.00 1.09 -0.34 -4.32 121.20 125.14 2fr8 s ILE 84 Ca 0.14 0.72 -0.19 0.00 -1.10 0.00 0.00 60.65 60.22 2fr8 s ILE 84 Cb -0.21 -3.93 -0.09 0.00 -1.06 0.00 0.00 42.46 37.17 2fr8 s ILE 84 CO 0.02 -0.09 0.78 -2.28 -0.10 0.00 0.00 174.94 173.28 2fr8 s HIS 85 N 2.45 3.54 0.09 3.97 2.46 -1.26 -3.04 115.29 123.51 2fr8 s HIS 85 Ca 0.22 1.42 -0.22 0.00 0.47 0.00 0.00 55.06 56.95 2fr8 s HIS 85 Cb -0.15 -2.67 -0.07 0.00 -0.13 0.00 0.00 32.58 29.56 2fr8 s HIS 85 CO 0.11 0.20 1.37 -1.35 -2.47 0.00 0.00 174.74 172.61 2fr8 h PRO 86 N 2.90 -0.19 -1.00 2.88 0.11 -1.97 -2.96 132.00 131.77 2fr8 h PRO 86 Ca -0.48 0.01 -0.52 0.00 0.11 0.00 0.00 66.00 65.13 2fr8 h PRO 86 Cb 1.19 0.04 -0.30 0.00 0.11 0.00 0.00 31.00 32.04 2fr8 h PRO 86 CO 0.65 -0.13 0.66 1.33 -0.21 0.00 0.00 178.00 180.30 2fr8 n VAL 87 N -4.53 3.19 -2.32 3.15 0.24 -1.26 -4.76 118.33 112.04 2fr8 n VAL 87 Ca -0.01 -1.96 -0.37 0.00 -2.04 0.00 0.00 64.34 59.95 2fr8 n VAL 87 Cb 0.22 -0.56 -0.02 0.00 -1.47 0.00 0.00 33.84 32.01 2fr8 n VAL 87 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2fr8 s ALA 88 N -3.25 3.03 0.00 2.33 0.00 -1.12 -4.76 121.76 117.98 2fr8 s ALA 88 Ca 0.56 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.42 2fr8 s ALA 88 Cb 0.47 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 20.23 2fr8 s ALA 88 CO 0.09 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.71 2fr8 n GLY 89 N 0.45 -0.10 0.00 0.00 0.00 -1.26 -4.47 105.19 99.82 2fr8 n GLY 89 Ca 0.06 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2fr8 n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fr8 n ARG 90 N 3.17 -0.37 -3.87 1.61 5.12 -1.26 -4.76 116.66 116.29 2fr8 n ARG 90 Ca 0.00 -0.32 -0.09 0.00 -1.93 0.00 0.00 57.85 55.51 2fr8 n ARG 90 Cb 0.00 -0.76 -0.07 0.00 -1.16 0.00 0.00 32.46 30.46 2fr8 n ARG 90 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2fr8 s MET 91 N -0.04 0.86 0.10 5.56 0.23 -1.26 -5.08 119.30 119.67 2fr8 s MET 91 Ca 0.00 -0.98 -0.34 0.00 -1.03 0.00 0.00 55.69 53.34 2fr8 s MET 91 Cb 0.00 0.34 -0.14 0.00 -1.53 0.00 0.00 34.83 33.50 2fr8 s MET 91 CO 0.00 -0.27 1.62 -2.30 -2.03 0.00 0.00 175.02 172.04 2fr8 n PRO 92 N -0.07 2.06 -1.35 3.16 -0.02 -1.26 -1.80 135.00 135.72 2fr8 n PRO 92 Ca -0.15 0.75 -0.11 0.00 -2.02 0.00 0.00 63.50 61.97 2fr8 n PRO 92 Cb 0.62 -2.52 -0.05 0.00 -0.02 0.00 0.00 33.50 31.54 2fr8 n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fr8 n GLY 93 N 3.56 1.19 0.19 -1.23 0.00 -1.26 -4.93 105.19 102.71 2fr8 n GLY 93 Ca 0.18 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 2fr8 n GLY 93 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2fr8 h HIS 94 N 0.00 -0.38 -0.62 1.61 2.76 -1.60 -2.54 115.15 114.38 2fr8 h HIS 94 Ca -0.23 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 57.91 2fr8 h HIS 94 Cb 0.73 0.15 -0.03 0.00 1.55 0.00 0.00 27.41 29.82 2fr8 h HIS 94 CO 0.31 -0.22 0.23 0.52 -1.30 0.00 0.00 177.93 177.47 2fr8 h MET 95 N -0.30 0.92 -0.01 5.26 2.86 -1.84 -3.32 114.93 118.51 2fr8 h MET 95 Ca 0.02 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2fr8 h MET 95 Cb 0.30 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2fr8 h MET 95 CO -0.07 0.77 0.01 -0.91 1.06 0.00 0.00 176.91 177.76 2fr8 h ASN 96 N 0.90 0.01 -0.62 1.22 4.21 -1.86 -2.14 115.58 117.32 2fr8 h ASN 96 Ca 0.21 -0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.65 2fr8 h ASN 96 Cb 0.20 -0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.37 2fr8 h ASN 96 CO -0.02 0.08 0.40 1.62 -1.29 0.00 0.00 177.43 178.23 2fr8 h VAL 97 N -0.06 1.16 -0.08 2.81 3.04 -1.61 0.40 116.25 121.91 2fr8 h VAL 97 Ca 0.00 -0.30 -0.06 0.00 -1.01 0.00 0.00 66.70 65.33 2fr8 h VAL 97 Cb 0.07 0.26 0.00 0.00 -2.01 0.00 0.00 31.29 29.61 2fr8 h VAL 97 CO -0.00 0.16 -0.19 -0.07 -1.01 0.00 0.00 177.57 176.45 2fr8 h LEU 98 N 0.84 0.31 -0.51 3.16 3.38 -1.62 0.35 115.31 121.22 2fr8 h LEU 98 Ca 0.23 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 2fr8 h LEU 98 Cb -0.09 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2fr8 h LEU 98 CO -0.05 0.84 0.20 -0.07 0.09 0.00 0.00 178.44 179.45 2fr8 h LEU 99 N -0.21 0.71 -0.74 1.67 3.38 -1.23 -0.31 115.31 118.58 2fr8 h LEU 99 Ca -0.00 -0.17 0.07 0.00 0.09 0.00 0.00 57.88 57.87 2fr8 h LEU 99 Cb 0.79 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 2fr8 h LEU 99 CO 0.04 0.68 0.42 0.00 0.09 0.00 0.00 178.44 179.67 2fr8 h ALA 100 N 1.05 1.02 -0.46 1.53 0.00 -0.17 -1.65 119.26 120.58 2fr8 h ALA 100 Ca 0.17 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 2fr8 h ALA 100 Cb 0.20 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2fr8 h ALA 100 CO -0.01 0.08 -0.06 1.49 0.00 0.00 0.00 179.25 180.75 2fr8 h GLU 101 N 0.74 0.81 0.00 0.00 4.81 -0.64 -2.48 114.58 117.82 2fr8 h GLU 101 Ca 0.34 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2fr8 h GLU 101 Cb 0.25 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2fr8 h GLU 101 CO -0.21 0.85 0.00 0.00 -0.73 0.00 0.00 179.01 178.92 2fr8 n ALA 102 N -2.48 2.37 -3.17 2.92 0.00 -0.15 -4.89 120.51 115.10 2fr8 n ALA 102 Ca 0.02 -0.14 -0.15 0.00 0.00 0.00 0.00 53.44 53.17 2fr8 n ALA 102 Cb 0.34 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 18.49 2fr8 n ALA 102 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2fr8 n ASN 103 N -0.98 -3.59 -4.71 0.00 4.13 -0.72 -4.89 115.26 104.49 2fr8 n ASN 103 Ca 0.17 -0.42 -0.41 0.00 1.68 0.00 0.00 54.58 55.60 2fr8 n ASN 103 Cb 0.08 -3.84 -0.04 0.00 -1.54 0.00 0.00 39.78 34.44 2fr8 n ASN 103 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2fr8 s VAL 104 N -3.25 4.96 0.31 2.41 1.01 -0.78 -5.02 120.40 120.04 2fr8 s VAL 104 Ca 0.21 1.74 -0.29 0.00 0.00 0.00 0.00 61.98 63.64 2fr8 s VAL 104 Cb -0.09 -4.18 -0.10 0.00 0.00 0.00 0.00 36.38 32.01 2fr8 s VAL 104 CO 0.53 0.20 1.34 -2.84 0.00 0.00 0.00 175.10 174.34 2fr8 s PRO 105 N 0.92 4.33 0.45 2.72 0.02 -1.26 -4.72 135.00 137.45 2fr8 s PRO 105 Ca 0.44 2.24 0.20 0.00 0.02 0.00 0.00 61.00 63.91 2fr8 s PRO 105 Cb -0.19 -3.08 1.06 0.00 0.02 0.00 0.00 34.50 32.30 2fr8 s PRO 105 CO 0.23 -0.25 1.94 1.88 -0.33 0.00 0.00 177.00 180.46 2fr8 h TYR 106 N 3.78 0.00 0.00 6.54 0.05 -1.95 -2.43 116.97 122.96 2fr8 h TYR 106 Ca -0.48 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.30 2fr8 h TYR 106 Cb 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 2fr8 h TYR 106 CO 0.57 0.24 0.00 -0.40 -1.05 0.00 0.00 178.16 177.51 2fr8 n ASP 107 N -3.86 0.00 -0.60 3.88 5.68 -1.26 -1.81 116.55 118.59 2fr8 n ASP 107 Ca -0.02 -0.05 0.07 0.00 -0.50 0.00 0.00 54.79 54.29 2fr8 n ASP 107 Cb 0.33 -0.19 0.09 0.00 -1.14 0.00 0.00 41.12 40.20 2fr8 n ASP 107 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2fr8 n GLU 108 N -1.19 1.41 -4.40 0.11 1.02 -0.91 -4.98 120.64 111.69 2fr8 n GLU 108 Ca 0.07 -1.54 -0.34 0.00 -0.02 0.00 0.00 57.16 55.33 2fr8 n GLU 108 Cb 0.08 -1.27 -0.11 0.00 -0.02 0.00 0.00 31.44 30.11 2fr8 n GLU 108 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2fr8 s VAL 109 N -1.08 4.01 0.05 2.62 1.01 -0.75 -0.72 120.40 125.54 2fr8 s VAL 109 Ca 0.19 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2fr8 s VAL 109 Cb 0.12 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 2fr8 s VAL 109 CO 0.17 0.53 -0.06 -0.36 0.00 0.00 0.00 175.10 175.38 2fr8 s PHE 110 N -0.04 0.60 0.45 5.22 0.40 -0.70 -4.97 117.98 118.94 2fr8 s PHE 110 Ca 0.02 -0.61 -0.14 0.00 -0.60 0.00 0.00 56.93 55.59 2fr8 s PHE 110 Cb -0.13 -0.37 -0.08 0.00 0.51 0.00 0.00 43.02 42.96 2fr8 s PHE 110 CO 0.02 -0.14 0.88 -1.83 0.70 0.00 0.00 175.22 174.86 2fr8 s GLU 111 N -2.07 3.90 0.13 0.44 -1.05 -1.26 -1.20 118.70 117.59 2fr8 s GLU 111 Ca -0.07 0.76 -0.23 0.00 -0.15 0.00 0.00 54.97 55.28 2fr8 s GLU 111 Cb -0.06 -2.26 -0.03 0.00 -0.44 0.00 0.00 34.13 31.34 2fr8 s GLU 111 CO -0.02 -0.14 1.19 -0.11 0.95 0.00 0.00 175.26 177.14 2fr8 n LEU 112 N -1.34 -0.78 -0.03 1.83 0.00 -1.17 -0.72 117.00 114.79 2fr8 n LEU 112 Ca 0.05 1.37 0.19 0.00 0.00 0.00 0.00 56.01 57.62 2fr8 n LEU 112 Cb 0.54 -0.19 0.65 0.00 0.00 0.00 0.00 43.42 44.42 2fr8 n LEU 112 CO 0.46 -1.13 1.19 -0.33 0.00 0.00 0.00 177.39 177.58 2fr8 h GLU 113 N 0.00 0.09 0.00 1.96 3.07 -1.93 0.13 114.58 117.89 2fr8 h GLU 113 Ca 0.14 -0.01 -0.22 0.00 -0.50 0.00 0.00 59.36 58.77 2fr8 h GLU 113 Cb 0.33 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.19 2fr8 h GLU 113 CO -0.73 0.06 -1.48 1.49 -1.40 0.00 0.00 179.01 176.95 2fr8 h GLU 114 N 0.09 0.00 0.00 2.33 4.81 -1.30 -3.41 114.58 117.10 2fr8 h GLU 114 Ca 0.27 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 2fr8 h GLU 114 Cb 0.96 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.34 2fr8 h GLU 114 CO -0.03 0.42 -1.15 1.51 -0.73 0.00 0.00 179.01 179.03 2fr8 n ILE 115 N -2.99 0.04 -0.51 2.32 3.06 -0.98 -4.79 119.36 115.52 2fr8 n ILE 115 Ca -0.12 -0.08 0.44 0.00 -2.50 0.00 0.00 62.75 60.49 2fr8 n ILE 115 Cb 0.93 0.12 0.76 0.00 0.54 0.00 0.00 39.64 41.99 2fr8 n ILE 115 CO 0.00 0.00 0.00 -1.13 -2.50 0.00 0.00 176.55 172.92 2fr8 h ASN 116 N 0.00 0.00 1.54 9.51 -1.24 -0.99 0.82 115.58 125.22 2fr8 h ASN 116 Ca -0.02 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.95 2fr8 h ASN 116 Cb 0.38 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.42 2fr8 h ASN 116 CO 0.00 0.00 -0.47 0.77 -1.29 0.00 0.00 177.43 176.44 2fr8 h SER 117 N 0.00 0.00 0.66 1.15 4.64 -1.86 -3.36 113.55 114.77 2fr8 h SER 117 Ca 0.75 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.07 2fr8 h SER 117 Cb 3.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 65.19 2fr8 h SER 117 CO -0.01 0.17 0.00 -1.20 -0.87 0.00 0.00 176.83 174.92 2fr8 n SER 118 N -3.01 0.39 0.28 4.97 7.64 0.28 -2.91 113.62 121.25 2fr8 n SER 118 Ca 0.01 0.59 0.11 0.00 1.01 0.00 0.00 58.87 60.60 2fr8 n SER 118 Cb 0.61 -0.68 0.77 0.00 -1.01 0.00 0.00 64.21 63.90 2fr8 n SER 118 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 2fr8 h PHE 119 N 0.00 0.00 -0.32 1.43 -1.00 -1.71 -2.16 116.94 113.18 2fr8 h PHE 119 Ca 0.00 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.84 2fr8 h PHE 119 Cb 0.33 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 39.81 2fr8 h PHE 119 CO 0.00 0.01 -0.47 1.96 -1.61 0.00 0.00 178.31 178.20 2fr8 h GLN 120 N 0.00 -0.39 0.08 1.51 4.20 -1.80 -2.88 115.11 115.83 2fr8 h GLN 120 Ca -0.00 0.03 -0.26 0.00 0.06 0.00 0.00 58.65 58.48 2fr8 h GLN 120 Cb 0.03 0.09 0.01 0.00 0.30 0.00 0.00 27.48 27.91 2fr8 h GLN 120 CO 0.00 -0.26 -1.13 1.79 -0.67 0.00 0.00 178.83 178.56 2fr8 h THR 121 N -0.41 1.43 -3.08 -0.54 1.35 -1.70 -3.44 112.91 106.52 2fr8 h THR 121 Ca 0.10 -2.73 -0.53 0.00 -0.55 0.00 0.00 66.41 62.71 2fr8 h THR 121 Cb 0.61 2.70 0.06 0.00 -1.73 0.00 0.00 68.15 69.80 2fr8 h THR 121 CO -0.53 0.81 0.88 0.00 -0.25 0.00 0.00 175.52 176.43 2fr8 s ALA 122 N -2.94 3.77 -1.18 6.62 0.00 -0.85 -4.89 121.76 122.28 2fr8 s ALA 122 Ca -0.05 1.47 0.23 0.00 0.00 0.00 0.00 51.96 53.61 2fr8 s ALA 122 Cb 0.07 -3.63 0.15 0.00 0.00 0.00 0.00 23.12 19.71 2fr8 s ALA 122 CO 0.88 -0.87 1.17 -0.40 0.00 0.00 0.00 175.76 176.54 2fr8 n ASP 123 N 3.02 0.93 -3.77 0.00 5.68 -1.07 -3.13 116.55 118.21 2fr8 n ASP 123 Ca 0.11 -0.77 -0.14 0.00 -0.50 0.00 0.00 54.79 53.49 2fr8 n ASP 123 Cb 0.38 0.59 -0.15 0.00 -1.14 0.00 0.00 41.12 40.81 2fr8 n ASP 123 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2fr8 s VAL 124 N -2.90 -0.04 -0.36 2.12 1.01 -1.23 0.03 120.40 119.03 2fr8 s VAL 124 Ca 0.12 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 2fr8 s VAL 124 Cb 0.17 -0.18 0.08 0.00 0.00 0.00 0.00 36.38 36.45 2fr8 s VAL 124 CO 0.75 0.06 0.12 0.00 0.00 0.00 0.00 175.10 176.03 2fr8 s ALA 125 N 0.93 3.03 -0.87 5.51 0.00 0.34 -2.42 121.76 128.27 2fr8 s ALA 125 Ca -0.07 -2.17 -0.22 0.00 0.00 0.00 0.00 51.96 49.49 2fr8 s ALA 125 Cb -0.10 -2.24 0.07 0.00 0.00 0.00 0.00 23.12 20.86 2fr8 s ALA 125 CO -0.04 -1.56 1.23 0.12 0.00 0.00 0.00 175.76 175.51 2fr8 s PHE 126 N 1.22 2.68 -0.52 0.00 5.36 -0.91 0.14 117.98 125.95 2fr8 s PHE 126 Ca 0.02 -0.79 -0.19 0.00 -0.96 0.00 0.00 56.93 55.01 2fr8 s PHE 126 Cb -0.21 -4.49 0.06 0.00 -0.34 0.00 0.00 43.02 38.04 2fr8 s PHE 126 CO -0.02 -1.78 0.65 0.08 -1.46 0.00 0.00 175.22 172.69 2fr8 s VAL 127 N 4.29 4.85 -0.36 3.12 1.01 0.20 -0.77 120.40 132.73 2fr8 s VAL 127 Ca 0.35 -0.50 -0.12 0.00 0.00 0.00 0.00 61.98 61.71 2fr8 s VAL 127 Cb -0.06 -4.33 0.01 0.00 0.00 0.00 0.00 36.38 32.00 2fr8 s VAL 127 CO -0.01 -0.85 0.22 -0.51 0.00 0.00 0.00 175.10 173.94 2fr8 s ILE 128 N 2.70 4.84 0.00 2.22 2.07 0.11 -0.38 121.20 132.76 2fr8 s ILE 128 Ca 0.15 -0.59 0.00 0.00 -1.41 0.00 0.00 60.65 58.81 2fr8 s ILE 128 Cb -0.19 -3.60 0.00 0.00 0.13 0.00 0.00 42.46 38.80 2fr8 s ILE 128 CO 0.12 -0.13 0.00 0.61 -1.91 0.00 0.00 174.94 173.63 2fr8 n GLY 129 N 5.04 0.21 3.91 1.50 0.00 -1.06 -0.83 105.19 113.95 2fr8 n GLY 129 Ca -0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 2fr8 n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 s ALA 130 N -1.56 3.95 0.00 4.61 0.00 -1.26 -1.13 121.76 126.37 2fr8 s ALA 130 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2fr8 s ALA 130 Cb 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.20 2fr8 s ALA 130 CO 0.00 0.78 0.00 -1.71 0.00 0.00 0.00 175.76 174.83 2fr8 n ASN 131 N 0.31 0.00 -0.22 0.00 2.85 -1.26 -4.92 115.26 112.03 2fr8 n ASN 131 Ca -0.05 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 54.51 2fr8 n ASN 131 Cb 0.51 0.12 0.36 0.00 1.24 0.00 0.00 39.78 42.01 2fr8 n ASN 131 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 2fr8 h ASP 132 N 0.00 0.67 0.00 1.20 3.32 -1.97 -1.96 116.42 117.68 2fr8 h ASP 132 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2fr8 h ASP 132 Cb 0.00 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.43 2fr8 h ASP 132 CO 0.00 0.40 0.11 0.58 -1.72 0.00 0.00 179.24 178.61 2fr8 h VAL 133 N 0.74 0.00 0.00 -1.35 2.07 -1.94 -2.50 116.25 113.28 2fr8 h VAL 133 Ca 0.37 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.89 2fr8 h VAL 133 Cb 0.44 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2fr8 h VAL 133 CO -0.14 0.00 -0.48 0.35 0.02 0.00 0.00 177.57 177.32 2fr8 n THR 134 N -2.71 0.00 -1.60 2.57 -2.24 -0.75 -1.65 114.28 107.90 2fr8 n THR 134 Ca -0.02 -0.32 -0.43 0.00 -2.27 0.00 0.00 64.05 61.01 2fr8 n THR 134 Cb 0.16 0.87 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 2fr8 n THR 134 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2fr8 n ASN 135 N -1.25 3.36 0.00 3.42 2.85 -0.94 -4.80 115.26 117.89 2fr8 n ASN 135 Ca 0.01 0.29 0.06 0.00 -0.11 0.00 0.00 54.58 54.83 2fr8 n ASN 135 Cb 0.10 -1.55 0.32 0.00 1.24 0.00 0.00 39.78 39.89 2fr8 n ASN 135 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2fr8 n PRO 136 N 8.60 0.23 0.08 1.20 -0.02 -1.26 -2.75 135.00 141.08 2fr8 n PRO 136 Ca 0.29 0.12 0.14 0.00 -2.02 0.00 0.00 63.50 62.03 2fr8 n PRO 136 Cb 0.44 -1.50 0.64 0.00 -0.02 0.00 0.00 33.50 33.06 2fr8 n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fr8 h ALA 137 N 2.62 2.23 0.00 3.55 0.00 -1.93 -1.15 119.26 124.58 2fr8 h ALA 137 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2fr8 h ALA 137 Cb 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2fr8 h ALA 137 CO 0.00 -0.32 -0.14 0.00 0.00 0.00 0.00 179.25 178.79 2fr8 h ALA 138 N 1.82 1.13 0.00 0.00 0.00 -1.74 -2.65 119.26 117.83 2fr8 h ALA 138 Ca 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2fr8 h ALA 138 Cb 0.56 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2fr8 h ALA 138 CO -0.01 0.17 -1.92 1.17 0.00 0.00 0.00 179.25 178.65 2fr8 n LYS 139 N -3.45 0.66 -1.65 0.00 4.81 -0.48 -0.18 118.16 117.87 2fr8 n LYS 139 Ca -0.01 -0.14 0.01 0.00 -0.87 0.00 0.00 58.31 57.30 2fr8 n LYS 139 Cb 0.30 -1.56 0.01 0.00 0.02 0.00 0.00 35.03 33.81 2fr8 n LYS 139 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2fr8 n THR 140 N -2.36 0.19 -3.22 3.15 -2.24 -0.91 -4.98 114.28 103.90 2fr8 n THR 140 Ca -0.07 -1.08 -0.02 0.00 -2.27 0.00 0.00 64.05 60.61 2fr8 n THR 140 Cb 0.63 0.94 -0.02 0.00 -2.10 0.00 0.00 70.33 69.78 2fr8 n THR 140 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2fr8 s ASP 141 N -2.02 -1.07 0.52 3.42 2.15 -1.00 -4.96 116.67 113.70 2fr8 s ASP 141 Ca 0.25 -0.96 0.32 0.00 0.43 0.00 0.00 52.55 52.58 2fr8 s ASP 141 Cb 0.30 1.72 1.45 0.00 -0.30 0.00 0.00 42.92 46.09 2fr8 s ASP 141 CO -0.11 -0.18 1.84 -0.65 -0.17 0.00 0.00 175.17 175.89 2fr8 h PRO 142 N 6.93 0.06 0.00 4.34 0.11 -1.94 -0.02 132.00 141.48 2fr8 h PRO 142 Ca 0.05 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2fr8 h PRO 142 Cb 1.16 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2fr8 h PRO 142 CO 0.11 0.04 0.00 0.66 -0.21 0.00 0.00 178.00 178.61 2fr8 h SER 143 N 0.07 0.00 -3.73 -2.05 4.64 -1.96 -3.46 113.55 107.05 2fr8 h SER 143 Ca 0.50 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.30 2fr8 h SER 143 Cb 1.89 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 64.05 2fr8 h SER 143 CO -0.05 0.00 0.72 -0.55 -0.87 0.00 0.00 176.83 176.08 2fr8 s SER 144 N -5.44 6.61 0.00 4.97 0.15 -0.02 -4.90 113.70 115.07 2fr8 s SER 144 Ca 0.05 2.79 0.12 0.00 0.70 0.00 0.00 55.95 59.61 2fr8 s SER 144 Cb 0.08 -2.65 0.73 0.00 -1.71 0.00 0.00 66.02 62.48 2fr8 s SER 144 CO 0.57 -0.69 1.34 -0.81 1.20 0.00 0.00 173.24 174.85 2fr8 n PRO 145 N 1.20 0.82 -0.00 5.44 -0.04 -1.26 -2.22 135.00 138.94 2fr8 n PRO 145 Ca 0.02 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.50 2fr8 n PRO 145 Cb 0.40 -1.23 0.02 0.00 -0.04 0.00 0.00 33.50 32.65 2fr8 n PRO 145 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2fr8 n ILE 146 N -0.73 0.03 -1.66 0.52 -5.35 -1.26 -5.06 119.36 105.85 2fr8 n ILE 146 Ca 0.09 -0.52 -0.46 0.00 -0.27 0.00 0.00 62.75 61.60 2fr8 n ILE 146 Cb 0.04 1.06 -0.04 0.00 -1.74 0.00 0.00 39.64 38.96 2fr8 n ILE 146 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2fr8 n TYR 147 N 0.20 2.16 0.00 4.28 9.36 -0.94 -1.77 117.16 130.45 2fr8 n TYR 147 Ca 0.02 0.37 0.00 0.00 3.32 0.00 0.00 57.90 61.61 2fr8 n TYR 147 Cb 0.10 -2.49 0.00 0.00 -0.63 0.00 0.00 39.34 36.32 2fr8 n TYR 147 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2fr8 n GLY 148 N 2.82 2.90 3.72 2.98 0.00 0.75 -5.01 105.19 113.35 2fr8 n GLY 148 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2fr8 n GLY 148 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2fr8 s MET 149 N -0.77 4.42 0.24 1.61 -2.45 -0.73 -5.01 119.30 116.62 2fr8 s MET 149 Ca 0.00 1.85 -0.30 0.00 -1.25 0.00 0.00 55.69 55.99 2fr8 s MET 149 Cb 0.00 -3.31 -0.09 0.00 1.25 0.00 0.00 34.83 32.68 2fr8 s MET 149 CO 0.00 -0.27 1.21 -1.25 1.05 0.00 0.00 175.02 175.76 2fr8 s PRO 150 N 0.87 4.49 0.39 4.11 0.04 -1.26 -4.67 135.00 138.98 2fr8 s PRO 150 Ca 0.59 1.95 0.06 0.00 0.04 0.00 0.00 61.00 63.64 2fr8 s PRO 150 Cb -0.31 -3.19 -0.08 0.00 0.04 0.00 0.00 34.50 30.96 2fr8 s PRO 150 CO 0.30 -0.05 0.02 0.96 0.04 0.00 0.00 177.00 178.28 2fr8 s ILE 151 N -0.56 1.79 -0.09 0.56 -5.25 -1.26 -4.97 121.20 111.43 2fr8 s ILE 151 Ca 0.50 -2.00 -0.22 0.00 -0.99 0.00 0.00 60.65 57.94 2fr8 s ILE 151 Cb -0.34 -2.95 -0.04 0.00 2.95 0.00 0.00 42.46 42.08 2fr8 s ILE 151 CO 0.41 0.00 0.66 -0.76 -1.79 0.00 0.00 174.94 173.47 2fr8 s LEU 152 N -3.65 4.28 -1.42 0.37 1.43 -0.66 -4.98 118.68 114.04 2fr8 s LEU 152 Ca 0.35 1.09 -0.14 0.00 -1.03 0.00 0.00 54.13 54.41 2fr8 s LEU 152 Cb 0.10 -3.01 0.06 0.00 0.03 0.00 0.00 46.19 43.37 2fr8 s LEU 152 CO 0.17 -0.13 2.14 0.47 0.23 0.00 0.00 176.35 179.24 2fr8 n ASP 153 N 3.97 4.11 -0.35 2.29 8.00 -1.26 -4.60 116.55 128.71 2fr8 n ASP 153 Ca -0.02 -2.88 0.12 0.00 0.71 0.00 0.00 54.79 52.73 2fr8 n ASP 153 Cb 0.51 -1.64 0.55 0.00 -0.02 0.00 0.00 41.12 40.51 2fr8 n ASP 153 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2fr8 n VAL 154 N 4.99 0.07 0.86 2.53 0.24 -1.26 -3.28 118.33 122.48 2fr8 n VAL 154 Ca 0.50 -0.20 0.13 0.00 -2.04 0.00 0.00 64.34 62.73 2fr8 n VAL 154 Cb 0.39 0.17 0.37 0.00 -1.47 0.00 0.00 33.84 33.30 2fr8 n VAL 154 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 2fr8 n GLU 155 N -0.12 0.10 0.09 7.34 0.28 -1.26 -4.04 120.64 123.02 2fr8 n GLU 155 Ca 0.18 0.05 -0.16 0.00 -0.16 0.00 0.00 57.16 57.07 2fr8 n GLU 155 Cb 0.26 -1.58 -0.11 0.00 1.43 0.00 0.00 31.44 31.44 2fr8 n GLU 155 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 2fr8 h LYS 156 N 0.00 0.36 -7.04 3.44 1.57 -1.85 -3.46 116.57 109.59 2fr8 h LYS 156 Ca 0.00 -0.51 -0.52 0.00 -1.87 0.00 0.00 60.65 57.75 2fr8 h LYS 156 Cb 0.58 0.17 0.09 0.00 0.08 0.00 0.00 32.23 33.16 2fr8 h LYS 156 CO 0.00 1.20 0.51 0.00 -0.57 0.00 0.00 179.45 180.59 2fr8 s ALA 157 N -2.89 2.84 0.03 3.86 0.00 -1.09 -4.66 121.76 119.85 2fr8 s ALA 157 Ca -0.05 1.03 -0.06 0.00 0.00 0.00 0.00 51.96 52.88 2fr8 s ALA 157 Cb 0.07 -3.43 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 2fr8 s ALA 157 CO 0.89 -0.91 0.93 0.41 0.00 0.00 0.00 175.76 177.07 2fr8 n GLY 158 N 0.49 -2.50 3.55 0.00 0.00 -1.06 -4.50 105.19 101.17 2fr8 n GLY 158 Ca 0.09 0.60 -0.29 0.00 0.00 0.00 0.00 46.02 46.42 2fr8 n GLY 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fr8 s THR 159 N -3.54 3.19 -0.21 2.61 -4.23 0.10 -4.74 115.64 108.83 2fr8 s THR 159 Ca -0.02 -1.41 0.02 0.00 -1.18 0.00 0.00 61.69 59.09 2fr8 s THR 159 Cb 0.02 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.39 2fr8 s THR 159 CO 0.11 0.06 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.42 2fr8 s VAL 160 N -1.29 1.98 -0.16 2.29 1.01 0.41 -0.50 120.40 124.13 2fr8 s VAL 160 Ca 0.21 -1.17 -0.07 0.00 0.00 0.00 0.00 61.98 60.95 2fr8 s VAL 160 Cb -0.10 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2fr8 s VAL 160 CO 0.13 0.26 0.08 -0.76 0.00 0.00 0.00 175.10 174.82 2fr8 s LEU 161 N 1.26 3.99 -0.21 3.92 1.02 0.12 -1.37 118.68 127.42 2fr8 s LEU 161 Ca -0.01 0.21 0.01 0.00 0.02 0.00 0.00 54.13 54.36 2fr8 s LEU 161 Cb -0.16 -1.99 0.05 0.00 0.02 0.00 0.00 46.19 44.10 2fr8 s LEU 161 CO -0.09 0.26 -0.10 -0.36 0.02 0.00 0.00 176.35 176.08 2fr8 s PHE 162 N -0.13 2.44 -0.07 0.29 2.99 -0.99 0.60 117.98 123.11 2fr8 s PHE 162 Ca 0.08 -1.64 -0.24 0.00 0.00 0.00 0.00 56.93 55.13 2fr8 s PHE 162 Cb -0.12 -1.64 -0.03 0.00 0.00 0.00 0.00 43.02 41.23 2fr8 s PHE 162 CO 0.01 -0.75 0.73 0.42 -0.00 0.00 0.00 175.22 175.63 2fr8 s ILE 163 N 1.39 5.02 -0.29 0.64 1.09 0.48 -0.12 121.20 129.41 2fr8 s ILE 163 Ca -0.02 1.50 -0.16 0.00 -1.10 0.00 0.00 60.65 60.87 2fr8 s ILE 163 Cb -0.17 -4.07 0.17 0.00 -1.06 0.00 0.00 42.46 37.33 2fr8 s ILE 163 CO -0.08 0.23 1.05 -0.75 -0.10 0.00 0.00 174.94 175.29 2fr8 s LYS 164 N 0.91 0.28 0.36 2.79 2.20 -1.11 -2.58 119.74 122.59 2fr8 s LYS 164 Ca 0.39 0.53 0.10 0.00 -0.36 0.00 0.00 55.97 56.63 2fr8 s LYS 164 Cb -0.18 0.14 0.86 0.00 -1.51 0.00 0.00 37.83 37.14 2fr8 s LYS 164 CO 0.19 -0.07 1.87 0.00 -0.36 0.00 0.00 175.35 176.97 2fr8 h ARG 165 N 6.26 0.63 0.00 4.03 3.08 -1.69 -1.38 114.38 125.31 2fr8 h ARG 165 Ca -0.24 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2fr8 h ARG 165 Cb 1.16 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.07 2fr8 h ARG 165 CO 0.17 0.41 0.00 -1.13 -1.07 0.00 0.00 179.97 178.35 2fr8 n SER 166 N -4.56 0.00 -0.23 7.04 3.41 -1.26 -3.87 113.62 114.15 2fr8 n SER 166 Ca 0.18 -0.54 0.14 0.00 -0.26 0.00 0.00 58.87 58.39 2fr8 n SER 166 Cb 0.50 0.00 0.71 0.00 -0.26 0.00 0.00 64.21 65.17 2fr8 n SER 166 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2fr8 n MET 167 N 0.00 1.32 -1.20 4.33 2.81 -1.26 -4.97 117.12 118.14 2fr8 n MET 167 Ca 0.00 -0.46 -0.35 0.00 -1.81 0.00 0.00 57.70 55.08 2fr8 n MET 167 Cb 0.00 -1.47 0.08 0.00 -0.71 0.00 0.00 33.22 31.12 2fr8 n MET 167 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2fr8 n ALA 168 N -0.43 -1.31 -1.84 3.04 0.00 -1.26 -4.99 120.51 113.73 2fr8 n ALA 168 Ca 0.21 -0.29 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 2fr8 n ALA 168 Cb 0.22 -1.93 0.10 0.00 0.00 0.00 0.00 19.45 17.85 2fr8 n ALA 168 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2fr8 s SER 169 N -1.63 4.25 0.00 0.00 1.04 -1.26 -5.05 113.70 111.05 2fr8 s SER 169 Ca 0.66 0.78 0.00 0.00 0.48 0.00 0.00 55.95 57.88 2fr8 s SER 169 Cb -0.32 -1.26 0.00 0.00 0.10 0.00 0.00 66.02 64.53 2fr8 s SER 169 CO 0.57 -2.07 0.00 0.61 0.98 0.00 0.00 173.24 173.33 2fr8 n GLY 170 N -3.15 0.88 0.36 7.32 0.00 -1.26 -4.90 105.19 104.44 2fr8 n GLY 170 Ca 0.08 -1.82 0.05 0.00 0.00 0.00 0.00 46.02 44.33 2fr8 n GLY 170 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2fr8 h TYR 171 N 0.00 0.95 -0.58 1.61 3.20 -1.99 -2.88 116.97 117.28 2fr8 h TYR 171 Ca 0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2fr8 h TYR 171 Cb 0.00 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 37.93 2fr8 h TYR 171 CO 0.00 0.50 0.31 0.00 -1.64 0.00 0.00 178.16 177.33 2fr8 h ALA 172 N 1.54 1.45 0.00 1.82 0.00 -1.98 -3.46 119.26 118.62 2fr8 h ALA 172 Ca 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2fr8 h ALA 172 Cb 0.21 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2fr8 h ALA 172 CO -0.13 0.45 0.00 0.41 0.00 0.00 0.00 179.25 179.98 2fr8 n GLY 173 N -1.24 0.74 3.93 0.00 0.00 -1.09 -4.97 105.19 102.56 2fr8 n GLY 173 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 2fr8 n GLY 173 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fr8 s VAL 174 N -2.53 2.77 0.13 1.61 -7.23 -1.26 -4.96 120.40 108.93 2fr8 s VAL 174 Ca 0.00 -1.20 0.03 0.00 -1.81 0.00 0.00 61.98 59.00 2fr8 s VAL 174 Cb 0.00 -2.97 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 2fr8 s VAL 174 CO 0.00 0.00 0.21 -0.70 -0.31 0.00 0.00 175.10 174.30 2fr8 s GLU 175 N -4.23 3.22 -0.22 4.82 2.12 -1.26 -4.31 118.70 118.84 2fr8 s GLU 175 Ca 0.51 -0.67 -0.05 0.00 0.36 0.00 0.00 54.97 55.12 2fr8 s GLU 175 Cb -0.06 -2.85 -0.02 0.00 0.26 0.00 0.00 34.13 31.45 2fr8 s GLU 175 CO 0.30 0.53 0.01 1.21 -0.54 0.00 0.00 175.26 176.77 2fr8 s ASN 176 N -3.00 4.83 0.43 -1.70 3.84 -1.26 -4.97 114.94 113.12 2fr8 s ASN 176 Ca 0.33 -0.23 0.13 0.00 0.21 0.00 0.00 52.86 53.30 2fr8 s ASN 176 Cb -0.11 -1.84 0.95 0.00 -0.55 0.00 0.00 41.25 39.70 2fr8 s ASN 176 CO 0.26 0.03 1.98 -0.33 -2.79 0.00 0.00 177.10 176.25 2fr8 h GLU 177 N 7.76 0.10 -0.61 0.43 4.39 -1.98 -2.89 114.58 121.77 2fr8 h GLU 177 Ca -0.37 -0.02 0.12 0.00 0.34 0.00 0.00 59.36 59.42 2fr8 h GLU 177 Cb 1.17 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.77 2fr8 h GLU 177 CO 0.60 0.24 0.42 -0.07 -1.16 0.00 0.00 179.01 179.04 2fr8 h LEU 178 N 0.10 0.31 -1.26 1.33 3.38 -1.94 -2.43 115.31 114.79 2fr8 h LEU 178 Ca 0.02 0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.17 2fr8 h LEU 178 Cb 0.30 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 40.92 2fr8 h LEU 178 CO 0.02 0.18 0.59 -0.26 0.09 0.00 0.00 178.44 179.06 2fr8 h PHE 179 N 0.34 0.83 -1.87 1.13 0.04 -1.92 -2.90 116.94 112.59 2fr8 h PHE 179 Ca 0.29 0.02 -0.73 0.00 2.80 0.00 0.00 57.97 60.35 2fr8 h PHE 179 Cb 0.68 -0.26 -0.30 0.00 2.20 0.00 0.00 35.95 38.28 2fr8 h PHE 179 CO -0.00 0.26 0.75 1.19 -0.60 0.00 0.00 178.31 179.91 2fr8 n PHE 180 N -4.59 3.06 -4.35 -0.55 3.01 -0.92 -4.40 117.46 108.72 2fr8 n PHE 180 Ca 0.19 -2.48 -0.23 0.00 1.01 0.00 0.00 57.45 55.94 2fr8 n PHE 180 Cb 0.53 -1.01 -0.12 0.00 -0.01 0.00 0.00 39.48 38.88 2fr8 n PHE 180 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2fr8 s ARG 181 N -3.98 1.31 0.41 -1.08 0.52 -1.09 -4.89 118.95 110.15 2fr8 s ARG 181 Ca 0.52 -1.39 0.08 0.00 -0.52 0.00 0.00 55.73 54.41 2fr8 s ARG 181 Cb 0.44 -1.46 0.88 0.00 0.52 0.00 0.00 34.95 35.32 2fr8 s ARG 181 CO -0.36 0.31 2.06 -0.91 0.02 0.00 0.00 175.30 176.42 2fr8 h ASN 182 N 3.38 0.45 -0.69 0.23 2.35 -1.90 -1.59 115.58 117.82 2fr8 h ASN 182 Ca -0.44 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.16 2fr8 h ASN 182 Cb 1.20 -0.11 -0.08 0.00 0.05 0.00 0.00 38.32 39.38 2fr8 h ASN 182 CO 0.48 0.33 0.18 0.59 -1.65 0.00 0.00 177.43 177.35 2fr8 n ASN 183 N -4.48 5.22 -4.17 5.81 3.02 -1.26 -4.92 115.26 114.48 2fr8 n ASN 183 Ca 0.03 -3.11 -0.26 0.00 -0.03 0.00 0.00 54.58 51.21 2fr8 n ASN 183 Cb 0.07 -0.73 -0.16 0.00 -0.61 0.00 0.00 39.78 38.36 2fr8 n ASN 183 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2fr8 s THR 184 N -2.90 1.52 -0.04 3.41 2.01 -0.60 0.15 115.64 119.19 2fr8 s THR 184 Ca 0.55 -0.79 0.01 0.00 0.31 0.00 0.00 61.69 61.77 2fr8 s THR 184 Cb 0.43 -1.28 0.02 0.00 0.01 0.00 0.00 72.50 71.69 2fr8 s THR 184 CO 0.15 0.43 -0.03 -0.32 -0.69 0.00 0.00 174.62 174.16 2fr8 s MET 185 N -0.21 0.62 0.01 4.92 0.00 -0.47 -4.52 119.30 119.65 2fr8 s MET 185 Ca 0.01 -0.05 -0.25 0.00 0.00 0.00 0.00 55.69 55.41 2fr8 s MET 185 Cb -0.10 -0.69 -0.05 0.00 0.00 0.00 0.00 34.83 34.00 2fr8 s MET 185 CO 0.01 -0.09 0.75 -1.64 0.00 0.00 0.00 175.02 174.05 2fr8 s MET 186 N 0.88 4.47 -0.83 4.11 -1.94 0.53 -2.35 119.30 124.18 2fr8 s MET 186 Ca -0.11 1.02 0.01 0.00 -1.71 0.00 0.00 55.69 54.90 2fr8 s MET 186 Cb -0.14 -3.39 0.21 0.00 2.01 0.00 0.00 34.83 33.52 2fr8 s MET 186 CO -0.00 0.20 0.72 1.28 -0.01 0.00 0.00 175.02 177.21 2fr8 n LEU 187 N 3.15 3.90 -4.66 -0.03 7.99 0.82 -0.42 117.00 127.75 2fr8 n LEU 187 Ca -0.02 -5.18 -0.42 0.00 -0.01 0.00 0.00 56.01 50.38 2fr8 n LEU 187 Cb 0.51 -0.98 -0.03 0.00 -0.11 0.00 0.00 43.42 42.81 2fr8 n LEU 187 CO 0.47 1.66 1.33 -0.36 -1.51 0.00 0.00 177.39 178.98 2fr8 s PHE 188 N -1.53 2.13 -5.00 -1.77 2.99 -1.25 -2.73 117.98 110.82 2fr8 s PHE 188 Ca 0.28 0.31 0.00 0.00 0.00 0.00 0.00 56.93 57.51 2fr8 s PHE 188 Cb -0.04 -3.87 0.00 0.00 0.00 0.00 0.00 43.02 39.11 2fr8 s PHE 188 CO -0.13 -3.59 0.00 0.41 -0.00 0.00 0.00 175.22 171.91 2fr8 n GLY 189 N 4.05 -1.69 3.73 4.36 0.00 -0.52 -4.92 105.19 110.19 2fr8 n GLY 189 Ca 0.17 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 2fr8 n GLY 189 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2fr8 s ASP 190 N -2.06 7.08 0.45 1.61 2.15 -1.26 -1.98 116.67 122.66 2fr8 s ASP 190 Ca 0.00 2.13 0.11 0.00 0.43 0.00 0.00 52.55 55.22 2fr8 s ASP 190 Cb 0.00 -2.59 1.02 0.00 -0.30 0.00 0.00 42.92 41.04 2fr8 s ASP 190 CO 0.00 -0.42 2.07 0.00 -0.17 0.00 0.00 175.17 176.65 2fr8 h ALA 191 N 6.04 1.87 0.11 3.66 0.00 -1.93 0.15 119.26 129.15 2fr8 h ALA 191 Ca -0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 2fr8 h ALA 191 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2fr8 h ALA 191 CO 0.78 0.10 -0.05 -0.22 0.00 0.00 0.00 179.25 179.85 2fr8 h LYS 192 N 0.37 -0.14 -0.43 0.00 3.64 -1.89 -2.63 116.57 115.48 2fr8 h LYS 192 Ca 0.14 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.61 2fr8 h LYS 192 Cb 0.09 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 31.87 2fr8 h LYS 192 CO -0.03 -0.09 -0.09 -0.22 -2.27 0.00 0.00 179.45 176.74 2fr8 h LYS 193 N -0.24 0.01 -0.97 1.90 3.64 -1.89 -0.43 116.57 118.58 2fr8 h LYS 193 Ca -0.01 -0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.51 2fr8 h LYS 193 Cb 0.11 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 31.84 2fr8 h LYS 193 CO 0.02 0.01 0.61 1.98 -2.27 0.00 0.00 179.45 179.81 2fr8 h MET 194 N 0.02 0.82 -0.02 1.90 4.05 -0.84 0.33 114.93 121.18 2fr8 h MET 194 Ca 0.21 -0.05 -0.21 0.00 -0.28 0.00 0.00 59.70 59.37 2fr8 h MET 194 Cb 0.32 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 30.93 2fr8 h MET 194 CO -0.43 0.54 -0.87 1.15 0.23 0.00 0.00 176.91 177.54 2fr8 h THR 195 N 0.85 1.41 -0.22 -0.77 2.02 -0.75 -2.30 112.91 113.15 2fr8 h THR 195 Ca 0.50 -2.39 -0.05 0.00 0.77 0.00 0.00 66.41 65.24 2fr8 h THR 195 Cb 0.66 2.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 2fr8 h THR 195 CO -0.27 0.71 -0.07 -0.33 0.37 0.00 0.00 175.52 175.93 2fr8 h GLU 196 N 0.22 0.43 -0.92 6.66 5.08 -0.02 -1.47 114.58 124.56 2fr8 h GLU 196 Ca -0.06 -0.17 0.12 0.00 -1.00 0.00 0.00 59.36 58.26 2fr8 h GLU 196 Cb 1.48 -0.02 -0.09 0.00 0.50 0.00 0.00 28.75 30.63 2fr8 h GLU 196 CO 0.15 0.68 0.54 1.96 -1.00 0.00 0.00 179.01 181.34 2fr8 h GLN 197 N 0.15 0.81 0.05 2.33 4.20 -0.44 -0.34 115.11 121.88 2fr8 h GLN 197 Ca 0.05 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2fr8 h GLN 197 Cb 0.53 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.13 2fr8 h GLN 197 CO 0.02 0.54 -0.02 0.82 -0.67 0.00 0.00 178.83 179.52 2fr8 h ILE 198 N 0.84 1.10 -0.73 2.54 2.04 -1.28 0.17 117.51 122.18 2fr8 h ILE 198 Ca 0.47 -0.50 0.11 0.00 1.00 0.00 0.00 64.86 65.94 2fr8 h ILE 198 Cb 0.52 1.43 -0.08 0.00 -0.74 0.00 0.00 36.82 37.96 2fr8 h ILE 198 CO -0.29 0.13 0.35 0.58 0.00 0.00 0.00 178.15 178.91 2fr8 h VAL 199 N -0.29 0.80 0.00 1.67 2.07 -0.80 0.21 116.25 119.91 2fr8 h VAL 199 Ca -0.01 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 2fr8 h VAL 199 Cb 0.26 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2fr8 h VAL 199 CO 0.01 0.10 -0.20 1.56 0.02 0.00 0.00 177.57 179.07 2fr8 h GLN 200 N 0.57 0.00 0.00 1.57 4.20 -0.97 -2.41 115.11 118.06 2fr8 h GLN 200 Ca 0.37 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.08 2fr8 h GLN 200 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2fr8 h GLN 200 CO -0.31 0.20 -0.35 0.00 -0.67 0.00 0.00 178.83 177.70 2fr8 h ALA 201 N 1.80 0.80 -0.00 3.87 0.00 0.23 -3.26 119.26 122.70 2fr8 h ALA 201 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2fr8 h ALA 201 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2fr8 h ALA 201 CO 0.03 0.00 -0.27 -1.33 0.00 0.00 0.00 179.25 177.68 2fr8 n MET 202 N -2.59 0.43 0.00 0.00 2.81 0.62 -4.94 117.12 113.45 2fr8 n MET 202 Ca 0.03 -0.21 0.00 0.00 -1.81 0.00 0.00 57.70 55.71 2fr8 n MET 202 Cb 0.49 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 2fr8 n MET 202 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75