#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fgx s ASN 2 N 0.00 -0.02 -0.56 6.12 4.22 -1.26 -5.08 114.94 118.36 2fgx s ASN 2 Ca 0.00 0.03 0.05 0.00 -2.14 0.00 0.00 52.86 50.80 2fgx s ASN 2 Cb 0.00 1.01 0.18 0.00 1.28 0.00 0.00 41.25 43.73 2fgx s ASN 2 CO 0.00 -0.00 0.46 -3.20 -2.04 0.00 0.00 177.10 172.32 2fgx n ASN 3 N 3.34 1.48 -4.52 3.54 5.15 -1.26 -5.06 115.26 117.92 2fgx n ASN 3 Ca -0.15 -2.86 -0.42 0.00 -0.60 0.00 0.00 54.58 50.55 2fgx n ASN 3 Cb 0.56 -0.66 -0.03 0.00 -0.53 0.00 0.00 39.78 39.13 2fgx n ASN 3 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2fgx s GLN 4 N -0.95 3.64 -0.18 1.20 0.74 -1.26 -4.96 119.66 117.89 2fgx s GLN 4 Ca 0.30 -1.44 -0.07 0.00 0.05 0.00 0.00 55.36 54.20 2fgx s GLN 4 Cb 0.03 -5.22 -0.04 0.00 1.10 0.00 0.00 33.01 28.88 2fgx s GLN 4 CO -0.16 -2.06 0.05 0.14 -0.55 0.00 0.00 175.29 172.71 2fgx s VAL 5 N 4.06 4.69 0.11 1.34 -7.23 -1.26 -5.10 120.40 117.01 2fgx s VAL 5 Ca 0.42 -0.07 0.04 0.00 -1.81 0.00 0.00 61.98 60.56 2fgx s VAL 5 Cb -0.01 -3.11 -0.04 0.00 0.56 0.00 0.00 36.38 33.78 2fgx s VAL 5 CO -0.08 0.46 -0.11 -1.61 -0.31 0.00 0.00 175.10 173.46 2fgx s GLU 6 N 0.37 0.92 1.11 4.82 2.02 -1.26 -5.15 118.70 121.54 2fgx s GLU 6 Ca 0.02 -1.25 -0.16 0.00 0.02 0.00 0.00 54.97 53.61 2fgx s GLU 6 Cb -0.13 -0.60 0.24 0.00 0.10 0.00 0.00 34.13 33.74 2fgx s GLU 6 CO 0.00 0.09 1.10 -1.25 0.02 0.00 0.00 175.26 175.22 2fgx s PRO 7 N -3.03 -0.47 0.01 0.39 0.04 -1.26 -5.08 135.00 125.60 2fgx s PRO 7 Ca 0.09 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.37 2fgx s PRO 7 Cb -0.02 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.87 2fgx s PRO 7 CO 0.00 -3.28 0.01 0.54 0.04 0.00 0.00 177.00 174.32 2fgx n ARG 8 N -4.51 1.39 -3.72 4.56 5.12 -0.66 -4.99 116.66 113.85 2fgx n ARG 8 Ca 0.09 -0.08 -0.13 0.00 -1.93 0.00 0.00 57.85 55.80 2fgx n ARG 8 Cb 0.58 0.01 -0.13 0.00 -1.16 0.00 0.00 32.46 31.76 2fgx n ARG 8 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2fgx s LYS 9 N -2.06 0.20 -0.13 5.56 2.20 -1.22 -3.64 119.74 120.66 2fgx s LYS 9 Ca 0.01 0.56 0.00 0.00 -0.36 0.00 0.00 55.97 56.18 2fgx s LYS 9 Cb -0.00 -0.11 -0.01 0.00 -1.51 0.00 0.00 37.83 36.19 2fgx s LYS 9 CO 0.01 -0.18 -0.15 -0.51 -0.36 0.00 0.00 175.35 174.16 2fgx s LEU 10 N 1.42 2.62 -0.19 5.43 1.43 0.10 -1.92 118.68 127.58 2fgx s LEU 10 Ca -0.08 -0.36 -0.05 0.00 -1.03 0.00 0.00 54.13 52.60 2fgx s LEU 10 Cb -0.11 -1.58 -0.03 0.00 0.03 0.00 0.00 46.19 44.50 2fgx s LEU 10 CO -0.09 0.16 0.01 -0.69 0.23 0.00 0.00 176.35 175.97 2fgx s VAL 11 N 0.36 4.11 -0.38 -1.59 1.01 -0.29 -2.65 120.40 120.98 2fgx s VAL 11 Ca -0.12 -0.26 -0.10 0.00 0.00 0.00 0.00 61.98 61.50 2fgx s VAL 11 Cb -0.16 -2.85 0.04 0.00 0.00 0.00 0.00 36.38 33.41 2fgx s VAL 11 CO 0.06 0.44 0.20 -0.69 0.00 0.00 0.00 175.10 175.11 2fgx s VAL 12 N 0.80 4.32 -0.46 2.92 1.01 0.97 0.03 120.40 129.99 2fgx s VAL 12 Ca 0.01 -1.07 -0.28 0.00 0.00 0.00 0.00 61.98 60.65 2fgx s VAL 12 Cb -0.14 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 32.78 2fgx s VAL 12 CO 0.02 -0.30 1.06 -0.31 0.00 0.00 0.00 175.10 175.57 2fgx s TYR 13 N 1.49 2.88 0.43 5.22 2.02 -0.89 -1.46 117.35 127.03 2fgx s TYR 13 Ca 0.01 0.65 0.07 0.00 -0.37 0.00 0.00 57.07 57.43 2fgx s TYR 13 Cb -0.20 -4.23 -0.04 0.00 -0.40 0.00 0.00 41.96 37.09 2fgx s TYR 13 CO 0.05 -1.17 0.19 0.20 -1.57 0.00 0.00 175.55 173.24 2fgx s GLY 14 N 2.33 2.38 0.00 0.71 0.00 0.21 -2.26 107.32 110.69 2fgx s GLY 14 Ca 0.44 -1.96 0.00 0.00 0.00 0.00 0.00 44.72 43.20 2fgx s GLY 14 CO 0.29 -1.93 0.60 -2.13 0.00 0.00 0.00 173.10 169.92 2fgx n ARG 15 N -1.28 0.00 0.00 2.90 0.63 -1.26 -1.25 116.66 116.40 2fgx n ARG 15 Ca -0.02 -0.20 0.00 0.00 -0.92 0.00 0.00 57.85 56.71 2fgx n ARG 15 Cb 0.65 0.07 0.00 0.00 0.45 0.00 0.00 32.46 33.62 2fgx n ARG 15 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2fgx n GLU 16 N 0.00 0.00 0.00 -0.14 1.02 -1.26 -4.90 120.64 115.36 2fgx n GLU 16 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2fgx n GLU 16 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.96 2fgx n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2fgx n GLY 17 N 0.00 2.25 0.00 0.62 0.00 -1.26 -4.63 105.19 102.16 2fgx n GLY 17 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2fgx n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fgx h HIS 19 N 0.77 0.06 -0.70 0.00 3.86 -2.01 -2.85 115.15 114.27 2fgx h HIS 19 Ca 0.00 -0.02 0.18 0.00 -1.16 0.00 0.00 60.37 59.38 2fgx h HIS 19 Cb 0.00 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.42 2fgx h HIS 19 CO 0.00 0.49 0.49 -0.07 0.86 0.00 0.00 177.93 179.70 2fgx h LEU 20 N 0.04 0.11 -0.16 2.43 3.38 -1.93 -1.08 115.31 118.11 2fgx h LEU 20 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2fgx h LEU 20 Cb 0.81 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2fgx h LEU 20 CO 0.06 0.05 0.10 0.00 0.09 0.00 0.00 178.44 178.75 2fgx h GLU 22 N 0.20 0.22 -0.83 0.00 4.11 -1.41 -2.26 114.58 114.61 2fgx h GLU 22 Ca 0.06 -0.19 -0.01 0.00 0.07 0.00 0.00 59.36 59.28 2fgx h GLU 22 Cb -0.02 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2fgx h GLU 22 CO -0.01 0.86 0.49 0.93 0.07 0.00 0.00 179.01 181.35 2fgx h GLU 23 N 0.15 1.14 -0.25 1.06 5.08 -1.11 -1.06 114.58 119.59 2fgx h GLU 23 Ca -0.02 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2fgx h GLU 23 Cb 1.30 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2fgx h GLU 23 CO 0.11 0.81 0.04 0.52 -1.00 0.00 0.00 179.01 179.49 2fgx h MET 24 N 1.15 0.41 -0.32 2.33 2.86 -1.01 -2.68 114.93 117.67 2fgx h MET 24 Ca 0.30 -0.11 0.04 0.00 -2.06 0.00 0.00 59.70 57.87 2fgx h MET 24 Cb -0.02 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 2fgx h MET 24 CO -0.05 0.54 0.08 0.82 1.06 0.00 0.00 176.91 179.36 2fgx h ILE 25 N 0.22 0.87 -0.94 -1.22 2.04 -0.93 -0.29 117.51 117.26 2fgx h ILE 25 Ca 0.07 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2fgx h ILE 25 Cb 0.33 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.01 2fgx h ILE 25 CO 0.01 0.04 0.56 0.00 0.00 0.00 0.00 178.15 178.75 2fgx h ALA 26 N 1.23 1.19 -0.65 1.87 0.00 -1.23 -2.28 119.26 119.40 2fgx h ALA 26 Ca 0.15 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2fgx h ALA 26 Cb 0.15 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2fgx h ALA 26 CO -0.18 0.65 0.13 0.77 0.00 0.00 0.00 179.25 180.62 2fgx h SER 27 N 1.29 0.99 -0.67 0.00 0.02 -1.01 -2.79 113.55 111.38 2fgx h SER 27 Ca 0.34 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 61.02 2fgx h SER 27 Cb -0.05 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.20 2fgx h SER 27 CO -0.06 0.97 0.24 -0.07 -1.14 0.00 0.00 176.83 176.77 2fgx h LEU 28 N 0.99 0.97 -0.60 5.07 3.38 -0.54 -1.71 115.31 122.86 2fgx h LEU 28 Ca 0.20 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2fgx h LEU 28 Cb 0.39 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2fgx h LEU 28 CO 0.01 0.89 0.26 0.03 0.09 0.00 0.00 178.44 179.71 2fgx h ARG 29 N 1.01 0.89 -0.22 1.13 2.47 -1.16 0.82 114.38 119.32 2fgx h ARG 29 Ca 0.23 -0.15 -0.14 0.00 -1.26 0.00 0.00 59.98 58.66 2fgx h ARG 29 Cb 0.25 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 2fgx h ARG 29 CO -0.01 0.74 -0.41 0.28 0.56 0.00 0.00 179.97 181.12 2fgx h VAL 30 N 0.83 1.32 -0.12 2.04 2.07 -1.37 -3.06 116.25 117.96 2fgx h VAL 30 Ca 0.20 -1.63 -0.07 0.00 0.82 0.00 0.00 66.70 66.03 2fgx h VAL 30 Cb 0.17 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 2fgx h VAL 30 CO -0.02 0.51 -0.24 0.25 0.02 0.00 0.00 177.57 178.09 2fgx h LEU 31 N 0.37 0.20 -2.07 2.57 6.46 -1.12 -1.39 115.31 120.33 2fgx h LEU 31 Ca 0.01 -0.06 0.05 0.00 -0.12 0.00 0.00 57.88 57.77 2fgx h LEU 31 Cb 1.01 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.88 2fgx h LEU 31 CO 0.09 0.45 0.14 1.56 -0.62 0.00 0.00 178.44 180.06 2fgx h GLN 32 N 0.19 0.00 0.00 1.25 4.20 -0.73 0.30 115.11 120.31 2fgx h GLN 32 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2fgx h GLN 32 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 2fgx h GLN 32 CO 0.04 0.00 0.00 1.63 -0.67 0.00 0.00 178.83 179.83 2fgx n LYS 33 N -4.32 0.14 -0.11 1.46 5.02 -0.53 -3.71 118.16 116.11 2fgx n LYS 33 Ca 0.01 0.12 -0.16 0.00 -2.02 0.00 0.00 58.31 56.25 2fgx n LYS 33 Cb 0.27 -1.66 -0.10 0.00 -0.02 0.00 0.00 35.03 33.53 2fgx n LYS 33 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2fgx n LYS 34 N -1.90 0.52 -3.64 1.97 5.02 0.27 -4.96 118.16 115.44 2fgx n LYS 34 Ca 0.06 0.14 -0.12 0.00 -2.02 0.00 0.00 58.31 56.37 2fgx n LYS 34 Cb 0.38 -1.41 -0.12 0.00 -0.02 0.00 0.00 35.03 33.87 2fgx n LYS 34 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2fgx s SER 35 N -6.23 0.22 0.07 4.39 0.01 0.80 -5.13 113.70 107.82 2fgx s SER 35 Ca -0.29 0.66 -0.31 0.00 1.31 0.00 0.00 55.95 57.32 2fgx s SER 35 Cb 0.08 0.89 -0.06 0.00 0.21 0.00 0.00 66.02 67.14 2fgx s SER 35 CO 0.48 -0.24 1.28 0.86 0.41 0.00 0.00 173.24 176.02 2fgx s TRP 36 N 2.48 3.33 -0.00 2.43 -0.11 -1.24 -3.97 118.94 121.85 2fgx s TRP 36 Ca 0.01 1.15 0.05 0.00 1.22 0.00 0.00 56.10 58.53 2fgx s TRP 36 Cb -0.12 -3.52 0.08 0.00 -1.50 0.00 0.00 33.47 28.40 2fgx s TRP 36 CO -0.10 -1.72 1.03 1.97 -4.62 0.00 0.00 176.95 173.51 2fgx n PHE 37 N 4.05 0.00 -2.21 5.86 1.16 -1.26 -1.66 117.46 123.40 2fgx n PHE 37 Ca 0.10 -0.11 0.15 0.00 -1.87 0.00 0.00 57.45 55.72 2fgx n PHE 37 Cb 0.45 -0.07 -0.04 0.00 -1.61 0.00 0.00 39.48 38.21 2fgx n PHE 37 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 2fgx n GLU 38 N 0.05 -2.16 -3.28 3.97 -0.58 -1.24 0.02 120.64 117.42 2fgx n GLU 38 Ca 0.01 1.42 -0.05 0.00 -0.42 0.00 0.00 57.16 58.13 2fgx n GLU 38 Cb 0.77 -2.63 -0.06 0.00 -0.57 0.00 0.00 31.44 28.96 2fgx n GLU 38 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2fgx s LEU 39 N 0.00 -0.90 -0.23 -4.62 2.96 -1.26 -4.49 118.68 110.15 2fgx s LEU 39 Ca 0.00 0.45 -0.02 0.00 -0.22 0.00 0.00 54.13 54.34 2fgx s LEU 39 Cb 0.00 1.48 0.01 0.00 0.50 0.00 0.00 46.19 48.18 2fgx s LEU 39 CO 0.00 -0.29 -0.08 -0.70 -1.32 0.00 0.00 176.35 173.97 2fgx s GLU 40 N 2.65 3.07 -0.33 1.98 2.12 -1.08 -5.04 118.70 122.08 2fgx s GLU 40 Ca 0.16 -0.82 -0.05 0.00 0.36 0.00 0.00 54.97 54.62 2fgx s GLU 40 Cb -0.15 -2.92 0.04 0.00 0.26 0.00 0.00 34.13 31.35 2fgx s GLU 40 CO -0.18 -0.29 0.07 0.08 -0.54 0.00 0.00 175.26 174.41 2fgx s VAL 41 N 1.38 3.58 -0.25 3.70 1.01 -1.26 -0.02 120.40 128.54 2fgx s VAL 41 Ca 0.03 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 60.87 2fgx s VAL 41 Cb -0.15 -3.02 0.05 0.00 0.00 0.00 0.00 36.38 33.26 2fgx s VAL 41 CO -0.05 -0.14 -0.11 -0.63 0.00 0.00 0.00 175.10 174.16 2fgx s ILE 42 N 1.37 2.22 -0.38 2.22 1.01 -0.54 -4.96 121.20 122.14 2fgx s ILE 42 Ca -0.02 -1.53 -0.28 0.00 0.00 0.00 0.00 60.65 58.81 2fgx s ILE 42 Cb -0.19 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.04 2fgx s ILE 42 CO 0.02 0.04 1.05 0.20 0.00 0.00 0.00 174.94 176.25 2fgx s ASN 43 N 1.14 6.77 0.00 3.58 -0.87 -1.25 -0.62 114.94 123.68 2fgx s ASN 43 Ca -0.07 0.74 0.31 0.00 -1.57 0.00 0.00 52.86 52.27 2fgx s ASN 43 Cb -0.19 -2.52 1.85 0.00 -0.02 0.00 0.00 41.25 40.37 2fgx s ASN 43 CO -0.06 -0.98 2.18 2.30 -2.57 0.00 0.00 177.10 177.97 2fgx n ILE 44 N 6.19 0.00 -0.32 0.60 -5.35 -0.38 -3.61 119.36 116.49 2fgx n ILE 44 Ca 0.11 0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.56 2fgx n ILE 44 Cb 0.48 -0.51 0.12 0.00 -1.74 0.00 0.00 39.64 37.98 2fgx n ILE 44 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2fgx h ASP 45 N 0.00 1.09 -0.17 7.28 1.82 -1.91 -1.73 116.42 122.81 2fgx h ASP 45 Ca 0.00 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.56 2fgx h ASP 45 Cb 0.00 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 39.73 2fgx h ASP 45 CO 0.00 0.85 0.00 0.61 -1.61 0.00 0.00 179.24 179.09 2fgx n GLY 46 N -1.20 -0.17 2.58 -0.78 0.00 -1.24 -4.53 105.19 99.85 2fgx n GLY 46 Ca 0.10 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2fgx n GLY 46 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2fgx s ASN 47 N -1.13 3.54 0.43 1.61 0.01 -0.65 -4.98 114.94 113.77 2fgx s ASN 47 Ca 0.16 -1.61 0.17 0.00 -0.71 0.00 0.00 52.86 50.87 2fgx s ASN 47 Cb 0.08 -0.51 1.08 0.00 0.41 0.00 0.00 41.25 42.32 2fgx s ASN 47 CO 0.12 -0.40 1.92 -0.33 -1.51 0.00 0.00 177.10 176.90 2fgx h GLU 48 N 7.98 0.37 -0.23 -0.60 3.07 -1.80 0.21 114.58 123.58 2fgx h GLU 48 Ca -0.12 -0.02 0.03 0.00 -0.50 0.00 0.00 59.36 58.75 2fgx h GLU 48 Cb 1.00 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.79 2fgx h GLU 48 CO 0.41 0.25 0.04 0.45 -1.40 0.00 0.00 179.01 178.76 2fgx h HIS 49 N 0.38 0.06 0.00 4.33 3.86 -1.94 -2.12 115.15 119.73 2fgx h HIS 49 Ca 0.37 0.01 -0.13 0.00 -1.16 0.00 0.00 60.37 59.46 2fgx h HIS 49 Cb 0.88 0.01 -0.02 0.00 1.06 0.00 0.00 27.41 29.34 2fgx h HIS 49 CO -0.00 0.01 -0.61 -0.07 0.86 0.00 0.00 177.93 178.12 2fgx h LEU 50 N 0.12 0.00 -0.27 2.43 3.38 -1.47 -3.30 115.31 116.21 2fgx h LEU 50 Ca 0.11 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2fgx h LEU 50 Cb 0.11 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2fgx h LEU 50 CO -0.15 0.61 0.03 0.74 0.09 0.00 0.00 178.44 179.75 2fgx h THR 51 N 0.00 0.84 -0.10 0.22 2.02 -0.00 -1.94 112.91 113.95 2fgx h THR 51 Ca -0.01 -0.04 -0.07 0.00 0.77 0.00 0.00 66.41 67.06 2fgx h THR 51 Cb 1.36 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 2fgx h THR 51 CO 0.08 0.02 -0.27 0.03 0.37 0.00 0.00 175.52 175.75 2fgx h ARG 52 N 0.12 0.18 -0.11 6.66 3.08 -1.51 0.49 114.38 123.29 2fgx h ARG 52 Ca 0.12 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2fgx h ARG 52 Cb 0.15 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 2fgx h ARG 52 CO -0.19 0.45 0.03 -0.07 -1.07 0.00 0.00 179.97 179.12 2fgx h LEU 53 N 0.17 0.17 -3.04 3.04 3.38 -1.50 -3.32 115.31 114.20 2fgx h LEU 53 Ca 0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2fgx h LEU 53 Cb 0.57 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2fgx h LEU 53 CO 0.04 0.34 -0.22 -1.22 0.09 0.00 0.00 178.44 177.47 2fgx n TYR 54 N -4.87 0.12 -1.78 1.13 4.01 -0.78 -4.92 117.16 110.06 2fgx n TYR 54 Ca -0.06 -1.24 -0.42 0.00 -0.16 0.00 0.00 57.90 56.02 2fgx n TYR 54 Cb 0.15 -0.22 -0.03 0.00 -0.31 0.00 0.00 39.34 38.92 2fgx n TYR 54 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2fgx s ASN 55 N -2.96 6.52 0.00 7.72 3.84 0.17 -0.71 114.94 129.51 2fgx s ASN 55 Ca 0.36 2.55 0.00 0.00 0.21 0.00 0.00 52.86 55.98 2fgx s ASN 55 Cb 0.33 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.49 2fgx s ASN 55 CO -0.01 -1.01 0.00 -0.67 -2.79 0.00 0.00 177.10 172.62 2fgx n ASP 56 N 7.17 0.00 -1.30 -4.21 2.03 -1.26 -4.78 116.55 114.20 2fgx n ASP 56 Ca 0.19 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.41 2fgx n ASP 56 Cb 0.41 -0.90 0.15 0.00 -0.72 0.00 0.00 41.12 40.07 2fgx n ASP 56 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2fgx n ARG 57 N -2.00 2.23 0.00 -0.67 0.63 0.11 -5.00 116.66 111.95 2fgx n ARG 57 Ca 0.00 -3.45 0.00 0.00 -0.92 0.00 0.00 57.85 53.48 2fgx n ARG 57 Cb 0.00 -1.90 0.00 0.00 0.45 0.00 0.00 32.46 31.01 2fgx n ARG 57 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 2fgx n VAL 58 N -1.02 0.00 0.00 5.15 0.24 -1.01 -4.33 118.33 117.36 2fgx n VAL 58 Ca 0.34 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.64 2fgx n VAL 58 Cb 0.91 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 2fgx n VAL 58 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2fgx n PRO 59 N 0.00 0.00 -3.34 7.34 -0.02 -1.21 -3.86 135.00 133.91 2fgx n PRO 59 Ca 0.00 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.10 2fgx n PRO 59 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.42 2fgx n PRO 59 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2fgx s VAL 60 N 0.00 5.16 -0.53 -1.45 1.01 -0.96 -0.68 120.40 122.95 2fgx s VAL 60 Ca 0.00 0.93 -0.17 0.00 0.00 0.00 0.00 61.98 62.74 2fgx s VAL 60 Cb 0.00 -3.80 0.10 0.00 0.00 0.00 0.00 36.38 32.68 2fgx s VAL 60 CO 0.00 0.36 0.55 -0.22 0.00 0.00 0.00 175.10 175.80 2fgx s LEU 61 N 0.38 5.66 -0.22 3.92 1.98 -0.14 -2.09 118.68 128.17 2fgx s LEU 61 Ca 0.25 -1.45 -0.15 0.00 -2.89 0.00 0.00 54.13 49.89 2fgx s LEU 61 Cb -0.15 -2.27 -0.04 0.00 0.66 0.00 0.00 46.19 44.39 2fgx s LEU 61 CO 0.11 -0.89 0.36 0.12 -1.89 0.00 0.00 176.35 174.16 2fgx s PHE 62 N 2.07 3.35 -0.54 5.38 5.36 0.10 -1.89 117.98 131.81 2fgx s PHE 62 Ca 0.07 0.54 -0.24 0.00 -0.96 0.00 0.00 56.93 56.34 2fgx s PHE 62 Cb -0.25 -2.50 0.04 0.00 -0.34 0.00 0.00 43.02 39.97 2fgx s PHE 62 CO 0.06 -0.03 0.94 0.00 -1.46 0.00 0.00 175.22 174.73 2fgx s ALA 63 N 1.38 3.17 0.63 11.12 0.00 0.27 -1.14 121.76 137.19 2fgx s ALA 63 Ca 0.17 -1.20 -0.17 0.00 0.00 0.00 0.00 51.96 50.76 2fgx s ALA 63 Cb -0.15 -3.72 -0.01 0.00 0.00 0.00 0.00 23.12 19.24 2fgx s ALA 63 CO 0.08 -2.35 1.15 0.08 0.00 0.00 0.00 175.76 174.72 2fgx s VAL 64 N 3.91 2.96 0.00 0.00 1.01 -0.81 0.08 120.40 127.55 2fgx s VAL 64 Ca 0.31 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.80 2fgx s VAL 64 Cb -0.12 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2fgx s VAL 64 CO 0.20 -0.21 0.00 0.59 0.00 0.00 0.00 175.10 175.67 2fgx n ASN 65 N -2.07 0.00 0.08 3.32 3.02 -1.26 -4.37 115.26 113.97 2fgx n ASN 65 Ca 0.12 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.52 2fgx n ASN 65 Cb 0.51 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.61 2fgx n ASN 65 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2fgx h GLU 66 N 0.00 0.40 -5.47 3.52 4.39 -1.93 -3.48 114.58 112.03 2fgx h GLU 66 Ca 0.00 -0.48 -0.36 0.00 0.34 0.00 0.00 59.36 58.86 2fgx h GLU 66 Cb 0.00 0.15 0.13 0.00 -0.10 0.00 0.00 28.75 28.93 2fgx h GLU 66 CO 0.00 1.15 -0.64 -3.47 -1.16 0.00 0.00 179.01 174.88 2fgx n ASP 67 N -3.71 -5.39 -4.08 1.42 2.03 0.11 -5.00 116.55 101.92 2fgx n ASP 67 Ca -0.08 -0.51 -0.09 0.00 0.52 0.00 0.00 54.79 54.63 2fgx n ASP 67 Cb 0.88 -4.71 -0.09 0.00 -0.72 0.00 0.00 41.12 36.48 2fgx n ASP 67 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2fgx s LYS 68 N -6.06 0.94 0.01 -0.67 -2.85 -1.16 -5.00 119.74 104.96 2fgx s LYS 68 Ca 0.45 -1.33 -0.22 0.00 -1.00 0.00 0.00 55.97 53.87 2fgx s LYS 68 Cb -0.20 0.28 -0.05 0.00 -2.06 0.00 0.00 37.83 35.79 2fgx s LYS 68 CO 0.67 -0.28 0.65 -1.21 0.10 0.00 0.00 175.35 175.28 2fgx s GLU 69 N -4.01 4.38 -0.21 1.78 2.02 -1.26 -0.57 118.70 120.83 2fgx s GLU 69 Ca 0.20 0.84 -0.21 0.00 0.02 0.00 0.00 54.97 55.82 2fgx s GLU 69 Cb 0.06 -3.35 -0.19 0.00 0.10 0.00 0.00 34.13 30.75 2fgx s GLU 69 CO -0.01 0.33 0.19 1.28 0.02 0.00 0.00 175.26 177.08 2fgx n LEU 70 N 2.78 1.86 -3.65 1.80 4.77 -0.79 -4.91 117.00 118.87 2fgx n LEU 70 Ca -0.05 0.42 -0.05 0.00 -0.03 0.00 0.00 56.01 56.30 2fgx n LEU 70 Cb 0.51 -0.96 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 2fgx n LEU 70 CO 0.45 0.29 0.76 0.00 -1.33 0.00 0.00 177.39 177.55 2fgx s HIS 72 N -3.10 -0.07 0.00 0.00 -3.43 -1.26 -0.97 115.29 106.46 2fgx s HIS 72 Ca 0.10 0.17 0.00 0.00 -0.80 0.00 0.00 55.06 54.53 2fgx s HIS 72 Cb -0.01 0.01 0.00 0.00 -1.43 0.00 0.00 32.58 31.15 2fgx s HIS 72 CO -0.03 -0.16 0.00 0.66 -2.00 0.00 0.00 174.74 173.21 2fgx n TYR 73 N 2.38 0.00 -4.42 0.38 4.01 0.14 -4.87 117.16 114.78 2fgx n TYR 73 Ca -0.17 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.37 2fgx n TYR 73 Cb 0.58 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.50 2fgx n TYR 73 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2fgx s PHE 74 N 0.00 1.91 -0.32 -0.72 0.08 -1.26 -4.75 117.98 112.92 2fgx s PHE 74 Ca 0.00 -0.75 0.03 0.00 0.12 0.00 0.00 56.93 56.33 2fgx s PHE 74 Cb 0.00 -1.12 0.09 0.00 -0.57 0.00 0.00 43.02 41.42 2fgx s PHE 74 CO 0.00 0.22 0.00 -1.17 -0.10 0.00 0.00 175.22 174.17 2fgx s LEU 75 N -3.43 4.35 -0.76 -0.37 2.96 -1.26 -4.81 118.68 115.35 2fgx s LEU 75 Ca 0.30 -1.90 -0.22 0.00 -0.22 0.00 0.00 54.13 52.09 2fgx s LEU 75 Cb 0.05 -1.61 0.08 0.00 0.50 0.00 0.00 46.19 45.21 2fgx s LEU 75 CO 0.12 -0.32 1.07 -1.81 -1.32 0.00 0.00 176.35 174.08 2fgx s ASP 76 N 1.00 6.32 0.49 3.68 1.11 -1.26 -4.88 116.67 123.11 2fgx s ASP 76 Ca 0.04 -1.26 0.15 0.00 0.18 0.00 0.00 52.55 51.66 2fgx s ASP 76 Cb -0.19 -2.43 1.15 0.00 1.07 0.00 0.00 42.92 42.51 2fgx s ASP 76 CO -0.07 -1.38 2.08 0.28 1.18 0.00 0.00 175.17 177.27 2fgx h SER 77 N 9.43 0.01 -0.56 0.27 0.02 -1.98 -1.71 113.55 119.03 2fgx h SER 77 Ca -0.13 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.77 2fgx h SER 77 Cb 1.05 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 2fgx h SER 77 CO 1.19 0.09 0.16 0.44 -1.14 0.00 0.00 176.83 177.57 2fgx h ASP 78 N 0.01 0.82 -0.01 3.07 3.32 -1.99 0.04 116.42 121.68 2fgx h ASP 78 Ca 0.00 -0.21 -0.15 0.00 0.02 0.00 0.00 57.03 56.69 2fgx h ASP 78 Cb 0.14 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.48 2fgx h ASP 78 CO 0.01 0.82 -0.57 0.58 -1.72 0.00 0.00 179.24 178.36 2fgx h VAL 79 N 0.78 1.43 -0.26 -1.35 2.07 -1.79 -2.47 116.25 114.66 2fgx h VAL 79 Ca 0.18 -2.04 -0.08 0.00 0.82 0.00 0.00 66.70 65.58 2fgx h VAL 79 Cb 0.30 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 2fgx h VAL 79 CO -0.00 0.59 -0.19 -0.29 0.02 0.00 0.00 177.57 177.69 2fgx h ILE 80 N -0.10 1.25 -0.36 4.57 6.09 -1.35 -2.17 117.51 125.44 2fgx h ILE 80 Ca -0.07 -1.14 -0.06 0.00 -1.37 0.00 0.00 64.86 62.22 2fgx h ILE 80 Cb 1.27 1.26 -0.02 0.00 0.47 0.00 0.00 36.82 39.81 2fgx h ILE 80 CO 0.11 0.37 -0.04 1.23 -3.07 0.00 0.00 178.15 176.75 2fgx h GLY 81 N 0.97 0.63 1.69 8.18 0.00 -0.98 0.47 103.07 114.02 2fgx h GLY 81 Ca 0.07 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 46.94 2fgx h GLY 81 CO 0.04 0.37 -0.11 0.00 0.00 0.00 0.00 176.54 176.84 2fgx h ALA 82 N 1.42 1.38 0.16 3.60 0.00 -0.91 -3.08 119.26 121.82 2fgx h ALA 82 Ca 0.11 -0.23 -0.35 0.00 0.00 0.00 0.00 54.91 54.43 2fgx h ALA 82 Cb 0.41 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2fgx h ALA 82 CO 0.02 0.43 -1.84 -0.92 0.00 0.00 0.00 179.25 176.94 2fgx h TYR 83 N 0.36 0.62 0.00 0.00 3.20 -0.99 -3.36 116.97 116.80 2fgx h TYR 83 Ca 0.07 -0.45 0.00 0.00 3.14 0.00 0.00 58.73 61.49 2fgx h TYR 83 Cb 0.41 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.66 2fgx h TYR 83 CO 0.01 1.72 0.00 1.28 -1.64 0.00 0.00 178.16 179.53 2fgx n LEU 84 N -3.57 0.00 0.00 2.82 7.99 0.16 -5.02 117.00 119.38 2fgx n LEU 84 Ca -0.28 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.72 2fgx n LEU 84 Cb 1.06 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.37 2fgx n LEU 84 CO 0.48 0.00 0.00 -1.20 -1.51 0.00 0.00 177.39 175.16