#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 1.44 -2.78 1.61 2.88 -1.26 -4.89 113.62 110.63 1ss1 n SER 0 Ca 0.00 -1.83 -0.06 0.00 -1.33 0.00 0.00 58.87 55.65 1ss1 n SER 0 Cb 0.00 -0.04 0.02 0.00 -0.75 0.00 0.00 64.21 63.43 1ss1 n SER 0 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1ss1 n THR 1 N -0.43 -0.03 0.00 2.46 5.66 -1.26 -5.10 114.28 115.57 1ss1 n THR 1 Ca 0.01 -1.22 0.00 0.00 -3.05 0.00 0.00 64.05 59.79 1ss1 n THR 1 Cb 0.37 1.05 0.00 0.00 -1.55 0.00 0.00 70.33 70.20 1ss1 n THR 1 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ss1 n ALA 2 N 2.56 0.00 -3.60 1.79 0.00 -1.26 -5.07 120.51 114.92 1ss1 n ALA 2 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.33 1ss1 n ALA 2 Cb 0.58 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.07 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 0.00 -5.64 -4.74 0.00 2.03 -1.26 -4.89 116.55 102.05 1ss1 n ASP 3 Ca 0.00 -0.90 -0.41 0.00 0.52 0.00 0.00 54.79 53.99 1ss1 n ASP 3 Cb 0.00 -3.54 -0.04 0.00 -0.72 0.00 0.00 41.12 36.82 1ss1 n ASP 3 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1ss1 s ASN 4 N -3.37 7.13 0.00 1.67 2.20 -1.26 -4.89 114.94 116.41 1ss1 s ASN 4 Ca 0.39 2.20 0.05 0.00 -0.94 0.00 0.00 52.86 54.56 1ss1 s ASN 4 Cb -0.13 -2.61 0.07 0.00 -2.00 0.00 0.00 41.25 36.59 1ss1 s ASN 4 CO 0.85 -0.34 0.87 2.29 -2.94 0.00 0.00 177.10 177.83 1ss1 n LYS 5 N 2.46 0.00 -2.33 3.55 2.85 -1.26 -5.06 118.16 118.37 1ss1 n LYS 5 Ca 0.04 -0.86 0.00 0.00 -1.05 0.00 0.00 58.31 56.44 1ss1 n LYS 5 Cb 0.45 0.11 0.00 0.00 -0.65 0.00 0.00 35.03 34.94 1ss1 n LYS 5 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1ss1 n PHE 6 N 0.09 0.00 0.00 5.58 3.01 -1.26 -4.85 117.46 120.03 1ss1 n PHE 6 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 1ss1 n PHE 6 Cb 0.72 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.19 1ss1 n PHE 6 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1ss1 n ASN 7 N 0.52 -1.18 0.23 4.37 4.13 -1.26 -3.31 115.26 118.76 1ss1 n ASN 7 Ca 0.00 0.00 -0.17 0.00 1.68 0.00 0.00 54.58 56.09 1ss1 n ASN 7 Cb 0.00 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.15 1ss1 n ASN 7 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1ss1 h LYS 8 N 0.00 -0.86 -0.22 3.52 1.57 -1.98 0.57 116.57 119.17 1ss1 h LYS 8 Ca 0.00 0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.89 1ss1 h LYS 8 Cb 0.00 0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 1ss1 h LYS 8 CO 0.00 -0.58 -0.09 0.93 -0.57 0.00 0.00 179.45 179.14 1ss1 h GLU 9 N -0.90 -0.06 0.06 3.15 3.07 -2.01 -1.82 114.58 116.08 1ss1 h GLU 9 Ca -0.05 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1ss1 h GLU 9 Cb 0.80 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.73 1ss1 h GLU 9 CO -0.12 -0.04 -0.03 0.37 -1.40 0.00 0.00 179.01 177.80 1ss1 h GLN 10 N -0.06 -0.07 -0.32 2.33 5.75 -1.82 -3.09 115.11 117.82 1ss1 h GLN 10 Ca 0.11 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.71 1ss1 h GLN 10 Cb 0.23 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 1ss1 h GLN 10 CO -0.26 0.32 0.30 0.37 -2.65 0.00 0.00 178.83 176.91 1ss1 h GLN 11 N -0.49 0.00 -0.96 1.69 -0.00 0.21 -1.05 115.11 114.51 1ss1 h GLN 11 Ca -0.01 0.00 0.16 0.00 -0.00 0.00 0.00 58.65 58.80 1ss1 h GLN 11 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 27.48 27.82 1ss1 h GLN 11 CO 0.01 0.00 0.56 -0.97 0.00 0.00 0.00 178.83 178.44 1ss1 h ASN 12 N 0.00 0.75 -0.83 -0.69 -1.24 -1.24 0.97 115.58 113.30 1ss1 h ASN 12 Ca 0.15 0.08 0.11 0.00 0.71 0.00 0.00 56.30 57.35 1ss1 h ASN 12 Cb 0.74 -0.06 -0.08 0.00 0.73 0.00 0.00 38.32 39.66 1ss1 h ASN 12 CO -0.00 0.32 0.46 0.00 -1.29 0.00 0.00 177.43 176.93 1ss1 h ALA 13 N 1.59 1.21 0.16 1.57 0.00 -1.33 -2.21 119.26 120.25 1ss1 h ALA 13 Ca 0.52 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.49 1ss1 h ALA 13 Cb 0.70 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1ss1 h ALA 13 CO -0.34 0.04 -0.35 0.35 0.00 0.00 0.00 179.25 178.95 1ss1 h PHE 14 N 0.74 -0.95 0.13 0.00 3.04 -0.94 0.29 116.94 119.25 1ss1 h PHE 14 Ca 0.42 0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.41 1ss1 h PHE 14 Cb 0.46 0.40 -0.04 0.00 2.56 0.00 0.00 35.95 39.33 1ss1 h PHE 14 CO -0.07 -0.46 -0.29 -1.49 -2.02 0.00 0.00 178.31 173.98 1ss1 h TRP 15 N -0.60 -0.79 -0.23 0.41 4.06 -1.43 0.58 115.95 117.96 1ss1 h TRP 15 Ca 0.02 0.02 0.07 0.00 2.06 0.00 0.00 58.89 61.05 1ss1 h TRP 15 Cb 0.61 0.33 -0.01 0.00 -1.00 0.00 0.00 29.16 29.10 1ss1 h TRP 15 CO -0.29 -0.40 0.20 0.93 -3.56 0.00 0.00 178.44 175.32 1ss1 h GLU 16 N -0.52 0.00 0.04 0.49 5.08 -1.20 0.85 114.58 119.32 1ss1 h GLU 16 Ca 0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ss1 h GLU 16 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1ss1 h GLU 16 CO -0.17 0.00 -0.02 0.82 -1.00 0.00 0.00 179.01 178.65 1ss1 h ILE 17 N 0.00 1.33 -0.13 3.13 5.03 0.10 -2.27 117.51 124.70 1ss1 h ILE 17 Ca 0.11 -1.72 -0.04 0.00 -0.12 0.00 0.00 64.86 63.08 1ss1 h ILE 17 Cb 0.51 2.38 -0.01 0.00 -3.03 0.00 0.00 36.82 36.67 1ss1 h ILE 17 CO -0.00 0.40 -0.11 -0.07 -0.68 0.00 0.00 178.15 177.69 1ss1 h LEU 18 N -0.88 0.18 0.20 1.44 -0.00 0.11 -3.08 115.31 113.29 1ss1 h LEU 18 Ca -0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.83 1ss1 h LEU 18 Cb 0.70 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.31 1ss1 h LEU 18 CO 0.01 0.32 -0.10 0.45 -0.00 0.00 0.00 178.44 179.12 1ss1 h HIS 19 N 0.19 -0.25 -1.14 1.13 3.86 0.60 -3.46 115.15 116.08 1ss1 h HIS 19 Ca 0.04 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1ss1 h HIS 19 Cb 0.32 0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1ss1 h HIS 19 CO 0.00 0.14 0.00 1.28 0.86 0.00 0.00 177.93 180.22 1ss1 n LEU 20 N -4.96 0.00 -4.54 2.43 4.77 -0.85 -4.56 117.00 109.28 1ss1 n LEU 20 Ca -0.08 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.54 1ss1 n LEU 20 Cb 0.26 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.28 1ss1 n LEU 20 CO 0.24 0.00 2.04 -2.65 -1.33 0.00 0.00 177.39 175.69 1ss1 n PRO 21 N -0.11 0.77 0.00 3.23 -0.02 -1.26 -1.20 135.00 136.41 1ss1 n PRO 21 Ca 0.00 -0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1ss1 n PRO 21 Cb 0.00 -3.00 0.00 0.00 -0.02 0.00 0.00 33.50 30.48 1ss1 n PRO 21 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1ss1 n ASN 22 N 14.77 0.00 -4.69 2.55 5.15 -1.26 -4.17 115.26 127.61 1ss1 n ASN 22 Ca 0.44 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 54.02 1ss1 n ASN 22 Cb 0.42 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 39.70 1ss1 n ASN 22 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1ss1 n LEU 23 N 0.00 4.12 -4.60 1.20 7.94 -0.34 -4.75 117.00 120.57 1ss1 n LEU 23 Ca 0.00 1.02 -0.48 0.00 -1.11 0.00 0.00 56.01 55.44 1ss1 n LEU 23 Cb 0.00 -1.48 -0.05 0.00 0.53 0.00 0.00 43.42 42.42 1ss1 n LEU 23 CO 0.00 -0.93 1.65 -3.20 -1.11 0.00 0.00 177.39 173.81 1ss1 n ASN 24 N -0.17 3.05 0.18 1.96 4.05 -1.26 -4.74 115.26 118.33 1ss1 n ASN 24 Ca 0.09 0.66 0.18 0.00 0.45 0.00 0.00 54.58 55.96 1ss1 n ASN 24 Cb 0.42 -1.38 0.81 0.00 1.23 0.00 0.00 39.78 40.86 1ss1 n ASN 24 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 177.26 175.26 1ss1 h GLU 25 N 11.32 0.00 0.00 1.20 9.09 -1.92 2.00 114.58 136.27 1ss1 h GLU 25 Ca -0.41 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 58.92 1ss1 h GLU 25 Cb 1.28 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.37 1ss1 h GLU 25 CO 0.97 0.00 -0.39 1.49 0.05 0.00 0.00 179.01 181.13 1ss1 h GLU 26 N 0.00 0.00 -0.03 1.06 4.57 -1.99 0.21 114.58 118.39 1ss1 h GLU 26 Ca 0.12 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 58.06 1ss1 h GLU 26 Cb 0.72 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.32 1ss1 h GLU 26 CO -0.00 0.39 -0.95 1.96 -1.18 0.00 0.00 179.01 179.23 1ss1 h GLN 27 N 0.00 0.61 0.65 1.92 4.20 0.27 -1.89 115.11 120.87 1ss1 h GLN 27 Ca -0.00 -0.61 -0.03 0.00 0.06 0.00 0.00 58.65 58.06 1ss1 h GLN 27 Cb 0.75 0.16 0.01 0.00 0.30 0.00 0.00 27.48 28.70 1ss1 h GLN 27 CO 0.05 1.22 -0.32 0.00 -0.67 0.00 0.00 178.83 179.11 1ss1 h ARG 28 N 0.36 -0.85 -0.69 1.46 3.08 0.17 0.19 114.38 118.11 1ss1 h ARG 28 Ca -0.09 0.06 0.13 0.00 0.07 0.00 0.00 59.98 60.14 1ss1 h ARG 28 Cb 1.58 0.19 -0.09 0.00 0.08 0.00 0.00 29.97 31.74 1ss1 h ARG 28 CO 0.18 -0.57 0.24 -0.97 -1.07 0.00 0.00 179.97 177.79 1ss1 h ASN 29 N -0.88 0.20 -0.59 7.04 -1.24 -0.67 0.35 115.58 119.78 1ss1 h ASN 29 Ca -0.09 0.11 0.04 0.00 0.71 0.00 0.00 56.30 57.07 1ss1 h ASN 29 Cb 0.68 0.10 -0.03 0.00 0.73 0.00 0.00 38.32 39.80 1ss1 h ASN 29 CO 0.14 0.08 0.39 1.23 -1.29 0.00 0.00 177.43 177.98 1ss1 h GLY 30 N 0.39 0.76 1.59 1.57 0.00 -0.94 -0.88 103.07 105.57 1ss1 h GLY 30 Ca 0.37 -0.26 -0.13 0.00 0.00 0.00 0.00 47.33 47.31 1ss1 h GLY 30 CO -0.39 0.22 -0.43 0.74 0.00 0.00 0.00 176.54 176.68 1ss1 h PHE 31 N 0.66 0.54 -0.33 5.60 0.04 0.17 -2.03 116.94 121.58 1ss1 h PHE 31 Ca 0.24 -0.16 -0.18 0.00 2.80 0.00 0.00 57.97 60.68 1ss1 h PHE 31 Cb 0.13 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.17 1ss1 h PHE 31 CO -0.00 0.81 -0.48 0.82 -0.60 0.00 0.00 178.31 178.86 1ss1 h ILE 32 N 0.37 1.27 -0.03 -0.55 2.04 0.19 -1.54 117.51 119.25 1ss1 h ILE 32 Ca 0.03 -1.66 -0.01 0.00 1.00 0.00 0.00 64.86 64.22 1ss1 h ILE 32 Cb 0.91 1.52 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1ss1 h ILE 32 CO 0.08 0.55 -0.02 0.06 0.00 0.00 0.00 178.15 178.81 1ss1 h GLN 33 N 0.71 0.08 -0.74 2.37 3.07 -1.19 0.99 115.11 120.40 1ss1 h GLN 33 Ca 0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 1ss1 h GLN 33 Cb 1.08 -0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.61 1ss1 h GLN 33 CO 0.11 0.49 0.38 1.03 0.09 0.00 0.00 178.83 180.93 1ss1 h SER 34 N -0.34 0.96 -0.07 0.06 0.87 -1.43 -2.23 113.55 111.37 1ss1 h SER 34 Ca 0.01 -0.12 -0.14 0.00 -1.23 0.00 0.00 61.79 60.31 1ss1 h SER 34 Cb 0.47 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1ss1 h SER 34 CO 0.01 0.80 -0.50 0.25 -0.53 0.00 0.00 176.83 176.86 1ss1 h LEU 35 N 1.04 0.56 0.26 2.23 5.85 -1.28 -2.80 115.31 121.17 1ss1 h LEU 35 Ca 0.26 -0.68 0.01 0.00 0.84 0.00 0.00 57.88 58.31 1ss1 h LEU 35 Cb 0.09 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 1ss1 h LEU 35 CO -0.04 1.15 -0.47 0.11 -0.34 0.00 0.00 178.44 178.86 1ss1 h LYS 36 N 0.01 -0.77 -0.03 1.25 1.79 0.12 -2.92 116.57 116.02 1ss1 h LYS 36 Ca -0.04 0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1ss1 h LYS 36 Cb 1.17 0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 31.99 1ss1 h LYS 36 CO 0.10 -0.51 0.02 -0.44 -1.08 0.00 0.00 179.45 177.54 1ss1 h ASP 37 N -0.80 0.04 -3.22 0.86 3.32 -1.54 -3.37 116.42 111.70 1ss1 h ASP 37 Ca -0.01 -0.11 -0.74 0.00 0.02 0.00 0.00 57.03 56.18 1ss1 h ASP 37 Cb 0.76 -0.01 -0.24 0.00 0.22 0.00 0.00 39.33 40.06 1ss1 h ASP 37 CO -0.18 0.14 -0.30 -0.62 -1.72 0.00 0.00 179.24 176.55 1ss1 s ASP 38 N -5.34 6.09 0.36 6.45 -1.08 -1.05 -4.92 116.67 117.18 1ss1 s ASP 38 Ca -0.14 -1.59 0.19 0.00 -0.52 0.00 0.00 52.55 50.50 1ss1 s ASP 38 Cb 0.05 -2.16 0.38 0.00 -1.46 0.00 0.00 42.92 39.73 1ss1 s ASP 38 CO 0.67 -0.73 1.59 1.55 0.52 0.00 0.00 175.17 178.77 1ss1 h PRO 39 N 8.76 0.00 0.00 4.34 0.13 -1.71 -2.99 132.00 140.52 1ss1 h PRO 39 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1ss1 h PRO 39 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ss1 h PRO 39 CO 0.94 0.31 0.00 -1.13 -0.23 0.00 0.00 178.00 177.89 1ss1 n SER 40 N -3.24 0.10 -0.16 1.44 3.41 -1.26 -2.02 113.62 111.89 1ss1 n SER 40 Ca 0.02 0.52 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 1ss1 n SER 40 Cb 0.60 -0.54 0.45 0.00 -0.26 0.00 0.00 64.21 64.45 1ss1 n SER 40 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ss1 n GLN 41 N -1.61 0.63 -0.26 4.33 6.02 -1.13 -4.40 117.38 120.96 1ss1 n GLN 41 Ca 0.04 -0.32 0.07 0.00 -0.01 0.00 0.00 57.00 56.79 1ss1 n GLN 41 Cb 0.22 -1.49 0.15 0.00 1.02 0.00 0.00 30.24 30.14 1ss1 n GLN 41 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1ss1 n SER 42 N -0.91 -0.19 -0.12 1.08 3.41 -0.85 0.81 113.62 116.84 1ss1 n SER 42 Ca 0.12 1.28 -0.11 0.00 -0.26 0.00 0.00 58.87 59.90 1ss1 n SER 42 Cb 0.32 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 63.83 1ss1 n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ss1 h ALA 43 N 1.50 0.50 -0.33 7.33 0.00 -1.86 0.43 119.26 126.83 1ss1 h ALA 43 Ca 0.40 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1ss1 h ALA 43 Cb 0.71 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1ss1 h ALA 43 CO -0.74 0.33 0.10 -0.97 0.00 0.00 0.00 179.25 177.98 1ss1 h ASN 44 N 0.49 0.48 -0.04 0.00 -0.73 0.11 0.71 115.58 116.60 1ss1 h ASN 44 Ca 0.09 -0.20 -0.08 0.00 1.87 0.00 0.00 56.30 57.98 1ss1 h ASN 44 Cb 0.57 -0.12 0.00 0.00 0.27 0.00 0.00 38.32 39.04 1ss1 h ASN 44 CO 0.03 0.55 -0.30 -0.07 -0.37 0.00 0.00 177.43 177.28 1ss1 h LEU 45 N 0.37 0.32 0.20 0.34 -0.00 -0.56 -1.37 115.31 114.62 1ss1 h LEU 45 Ca 0.11 -0.70 -0.00 0.00 -0.00 0.00 0.00 57.88 57.29 1ss1 h LEU 45 Cb 0.25 -0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 40.80 1ss1 h LEU 45 CO -0.00 0.97 -0.15 0.25 -0.00 0.00 0.00 178.44 179.50 1ss1 h LEU 46 N -0.30 -0.39 0.01 1.67 5.85 -0.14 0.32 115.31 122.32 1ss1 h LEU 46 Ca -0.03 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ss1 h LEU 46 Cb 0.98 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1ss1 h LEU 46 CO 0.06 -0.24 -0.00 0.00 -0.34 0.00 0.00 178.44 177.92 1ss1 h ALA 47 N 0.41 -0.01 -0.43 1.25 0.00 -0.96 0.30 119.26 119.82 1ss1 h ALA 47 Ca -0.01 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ss1 h ALA 47 Cb 0.32 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1ss1 h ALA 47 CO -0.01 -0.44 0.21 0.93 0.00 0.00 0.00 179.25 179.95 1ss1 h GLU 48 N -0.14 0.42 -0.37 0.00 4.39 -1.15 0.25 114.58 117.97 1ss1 h GLU 48 Ca -0.00 -0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.54 1ss1 h GLU 48 Cb 0.14 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1ss1 h GLU 48 CO 0.00 0.28 -0.31 0.00 -1.16 0.00 0.00 179.01 177.82 1ss1 h ALA 49 N 1.23 0.76 0.43 3.43 0.00 -0.27 -0.96 119.26 123.88 1ss1 h ALA 49 Ca 0.19 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ss1 h ALA 49 Cb 0.09 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ss1 h ALA 49 CO -0.13 0.66 -0.21 0.87 0.00 0.00 0.00 179.25 180.44 1ss1 h LYS 50 N 0.68 -0.56 -0.52 0.00 1.79 0.07 -1.94 116.57 116.10 1ss1 h LYS 50 Ca 0.08 0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.60 1ss1 h LYS 50 Cb 0.85 0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.60 1ss1 h LYS 50 CO 0.07 -0.25 0.33 0.87 -1.08 0.00 0.00 179.45 179.40 1ss1 h LYS 51 N -0.91 0.65 0.20 3.15 1.57 -0.58 -0.08 116.57 120.57 1ss1 h LYS 51 Ca -0.06 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1ss1 h LYS 51 Cb 0.57 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1ss1 h LYS 51 CO 0.10 0.43 -0.34 1.25 -0.57 0.00 0.00 179.45 180.32 1ss1 h LEU 52 N 0.67 -0.95 -1.84 2.94 5.85 -1.21 -0.70 115.31 120.08 1ss1 h LEU 52 Ca 0.20 0.10 0.04 0.00 0.84 0.00 0.00 57.88 59.05 1ss1 h LEU 52 Cb -0.04 0.34 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1ss1 h LEU 52 CO -0.06 -0.44 0.18 -1.13 -0.34 0.00 0.00 178.44 176.65 1ss1 h ASN 53 N -0.61 0.18 -0.29 1.25 -1.24 -1.17 0.44 115.58 114.14 1ss1 h ASN 53 Ca 0.01 -0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.01 1ss1 h ASN 53 Cb 0.61 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 1ss1 h ASN 53 CO -0.15 0.12 0.13 0.44 -1.29 0.00 0.00 177.43 176.69 1ss1 h ASP 54 N 0.21 0.39 0.74 1.15 5.19 0.38 0.83 116.42 125.30 1ss1 h ASP 54 Ca 0.11 -0.14 -0.25 0.00 -0.62 0.00 0.00 57.03 56.13 1ss1 h ASP 54 Cb 0.20 -0.10 -0.03 0.00 0.18 0.00 0.00 39.33 39.58 1ss1 h ASP 54 CO -0.02 0.42 -1.31 0.00 -3.12 0.00 0.00 179.24 175.21 1ss1 h ALA 55 N 0.98 0.46 -0.42 3.45 0.00 -0.43 -3.32 119.26 119.98 1ss1 h ALA 55 Ca 0.10 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.89 1ss1 h ALA 55 Cb 0.14 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ss1 h ALA 55 CO -0.01 1.33 0.00 0.00 0.00 0.00 0.00 179.25 180.57 1ss1 n GLN 56 N -3.28 2.40 -3.65 0.00 10.64 0.15 -4.93 117.38 118.71 1ss1 n GLN 56 Ca -0.08 -2.14 -0.15 0.00 -1.83 0.00 0.00 57.00 52.80 1ss1 n GLN 56 Cb 0.99 -1.50 -0.08 0.00 -0.86 0.00 0.00 30.24 28.80 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 -1.45 -1.30 -2.40 2.61 0.00 0.29 -4.74 121.76 114.76 1ss1 s ALA 57 Ca 0.39 1.05 0.25 0.00 0.00 0.00 0.00 51.96 53.65 1ss1 s ALA 57 Cb 0.22 -0.26 0.90 0.00 0.00 0.00 0.00 23.12 23.99 1ss1 s ALA 57 CO 0.30 -0.30 1.65 -0.35 0.00 0.00 0.00 175.76 177.07 1ss1 n PRO 58 N 1.64 1.71 -2.30 0.00 -0.04 -1.26 -4.23 135.00 130.51 1ss1 n PRO 58 Ca -0.18 -1.04 -0.01 0.00 -0.04 0.00 0.00 63.50 62.23 1ss1 n PRO 58 Cb 0.56 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 1ss1 n PRO 58 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ss1 n LYS 59 N 0.26 -0.76 0.00 0.54 5.02 -1.26 -5.13 118.16 116.84 1ss1 n LYS 59 Ca 0.18 1.06 0.00 0.00 -2.02 0.00 0.00 58.31 57.53 1ss1 n LYS 59 Cb 0.35 -3.72 0.00 0.00 -0.02 0.00 0.00 35.03 31.64 1ss1 n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88