#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 -7.44 -4.91 1.61 2.88 -1.26 -5.01 113.62 99.49 1ss1 n SER 0 Ca 0.00 -0.26 -0.32 0.00 -1.33 0.00 0.00 58.87 56.96 1ss1 n SER 0 Cb 0.00 -5.27 -0.04 0.00 -0.75 0.00 0.00 64.21 58.15 1ss1 n SER 0 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1ss1 s THR 1 N -3.12 5.33 -0.43 2.46 -4.23 -1.26 -5.07 115.64 109.33 1ss1 s THR 1 Ca 0.14 -0.20 0.04 0.00 -1.18 0.00 0.00 61.69 60.49 1ss1 s THR 1 Cb -0.02 -3.61 0.17 0.00 1.34 0.00 0.00 72.50 70.38 1ss1 s THR 1 CO 0.74 0.16 0.34 0.00 -0.54 0.00 0.00 174.62 175.33 1ss1 s ALA 2 N -1.50 1.56 -1.12 3.99 0.00 -1.26 -5.02 121.76 118.40 1ss1 s ALA 2 Ca 0.35 -2.52 -0.05 0.00 0.00 0.00 0.00 51.96 49.73 1ss1 s ALA 2 Cb -0.13 -1.64 0.27 0.00 0.00 0.00 0.00 23.12 21.63 1ss1 s ALA 2 CO 0.25 -1.99 1.66 -0.25 0.00 0.00 0.00 175.76 175.42 1ss1 n ASP 3 N 2.86 6.39 -3.59 0.00 9.92 -1.26 -4.94 116.55 125.93 1ss1 n ASP 3 Ca 0.28 -3.38 -0.15 0.00 -0.53 0.00 0.00 54.79 51.01 1ss1 n ASP 3 Cb 0.46 -1.30 -0.06 0.00 -0.64 0.00 0.00 41.12 39.58 1ss1 n ASP 3 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1ss1 s ASN 4 N -1.12 -0.46 0.00 -2.24 -0.87 -1.26 -5.11 114.94 103.88 1ss1 s ASN 4 Ca 0.35 0.30 0.00 0.00 -1.57 0.00 0.00 52.86 51.94 1ss1 s ASN 4 Cb 0.09 0.48 0.00 0.00 -0.02 0.00 0.00 41.25 41.79 1ss1 s ASN 4 CO 0.05 -0.65 0.43 1.17 -2.57 0.00 0.00 177.10 175.52 1ss1 n LYS 5 N 0.65 0.00 -3.46 -0.60 0.00 -1.26 -4.91 118.16 108.58 1ss1 n LYS 5 Ca -0.19 0.18 -0.16 0.00 0.00 0.00 0.00 58.31 58.14 1ss1 n LYS 5 Cb 0.59 -0.93 0.01 0.00 0.00 0.00 0.00 35.03 34.70 1ss1 n LYS 5 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1ss1 n PHE 6 N -0.61 -2.40 -0.07 5.64 3.72 -1.26 -4.90 117.46 117.58 1ss1 n PHE 6 Ca 0.00 0.87 -0.03 0.00 -0.05 0.00 0.00 57.45 58.24 1ss1 n PHE 6 Cb 0.00 -3.49 0.03 0.00 -0.94 0.00 0.00 39.48 35.08 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 -2.31 -1.53 -0.05 4.37 0.23 -1.26 -2.81 115.26 111.90 1ss1 n ASN 7 Ca -0.14 -0.08 -0.08 0.00 -0.53 0.00 0.00 54.58 53.75 1ss1 n ASN 7 Cb 0.59 -0.13 -0.01 0.00 -2.08 0.00 0.00 39.78 38.15 1ss1 n ASN 7 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1ss1 h LYS 8 N 0.00 -0.09 -0.75 -3.83 3.11 -1.98 0.96 116.57 113.99 1ss1 h LYS 8 Ca -0.04 0.01 -0.06 0.00 -2.81 0.00 0.00 60.65 57.75 1ss1 h LYS 8 Cb 0.13 0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 31.35 1ss1 h LYS 8 CO 0.02 -0.06 0.24 0.93 -2.81 0.00 0.00 179.45 177.77 1ss1 h GLU 9 N -0.10 1.16 0.11 1.90 4.39 -2.02 -2.86 114.58 117.16 1ss1 h GLU 9 Ca 0.13 -0.24 -0.16 0.00 0.34 0.00 0.00 59.36 59.42 1ss1 h GLU 9 Cb 0.29 -0.17 0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1ss1 h GLU 9 CO -0.30 0.98 -0.69 0.37 -1.16 0.00 0.00 179.01 178.20 1ss1 h GLN 10 N 1.11 0.28 -0.67 2.33 4.15 -1.71 -3.33 115.11 117.27 1ss1 h GLN 10 Ca 0.24 -0.45 0.12 0.00 0.77 0.00 0.00 58.65 59.33 1ss1 h GLN 10 Cb 0.30 0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 1ss1 h GLN 10 CO -0.01 1.19 0.45 0.37 -1.93 0.00 0.00 178.83 178.90 1ss1 h GLN 11 N -0.40 0.43 -0.73 1.69 5.75 0.11 -0.25 115.11 121.71 1ss1 h GLN 11 Ca -0.12 -0.03 0.21 0.00 -0.15 0.00 0.00 58.65 58.57 1ss1 h GLN 11 Cb 1.52 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.94 1ss1 h GLN 11 CO 0.13 0.28 0.52 -0.91 -2.65 0.00 0.00 178.83 176.21 1ss1 h ASN 12 N 0.44 0.02 -0.42 -0.69 4.21 -1.61 0.05 115.58 117.58 1ss1 h ASN 12 Ca 0.32 0.00 0.06 0.00 1.21 0.00 0.00 56.30 57.89 1ss1 h ASN 12 Cb 0.64 -0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 37.79 1ss1 h ASN 12 CO -0.10 0.01 0.12 0.00 -1.29 0.00 0.00 177.43 176.17 1ss1 h ALA 13 N 1.64 0.48 0.49 -0.83 0.00 -1.22 -1.08 119.26 118.73 1ss1 h ALA 13 Ca 0.35 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1ss1 h ALA 13 Cb 1.37 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1ss1 h ALA 13 CO -0.01 -0.28 -0.36 0.35 0.00 0.00 0.00 179.25 178.95 1ss1 h PHE 14 N 0.26 -0.96 -0.79 0.00 3.57 -1.13 0.29 116.94 118.19 1ss1 h PHE 14 Ca 0.20 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.77 1ss1 h PHE 14 Cb 0.21 0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 1ss1 h PHE 14 CO -0.18 -0.53 0.52 -1.49 -2.23 0.00 0.00 178.31 174.40 1ss1 h TRP 15 N -0.83 0.82 0.13 0.41 4.06 -1.51 0.30 115.95 119.33 1ss1 h TRP 15 Ca -0.05 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.91 1ss1 h TRP 15 Cb 0.70 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 28.59 1ss1 h TRP 15 CO -0.14 0.41 -0.06 0.93 -3.56 0.00 0.00 178.44 176.02 1ss1 h GLU 16 N 0.79 -0.17 -0.83 0.49 3.07 -0.92 -2.95 114.58 114.07 1ss1 h GLU 16 Ca 0.35 0.01 0.13 0.00 -0.50 0.00 0.00 59.36 59.35 1ss1 h GLU 16 Cb 0.33 0.04 -0.09 0.00 -0.84 0.00 0.00 28.75 28.19 1ss1 h GLU 16 CO -0.13 0.30 0.43 0.82 -1.40 0.00 0.00 179.01 179.03 1ss1 h ILE 17 N -0.87 0.78 -0.20 3.13 2.04 -0.14 -0.59 117.51 121.66 1ss1 h ILE 17 Ca -0.02 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1ss1 h ILE 17 Cb 0.54 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1ss1 h ILE 17 CO 0.03 0.12 0.06 -0.07 0.00 0.00 0.00 178.15 178.29 1ss1 h LEU 18 N 0.65 0.06 0.18 1.44 -0.00 -0.46 -3.27 115.31 113.91 1ss1 h LEU 18 Ca 0.43 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 58.33 1ss1 h LEU 18 Cb 0.56 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.24 1ss1 h LEU 18 CO -0.33 0.06 -0.09 -0.74 -0.00 0.00 0.00 178.44 177.34 1ss1 h HIS 19 N 0.15 -0.23 -6.22 1.13 2.76 -1.22 -3.47 115.15 108.06 1ss1 h HIS 19 Ca 0.09 -0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.11 1ss1 h HIS 19 Cb 0.07 0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.07 1ss1 h HIS 19 CO -0.13 0.19 -0.23 1.28 -1.30 0.00 0.00 177.93 177.74 1ss1 n LEU 20 N -4.95 -0.14 -4.29 0.26 4.77 -0.29 -4.41 117.00 107.96 1ss1 n LEU 20 Ca -0.08 -0.30 -0.19 0.00 -0.03 0.00 0.00 56.01 55.41 1ss1 n LEU 20 Cb 0.26 -0.37 -0.20 0.00 -2.33 0.00 0.00 43.42 40.78 1ss1 n LEU 20 CO 0.25 0.14 1.90 -2.65 -1.33 0.00 0.00 177.39 175.71 1ss1 n PRO 21 N -1.86 0.00 0.00 3.23 -0.02 -1.26 -0.24 135.00 134.84 1ss1 n PRO 21 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1ss1 n PRO 21 Cb 0.15 -0.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 1ss1 n PRO 21 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ss1 n ASN 22 N 5.20 0.00 -3.27 2.55 3.02 -1.26 -4.85 115.26 116.64 1ss1 n ASN 22 Ca 0.58 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.84 1ss1 n ASN 22 Cb 0.17 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.36 1ss1 n ASN 22 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1ss1 n LEU 23 N 0.00 -3.80 -4.61 3.41 0.00 0.67 -4.20 117.00 108.47 1ss1 n LEU 23 Ca 0.00 0.34 -0.43 0.00 0.00 0.00 0.00 56.01 55.92 1ss1 n LEU 23 Cb 0.00 -0.64 -0.03 0.00 0.00 0.00 0.00 43.42 42.75 1ss1 n LEU 23 CO 0.00 -4.27 1.63 0.21 0.00 0.00 0.00 177.39 174.96 1ss1 s ASN 24 N -0.79 5.87 0.61 1.96 2.47 -1.26 -4.81 114.94 118.98 1ss1 s ASN 24 Ca 0.39 1.70 0.30 0.00 0.42 0.00 0.00 52.86 55.67 1ss1 s ASN 24 Cb -0.28 -2.52 1.62 0.00 -1.45 0.00 0.00 41.25 38.62 1ss1 s ASN 24 CO 0.59 -1.66 2.01 -0.08 -3.72 0.00 0.00 177.10 174.23 1ss1 h GLU 25 N 13.09 0.00 0.00 0.43 4.81 -1.92 1.29 114.58 132.28 1ss1 h GLU 25 Ca -0.38 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.75 1ss1 h GLU 25 Cb 1.20 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 1ss1 h GLU 25 CO 0.99 0.00 -0.50 1.49 -0.73 0.00 0.00 179.01 180.26 1ss1 h GLU 26 N 0.00 0.00 -0.06 1.92 4.81 -2.00 -0.34 114.58 118.91 1ss1 h GLU 26 Ca 0.11 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.10 1ss1 h GLU 26 Cb 0.74 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.14 1ss1 h GLU 26 CO -0.00 0.50 -0.92 1.96 -0.73 0.00 0.00 179.01 179.82 1ss1 h GLN 27 N 0.00 0.71 0.47 1.92 4.20 0.12 -2.25 115.11 120.29 1ss1 h GLN 27 Ca -0.01 -0.68 -0.01 0.00 0.06 0.00 0.00 58.65 58.01 1ss1 h GLN 27 Cb 0.97 0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.91 1ss1 h GLN 27 CO 0.07 1.27 -0.40 0.00 -0.67 0.00 0.00 178.83 179.10 1ss1 h ARG 28 N 0.44 -0.83 -0.55 1.46 3.08 -0.50 0.12 114.38 117.61 1ss1 h ARG 28 Ca -0.09 0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.13 1ss1 h ARG 28 Cb 1.56 0.19 -0.10 0.00 0.08 0.00 0.00 29.97 31.70 1ss1 h ARG 28 CO 0.18 -0.55 -0.09 -0.97 -1.07 0.00 0.00 179.97 177.47 1ss1 h ASN 29 N -0.86 -0.42 -0.78 7.04 -1.24 -1.11 0.85 115.58 119.05 1ss1 h ASN 29 Ca -0.05 0.16 0.09 0.00 0.71 0.00 0.00 56.30 57.20 1ss1 h ASN 29 Cb 0.75 0.31 -0.05 0.00 0.73 0.00 0.00 38.32 40.05 1ss1 h ASN 29 CO -0.02 -0.15 0.51 1.23 -1.29 0.00 0.00 177.43 177.71 1ss1 h GLY 30 N 0.03 1.03 0.56 1.57 0.00 -0.93 0.25 103.07 105.58 1ss1 h GLY 30 Ca 0.27 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1ss1 h GLY 30 CO -0.53 0.19 -0.10 0.74 0.00 0.00 0.00 176.54 176.84 1ss1 h PHE 31 N 0.74 0.20 -0.16 5.60 0.04 0.28 -2.00 116.94 121.65 1ss1 h PHE 31 Ca 0.35 -0.07 0.01 0.00 2.80 0.00 0.00 57.97 61.06 1ss1 h PHE 31 Cb 0.39 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.49 1ss1 h PHE 31 CO -0.00 0.69 0.08 0.82 -0.60 0.00 0.00 178.31 179.31 1ss1 h ILE 32 N -0.35 1.01 -0.15 -0.55 1.08 0.10 0.96 117.51 119.61 1ss1 h ILE 32 Ca 0.00 -0.06 0.03 0.00 -0.39 0.00 0.00 64.86 64.44 1ss1 h ILE 32 Cb 0.68 0.81 -0.03 0.00 -3.07 0.00 0.00 36.82 35.22 1ss1 h ILE 32 CO 0.02 0.03 -0.02 1.56 -0.69 0.00 0.00 178.15 179.06 1ss1 h GLN 33 N 0.18 0.02 -0.75 2.37 1.08 -0.59 2.60 115.11 120.03 1ss1 h GLN 33 Ca 0.06 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.22 1ss1 h GLN 33 Cb 0.00 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.40 1ss1 h GLN 33 CO -0.04 0.02 0.29 1.03 -0.95 0.00 0.00 178.83 179.18 1ss1 h SER 34 N 0.02 1.04 0.57 1.46 0.87 -1.14 0.14 113.55 116.52 1ss1 h SER 34 Ca 0.07 -0.18 -0.20 0.00 -1.23 0.00 0.00 61.79 60.25 1ss1 h SER 34 Cb 0.10 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 1ss1 h SER 34 CO -0.13 0.93 -0.90 0.25 -0.53 0.00 0.00 176.83 176.45 1ss1 h LEU 35 N 1.08 0.28 -0.73 2.23 5.85 -0.43 -3.21 115.31 120.37 1ss1 h LEU 35 Ca 0.25 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1ss1 h LEU 35 Cb 0.22 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 1ss1 h LEU 35 CO -0.02 1.04 -0.01 0.50 -0.34 0.00 0.00 178.44 179.60 1ss1 h LYS 36 N 0.11 0.00 0.00 1.25 3.11 0.49 -2.90 116.57 118.64 1ss1 h LYS 36 Ca -0.05 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 1ss1 h LYS 36 Cb 1.53 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.76 1ss1 h LYS 36 CO 0.14 0.01 -0.49 -0.25 -2.81 0.00 0.00 179.45 176.06 1ss1 n ASP 37 N -3.11 0.49 -3.67 4.20 8.00 0.47 -4.87 116.55 118.05 1ss1 n ASP 37 Ca 0.02 -0.19 -0.10 0.00 0.71 0.00 0.00 54.79 55.23 1ss1 n ASP 37 Cb 0.42 0.21 -0.09 0.00 -0.02 0.00 0.00 41.12 41.65 1ss1 n ASP 37 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ss1 s ASP 38 N -3.08 -0.69 0.01 -2.24 2.15 -1.09 -5.06 116.67 106.66 1ss1 s ASP 38 Ca 0.11 1.20 0.05 0.00 0.43 0.00 0.00 52.55 54.34 1ss1 s ASP 38 Cb 0.17 1.13 -0.24 0.00 -0.30 0.00 0.00 42.92 43.68 1ss1 s ASP 38 CO 0.69 -0.21 0.86 1.55 -0.17 0.00 0.00 175.17 177.89 1ss1 h PRO 39 N 6.39 0.09 0.00 4.34 0.13 -1.90 -3.32 132.00 137.73 1ss1 h PRO 39 Ca -0.31 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ss1 h PRO 39 Cb 1.19 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1ss1 h PRO 39 CO 0.19 0.86 0.00 0.43 -0.23 0.00 0.00 178.00 179.25 1ss1 n SER 40 N -3.28 0.00 0.00 1.44 7.64 -1.26 -1.71 113.62 116.46 1ss1 n SER 40 Ca -0.13 0.33 0.11 0.00 1.01 0.00 0.00 58.87 60.18 1ss1 n SER 40 Cb 1.02 -0.40 -0.03 0.00 -1.01 0.00 0.00 64.21 63.79 1ss1 n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ss1 n GLN 41 N -1.40 0.13 -0.59 1.43 1.13 -1.25 -4.47 117.38 112.37 1ss1 n GLN 41 Ca 0.04 -0.02 0.46 0.00 -1.94 0.00 0.00 57.00 55.54 1ss1 n GLN 41 Cb 0.10 -1.52 0.74 0.00 0.11 0.00 0.00 30.24 29.67 1ss1 n GLN 41 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1ss1 n SER 42 N -1.67 0.11 -0.02 1.08 2.88 -0.69 0.35 113.62 115.65 1ss1 n SER 42 Ca 0.03 1.19 -0.15 0.00 -1.33 0.00 0.00 58.87 58.61 1ss1 n SER 42 Cb 0.38 -0.59 -0.11 0.00 -0.75 0.00 0.00 64.21 63.14 1ss1 n SER 42 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ss1 h ALA 43 N 1.30 0.07 -0.12 -1.46 0.00 -1.82 -0.05 119.26 117.17 1ss1 h ALA 43 Ca 0.91 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 55.22 1ss1 h ALA 43 Cb 3.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 21.07 1ss1 h ALA 43 CO -0.24 0.15 -0.48 -0.91 0.00 0.00 0.00 179.25 177.76 1ss1 h ASN 44 N -0.34 0.32 0.02 0.00 4.21 -0.41 -1.58 115.58 117.80 1ss1 h ASN 44 Ca -0.03 -0.15 -0.00 0.00 1.21 0.00 0.00 56.30 57.32 1ss1 h ASN 44 Cb 1.03 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.14 1ss1 h ASN 44 CO 0.06 0.76 -0.01 -0.07 -1.29 0.00 0.00 177.43 176.88 1ss1 h LEU 45 N 0.24 -0.02 -0.34 1.61 -0.00 -0.78 -2.82 115.31 113.20 1ss1 h LEU 45 Ca 0.01 -0.59 0.02 0.00 -0.00 0.00 0.00 57.88 57.33 1ss1 h LEU 45 Cb 0.94 0.01 -0.03 0.00 -0.00 0.00 0.00 40.66 41.58 1ss1 h LEU 45 CO 0.08 0.75 0.16 0.25 -0.00 0.00 0.00 178.44 179.68 1ss1 h LEU 46 N -0.97 0.24 0.01 1.67 6.46 -1.07 0.25 115.31 121.89 1ss1 h LEU 46 Ca -0.00 0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.77 1ss1 h LEU 46 Cb 0.61 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.51 1ss1 h LEU 46 CO 0.00 0.18 -0.01 0.00 -0.62 0.00 0.00 178.44 178.00 1ss1 h ALA 47 N 1.18 -0.02 -0.90 1.25 0.00 -1.44 0.15 119.26 119.48 1ss1 h ALA 47 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ss1 h ALA 47 Cb 0.06 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1ss1 h ALA 47 CO -0.10 -0.44 0.51 0.93 0.00 0.00 0.00 179.25 180.15 1ss1 h GLU 48 N -0.17 1.24 -0.14 0.00 5.08 -1.33 -1.34 114.58 117.92 1ss1 h GLU 48 Ca -0.00 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 1ss1 h GLU 48 Cb 0.16 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 1ss1 h GLU 48 CO 0.00 0.89 -0.15 0.00 -1.00 0.00 0.00 179.01 178.75 1ss1 h ALA 49 N 1.31 0.20 -0.16 3.43 0.00 -0.36 -1.43 119.26 122.27 1ss1 h ALA 49 Ca 0.32 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ss1 h ALA 49 Cb -0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ss1 h ALA 49 CO -0.05 0.09 0.05 -0.22 0.00 0.00 0.00 179.25 179.12 1ss1 h LYS 50 N -0.04 0.13 -0.53 0.00 1.63 -0.53 -0.79 116.57 116.44 1ss1 h LYS 50 Ca 0.02 -0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 59.72 1ss1 h LYS 50 Cb 0.69 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.27 1ss1 h LYS 50 CO 0.04 0.08 -0.03 1.57 -3.45 0.00 0.00 179.45 177.66 1ss1 h LYS 51 N 0.13 0.91 -0.08 1.90 2.10 -1.30 -3.13 116.57 117.10 1ss1 h LYS 51 Ca 0.07 -0.28 -0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1ss1 h LYS 51 Cb 0.04 -0.09 -0.00 0.00 -0.90 0.00 0.00 32.23 31.28 1ss1 h LYS 51 CO -0.07 0.93 0.03 1.25 -2.00 0.00 0.00 179.45 179.59 1ss1 h LEU 52 N 0.84 0.11 -0.53 7.07 6.46 -0.93 -2.09 115.31 126.23 1ss1 h LEU 52 Ca 0.15 -0.16 0.11 0.00 -0.12 0.00 0.00 57.88 57.86 1ss1 h LEU 52 Cb 0.54 -0.03 -0.10 0.00 -0.73 0.00 0.00 40.66 40.34 1ss1 h LEU 52 CO 0.03 0.24 -0.06 -1.13 -0.62 0.00 0.00 178.44 176.90 1ss1 h ASN 53 N -0.03 -0.36 0.15 1.25 -1.24 -1.10 0.56 115.58 114.81 1ss1 h ASN 53 Ca 0.03 0.14 -0.01 0.00 0.71 0.00 0.00 56.30 57.17 1ss1 h ASN 53 Cb 0.16 0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.49 1ss1 h ASN 53 CO -0.00 -0.13 -0.07 -2.24 -1.29 0.00 0.00 177.43 173.69 1ss1 h ASP 54 N 0.06 -0.17 0.05 1.15 3.04 -1.52 0.43 116.42 119.45 1ss1 h ASP 54 Ca 0.27 -0.30 -0.05 0.00 -3.24 0.00 0.00 57.03 53.70 1ss1 h ASP 54 Cb 0.41 0.04 -0.01 0.00 -1.04 0.00 0.00 39.33 38.74 1ss1 h ASP 54 CO -0.50 0.23 -0.15 0.00 -2.04 0.00 0.00 179.24 176.78 1ss1 h ALA 55 N 0.14 1.49 0.00 4.15 0.00 -1.11 -2.97 119.26 120.96 1ss1 h ALA 55 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ss1 h ALA 55 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ss1 h ALA 55 CO 0.03 0.37 -1.11 0.00 0.00 0.00 0.00 179.25 178.54 1ss1 n GLN 56 N -4.26 0.11 0.00 0.00 -0.00 0.19 -4.86 117.38 108.57 1ss1 n GLN 56 Ca -0.01 -0.03 0.00 0.00 -0.00 0.00 0.00 57.00 56.96 1ss1 n GLN 56 Cb 0.28 -1.51 0.00 0.00 -0.00 0.00 0.00 30.24 29.01 1ss1 n GLN 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ss1 n ALA 57 N -1.63 0.00 -0.02 2.61 0.00 0.15 -0.67 120.51 120.95 1ss1 n ALA 57 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.31 1ss1 n ALA 57 Cb 0.37 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.70 1ss1 n ALA 57 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ss1 h PRO 58 N 0.00 0.16 -0.34 0.00 0.13 -1.85 -3.33 132.00 126.76 1ss1 h PRO 58 Ca 0.00 -0.22 0.07 0.00 -0.87 0.00 0.00 66.00 64.99 1ss1 h PRO 58 Cb 0.00 0.07 -0.07 0.00 0.13 0.00 0.00 31.00 31.13 1ss1 h PRO 58 CO 0.00 1.02 -0.12 -0.22 -0.23 0.00 0.00 178.00 178.45 1ss1 h LYS 59 N -0.60 -0.05 0.00 0.86 3.64 -1.92 -3.49 116.57 115.01 1ss1 h LYS 59 Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1ss1 h LYS 59 Cb 1.16 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1ss1 h LYS 59 CO 0.06 -0.03 0.00 0.00 -2.27 0.00 0.00 179.45 177.21