#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fuh h LEU 3 N 0.00 0.76 0.02 0.00 -0.00 -1.99 0.19 115.31 114.29 2fuh h LEU 3 Ca 0.00 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 2fuh h LEU 3 Cb 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 40.49 2fuh h LEU 3 CO 0.00 0.52 -0.11 0.07 -0.00 0.00 0.00 178.44 178.92 2fuh h LYS 4 N 0.88 0.05 0.35 1.13 2.10 -1.98 -3.03 116.57 116.07 2fuh h LYS 4 Ca 0.30 -0.07 -0.01 0.00 -2.00 0.00 0.00 60.65 58.87 2fuh h LYS 4 Cb 0.09 0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2fuh h LYS 4 CO -0.09 0.99 -0.28 -0.09 -2.00 0.00 0.00 179.45 177.98 2fuh h ARG 5 N -0.87 -0.62 -0.97 0.07 2.43 -1.96 -1.94 114.38 110.53 2fuh h ARG 5 Ca -0.02 0.04 0.16 0.00 -0.81 0.00 0.00 59.98 59.35 2fuh h ARG 5 Cb 1.04 0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 30.65 2fuh h ARG 5 CO 0.02 -0.41 0.61 0.82 -1.51 0.00 0.00 179.97 179.50 2fuh h ILE 6 N -0.64 0.80 0.00 1.20 2.04 -0.78 0.59 117.51 120.72 2fuh h ILE 6 Ca -0.03 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2fuh h ILE 6 Cb 0.56 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2fuh h ILE 6 CO -0.02 0.15 0.00 -1.13 0.00 0.00 0.00 178.15 177.15 2fuh h ASN 7 N 0.80 0.00 0.01 1.72 -0.73 -1.27 -2.89 115.58 113.21 2fuh h ASN 7 Ca 0.52 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.68 2fuh h ASN 7 Cb 0.75 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.34 2fuh h ASN 7 CO -0.29 0.00 -0.00 0.50 -0.37 0.00 0.00 177.43 177.27 2fuh h LYS 8 N 0.00 -0.01 -0.26 6.67 3.11 0.95 -2.32 116.57 124.70 2fuh h LYS 8 Ca 0.00 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.75 2fuh h LYS 8 Cb 0.31 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.53 2fuh h LYS 8 CO 0.00 0.04 -0.23 0.93 -2.81 0.00 0.00 179.45 177.37 2fuh h GLU 9 N -0.05 0.49 -0.86 1.90 5.08 -1.56 -2.78 114.58 116.81 2fuh h GLU 9 Ca -0.00 -0.18 0.07 0.00 -1.00 0.00 0.00 59.36 58.25 2fuh h GLU 9 Cb 0.05 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 2fuh h GLU 9 CO 0.00 0.70 0.56 1.25 -1.00 0.00 0.00 179.01 180.52 2fuh h LEU 10 N 0.44 0.82 0.03 1.33 6.46 -1.38 0.35 115.31 123.36 2fuh h LEU 10 Ca 0.07 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.84 2fuh h LEU 10 Cb 0.65 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 2fuh h LEU 10 CO 0.05 0.52 -0.02 -1.28 -0.62 0.00 0.00 178.44 177.09 2fuh h SER 11 N 0.93 -0.04 1.24 1.25 0.87 -1.13 0.38 113.55 117.05 2fuh h SER 11 Ca 0.38 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.91 2fuh h SER 11 Cb 0.27 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.24 2fuh h SER 11 CO -0.15 -0.03 -0.14 0.44 -0.53 0.00 0.00 176.83 176.43 2fuh h ASP 12 N -0.05 0.00 0.01 6.23 3.32 -1.44 -2.39 116.42 122.11 2fuh h ASP 12 Ca -0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 2fuh h ASP 12 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2fuh h ASP 12 CO 0.00 0.14 -0.16 0.25 -1.72 0.00 0.00 179.24 177.75 2fuh h LEU 13 N 0.00 0.13 0.67 1.55 5.85 0.30 -3.04 115.31 120.77 2fuh h LEU 13 Ca -0.00 -0.83 -0.03 0.00 0.84 0.00 0.00 57.88 57.85 2fuh h LEU 13 Cb 0.79 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.79 2fuh h LEU 13 CO 0.02 0.94 -0.32 0.00 -0.34 0.00 0.00 178.44 178.74 2fuh h ALA 14 N 0.18 -0.96 -1.08 1.25 0.00 -0.27 0.50 119.26 118.88 2fuh h ALA 14 Ca -0.02 -0.20 0.34 0.00 0.00 0.00 0.00 54.91 55.03 2fuh h ALA 14 Cb 0.98 0.35 -0.14 0.00 0.00 0.00 0.00 17.79 18.98 2fuh h ALA 14 CO 0.03 -0.90 0.65 0.00 0.00 0.00 0.00 179.25 179.04 2fuh h ARG 15 N -1.17 0.26 -0.92 0.00 3.08 -1.60 -3.34 114.38 110.69 2fuh h ARG 15 Ca -0.09 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 2fuh h ARG 15 Cb 0.69 -0.06 -0.19 0.00 0.08 0.00 0.00 29.97 30.49 2fuh h ARG 15 CO 0.15 0.17 -0.41 -0.51 -1.07 0.00 0.00 179.97 178.31 2fuh s ASP 16 N -4.85 -1.43 0.45 7.04 1.01 -1.15 -5.10 116.67 112.65 2fuh s ASP 16 Ca -0.09 -0.65 -0.20 0.00 0.71 0.00 0.00 52.55 52.32 2fuh s ASP 16 Cb 0.29 1.83 -0.10 0.00 1.01 0.00 0.00 42.92 45.95 2fuh s ASP 16 CO 0.80 -0.17 0.97 -2.16 0.21 0.00 0.00 175.17 174.82 2fuh s PRO 17 N 1.94 4.12 0.06 8.23 0.04 0.17 -4.45 135.00 145.11 2fuh s PRO 17 Ca 0.16 1.13 -0.36 0.00 0.04 0.00 0.00 61.00 61.97 2fuh s PRO 17 Cb -0.04 -2.16 -0.15 0.00 0.04 0.00 0.00 34.50 32.19 2fuh s PRO 17 CO -0.09 -0.13 1.53 -2.30 0.04 0.00 0.00 177.00 176.05 2fuh n PRO 18 N -0.83 1.64 0.06 0.56 -0.02 -1.26 -4.88 135.00 130.28 2fuh n PRO 18 Ca 0.07 0.59 -0.12 0.00 -2.02 0.00 0.00 63.50 62.03 2fuh n PRO 18 Cb 0.54 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 2fuh n PRO 18 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fuh h ALA 19 N 5.88 0.45 -0.04 3.55 0.00 -2.01 -3.09 119.26 124.01 2fuh h ALA 19 Ca -0.47 -0.68 0.01 0.00 0.00 0.00 0.00 54.91 53.78 2fuh h ALA 19 Cb 1.30 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2fuh h ALA 19 CO 0.86 0.81 0.04 0.37 0.00 0.00 0.00 179.25 181.33 2fuh h GLN 20 N 0.24 0.00 -1.90 0.00 5.75 -1.98 -3.42 115.11 113.79 2fuh h GLN 20 Ca -0.06 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2fuh h GLN 20 Cb 1.48 0.00 -0.22 0.00 1.07 0.00 0.00 27.48 29.81 2fuh h GLN 20 CO 0.15 0.00 0.18 0.00 -2.65 0.00 0.00 178.83 176.51 2fuh s SER 22 N 0.68 6.70 0.06 0.00 0.15 -1.25 -4.15 113.70 115.88 2fuh s SER 22 Ca -0.02 1.09 -0.26 0.00 0.70 0.00 0.00 55.95 57.46 2fuh s SER 22 Cb -0.05 -2.30 0.09 0.00 -1.71 0.00 0.00 66.02 62.05 2fuh s SER 22 CO -0.06 -0.13 0.76 0.00 1.20 0.00 0.00 173.24 175.01 2fuh s ALA 23 N -1.89 -1.73 0.00 5.45 0.00 -1.26 -1.99 121.76 120.34 2fuh s ALA 23 Ca 0.51 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.29 2fuh s ALA 23 Cb -0.11 0.56 0.00 0.00 0.00 0.00 0.00 23.12 23.57 2fuh s ALA 23 CO 0.19 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.67 2fuh n GLY 24 N -0.21 1.34 3.78 0.00 0.00 -1.14 -5.00 105.19 103.96 2fuh n GLY 24 Ca -0.13 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.05 2fuh n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fuh s PRO 25 N -2.00 3.84 -0.02 1.61 0.04 -1.26 -3.63 135.00 133.57 2fuh s PRO 25 Ca 0.00 1.53 -0.24 0.00 0.04 0.00 0.00 61.00 62.32 2fuh s PRO 25 Cb 0.00 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2fuh s PRO 25 CO 0.00 -0.43 0.74 0.08 0.04 0.00 0.00 177.00 177.43 2fuh s VAL 26 N -1.76 4.93 0.00 -0.36 1.01 -1.18 -4.92 120.40 118.12 2fuh s VAL 26 Ca 0.64 1.55 0.00 0.00 0.00 0.00 0.00 61.98 64.17 2fuh s VAL 26 Cb -0.22 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.08 2fuh s VAL 26 CO 0.26 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.26 2fuh n GLY 27 N 2.84 -0.24 0.00 4.51 0.00 -1.26 -3.08 105.19 107.97 2fuh n GLY 27 Ca -0.01 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.48 2fuh n GLY 27 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2fuh n ASP 28 N -3.38 0.00 -4.56 1.61 2.03 -1.26 -4.72 116.55 106.28 2fuh n ASP 28 Ca 0.00 -0.70 -0.39 0.00 0.52 0.00 0.00 54.79 54.22 2fuh n ASP 28 Cb 0.00 -0.08 -0.03 0.00 -0.72 0.00 0.00 41.12 40.29 2fuh n ASP 28 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2fuh s ASP 29 N -2.16 5.49 -1.23 1.67 1.01 -1.18 -4.91 116.67 115.38 2fuh s ASP 29 Ca 0.39 0.36 -0.17 0.00 0.71 0.00 0.00 52.55 53.85 2fuh s ASP 29 Cb 0.20 -2.53 0.11 0.00 1.01 0.00 0.00 42.92 41.71 2fuh s ASP 29 CO 0.36 -2.20 1.56 -0.04 0.21 0.00 0.00 175.17 175.07 2fuh s MET 30 N 6.64 3.99 0.00 8.23 -1.94 -1.26 -3.94 119.30 131.02 2fuh s MET 30 Ca 0.64 -2.18 0.00 0.00 -1.71 0.00 0.00 55.69 52.44 2fuh s MET 30 Cb -0.13 -5.30 0.00 0.00 2.01 0.00 0.00 34.83 31.41 2fuh s MET 30 CO 0.22 -2.03 0.00 1.19 -0.01 0.00 0.00 175.02 174.39 2fuh n PHE 31 N 7.19 0.00 -3.65 -0.03 3.72 -1.26 -4.78 117.46 118.65 2fuh n PHE 31 Ca 0.42 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.44 2fuh n PHE 31 Cb 0.45 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.88 2fuh n PHE 31 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2fuh s HIS 32 N -0.99 3.20 0.21 1.38 3.76 -1.25 -2.86 115.29 118.73 2fuh s HIS 32 Ca 0.00 -0.01 0.10 0.00 -0.15 0.00 0.00 55.06 55.01 2fuh s HIS 32 Cb 0.00 -2.33 -0.04 0.00 1.11 0.00 0.00 32.58 31.32 2fuh s HIS 32 CO 0.00 -0.18 -0.16 -1.58 -0.85 0.00 0.00 174.74 171.97 2fuh s TRP 33 N 1.62 2.45 0.24 1.40 0.52 -1.25 -3.13 118.94 120.78 2fuh s TRP 33 Ca 0.07 -0.30 -0.06 0.00 0.02 0.00 0.00 56.10 55.83 2fuh s TRP 33 Cb -0.15 -1.17 -0.02 0.00 -1.15 0.00 0.00 33.47 30.97 2fuh s TRP 33 CO 0.08 0.55 0.32 1.14 0.02 0.00 0.00 176.95 179.06 2fuh s GLN 34 N -2.94 1.43 0.35 4.98 -2.07 -1.24 0.41 119.66 120.58 2fuh s GLN 34 Ca 0.24 -1.47 -0.17 0.00 -1.82 0.00 0.00 55.36 52.14 2fuh s GLN 34 Cb -0.08 0.38 0.04 0.00 -1.09 0.00 0.00 33.01 32.26 2fuh s GLN 34 CO 0.13 -0.54 0.76 0.00 -1.32 0.00 0.00 175.29 174.32 2fuh s ALA 35 N -3.99 -0.89 0.04 2.60 0.00 -0.97 -2.87 121.76 115.68 2fuh s ALA 35 Ca 0.31 -0.61 -0.09 0.00 0.00 0.00 0.00 51.96 51.57 2fuh s ALA 35 Cb 0.03 0.74 0.00 0.00 0.00 0.00 0.00 23.12 23.89 2fuh s ALA 35 CO 0.12 -1.00 0.17 -0.08 0.00 0.00 0.00 175.76 174.97 2fuh s THR 36 N -2.88 0.11 -0.03 0.00 -1.32 -0.84 -2.86 115.64 107.81 2fuh s THR 36 Ca 0.14 -0.92 -0.02 0.00 -1.21 0.00 0.00 61.69 59.68 2fuh s THR 36 Cb -0.05 -0.88 0.02 0.00 -1.51 0.00 0.00 72.50 70.08 2fuh s THR 36 CO 0.10 -0.50 0.08 -0.63 -2.21 0.00 0.00 174.62 171.46 2fuh s ILE 37 N -2.49 -0.02 0.07 5.08 1.01 -0.75 -3.89 121.20 120.21 2fuh s ILE 37 Ca -0.06 0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.69 2fuh s ILE 37 Cb -0.02 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.28 2fuh s ILE 37 CO -0.04 0.02 0.01 -0.32 0.00 0.00 0.00 174.94 174.62 2fuh s MET 38 N 0.38 2.66 -0.43 2.79 1.75 -1.26 -0.88 119.30 124.31 2fuh s MET 38 Ca -0.03 -0.76 -0.37 0.00 -1.25 0.00 0.00 55.69 53.28 2fuh s MET 38 Cb -0.04 -2.60 -0.14 0.00 2.84 0.00 0.00 34.83 34.88 2fuh s MET 38 CO -0.01 0.56 2.21 0.41 -0.65 0.00 0.00 175.02 177.54 2fuh n GLY 39 N 0.74 0.24 0.00 2.11 0.00 -1.18 -4.70 105.19 102.40 2fuh n GLY 39 Ca -0.11 0.99 0.00 0.00 0.00 0.00 0.00 46.02 46.90 2fuh n GLY 39 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2fuh n PRO 40 N 8.03 0.00 -2.47 1.61 -0.02 -1.26 -4.61 135.00 136.28 2fuh n PRO 40 Ca 0.47 0.12 -0.05 0.00 -2.02 0.00 0.00 63.50 62.02 2fuh n PRO 40 Cb 0.15 -1.72 0.03 0.00 -0.02 0.00 0.00 33.50 31.93 2fuh n PRO 40 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2fuh n ASN 41 N -1.03 -2.20 0.00 2.55 3.02 -1.26 -4.91 115.26 111.43 2fuh n ASN 41 Ca 0.00 -0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 2fuh n ASN 41 Cb 0.22 -1.81 0.00 0.00 -0.61 0.00 0.00 39.78 37.58 2fuh n ASN 41 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2fuh n ASP 42 N -1.32 0.00 -4.90 6.41 9.92 -1.26 -5.08 116.55 120.31 2fuh n ASP 42 Ca -0.07 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 53.91 2fuh n ASP 42 Cb 0.54 0.27 0.02 0.00 -0.64 0.00 0.00 41.12 41.32 2fuh n ASP 42 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2fuh s SER 43 N -2.39 5.84 -0.96 -2.24 0.01 -1.26 -4.93 113.70 107.77 2fuh s SER 43 Ca 0.00 0.92 -0.24 0.00 1.31 0.00 0.00 55.95 57.94 2fuh s SER 43 Cb 0.00 -1.99 -0.16 0.00 0.21 0.00 0.00 66.02 64.09 2fuh s SER 43 CO 0.00 -0.94 1.93 -0.81 0.41 0.00 0.00 173.24 173.83 2fuh n PRO 44 N -2.57 1.20 -0.06 12.44 -0.04 -1.26 -3.32 135.00 141.39 2fuh n PRO 44 Ca 0.04 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.44 2fuh n PRO 44 Cb 0.56 -3.45 0.00 0.00 -0.04 0.00 0.00 33.50 30.58 2fuh n PRO 44 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2fuh n TYR 45 N 13.04 0.00 -1.64 0.54 4.01 -1.26 -4.77 117.16 127.08 2fuh n TYR 45 Ca 0.46 0.00 -0.47 0.00 -0.16 0.00 0.00 57.90 57.73 2fuh n TYR 45 Cb 0.45 0.13 -0.04 0.00 -0.31 0.00 0.00 39.34 39.56 2fuh n TYR 45 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2fuh n GLN 46 N 0.00 1.75 -0.85 -0.72 6.02 -1.21 -0.07 117.38 122.30 2fuh n GLN 46 Ca 0.00 0.63 0.00 0.00 -0.01 0.00 0.00 57.00 57.62 2fuh n GLN 46 Cb 0.11 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.10 2fuh n GLN 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2fuh n GLY 47 N 2.45 1.05 3.54 1.08 0.00 -1.26 -4.96 105.19 107.09 2fuh n GLY 47 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2fuh n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fuh s GLY 48 N -1.91 1.70 -0.04 -0.02 0.00 0.90 -4.75 107.32 103.20 2fuh s GLY 48 Ca 0.00 -1.06 -0.24 0.00 0.00 0.00 0.00 44.72 43.42 2fuh s GLY 48 CO 0.00 1.57 0.71 -1.34 0.00 0.00 0.00 173.10 174.04 2fuh s VAL 49 N 2.88 4.97 0.05 1.40 -7.23 -1.25 -3.09 120.40 118.13 2fuh s VAL 49 Ca 0.25 1.48 0.06 0.00 -1.81 0.00 0.00 61.98 61.95 2fuh s VAL 49 Cb -0.14 -4.05 -0.04 0.00 0.56 0.00 0.00 36.38 32.71 2fuh s VAL 49 CO 0.18 0.28 -0.11 -0.36 -0.31 0.00 0.00 175.10 174.78 2fuh s PHE 50 N 0.56 2.73 -0.03 2.82 0.08 -0.06 -4.69 117.98 119.40 2fuh s PHE 50 Ca 0.38 -0.15 0.03 0.00 0.12 0.00 0.00 56.93 57.30 2fuh s PHE 50 Cb -0.18 -1.50 0.00 0.00 -0.57 0.00 0.00 43.02 40.77 2fuh s PHE 50 CO 0.19 0.35 -0.10 -0.06 -0.10 0.00 0.00 175.22 175.51 2fuh s PHE 51 N -1.05 1.03 -0.03 0.36 0.08 -1.26 -1.80 117.98 115.31 2fuh s PHE 51 Ca 0.18 -0.27 0.00 0.00 0.12 0.00 0.00 56.93 56.96 2fuh s PHE 51 Cb -0.11 -0.74 0.03 0.00 -0.57 0.00 0.00 43.02 41.63 2fuh s PHE 51 CO 0.09 -0.12 0.00 -0.48 -0.10 0.00 0.00 175.22 174.61 2fuh s LEU 52 N 0.25 1.21 0.40 -0.37 0.05 -1.14 -3.32 118.68 115.76 2fuh s LEU 52 Ca -0.04 -0.01 0.02 0.00 0.05 0.00 0.00 54.13 54.14 2fuh s LEU 52 Cb -0.09 -0.18 -0.01 0.00 -2.05 0.00 0.00 46.19 43.85 2fuh s LEU 52 CO 0.01 -0.10 0.59 -0.89 -0.55 0.00 0.00 176.35 175.41 2fuh s THR 53 N 0.95 4.33 0.22 5.48 2.01 -1.24 -2.29 115.64 125.09 2fuh s THR 53 Ca -0.09 -0.60 0.06 0.00 0.31 0.00 0.00 61.69 61.36 2fuh s THR 53 Cb -0.13 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2fuh s THR 53 CO -0.02 -0.36 -0.08 -0.63 -0.69 0.00 0.00 174.62 172.85 2fuh s ILE 54 N -2.40 1.41 -0.24 1.82 1.01 0.17 -3.66 121.20 119.31 2fuh s ILE 54 Ca 0.45 -2.11 -0.03 0.00 0.00 0.00 0.00 60.65 58.96 2fuh s ILE 54 Cb -0.10 -2.18 0.11 0.00 0.01 0.00 0.00 42.46 40.30 2fuh s ILE 54 CO 0.36 -0.48 0.24 -1.00 0.00 0.00 0.00 174.94 174.05 2fuh s HIS 55 N -3.17 -0.29 0.23 3.97 3.76 -0.94 -3.79 115.29 115.06 2fuh s HIS 55 Ca 0.24 0.01 -0.29 0.00 -0.15 0.00 0.00 55.06 54.88 2fuh s HIS 55 Cb 0.03 -0.43 -0.09 0.00 1.11 0.00 0.00 32.58 33.19 2fuh s HIS 55 CO 0.07 -0.72 0.91 -0.06 -0.85 0.00 0.00 174.74 174.09 2fuh s PHE 56 N 2.32 3.96 0.66 1.40 0.08 -1.13 -2.90 117.98 122.37 2fuh s PHE 56 Ca 0.08 1.86 -0.13 0.00 0.12 0.00 0.00 56.93 58.86 2fuh s PHE 56 Cb -0.15 -2.94 -0.01 0.00 -0.57 0.00 0.00 43.02 39.35 2fuh s PHE 56 CO -0.21 0.46 1.06 -1.25 -0.10 0.00 0.00 175.22 175.19 2fuh s PRO 57 N -1.22 3.01 0.00 0.24 0.04 -1.26 -4.93 135.00 130.88 2fuh s PRO 57 Ca 0.40 1.09 0.31 0.00 0.04 0.00 0.00 61.00 62.85 2fuh s PRO 57 Cb -0.25 -2.00 1.88 0.00 0.04 0.00 0.00 34.50 34.17 2fuh s PRO 57 CO 0.31 -1.05 2.20 0.25 0.04 0.00 0.00 177.00 178.75 2fuh n THR 58 N -2.70 0.00 -1.11 1.26 -2.24 -1.26 -2.96 114.28 105.27 2fuh n THR 58 Ca 0.08 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.89 2fuh n THR 58 Cb 0.53 -0.50 0.26 0.00 -2.10 0.00 0.00 70.33 68.51 2fuh n THR 58 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2fuh n ASP 59 N -1.00 3.75 -0.46 3.42 9.92 -1.26 -5.02 116.55 125.91 2fuh n ASP 59 Ca 0.24 -3.24 0.00 0.00 -0.53 0.00 0.00 54.79 51.26 2fuh n ASP 59 Cb 0.11 -0.61 0.00 0.00 -0.64 0.00 0.00 41.12 39.98 2fuh n ASP 59 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2fuh n TYR 60 N -0.59 -1.26 0.01 1.24 4.01 -1.15 -4.22 117.16 115.20 2fuh n TYR 60 Ca 0.28 0.68 0.15 0.00 -0.16 0.00 0.00 57.90 58.85 2fuh n TYR 60 Cb 1.03 -1.42 0.22 0.00 -0.31 0.00 0.00 39.34 38.87 2fuh n TYR 60 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2fuh n PRO 61 N -1.81 0.02 0.26 -0.72 -0.02 -1.26 -0.78 135.00 130.68 2fuh n PRO 61 Ca 0.00 0.88 0.05 0.00 -2.02 0.00 0.00 63.50 62.40 2fuh n PRO 61 Cb 0.14 -2.26 0.25 0.00 -0.02 0.00 0.00 33.50 31.60 2fuh n PRO 61 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2fuh h PHE 62 N 0.00 0.00 -3.34 6.00 -1.00 -1.81 -3.37 116.94 113.42 2fuh h PHE 62 Ca 0.26 0.00 -0.68 0.00 2.81 0.00 0.00 57.97 60.36 2fuh h PHE 62 Cb 2.26 0.00 -0.16 0.00 3.61 0.00 0.00 35.95 41.67 2fuh h PHE 62 CO 0.00 0.00 -0.63 0.15 -1.61 0.00 0.00 178.31 176.22 2fuh s LYS 63 N -3.62 3.02 -0.20 1.51 1.02 0.04 -4.98 119.74 116.54 2fuh s LYS 63 Ca -0.01 -0.42 -0.36 0.00 0.02 0.00 0.00 55.97 55.20 2fuh s LYS 63 Cb 0.03 -2.80 -0.12 0.00 -0.52 0.00 0.00 37.83 34.42 2fuh s LYS 63 CO 0.08 0.67 1.92 -2.30 -0.92 0.00 0.00 175.35 174.80 2fuh n PRO 64 N 2.24 1.69 -2.74 -1.68 -0.02 -1.26 -4.72 135.00 128.51 2fuh n PRO 64 Ca -0.18 0.59 -0.36 0.00 -2.02 0.00 0.00 63.50 61.53 2fuh n PRO 64 Cb 0.53 -2.49 -0.06 0.00 -0.02 0.00 0.00 33.50 31.47 2fuh n PRO 64 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2fuh s PRO 65 N 4.42 4.38 0.08 0.52 0.04 -1.26 -4.88 135.00 138.30 2fuh s PRO 65 Ca 0.98 1.30 -0.21 0.00 0.04 0.00 0.00 61.00 63.11 2fuh s PRO 65 Cb -0.81 -2.54 -0.07 0.00 0.04 0.00 0.00 34.50 31.11 2fuh s PRO 65 CO 0.55 0.09 0.61 0.15 0.04 0.00 0.00 177.00 178.44 2fuh s LYS 66 N -2.51 4.29 0.01 4.56 1.02 -1.14 -4.95 119.74 121.02 2fuh s LYS 66 Ca 0.56 0.82 0.01 0.00 0.02 0.00 0.00 55.97 57.38 2fuh s LYS 66 Cb -0.16 -3.26 -0.01 0.00 -0.52 0.00 0.00 37.83 33.88 2fuh s LYS 66 CO 0.21 0.57 -0.05 0.08 -0.92 0.00 0.00 175.35 175.25 2fuh s VAL 67 N -0.94 0.34 0.22 3.17 1.01 -1.26 -2.21 120.40 120.73 2fuh s VAL 67 Ca 0.31 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 2fuh s VAL 67 Cb -0.20 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2fuh s VAL 67 CO 0.20 -0.09 0.17 0.00 0.00 0.00 0.00 175.10 175.38 2fuh s ALA 68 N -0.54 1.14 -0.30 5.51 0.00 -1.24 -4.58 121.76 121.74 2fuh s ALA 68 Ca -0.03 -1.68 0.03 0.00 0.00 0.00 0.00 51.96 50.28 2fuh s ALA 68 Cb -0.04 1.38 0.08 0.00 0.00 0.00 0.00 23.12 24.54 2fuh s ALA 68 CO -0.00 -0.61 -0.01 0.12 0.00 0.00 0.00 175.76 175.25 2fuh s PHE 69 N -4.08 3.43 0.38 0.00 5.36 -1.19 -3.68 117.98 118.20 2fuh s PHE 69 Ca 0.38 -2.64 0.22 0.00 -0.96 0.00 0.00 56.93 53.93 2fuh s PHE 69 Cb 0.06 -2.44 1.15 0.00 -0.34 0.00 0.00 43.02 41.45 2fuh s PHE 69 CO 0.13 -0.91 1.97 0.00 -1.46 0.00 0.00 175.22 174.95 2fuh h THR 70 N 6.67 0.82 -3.46 0.12 1.03 -1.93 -3.41 112.91 112.75 2fuh h THR 70 Ca -0.11 -0.79 -0.54 0.00 -0.01 0.00 0.00 66.41 64.96 2fuh h THR 70 Cb 1.03 1.47 -0.03 0.00 -1.07 0.00 0.00 68.15 69.55 2fuh h THR 70 CO 0.49 0.20 0.05 -0.89 -0.01 0.00 0.00 175.52 175.36 2fuh s THR 71 N -4.20 4.63 -0.87 0.00 2.01 -1.26 -5.01 115.64 110.96 2fuh s THR 71 Ca -0.03 1.23 -0.23 0.00 0.31 0.00 0.00 61.69 62.97 2fuh s THR 71 Cb 0.13 -3.87 0.07 0.00 0.01 0.00 0.00 72.50 68.84 2fuh s THR 71 CO 0.64 0.31 1.24 -0.13 -0.69 0.00 0.00 174.62 175.99 2fuh s ARG 72 N -1.74 3.41 -0.24 4.92 1.81 -1.26 -4.98 118.95 120.87 2fuh s ARG 72 Ca 0.39 -1.02 -0.08 0.00 -1.72 0.00 0.00 55.73 53.30 2fuh s ARG 72 Cb -0.17 -4.78 -0.04 0.00 -0.45 0.00 0.00 34.95 29.51 2fuh s ARG 72 CO 0.21 -2.02 0.09 -1.50 -0.68 0.00 0.00 175.30 171.40 2fuh s ILE 73 N 4.44 4.62 -0.65 1.52 2.07 -1.26 -4.87 121.20 127.06 2fuh s ILE 73 Ca 0.36 -0.07 -0.05 0.00 -1.41 0.00 0.00 60.65 59.48 2fuh s ILE 73 Cb -0.06 -3.15 0.05 0.00 0.13 0.00 0.00 42.46 39.43 2fuh s ILE 73 CO -0.00 0.35 2.75 0.00 -1.91 0.00 0.00 174.94 176.12 2fuh n TYR 74 N 4.61 1.74 -3.67 3.50 9.36 -1.26 -4.88 117.16 126.56 2fuh n TYR 74 Ca -0.16 -2.14 -0.37 0.00 3.32 0.00 0.00 57.90 58.55 2fuh n TYR 74 Cb 0.52 -1.53 -0.07 0.00 -0.63 0.00 0.00 39.34 37.63 2fuh n TYR 74 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2fuh s HIS 75 N -1.31 3.55 -0.69 2.98 2.46 -1.26 -4.91 115.29 116.10 2fuh s HIS 75 Ca 0.59 0.61 -0.17 0.00 0.47 0.00 0.00 55.06 56.56 2fuh s HIS 75 Cb 0.33 -2.17 -0.14 0.00 -0.13 0.00 0.00 32.58 30.46 2fuh s HIS 75 CO -0.17 0.49 1.89 -0.35 -2.47 0.00 0.00 174.74 174.12 2fuh n PRO 76 N 2.71 1.43 0.00 2.88 -0.04 -1.26 -2.26 135.00 138.46 2fuh n PRO 76 Ca -0.16 -1.57 0.00 0.00 -0.04 0.00 0.00 63.50 61.73 2fuh n PRO 76 Cb 0.53 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 31.30 2fuh n PRO 76 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2fuh n ASN 77 N 6.54 0.00 -3.92 3.54 2.85 -1.26 -4.79 115.26 118.23 2fuh n ASN 77 Ca 0.45 -0.11 -0.22 0.00 -0.11 0.00 0.00 54.58 54.59 2fuh n ASN 77 Cb 0.30 0.00 -0.17 0.00 1.24 0.00 0.00 39.78 41.16 2fuh n ASN 77 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2fuh s ILE 78 N 0.00 0.72 0.00 -1.44 1.01 -0.96 -3.90 121.20 116.62 2fuh s ILE 78 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.44 2fuh s ILE 78 Cb 0.00 -0.72 0.00 0.00 0.01 0.00 0.00 42.46 41.75 2fuh s ILE 78 CO 0.00 0.27 0.00 -3.20 0.00 0.00 0.00 174.94 172.01 2fuh n ASN 79 N 4.12 0.00 0.07 3.58 4.05 -1.21 -4.71 115.26 121.17 2fuh n ASN 79 Ca -0.22 0.00 -0.19 0.00 0.45 0.00 0.00 54.58 54.62 2fuh n ASN 79 Cb 0.51 0.00 -0.14 0.00 1.23 0.00 0.00 39.78 41.37 2fuh n ASN 79 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 177.26 174.98 2fuh h SER 80 N 0.00 0.48 0.00 1.20 4.64 -1.94 -3.26 113.55 114.67 2fuh h SER 80 Ca 0.00 -0.67 0.00 0.00 -0.47 0.00 0.00 61.79 60.65 2fuh h SER 80 Cb 0.00 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 2fuh h SER 80 CO 0.00 1.56 0.00 -0.46 -0.87 0.00 0.00 176.83 177.06 2fuh n ASN 81 N -3.50 0.00 -0.17 4.97 6.94 -1.26 -4.81 115.26 117.43 2fuh n ASN 81 Ca -0.19 -0.74 0.00 0.00 -0.02 0.00 0.00 54.58 53.63 2fuh n ASN 81 Cb 1.06 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.48 2fuh n ASN 81 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2fuh n GLY 82 N 0.27 0.58 3.56 4.83 0.00 -1.23 -4.22 105.19 108.99 2fuh n GLY 82 Ca 0.13 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 2fuh n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fuh s SER 83 N -2.98 5.76 -0.15 1.61 0.01 -1.26 -3.19 113.70 113.50 2fuh s SER 83 Ca 0.00 0.26 -0.18 0.00 1.31 0.00 0.00 55.95 57.34 2fuh s SER 83 Cb 0.00 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 2fuh s SER 83 CO 0.00 -2.00 0.49 -0.63 0.41 0.00 0.00 173.24 171.50 2fuh s ILE 84 N 7.30 5.16 -0.40 1.44 1.01 -1.26 -3.33 121.20 131.11 2fuh s ILE 84 Ca 0.58 0.94 -0.28 0.00 0.00 0.00 0.00 60.65 61.89 2fuh s ILE 84 Cb -0.12 -3.82 0.02 0.00 0.01 0.00 0.00 42.46 38.55 2fuh s ILE 84 CO 0.22 0.27 1.04 0.00 0.00 0.00 0.00 174.94 176.48 2fuh s LEU 86 N 3.90 1.22 0.61 0.00 1.43 -1.26 -4.99 118.68 119.59 2fuh s LEU 86 Ca 0.44 -0.76 0.33 0.00 -1.03 0.00 0.00 54.13 53.11 2fuh s LEU 86 Cb -0.10 -0.63 1.93 0.00 0.03 0.00 0.00 46.19 47.42 2fuh s LEU 86 CO 0.23 -0.28 2.26 -0.78 0.23 0.00 0.00 176.35 178.00 2fuh h ASP 87 N 8.23 0.00 -0.55 2.29 1.82 -1.97 -2.33 116.42 123.92 2fuh h ASP 87 Ca -0.17 0.00 0.10 0.00 -0.39 0.00 0.00 57.03 56.57 2fuh h ASP 87 Cb 1.12 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 41.04 2fuh h ASP 87 CO 0.34 0.00 0.07 0.40 -1.61 0.00 0.00 179.24 178.44 2fuh h ILE 88 N 0.00 0.63 -0.97 2.25 1.08 -1.95 -0.09 117.51 118.47 2fuh h ILE 88 Ca 0.01 -0.07 0.16 0.00 -0.39 0.00 0.00 64.86 64.57 2fuh h ILE 88 Cb 0.08 0.42 -0.09 0.00 -3.07 0.00 0.00 36.82 34.16 2fuh h ILE 88 CO -0.00 0.04 0.61 -0.07 -0.69 0.00 0.00 178.15 178.04 2fuh h LEU 89 N 0.20 0.77 0.00 1.44 4.07 -1.66 0.09 115.31 120.22 2fuh h LEU 89 Ca 0.28 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.30 2fuh h LEU 89 Cb 0.42 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.07 2fuh h LEU 89 CO -0.40 0.35 0.00 0.54 -1.08 0.00 0.00 178.44 177.85 2fuh n ARG 90 N -4.64 -0.89 -0.29 1.13 1.74 -0.05 -4.36 116.66 109.29 2fuh n ARG 90 Ca 0.20 0.00 0.30 0.00 -0.77 0.00 0.00 57.85 57.58 2fuh n ARG 90 Cb 0.48 0.00 0.46 0.00 -1.02 0.00 0.00 32.46 32.38 2fuh n ARG 90 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2fuh n SER 91 N -2.33 0.00 -0.95 0.55 2.88 -1.26 0.89 113.62 113.40 2fuh n SER 91 Ca 0.00 0.71 0.00 0.00 -1.33 0.00 0.00 58.87 58.25 2fuh n SER 91 Cb 0.00 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 2fuh n SER 91 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fuh n GLN 92 N -3.15 0.87 -3.54 -1.46 1.13 -1.25 -4.68 117.38 105.30 2fuh n GLN 92 Ca 0.25 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.90 2fuh n GLN 92 Cb 1.44 -1.11 -0.09 0.00 0.11 0.00 0.00 30.24 30.60 2fuh n GLN 92 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 2fuh s TRP 93 N 0.01 3.35 -0.22 1.08 -0.11 0.26 -4.52 118.94 118.79 2fuh s TRP 93 Ca 0.00 -1.55 -0.23 0.00 1.22 0.00 0.00 56.10 55.55 2fuh s TRP 93 Cb 0.00 -3.23 -0.02 0.00 -1.50 0.00 0.00 33.47 28.73 2fuh s TRP 93 CO 0.00 -0.90 0.73 -1.12 -4.62 0.00 0.00 176.95 171.03 2fuh s SER 94 N 2.48 6.76 0.00 5.86 0.01 -1.26 -4.90 113.70 122.64 2fuh s SER 94 Ca 0.04 0.93 0.00 0.00 1.31 0.00 0.00 55.95 58.23 2fuh s SER 94 Cb -0.25 -2.39 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2fuh s SER 94 CO 0.02 -0.39 0.62 -2.65 0.41 0.00 0.00 173.24 171.25 2fuh n PRO 95 N 5.51 0.00 -3.08 12.44 -0.02 -1.26 -1.80 135.00 146.79 2fuh n PRO 95 Ca 0.02 0.14 -0.19 0.00 -2.02 0.00 0.00 63.50 61.45 2fuh n PRO 95 Cb 0.49 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.10 2fuh n PRO 95 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fuh n ALA 96 N -1.12 1.41 -2.82 3.55 0.00 -1.26 -4.57 120.51 115.70 2fuh n ALA 96 Ca 0.00 -2.90 -0.30 0.00 0.00 0.00 0.00 53.44 50.24 2fuh n ALA 96 Cb 0.34 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.78 2fuh n ALA 96 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2fuh s LEU 97 N -1.39 3.95 -0.87 0.00 0.05 -0.74 -5.05 118.68 114.63 2fuh s LEU 97 Ca 0.35 0.05 -0.23 0.00 0.05 0.00 0.00 54.13 54.35 2fuh s LEU 97 Cb 0.22 -2.61 0.06 0.00 -2.05 0.00 0.00 46.19 41.82 2fuh s LEU 97 CO -0.13 0.16 1.26 -0.89 -0.55 0.00 0.00 176.35 176.21 2fuh s THR 98 N -1.46 4.09 0.58 5.48 2.01 -1.26 -4.84 115.64 120.24 2fuh s THR 98 Ca 0.31 -0.54 0.17 0.00 0.31 0.00 0.00 61.69 61.94 2fuh s THR 98 Cb -0.12 -4.91 0.25 0.00 0.01 0.00 0.00 72.50 67.73 2fuh s THR 98 CO 0.24 -1.76 1.12 0.00 -0.69 0.00 0.00 174.62 173.53 2fuh n ILE 99 N 6.33 0.00 -0.29 1.82 3.06 -1.26 0.91 119.36 129.93 2fuh n ILE 99 Ca 0.17 1.10 0.13 0.00 -2.50 0.00 0.00 62.75 61.65 2fuh n ILE 99 Cb 0.49 -2.03 0.38 0.00 0.54 0.00 0.00 39.64 39.02 2fuh n ILE 99 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 2fuh h SER 100 N 0.00 0.66 -0.02 9.51 4.64 -1.99 0.43 113.55 126.77 2fuh h SER 100 Ca 0.32 0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.54 2fuh h SER 100 Cb 2.47 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 64.48 2fuh h SER 100 CO -0.00 0.30 -0.50 0.07 -0.87 0.00 0.00 176.83 175.83 2fuh h LYS 101 N 0.68 0.58 0.08 4.77 2.10 0.12 -3.14 116.57 121.76 2fuh h LYS 101 Ca 0.49 -0.34 0.01 0.00 -2.00 0.00 0.00 60.65 58.81 2fuh h LYS 101 Cb 0.83 0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 32.17 2fuh h LYS 101 CO -0.24 0.95 -0.14 0.28 -2.00 0.00 0.00 179.45 178.30 2fuh h VAL 102 N 0.46 0.68 -0.60 0.07 2.07 -1.04 -1.03 116.25 116.87 2fuh h VAL 102 Ca 0.02 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.65 2fuh h VAL 102 Cb 1.03 0.68 -0.08 0.00 -1.52 0.00 0.00 31.29 31.40 2fuh h VAL 102 CO 0.10 0.00 0.13 -0.07 0.02 0.00 0.00 177.57 177.75 2fuh h LEU 103 N -0.27 0.01 -1.10 2.57 4.07 -1.47 0.32 115.31 119.44 2fuh h LEU 103 Ca 0.02 0.11 0.01 0.00 0.08 0.00 0.00 57.88 58.10 2fuh h LEU 103 Cb 0.29 0.15 -0.05 0.00 1.08 0.00 0.00 40.66 42.13 2fuh h LEU 103 CO -0.08 0.01 0.60 -0.07 -1.08 0.00 0.00 178.44 177.83 2fuh h LEU 104 N 0.26 1.05 -0.92 1.67 4.07 -1.41 -1.77 115.31 118.27 2fuh h LEU 104 Ca 0.31 -0.03 0.13 0.00 0.08 0.00 0.00 57.88 58.38 2fuh h LEU 104 Cb 0.46 -0.26 -0.09 0.00 1.08 0.00 0.00 40.66 41.85 2fuh h LEU 104 CO -0.40 0.76 0.54 0.28 -1.08 0.00 0.00 178.44 178.55 2fuh h SER 105 N 1.24 0.74 0.17 -0.43 0.02 0.40 0.89 113.55 116.57 2fuh h SER 105 Ca 0.33 0.07 -0.15 0.00 -0.84 0.00 0.00 61.79 61.21 2fuh h SER 105 Cb -0.14 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 2fuh h SER 105 CO -0.07 0.36 -0.54 0.40 -1.14 0.00 0.00 176.83 175.84 2fuh h ILE 106 N 0.81 1.34 -0.34 3.27 2.04 -0.98 -1.93 117.51 121.72 2fuh h ILE 106 Ca 0.48 -1.81 -0.04 0.00 1.00 0.00 0.00 64.86 64.49 2fuh h ILE 106 Cb 0.57 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 2fuh h ILE 106 CO -0.31 0.55 0.06 0.00 0.00 0.00 0.00 178.15 178.45 2fuh h SER 108 N 0.39 0.00 -0.32 0.00 4.64 -0.92 -2.84 113.55 114.50 2fuh h SER 108 Ca 0.10 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.45 2fuh h SER 108 Cb 0.34 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.40 2fuh h SER 108 CO 0.01 0.26 0.14 0.25 -0.87 0.00 0.00 176.83 176.62 2fuh h LEU 109 N 0.00 0.19 -0.30 5.97 5.85 -0.96 0.16 115.31 126.21 2fuh h LEU 109 Ca -0.00 0.02 -0.20 0.00 0.84 0.00 0.00 57.88 58.54 2fuh h LEU 109 Cb 0.74 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.76 2fuh h LEU 109 CO 0.03 0.15 -0.79 -0.07 -0.34 0.00 0.00 178.44 177.42 2fuh h LEU 110 N 0.30 0.60 0.00 2.25 4.07 -1.48 -1.27 115.31 119.78 2fuh h LEU 110 Ca 0.14 -0.41 0.00 0.00 0.08 0.00 0.00 57.88 57.69 2fuh h LEU 110 Cb 0.08 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.64 2fuh h LEU 110 CO -0.12 1.18 0.00 0.00 -1.08 0.00 0.00 178.44 178.42 2fuh n ASP 112 N -0.75 -1.83 -4.85 0.00 -0.08 0.52 -5.02 116.55 104.54 2fuh n ASP 112 Ca 0.11 -2.36 -0.30 0.00 -1.51 0.00 0.00 54.79 50.73 2fuh n ASP 112 Cb 0.05 1.17 0.06 0.00 2.34 0.00 0.00 41.12 44.74 2fuh n ASP 112 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 2fuh s PRO 113 N 0.29 2.69 -0.42 -0.67 0.04 -0.50 -4.63 135.00 131.79 2fuh s PRO 113 Ca 0.27 0.60 0.07 0.00 0.04 0.00 0.00 61.00 61.97 2fuh s PRO 113 Cb 0.23 -1.99 0.23 0.00 0.04 0.00 0.00 34.50 33.00 2fuh s PRO 113 CO -0.14 -1.18 0.57 0.09 0.04 0.00 0.00 177.00 176.37 2fuh n ASN 114 N -3.13 -0.83 -4.50 6.66 4.13 -1.26 -5.10 115.26 111.22 2fuh n ASN 114 Ca 0.07 -2.75 -0.54 0.00 1.68 0.00 0.00 54.58 53.04 2fuh n ASN 114 Cb 0.56 0.03 -0.08 0.00 -1.54 0.00 0.00 39.78 38.75 2fuh n ASN 114 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 2fuh n PRO 115 N 1.89 0.98 0.00 3.52 -0.02 -1.26 -4.76 135.00 135.35 2fuh n PRO 115 Ca 0.21 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2fuh n PRO 115 Cb 0.54 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 2fuh n PRO 115 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2fuh n ASP 116 N 8.19 0.00 -2.75 2.55 2.03 -1.26 -5.04 116.55 120.27 2fuh n ASP 116 Ca 0.39 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.53 2fuh n ASP 116 Cb 0.17 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.57 2fuh n ASP 116 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2fuh n ASP 117 N 0.00 2.43 -2.93 1.67 8.00 -1.26 -5.00 116.55 119.46 2fuh n ASP 117 Ca 0.00 -3.12 -0.13 0.00 0.71 0.00 0.00 54.79 52.25 2fuh n ASP 117 Cb 0.00 -0.53 0.10 0.00 -0.02 0.00 0.00 41.12 40.67 2fuh n ASP 117 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2fuh n PRO 118 N -0.11 -1.69 -0.02 -0.24 -0.04 -1.26 -4.87 135.00 126.77 2fuh n PRO 118 Ca 0.22 -0.78 -0.00 0.00 -0.04 0.00 0.00 63.50 62.90 2fuh n PRO 118 Cb 0.70 -0.69 0.01 0.00 -0.04 0.00 0.00 33.50 33.48 2fuh n PRO 118 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2fuh n LEU 119 N 0.00 1.55 -2.95 1.53 4.77 -1.26 -3.95 117.00 116.69 2fuh n LEU 119 Ca 0.07 -0.78 -0.15 0.00 -0.03 0.00 0.00 56.01 55.12 2fuh n LEU 119 Cb 0.25 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.85 2fuh n LEU 119 CO 0.18 0.32 0.01 1.33 -1.33 0.00 0.00 177.39 177.89 2fuh n VAL 120 N 0.12 -0.23 0.30 4.08 0.24 -1.26 -4.56 118.33 117.03 2fuh n VAL 120 Ca 0.01 -2.76 0.19 0.00 -2.04 0.00 0.00 64.34 59.74 2fuh n VAL 120 Cb 0.33 0.20 0.95 0.00 -1.47 0.00 0.00 33.84 33.85 2fuh n VAL 120 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2fuh h PRO 121 N 3.62 0.00 -0.36 7.34 0.13 -1.94 -2.46 132.00 138.33 2fuh h PRO 121 Ca -0.03 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.94 2fuh h PRO 121 Cb 0.99 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 2fuh h PRO 121 CO 0.36 0.03 -0.40 1.05 -0.23 0.00 0.00 178.00 178.80 2fuh h GLU 122 N 0.00 0.90 0.00 0.86 9.09 -1.95 -2.76 114.58 120.72 2fuh h GLU 122 Ca -0.00 -0.49 -0.10 0.00 0.05 0.00 0.00 59.36 58.81 2fuh h GLU 122 Cb 0.22 0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.33 2fuh h GLU 122 CO 0.00 1.14 -0.50 0.82 0.05 0.00 0.00 179.01 180.53 2fuh h ILE 123 N 0.71 0.96 0.26 -1.06 2.04 -1.87 -3.12 117.51 115.43 2fuh h ILE 123 Ca 0.05 -2.03 -0.01 0.00 1.00 0.00 0.00 64.86 63.87 2fuh h ILE 123 Cb 0.99 2.24 0.00 0.00 -0.74 0.00 0.00 36.82 39.32 2fuh h ILE 123 CO 0.10 0.49 -0.13 0.00 0.00 0.00 0.00 178.15 178.61 2fuh h ALA 124 N 1.50 -0.35 -0.12 1.87 0.00 -1.32 -0.72 119.26 120.12 2fuh h ALA 124 Ca -0.00 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2fuh h ALA 124 Cb 1.20 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2fuh h ALA 124 CO 0.06 -0.62 -0.06 0.00 0.00 0.00 0.00 179.25 178.64 2fuh h ARG 125 N -0.51 -0.04 -0.44 0.00 3.08 -1.55 1.23 114.38 116.14 2fuh h ARG 125 Ca -0.04 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.09 2fuh h ARG 125 Cb 0.38 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.38 2fuh h ARG 125 CO 0.06 -0.03 0.08 0.82 -1.07 0.00 0.00 179.97 179.83 2fuh h ILE 126 N -0.04 0.75 -0.04 2.04 2.04 -1.50 -0.88 117.51 119.87 2fuh h ILE 126 Ca 0.07 -0.07 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 2fuh h ILE 126 Cb 0.15 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2fuh h ILE 126 CO -0.15 0.04 -0.54 0.22 0.00 0.00 0.00 178.15 177.71 2fuh h TYR 127 N 0.21 0.16 0.01 1.37 3.20 -0.60 -0.41 116.97 120.91 2fuh h TYR 127 Ca 0.22 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2fuh h TYR 127 Cb 0.28 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 2fuh h TYR 127 CO -0.22 0.64 -0.10 -0.22 -1.64 0.00 0.00 178.16 176.63 2fuh h LYS 128 N 0.10 -0.13 0.00 1.82 1.63 0.30 -3.40 116.57 116.90 2fuh h LYS 128 Ca -0.00 0.01 -0.18 0.00 -0.85 0.00 0.00 60.65 59.63 2fuh h LYS 128 Cb 0.99 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.62 2fuh h LYS 128 CO 0.08 -0.08 -1.65 -2.37 -3.45 0.00 0.00 179.45 171.97 2fuh n THR 129 N -3.01 0.65 -1.28 1.00 5.66 -1.08 -4.76 114.28 111.46 2fuh n THR 129 Ca -0.01 -0.23 -0.39 0.00 -3.05 0.00 0.00 64.05 60.37 2fuh n THR 129 Cb 0.07 -1.07 -0.03 0.00 -1.55 0.00 0.00 70.33 67.76 2fuh n THR 129 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2fuh n ASP 130 N -2.99 4.21 -0.05 1.09 -0.08 -0.17 -4.56 116.55 114.00 2fuh n ASP 130 Ca -0.21 -2.65 -0.16 0.00 -1.51 0.00 0.00 54.79 50.26 2fuh n ASP 130 Cb 0.70 -1.34 -0.06 0.00 2.34 0.00 0.00 41.12 42.76 2fuh n ASP 130 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2fuh h ARG 131 N 6.62 0.83 -0.55 -0.67 2.47 -1.75 -2.92 114.38 118.42 2fuh h ARG 131 Ca 0.54 -0.61 0.11 0.00 -1.26 0.00 0.00 59.98 58.77 2fuh h ARG 131 Cb 0.52 0.10 -0.10 0.00 -1.65 0.00 0.00 29.97 28.84 2fuh h ARG 131 CO 1.82 1.23 -0.06 -0.44 0.56 0.00 0.00 179.97 183.08 2fuh h ASP 132 N 0.60 -0.35 -0.02 7.04 5.19 -1.89 -0.72 116.42 126.27 2fuh h ASP 132 Ca -0.02 0.15 -0.00 0.00 -0.62 0.00 0.00 57.03 56.53 2fuh h ASP 132 Cb 1.30 0.28 -0.00 0.00 0.18 0.00 0.00 39.33 41.09 2fuh h ASP 132 CO 0.14 -0.13 0.00 0.11 -3.12 0.00 0.00 179.24 176.24 2fuh h LYS 133 N 0.06 0.04 -1.01 3.56 1.57 -1.90 -2.88 116.57 116.01 2fuh h LYS 133 Ca 0.28 -0.01 0.26 0.00 -1.87 0.00 0.00 60.65 59.30 2fuh h LYS 133 Cb 0.43 -0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.61 2fuh h LYS 133 CO -0.51 0.33 0.60 -0.92 -0.57 0.00 0.00 179.45 178.38 2fuh h TYR 134 N -0.25 0.98 -0.36 -1.35 3.20 -1.16 0.71 116.97 118.75 2fuh h TYR 134 Ca 0.01 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 2fuh h TYR 134 Cb 0.31 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2fuh h TYR 134 CO 0.03 0.02 -0.08 -0.91 -1.64 0.00 0.00 178.16 175.58 2fuh h ASN 135 N 0.53 0.58 0.01 -2.11 4.21 -0.97 0.17 115.58 118.00 2fuh h ASN 135 Ca 0.66 -0.14 -0.00 0.00 1.21 0.00 0.00 56.30 58.03 2fuh h ASN 135 Cb 1.32 -0.15 0.00 0.00 -1.12 0.00 0.00 38.32 38.37 2fuh h ASN 135 CO -0.49 0.70 -0.01 -0.09 -1.29 0.00 0.00 177.43 176.25 2fuh h ARG 136 N 0.56 -0.01 -0.31 0.81 2.43 0.61 -1.45 114.38 117.02 2fuh h ARG 136 Ca 0.11 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.14 2fuh h ARG 136 Cb 0.47 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2fuh h ARG 136 CO 0.03 0.16 -0.35 0.82 -1.51 0.00 0.00 179.97 179.11 2fuh h ILE 137 N -0.19 1.29 -0.64 1.20 5.03 -1.21 -0.36 117.51 122.62 2fuh h ILE 137 Ca -0.00 -1.51 0.04 0.00 -0.12 0.00 0.00 64.86 63.27 2fuh h ILE 137 Cb 0.18 1.43 -0.04 0.00 -3.03 0.00 0.00 36.82 35.36 2fuh h ILE 137 CO 0.00 0.49 0.39 -1.28 -0.68 0.00 0.00 178.15 177.07 2fuh h SER 138 N 0.58 0.61 0.93 1.72 0.87 -0.51 0.53 113.55 118.29 2fuh h SER 138 Ca 0.06 0.01 -0.20 0.00 -1.23 0.00 0.00 61.79 60.43 2fuh h SER 138 Cb 0.88 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.69 2fuh h SER 138 CO 0.08 0.42 -0.95 0.03 -0.53 0.00 0.00 176.83 175.87 2fuh h ARG 139 N 0.75 0.01 -0.19 2.24 3.08 -1.17 -3.04 114.38 116.06 2fuh h ARG 139 Ca 0.27 -0.02 -0.19 0.00 0.07 0.00 0.00 59.98 60.11 2fuh h ARG 139 Cb 0.07 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2fuh h ARG 139 CO -0.12 0.96 -0.64 1.49 -1.07 0.00 0.00 179.97 180.58 2fuh h GLU 140 N 0.00 0.68 0.00 0.04 4.22 -0.48 -2.77 114.58 116.28 2fuh h GLU 140 Ca -0.01 -0.48 0.00 0.00 0.08 0.00 0.00 59.36 58.95 2fuh h GLU 140 Cb 1.68 0.08 0.00 0.00 0.50 0.00 0.00 28.75 31.01 2fuh h GLU 140 CO 0.13 1.10 0.00 0.91 -2.18 0.00 0.00 179.01 178.97 2fuh n TRP 141 N -3.95 0.00 0.01 0.92 7.02 0.18 -2.93 117.44 118.70 2fuh n TRP 141 Ca -0.05 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.41 2fuh n TRP 141 Cb 0.66 -0.20 -0.01 0.00 -2.42 0.00 0.00 31.31 29.34 2fuh n TRP 141 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 2fuh h THR 142 N 0.00 0.00 -0.08 -0.99 2.02 -1.36 -3.30 112.91 109.19 2fuh h THR 142 Ca 0.00 -0.84 -0.05 0.00 0.77 0.00 0.00 66.41 66.28 2fuh h THR 142 Cb 0.18 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.58 2fuh h THR 142 CO 0.00 0.00 -0.20 1.56 0.37 0.00 0.00 175.52 177.25 2fuh h GLN 143 N -0.98 0.13 -0.37 6.66 1.08 -1.65 0.31 115.11 120.29 2fuh h GLN 143 Ca -0.01 -0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.23 2fuh h GLN 143 Cb 0.11 -0.02 -0.09 0.00 -0.05 0.00 0.00 27.48 27.43 2fuh h GLN 143 CO 0.02 0.33 -0.33 -0.22 -0.95 0.00 0.00 178.83 177.69 2fuh h LYS 144 N 0.12 -0.26 0.00 1.46 3.64 -1.65 -3.37 116.57 116.51 2fuh h LYS 144 Ca 0.02 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2fuh h LYS 144 Cb 0.43 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2fuh h LYS 144 CO 0.03 -0.17 -0.34 0.66 -2.27 0.00 0.00 179.45 177.36 2fuh n TYR 145 N -5.41 0.00 0.09 1.91 4.01 -1.18 -4.88 117.16 111.70 2fuh n TYR 145 Ca 0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.62 2fuh n TYR 145 Cb 0.34 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.31 2fuh n TYR 145 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fuh h ALA 146 N 0.00 -0.55 -0.02 -0.72 0.00 -0.58 -3.48 119.26 113.92 2fuh h ALA 146 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2fuh h ALA 146 Cb 0.34 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2fuh h ALA 146 CO 0.00 -0.87 0.00 -1.33 0.00 0.00 0.00 179.25 177.05