#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dj8 n LYS 10 N 0.00 1.31 -2.33 1.20 4.76 -1.26 -4.94 118.16 116.89 1dj8 n LYS 10 Ca 0.00 -0.89 -0.40 0.00 -2.87 0.00 0.00 58.31 54.15 1dj8 n LYS 10 Cb 0.00 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 31.68 1dj8 n LYS 10 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1dj8 s LYS 11 N -2.31 4.41 0.38 1.97 1.02 -1.26 -4.95 119.74 118.99 1dj8 s LYS 11 Ca 0.27 1.92 -0.28 0.00 0.02 0.00 0.00 55.97 57.90 1dj8 s LYS 11 Cb 0.20 -3.01 -0.10 0.00 -0.52 0.00 0.00 37.83 34.39 1dj8 s LYS 11 CO 0.46 -0.04 1.44 -2.14 -0.92 0.00 0.00 175.35 174.16 1dj8 s PRO 12 N -1.78 4.10 0.27 -1.68 0.02 -1.26 -4.85 135.00 129.82 1dj8 s PRO 12 Ca 0.49 2.48 0.01 0.00 0.02 0.00 0.00 61.00 64.00 1dj8 s PRO 12 Cb -0.34 -2.95 0.59 0.00 0.02 0.00 0.00 34.50 31.83 1dj8 s PRO 12 CO 0.43 -0.50 1.77 0.28 -0.33 0.00 0.00 177.00 178.65 1dj8 h VAL 13 N 2.90 0.72 0.00 3.83 2.07 -1.97 0.11 116.25 123.91 1dj8 h VAL 13 Ca -0.50 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1dj8 h VAL 13 Cb 1.24 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1dj8 h VAL 13 CO 0.64 0.12 0.00 0.59 0.02 0.00 0.00 177.57 178.94 1dj8 n ASN 14 N -4.84 0.23 -0.02 0.57 4.13 -1.26 -1.35 115.26 112.72 1dj8 n ASN 14 Ca 0.19 0.58 0.10 0.00 1.68 0.00 0.00 54.58 57.13 1dj8 n ASN 14 Cb 0.47 -0.62 -0.11 0.00 -1.54 0.00 0.00 39.78 37.97 1dj8 n ASN 14 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1dj8 n SER 15 N -1.79 1.03 -4.72 6.41 7.64 0.37 -4.92 113.62 117.65 1dj8 n SER 15 Ca 0.01 -1.02 -0.37 0.00 1.01 0.00 0.00 58.87 58.50 1dj8 n SER 15 Cb 0.10 0.98 0.07 0.00 -1.01 0.00 0.00 64.21 64.34 1dj8 n SER 15 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 1dj8 n TRP 16 N -1.43 1.91 -3.94 1.43 7.02 -0.46 -4.94 117.44 117.03 1dj8 n TRP 16 Ca 0.04 0.42 -0.25 0.00 -1.02 0.00 0.00 57.50 56.70 1dj8 n TRP 16 Cb 0.33 -2.27 -0.04 0.00 -2.42 0.00 0.00 31.31 26.91 1dj8 n TRP 16 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1dj8 s THR 17 N -1.38 2.14 0.46 -0.99 -4.23 -1.26 -2.10 115.64 108.28 1dj8 s THR 17 Ca 0.82 -1.56 0.14 0.00 -1.18 0.00 0.00 61.69 59.91 1dj8 s THR 17 Cb -0.38 -2.70 0.31 0.00 1.34 0.00 0.00 72.50 71.07 1dj8 s THR 17 CO 0.41 0.00 2.04 0.00 -0.54 0.00 0.00 174.62 176.53 1dj8 h GLU 19 N 0.29 0.95 -0.46 0.00 4.81 -1.68 -0.14 114.58 118.34 1dj8 h GLU 19 Ca 0.18 -0.10 -0.11 0.00 -0.13 0.00 0.00 59.36 59.20 1dj8 h GLU 19 Cb 0.34 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1dj8 h GLU 19 CO -0.04 0.69 -0.14 -0.44 -0.73 0.00 0.00 179.01 178.35 1dj8 h ASP 20 N 0.96 0.91 -0.47 1.04 3.32 -1.63 -3.08 116.42 117.47 1dj8 h ASP 20 Ca 0.24 -0.37 -0.12 0.00 0.02 0.00 0.00 57.03 56.80 1dj8 h ASP 20 Cb 0.02 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1dj8 h ASP 20 CO -0.04 1.08 -0.15 0.15 -1.72 0.00 0.00 179.24 178.56 1dj8 h PHE 21 N 0.74 1.08 0.00 4.55 3.57 -1.19 -2.33 116.94 123.36 1dj8 h PHE 21 Ca 0.11 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.38 1dj8 h PHE 21 Cb 0.70 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.17 1dj8 h PHE 21 CO 0.05 1.03 0.00 1.28 -2.23 0.00 0.00 178.31 178.44 1dj8 n LEU 22 N -4.13 0.38 0.12 0.59 4.77 -0.14 -1.24 117.00 117.36 1dj8 n LEU 22 Ca 0.01 0.63 0.12 0.00 -0.03 0.00 0.00 56.01 56.74 1dj8 n LEU 22 Cb 0.42 -0.62 0.13 0.00 -2.33 0.00 0.00 43.42 41.02 1dj8 n LEU 22 CO 0.45 -0.60 0.41 0.00 -1.33 0.00 0.00 177.39 176.32 1dj8 h ALA 23 N 2.19 0.71 -2.70 -1.18 0.00 -1.33 -3.45 119.26 113.48 1dj8 h ALA 23 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 1dj8 h ALA 23 Cb 0.17 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.98 1dj8 h ALA 23 CO 0.00 0.00 0.53 0.08 0.00 0.00 0.00 179.25 179.86 1dj8 s VAL 24 N -3.24 3.57 0.54 0.00 1.01 -0.37 -4.97 120.40 116.93 1dj8 s VAL 24 Ca 0.04 1.39 -0.22 0.00 0.00 0.00 0.00 61.98 63.19 1dj8 s VAL 24 Cb 0.10 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1dj8 s VAL 24 CO 0.72 0.25 1.35 -0.67 0.00 0.00 0.00 175.10 176.75 1dj8 n ASP 25 N 2.11 2.66 -0.32 3.32 2.03 -1.26 -4.77 116.55 120.32 1dj8 n ASP 25 Ca 0.03 0.99 0.21 0.00 0.52 0.00 0.00 54.79 56.53 1dj8 n ASP 25 Cb 0.45 -1.57 0.48 0.00 -0.72 0.00 0.00 41.12 39.76 1dj8 n ASP 25 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1dj8 h GLU 26 N 1.49 0.43 0.00 -0.67 4.81 -1.94 -0.92 114.58 117.79 1dj8 h GLU 26 Ca -0.51 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 1dj8 h GLU 26 Cb 1.30 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 1dj8 h GLU 26 CO 0.57 0.29 -0.07 0.66 -0.73 0.00 0.00 179.01 179.73 1dj8 h SER 27 N 0.45 0.00 -0.09 1.04 4.64 -2.04 -2.98 113.55 114.57 1dj8 h SER 27 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 1dj8 h SER 27 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 1dj8 h SER 27 CO -0.31 0.07 0.00 0.49 -0.87 0.00 0.00 176.83 176.21 1dj8 n PHE 28 N -3.31 0.11 -0.26 4.77 3.01 -0.37 -4.70 117.46 116.71 1dj8 n PHE 28 Ca -0.01 -0.09 -0.05 0.00 1.01 0.00 0.00 57.45 58.31 1dj8 n PHE 28 Cb 0.25 -0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.78 1dj8 n PHE 28 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1dj8 h GLN 29 N 2.65 0.98 0.00 -1.08 4.20 -1.35 -1.83 115.11 118.68 1dj8 h GLN 29 Ca 0.00 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1dj8 h GLN 29 Cb 0.61 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 1dj8 h GLN 29 CO 0.00 0.68 -0.19 -1.00 -0.67 0.00 0.00 178.83 177.65 1dj8 h PRO 30 N 0.99 0.00 -0.25 1.46 0.13 -1.84 -0.61 132.00 131.88 1dj8 h PRO 30 Ca 0.26 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.24 1dj8 h PRO 30 Cb -0.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.07 1dj8 h PRO 30 CO -0.05 0.19 -0.47 1.15 -0.23 0.00 0.00 178.00 178.59 1dj8 h THR 31 N 0.00 1.30 -0.45 1.56 2.02 -1.73 -0.75 112.91 114.85 1dj8 h THR 31 Ca -0.00 -1.66 -0.12 0.00 0.77 0.00 0.00 66.41 65.40 1dj8 h THR 31 Cb 0.39 1.60 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1dj8 h THR 31 CO 0.02 0.53 -0.18 0.00 0.37 0.00 0.00 175.52 176.27 1dj8 h ALA 32 N 0.95 0.83 -0.35 6.16 0.00 -0.72 -0.29 119.26 125.84 1dj8 h ALA 32 Ca 0.03 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1dj8 h ALA 32 Cb 1.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1dj8 h ALA 32 CO 0.09 0.65 0.06 0.28 0.00 0.00 0.00 179.25 180.34 1dj8 h VAL 33 N 0.77 1.23 -0.28 0.00 2.07 -0.98 -1.99 116.25 117.08 1dj8 h VAL 33 Ca 0.11 -0.81 -0.09 0.00 0.82 0.00 0.00 66.70 66.72 1dj8 h VAL 33 Cb 0.71 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1dj8 h VAL 33 CO 0.05 0.27 -0.22 1.23 0.02 0.00 0.00 177.57 178.93 1dj8 h GLY 34 N 0.41 0.58 0.96 2.17 0.00 -0.98 -2.22 103.07 104.00 1dj8 h GLY 34 Ca 0.11 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 1dj8 h GLY 34 CO 0.01 0.42 0.12 -2.75 0.00 0.00 0.00 176.54 174.34 1dj8 h PHE 35 N 0.47 0.76 -0.84 5.60 3.57 -0.90 -1.51 116.94 124.09 1dj8 h PHE 35 Ca 0.07 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.50 1dj8 h PHE 35 Cb 0.65 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.13 1dj8 h PHE 35 CO 0.02 0.69 0.55 0.00 -2.23 0.00 0.00 178.31 177.34 1dj8 h ALA 36 N 0.98 1.08 -0.52 2.41 0.00 -1.22 -2.34 119.26 119.65 1dj8 h ALA 36 Ca 0.14 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1dj8 h ALA 36 Cb 0.30 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1dj8 h ALA 36 CO -0.00 0.44 -0.02 0.93 0.00 0.00 0.00 179.25 180.60 1dj8 h GLU 37 N 1.11 0.93 -0.73 0.00 5.08 -0.97 -2.95 114.58 117.06 1dj8 h GLU 37 Ca 0.32 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1dj8 h GLU 37 Cb -0.09 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 1dj8 h GLU 37 CO -0.08 0.96 0.43 0.00 -1.00 0.00 0.00 179.01 179.32 1dj8 h ALA 38 N 0.94 1.39 0.00 3.43 0.00 -1.01 -2.17 119.26 121.84 1dj8 h ALA 38 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dj8 h ALA 38 Cb 0.55 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1dj8 h ALA 38 CO 0.03 0.52 0.00 -0.07 0.00 0.00 0.00 179.25 179.73 1dj8 h LEU 39 N 1.00 0.00 -0.98 0.00 4.07 -1.24 0.24 115.31 118.40 1dj8 h LEU 39 Ca 0.26 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1dj8 h LEU 39 Cb -0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.71 1dj8 h LEU 39 CO -0.05 0.00 -0.01 0.59 -1.08 0.00 0.00 178.44 177.89 1dj8 n ASN 40 N -2.96 1.54 -0.08 -0.43 5.03 -0.82 -4.08 115.26 113.46 1dj8 n ASN 40 Ca -0.02 -1.49 0.10 0.00 0.87 0.00 0.00 54.58 54.03 1dj8 n ASN 40 Cb 0.09 0.01 0.14 0.00 -1.02 0.00 0.00 39.78 38.99 1dj8 n ASN 40 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1dj8 n ASN 41 N 0.19 2.35 0.13 6.41 3.02 0.07 -4.81 115.26 122.61 1dj8 n ASN 41 Ca 0.18 -3.10 0.05 0.00 -0.03 0.00 0.00 54.58 51.69 1dj8 n ASN 41 Cb 0.36 -0.43 0.50 0.00 -0.61 0.00 0.00 39.78 39.60 1dj8 n ASN 41 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1dj8 h LYS 42 N 0.01 0.26 -0.02 3.52 2.10 -1.71 -2.99 116.57 117.75 1dj8 h LYS 42 Ca 0.00 -0.03 -0.17 0.00 -2.00 0.00 0.00 60.65 58.46 1dj8 h LYS 42 Cb 1.00 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 32.26 1dj8 h LYS 42 CO 0.00 0.23 -0.74 -0.44 -2.00 0.00 0.00 179.45 176.50 1dj8 h ASP 43 N 0.27 0.19 -2.13 7.07 3.32 -1.92 -3.37 116.42 119.85 1dj8 h ASP 43 Ca 0.07 -0.13 -0.57 0.00 0.02 0.00 0.00 57.03 56.41 1dj8 h ASP 43 Cb 0.07 -0.06 -0.39 0.00 0.22 0.00 0.00 39.33 39.17 1dj8 h ASP 43 CO -0.01 0.86 -1.04 0.29 -1.72 0.00 0.00 179.24 177.63 1dj8 n LYS 44 N -3.74 0.69 -0.34 3.56 5.02 -1.22 -5.00 118.16 117.14 1dj8 n LYS 44 Ca -0.02 -3.31 0.04 0.00 -2.02 0.00 0.00 58.31 53.00 1dj8 n LYS 44 Cb 0.71 -1.41 0.19 0.00 -0.02 0.00 0.00 35.03 34.51 1dj8 n LYS 44 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1dj8 h PRO 45 N 4.46 0.95 0.00 1.97 0.13 -1.70 -1.55 132.00 136.25 1dj8 h PRO 45 Ca 0.13 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1dj8 h PRO 45 Cb 0.87 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1dj8 h PRO 45 CO 0.46 0.63 0.00 -0.85 -0.23 0.00 0.00 178.00 178.01 1dj8 n GLU 46 N -4.63 0.03 0.00 0.86 0.00 -1.26 -1.23 120.64 114.41 1dj8 n GLU 46 Ca 0.16 0.31 0.08 0.00 0.00 0.00 0.00 57.16 57.70 1dj8 n GLU 46 Cb 0.26 -1.50 -0.00 0.00 0.00 0.00 0.00 31.44 30.20 1dj8 n GLU 46 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1dj8 n ASP 47 N -1.35 1.60 -4.74 -1.84 8.00 -0.58 -5.00 116.55 112.64 1dj8 n ASP 47 Ca 0.01 -1.30 -0.41 0.00 0.71 0.00 0.00 54.79 53.80 1dj8 n ASP 47 Cb 0.03 0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 41.57 1dj8 n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dj8 s ALA 48 N -1.85 3.65 -0.13 2.24 0.00 -0.37 -5.01 121.76 120.30 1dj8 s ALA 48 Ca 0.13 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.45 1dj8 s ALA 48 Cb 0.13 -3.57 -0.00 0.00 0.00 0.00 0.00 23.12 19.68 1dj8 s ALA 48 CO 0.39 -0.75 -0.19 0.08 0.00 0.00 0.00 175.76 175.29 1dj8 s VAL 49 N 0.14 2.42 -0.29 0.00 1.01 -1.26 -5.10 120.40 117.31 1dj8 s VAL 49 Ca 0.61 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 1dj8 s VAL 49 Cb -0.42 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1dj8 s VAL 49 CO 0.42 0.54 0.18 -0.22 0.00 0.00 0.00 175.10 176.02 1dj8 s LEU 50 N 0.52 4.07 -0.54 3.92 2.96 -1.26 -5.04 118.68 123.32 1dj8 s LEU 50 Ca -0.12 -0.18 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 1dj8 s LEU 50 Cb -0.17 -2.09 0.14 0.00 0.50 0.00 0.00 46.19 44.58 1dj8 s LEU 50 CO 0.05 -0.10 0.40 -0.62 -1.32 0.00 0.00 176.35 174.75 1dj8 s ASP 51 N 1.72 5.69 0.32 3.68 3.68 -1.26 -4.95 116.67 125.54 1dj8 s ASP 51 Ca 0.06 -2.20 0.03 0.00 2.13 0.00 0.00 52.55 52.57 1dj8 s ASP 51 Cb -0.16 -1.99 0.53 0.00 -1.45 0.00 0.00 42.92 39.86 1dj8 s ASP 51 CO 0.09 -0.60 1.85 -0.37 0.13 0.00 0.00 175.17 176.28 1dj8 h VAL 52 N 5.83 1.21 -0.00 1.11 -1.51 -1.99 -1.39 116.25 119.50 1dj8 h VAL 52 Ca -0.13 -0.81 -0.12 0.00 -1.23 0.00 0.00 66.70 64.42 1dj8 h VAL 52 Cb 1.04 0.87 -0.02 0.00 -2.13 0.00 0.00 31.29 31.06 1dj8 h VAL 52 CO 0.80 0.28 -0.57 -0.61 -1.23 0.00 0.00 177.57 176.24 1dj8 h GLN 53 N 0.59 0.00 -0.15 5.19 5.75 -1.99 -0.95 115.11 123.55 1dj8 h GLN 53 Ca 0.13 -0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.60 1dj8 h GLN 53 Cb 0.33 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 1dj8 h GLN 53 CO 0.01 0.58 -0.02 0.78 -2.65 0.00 0.00 178.83 177.53 1dj8 h GLY 54 N 1.72 0.31 0.67 2.39 0.00 -1.85 -0.63 103.07 105.68 1dj8 h GLY 54 Ca -0.01 -0.24 0.05 0.00 0.00 0.00 0.00 47.33 47.14 1dj8 h GLY 54 CO 0.07 0.22 0.26 -2.22 0.00 0.00 0.00 176.54 174.88 1dj8 h ILE 55 N 0.00 0.93 -0.53 2.60 1.08 -1.05 0.11 117.51 120.65 1dj8 h ILE 55 Ca 0.04 -0.17 0.06 0.00 -0.39 0.00 0.00 64.86 64.40 1dj8 h ILE 55 Cb 0.42 0.38 -0.05 0.00 -3.07 0.00 0.00 36.82 34.51 1dj8 h ILE 55 CO 0.01 0.09 0.25 0.00 -0.69 0.00 0.00 178.15 177.82 1dj8 h ALA 56 N 1.30 0.68 -0.14 1.87 0.00 -0.90 -1.59 119.26 120.49 1dj8 h ALA 56 Ca 0.24 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 55.01 1dj8 h ALA 56 Cb 0.17 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1dj8 h ALA 56 CO -0.18 -0.11 -0.62 1.15 0.00 0.00 0.00 179.25 179.49 1dj8 h THR 57 N 0.48 1.32 0.00 0.00 2.02 -0.79 -3.34 112.91 112.61 1dj8 h THR 57 Ca 0.24 -1.87 -0.11 0.00 0.77 0.00 0.00 66.41 65.44 1dj8 h THR 57 Cb 0.19 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 1dj8 h THR 57 CO -0.19 0.58 -0.51 1.62 0.37 0.00 0.00 175.52 177.39 1dj8 h VAL 58 N 0.33 0.93 -0.07 3.16 3.04 -0.65 -3.36 116.25 119.62 1dj8 h VAL 58 Ca -0.04 -2.14 0.04 0.00 -1.01 0.00 0.00 66.70 63.55 1dj8 h VAL 58 Cb 1.25 2.34 -0.05 0.00 -2.01 0.00 0.00 31.29 32.81 1dj8 h VAL 58 CO 0.13 0.50 -0.26 0.74 -1.01 0.00 0.00 177.57 177.67 1dj8 h THR 59 N 0.00 0.40 -0.06 3.17 2.02 -1.41 -0.38 112.91 116.65 1dj8 h THR 59 Ca -0.01 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.19 1dj8 h THR 59 Cb 1.29 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1dj8 h THR 59 CO 0.07 0.00 0.07 1.55 0.37 0.00 0.00 175.52 177.57 1dj8 h PRO 60 N -0.36 0.00 -0.06 6.66 0.13 -1.77 -0.92 132.00 135.68 1dj8 h PRO 60 Ca 0.08 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.03 1dj8 h PRO 60 Cb 0.48 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 1dj8 h PRO 60 CO -0.28 0.00 -0.73 0.00 -0.23 0.00 0.00 178.00 176.76 1dj8 h ALA 61 N 1.93 0.64 -0.18 -0.56 0.00 -1.27 -2.18 119.26 117.63 1dj8 h ALA 61 Ca 0.03 -0.61 -0.20 0.00 0.00 0.00 0.00 54.91 54.13 1dj8 h ALA 61 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1dj8 h ALA 61 CO -0.00 0.78 -0.67 0.82 0.00 0.00 0.00 179.25 180.18 1dj8 h ILE 62 N 0.22 1.30 -0.21 0.00 2.04 -0.61 -0.51 117.51 119.74 1dj8 h ILE 62 Ca -0.03 -1.91 0.01 0.00 1.00 0.00 0.00 64.86 63.93 1dj8 h ILE 62 Cb 1.30 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 39.24 1dj8 h ILE 62 CO 0.12 0.60 0.10 0.58 0.00 0.00 0.00 178.15 179.56 1dj8 h VAL 63 N 0.50 1.00 -0.61 1.67 2.07 -1.06 0.10 116.25 119.92 1dj8 h VAL 63 Ca -0.02 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1dj8 h VAL 63 Cb 1.27 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1dj8 h VAL 63 CO 0.13 0.04 0.15 -0.61 0.02 0.00 0.00 177.57 177.30 1dj8 h GLN 64 N 0.22 0.97 -0.67 1.57 4.15 -1.31 -1.42 115.11 118.63 1dj8 h GLN 64 Ca 0.09 -0.23 -0.05 0.00 0.77 0.00 0.00 58.65 59.22 1dj8 h GLN 64 Cb 0.02 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.55 1dj8 h GLN 64 CO -0.06 0.89 0.21 0.00 -1.93 0.00 0.00 178.83 177.94 1dj8 h ALA 65 N 1.04 1.11 -0.32 3.38 0.00 -0.67 -2.50 119.26 121.30 1dj8 h ALA 65 Ca 0.19 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1dj8 h ALA 65 Cb 0.36 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1dj8 h ALA 65 CO 0.00 0.61 -0.22 0.00 0.00 0.00 0.00 179.25 179.64 1dj8 h THR 67 N 0.54 1.18 -0.01 0.00 2.02 -0.83 -1.50 112.91 114.31 1dj8 h THR 67 Ca 0.08 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1dj8 h THR 67 Cb 0.67 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1dj8 h THR 67 CO 0.05 0.19 -0.06 0.00 0.37 0.00 0.00 175.52 176.08 1dj8 n GLN 68 N -4.39 1.07 -2.82 6.66 6.02 -1.07 -4.30 117.38 118.55 1dj8 n GLN 68 Ca 0.05 -0.41 -0.11 0.00 -0.01 0.00 0.00 57.00 56.53 1dj8 n GLN 68 Cb 0.10 -1.49 0.07 0.00 1.02 0.00 0.00 30.24 29.93 1dj8 n GLN 68 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1dj8 n ASP 69 N -0.61 -1.46 -0.08 1.08 4.64 -0.68 -5.02 116.55 114.42 1dj8 n ASP 69 Ca 0.18 -3.37 0.26 0.00 -1.38 0.00 0.00 54.79 50.48 1dj8 n ASP 69 Cb 0.26 1.18 0.72 0.00 -1.04 0.00 0.00 41.12 42.23 1dj8 n ASP 69 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 1dj8 h LYS 70 N 2.88 0.00 0.00 -0.67 1.57 -1.50 -1.85 116.57 117.00 1dj8 h LYS 70 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1dj8 h LYS 70 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1dj8 h LYS 70 CO 0.20 0.00 0.00 1.96 -0.57 0.00 0.00 179.45 181.04 1dj8 h GLN 71 N 0.00 0.00 -7.21 3.15 1.08 -1.95 -2.25 115.11 107.93 1dj8 h GLN 71 Ca 0.34 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 57.03 1dj8 h GLN 71 Cb 1.55 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 29.11 1dj8 h GLN 71 CO -0.00 0.00 0.36 0.00 -0.95 0.00 0.00 178.83 178.24 1dj8 s ALA 72 N -3.19 2.27 -0.02 3.87 0.00 -0.70 -4.67 121.76 119.33 1dj8 s ALA 72 Ca 0.08 0.63 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 1dj8 s ALA 72 Cb 0.07 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.76 1dj8 s ALA 72 CO 0.65 -1.62 1.45 1.21 0.00 0.00 0.00 175.76 177.46 1dj8 s ASN 73 N -2.49 6.81 0.14 0.00 2.47 -1.26 0.53 114.94 121.14 1dj8 s ASN 73 Ca 0.69 2.13 -0.23 0.00 0.42 0.00 0.00 52.86 55.86 1dj8 s ASN 73 Cb -0.23 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.02 1dj8 s ASN 73 CO 0.45 -0.77 1.64 0.15 -3.72 0.00 0.00 177.10 174.84 1dj8 h PHE 74 N 8.19 -0.63 -0.76 0.43 3.57 -1.63 -2.47 116.94 123.64 1dj8 h PHE 74 Ca -0.37 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.21 1dj8 h PHE 74 Cb 1.17 0.30 -0.05 0.00 2.79 0.00 0.00 35.95 40.17 1dj8 h PHE 74 CO 0.78 -0.32 0.50 0.87 -2.23 0.00 0.00 178.31 177.92 1dj8 h LYS 75 N -0.28 0.83 -0.79 1.11 1.79 -1.86 -0.97 116.57 116.40 1dj8 h LYS 75 Ca 0.11 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.49 1dj8 h LYS 75 Cb 0.45 -0.19 -0.04 0.00 -1.58 0.00 0.00 32.23 30.87 1dj8 h LYS 75 CO -0.33 0.55 0.35 -0.44 -1.08 0.00 0.00 179.45 178.50 1dj8 h ASP 76 N 0.86 1.06 0.19 0.86 3.32 -1.85 -0.67 116.42 120.20 1dj8 h ASP 76 Ca 0.32 -0.15 -0.13 0.00 0.02 0.00 0.00 57.03 57.09 1dj8 h ASP 76 Cb 0.17 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1dj8 h ASP 76 CO -0.10 0.92 -0.49 0.11 -1.72 0.00 0.00 179.24 177.96 1dj8 h LYS 77 N 1.14 0.34 0.14 3.56 1.79 -1.05 -0.16 116.57 122.34 1dj8 h LYS 77 Ca 0.27 -0.19 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1dj8 h LYS 77 Cb 0.17 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 1dj8 h LYS 77 CO -0.03 0.76 -0.07 0.28 -1.08 0.00 0.00 179.45 179.31 1dj8 h VAL 78 N 0.27 0.88 -0.61 0.50 2.07 -0.85 -0.51 116.25 118.01 1dj8 h VAL 78 Ca 0.01 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1dj8 h VAL 78 Cb 0.96 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1dj8 h VAL 78 CO 0.08 0.01 0.31 0.50 0.02 0.00 0.00 177.57 178.50 1dj8 h LYS 79 N -0.20 0.86 -0.29 1.57 3.64 -1.00 -1.33 116.57 119.81 1dj8 h LYS 79 Ca -0.02 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1dj8 h LYS 79 Cb 0.16 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1dj8 h LYS 79 CO 0.03 0.67 0.18 0.78 -2.27 0.00 0.00 179.45 178.84 1dj8 h GLY 80 N 0.83 0.40 1.40 5.01 0.00 -0.86 -0.99 103.07 108.85 1dj8 h GLY 80 Ca 0.21 -0.14 -0.15 0.00 0.00 0.00 0.00 47.33 47.25 1dj8 h GLY 80 CO -0.03 0.14 -0.45 0.83 0.00 0.00 0.00 176.54 177.03 1dj8 h GLU 81 N 0.37 0.65 -0.48 4.80 4.39 -0.93 -2.57 114.58 120.81 1dj8 h GLU 81 Ca 0.11 -0.36 -0.07 0.00 0.34 0.00 0.00 59.36 59.38 1dj8 h GLU 81 Cb -0.03 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 1dj8 h GLU 81 CO -0.03 0.97 -0.01 2.35 -1.16 0.00 0.00 179.01 181.13 1dj8 h TRP 82 N 0.52 0.85 -0.57 4.33 2.91 -1.10 -2.54 115.95 120.35 1dj8 h TRP 82 Ca 0.03 -0.12 -0.05 0.00 1.13 0.00 0.00 58.89 59.89 1dj8 h TRP 82 Cb 0.98 -0.23 -0.03 0.00 -0.51 0.00 0.00 29.16 29.38 1dj8 h TRP 82 CO 0.05 0.79 0.17 -0.44 -1.03 0.00 0.00 178.44 177.97 1dj8 h ASP 83 N 0.74 0.80 0.88 2.65 3.32 -1.00 -1.57 116.42 122.25 1dj8 h ASP 83 Ca 0.14 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 1dj8 h ASP 83 Cb 0.46 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1dj8 h ASP 83 CO 0.02 0.76 -0.12 0.11 -1.72 0.00 0.00 179.24 178.29 1dj8 h LYS 84 N 0.84 0.00 0.00 3.56 1.57 -1.12 -2.82 116.57 118.59 1dj8 h LYS 84 Ca 0.19 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1dj8 h LYS 84 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 1dj8 h LYS 84 CO -0.01 0.12 -0.01 0.82 -0.57 0.00 0.00 179.45 179.80 1dj8 h ILE 85 N 0.00 1.27 0.00 1.86 2.04 -0.95 -3.43 117.51 118.30 1dj8 h ILE 85 Ca -0.00 -1.96 0.00 0.00 1.00 0.00 0.00 64.86 63.90 1dj8 h ILE 85 Cb 0.60 2.41 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1dj8 h ILE 85 CO 0.02 0.43 0.00 1.17 0.00 0.00 0.00 178.15 179.77 1dj8 n LYS 86 N -4.66 0.00 0.00 2.37 4.81 -0.67 -5.12 118.16 114.89 1dj8 n LYS 86 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 1dj8 n LYS 86 Cb 0.34 -0.32 0.00 0.00 0.02 0.00 0.00 35.03 35.07 1dj8 n LYS 86 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20