#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fj0 h ALA 3 N 0.00 1.46 -0.22 -1.67 0.00 -1.84 -0.40 119.26 116.59 1fj0 h ALA 3 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1fj0 h ALA 3 Cb 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1fj0 h ALA 3 CO 0.00 0.38 0.12 -0.22 0.00 0.00 0.00 179.25 179.53 1fj0 h LYS 4 N 0.26 0.32 -0.21 0.00 1.63 -1.95 -1.96 116.57 114.65 1fj0 h LYS 4 Ca 0.05 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.77 1fj0 h LYS 4 Cb 0.39 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.95 1fj0 h LYS 4 CO 0.02 0.30 -0.06 0.00 -3.45 0.00 0.00 179.45 176.26 1fj0 h ALA 5 N 1.00 1.50 -0.16 5.00 0.00 -1.83 -1.90 119.26 122.87 1fj0 h ALA 5 Ca 0.08 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1fj0 h ALA 5 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1fj0 h ALA 5 CO -0.01 0.36 0.14 0.78 0.00 0.00 0.00 179.25 180.51 1fj0 h GLY 6 N 0.72 0.00 0.50 0.00 0.00 -0.33 -2.54 103.07 101.42 1fj0 h GLY 6 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.50 1fj0 h GLY 6 CO 0.01 0.00 0.55 0.83 0.00 0.00 0.00 176.54 177.93 1fj0 h GLU 7 N 0.00 0.87 -0.33 4.80 5.08 -0.86 0.23 114.58 124.38 1fj0 h GLU 7 Ca 0.08 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1fj0 h GLU 7 Cb 0.35 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1fj0 h GLU 7 CO -0.00 0.58 -0.12 0.00 -1.00 0.00 0.00 179.01 178.47 1fj0 h ALA 8 N 1.49 0.46 -0.53 3.43 0.00 -1.60 -2.81 119.26 119.69 1fj0 h ALA 8 Ca 0.44 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1fj0 h ALA 8 Cb 0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1fj0 h ALA 8 CO -0.25 0.33 0.07 0.28 0.00 0.00 0.00 179.25 179.68 1fj0 h VAL 9 N 0.43 1.24 0.00 0.00 2.07 -1.50 -2.84 116.25 115.64 1fj0 h VAL 9 Ca 0.08 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1fj0 h VAL 9 Cb 0.63 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1fj0 h VAL 9 CO 0.04 0.34 -0.04 0.15 0.02 0.00 0.00 177.57 178.08 1fj0 h PHE 10 N 0.81 0.00 -0.64 1.57 3.57 -0.71 -1.38 116.94 120.16 1fj0 h PHE 10 Ca 0.17 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.73 1fj0 h PHE 10 Cb 0.38 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 1fj0 h PHE 10 CO 0.02 0.04 0.42 0.87 -2.23 0.00 0.00 178.31 177.43 1fj0 h LYS 11 N 0.00 0.60 -0.50 1.11 1.57 -1.35 -0.24 116.57 117.76 1fj0 h LYS 11 Ca -0.00 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 1fj0 h LYS 11 Cb 0.23 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1fj0 h LYS 11 CO 0.00 0.39 -0.03 1.96 -0.57 0.00 0.00 179.45 181.21 1fj0 h GLN 12 N 0.61 0.90 -0.07 3.15 4.20 -1.42 -2.88 115.11 119.61 1fj0 h GLN 12 Ca 0.28 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1fj0 h GLN 12 Cb 0.30 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1fj0 h GLN 12 CO -0.09 0.94 -0.05 0.00 -0.67 0.00 0.00 178.83 178.97 1fj0 n MET 14 N -4.42 0.11 -0.23 0.00 2.81 -0.31 -0.51 117.12 114.57 1fj0 n MET 14 Ca -0.02 0.47 0.04 0.00 -1.81 0.00 0.00 57.70 56.38 1fj0 n MET 14 Cb 0.17 -1.77 0.28 0.00 -0.71 0.00 0.00 33.22 31.19 1fj0 n MET 14 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1fj0 h THR 15 N 0.00 1.09 0.00 2.03 2.02 -1.41 -3.34 112.91 113.30 1fj0 h THR 15 Ca 0.00 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1fj0 h THR 15 Cb 0.18 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 1fj0 h THR 15 CO 0.00 0.17 -0.36 0.00 0.37 0.00 0.00 175.52 175.70 1fj0 s HIS 17 N -1.20 2.24 0.36 0.00 3.76 0.33 -0.66 115.29 120.13 1fj0 s HIS 17 Ca 0.00 -0.40 0.08 0.00 -0.15 0.00 0.00 55.06 54.59 1fj0 s HIS 17 Cb 0.00 -1.30 -0.07 0.00 1.11 0.00 0.00 32.58 32.32 1fj0 s HIS 17 CO 0.00 0.19 -0.03 1.03 -0.85 0.00 0.00 174.74 175.08 1fj0 s ARG 18 N -1.52 1.84 -0.06 1.40 0.52 -1.26 -4.12 118.95 115.75 1fj0 s ARG 18 Ca 0.12 -2.00 -0.24 0.00 -0.52 0.00 0.00 55.73 53.09 1fj0 s ARG 18 Cb -0.10 -1.55 -0.24 0.00 0.52 0.00 0.00 34.95 33.57 1fj0 s ARG 18 CO 0.03 0.02 0.99 0.00 0.02 0.00 0.00 175.30 176.37 1fj0 h ALA 19 N 1.95 0.02 -0.00 2.13 0.00 -1.95 -1.32 119.26 120.09 1fj0 h ALA 19 Ca -0.43 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.99 1fj0 h ALA 19 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1fj0 h ALA 19 CO 0.75 0.11 -0.67 -0.25 0.00 0.00 0.00 179.25 179.19 1fj0 n ASP 20 N -4.47 0.75 -4.32 0.00 8.00 -1.26 -0.37 116.55 114.88 1fj0 n ASP 20 Ca -0.10 -0.88 -0.20 0.00 0.71 0.00 0.00 54.79 54.32 1fj0 n ASP 20 Cb 0.54 0.96 -0.11 0.00 -0.02 0.00 0.00 41.12 42.49 1fj0 n ASP 20 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1fj0 s LYS 21 N -2.35 1.26 0.48 -1.24 -0.14 -1.26 -4.93 119.74 111.54 1fj0 s LYS 21 Ca 0.06 -1.46 -0.20 0.00 -1.36 0.00 0.00 55.97 53.02 1fj0 s LYS 21 Cb 0.11 -1.18 -0.09 0.00 -1.68 0.00 0.00 37.83 35.00 1fj0 s LYS 21 CO 0.59 0.22 1.00 -0.80 -0.76 0.00 0.00 175.35 175.60 1fj0 s ASN 22 N -2.90 6.58 0.00 2.83 0.01 -1.26 -3.74 114.94 116.46 1fj0 s ASN 22 Ca 0.17 1.77 0.00 0.00 -0.71 0.00 0.00 52.86 54.10 1fj0 s ASN 22 Cb -0.04 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.08 1fj0 s ASN 22 CO 0.06 -0.62 0.00 0.80 -1.51 0.00 0.00 177.10 175.84 1fj0 n MET 23 N -1.01 0.00 -0.14 -0.60 1.56 -1.26 -4.92 117.12 110.75 1fj0 n MET 23 Ca 0.08 0.00 -0.11 0.00 -0.27 0.00 0.00 57.70 57.40 1fj0 n MET 23 Cb 0.53 0.00 -0.02 0.00 2.15 0.00 0.00 33.22 35.89 1fj0 n MET 23 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 1fj0 h VAL 24 N 0.00 1.26 -1.28 1.12 2.07 -1.81 -3.44 116.25 114.17 1fj0 h VAL 24 Ca 0.00 -1.03 -0.54 0.00 0.82 0.00 0.00 66.70 65.95 1fj0 h VAL 24 Cb 0.00 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 1fj0 h VAL 24 CO 0.00 0.35 -0.39 -0.83 0.02 0.00 0.00 177.57 176.72 1fj0 s GLY 25 N -3.33 2.26 0.60 2.17 0.00 0.17 -5.05 107.32 104.14 1fj0 s GLY 25 Ca -0.13 -1.79 -0.17 0.00 0.00 0.00 0.00 44.72 42.63 1fj0 s GLY 25 CO 0.79 -1.82 1.11 2.56 0.00 0.00 0.00 173.10 175.74 1fj0 s PRO 26 N -4.11 3.13 0.28 2.90 0.04 -1.26 -4.65 135.00 131.32 1fj0 s PRO 26 Ca 0.43 1.45 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 1fj0 s PRO 26 Cb -0.01 -1.99 -0.13 0.00 0.04 0.00 0.00 34.50 32.41 1fj0 s PRO 26 CO 0.25 -1.00 1.37 0.00 0.04 0.00 0.00 177.00 177.67 1fj0 n ALA 27 N -1.86 1.24 0.90 8.56 0.00 -1.24 -4.56 120.51 123.54 1fj0 n ALA 27 Ca 0.11 0.39 0.10 0.00 0.00 0.00 0.00 53.44 54.03 1fj0 n ALA 27 Cb 0.52 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.65 1fj0 n ALA 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fj0 n LEU 28 N 1.71 1.50 -4.72 0.00 4.77 -0.50 -4.83 117.00 114.93 1fj0 n LEU 28 Ca 0.09 -0.66 -0.42 0.00 -0.03 0.00 0.00 56.01 55.00 1fj0 n LEU 28 Cb 0.33 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1fj0 n LEU 28 CO 0.63 0.30 1.31 0.00 -1.33 0.00 0.00 177.39 178.30 1fj0 s ALA 29 N -2.49 3.87 -0.49 -1.18 0.00 0.50 -1.16 121.76 120.82 1fj0 s ALA 29 Ca 0.13 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.60 1fj0 s ALA 29 Cb 0.16 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1fj0 s ALA 29 CO 0.62 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.92 1fj0 n GLY 30 N 3.76 0.73 0.23 0.00 0.00 0.11 -4.93 105.19 105.09 1fj0 n GLY 30 Ca 0.15 -0.56 -0.00 0.00 0.00 0.00 0.00 46.02 45.61 1fj0 n GLY 30 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1fj0 h VAL 31 N 0.00 1.24 -3.00 1.61 3.04 -1.36 -3.33 116.25 114.44 1fj0 h VAL 31 Ca -0.09 -1.10 -0.56 0.00 -1.01 0.00 0.00 66.70 63.94 1fj0 h VAL 31 Cb 0.38 1.35 -0.05 0.00 -2.01 0.00 0.00 31.29 30.96 1fj0 h VAL 31 CO 0.14 0.34 1.13 -0.69 -1.01 0.00 0.00 177.57 177.48 1fj0 s VAL 32 N -4.53 3.77 0.00 1.51 1.01 -1.26 -1.85 120.40 119.05 1fj0 s VAL 32 Ca -0.06 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.67 1fj0 s VAL 32 Cb 0.14 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.39 1fj0 s VAL 32 CO 0.76 -0.80 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1fj0 n GLY 33 N 5.22 0.94 3.81 4.51 0.00 0.11 -5.00 105.19 114.78 1fj0 n GLY 33 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1fj0 n GLY 33 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1fj0 s ARG 34 N -0.84 3.85 0.27 1.61 3.52 -0.77 -4.80 118.95 121.78 1fj0 s ARG 34 Ca 0.00 -0.05 -0.31 0.00 -0.13 0.00 0.00 55.73 55.24 1fj0 s ARG 34 Cb 0.00 -3.30 -0.12 0.00 -1.56 0.00 0.00 34.95 29.97 1fj0 s ARG 34 CO 0.00 0.54 1.55 1.17 -0.81 0.00 0.00 175.30 177.76 1fj0 n LYS 35 N 2.67 2.52 -1.72 5.12 4.81 -1.26 -1.54 118.16 128.76 1fj0 n LYS 35 Ca -0.17 0.90 -0.39 0.00 -0.87 0.00 0.00 58.31 57.78 1fj0 n LYS 35 Cb 0.53 -2.65 0.03 0.00 0.02 0.00 0.00 35.03 32.96 1fj0 n LYS 35 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fj0 n ALA 36 N 2.21 1.48 -2.35 3.14 0.00 0.37 -3.22 120.51 122.14 1fj0 n ALA 36 Ca 0.10 0.18 -0.06 0.00 0.00 0.00 0.00 53.44 53.65 1fj0 n ALA 36 Cb 0.35 -2.32 0.01 0.00 0.00 0.00 0.00 19.45 17.49 1fj0 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fj0 n GLY 37 N 0.78 0.25 0.05 0.00 0.00 -1.26 -3.98 105.19 101.03 1fj0 n GLY 37 Ca 0.09 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.55 1fj0 n GLY 37 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fj0 n THR 38 N -3.75 0.43 -1.89 2.61 -2.24 -1.20 -4.87 114.28 103.38 1fj0 n THR 38 Ca -0.05 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.86 1fj0 n THR 38 Cb 0.54 0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 1fj0 n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fj0 s ALA 39 N -0.49 3.81 0.15 6.98 0.00 -1.26 -4.86 121.76 126.09 1fj0 s ALA 39 Ca 0.02 1.42 -0.34 0.00 0.00 0.00 0.00 51.96 53.06 1fj0 s ALA 39 Cb 0.02 -3.64 -0.14 0.00 0.00 0.00 0.00 23.12 19.36 1fj0 s ALA 39 CO 0.00 -0.81 1.61 0.00 0.00 0.00 0.00 175.76 176.56 1fj0 n ALA 40 N 3.92 1.43 -0.38 0.00 0.00 -1.26 -2.22 120.51 122.00 1fj0 n ALA 40 Ca 0.14 0.43 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1fj0 n ALA 40 Cb 0.38 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1fj0 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fj0 n GLY 41 N 3.52 1.70 3.81 0.00 0.00 -1.26 -4.91 105.19 108.06 1fj0 n GLY 41 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1fj0 n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fj0 s PHE 42 N -3.19 3.66 -0.46 1.61 5.36 -0.94 -5.04 117.98 118.98 1fj0 s PHE 42 Ca 0.00 0.88 -0.18 0.00 -0.96 0.00 0.00 56.93 56.68 1fj0 s PHE 42 Cb 0.00 -2.29 0.04 0.00 -0.34 0.00 0.00 43.02 40.43 1fj0 s PHE 42 CO 0.00 0.54 0.51 0.99 -1.46 0.00 0.00 175.22 175.80 1fj0 s THR 43 N -0.66 5.02 0.53 0.12 2.01 -1.26 -4.84 115.64 116.56 1fj0 s THR 43 Ca 0.22 -0.48 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 1fj0 s THR 43 Cb -0.16 -4.15 0.01 0.00 0.01 0.00 0.00 72.50 68.22 1fj0 s THR 43 CO 0.11 -0.59 0.78 -0.31 -0.69 0.00 0.00 174.62 173.92 1fj0 s TYR 44 N 2.27 3.11 0.77 4.92 2.02 -1.26 -5.07 117.35 124.11 1fj0 s TYR 44 Ca 0.12 0.28 -0.12 0.00 -0.37 0.00 0.00 57.07 56.98 1fj0 s TYR 44 Cb -0.19 -2.59 0.06 0.00 -0.40 0.00 0.00 41.96 38.84 1fj0 s TYR 44 CO 0.12 -0.68 1.12 -1.54 -1.57 0.00 0.00 175.55 173.01 1fj0 s SER 45 N -4.31 4.26 0.24 2.29 1.04 -1.26 -4.82 113.70 111.13 1fj0 s SER 45 Ca 0.53 2.02 -0.06 0.00 0.48 0.00 0.00 55.95 58.91 1fj0 s SER 45 Cb -0.10 -2.55 0.33 0.00 0.10 0.00 0.00 66.02 63.80 1fj0 s SER 45 CO 0.40 -2.21 1.84 -0.65 0.98 0.00 0.00 173.24 173.60 1fj0 h PRO 46 N -0.91 0.87 -0.13 4.02 0.11 -1.97 0.06 132.00 134.05 1fj0 h PRO 46 Ca -0.45 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.64 1fj0 h PRO 46 Cb 1.25 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 1fj0 h PRO 46 CO 0.50 0.58 -0.07 1.25 -0.21 0.00 0.00 178.00 180.04 1fj0 h LEU 47 N 0.90 -0.23 -0.19 2.35 5.85 -1.82 0.48 115.31 122.65 1fj0 h LEU 47 Ca 0.37 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 59.09 1fj0 h LEU 47 Cb 0.20 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 1fj0 h LEU 47 CO -0.19 -0.10 -0.10 -1.13 -0.34 0.00 0.00 178.44 176.59 1fj0 h ASN 48 N -0.06 0.41 -0.30 1.25 -0.73 -1.83 -2.18 115.58 112.15 1fj0 h ASN 48 Ca 0.08 -0.42 0.06 0.00 1.87 0.00 0.00 56.30 57.89 1fj0 h ASN 48 Cb 0.18 -0.11 -0.06 0.00 0.27 0.00 0.00 38.32 38.59 1fj0 h ASN 48 CO -0.17 0.74 -0.10 -0.74 -0.37 0.00 0.00 177.43 176.78 1fj0 h HIS 49 N 0.08 -0.23 -0.48 0.67 2.76 -0.79 -1.80 115.15 115.37 1fj0 h HIS 49 Ca 0.04 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.18 1fj0 h HIS 49 Cb 0.59 0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.67 1fj0 h HIS 49 CO 0.07 -0.16 0.07 -0.91 -1.30 0.00 0.00 177.93 175.69 1fj0 h ASN 50 N -0.04 0.70 -0.26 3.26 2.35 -0.02 -1.38 115.58 120.19 1fj0 h ASN 50 Ca 0.15 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1fj0 h ASN 50 Cb 0.26 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1fj0 h ASN 50 CO -0.33 0.73 0.13 0.28 -1.65 0.00 0.00 177.43 176.59 1fj0 h SER 51 N 0.71 0.34 -0.61 5.81 0.02 -0.68 -1.03 113.55 118.11 1fj0 h SER 51 Ca 0.15 -0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1fj0 h SER 51 Cb 0.34 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 1fj0 h SER 51 CO 0.01 0.36 0.13 1.23 -1.14 0.00 0.00 176.83 177.41 1fj0 h GLY 52 N 0.30 1.10 2.00 -3.77 0.00 -0.92 -1.99 103.07 99.79 1fj0 h GLY 52 Ca 0.09 -0.69 -0.04 0.00 0.00 0.00 0.00 47.33 46.69 1fj0 h GLY 52 CO -0.01 0.64 -0.20 0.83 0.00 0.00 0.00 176.54 177.80 1fj0 h GLU 53 N 0.97 0.00 -0.00 4.80 4.39 -0.98 -1.20 114.58 122.56 1fj0 h GLU 53 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1fj0 h GLU 53 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1fj0 h GLU 53 CO 0.01 0.20 -0.03 0.00 -1.16 0.00 0.00 179.01 178.02 1fj0 n ALA 54 N -2.41 2.65 0.00 3.43 0.00 -0.42 -4.88 120.51 118.88 1fj0 n ALA 54 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1fj0 n ALA 54 Cb 0.28 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1fj0 n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fj0 n GLY 55 N 1.17 1.00 3.66 0.00 0.00 -0.45 -5.08 105.19 105.48 1fj0 n GLY 55 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1fj0 n GLY 55 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fj0 s LEU 56 N 0.00 4.27 -0.12 0.99 2.96 -0.81 -4.97 118.68 121.00 1fj0 s LEU 56 Ca 0.00 2.20 0.00 0.00 -0.22 0.00 0.00 54.13 56.11 1fj0 s LEU 56 Cb 0.00 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.14 1fj0 s LEU 56 CO 0.00 -0.98 -0.13 -0.69 -1.32 0.00 0.00 176.35 173.23 1fj0 s VAL 57 N 4.23 3.03 0.14 1.68 1.01 -1.26 -0.48 120.40 128.75 1fj0 s VAL 57 Ca 0.74 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 1fj0 s VAL 57 Cb -0.33 -2.26 -0.07 0.00 0.00 0.00 0.00 36.38 33.71 1fj0 s VAL 57 CO 0.30 0.53 1.20 0.26 0.00 0.00 0.00 175.10 177.39 1fj0 s TRP 58 N 0.29 3.43 0.33 5.22 0.52 -0.59 -4.92 118.94 123.22 1fj0 s TRP 58 Ca -0.10 1.37 0.04 0.00 0.02 0.00 0.00 56.10 57.43 1fj0 s TRP 58 Cb -0.16 -3.43 -0.06 0.00 -1.15 0.00 0.00 33.47 28.67 1fj0 s TRP 58 CO 0.06 -1.25 0.05 0.95 0.02 0.00 0.00 176.95 176.77 1fj0 s THR 59 N 0.33 1.28 0.55 2.01 -4.23 -1.26 0.06 115.64 114.39 1fj0 s THR 59 Ca 0.55 -2.01 0.32 0.00 -1.18 0.00 0.00 61.69 59.37 1fj0 s THR 59 Cb -0.32 -2.78 0.36 0.00 1.34 0.00 0.00 72.50 71.10 1fj0 s THR 59 CO 0.34 -0.03 2.23 0.00 -0.54 0.00 0.00 174.62 176.62 1fj0 h ALA 60 N 2.11 1.38 0.13 3.99 0.00 -1.95 -2.40 119.26 122.53 1fj0 h ALA 60 Ca -0.41 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.21 1fj0 h ALA 60 Cb 1.24 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.03 1fj0 h ALA 60 CO 0.70 0.03 -1.31 -0.44 0.00 0.00 0.00 179.25 178.24 1fj0 h ASP 61 N 0.00 0.44 0.70 0.00 3.32 -1.99 -3.40 116.42 115.49 1fj0 h ASP 61 Ca -0.00 -0.88 0.00 0.00 0.02 0.00 0.00 57.03 56.17 1fj0 h ASP 61 Cb 0.09 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1fj0 h ASP 61 CO 0.00 1.59 -0.51 -0.46 -1.72 0.00 0.00 179.24 178.14 1fj0 n ASN 62 N -3.94 0.54 0.10 6.45 0.23 -1.07 -3.49 115.26 114.08 1fj0 n ASN 62 Ca -0.22 -0.02 -0.03 0.00 -0.53 0.00 0.00 54.58 53.77 1fj0 n ASN 62 Cb 0.91 0.14 0.16 0.00 -2.08 0.00 0.00 39.78 38.91 1fj0 n ASN 62 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 1fj0 h ILE 63 N 0.00 1.38 0.11 1.53 2.04 -1.64 -2.84 117.51 118.09 1fj0 h ILE 63 Ca 0.00 -1.89 0.02 0.00 1.00 0.00 0.00 64.86 63.99 1fj0 h ILE 63 Cb 0.61 1.96 -0.05 0.00 -0.74 0.00 0.00 36.82 38.60 1fj0 h ILE 63 CO 0.00 0.56 -0.42 0.58 0.00 0.00 0.00 178.15 178.87 1fj0 h VAL 64 N 0.14 0.16 -0.35 1.67 2.07 -1.77 -0.95 116.25 117.22 1fj0 h VAL 64 Ca -0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1fj0 h VAL 64 Cb 1.03 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1fj0 h VAL 64 CO 0.08 0.00 -0.07 1.55 0.02 0.00 0.00 177.57 179.16 1fj0 h PRO 65 N -0.65 0.58 -0.59 1.57 0.13 -1.75 -2.86 132.00 128.44 1fj0 h PRO 65 Ca 0.02 -0.16 0.08 0.00 -0.87 0.00 0.00 66.00 65.08 1fj0 h PRO 65 Cb 0.68 -0.07 -0.07 0.00 0.13 0.00 0.00 31.00 31.67 1fj0 h PRO 65 CO -0.25 0.66 0.25 -0.92 -0.23 0.00 0.00 178.00 177.51 1fj0 h TYR 66 N 0.55 0.44 0.00 1.56 3.20 -1.21 -2.19 116.97 119.30 1fj0 h TYR 66 Ca 0.11 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 1fj0 h TYR 66 Cb 0.45 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 1fj0 h TYR 66 CO 0.02 0.14 -0.09 -0.07 -1.64 0.00 0.00 178.16 176.51 1fj0 h LEU 67 N 0.45 0.00 -0.98 2.82 3.38 -0.93 -1.33 115.31 118.72 1fj0 h LEU 67 Ca 0.29 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.16 1fj0 h LEU 67 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1fj0 h LEU 67 CO -0.27 0.09 -0.35 0.00 0.09 0.00 0.00 178.44 178.01 1fj0 h ALA 68 N 1.91 1.13 -0.64 1.53 0.00 -1.45 -0.17 119.26 121.57 1fj0 h ALA 68 Ca -0.00 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.57 1fj0 h ALA 68 Cb 0.36 -0.10 -0.18 0.00 0.00 0.00 0.00 17.79 17.86 1fj0 h ALA 68 CO 0.01 0.56 -0.29 0.34 0.00 0.00 0.00 179.25 179.88 1fj0 s ASP 69 N -6.86 -1.00 0.20 0.00 -1.08 -0.86 -4.41 116.67 102.66 1fj0 s ASP 69 Ca -0.05 -0.43 -0.12 0.00 -0.52 0.00 0.00 52.55 51.43 1fj0 s ASP 69 Cb 0.14 1.31 0.23 0.00 -1.46 0.00 0.00 42.92 43.14 1fj0 s ASP 69 CO 0.77 -0.12 1.70 -0.65 0.52 0.00 0.00 175.17 177.40 1fj0 h PRO 70 N 6.43 0.22 -0.31 4.34 0.11 -1.52 -1.06 132.00 140.21 1fj0 h PRO 70 Ca 0.00 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 1fj0 h PRO 70 Cb 1.20 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1fj0 h PRO 70 CO 0.02 0.14 0.19 -0.91 -0.21 0.00 0.00 178.00 177.23 1fj0 h ASN 71 N 0.22 0.37 -0.57 -2.05 2.35 -1.92 -1.63 115.58 112.36 1fj0 h ASN 71 Ca 0.28 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.96 1fj0 h ASN 71 Cb 0.40 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.65 1fj0 h ASN 71 CO -0.38 0.32 0.32 0.00 -1.65 0.00 0.00 177.43 176.04 1fj0 h ALA 72 N 1.07 0.73 0.35 -0.83 0.00 -1.84 -0.58 119.26 118.16 1fj0 h ALA 72 Ca 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1fj0 h ALA 72 Cb 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1fj0 h ALA 72 CO -0.02 0.24 -0.17 0.35 0.00 0.00 0.00 179.25 179.65 1fj0 h PHE 73 N 0.77 -0.44 -0.76 0.00 3.57 -0.98 -1.25 116.94 117.85 1fj0 h PHE 73 Ca 0.20 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1fj0 h PHE 73 Cb 0.03 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 1fj0 h PHE 73 CO -0.02 -0.26 0.40 -0.07 -2.23 0.00 0.00 178.31 176.14 1fj0 h LEU 74 N -0.50 0.96 -0.80 0.59 3.38 -1.21 -0.96 115.31 116.77 1fj0 h LEU 74 Ca -0.05 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 1fj0 h LEU 74 Cb 0.38 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1fj0 h LEU 74 CO 0.08 0.79 0.01 0.11 0.09 0.00 0.00 178.44 179.53 1fj0 h LYS 75 N 1.05 0.91 -0.35 1.13 1.57 -1.09 -1.68 116.57 118.12 1fj0 h LYS 75 Ca 0.27 -0.26 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1fj0 h LYS 75 Cb 0.06 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1fj0 h LYS 75 CO -0.04 0.90 -0.02 -0.22 -0.57 0.00 0.00 179.45 179.50 1fj0 h LYS 76 N 0.85 0.63 0.03 3.15 3.64 -1.04 -0.94 116.57 122.89 1fj0 h LYS 76 Ca 0.16 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1fj0 h LYS 76 Cb 0.49 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1fj0 h LYS 76 CO 0.02 0.76 -0.06 0.35 -2.27 0.00 0.00 179.45 178.25 1fj0 h PHE 77 N 0.44 -0.16 -0.39 1.91 3.57 -0.98 0.24 116.94 121.57 1fj0 h PHE 77 Ca 0.10 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.53 1fj0 h PHE 77 Cb 0.49 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 1fj0 h PHE 77 CO 0.04 -0.10 -0.06 -0.07 -2.23 0.00 0.00 178.31 175.90 1fj0 h LEU 78 N -0.13 0.62 -0.59 0.59 3.38 -1.28 -2.61 115.31 115.30 1fj0 h LEU 78 Ca 0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1fj0 h LEU 78 Cb 0.14 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1fj0 h LEU 78 CO -0.04 0.73 0.20 0.74 0.09 0.00 0.00 178.44 180.16 1fj0 h THR 79 N 0.60 1.24 0.00 0.22 2.02 -0.74 0.21 112.91 116.45 1fj0 h THR 79 Ca 0.12 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 1fj0 h THR 79 Cb 0.46 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1fj0 h THR 79 CO 0.02 0.30 -0.07 -0.33 0.37 0.00 0.00 175.52 175.81 1fj0 h GLU 80 N 0.82 0.00 -0.01 6.66 5.08 -0.62 -1.49 114.58 125.02 1fj0 h GLU 80 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1fj0 h GLU 80 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1fj0 h GLU 80 CO -0.01 0.07 -0.01 1.63 -1.00 0.00 0.00 179.01 179.70 1fj0 n LYS 81 N -3.42 1.41 -2.19 2.33 4.76 -0.76 -4.89 118.16 115.40 1fj0 n LYS 81 Ca -0.02 -0.62 -0.03 0.00 -2.87 0.00 0.00 58.31 54.78 1fj0 n LYS 81 Cb 0.22 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.92 1fj0 n LYS 81 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1fj0 n GLY 82 N 1.12 0.37 2.16 0.72 0.00 -0.56 -4.95 105.19 104.06 1fj0 n GLY 82 Ca 0.20 -0.72 -0.06 0.00 0.00 0.00 0.00 46.02 45.44 1fj0 n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fj0 n LYS 83 N -1.22 1.99 -0.10 1.61 5.02 -0.01 -4.85 118.16 120.60 1fj0 n LYS 83 Ca -0.02 -3.45 0.11 0.00 -2.02 0.00 0.00 58.31 52.93 1fj0 n LYS 83 Cb 0.52 -1.55 0.48 0.00 -0.02 0.00 0.00 35.03 34.46 1fj0 n LYS 83 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fj0 h ALA 84 N 2.07 1.98 0.00 7.82 0.00 -1.79 -0.78 119.26 128.56 1fj0 h ALA 84 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1fj0 h ALA 84 Cb 1.42 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1fj0 h ALA 84 CO 0.32 -0.11 -0.03 0.38 0.00 0.00 0.00 179.25 179.80 1fj0 h ASP 85 N 0.45 0.00 -0.02 0.00 2.03 -1.92 -1.42 116.42 115.54 1fj0 h ASP 85 Ca 0.29 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1fj0 h ASP 85 Cb 0.52 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.02 1fj0 h ASP 85 CO -0.08 0.03 0.00 0.00 -1.03 0.00 0.00 179.24 178.16 1fj0 n GLN 86 N -3.25 1.32 -0.28 4.15 6.02 -0.30 -3.80 117.38 121.24 1fj0 n GLN 86 Ca -0.02 -0.46 0.09 0.00 -0.01 0.00 0.00 57.00 56.60 1fj0 n GLN 86 Cb 0.19 -1.46 0.20 0.00 1.02 0.00 0.00 30.24 30.19 1fj0 n GLN 86 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fj0 n ALA 87 N -0.42 2.65 0.21 -1.58 0.00 -0.53 -4.57 120.51 116.26 1fj0 n ALA 87 Ca 0.20 -2.35 0.08 0.00 0.00 0.00 0.00 53.44 51.38 1fj0 n ALA 87 Cb 0.22 -0.55 0.41 0.00 0.00 0.00 0.00 19.45 19.52 1fj0 n ALA 87 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1fj0 h VAL 88 N 1.06 0.72 -3.99 0.00 -1.51 -1.67 -3.46 116.25 107.40 1fj0 h VAL 88 Ca 0.00 -1.29 -0.30 0.00 -1.23 0.00 0.00 66.70 63.88 1fj0 h VAL 88 Cb 1.22 1.83 0.09 0.00 -2.13 0.00 0.00 31.29 32.29 1fj0 h VAL 88 CO 0.12 0.29 0.18 0.61 -1.23 0.00 0.00 177.57 177.54 1fj0 n GLY 89 N 0.16 -0.39 3.55 5.19 0.00 -1.26 -5.12 105.19 107.32 1fj0 n GLY 89 Ca -0.00 -1.85 -0.26 0.00 0.00 0.00 0.00 46.02 43.92 1fj0 n GLY 89 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fj0 s VAL 90 N -2.50 2.34 0.65 1.61 -7.23 -1.26 -4.86 120.40 109.15 1fj0 s VAL 90 Ca 0.48 -2.19 -0.11 0.00 -1.81 0.00 0.00 61.98 58.35 1fj0 s VAL 90 Cb -0.02 -2.64 -0.02 0.00 0.56 0.00 0.00 36.38 34.26 1fj0 s VAL 90 CO 0.33 -0.22 1.04 0.28 -0.31 0.00 0.00 175.10 176.22 1fj0 s THR 91 N -2.58 4.43 -0.45 5.32 -1.32 -1.26 -4.64 115.64 115.14 1fj0 s THR 91 Ca 0.33 0.79 0.26 0.00 -1.21 0.00 0.00 61.69 61.85 1fj0 s THR 91 Cb 0.01 -3.71 0.32 0.00 -1.51 0.00 0.00 72.50 67.62 1fj0 s THR 91 CO 0.17 -1.03 1.73 0.11 -2.21 0.00 0.00 174.62 173.39 1fj0 h LYS 92 N -0.46 0.00 -6.45 7.08 1.57 -1.98 -3.43 116.57 112.91 1fj0 h LYS 92 Ca -0.44 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.79 1fj0 h LYS 92 Cb 1.20 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.45 1fj0 h LYS 92 CO 0.61 0.00 1.07 1.41 -0.57 0.00 0.00 179.45 181.97 1fj0 s MET 93 N -3.26 3.35 -1.13 3.15 1.75 -1.26 -4.93 119.30 116.98 1fj0 s MET 93 Ca 0.07 0.40 -0.08 0.00 -1.25 0.00 0.00 55.69 54.83 1fj0 s MET 93 Cb 0.08 -4.10 0.27 0.00 2.84 0.00 0.00 34.83 33.93 1fj0 s MET 93 CO 0.60 -1.88 1.36 0.25 -0.65 0.00 0.00 175.02 174.70 1fj0 n THR 94 N 6.81 4.82 -3.64 10.11 -2.24 -1.26 -4.90 114.28 123.98 1fj0 n THR 94 Ca 0.11 -5.45 -0.10 0.00 -2.27 0.00 0.00 64.05 56.34 1fj0 n THR 94 Cb 0.49 -2.36 -0.07 0.00 -2.10 0.00 0.00 70.33 66.29 1fj0 n THR 94 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1fj0 s PHE 95 N -1.45 -0.71 0.05 4.78 2.19 -1.26 -5.17 117.98 116.41 1fj0 s PHE 95 Ca 0.33 1.64 0.02 0.00 0.33 0.00 0.00 56.93 59.25 1fj0 s PHE 95 Cb -0.02 0.36 -0.03 0.00 -1.31 0.00 0.00 43.02 42.02 1fj0 s PHE 95 CO 0.01 -0.34 -0.07 0.15 1.83 0.00 0.00 175.22 176.80 1fj0 s LYS 96 N 0.59 0.55 -0.26 10.12 1.02 -1.26 -4.70 119.74 125.80 1fj0 s LYS 96 Ca -0.01 -0.84 0.01 0.00 0.02 0.00 0.00 55.97 55.15 1fj0 s LYS 96 Cb -0.05 -0.21 0.07 0.00 -0.52 0.00 0.00 37.83 37.12 1fj0 s LYS 96 CO -0.06 0.02 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.22 1fj0 s LEU 97 N -1.82 2.64 0.10 3.17 2.96 -0.08 -5.02 118.68 120.64 1fj0 s LEU 97 Ca -0.07 -1.33 -0.13 0.00 -0.22 0.00 0.00 54.13 52.37 1fj0 s LEU 97 Cb -0.07 -1.12 -0.12 0.00 0.50 0.00 0.00 46.19 45.38 1fj0 s LEU 97 CO -0.01 -0.29 1.36 0.00 -1.32 0.00 0.00 176.35 176.09 1fj0 h ALA 98 N 7.96 0.38 -2.21 5.97 0.00 -1.85 -3.32 119.26 126.19 1fj0 h ALA 98 Ca -0.15 -0.51 -0.55 0.00 0.00 0.00 0.00 54.91 53.69 1fj0 h ALA 98 Cb 1.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1fj0 h ALA 98 CO 0.43 0.59 1.10 1.21 0.00 0.00 0.00 179.25 182.58 1fj0 s ASN 99 N -6.87 6.59 0.19 0.00 3.84 -1.26 -4.91 114.94 112.51 1fj0 s ASN 99 Ca -0.11 2.10 -0.13 0.00 0.21 0.00 0.00 52.86 54.93 1fj0 s ASN 99 Cb 0.09 -2.53 0.10 0.00 -0.55 0.00 0.00 41.25 38.35 1fj0 s ASN 99 CO 0.87 -1.01 1.85 -0.08 -2.79 0.00 0.00 177.10 175.95 1fj0 h GLU 100 N 9.86 0.78 -0.74 0.43 4.81 -1.99 -1.71 114.58 126.02 1fj0 h GLU 100 Ca -0.38 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.79 1fj0 h GLU 100 Cb 1.17 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 1fj0 h GLU 100 CO 0.96 0.51 0.39 0.37 -0.73 0.00 0.00 179.01 180.52 1fj0 h GLN 101 N 0.80 1.04 -0.64 1.92 5.75 -1.99 -0.24 115.11 121.74 1fj0 h GLN 101 Ca 0.22 -0.13 -0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1fj0 h GLN 101 Cb -0.08 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.24 1fj0 h GLN 101 CO -0.05 0.79 0.27 1.96 -2.65 0.00 0.00 178.83 179.14 1fj0 h GLN 102 N 1.03 0.93 -0.47 1.69 4.20 -1.88 -0.39 115.11 120.23 1fj0 h GLN 102 Ca 0.26 -0.14 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 1fj0 h GLN 102 Cb 0.06 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1fj0 h GLN 102 CO -0.04 0.76 -0.10 0.00 -0.67 0.00 0.00 178.83 178.77 1fj0 h ARG 103 N 0.92 0.90 -0.73 1.46 3.08 -0.73 0.52 114.38 119.80 1fj0 h ARG 103 Ca 0.22 -0.34 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 1fj0 h ARG 103 Cb 0.16 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 1fj0 h ARG 103 CO -0.02 0.99 0.24 0.87 -1.07 0.00 0.00 179.97 180.97 1fj0 h LYS 104 N 0.74 1.13 -0.27 0.04 1.57 -0.69 -1.71 116.57 117.38 1fj0 h LYS 104 Ca 0.12 -0.24 -0.12 0.00 -1.87 0.00 0.00 60.65 58.55 1fj0 h LYS 104 Cb 0.65 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 1fj0 h LYS 104 CO 0.04 0.95 -0.30 -0.44 -0.57 0.00 0.00 179.45 179.14 1fj0 h ASP 105 N 1.07 0.72 0.18 0.86 3.32 -0.90 -0.69 116.42 120.98 1fj0 h ASP 105 Ca 0.24 -0.48 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 1fj0 h ASP 105 Cb 0.29 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1fj0 h ASP 105 CO -0.01 1.06 -0.37 1.62 -1.72 0.00 0.00 179.24 179.82 1fj0 h VAL 106 N 0.40 1.29 -0.23 -1.35 3.04 -0.75 -1.63 116.25 117.02 1fj0 h VAL 106 Ca 0.04 -1.43 -0.10 0.00 -1.01 0.00 0.00 66.70 64.19 1fj0 h VAL 106 Cb 0.87 1.61 -0.01 0.00 -2.01 0.00 0.00 31.29 31.74 1fj0 h VAL 106 CO 0.07 0.43 -0.30 0.58 -1.01 0.00 0.00 177.57 177.34 1fj0 h VAL 107 N 0.23 1.28 -0.49 1.51 2.07 -1.13 0.66 116.25 120.38 1fj0 h VAL 107 Ca 0.03 -1.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.13 1fj0 h VAL 107 Cb 0.76 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 1fj0 h VAL 107 CO 0.06 0.42 0.06 0.00 0.02 0.00 0.00 177.57 178.13 1fj0 h ALA 108 N 1.28 1.19 -0.49 1.67 0.00 -0.47 -1.47 119.26 120.97 1fj0 h ALA 108 Ca 0.05 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1fj0 h ALA 108 Cb 0.73 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1fj0 h ALA 108 CO 0.06 0.54 0.04 -0.92 0.00 0.00 0.00 179.25 178.97 1fj0 h TYR 109 N 0.73 0.89 -0.78 0.00 3.20 -0.41 -2.88 116.97 117.73 1fj0 h TYR 109 Ca 0.15 -0.14 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1fj0 h TYR 109 Cb 0.36 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 1fj0 h TYR 109 CO 0.02 0.83 0.51 -0.07 -1.64 0.00 0.00 178.16 177.81 1fj0 h LEU 110 N 0.69 0.79 -2.26 2.82 3.38 -0.23 -1.06 115.31 119.45 1fj0 h LEU 110 Ca 0.14 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1fj0 h LEU 110 Cb 0.45 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1fj0 h LEU 110 CO 0.02 0.53 -0.04 0.00 0.09 0.00 0.00 178.44 179.04 1fj0 h ALA 111 N 1.56 1.15 -0.01 1.53 0.00 -1.07 -0.99 119.26 121.43 1fj0 h ALA 111 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1fj0 h ALA 111 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1fj0 h ALA 111 CO -0.10 0.05 -0.25 0.25 0.00 0.00 0.00 179.25 179.20 1fj0 n THR 112 N -3.35 0.00 -2.74 0.00 -2.24 -0.41 -4.58 114.28 100.96 1fj0 n THR 112 Ca -0.02 -0.12 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 1fj0 n THR 112 Cb 0.18 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1fj0 n THR 112 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1fj0 n LEU 113 N -0.69 5.34 0.00 3.22 4.77 -0.38 -5.07 117.00 124.20 1fj0 n LEU 113 Ca 0.12 -4.31 0.06 0.00 -0.03 0.00 0.00 56.01 51.85 1fj0 n LEU 113 Cb 0.34 -1.65 0.37 0.00 -2.33 0.00 0.00 43.42 40.16 1fj0 n LEU 113 CO 0.26 0.64 0.59 0.29 -1.33 0.00 0.00 177.39 177.83