#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss1 n SER 0 N 0.00 0.00 -4.34 1.61 3.41 -1.26 -5.01 113.62 108.03 1ss1 n SER 0 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.29 1ss1 n SER 0 Cb 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.80 1ss1 n SER 0 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ss1 s THR 1 N 0.18 2.61 -0.75 6.66 -1.32 -1.26 -5.04 115.64 116.71 1ss1 s THR 1 Ca 0.00 -0.84 -0.25 0.00 -1.21 0.00 0.00 61.69 59.39 1ss1 s THR 1 Cb 0.00 -2.03 -0.16 0.00 -1.51 0.00 0.00 72.50 68.80 1ss1 s THR 1 CO 0.00 0.55 2.45 0.00 -2.21 0.00 0.00 174.62 175.41 1ss1 n ALA 2 N 3.16 0.61 0.00 11.08 0.00 -1.26 -4.38 120.51 129.72 1ss1 n ALA 2 Ca -0.18 -0.88 0.00 0.00 0.00 0.00 0.00 53.44 52.38 1ss1 n ALA 2 Cb 0.52 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.07 1ss1 n ALA 2 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ss1 n ASP 3 N 13.91 0.00 0.00 0.00 2.03 -1.26 -4.75 116.55 126.48 1ss1 n ASP 3 Ca 0.50 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.81 1ss1 n ASP 3 Cb 0.34 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.74 1ss1 n ASP 3 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1ss1 n ASN 4 N 0.00 0.00 -2.83 1.67 5.15 -1.26 -4.68 115.26 113.30 1ss1 n ASN 4 Ca 0.00 0.00 -0.09 0.00 -0.60 0.00 0.00 54.58 53.89 1ss1 n ASN 4 Cb 0.00 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 39.26 1ss1 n ASN 4 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1ss1 n LYS 5 N 0.00 0.64 -1.44 1.20 4.81 -1.26 -5.06 118.16 117.05 1ss1 n LYS 5 Ca 0.00 -2.07 -0.43 0.00 -0.87 0.00 0.00 58.31 54.95 1ss1 n LYS 5 Cb 0.00 -1.46 -0.03 0.00 0.02 0.00 0.00 35.03 33.56 1ss1 n LYS 5 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1ss1 n PHE 6 N 2.22 2.70 0.00 5.64 3.72 -1.26 -4.79 117.46 125.70 1ss1 n PHE 6 Ca 0.15 -2.40 0.00 0.00 -0.05 0.00 0.00 57.45 55.15 1ss1 n PHE 6 Cb 0.58 -2.13 0.00 0.00 -0.94 0.00 0.00 39.48 36.99 1ss1 n PHE 6 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1ss1 n ASN 7 N 6.77 0.00 -0.02 4.37 0.23 -1.26 -3.01 115.26 122.34 1ss1 n ASN 7 Ca 0.51 0.00 -0.01 0.00 -0.53 0.00 0.00 54.58 54.55 1ss1 n ASN 7 Cb 0.40 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1ss1 n ASN 7 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1ss1 h LYS 8 N 0.00 -0.06 0.02 -3.83 6.56 -1.98 -3.24 116.57 114.03 1ss1 h LYS 8 Ca 0.00 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1ss1 h LYS 8 Cb 0.00 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 1ss1 h LYS 8 CO 0.00 -0.04 -0.01 0.93 -2.06 0.00 0.00 179.45 178.27 1ss1 h GLU 9 N -0.97 -0.03 0.05 3.15 3.07 -1.93 -3.13 114.58 114.80 1ss1 h GLU 9 Ca -0.01 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.69 1ss1 h GLU 9 Cb 0.05 0.01 0.02 0.00 -0.84 0.00 0.00 28.75 27.98 1ss1 h GLU 9 CO 0.01 0.31 -0.67 1.96 -1.40 0.00 0.00 179.01 179.23 1ss1 h GLN 10 N -0.38 0.36 -0.85 2.33 4.20 -1.85 -3.32 115.11 115.60 1ss1 h GLN 10 Ca -0.00 -0.46 0.10 0.00 0.06 0.00 0.00 58.65 58.35 1ss1 h GLN 10 Cb 0.36 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 28.22 1ss1 h GLN 10 CO 0.01 1.15 0.55 0.37 -0.67 0.00 0.00 178.83 180.24 1ss1 h GLN 11 N -0.23 0.78 -0.92 1.46 4.15 -1.56 -0.82 115.11 117.97 1ss1 h GLN 11 Ca -0.10 -0.05 0.20 0.00 0.77 0.00 0.00 58.65 59.48 1ss1 h GLN 11 Cb 1.43 -0.18 -0.07 0.00 0.21 0.00 0.00 27.48 28.87 1ss1 h GLN 11 CO 0.13 0.51 0.60 -0.97 -1.93 0.00 0.00 178.83 177.18 1ss1 h ASN 12 N 0.80 0.45 -0.46 -0.69 -0.00 -1.64 0.13 115.58 114.16 1ss1 h ASN 12 Ca 0.39 0.05 0.05 0.00 -0.00 0.00 0.00 56.30 56.79 1ss1 h ASN 12 Cb 0.45 -0.03 -0.04 0.00 -0.00 0.00 0.00 38.32 38.69 1ss1 h ASN 12 CO -0.16 0.17 0.21 0.00 -0.00 0.00 0.00 177.43 177.65 1ss1 h ALA 13 N 1.61 0.58 0.36 1.57 0.00 -1.30 -1.56 119.26 120.52 1ss1 h ALA 13 Ca 0.49 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.43 1ss1 h ALA 13 Cb 1.16 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1ss1 h ALA 13 CO -0.20 -0.15 -0.37 0.35 0.00 0.00 0.00 179.25 178.88 1ss1 h PHE 14 N 0.42 -1.00 -0.55 0.00 3.57 -0.83 0.45 116.94 118.99 1ss1 h PHE 14 Ca 0.21 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 1ss1 h PHE 14 Cb 0.15 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1ss1 h PHE 14 CO -0.12 -0.51 0.16 -1.49 -2.23 0.00 0.00 178.31 174.12 1ss1 h TRP 15 N -0.75 0.90 0.25 0.41 4.06 -1.47 0.22 115.95 119.57 1ss1 h TRP 15 Ca -0.02 -0.10 -0.01 0.00 2.06 0.00 0.00 58.89 60.82 1ss1 h TRP 15 Cb 0.68 -0.26 0.00 0.00 -1.00 0.00 0.00 29.16 28.58 1ss1 h TRP 15 CO -0.21 0.77 -0.12 1.49 -3.56 0.00 0.00 178.44 176.81 1ss1 h GLU 16 N 0.78 -0.32 -0.65 0.49 4.22 -1.21 -1.87 114.58 116.01 1ss1 h GLU 16 Ca 0.18 0.02 0.12 0.00 0.08 0.00 0.00 59.36 59.76 1ss1 h GLU 16 Cb 0.30 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.53 1ss1 h GLU 16 CO -0.00 0.02 0.19 0.82 -2.18 0.00 0.00 179.01 177.85 1ss1 h ILE 17 N -0.72 0.65 0.33 2.32 2.04 -0.07 -0.85 117.51 121.21 1ss1 h ILE 17 Ca -0.03 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1ss1 h ILE 17 Cb 0.49 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1ss1 h ILE 17 CO 0.06 0.06 -0.18 -0.07 0.00 0.00 0.00 178.15 178.02 1ss1 h LEU 18 N 0.32 -0.43 0.05 1.44 4.07 -0.50 -3.13 115.31 117.14 1ss1 h LEU 18 Ca 0.35 0.02 0.01 0.00 0.08 0.00 0.00 57.88 58.34 1ss1 h LEU 18 Cb 0.52 0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.36 1ss1 h LEU 18 CO -0.40 -0.29 -0.11 0.45 -1.08 0.00 0.00 178.44 177.01 1ss1 h HIS 19 N -0.47 -0.27 -1.42 1.13 3.86 -0.95 -3.44 115.15 113.59 1ss1 h HIS 19 Ca -0.04 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1ss1 h HIS 19 Cb 0.37 0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1ss1 h HIS 19 CO -0.07 -0.16 0.00 1.28 0.86 0.00 0.00 177.93 179.84 1ss1 n LEU 20 N -5.23 0.00 -4.55 2.43 4.77 -0.36 -4.66 117.00 109.40 1ss1 n LEU 20 Ca -0.06 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.63 1ss1 n LEU 20 Cb 0.15 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1ss1 n LEU 20 CO 0.29 0.00 1.57 -2.84 -1.33 0.00 0.00 177.39 175.08 1ss1 s PRO 21 N -0.78 2.15 0.00 3.23 0.02 -1.26 -1.19 135.00 137.17 1ss1 s PRO 21 Ca 0.00 0.64 0.00 0.00 0.02 0.00 0.00 61.00 61.66 1ss1 s PRO 21 Cb 0.00 -4.70 0.00 0.00 0.02 0.00 0.00 34.50 29.82 1ss1 s PRO 21 CO 0.00 -3.53 0.00 0.27 -0.33 0.00 0.00 177.00 173.41 1ss1 n ASN 22 N 15.71 0.00 -4.70 2.53 0.23 -1.26 -4.84 115.26 122.93 1ss1 n ASN 22 Ca 0.37 0.00 -0.33 0.00 -0.53 0.00 0.00 54.58 54.09 1ss1 n ASN 22 Cb 0.49 0.00 -0.09 0.00 -2.08 0.00 0.00 39.78 38.11 1ss1 n ASN 22 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 1ss1 s LEU 23 N 0.00 3.61 -0.26 -4.53 2.96 -0.33 -4.35 118.68 115.78 1ss1 s LEU 23 Ca 0.00 0.05 -0.39 0.00 -0.22 0.00 0.00 54.13 53.57 1ss1 s LEU 23 Cb 0.00 -2.03 -0.15 0.00 0.50 0.00 0.00 46.19 44.51 1ss1 s LEU 23 CO 0.00 0.30 1.79 -3.20 -1.32 0.00 0.00 176.35 173.91 1ss1 n ASN 24 N 1.48 2.53 0.31 3.68 5.15 -1.26 -4.73 115.26 122.41 1ss1 n ASN 24 Ca -0.15 1.04 0.19 0.00 -0.60 0.00 0.00 54.58 55.06 1ss1 n ASN 24 Cb 0.53 -1.17 0.99 0.00 -0.53 0.00 0.00 39.78 39.59 1ss1 n ASN 24 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1ss1 h GLU 25 N 7.69 0.00 0.00 1.20 4.22 -1.95 0.91 114.58 126.66 1ss1 h GLU 25 Ca -0.46 0.00 -0.11 0.00 0.08 0.00 0.00 59.36 58.87 1ss1 h GLU 25 Cb 1.31 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.55 1ss1 h GLU 25 CO 0.96 0.02 -0.54 1.05 -2.18 0.00 0.00 179.01 178.33 1ss1 h GLU 26 N 0.00 0.00 -0.05 1.92 4.11 -1.99 -1.31 114.58 117.26 1ss1 h GLU 26 Ca -0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.24 1ss1 h GLU 26 Cb 0.18 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.44 1ss1 h GLU 26 CO 0.00 0.54 -0.70 1.96 0.07 0.00 0.00 179.01 180.88 1ss1 h GLN 27 N 0.00 0.57 0.28 1.06 1.08 0.28 -1.73 115.11 116.65 1ss1 h GLN 27 Ca -0.01 -0.54 0.00 0.00 -1.45 0.00 0.00 58.65 56.65 1ss1 h GLN 27 Cb 1.26 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 28.80 1ss1 h GLN 27 CO 0.07 1.17 -0.27 0.00 -0.95 0.00 0.00 178.83 178.84 1ss1 h ARG 28 N 0.18 -0.56 -0.53 1.46 3.08 -0.04 -0.02 114.38 117.93 1ss1 h ARG 28 Ca -0.07 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.10 1ss1 h ARG 28 Cb 1.37 0.13 -0.06 0.00 0.08 0.00 0.00 29.97 31.48 1ss1 h ARG 28 CO 0.14 -0.38 0.18 -0.97 -1.07 0.00 0.00 179.97 177.87 1ss1 h ASN 29 N -0.58 0.15 -0.54 7.04 -1.24 -1.29 0.16 115.58 119.28 1ss1 h ASN 29 Ca -0.01 0.07 0.05 0.00 0.71 0.00 0.00 56.30 57.12 1ss1 h ASN 29 Cb 0.54 0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.62 1ss1 h ASN 29 CO -0.06 0.11 0.36 1.23 -1.29 0.00 0.00 177.43 177.78 1ss1 h GLY 30 N 0.34 0.66 1.18 1.57 0.00 -0.83 -1.02 103.07 104.96 1ss1 h GLY 30 Ca 0.26 -0.22 -0.17 0.00 0.00 0.00 0.00 47.33 47.20 1ss1 h GLY 30 CO -0.28 0.18 -0.46 0.74 0.00 0.00 0.00 176.54 176.71 1ss1 h PHE 31 N 0.55 1.08 -0.60 5.60 0.04 0.89 -1.83 116.94 122.68 1ss1 h PHE 31 Ca 0.23 -0.35 -0.09 0.00 2.80 0.00 0.00 57.97 60.55 1ss1 h PHE 31 Cb 0.20 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.11 1ss1 h PHE 31 CO -0.00 1.17 0.02 0.82 -0.60 0.00 0.00 178.31 179.72 1ss1 h ILE 32 N 0.70 1.26 -0.05 -0.55 2.04 -0.15 -0.84 117.51 119.92 1ss1 h ILE 32 Ca 0.04 -1.11 -0.03 0.00 1.00 0.00 0.00 64.86 64.76 1ss1 h ILE 32 Cb 1.06 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 1ss1 h ILE 32 CO 0.11 0.40 -0.08 0.06 0.00 0.00 0.00 178.15 178.64 1ss1 h GLN 33 N 0.95 0.15 -0.83 2.37 3.07 -1.20 0.17 115.11 119.78 1ss1 h GLN 33 Ca 0.17 -0.09 -0.02 0.00 0.09 0.00 0.00 58.65 58.80 1ss1 h GLN 33 Cb 0.52 0.01 -0.04 0.00 0.08 0.00 0.00 27.48 28.05 1ss1 h GLN 33 CO 0.03 0.65 0.43 1.03 0.09 0.00 0.00 178.83 181.06 1ss1 h SER 34 N -0.35 1.05 -0.03 0.06 0.87 -1.33 -2.02 113.55 111.81 1ss1 h SER 34 Ca 0.00 -0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.44 1ss1 h SER 34 Cb 0.64 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1ss1 h SER 34 CO 0.02 0.86 -0.04 0.25 -0.53 0.00 0.00 176.83 177.39 1ss1 h LEU 35 N 1.17 0.10 0.37 2.23 5.85 -1.17 -2.79 115.31 121.07 1ss1 h LEU 35 Ca 0.29 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1ss1 h LEU 35 Cb 0.06 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1ss1 h LEU 35 CO -0.04 0.59 -0.52 0.11 -0.34 0.00 0.00 178.44 178.24 1ss1 h LYS 36 N -0.39 -0.89 -0.38 1.25 1.57 -0.79 -1.78 116.57 115.17 1ss1 h LYS 36 Ca 0.00 0.06 0.11 0.00 -1.87 0.00 0.00 60.65 58.95 1ss1 h LYS 36 Cb 0.56 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1ss1 h LYS 36 CO 0.01 -0.59 0.31 0.38 -0.57 0.00 0.00 179.45 178.99 1ss1 h ASP 37 N -0.92 0.00 -3.48 0.86 3.04 -1.47 -3.37 116.42 111.08 1ss1 h ASP 37 Ca -0.04 0.00 -0.57 0.00 -3.24 0.00 0.00 57.03 53.18 1ss1 h ASP 37 Cb 0.84 0.00 -0.39 0.00 -1.04 0.00 0.00 39.33 38.74 1ss1 h ASP 37 CO -0.14 0.00 -0.78 -0.62 -2.04 0.00 0.00 179.24 175.66 1ss1 s ASP 38 N -6.05 3.42 0.19 4.15 -1.08 -0.67 -5.00 116.67 111.64 1ss1 s ASP 38 Ca -0.05 -1.01 0.05 0.00 -0.52 0.00 0.00 52.55 51.02 1ss1 s ASP 38 Cb 0.18 -0.93 0.08 0.00 -1.46 0.00 0.00 42.92 40.79 1ss1 s ASP 38 CO 0.65 -0.26 1.44 1.55 0.52 0.00 0.00 175.17 179.07 1ss1 h PRO 39 N 8.08 0.14 0.00 4.34 0.13 -1.73 -2.95 132.00 140.00 1ss1 h PRO 39 Ca -0.17 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1ss1 h PRO 39 Cb 1.09 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1ss1 h PRO 39 CO 0.38 0.86 0.00 1.03 -0.23 0.00 0.00 178.00 180.04 1ss1 h SER 40 N 0.09 0.00 0.49 1.44 0.87 -1.93 -2.05 113.55 112.46 1ss1 h SER 40 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1ss1 h SER 40 Cb 1.39 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 1ss1 h SER 40 CO 0.12 0.00 -0.19 0.00 -0.53 0.00 0.00 176.83 176.22 1ss1 n GLN 41 N -2.69 0.44 -0.46 2.24 1.13 -1.12 -4.14 117.38 112.78 1ss1 n GLN 41 Ca 0.01 -0.17 0.39 0.00 -1.94 0.00 0.00 57.00 55.29 1ss1 n GLN 41 Cb 0.28 -1.50 0.72 0.00 0.11 0.00 0.00 30.24 29.85 1ss1 n GLN 41 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1ss1 h SER 42 N 0.42 0.11 0.07 1.08 4.64 -1.44 0.56 113.55 119.00 1ss1 h SER 42 Ca 0.00 0.04 -0.27 0.00 -0.47 0.00 0.00 61.79 61.10 1ss1 h SER 42 Cb 0.43 0.03 0.02 0.00 -0.31 0.00 0.00 62.40 62.58 1ss1 h SER 42 CO 0.00 -0.03 -1.08 0.00 -0.87 0.00 0.00 176.83 174.84 1ss1 h ALA 43 N 1.37 0.03 -0.23 5.18 0.00 -1.83 -1.57 119.26 122.21 1ss1 h ALA 43 Ca 0.74 -0.72 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1ss1 h ALA 43 Cb 2.68 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 20.55 1ss1 h ALA 43 CO -0.14 0.62 -0.41 -0.91 0.00 0.00 0.00 179.25 178.41 1ss1 h ASN 44 N 0.23 0.59 0.02 0.00 4.21 -0.28 -1.60 115.58 118.75 1ss1 h ASN 44 Ca -0.16 -0.27 -0.00 0.00 1.21 0.00 0.00 56.30 57.09 1ss1 h ASN 44 Cb 1.76 -0.17 0.00 0.00 -1.12 0.00 0.00 38.32 38.80 1ss1 h ASN 44 CO 0.21 0.94 -0.01 -0.07 -1.29 0.00 0.00 177.43 177.20 1ss1 h LEU 45 N 0.46 -0.03 -0.67 1.61 -0.00 -0.88 -1.94 115.31 113.86 1ss1 h LEU 45 Ca 0.04 -0.71 0.04 0.00 -0.00 0.00 0.00 57.88 57.25 1ss1 h LEU 45 Cb 0.92 0.01 -0.05 0.00 -0.00 0.00 0.00 40.66 41.53 1ss1 h LEU 45 CO 0.08 0.76 0.39 0.25 -0.00 0.00 0.00 178.44 179.93 1ss1 h LEU 46 N -0.89 0.61 -0.30 1.67 6.46 -1.35 0.65 115.31 122.16 1ss1 h LEU 46 Ca -0.00 0.02 -0.19 0.00 -0.12 0.00 0.00 57.88 57.58 1ss1 h LEU 46 Cb 0.74 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.56 1ss1 h LEU 46 CO 0.01 0.41 -0.60 0.00 -0.62 0.00 0.00 178.44 177.64 1ss1 h ALA 47 N 1.32 0.47 -0.36 1.25 0.00 -1.41 -1.09 119.26 119.44 1ss1 h ALA 47 Ca 0.28 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1ss1 h ALA 47 Cb 0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ss1 h ALA 47 CO -0.14 0.69 0.14 0.93 0.00 0.00 0.00 179.25 180.87 1ss1 h GLU 48 N 0.61 0.53 -0.19 0.00 4.39 -0.95 -2.00 114.58 116.97 1ss1 h GLU 48 Ca -0.00 -0.10 -0.14 0.00 0.34 0.00 0.00 59.36 59.46 1ss1 h GLU 48 Cb 1.20 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 1ss1 h GLU 48 CO 0.13 0.52 -0.48 0.00 -1.16 0.00 0.00 179.01 178.02 1ss1 h ALA 49 N 0.99 0.82 0.43 3.43 0.00 -0.90 -1.77 119.26 122.26 1ss1 h ALA 49 Ca 0.12 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1ss1 h ALA 49 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ss1 h ALA 49 CO -0.01 0.66 -0.22 0.87 0.00 0.00 0.00 179.25 180.56 1ss1 h LYS 50 N 0.40 -0.58 -0.30 0.00 1.79 -0.98 0.51 116.57 117.41 1ss1 h LYS 50 Ca 0.02 0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.49 1ss1 h LYS 50 Cb 0.98 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.75 1ss1 h LYS 50 CO 0.09 -0.38 0.02 1.57 -1.08 0.00 0.00 179.45 179.66 1ss1 h LYS 51 N -0.60 0.53 0.32 3.15 5.09 -1.40 -2.36 116.57 121.29 1ss1 h LYS 51 Ca -0.06 -0.16 0.00 0.00 0.09 0.00 0.00 60.65 60.52 1ss1 h LYS 51 Cb 0.47 -0.05 -0.02 0.00 0.10 0.00 0.00 32.23 32.72 1ss1 h LYS 51 CO 0.09 0.65 -0.32 1.25 -2.09 0.00 0.00 179.45 179.03 1ss1 h LEU 52 N 0.33 -0.88 -0.74 7.07 7.12 -1.26 0.75 115.31 127.69 1ss1 h LEU 52 Ca 0.09 0.08 0.15 0.00 0.13 0.00 0.00 57.88 58.32 1ss1 h LEU 52 Cb 0.40 0.30 -0.10 0.00 -0.53 0.00 0.00 40.66 40.74 1ss1 h LEU 52 CO 0.01 -0.46 0.26 -1.13 -0.13 0.00 0.00 178.44 177.00 1ss1 h ASN 53 N -0.67 0.19 -0.07 1.25 -1.24 -0.91 0.08 115.58 114.21 1ss1 h ASN 53 Ca -0.02 0.12 0.02 0.00 0.71 0.00 0.00 56.30 57.13 1ss1 h ASN 53 Cb 0.61 0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.77 1ss1 h ASN 53 CO -0.07 0.06 -0.03 0.44 -1.29 0.00 0.00 177.43 176.54 1ss1 h ASP 54 N 0.38 -0.11 -0.58 1.15 3.32 -0.84 0.60 116.42 120.34 1ss1 h ASP 54 Ca 0.41 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.59 1ss1 h ASP 54 Cb 0.65 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 1ss1 h ASP 54 CO -0.43 -0.05 0.39 0.00 -1.72 0.00 0.00 179.24 177.43 1ss1 h ALA 55 N 1.04 2.04 -0.03 3.45 0.00 0.10 -0.72 119.26 125.15 1ss1 h ALA 55 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ss1 h ALA 55 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ss1 h ALA 55 CO -0.09 -0.17 -0.05 0.00 0.00 0.00 0.00 179.25 178.95 1ss1 n GLN 56 N -4.47 2.05 -1.35 0.00 10.64 -0.57 -4.82 117.38 118.86 1ss1 n GLN 56 Ca 0.09 -1.75 -0.30 0.00 -1.83 0.00 0.00 57.00 53.21 1ss1 n GLN 56 Cb 0.37 -1.44 0.10 0.00 -0.86 0.00 0.00 30.24 28.42 1ss1 n GLN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ss1 s ALA 57 N -1.94 2.09 -0.81 2.61 0.00 0.20 -4.85 121.76 119.07 1ss1 s ALA 57 Ca 0.25 0.04 -0.25 0.00 0.00 0.00 0.00 51.96 52.00 1ss1 s ALA 57 Cb 0.19 -3.20 -0.20 0.00 0.00 0.00 0.00 23.12 19.90 1ss1 s ALA 57 CO 0.31 -1.86 1.90 -0.35 0.00 0.00 0.00 175.76 175.76 1ss1 n PRO 58 N -3.56 0.89 0.00 0.00 -0.04 -1.26 -4.05 135.00 126.98 1ss1 n PRO 58 Ca 0.08 -1.82 0.00 0.00 -0.04 0.00 0.00 63.50 61.71 1ss1 n PRO 58 Cb 0.54 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.69 1ss1 n PRO 58 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1ss1 n LYS 59 N 7.87 0.00 0.00 0.54 2.85 -1.26 -5.21 118.16 122.94 1ss1 n LYS 59 Ca 0.46 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.72 1ss1 n LYS 59 Cb 0.44 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.82 1ss1 n LYS 59 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35