#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fl7 n ASP 6 N 0.00 -7.46 -3.52 1.69 2.03 -1.26 -5.05 116.55 102.99 1fl7 n ASP 6 Ca 0.00 1.59 -0.28 0.00 0.52 0.00 0.00 54.79 56.62 1fl7 n ASP 6 Cb 0.00 -4.75 -0.14 0.00 -0.72 0.00 0.00 41.12 35.51 1fl7 n ASP 6 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fl7 n PRO 8 N 5.16 0.00 -2.07 0.00 -0.02 -1.26 -4.49 135.00 132.32 1fl7 n PRO 8 Ca -0.04 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.06 1fl7 n PRO 8 Cb 0.42 -0.69 0.01 0.00 -0.02 0.00 0.00 33.50 33.22 1fl7 n PRO 8 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1fl7 s GLU 9 N -0.04 3.51 -0.20 -0.52 2.12 -1.26 0.13 118.70 122.43 1fl7 s GLU 9 Ca 0.42 1.95 -0.29 0.00 0.36 0.00 0.00 54.97 57.42 1fl7 s GLU 9 Cb -0.58 -2.35 -0.04 0.00 0.26 0.00 0.00 34.13 31.42 1fl7 s GLU 9 CO 0.27 -0.80 1.89 0.00 -0.54 0.00 0.00 175.26 176.08 1fl7 s THR 11 N 6.39 0.00 0.18 0.00 2.01 -0.68 -4.76 115.64 118.78 1fl7 s THR 11 Ca 0.85 -1.85 -0.30 0.00 0.31 0.00 0.00 61.69 60.70 1fl7 s THR 11 Cb -0.30 -2.54 -0.08 0.00 0.01 0.00 0.00 72.50 69.59 1fl7 s THR 11 CO 0.34 0.00 0.93 -0.76 -0.69 0.00 0.00 174.62 174.44 1fl7 s LEU 12 N -3.30 4.58 0.06 4.42 1.43 -1.26 -1.94 118.68 122.67 1fl7 s LEU 12 Ca 0.37 1.85 -0.09 0.00 -1.03 0.00 0.00 54.13 55.23 1fl7 s LEU 12 Cb 0.02 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.67 1fl7 s LEU 12 CO 0.23 0.07 0.19 -1.10 0.23 0.00 0.00 176.35 175.97 1fl7 s GLN 13 N -0.67 0.76 0.20 1.70 -1.52 -0.55 -4.93 119.66 114.64 1fl7 s GLN 13 Ca 0.43 -0.78 -0.30 0.00 -1.95 0.00 0.00 55.36 52.76 1fl7 s GLN 13 Cb -0.25 0.31 -0.08 0.00 -0.22 0.00 0.00 33.01 32.77 1fl7 s GLN 13 CO 0.30 -0.23 1.08 -1.21 -0.25 0.00 0.00 175.29 174.99 1fl7 s GLU 14 N -3.15 4.63 -0.34 2.91 2.02 -1.26 0.41 118.70 123.91 1fl7 s GLU 14 Ca -0.01 1.71 -0.25 0.00 0.02 0.00 0.00 54.97 56.45 1fl7 s GLU 14 Cb 0.02 -3.26 0.01 0.00 0.10 0.00 0.00 34.13 31.00 1fl7 s GLU 14 CO -0.07 0.14 0.89 1.21 0.02 0.00 0.00 175.26 177.45 1fl7 s ASN 15 N -0.37 6.70 0.21 -0.19 3.84 0.01 -4.82 114.94 120.32 1fl7 s ASN 15 Ca 0.47 0.65 -0.10 0.00 0.21 0.00 0.00 52.86 54.09 1fl7 s ASN 15 Cb -0.30 -2.45 0.31 0.00 -0.55 0.00 0.00 41.25 38.26 1fl7 s ASN 15 CO 0.36 -0.77 1.67 -0.65 -2.79 0.00 0.00 177.10 174.92 1fl7 h PRO 16 N 8.31 0.14 0.28 0.43 0.11 -1.92 -1.23 132.00 138.13 1fl7 h PRO 16 Ca -0.23 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.86 1fl7 h PRO 16 Cb 1.08 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1fl7 h PRO 16 CO 0.95 0.09 -0.13 0.35 -0.21 0.00 0.00 178.00 179.05 1fl7 h PHE 17 N 0.15 -0.35 0.00 0.65 3.57 -1.98 -3.29 116.94 115.69 1fl7 h PHE 17 Ca 0.33 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1fl7 h PHE 17 Cb 0.53 0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.38 1fl7 h PHE 17 CO -0.34 -0.14 -0.56 1.19 -2.23 0.00 0.00 178.31 176.23 1fl7 n PHE 18 N -5.20 0.49 -2.48 0.41 3.01 -1.21 -4.92 117.46 107.55 1fl7 n PHE 18 Ca -0.10 0.14 -0.36 0.00 1.01 0.00 0.00 57.45 58.15 1fl7 n PHE 18 Cb 0.21 -0.61 -0.03 0.00 -0.01 0.00 0.00 39.48 39.03 1fl7 n PHE 18 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1fl7 s SER 19 N -4.05 6.45 0.26 4.37 0.01 -0.47 -4.66 113.70 115.62 1fl7 s SER 19 Ca 0.07 2.05 -0.05 0.00 1.31 0.00 0.00 55.95 59.32 1fl7 s SER 19 Cb 0.14 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.78 1fl7 s SER 19 CO 0.71 -0.71 0.36 -1.10 0.41 0.00 0.00 173.24 172.91 1fl7 s GLN 20 N -2.85 1.55 0.22 12.44 -0.21 -1.12 -4.95 119.66 124.74 1fl7 s GLN 20 Ca 0.63 -1.54 -0.30 0.00 0.02 0.00 0.00 55.36 54.17 1fl7 s GLN 20 Cb -0.21 0.40 -0.09 0.00 1.00 0.00 0.00 33.01 34.10 1fl7 s GLN 20 CO 0.26 -0.61 1.33 -2.14 -2.12 0.00 0.00 175.29 172.01 1fl7 s PRO 21 N -3.77 4.37 -1.18 2.91 0.02 -1.26 -2.49 135.00 133.60 1fl7 s PRO 21 Ca 0.31 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.43 1fl7 s PRO 21 Cb 0.02 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1fl7 s PRO 21 CO 0.14 -0.28 0.00 0.41 -0.33 0.00 0.00 177.00 176.94 1fl7 n GLY 22 N 2.24 1.15 2.72 0.52 0.00 -1.26 -4.83 105.19 105.73 1fl7 n GLY 22 Ca 0.06 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 1fl7 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fl7 n ALA 23 N 1.21 -1.35 -1.11 4.61 0.00 -1.04 -5.16 120.51 117.67 1fl7 n ALA 23 Ca -0.11 -1.27 -0.31 0.00 0.00 0.00 0.00 53.44 51.75 1fl7 n ALA 23 Cb 0.49 -1.52 0.12 0.00 0.00 0.00 0.00 19.45 18.53 1fl7 n ALA 23 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1fl7 s PRO 24 N 0.35 1.78 -0.30 0.00 0.02 -1.22 -2.78 135.00 132.85 1fl7 s PRO 24 Ca 0.25 1.20 -0.00 0.00 0.02 0.00 0.00 61.00 62.46 1fl7 s PRO 24 Cb 0.27 -1.84 0.09 0.00 0.02 0.00 0.00 34.50 33.05 1fl7 s PRO 24 CO -0.12 -1.98 0.08 0.42 -0.33 0.00 0.00 177.00 175.06 1fl7 s ILE 25 N -2.84 1.13 0.40 2.83 -1.09 -1.26 -4.87 121.20 115.50 1fl7 s ILE 25 Ca 0.63 -1.49 -0.24 0.00 -2.23 0.00 0.00 60.65 57.32 1fl7 s ILE 25 Cb -0.19 -1.80 -0.09 0.00 -1.58 0.00 0.00 42.46 38.80 1fl7 s ILE 25 CO 0.57 -0.60 1.07 -0.76 -1.23 0.00 0.00 174.94 173.99 1fl7 s LEU 26 N 1.50 4.13 -0.05 2.97 1.43 -1.26 -0.81 118.68 126.59 1fl7 s LEU 26 Ca 0.08 2.09 -0.05 0.00 -1.03 0.00 0.00 54.13 55.22 1fl7 s LEU 26 Cb -0.18 -4.18 0.01 0.00 0.03 0.00 0.00 46.19 41.88 1fl7 s LEU 26 CO -0.20 -0.54 0.15 -1.58 0.23 0.00 0.00 176.35 174.40 1fl7 s GLN 27 N -2.50 0.17 -0.15 1.70 0.74 0.16 -1.70 119.66 118.09 1fl7 s GLN 27 Ca 0.58 0.20 -0.28 0.00 0.05 0.00 0.00 55.36 55.91 1fl7 s GLN 27 Cb -0.23 0.08 -0.01 0.00 1.10 0.00 0.00 33.01 33.95 1fl7 s GLN 27 CO 0.29 -0.02 0.96 0.00 -0.55 0.00 0.00 175.29 175.97 1fl7 s MET 29 N 2.29 0.76 0.00 0.00 0.00 -0.82 -4.77 119.30 116.76 1fl7 s MET 29 Ca 0.44 -0.36 0.00 0.00 0.00 0.00 0.00 55.69 55.77 1fl7 s MET 29 Cb -0.17 0.33 0.00 0.00 0.00 0.00 0.00 34.83 34.99 1fl7 s MET 29 CO 0.14 -0.23 0.00 0.41 0.00 0.00 0.00 175.02 175.34 1fl7 n GLY 30 N 0.88 0.22 3.47 3.16 0.00 -1.26 -1.69 105.19 109.97 1fl7 n GLY 30 Ca -0.20 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 1fl7 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fl7 s PHE 33 N -2.73 3.44 0.33 0.00 5.36 -1.26 -4.88 117.98 118.24 1fl7 s PHE 33 Ca -0.00 1.69 -0.16 0.00 -0.96 0.00 0.00 56.93 57.49 1fl7 s PHE 33 Cb -0.01 -3.00 0.03 0.00 -0.34 0.00 0.00 43.02 39.70 1fl7 s PHE 33 CO -0.04 -0.21 0.71 -1.54 -1.46 0.00 0.00 175.22 172.67 1fl7 s SER 34 N -1.69 -0.03 0.01 6.13 1.04 -1.26 -3.13 113.70 114.76 1fl7 s SER 34 Ca 0.55 -0.95 -0.29 0.00 0.48 0.00 0.00 55.95 55.74 1fl7 s SER 34 Cb -0.18 0.77 0.11 0.00 0.10 0.00 0.00 66.02 66.81 1fl7 s SER 34 CO 0.24 -1.48 1.25 0.00 0.98 0.00 0.00 173.24 174.23 1fl7 s ARG 35 N -3.14 0.50 0.04 4.02 1.70 0.01 -5.00 118.95 117.07 1fl7 s ARG 35 Ca 0.16 -0.29 -0.01 0.00 -0.47 0.00 0.00 55.73 55.12 1fl7 s ARG 35 Cb -0.05 0.16 -0.03 0.00 -0.57 0.00 0.00 34.95 34.47 1fl7 s ARG 35 CO 0.10 -0.23 -0.02 0.00 -1.08 0.00 0.00 175.30 174.07 1fl7 s ALA 36 N -2.41 0.31 0.17 7.88 0.00 -1.26 -0.79 121.76 125.67 1fl7 s ALA 36 Ca 0.17 -0.91 -0.24 0.00 0.00 0.00 0.00 51.96 50.97 1fl7 s ALA 36 Cb 0.03 0.22 0.06 0.00 0.00 0.00 0.00 23.12 23.43 1fl7 s ALA 36 CO -0.02 -0.28 0.88 1.52 0.00 0.00 0.00 175.76 177.86 1fl7 s TYR 37 N -2.80 -0.18 0.08 0.00 -0.85 -0.24 -5.01 117.35 108.35 1fl7 s TYR 37 Ca -0.03 -0.14 -0.31 0.00 -0.52 0.00 0.00 57.07 56.07 1fl7 s TYR 37 Cb -0.00 0.64 -0.08 0.00 0.38 0.00 0.00 41.96 42.90 1fl7 s TYR 37 CO -0.06 -0.90 1.51 -2.14 -1.52 0.00 0.00 175.55 172.44 1fl7 s PRO 38 N -3.44 4.25 0.18 -3.49 0.02 -1.26 -0.44 135.00 130.82 1fl7 s PRO 38 Ca 0.11 2.18 -0.33 0.00 0.02 0.00 0.00 61.00 62.98 1fl7 s PRO 38 Cb -0.02 -3.42 -0.13 0.00 0.02 0.00 0.00 34.50 30.94 1fl7 s PRO 38 CO 0.02 -0.60 1.60 2.41 -0.33 0.00 0.00 177.00 180.10 1fl7 n THR 39 N 4.38 0.11 -2.38 0.99 -1.04 0.91 -4.75 114.28 112.49 1fl7 n THR 39 Ca 0.14 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.05 61.75 1fl7 n THR 39 Cb 0.41 -1.66 -0.02 0.00 -1.82 0.00 0.00 70.33 67.24 1fl7 n THR 39 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1fl7 s PRO 40 N 0.82 3.89 0.16 -2.82 0.02 -1.26 -4.81 135.00 131.00 1fl7 s PRO 40 Ca 0.76 1.64 -0.20 0.00 0.02 0.00 0.00 61.00 63.23 1fl7 s PRO 40 Cb -0.63 -2.41 0.06 0.00 0.02 0.00 0.00 34.50 31.54 1fl7 s PRO 40 CO 0.38 -0.41 1.64 1.25 -0.33 0.00 0.00 177.00 179.53 1fl7 h LEU 41 N 2.13 -0.62 -1.82 -5.54 5.85 -1.98 0.25 115.31 113.59 1fl7 h LEU 41 Ca -0.49 0.13 0.30 0.00 0.84 0.00 0.00 57.88 58.66 1fl7 h LEU 41 Cb 1.23 0.32 -0.06 0.00 0.37 0.00 0.00 40.66 42.53 1fl7 h LEU 41 CO 0.61 -0.22 0.75 -0.09 -0.34 0.00 0.00 178.44 179.14 1fl7 h ARG 42 N -0.15 0.11 0.00 1.25 9.65 -2.01 -0.13 114.38 123.10 1fl7 h ARG 42 Ca 0.16 -0.01 -0.30 0.00 -1.10 0.00 0.00 59.98 58.73 1fl7 h ARG 42 Cb 0.40 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.90 1fl7 h ARG 42 CO -0.41 0.07 -1.86 0.43 2.80 0.00 0.00 179.97 181.01 1fl7 n SER 43 N -4.33 0.66 0.19 -3.80 7.64 -0.47 -3.66 113.62 109.87 1fl7 n SER 43 Ca 0.24 0.32 0.14 0.00 1.01 0.00 0.00 58.87 60.57 1fl7 n SER 43 Cb 1.06 0.20 0.64 0.00 -1.01 0.00 0.00 64.21 65.11 1fl7 n SER 43 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1fl7 h LYS 44 N 0.00 0.00 0.05 1.43 3.64 0.86 -2.86 116.57 119.68 1fl7 h LYS 44 Ca -0.34 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 58.72 1fl7 h LYS 44 Cb 2.05 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.84 1fl7 h LYS 44 CO 0.07 0.00 -1.73 1.17 -2.27 0.00 0.00 179.45 176.69 1fl7 n LYS 45 N -2.50 0.65 0.00 1.90 4.81 -0.84 -4.23 118.16 117.95 1fl7 n LYS 45 Ca 0.00 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 1fl7 n LYS 45 Cb 0.17 -1.70 0.00 0.00 0.02 0.00 0.00 35.03 33.52 1fl7 n LYS 45 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1fl7 n THR 46 N -3.98 0.19 -4.09 3.15 -1.04 -1.08 -4.69 114.28 102.75 1fl7 n THR 46 Ca -0.35 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.52 1fl7 n THR 46 Cb 0.86 -0.45 -0.14 0.00 -1.82 0.00 0.00 70.33 68.78 1fl7 n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1fl7 s MET 47 N -0.07 0.37 0.06 -2.82 0.23 -1.25 -5.06 119.30 110.76 1fl7 s MET 47 Ca 0.00 -0.26 -0.31 0.00 -1.03 0.00 0.00 55.69 54.09 1fl7 s MET 47 Cb 0.00 -0.30 -0.18 0.00 -1.53 0.00 0.00 34.83 32.81 1fl7 s MET 47 CO 0.00 0.08 1.58 1.25 -2.03 0.00 0.00 175.02 175.89 1fl7 h LEU 48 N 5.75 -0.69 -8.22 0.18 6.46 -1.92 -3.37 115.31 113.50 1fl7 h LEU 48 Ca -0.29 0.01 -0.71 0.00 -0.12 0.00 0.00 57.88 56.77 1fl7 h LEU 48 Cb 1.20 0.18 -0.26 0.00 -0.73 0.00 0.00 40.66 41.04 1fl7 h LEU 48 CO 0.48 -0.46 -0.48 -0.69 -0.62 0.00 0.00 178.44 176.68 1fl7 s VAL 49 N -5.88 4.42 0.34 1.05 1.01 -1.26 -5.06 120.40 115.02 1fl7 s VAL 49 Ca -0.17 -1.18 -0.28 0.00 0.00 0.00 0.00 61.98 60.35 1fl7 s VAL 49 Cb 0.03 -3.61 -0.12 0.00 0.00 0.00 0.00 36.38 32.69 1fl7 s VAL 49 CO 0.61 -0.41 1.41 0.00 0.00 0.00 0.00 175.10 176.70 1fl7 n GLN 50 N 4.97 2.39 -3.90 2.72 6.02 -1.26 -5.00 117.38 123.31 1fl7 n GLN 50 Ca -0.11 0.84 -0.29 0.00 -0.01 0.00 0.00 57.00 57.43 1fl7 n GLN 50 Cb 0.44 -2.50 -0.16 0.00 1.02 0.00 0.00 30.24 29.04 1fl7 n GLN 50 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1fl7 s LYS 51 N -1.70 1.47 0.54 -1.09 -0.14 -1.26 -5.01 119.74 112.55 1fl7 s LYS 51 Ca 0.56 -0.76 0.22 0.00 -1.36 0.00 0.00 55.97 54.64 1fl7 s LYS 51 Cb -0.53 -2.34 1.48 0.00 -1.68 0.00 0.00 37.83 34.77 1fl7 s LYS 51 CO 0.60 -0.54 2.18 -0.91 -0.76 0.00 0.00 175.35 175.92 1fl7 h ASN 52 N 8.05 0.00 -3.80 2.83 2.35 -1.94 -3.41 115.58 119.66 1fl7 h ASN 52 Ca -0.20 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 54.86 1fl7 h ASN 52 Cb 1.09 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.26 1fl7 h ASN 52 CO 0.40 0.02 -0.74 -0.69 -1.65 0.00 0.00 177.43 174.77 1fl7 s VAL 53 N -4.84 3.31 -0.05 2.81 1.01 -1.26 -0.06 120.40 121.32 1fl7 s VAL 53 Ca -0.05 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.16 1fl7 s VAL 53 Cb 0.16 -2.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 1fl7 s VAL 53 CO 0.62 0.44 -0.23 -0.89 0.00 0.00 0.00 175.10 175.04 1fl7 s THR 54 N -0.90 1.89 0.03 3.92 2.01 0.41 -4.68 115.64 118.32 1fl7 s THR 54 Ca 0.15 -0.99 0.08 0.00 0.31 0.00 0.00 61.69 61.24 1fl7 s THR 54 Cb -0.11 -1.60 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 1fl7 s THR 54 CO 0.05 0.53 -0.23 -0.55 -0.69 0.00 0.00 174.62 173.72 1fl7 s SER 55 N -0.22 3.37 -0.11 3.53 0.15 -1.26 -1.07 113.70 118.08 1fl7 s SER 55 Ca -0.00 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1fl7 s SER 55 Cb -0.12 -0.41 0.02 0.00 -1.71 0.00 0.00 66.02 63.80 1fl7 s SER 55 CO 0.02 0.27 -0.10 -1.61 1.20 0.00 0.00 173.24 173.03 1fl7 s GLU 56 N -1.19 1.69 0.04 5.44 2.02 0.03 -5.00 118.70 121.73 1fl7 s GLU 56 Ca 0.12 -0.34 -0.03 0.00 0.02 0.00 0.00 54.97 54.75 1fl7 s GLU 56 Cb -0.10 -1.64 -0.02 0.00 0.10 0.00 0.00 34.13 32.47 1fl7 s GLU 56 CO 0.02 -0.20 0.03 -1.54 0.02 0.00 0.00 175.26 173.59 1fl7 s SER 57 N 1.45 0.28 0.29 -0.19 1.04 -1.26 -0.81 113.70 114.49 1fl7 s SER 57 Ca 0.01 -0.65 0.04 0.00 0.48 0.00 0.00 55.95 55.82 1fl7 s SER 57 Cb -0.13 0.19 -0.06 0.00 0.10 0.00 0.00 66.02 66.11 1fl7 s SER 57 CO -0.06 -0.48 0.03 0.42 0.98 0.00 0.00 173.24 174.13 1fl7 s THR 58 N -2.66 1.16 0.00 2.02 -4.23 -1.18 -4.62 115.64 106.11 1fl7 s THR 58 Ca -0.05 -2.02 -0.12 0.00 -1.18 0.00 0.00 61.69 58.32 1fl7 s THR 58 Cb -0.01 -2.63 0.01 0.00 1.34 0.00 0.00 72.50 71.21 1fl7 s THR 58 CO -0.05 -0.12 0.24 0.00 -0.54 0.00 0.00 174.62 174.15 1fl7 s VAL 61 N 6.12 0.21 0.17 0.00 -7.23 -0.66 -4.77 120.40 114.24 1fl7 s VAL 61 Ca 0.76 -1.18 -0.31 0.00 -1.81 0.00 0.00 61.98 59.44 1fl7 s VAL 61 Cb -0.24 -0.65 -0.09 0.00 0.56 0.00 0.00 36.38 35.96 1fl7 s VAL 61 CO 0.32 -0.62 1.48 0.00 -0.31 0.00 0.00 175.10 175.97 1fl7 s ALA 62 N -2.11 3.68 0.05 1.32 0.00 -1.26 -1.95 121.76 121.49 1fl7 s ALA 62 Ca -0.09 1.28 -0.10 0.00 0.00 0.00 0.00 51.96 53.05 1fl7 s ALA 62 Cb -0.05 -3.58 -0.32 0.00 0.00 0.00 0.00 23.12 19.17 1fl7 s ALA 62 CO -0.03 -0.71 1.05 -0.22 0.00 0.00 0.00 175.76 175.85 1fl7 h LYS 63 N 6.34 0.41 -3.82 0.00 3.64 -0.92 -3.43 116.57 118.79 1fl7 h LYS 63 Ca -0.43 -0.70 -0.09 0.00 -1.27 0.00 0.00 60.65 58.15 1fl7 h LYS 63 Cb 1.21 0.26 -0.12 0.00 -0.41 0.00 0.00 32.23 33.17 1fl7 h LYS 63 CO 0.86 1.33 -0.29 -1.54 -2.27 0.00 0.00 179.45 177.54 1fl7 s SER 64 N -7.37 0.02 -0.18 4.20 1.04 -1.24 -4.85 113.70 105.32 1fl7 s SER 64 Ca -0.07 -0.81 -0.35 0.00 0.48 0.00 0.00 55.95 55.20 1fl7 s SER 64 Cb 0.06 0.44 0.14 0.00 0.10 0.00 0.00 66.02 66.76 1fl7 s SER 64 CO 0.91 -0.89 1.27 -0.72 0.98 0.00 0.00 173.24 174.79 1fl7 s TYR 65 N -3.95 -0.08 0.03 5.02 -0.85 -1.26 -2.20 117.35 114.06 1fl7 s TYR 65 Ca 0.15 0.04 0.05 0.00 -0.52 0.00 0.00 57.07 56.79 1fl7 s TYR 65 Cb 0.03 0.52 -0.03 0.00 0.38 0.00 0.00 41.96 42.85 1fl7 s TYR 65 CO -0.01 -0.17 -0.10 -0.80 -1.52 0.00 0.00 175.55 172.94 1fl7 s ASN 66 N -2.31 4.35 0.50 -0.18 0.02 -0.95 -4.89 114.94 111.47 1fl7 s ASN 66 Ca 0.11 -0.26 -0.18 0.00 -1.02 0.00 0.00 52.86 51.51 1fl7 s ASN 66 Cb 0.00 -0.91 -0.08 0.00 0.02 0.00 0.00 41.25 40.28 1fl7 s ASN 66 CO -0.04 0.26 0.99 -0.13 0.02 0.00 0.00 177.10 178.20 1fl7 s ARG 67 N -1.52 3.91 -0.14 -0.60 1.81 -1.26 -0.36 118.95 120.79 1fl7 s ARG 67 Ca 0.17 1.08 -0.19 0.00 -1.72 0.00 0.00 55.73 55.07 1fl7 s ARG 67 Cb -0.11 -2.13 0.05 0.00 -0.45 0.00 0.00 34.95 32.31 1fl7 s ARG 67 CO 0.08 -0.31 0.49 0.08 -0.68 0.00 0.00 175.30 174.95 1fl7 s VAL 68 N -2.41 0.01 0.02 3.52 1.01 -0.76 -4.86 120.40 116.93 1fl7 s VAL 68 Ca 0.61 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.44 1fl7 s VAL 68 Cb -0.11 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.50 1fl7 s VAL 68 CO 0.26 -0.05 0.29 0.42 0.00 0.00 0.00 175.10 176.02 1fl7 s THR 69 N -0.21 5.27 0.00 3.92 -4.23 -1.26 -0.81 115.64 118.31 1fl7 s THR 69 Ca -0.04 0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.67 1fl7 s THR 69 Cb -0.03 -3.58 0.00 0.00 1.34 0.00 0.00 72.50 70.23 1fl7 s THR 69 CO 0.03 0.35 0.00 1.33 -0.54 0.00 0.00 174.62 175.78 1fl7 n VAL 70 N 1.06 0.00 -1.34 2.29 0.24 -0.39 -4.97 118.33 115.22 1fl7 n VAL 70 Ca -0.11 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.83 1fl7 n VAL 70 Cb 0.53 0.00 0.07 0.00 -1.47 0.00 0.00 33.84 32.96 1fl7 n VAL 70 CO 0.00 0.00 0.00 1.15 -2.14 0.00 0.00 176.83 175.84 1fl7 n MET 71 N 0.00 0.42 -0.55 7.34 0.00 -1.26 -1.52 117.12 121.55 1fl7 n MET 71 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 57.70 57.88 1fl7 n MET 71 Cb 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 33.22 31.30 1fl7 n MET 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1fl7 n GLY 72 N 1.53 1.34 2.80 3.17 0.00 -1.26 -3.06 105.19 109.71 1fl7 n GLY 72 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1fl7 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fl7 n GLY 73 N -2.00 2.73 3.66 -0.02 0.00 -0.57 -4.98 105.19 104.00 1fl7 n GLY 73 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1fl7 n GLY 73 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fl7 n PHE 74 N -2.00 1.51 -4.55 1.61 3.01 -1.17 -4.61 117.46 111.26 1fl7 n PHE 74 Ca 0.00 0.48 -0.34 0.00 1.01 0.00 0.00 57.45 58.60 1fl7 n PHE 74 Cb 0.00 -2.26 -0.11 0.00 -0.01 0.00 0.00 39.48 37.10 1fl7 n PHE 74 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1fl7 s LYS 75 N -2.45 2.88 0.03 -1.08 1.02 -1.26 -1.26 119.74 117.62 1fl7 s LYS 75 Ca 0.68 -0.51 0.04 0.00 0.02 0.00 0.00 55.97 56.19 1fl7 s LYS 75 Cb -0.48 -2.66 -0.02 0.00 -0.52 0.00 0.00 37.83 34.15 1fl7 s LYS 75 CO 0.53 0.63 -0.12 0.14 -0.92 0.00 0.00 175.35 175.61 1fl7 s VAL 76 N -0.72 0.93 0.35 3.17 -7.23 0.01 -4.93 120.40 111.97 1fl7 s VAL 76 Ca 0.11 -0.84 -0.24 0.00 -1.81 0.00 0.00 61.98 59.20 1fl7 s VAL 76 Cb -0.11 -0.84 -0.10 0.00 0.56 0.00 0.00 36.38 35.88 1fl7 s VAL 76 CO 0.02 0.01 0.92 -1.83 -0.31 0.00 0.00 175.10 173.91 1fl7 s GLU 77 N -0.94 4.43 -0.45 4.82 -1.05 -1.26 -1.83 118.70 122.43 1fl7 s GLU 77 Ca 0.01 1.21 0.01 0.00 -0.15 0.00 0.00 54.97 56.05 1fl7 s GLU 77 Cb -0.07 -2.61 0.12 0.00 -0.44 0.00 0.00 34.13 31.14 1fl7 s GLU 77 CO 0.01 0.19 0.20 1.21 0.95 0.00 0.00 175.26 177.82 1fl7 s ASN 78 N -1.81 4.85 0.69 0.83 2.47 0.52 -4.85 114.94 117.64 1fl7 s ASN 78 Ca 0.53 -2.46 -0.17 0.00 0.42 0.00 0.00 52.86 51.19 1fl7 s ASN 78 Cb -0.15 -1.72 0.00 0.00 -1.45 0.00 0.00 41.25 37.93 1fl7 s ASN 78 CO 0.20 -0.38 1.09 1.41 -3.72 0.00 0.00 177.10 175.69 1fl7 n HIS 79 N 3.92 1.12 0.00 0.43 8.25 -0.69 -2.25 115.22 126.00 1fl7 n HIS 79 Ca 0.03 0.41 0.00 0.00 -0.26 0.00 0.00 57.72 57.90 1fl7 n HIS 79 Cb 0.39 -2.15 0.00 0.00 1.12 0.00 0.00 29.99 29.35 1fl7 n HIS 79 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1fl7 n THR 80 N -2.29 0.00 -3.76 1.59 -2.24 -0.93 -4.53 114.28 102.11 1fl7 n THR 80 Ca 0.14 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.79 1fl7 n THR 80 Cb 0.49 -0.41 -0.09 0.00 -2.10 0.00 0.00 70.33 68.23 1fl7 n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fl7 s ALA 81 N -1.65 -0.77 0.05 6.98 0.00 -1.25 -4.99 121.76 120.14 1fl7 s ALA 81 Ca 0.00 0.30 0.04 0.00 0.00 0.00 0.00 51.96 52.30 1fl7 s ALA 81 Cb 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 1fl7 s ALA 81 CO 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 175.76 175.38 1fl7 s HIS 83 N -1.10 -0.30 -0.25 0.00 -3.43 -0.82 -4.85 115.29 104.55 1fl7 s HIS 83 Ca -0.03 0.09 -0.28 0.00 -0.80 0.00 0.00 55.06 54.04 1fl7 s HIS 83 Cb -0.09 0.31 0.01 0.00 -1.43 0.00 0.00 32.58 31.38 1fl7 s HIS 83 CO 0.01 -0.70 0.98 0.00 -2.00 0.00 0.00 174.74 173.03 1fl7 n SER 85 N 6.30 0.23 -4.64 0.00 2.88 0.22 -4.76 113.62 113.85 1fl7 n SER 85 Ca 0.10 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.20 1fl7 n SER 85 Cb 0.47 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.91 1fl7 n SER 85 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1fl7 n THR 86 N 0.00 1.90 -4.00 2.46 -1.04 -1.25 0.06 114.28 112.41 1fl7 n THR 86 Ca 0.00 -0.48 -0.35 0.00 -2.04 0.00 0.00 64.05 61.19 1fl7 n THR 86 Cb 0.00 -1.24 -0.10 0.00 -1.82 0.00 0.00 70.33 67.17 1fl7 n THR 86 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1fl7 n TYR 88 N 3.45 0.00 0.00 0.00 4.19 -1.26 -4.84 117.16 118.70 1fl7 n TYR 88 Ca -0.17 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.04 1fl7 n TYR 88 Cb 0.52 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.35 1fl7 n TYR 88 CO 0.00 0.00 0.00 0.98 0.91 0.00 0.00 176.86 178.75 1fl7 n TYR 89 N 0.00 0.00 0.00 2.98 4.19 -1.26 -5.12 117.16 117.95 1fl7 n TYR 89 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1fl7 n TYR 89 Cb 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 1fl7 n TYR 89 CO 0.00 0.00 0.00 1.58 0.91 0.00 0.00 176.86 179.35 1fl7 n HIS 90 N -0.39 0.00 -0.72 2.98 -0.00 -1.26 -5.04 115.22 110.79 1fl7 n HIS 90 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1fl7 n HIS 90 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1fl7 n HIS 90 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 1fl7 n LYS 91 N 0.00 0.00 0.00 1.57 0.00 -1.26 -3.89 118.16 114.58 1fl7 n LYS 91 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.38 1fl7 n LYS 91 Cb 0.00 0.00 0.40 0.00 -0.00 0.00 0.00 35.03 35.43 1fl7 n LYS 91 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27