#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dj8 h LYS 10 N 0.00 0.00 -6.82 1.20 1.57 -2.07 -3.46 116.57 106.98 1dj8 h LYS 10 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1dj8 h LYS 10 Cb 0.00 0.00 0.10 0.00 0.08 0.00 0.00 32.23 32.41 1dj8 h LYS 10 CO 0.00 0.00 0.71 1.17 -0.57 0.00 0.00 179.45 180.76 1dj8 n LYS 11 N -2.36 2.48 -2.08 3.15 4.81 -1.26 -4.91 118.16 117.99 1dj8 n LYS 11 Ca 0.05 0.87 -0.41 0.00 -0.87 0.00 0.00 58.31 57.96 1dj8 n LYS 11 Cb 0.44 -2.57 -0.02 0.00 0.02 0.00 0.00 35.03 32.90 1dj8 n LYS 11 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1dj8 s PRO 12 N -1.51 4.31 0.29 1.64 0.02 -1.26 -4.90 135.00 133.58 1dj8 s PRO 12 Ca 0.58 2.24 0.03 0.00 0.02 0.00 0.00 61.00 63.87 1dj8 s PRO 12 Cb -0.52 -3.11 0.71 0.00 0.02 0.00 0.00 34.50 31.60 1dj8 s PRO 12 CO 0.59 -0.32 1.70 0.28 -0.33 0.00 0.00 177.00 178.91 1dj8 h VAL 13 N 3.41 0.49 0.00 3.83 2.07 -1.95 0.55 116.25 124.66 1dj8 h VAL 13 Ca -0.47 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1dj8 h VAL 13 Cb 1.22 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1dj8 h VAL 13 CO 0.74 0.08 0.02 0.59 0.02 0.00 0.00 177.57 179.02 1dj8 n ASN 14 N -5.03 0.22 -0.51 0.57 4.13 -1.26 -1.10 115.26 112.27 1dj8 n ASN 14 Ca 0.22 0.59 0.09 0.00 1.68 0.00 0.00 54.58 57.15 1dj8 n ASN 14 Cb 0.64 -0.61 0.03 0.00 -1.54 0.00 0.00 39.78 38.29 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 2.00 -4.76 6.41 7.64 0.19 -4.89 113.62 118.42 1dj8 n SER 15 Ca -0.01 -1.50 -0.36 0.00 1.01 0.00 0.00 58.87 58.02 1dj8 n SER 15 Cb 0.04 0.30 0.02 0.00 -1.01 0.00 0.00 64.21 63.56 1dj8 n SER 15 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1dj8 s TRP 16 N -1.83 2.48 0.39 1.43 0.52 -0.26 -4.95 118.94 116.73 1dj8 s TRP 16 Ca 0.17 1.52 0.08 0.00 0.02 0.00 0.00 56.10 57.88 1dj8 s TRP 16 Cb 0.14 -3.43 -0.02 0.00 -1.15 0.00 0.00 33.47 29.01 1dj8 s TRP 16 CO 0.36 -2.03 0.35 0.95 0.02 0.00 0.00 176.95 176.60 1dj8 s THR 17 N -1.63 2.88 0.40 2.01 -4.23 -1.26 -1.62 115.64 112.18 1dj8 s THR 17 Ca 0.76 -1.36 0.11 0.00 -1.18 0.00 0.00 61.69 60.01 1dj8 s THR 17 Cb -0.29 -3.04 0.33 0.00 1.34 0.00 0.00 72.50 70.84 1dj8 s THR 17 CO 0.32 -0.05 1.93 0.00 -0.54 0.00 0.00 174.62 176.28 1dj8 h GLU 19 N 0.56 0.08 -0.04 0.00 4.57 -1.62 0.08 114.58 118.21 1dj8 h GLU 19 Ca 0.35 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.50 1dj8 h GLU 19 Cb 0.61 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.18 1dj8 h GLU 19 CO -0.13 0.13 -0.05 -0.44 -1.18 0.00 0.00 179.01 177.34 1dj8 h ASP 20 N 0.09 0.12 -0.76 1.04 3.32 -1.15 -3.17 116.42 115.90 1dj8 h ASP 20 Ca 0.02 -0.51 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 1dj8 h ASP 20 Cb 0.12 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1dj8 h ASP 20 CO 0.01 0.61 0.28 0.15 -1.72 0.00 0.00 179.24 178.56 1dj8 h PHE 21 N -0.36 1.19 0.00 4.55 3.57 -1.09 -2.10 116.94 122.70 1dj8 h PHE 21 Ca 0.01 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.40 1dj8 h PHE 21 Cb 0.57 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 1dj8 h PHE 21 CO 0.10 0.91 -0.02 -0.07 -2.23 0.00 0.00 178.31 177.00 1dj8 h LEU 22 N 1.13 0.00 0.00 0.59 3.38 -1.04 -1.31 115.31 118.05 1dj8 h LEU 22 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1dj8 h LEU 22 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1dj8 h LEU 22 CO -0.02 0.02 -0.20 0.00 0.09 0.00 0.00 178.44 178.33 1dj8 n ALA 23 N -2.18 2.60 -1.83 1.53 0.00 -0.79 -4.84 120.51 115.01 1dj8 n ALA 23 Ca -0.02 -0.14 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 1dj8 n ALA 23 Cb 0.13 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.18 1dj8 n ALA 23 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1dj8 s VAL 24 N -3.07 3.58 0.58 0.00 1.01 -0.50 -4.99 120.40 117.02 1dj8 s VAL 24 Ca 0.11 1.54 -0.20 0.00 0.00 0.00 0.00 61.98 63.43 1dj8 s VAL 24 Cb 0.15 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1dj8 s VAL 24 CO 0.62 0.34 1.25 -0.62 0.00 0.00 0.00 175.10 176.69 1dj8 s ASP 25 N -0.70 5.19 0.26 3.32 2.15 -1.26 -4.77 116.67 120.86 1dj8 s ASP 25 Ca 0.46 2.50 -0.08 0.00 0.43 0.00 0.00 52.55 55.86 1dj8 s ASP 25 Cb -0.31 -2.61 0.44 0.00 -0.30 0.00 0.00 42.92 40.14 1dj8 s ASP 25 CO 0.39 -1.60 1.59 -0.33 -0.17 0.00 0.00 175.17 175.05 1dj8 h GLU 26 N 1.05 0.02 -0.46 4.34 5.08 -1.95 -1.25 114.58 121.42 1dj8 h GLU 26 Ca -0.51 -0.00 0.13 0.00 -1.00 0.00 0.00 59.36 57.99 1dj8 h GLU 26 Cb 1.30 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 1dj8 h GLU 26 CO 0.56 0.02 0.38 0.66 -1.00 0.00 0.00 179.01 179.62 1dj8 h SER 27 N 0.02 0.00 -0.10 1.42 4.64 -2.04 -2.56 113.55 114.93 1dj8 h SER 27 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1dj8 h SER 27 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1dj8 h SER 27 CO -0.84 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 175.61 1dj8 n PHE 28 N -4.10 0.12 -0.04 4.77 3.01 -0.49 -4.62 117.46 116.12 1dj8 n PHE 28 Ca 0.08 -0.11 -0.11 0.00 1.01 0.00 0.00 57.45 58.32 1dj8 n PHE 28 Cb 0.58 -0.01 -0.05 0.00 -0.01 0.00 0.00 39.48 40.00 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 2.53 0.23 0.00 -1.08 4.20 -1.27 -0.98 115.11 118.74 1dj8 h GLN 29 Ca 0.00 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1dj8 h GLN 29 Cb 0.60 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.33 1dj8 h GLN 29 CO 0.00 0.27 -0.06 -1.00 -0.67 0.00 0.00 178.83 177.37 1dj8 h PRO 30 N 0.13 0.00 -0.25 1.46 0.13 -1.82 0.01 132.00 131.66 1dj8 h PRO 30 Ca 0.06 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.01 1dj8 h PRO 30 Cb 0.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.24 1dj8 h PRO 30 CO -0.01 0.06 -0.54 1.15 -0.23 0.00 0.00 178.00 178.44 1dj8 h THR 31 N 0.00 1.29 -0.60 1.56 2.02 -1.74 -0.99 112.91 114.45 1dj8 h THR 31 Ca -0.00 -1.75 -0.01 0.00 0.77 0.00 0.00 66.41 65.42 1dj8 h THR 31 Cb 0.12 1.67 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 1dj8 h THR 31 CO 0.01 0.56 0.32 0.00 0.37 0.00 0.00 175.52 176.78 1dj8 h ALA 32 N 0.80 0.77 -0.51 6.16 0.00 -0.13 -1.06 119.26 125.29 1dj8 h ALA 32 Ca 0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1dj8 h ALA 32 Cb 1.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1dj8 h ALA 32 CO 0.11 0.30 0.22 0.28 0.00 0.00 0.00 179.25 180.17 1dj8 h VAL 33 N 0.82 1.21 -0.31 0.00 2.07 -0.89 -1.53 116.25 117.62 1dj8 h VAL 33 Ca 0.21 -0.63 -0.08 0.00 0.82 0.00 0.00 66.70 67.03 1dj8 h VAL 33 Cb 0.07 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1dj8 h VAL 33 CO -0.03 0.24 -0.13 1.23 0.02 0.00 0.00 177.57 178.90 1dj8 h GLY 34 N 0.69 0.58 0.81 2.17 0.00 -0.98 -2.18 103.07 104.15 1dj8 h GLY 34 Ca 0.17 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 1dj8 h GLY 34 CO -0.02 0.38 0.02 -2.75 0.00 0.00 0.00 176.54 174.17 1dj8 h PHE 35 N 0.49 0.23 -0.60 5.60 3.57 -0.96 -0.76 116.94 124.51 1dj8 h PHE 35 Ca 0.09 -0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.64 1dj8 h PHE 35 Cb 0.51 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1dj8 h PHE 35 CO 0.02 0.40 0.40 0.00 -2.23 0.00 0.00 178.31 176.90 1dj8 h ALA 36 N 0.81 1.89 -0.01 2.41 0.00 -1.09 -1.39 119.26 121.88 1dj8 h ALA 36 Ca 0.04 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 1dj8 h ALA 36 Cb 0.29 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 17.98 1dj8 h ALA 36 CO 0.00 -0.01 -1.03 0.93 0.00 0.00 0.00 179.25 179.14 1dj8 h GLU 37 N 0.52 0.70 -0.35 0.00 5.08 -1.02 -3.20 114.58 116.30 1dj8 h GLU 37 Ca 0.27 -0.75 -0.07 0.00 -1.00 0.00 0.00 59.36 57.81 1dj8 h GLU 37 Cb 0.39 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1dj8 h GLU 37 CO -0.08 1.32 -0.09 0.00 -1.00 0.00 0.00 179.01 179.16 1dj8 h ALA 38 N 0.42 1.19 0.00 3.43 0.00 -0.63 -2.64 119.26 121.03 1dj8 h ALA 38 Ca -0.13 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1dj8 h ALA 38 Cb 1.68 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.32 1dj8 h ALA 38 CO 0.20 0.52 -0.01 -0.07 0.00 0.00 0.00 179.25 179.90 1dj8 h LEU 39 N 0.55 0.00 -2.25 0.00 4.07 -1.28 -0.91 115.31 115.50 1dj8 h LEU 39 Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 1dj8 h LEU 39 Cb 0.49 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1dj8 h LEU 39 CO 0.03 0.01 0.00 0.59 -1.08 0.00 0.00 178.44 177.99 1dj8 n ASN 40 N -4.31 3.38 0.00 -0.43 5.03 -1.00 -4.04 115.26 113.89 1dj8 n ASN 40 Ca -0.03 -2.33 0.00 0.00 0.87 0.00 0.00 54.58 53.09 1dj8 n ASN 40 Cb 0.10 -0.48 0.00 0.00 -1.02 0.00 0.00 39.78 38.37 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 0.64 1.13 -4.26 6.41 3.02 -0.35 -4.96 115.26 116.89 1dj8 n ASN 41 Ca 0.17 -1.47 -0.44 0.00 -0.03 0.00 0.00 54.58 52.81 1dj8 n ASN 41 Cb 0.65 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.83 1dj8 n ASN 41 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1dj8 n LYS 42 N -0.23 3.64 0.00 3.52 2.85 -1.22 -2.95 118.16 123.77 1dj8 n LYS 42 Ca 0.00 -4.10 0.00 0.00 -1.05 0.00 0.00 58.31 53.16 1dj8 n LYS 42 Cb 0.26 -2.79 0.00 0.00 -0.65 0.00 0.00 35.03 31.86 1dj8 n LYS 42 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1dj8 n ASP 43 N 3.74 0.00 -2.56 -5.58 8.00 -1.26 -4.87 116.55 114.02 1dj8 n ASP 43 Ca 0.32 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.64 1dj8 n ASP 43 Cb 0.39 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.51 1dj8 n ASP 43 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1dj8 n LYS 44 N -0.86 2.28 -0.08 -1.24 2.85 -1.20 -4.95 118.16 114.95 1dj8 n LYS 44 Ca 0.00 -3.86 0.22 0.00 -1.05 0.00 0.00 58.31 53.62 1dj8 n LYS 44 Cb 0.00 -1.74 0.67 0.00 -0.65 0.00 0.00 35.03 33.30 1dj8 n LYS 44 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 1dj8 h PRO 45 N 2.77 0.07 0.00 -1.58 0.13 -1.87 -1.68 132.00 129.84 1dj8 h PRO 45 Ca 0.10 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1dj8 h PRO 45 Cb 1.07 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1dj8 h PRO 45 CO 0.66 0.05 0.00 -0.85 -0.23 0.00 0.00 178.00 177.63 1dj8 n GLU 46 N -4.37 0.07 0.00 0.86 0.00 -1.26 -2.01 120.64 113.93 1dj8 n GLU 46 Ca 0.13 0.26 0.03 0.00 0.00 0.00 0.00 57.16 57.58 1dj8 n GLU 46 Cb 0.71 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.66 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 -1.40 1.20 -4.67 -1.84 8.00 -0.63 -5.01 116.55 112.20 1dj8 n ASP 47 Ca 0.04 -1.10 -0.42 0.00 0.71 0.00 0.00 54.79 54.02 1dj8 n ASP 47 Cb 0.11 0.21 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 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 -0.67 3.63 -0.21 2.24 0.00 -0.85 -5.00 121.76 120.90 1dj8 s ALA 48 Ca 0.05 0.98 -0.09 0.00 0.00 0.00 0.00 51.96 52.90 1dj8 s ALA 48 Cb 0.04 -3.73 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 1dj8 s ALA 48 CO 0.10 -1.31 0.11 0.08 0.00 0.00 0.00 175.76 174.73 1dj8 s VAL 49 N 3.68 5.11 -0.42 0.00 1.01 -1.26 -5.06 120.40 123.47 1dj8 s VAL 49 Ca 0.73 0.09 -0.19 0.00 0.00 0.00 0.00 61.98 62.60 1dj8 s VAL 49 Cb -0.34 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 32.72 1dj8 s VAL 49 CO 0.30 0.42 0.56 -0.22 0.00 0.00 0.00 175.10 176.15 1dj8 s LEU 50 N 0.60 4.61 -0.51 3.92 2.96 -1.26 -5.00 118.68 124.00 1dj8 s LEU 50 Ca 0.06 -0.42 -0.08 0.00 -0.22 0.00 0.00 54.13 53.46 1dj8 s LEU 50 Cb -0.12 -2.59 0.13 0.00 0.50 0.00 0.00 46.19 44.11 1dj8 s LEU 50 CO 0.01 -0.67 0.38 -0.62 -1.32 0.00 0.00 176.35 174.12 1dj8 s ASP 51 N 1.91 5.70 0.33 3.68 3.68 -1.26 -4.94 116.67 125.76 1dj8 s ASP 51 Ca 0.18 -2.09 0.03 0.00 2.13 0.00 0.00 52.55 52.80 1dj8 s ASP 51 Cb -0.15 -2.00 0.57 0.00 -1.45 0.00 0.00 42.92 39.89 1dj8 s ASP 51 CO 0.16 -0.64 1.89 0.58 0.13 0.00 0.00 175.17 177.30 1dj8 h VAL 52 N 5.95 1.19 -0.19 1.11 2.07 -1.99 -0.09 116.25 124.30 1dj8 h VAL 52 Ca -0.16 -0.69 -0.17 0.00 0.82 0.00 0.00 66.70 66.50 1dj8 h VAL 52 Cb 1.05 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1dj8 h VAL 52 CO 0.82 0.25 -0.59 -0.61 0.02 0.00 0.00 177.57 177.47 1dj8 h GLN 53 N 0.64 0.61 -0.47 1.57 4.15 -1.99 -2.29 115.11 117.33 1dj8 h GLN 53 Ca 0.15 -0.41 -0.11 0.00 0.77 0.00 0.00 58.65 59.06 1dj8 h GLN 53 Cb 0.24 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 1dj8 h GLN 53 CO -0.00 1.02 -0.12 0.78 -1.93 0.00 0.00 178.83 178.58 1dj8 h GLY 54 N 0.99 0.98 1.13 2.39 0.00 -1.84 -1.17 103.07 105.56 1dj8 h GLY 54 Ca -0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.44 1dj8 h GLY 54 CO 0.11 0.75 0.12 -2.22 0.00 0.00 0.00 176.54 175.30 1dj8 h ILE 55 N 0.75 1.26 -0.05 2.60 2.04 -0.94 -1.39 117.51 121.78 1dj8 h ILE 55 Ca 0.12 -1.00 -0.12 0.00 1.00 0.00 0.00 64.86 64.86 1dj8 h ILE 55 Cb 0.67 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1dj8 h ILE 55 CO 0.05 0.38 -0.52 0.00 0.00 0.00 0.00 178.15 178.06 1dj8 h ALA 56 N 1.12 1.04 0.01 1.87 0.00 -1.24 -1.78 119.26 120.28 1dj8 h ALA 56 Ca 0.20 -0.48 -0.20 0.00 0.00 0.00 0.00 54.91 54.44 1dj8 h ALA 56 Cb 0.41 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1dj8 h ALA 56 CO 0.01 0.66 -0.89 1.15 0.00 0.00 0.00 179.25 180.18 1dj8 h THR 57 N 0.11 1.53 0.00 0.00 2.02 -0.91 -3.32 112.91 112.34 1dj8 h THR 57 Ca 0.00 -2.74 -0.15 0.00 0.77 0.00 0.00 66.41 64.29 1dj8 h THR 57 Cb 0.95 2.53 -0.02 0.00 -1.74 0.00 0.00 68.15 69.87 1dj8 h THR 57 CO 0.07 0.79 -1.09 1.62 0.37 0.00 0.00 175.52 177.29 1dj8 h VAL 58 N 0.07 0.68 0.12 3.16 3.04 -1.17 -3.38 116.25 118.78 1dj8 h VAL 58 Ca -0.04 -2.14 0.02 0.00 -1.01 0.00 0.00 66.70 63.53 1dj8 h VAL 58 Cb 1.53 2.21 -0.03 0.00 -2.01 0.00 0.00 31.29 32.98 1dj8 h VAL 58 CO 0.13 0.39 -0.28 0.74 -1.01 0.00 0.00 177.57 177.54 1dj8 h THR 59 N 0.00 0.39 0.00 3.17 2.02 -1.42 0.49 112.91 117.57 1dj8 h THR 59 Ca -0.10 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 1dj8 h THR 59 Cb 1.53 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 1dj8 h THR 59 CO 0.06 0.00 -0.21 1.55 0.37 0.00 0.00 175.52 177.29 1dj8 h PRO 60 N -0.49 0.00 -0.53 6.66 0.13 -1.76 -0.29 132.00 135.72 1dj8 h PRO 60 Ca 0.03 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.07 1dj8 h PRO 60 Cb 0.52 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.63 1dj8 h PRO 60 CO -0.16 0.21 -0.00 0.00 -0.23 0.00 0.00 178.00 177.81 1dj8 h ALA 61 N 1.79 0.72 -0.44 -0.56 0.00 -1.57 -1.94 119.26 117.26 1dj8 h ALA 61 Ca -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1dj8 h ALA 61 Cb 0.45 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1dj8 h ALA 61 CO 0.03 0.54 0.02 0.82 0.00 0.00 0.00 179.25 180.65 1dj8 h ILE 62 N 0.81 1.26 -0.39 0.00 2.04 -0.18 -0.90 117.51 120.16 1dj8 h ILE 62 Ca 0.15 -1.00 0.06 0.00 1.00 0.00 0.00 64.86 65.07 1dj8 h ILE 62 Cb 0.54 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.61 1dj8 h ILE 62 CO 0.03 0.34 0.08 0.58 0.00 0.00 0.00 178.15 179.18 1dj8 h VAL 63 N 0.60 0.80 -0.29 1.67 2.07 -0.87 -0.06 116.25 120.18 1dj8 h VAL 63 Ca 0.13 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.51 1dj8 h VAL 63 Cb 0.46 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1dj8 h VAL 63 CO 0.02 0.04 -0.08 -0.61 0.02 0.00 0.00 177.57 176.96 1dj8 h GLN 64 N 0.21 0.57 -0.42 1.57 4.15 -1.27 -2.29 115.11 117.62 1dj8 h GLN 64 Ca 0.19 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1dj8 h GLN 64 Cb 0.22 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.86 1dj8 h GLN 64 CO -0.24 0.77 0.24 0.00 -1.93 0.00 0.00 178.83 177.67 1dj8 h ALA 65 N 0.78 1.63 -0.34 3.38 0.00 -0.88 -2.55 119.26 121.28 1dj8 h ALA 65 Ca 0.07 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1dj8 h ALA 65 Cb 0.56 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1dj8 h ALA 65 CO 0.03 0.32 -0.35 0.00 0.00 0.00 0.00 179.25 179.25 1dj8 h THR 67 N 0.65 0.32 -0.09 0.00 1.35 -0.99 -1.70 112.91 112.46 1dj8 h THR 67 Ca 0.06 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 1dj8 h THR 67 Cb 0.90 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1dj8 h THR 67 CO 0.08 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.41 1dj8 n GLN 68 N -3.41 1.78 -2.74 4.72 6.02 -1.05 -4.48 117.38 118.22 1dj8 n GLN 68 Ca -0.02 -1.15 -0.09 0.00 -0.01 0.00 0.00 57.00 55.74 1dj8 n GLN 68 Cb 0.21 -1.45 0.07 0.00 1.02 0.00 0.00 30.24 30.09 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 0.38 -2.55 0.11 1.08 4.64 -0.67 -5.03 116.55 114.51 1dj8 n ASP 69 Ca 0.18 -3.56 0.18 0.00 -1.38 0.00 0.00 54.79 50.21 1dj8 n ASP 69 Cb 0.38 1.90 0.74 0.00 -1.04 0.00 0.00 41.12 43.09 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 3.38 0.00 -0.01 -0.67 1.57 -1.71 -2.34 116.57 116.79 1dj8 h LYS 70 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1dj8 h LYS 70 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 1dj8 h LYS 70 CO 0.21 0.00 -0.20 1.04 -0.57 0.00 0.00 179.45 179.93 1dj8 n GLN 71 N -4.13 0.76 -1.45 3.15 1.13 -1.26 -1.77 117.38 113.82 1dj8 n GLN 71 Ca 0.05 -0.38 -0.32 0.00 -1.94 0.00 0.00 57.00 54.41 1dj8 n GLN 71 Cb 0.46 -1.49 0.07 0.00 0.11 0.00 0.00 30.24 29.39 1dj8 n GLN 71 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1dj8 s ALA 72 N -2.50 2.34 -0.07 -1.58 0.00 -0.88 -4.75 121.76 114.31 1dj8 s ALA 72 Ca 0.26 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 52.29 1dj8 s ALA 72 Cb 0.20 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 1dj8 s ALA 72 CO 0.50 -1.58 1.39 1.21 0.00 0.00 0.00 175.76 177.28 1dj8 s ASN 73 N -3.09 6.86 0.15 0.00 2.47 -1.26 -0.44 114.94 119.63 1dj8 s ASN 73 Ca 0.63 1.96 -0.25 0.00 0.42 0.00 0.00 52.86 55.63 1dj8 s ASN 73 Cb -0.18 -2.55 0.01 0.00 -1.45 0.00 0.00 41.25 37.08 1dj8 s ASN 73 CO 0.51 -0.77 1.60 0.15 -3.72 0.00 0.00 177.10 174.87 1dj8 h PHE 74 N 8.30 -0.95 -1.01 0.43 3.57 -1.51 -2.13 116.94 123.65 1dj8 h PHE 74 Ca -0.34 0.05 0.22 0.00 3.53 0.00 0.00 57.97 61.43 1dj8 h PHE 74 Cb 1.15 0.45 -0.11 0.00 2.79 0.00 0.00 35.95 40.23 1dj8 h PHE 74 CO 0.80 -0.40 0.61 -0.22 -2.23 0.00 0.00 178.31 176.86 1dj8 h LYS 75 N -0.34 0.63 0.00 1.11 3.64 -1.84 -0.14 116.57 119.63 1dj8 h LYS 75 Ca 0.13 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.34 1dj8 h LYS 75 Cb 0.55 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1dj8 h LYS 75 CO -0.45 0.42 -0.64 -0.44 -2.27 0.00 0.00 179.45 176.06 1dj8 h ASP 76 N 0.65 0.00 0.07 4.20 3.32 -1.78 -2.59 116.42 120.29 1dj8 h ASP 76 Ca 0.61 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.50 1dj8 h ASP 76 Cb 1.10 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 1dj8 h ASP 76 CO -0.42 0.64 -0.58 0.11 -1.72 0.00 0.00 179.24 177.27 1dj8 h LYS 77 N 0.00 0.53 -0.02 3.56 1.79 -0.78 -1.23 116.57 120.41 1dj8 h LYS 77 Ca -0.01 -0.35 0.02 0.00 -2.18 0.00 0.00 60.65 58.14 1dj8 h LYS 77 Cb 1.15 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.82 1dj8 h LYS 77 CO 0.08 0.96 -0.09 0.28 -1.08 0.00 0.00 179.45 179.60 1dj8 h VAL 78 N 0.40 0.75 -0.12 0.50 2.07 -1.09 0.12 116.25 118.88 1dj8 h VAL 78 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1dj8 h VAL 78 Cb 1.13 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1dj8 h VAL 78 CO 0.11 0.00 0.07 0.50 0.02 0.00 0.00 177.57 178.27 1dj8 h LYS 79 N -0.15 0.17 -0.52 1.57 3.64 -1.35 -0.30 116.57 119.63 1dj8 h LYS 79 Ca 0.04 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 1dj8 h LYS 79 Cb 0.21 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1dj8 h LYS 79 CO -0.11 0.17 -0.02 0.78 -2.27 0.00 0.00 179.45 178.00 1dj8 h GLY 80 N 0.12 0.96 1.39 5.01 0.00 -1.11 -1.00 103.07 108.44 1dj8 h GLY 80 Ca 0.04 -0.68 -0.18 0.00 0.00 0.00 0.00 47.33 46.52 1dj8 h GLY 80 CO -0.01 0.63 -0.62 0.83 0.00 0.00 0.00 176.54 177.37 1dj8 h GLU 81 N 0.82 0.63 -0.45 4.80 4.39 -0.68 -1.86 114.58 122.22 1dj8 h GLU 81 Ca 0.15 -0.43 -0.09 0.00 0.34 0.00 0.00 59.36 59.33 1dj8 h GLU 81 Cb 0.52 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 1dj8 h GLU 81 CO 0.03 1.05 -0.07 2.35 -1.16 0.00 0.00 179.01 181.21 1dj8 h TRP 82 N 0.46 0.85 0.13 4.33 2.91 -0.78 -2.06 115.95 121.79 1dj8 h TRP 82 Ca -0.01 -0.14 -0.01 0.00 1.13 0.00 0.00 58.89 59.87 1dj8 h TRP 82 Cb 1.19 -0.22 0.00 0.00 -0.51 0.00 0.00 29.16 29.62 1dj8 h TRP 82 CO 0.06 0.82 -0.06 -0.44 -1.03 0.00 0.00 178.44 177.79 1dj8 h ASP 83 N 0.72 -0.15 -0.86 2.65 3.32 -1.09 -0.68 116.42 120.33 1dj8 h ASP 83 Ca 0.13 -0.30 0.12 0.00 0.02 0.00 0.00 57.03 57.00 1dj8 h ASP 83 Cb 0.54 0.04 -0.08 0.00 0.22 0.00 0.00 39.33 40.04 1dj8 h ASP 83 CO 0.03 0.24 0.48 0.50 -1.72 0.00 0.00 179.24 178.77 1dj8 h LYS 84 N -0.55 0.72 0.00 3.56 3.64 -1.27 -1.59 116.57 121.08 1dj8 h LYS 84 Ca -0.02 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.25 1dj8 h LYS 84 Cb 0.43 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1dj8 h LYS 84 CO 0.03 0.48 -0.77 0.82 -2.27 0.00 0.00 179.45 177.74 1dj8 h ILE 85 N 0.74 0.34 0.00 2.00 2.04 -1.39 -3.38 117.51 117.86 1dj8 h ILE 85 Ca 0.44 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1dj8 h ILE 85 Cb 0.52 1.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1dj8 h ILE 85 CO -0.30 0.19 -0.07 0.50 0.00 0.00 0.00 178.15 178.47 1dj8 h LYS 86 N 0.00 0.00 0.00 2.37 3.64 -0.76 -3.51 116.57 118.31 1dj8 h LYS 86 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1dj8 h LYS 86 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1dj8 h LYS 86 CO 0.03 0.00 0.00 1.63 -2.27 0.00 0.00 179.45 178.84