#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss1 s SER 0 N 0.00 0.36 0.00 1.61 0.15 -1.26 -4.99 113.70 109.57 1ss1 s SER 0 Ca 0.00 -0.20 0.06 0.00 0.70 0.00 0.00 55.95 56.51 1ss1 s SER 0 Cb 0.00 1.11 0.00 0.00 -1.71 0.00 0.00 66.02 65.42 1ss1 s SER 0 CO 0.00 -0.34 0.51 1.07 1.20 0.00 0.00 173.24 175.68 1ss1 n THR 1 N 5.36 0.00 -3.00 6.45 5.66 -1.26 -5.06 114.28 122.43 1ss1 n THR 1 Ca -0.01 -0.44 -0.11 0.00 -3.05 0.00 0.00 64.05 60.44 1ss1 n THR 1 Cb 0.49 1.08 0.01 0.00 -1.55 0.00 0.00 70.33 70.37 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 -0.27 -2.84 0.12 1.79 0.00 -1.26 -4.93 120.51 113.11 1ss1 n ALA 2 Ca 0.03 0.84 -0.06 0.00 0.00 0.00 0.00 53.44 54.25 1ss1 n ALA 2 Cb 0.13 -3.14 -0.03 0.00 0.00 0.00 0.00 19.45 16.41 1ss1 n ALA 2 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1ss1 h ASP 3 N 1.69 -0.32 0.00 0.00 3.58 -1.97 -3.39 116.42 116.02 1ss1 h ASP 3 Ca -0.09 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.37 1ss1 h ASP 3 Cb 1.07 0.08 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1ss1 h ASP 3 CO 0.23 0.09 0.00 -3.20 -2.88 0.00 0.00 179.24 173.48 1ss1 n ASN 4 N -4.79 0.00 -0.05 2.28 5.15 -1.26 -4.75 115.26 111.84 1ss1 n ASN 4 Ca -0.05 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 53.88 1ss1 n ASN 4 Cb 0.15 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.32 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 2.26 0.00 1.20 3.00 -1.26 -4.94 118.16 118.42 1ss1 n LYS 5 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1ss1 n LYS 5 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 35.03 33.76 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 -2.39 0.00 -4.20 5.64 3.72 -1.26 -4.83 117.46 114.13 1ss1 n PHE 6 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1ss1 n PHE 6 Cb 0.84 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.38 1ss1 n PHE 6 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1ss1 n ASN 7 N 0.01 -0.53 0.08 4.37 4.13 -1.26 -2.20 115.26 119.86 1ss1 n ASN 7 Ca 0.00 0.00 -0.06 0.00 1.68 0.00 0.00 54.58 56.20 1ss1 n ASN 7 Cb 0.00 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 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 0.00 0.04 3.52 6.56 -1.98 -2.13 116.57 122.58 1ss1 h LYS 8 Ca 0.00 0.00 -0.12 0.00 -1.06 0.00 0.00 60.65 59.47 1ss1 h LYS 8 Cb 0.00 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.67 1ss1 h LYS 8 CO 0.00 0.91 -0.50 1.05 -2.06 0.00 0.00 179.45 178.85 1ss1 h GLU 9 N 0.00 0.26 0.09 3.15 4.11 -1.97 -3.26 114.58 116.96 1ss1 h GLU 9 Ca -0.01 -0.34 -0.27 0.00 0.07 0.00 0.00 59.36 58.82 1ss1 h GLU 9 Cb 1.61 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.96 1ss1 h GLU 9 CO 0.12 1.08 -1.26 1.96 0.07 0.00 0.00 179.01 180.98 1ss1 h GLN 10 N -0.39 0.19 0.00 1.06 1.08 -1.58 -3.29 115.11 112.18 1ss1 h GLN 10 Ca -0.07 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 56.80 1ss1 h GLN 10 Cb 1.28 0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.83 1ss1 h GLN 10 CO 0.10 1.11 -0.03 0.37 -0.95 0.00 0.00 178.83 179.43 1ss1 h GLN 11 N 0.05 0.00 -0.85 1.46 4.15 -1.49 -1.82 115.11 116.60 1ss1 h GLN 11 Ca -0.13 0.00 0.20 0.00 0.77 0.00 0.00 58.65 59.49 1ss1 h GLN 11 Cb 1.93 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 29.57 1ss1 h GLN 11 CO 0.17 0.03 0.58 -0.91 -1.93 0.00 0.00 178.83 176.77 1ss1 h ASN 12 N 0.00 0.30 -0.95 -0.69 4.21 -1.62 0.37 115.58 117.20 1ss1 h ASN 12 Ca -0.00 0.03 0.12 0.00 1.21 0.00 0.00 56.30 57.66 1ss1 h ASN 12 Cb 0.08 -0.03 -0.08 0.00 -1.12 0.00 0.00 38.32 37.18 1ss1 h ASN 12 CO 0.00 0.12 0.60 0.00 -1.29 0.00 0.00 177.43 176.87 1ss1 h ALA 13 N 1.61 1.63 0.18 -0.83 0.00 -1.56 -2.08 119.26 118.21 1ss1 h ALA 13 Ca 0.43 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.37 1ss1 h ALA 13 Cb 1.22 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1ss1 h ALA 13 CO -0.13 0.14 -0.34 0.35 0.00 0.00 0.00 179.25 179.27 1ss1 h PHE 14 N 0.89 -0.94 0.63 0.00 3.57 -0.44 0.51 116.94 121.16 1ss1 h PHE 14 Ca 0.46 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.95 1ss1 h PHE 14 Cb 0.53 0.39 0.01 0.00 2.79 0.00 0.00 35.95 39.66 1ss1 h PHE 14 CO -0.00 -0.46 -0.30 -1.49 -2.23 0.00 0.00 178.31 173.83 1ss1 h TRP 15 N -0.61 -0.78 -0.26 0.41 4.06 -1.53 0.57 115.95 117.82 1ss1 h TRP 15 Ca 0.02 -0.02 0.07 0.00 2.06 0.00 0.00 58.89 61.02 1ss1 h TRP 15 Cb 0.61 0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 29.02 1ss1 h TRP 15 CO -0.28 -0.46 0.27 1.49 -3.56 0.00 0.00 178.44 175.91 1ss1 h GLU 16 N -0.93 0.00 0.08 0.49 4.22 -1.34 1.08 114.58 118.18 1ss1 h GLU 16 Ca -0.09 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.23 1ss1 h GLU 16 Cb 0.67 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.94 1ss1 h GLU 16 CO 0.14 0.00 -0.55 0.82 -2.18 0.00 0.00 179.01 177.25 1ss1 h ILE 17 N 0.00 1.57 -0.15 2.32 2.04 0.48 -1.46 117.51 122.31 1ss1 h ILE 17 Ca 0.12 -2.37 -0.11 0.00 1.00 0.00 0.00 64.86 63.50 1ss1 h ILE 17 Cb 0.65 3.11 -0.01 0.00 -0.74 0.00 0.00 36.82 39.84 1ss1 h ILE 17 CO -0.00 0.66 -0.41 -0.07 0.00 0.00 0.00 178.15 178.33 1ss1 h LEU 18 N -0.49 0.35 0.02 1.44 -0.00 0.23 -3.32 115.31 113.55 1ss1 h LEU 18 Ca -0.09 -0.15 -0.00 0.00 -0.00 0.00 0.00 57.88 57.64 1ss1 h LEU 18 Cb 1.39 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 1ss1 h LEU 18 CO 0.10 0.73 -0.01 0.45 -0.00 0.00 0.00 178.44 179.71 1ss1 h HIS 19 N 0.28 -0.03 -7.08 1.13 3.86 0.99 -3.47 115.15 110.84 1ss1 h HIS 19 Ca 0.03 -0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.07 1ss1 h HIS 19 Cb 0.84 0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.31 1ss1 h HIS 19 CO 0.02 -0.02 -0.28 1.28 0.86 0.00 0.00 177.93 179.80 1ss1 n LEU 20 N -3.96 -0.06 -4.56 2.43 4.77 -0.55 -4.66 117.00 110.42 1ss1 n LEU 20 Ca -0.00 -0.36 -0.19 0.00 -0.03 0.00 0.00 56.01 55.43 1ss1 n LEU 20 Cb 0.01 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.60 1ss1 n LEU 20 CO 0.01 0.22 1.29 -2.84 -1.33 0.00 0.00 177.39 174.74 1ss1 s PRO 21 N -5.49 1.93 0.00 3.23 0.02 -1.26 -1.63 135.00 131.80 1ss1 s PRO 21 Ca 0.12 0.28 0.00 0.00 0.02 0.00 0.00 61.00 61.41 1ss1 s PRO 21 Cb -0.07 -4.86 0.00 0.00 0.02 0.00 0.00 34.50 29.60 1ss1 s PRO 21 CO 0.27 -4.05 0.00 -1.71 -0.33 0.00 0.00 177.00 171.18 1ss1 n ASN 22 N 17.01 0.00 -4.32 2.53 5.15 -1.26 -5.05 115.26 129.32 1ss1 n ASN 22 Ca 0.44 0.00 -0.24 0.00 -0.60 0.00 0.00 54.58 54.18 1ss1 n ASN 22 Cb 0.45 0.00 -0.12 0.00 -0.53 0.00 0.00 39.78 39.58 1ss1 n ASN 22 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1ss1 s LEU 23 N 0.00 2.36 -0.21 1.20 0.20 -0.65 -3.45 118.68 118.13 1ss1 s LEU 23 Ca 0.00 -0.76 -0.32 0.00 0.69 0.00 0.00 54.13 53.73 1ss1 s LEU 23 Cb 0.00 -0.91 -0.09 0.00 -0.43 0.00 0.00 46.19 44.76 1ss1 s LEU 23 CO 0.00 0.04 2.10 -3.20 -0.29 0.00 0.00 176.35 175.00 1ss1 n ASN 24 N 0.74 2.99 0.29 3.68 5.15 -1.26 -4.76 115.26 122.10 1ss1 n ASN 24 Ca -0.17 0.53 0.17 0.00 -0.60 0.00 0.00 54.58 54.52 1ss1 n ASN 24 Cb 0.55 -1.40 0.88 0.00 -0.53 0.00 0.00 39.78 39.27 1ss1 n ASN 24 CO 0.00 0.00 0.00 1.05 1.40 0.00 0.00 177.26 179.71 1ss1 h GLU 25 N 12.27 0.00 0.00 1.20 -0.00 -1.95 1.56 114.58 127.67 1ss1 h GLU 25 Ca -0.39 0.00 -0.10 0.00 -0.00 0.00 0.00 59.36 58.87 1ss1 h GLU 25 Cb 1.28 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 30.01 1ss1 h GLU 25 CO 0.97 0.00 -0.47 0.93 -0.00 0.00 0.00 179.01 180.45 1ss1 h GLU 26 N 0.00 0.00 -0.04 1.06 5.08 -2.00 0.50 114.58 119.18 1ss1 h GLU 26 Ca 0.03 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.19 1ss1 h GLU 26 Cb 0.59 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1ss1 h GLU 26 CO -0.00 0.47 -0.84 1.96 -1.00 0.00 0.00 179.01 179.59 1ss1 h GLN 27 N 0.00 0.43 0.44 2.33 4.20 0.18 -2.46 115.11 120.23 1ss1 h GLN 27 Ca -0.00 -0.40 -0.02 0.00 0.06 0.00 0.00 58.65 58.28 1ss1 h GLN 27 Cb 0.91 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.79 1ss1 h GLN 27 CO 0.06 1.06 -0.25 0.00 -0.67 0.00 0.00 178.83 179.03 1ss1 h ARG 28 N 0.27 -0.62 -0.41 1.46 3.08 -0.17 -1.03 114.38 116.96 1ss1 h ARG 28 Ca -0.06 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.12 1ss1 h ARG 28 Cb 1.45 0.14 -0.09 0.00 0.08 0.00 0.00 29.97 31.55 1ss1 h ARG 28 CO 0.15 -0.42 -0.25 -0.97 -1.07 0.00 0.00 179.97 177.41 1ss1 h ASN 29 N -0.65 -0.85 -0.91 7.04 -1.24 -0.91 0.48 115.58 118.54 1ss1 h ASN 29 Ca -0.05 0.17 0.18 0.00 0.71 0.00 0.00 56.30 57.31 1ss1 h ASN 29 Cb 0.52 0.43 -0.07 0.00 0.73 0.00 0.00 38.32 39.92 1ss1 h ASN 29 CO 0.07 -0.27 0.59 1.23 -1.29 0.00 0.00 177.43 177.76 1ss1 h GLY 30 N -0.18 1.10 1.85 1.57 0.00 -1.16 0.33 103.07 106.57 1ss1 h GLY 30 Ca 0.19 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1ss1 h GLY 30 CO -0.51 0.01 -0.43 0.74 0.00 0.00 0.00 176.54 176.35 1ss1 h PHE 31 N 0.54 0.20 -0.19 5.60 0.04 0.12 -2.24 116.94 121.01 1ss1 h PHE 31 Ca 0.48 -0.05 -0.06 0.00 2.80 0.00 0.00 57.97 61.14 1ss1 h PHE 31 Cb 1.00 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 39.11 1ss1 h PHE 31 CO -0.00 0.58 -0.10 0.82 -0.60 0.00 0.00 178.31 179.00 1ss1 h ILE 32 N 0.14 1.31 -0.02 -0.55 2.04 0.18 0.85 117.51 121.46 1ss1 h ILE 32 Ca 0.01 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.70 1ss1 h ILE 32 Cb 0.83 1.67 -0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1ss1 h ILE 32 CO 0.06 0.35 0.01 1.56 0.00 0.00 0.00 178.15 180.13 1ss1 h GLN 33 N 0.10 0.03 -0.77 2.37 1.08 -1.30 0.83 115.11 117.45 1ss1 h GLN 33 Ca 0.04 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 1ss1 h GLN 33 Cb 0.59 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.98 1ss1 h GLN 33 CO 0.03 0.22 0.32 1.03 -0.95 0.00 0.00 178.83 179.48 1ss1 h SER 34 N -0.16 1.04 -0.04 1.46 0.87 -1.44 -2.23 113.55 113.05 1ss1 h SER 34 Ca 0.01 -0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.38 1ss1 h SER 34 Cb 0.20 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1ss1 h SER 34 CO -0.00 0.91 -0.14 0.25 -0.53 0.00 0.00 176.83 177.32 1ss1 h LEU 35 N 1.11 0.19 0.34 2.23 5.85 -0.66 -3.14 115.31 121.24 1ss1 h LEU 35 Ca 0.26 -0.63 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 1ss1 h LEU 35 Cb 0.19 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1ss1 h LEU 35 CO -0.02 0.79 -0.49 0.50 -0.34 0.00 0.00 178.44 178.87 1ss1 h LYS 36 N -0.40 -0.84 0.00 1.25 1.63 0.79 -0.62 116.57 118.38 1ss1 h LYS 36 Ca -0.01 0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1ss1 h LYS 36 Cb 0.77 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.60 1ss1 h LYS 36 CO 0.03 -0.56 0.27 0.22 -3.45 0.00 0.00 179.45 175.96 1ss1 h ASP 37 N -0.87 0.00 -2.49 4.20 3.58 -1.53 -3.37 116.42 115.94 1ss1 h ASP 37 Ca -0.04 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.09 1ss1 h ASP 37 Cb 0.80 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 41.49 1ss1 h ASP 37 CO -0.14 0.00 -0.62 -0.62 -2.88 0.00 0.00 179.24 174.98 1ss1 s ASP 38 N -4.27 1.37 0.34 2.28 -1.08 -0.24 -4.94 116.67 110.12 1ss1 s ASP 38 Ca -0.03 -0.24 0.18 0.00 -0.52 0.00 0.00 52.55 51.94 1ss1 s ASP 38 Cb 0.08 0.40 0.35 0.00 -1.46 0.00 0.00 42.92 42.29 1ss1 s ASP 38 CO 0.25 -0.33 1.58 1.55 0.52 0.00 0.00 175.17 178.74 1ss1 h PRO 39 N 8.31 0.00 0.00 4.34 0.13 -1.72 -2.84 132.00 140.22 1ss1 h PRO 39 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1ss1 h PRO 39 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1ss1 h PRO 39 CO 0.29 0.40 0.00 1.03 -0.23 0.00 0.00 178.00 179.48 1ss1 h SER 40 N 0.00 0.00 0.54 1.44 0.87 -1.88 -2.02 113.55 112.50 1ss1 h SER 40 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ss1 h SER 40 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 1ss1 h SER 40 CO 0.05 0.00 -0.44 0.00 -0.53 0.00 0.00 176.83 175.91 1ss1 n GLN 41 N -2.65 0.02 -0.26 2.24 1.13 -1.07 -4.18 117.38 112.62 1ss1 n GLN 41 Ca 0.02 -0.01 0.33 0.00 -1.94 0.00 0.00 57.00 55.40 1ss1 n GLN 41 Cb 0.32 -1.50 0.67 0.00 0.11 0.00 0.00 30.24 29.84 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 0.03 0.00 0.11 1.08 4.64 -1.40 0.51 113.55 118.52 1ss1 h SER 42 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 1ss1 h SER 42 Cb 0.50 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.61 1ss1 h SER 42 CO 0.00 0.00 -0.87 0.00 -0.87 0.00 0.00 176.83 175.09 1ss1 h ALA 43 N 1.10 -0.05 -0.47 5.18 0.00 -1.81 -0.97 119.26 122.23 1ss1 h ALA 43 Ca 0.52 -0.69 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 1ss1 h ALA 43 Cb 2.45 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 20.32 1ss1 h ALA 43 CO -0.01 0.43 -0.23 -0.97 0.00 0.00 0.00 179.25 178.48 1ss1 h ASN 44 N -0.19 1.01 0.01 0.00 -1.24 -0.38 -0.36 115.58 114.43 1ss1 h ASN 44 Ca -0.14 -0.39 -0.04 0.00 0.71 0.00 0.00 56.30 56.44 1ss1 h ASN 44 Cb 1.64 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 40.41 1ss1 h ASN 44 CO 0.16 1.18 -0.17 -0.07 -1.29 0.00 0.00 177.43 177.25 1ss1 h LEU 45 N 0.84 0.12 -1.25 0.34 -0.00 -1.03 -2.12 115.31 112.21 1ss1 h LEU 45 Ca 0.11 -0.86 -0.01 0.00 -0.00 0.00 0.00 57.88 57.11 1ss1 h LEU 45 Cb 0.81 -0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 41.40 1ss1 h LEU 45 CO 0.07 0.97 0.32 0.25 -0.00 0.00 0.00 178.44 180.05 1ss1 h LEU 46 N -0.71 0.74 -0.07 1.67 5.85 -1.23 0.32 115.31 121.88 1ss1 h LEU 46 Ca -0.02 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.56 1ss1 h LEU 46 Cb 1.01 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1ss1 h LEU 46 CO 0.03 0.61 -0.26 0.00 -0.34 0.00 0.00 178.44 178.48 1ss1 h ALA 47 N 1.51 0.13 -0.59 1.25 0.00 -1.15 -1.16 119.26 119.26 1ss1 h ALA 47 Ca 0.21 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1ss1 h ALA 47 Cb 0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ss1 h ALA 47 CO -0.03 0.14 0.02 0.93 0.00 0.00 0.00 179.25 180.31 1ss1 h GLU 48 N -0.18 1.01 -0.35 0.00 4.39 -1.15 -1.41 114.58 116.89 1ss1 h GLU 48 Ca -0.01 -0.30 -0.11 0.00 0.34 0.00 0.00 59.36 59.28 1ss1 h GLU 48 Cb 0.90 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1ss1 h GLU 48 CO 0.06 0.98 -0.22 0.00 -1.16 0.00 0.00 179.01 178.66 1ss1 h ALA 49 N 1.08 0.50 0.54 3.43 0.00 -0.41 -1.73 119.26 122.66 1ss1 h ALA 49 Ca 0.17 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ss1 h ALA 49 Cb 0.51 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ss1 h ALA 49 CO 0.02 0.46 -0.26 0.87 0.00 0.00 0.00 179.25 180.35 1ss1 h LYS 50 N 0.54 -0.70 -0.32 0.00 1.79 -1.07 -1.82 116.57 115.00 1ss1 h LYS 50 Ca 0.07 0.05 0.05 0.00 -2.18 0.00 0.00 60.65 58.64 1ss1 h LYS 50 Cb 0.77 0.16 -0.05 0.00 -1.58 0.00 0.00 32.23 31.54 1ss1 h LYS 50 CO 0.06 -0.40 0.03 0.87 -1.08 0.00 0.00 179.45 178.93 1ss1 h LYS 51 N -0.91 0.12 -0.44 3.15 1.57 -1.33 -2.26 116.57 116.48 1ss1 h LYS 51 Ca -0.07 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.77 1ss1 h LYS 51 Cb 0.62 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.84 1ss1 h LYS 51 CO 0.12 0.08 0.05 1.25 -0.57 0.00 0.00 179.45 180.38 1ss1 h LEU 52 N 0.13 -0.08 -0.90 2.94 6.46 -1.31 0.34 115.31 122.90 1ss1 h LEU 52 Ca 0.15 0.09 0.12 0.00 -0.12 0.00 0.00 57.88 58.12 1ss1 h LEU 52 Cb 0.19 0.14 -0.08 0.00 -0.73 0.00 0.00 40.66 40.17 1ss1 h LEU 52 CO -0.23 -0.00 0.52 -0.55 -0.62 0.00 0.00 178.44 177.55 1ss1 h ASN 53 N 0.17 0.72 1.15 1.25 -1.07 -0.76 0.48 115.58 117.52 1ss1 h ASN 53 Ca 0.22 0.06 -0.09 0.00 0.07 0.00 0.00 56.30 56.56 1ss1 h ASN 53 Cb 0.29 -0.07 -0.01 0.00 -2.07 0.00 0.00 38.32 36.46 1ss1 h ASN 53 CO -0.32 0.37 -0.41 -2.24 0.07 0.00 0.00 177.43 174.90 1ss1 h ASP 54 N 0.80 0.00 0.53 6.14 3.04 -0.85 0.46 116.42 126.54 1ss1 h ASP 54 Ca 0.46 0.00 -0.29 0.00 -3.24 0.00 0.00 57.03 53.96 1ss1 h ASP 54 Cb 0.52 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.79 1ss1 h ASP 54 CO -0.29 0.41 -1.48 0.00 -2.04 0.00 0.00 179.24 175.84 1ss1 h ALA 55 N 1.59 0.33 -0.04 4.15 0.00 0.75 -3.35 119.26 122.69 1ss1 h ALA 55 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 1ss1 h ALA 55 Cb 1.10 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1ss1 h ALA 55 CO 0.05 1.20 0.00 0.00 0.00 0.00 0.00 179.25 180.50 1ss1 n GLN 56 N -3.40 1.38 -0.42 0.00 10.64 0.15 -5.02 117.38 120.71 1ss1 n GLN 56 Ca -0.14 -1.53 -0.19 0.00 -1.83 0.00 0.00 57.00 53.32 1ss1 n GLN 56 Cb 1.03 -1.32 -0.04 0.00 -0.86 0.00 0.00 30.24 29.05 1ss1 n GLN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ss1 n ALA 57 N 0.95 0.07 1.66 2.61 0.00 0.16 -4.73 120.51 121.23 1ss1 n ALA 57 Ca 0.10 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1ss1 n ALA 57 Cb 0.42 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1ss1 n ALA 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ss1 n PRO 58 N 2.47 0.93 0.00 0.00 -0.04 -1.25 -4.76 135.00 132.35 1ss1 n PRO 58 Ca 0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1ss1 n PRO 58 Cb -0.01 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 -0.38 3.42 -0.65 0.54 2.85 -1.26 -5.15 118.16 117.52 1ss1 n LYS 59 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1ss1 n LYS 59 Cb 0.05 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.43 1ss1 n LYS 59 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35