#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h0t s ASP 2 N 0.00 6.60 0.37 4.52 2.15 -1.26 -4.91 116.67 124.14 1h0t s ASP 2 Ca 0.00 0.37 0.05 0.00 0.43 0.00 0.00 52.55 53.40 1h0t s ASP 2 Cb 0.00 -2.52 0.72 0.00 -0.30 0.00 0.00 42.92 40.82 1h0t s ASP 2 CO 0.00 -1.19 1.99 0.78 -0.17 0.00 0.00 175.17 176.58 1h0t h ASN 3 N 9.17 0.55 0.49 -0.34 2.35 -2.06 -1.46 115.58 124.28 1h0t h ASN 3 Ca -0.23 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.46 1h0t h ASN 3 Cb 1.06 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.29 1h0t h ASN 3 CO 1.10 0.46 -0.31 0.50 -1.65 0.00 0.00 177.43 177.53 1h0t h LYS 4 N 0.62 -0.72 0.00 0.81 3.64 -2.01 -2.93 116.57 115.98 1h0t h LYS 4 Ca 0.16 0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 1h0t h LYS 4 Cb 0.05 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1h0t h LYS 4 CO -0.02 -0.48 -0.21 0.74 -2.27 0.00 0.00 179.45 177.20 1h0t h PHE 5 N -0.75 0.00 -0.24 1.91 0.04 -1.88 -0.14 116.94 115.88 1h0t h PHE 5 Ca -0.07 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.76 1h0t h PHE 5 Cb 0.60 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.69 1h0t h PHE 5 CO -0.02 0.21 -0.17 -0.97 -0.60 0.00 0.00 178.31 176.76 1h0t h ASN 6 N 0.00 -0.55 0.49 2.17 -0.73 -1.08 -2.65 115.58 113.22 1h0t h ASN 6 Ca -0.00 0.11 -0.01 0.00 1.87 0.00 0.00 56.30 58.27 1h0t h ASN 6 Cb 0.48 0.28 -0.00 0.00 0.27 0.00 0.00 38.32 39.35 1h0t h ASN 6 CO 0.03 -0.21 -1.52 1.17 -0.37 0.00 0.00 177.43 176.52 1h0t n LYS 7 N -5.33 0.63 -0.01 6.67 0.00 -1.16 -4.28 118.16 114.69 1h0t n LYS 7 Ca -0.01 -0.03 0.01 0.00 0.00 0.00 0.00 58.31 58.28 1h0t n LYS 7 Cb 0.24 -1.67 0.34 0.00 0.00 0.00 0.00 35.03 33.94 1h0t n LYS 7 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1h0t h GLU 8 N 0.00 0.55 -0.73 1.64 4.39 -0.85 0.37 114.58 119.94 1h0t h GLU 8 Ca -0.01 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 1h0t h GLU 8 Cb 1.04 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.56 1h0t h GLU 8 CO 0.00 0.49 0.41 1.96 -1.16 0.00 0.00 179.01 180.71 1h0t h GLN 9 N 0.54 1.01 0.22 2.33 4.20 -1.66 0.61 115.11 122.36 1h0t h GLN 9 Ca 0.13 -0.11 -0.32 0.00 0.06 0.00 0.00 58.65 58.41 1h0t h GLN 9 Cb 0.18 -0.20 0.03 0.00 0.30 0.00 0.00 27.48 27.80 1h0t h GLN 9 CO -0.01 0.74 -1.42 -0.56 -0.67 0.00 0.00 178.83 176.91 1h0t h GLN 10 N 1.02 0.53 -0.51 1.46 -0.00 -1.46 -0.54 115.11 115.60 1h0t h GLN 10 Ca 0.26 -0.86 -0.05 0.00 -0.00 0.00 0.00 58.65 58.00 1h0t h GLN 10 Cb 0.02 0.31 -0.02 0.00 -0.00 0.00 0.00 27.48 27.79 1h0t h GLN 10 CO -0.04 1.41 0.12 -0.97 -0.00 0.00 0.00 178.83 179.34 1h0t h ASN 11 N 0.16 0.78 -0.25 0.06 -1.24 0.04 0.59 115.58 115.72 1h0t h ASN 11 Ca -0.23 -0.24 -0.05 0.00 0.71 0.00 0.00 56.30 56.50 1h0t h ASN 11 Cb 2.11 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 40.94 1h0t h ASN 11 CO 0.26 0.82 -0.02 0.00 -1.29 0.00 0.00 177.43 177.20 1h0t h ALA 12 N 0.99 0.34 0.30 1.57 0.00 0.14 0.22 119.26 122.83 1h0t h ALA 12 Ca 0.16 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1h0t h ALA 12 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1h0t h ALA 12 CO 0.00 0.10 -0.25 0.35 0.00 0.00 0.00 179.25 179.45 1h0t h PHE 13 N 0.21 -0.66 -0.07 0.00 3.57 -0.87 0.28 116.94 119.40 1h0t h PHE 13 Ca 0.07 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.61 1h0t h PHE 13 Cb 0.46 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.39 1h0t h PHE 13 CO 0.04 -0.37 -0.34 -0.92 -2.23 0.00 0.00 178.31 174.49 1h0t h TYR 14 N -0.56 -0.94 -0.67 0.41 3.20 0.26 -0.47 116.97 118.20 1h0t h TYR 14 Ca -0.02 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.90 1h0t h TYR 14 Cb 0.50 0.42 -0.03 0.00 1.54 0.00 0.00 36.73 39.16 1h0t h TYR 14 CO -0.14 -0.42 0.44 0.93 -1.64 0.00 0.00 178.16 177.33 1h0t h GLU 15 N -0.45 0.87 -0.64 1.82 4.39 -0.34 0.37 114.58 120.60 1h0t h GLU 15 Ca 0.08 -0.05 0.11 0.00 0.34 0.00 0.00 59.36 59.83 1h0t h GLU 15 Cb 0.57 -0.20 -0.08 0.00 -0.10 0.00 0.00 28.75 28.94 1h0t h GLU 15 CO -0.32 0.58 0.23 0.82 -1.16 0.00 0.00 179.01 179.15 1h0t h ILE 16 N 0.90 0.73 -0.29 3.13 2.04 0.33 0.32 117.51 124.66 1h0t h ILE 16 Ca 0.25 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.86 1h0t h ILE 16 Cb -0.10 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1h0t h ILE 16 CO -0.06 0.07 -0.25 -0.07 0.00 0.00 0.00 178.15 177.85 1h0t h LEU 17 N 0.40 0.72 -0.97 1.44 3.38 -0.26 -3.22 115.31 116.80 1h0t h LEU 17 Ca 0.33 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1h0t h LEU 17 Cb 0.44 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1h0t h LEU 17 CO -0.34 1.03 -0.18 0.45 0.09 0.00 0.00 178.44 179.48 1h0t h HIS 18 N 0.43 0.00 -2.10 1.13 3.86 0.56 -3.45 115.15 115.58 1h0t h HIS 18 Ca 0.05 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.66 1h0t h HIS 18 Cb 0.81 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.29 1h0t h HIS 18 CO 0.07 0.18 1.14 1.28 0.86 0.00 0.00 177.93 181.46 1h0t n LEU 19 N -3.29 3.62 0.30 2.43 4.77 0.10 -4.86 117.00 120.07 1h0t n LEU 19 Ca 0.01 0.95 0.20 0.00 -0.03 0.00 0.00 56.01 57.14 1h0t n LEU 19 Cb 0.44 -1.41 0.93 0.00 -2.33 0.00 0.00 43.42 41.06 1h0t n LEU 19 CO 0.33 0.01 1.08 1.55 -1.33 0.00 0.00 177.39 179.02 1h0t h PRO 20 N 9.59 0.00 -0.34 3.23 0.13 -1.90 -2.89 132.00 139.82 1h0t h PRO 20 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1h0t h PRO 20 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1h0t h PRO 20 CO 0.95 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.81 1h0t n ASN 21 N -3.03 2.91 -4.77 1.44 3.02 -1.26 -4.97 115.26 108.59 1h0t n ASN 21 Ca -0.01 -1.93 -0.39 0.00 -0.03 0.00 0.00 54.58 52.22 1h0t n ASN 21 Cb 0.19 -0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 1h0t n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1h0t s LEU 22 N -1.01 4.45 0.00 3.41 1.43 -1.09 -4.73 118.68 121.14 1h0t s LEU 22 Ca 0.25 1.22 0.02 0.00 -1.03 0.00 0.00 54.13 54.59 1h0t s LEU 22 Cb 0.13 -2.94 0.02 0.00 0.03 0.00 0.00 46.19 43.43 1h0t s LEU 22 CO 0.18 0.15 0.16 -0.46 0.23 0.00 0.00 176.35 176.61 1h0t n ASN 23 N 2.43 1.61 -0.26 2.29 0.23 -1.26 -4.80 115.26 115.49 1h0t n ASN 23 Ca -0.08 -1.71 -0.05 0.00 -0.53 0.00 0.00 54.58 52.21 1h0t n ASN 23 Cb 0.51 -0.02 0.09 0.00 -2.08 0.00 0.00 39.78 38.27 1h0t n ASN 23 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1h0t h GLU 24 N 0.00 1.13 -0.26 -3.83 5.08 -1.97 0.38 114.58 115.12 1h0t h GLU 24 Ca -0.13 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 1h0t h GLU 24 Cb 0.48 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1h0t h GLU 24 CO 0.20 0.94 0.11 1.49 -1.00 0.00 0.00 179.01 180.75 1h0t h GLU 25 N 1.10 0.38 0.11 2.33 4.81 -1.98 -0.79 114.58 120.54 1h0t h GLU 25 Ca 0.25 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1h0t h GLU 25 Cb 0.25 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1h0t h GLU 25 CO -0.02 0.41 -0.05 1.96 -0.73 0.00 0.00 179.01 180.58 1h0t h GLN 26 N 0.26 -0.14 -0.23 1.92 1.08 -1.91 -2.88 115.11 113.23 1h0t h GLN 26 Ca 0.09 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 1h0t h GLN 26 Cb 0.17 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 1h0t h GLN 26 CO -0.01 0.30 0.12 -0.09 -0.95 0.00 0.00 178.83 178.20 1h0t h ARG 27 N -0.93 0.32 -0.39 1.46 2.43 -0.33 -1.50 114.38 115.44 1h0t h ARG 27 Ca -0.01 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.03 1h0t h ARG 27 Cb 0.50 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1h0t h ARG 27 CO 0.02 0.32 -0.08 -0.91 -1.51 0.00 0.00 179.97 177.81 1h0t h ASN 28 N 0.25 0.75 -0.73 -3.80 2.35 -1.28 -1.46 115.58 111.65 1h0t h ASN 28 Ca 0.08 -0.36 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1h0t h ASN 28 Cb 0.10 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 1h0t h ASN 28 CO -0.01 0.93 0.46 0.00 -1.65 0.00 0.00 177.43 177.16 1h0t h ALA 29 N 0.84 1.43 -0.32 -0.83 0.00 -1.49 -0.84 119.26 118.06 1h0t h ALA 29 Ca 0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1h0t h ALA 29 Cb 0.60 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1h0t h ALA 29 CO 0.04 0.51 0.13 0.74 0.00 0.00 0.00 179.25 180.67 1h0t h PHE 30 N 1.01 0.48 0.00 0.00 0.04 -0.96 0.27 116.94 117.79 1h0t h PHE 30 Ca 0.27 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.98 1h0t h PHE 30 Cb -0.07 -0.15 -0.00 0.00 2.20 0.00 0.00 35.95 37.93 1h0t h PHE 30 CO 0.00 0.45 -0.09 0.82 -0.60 0.00 0.00 178.31 178.89 1h0t h ILE 31 N 0.37 0.86 -0.00 -0.55 2.04 -0.55 0.71 117.51 120.39 1h0t h ILE 31 Ca 0.11 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1h0t h ILE 31 Cb 0.17 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1h0t h ILE 31 CO -0.01 0.09 -0.02 1.56 0.00 0.00 0.00 178.15 179.77 1h0t h GLN 32 N 0.00 0.02 0.00 2.37 4.20 -0.06 0.15 115.11 121.78 1h0t h GLN 32 Ca -0.00 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1h0t h GLN 32 Cb 0.19 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1h0t h GLN 32 CO 0.01 0.69 -0.32 0.66 -0.67 0.00 0.00 178.83 179.21 1h0t h SER 33 N -0.65 0.00 0.12 1.46 4.64 -0.56 -2.58 113.55 115.99 1h0t h SER 33 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1h0t h SER 33 Cb 0.70 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.81 1h0t h SER 33 CO 0.00 0.32 -0.72 0.25 -0.87 0.00 0.00 176.83 175.82 1h0t h LEU 34 N 0.00 0.40 -1.41 5.97 5.85 0.42 -1.06 115.31 125.48 1h0t h LEU 34 Ca -0.00 -0.96 -0.06 0.00 0.84 0.00 0.00 57.88 57.70 1h0t h LEU 34 Cb 0.58 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1h0t h LEU 34 CO 0.04 1.34 -0.30 0.11 -0.34 0.00 0.00 178.44 179.30 1h0t h LYS 35 N -0.46 0.00 0.01 1.25 1.57 -0.69 -3.09 116.57 115.16 1h0t h LYS 35 Ca -0.13 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.35 1h0t h LYS 35 Cb 1.56 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.82 1h0t h LYS 35 CO 0.13 0.30 -1.82 -0.25 -0.57 0.00 0.00 179.45 177.24 1h0t n ASP 36 N -4.13 0.89 -4.03 0.86 8.00 -0.98 -4.79 116.55 112.37 1h0t n ASP 36 Ca -0.02 0.35 -0.31 0.00 0.71 0.00 0.00 54.79 55.51 1h0t n ASP 36 Cb 0.35 -0.02 -0.15 0.00 -0.02 0.00 0.00 41.12 41.28 1h0t n ASP 36 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1h0t s ASP 37 N -6.11 4.64 0.17 -2.24 -1.08 -0.40 -4.98 116.67 106.68 1h0t s ASP 37 Ca -0.07 -1.90 -0.07 0.00 -0.52 0.00 0.00 52.55 49.99 1h0t s ASP 37 Cb 0.08 -1.59 0.06 0.00 -1.46 0.00 0.00 42.92 40.01 1h0t s ASP 37 CO 0.82 -0.32 1.53 1.55 0.52 0.00 0.00 175.17 179.27 1h0t h PRO 38 N 7.67 0.82 -0.38 4.34 0.13 -1.84 -3.16 132.00 139.58 1h0t h PRO 38 Ca -0.09 -0.41 -0.09 0.00 -0.87 0.00 0.00 66.00 64.54 1h0t h PRO 38 Cb 1.03 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.15 1h0t h PRO 38 CO 0.50 1.05 -0.14 1.03 -0.23 0.00 0.00 178.00 180.21 1h0t h SER 39 N 0.67 0.67 0.11 1.44 0.87 -1.93 -2.77 113.55 112.61 1h0t h SER 39 Ca 0.06 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 1h0t h SER 39 Cb 0.93 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1h0t h SER 39 CO 0.09 0.83 -0.01 1.67 -0.53 0.00 0.00 176.83 178.87 1h0t n GLN 40 N -4.16 0.99 -0.18 2.24 7.27 -1.22 -4.26 117.38 118.06 1h0t n GLN 40 Ca 0.01 -0.17 -0.03 0.00 0.07 0.00 0.00 57.00 56.88 1h0t n GLN 40 Cb 0.36 -1.50 0.07 0.00 2.41 0.00 0.00 30.24 31.59 1h0t n GLN 40 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 1h0t h SER 41 N 0.41 0.32 -0.29 1.69 0.02 -1.46 0.50 113.55 114.74 1h0t h SER 41 Ca 0.00 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1h0t h SER 41 Cb 0.15 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1h0t h SER 41 CO 0.00 0.21 0.17 0.00 -1.14 0.00 0.00 176.83 176.07 1h0t h ALA 42 N 1.32 0.38 -0.87 3.77 0.00 -1.81 0.16 119.26 122.20 1h0t h ALA 42 Ca 0.25 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1h0t h ALA 42 Cb 0.21 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1h0t h ALA 42 CO -0.21 -0.10 0.57 -0.91 0.00 0.00 0.00 179.25 178.61 1h0t h ASN 43 N 0.36 0.94 -0.68 0.00 -0.26 -1.69 0.39 115.58 114.64 1h0t h ASN 43 Ca 0.10 -0.01 -0.05 0.00 -0.56 0.00 0.00 56.30 55.79 1h0t h ASN 43 Cb 0.05 -0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 1h0t h ASN 43 CO -0.02 0.65 0.24 -0.07 -1.06 0.00 0.00 177.43 177.17 1h0t h LEU 44 N 1.09 0.97 -0.01 1.61 3.38 0.91 0.69 115.31 123.96 1h0t h LEU 44 Ca 0.35 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1h0t h LEU 44 Cb 0.02 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1h0t h LEU 44 CO -0.10 0.90 -0.00 0.25 0.09 0.00 0.00 178.44 179.58 1h0t h LEU 45 N 0.98 0.01 -0.67 1.67 5.85 0.37 0.16 115.31 123.68 1h0t h LEU 45 Ca 0.22 -0.37 0.12 0.00 0.84 0.00 0.00 57.88 58.69 1h0t h LEU 45 Cb 0.26 -0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.20 1h0t h LEU 45 CO -0.01 0.38 0.21 0.00 -0.34 0.00 0.00 178.44 178.68 1h0t h ALA 46 N 0.63 0.87 -0.30 1.25 0.00 0.32 1.15 119.26 123.17 1h0t h ALA 46 Ca 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1h0t h ALA 46 Cb 0.38 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1h0t h ALA 46 CO 0.00 -0.25 -0.30 1.05 0.00 0.00 0.00 179.25 179.75 1h0t h GLU 47 N 0.36 0.64 -0.53 0.00 4.11 0.49 0.82 114.58 120.46 1h0t h GLU 47 Ca 0.36 -0.28 -0.09 0.00 0.07 0.00 0.00 59.36 59.42 1h0t h GLU 47 Cb 0.52 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1h0t h GLU 47 CO -0.39 0.86 -0.03 0.00 0.07 0.00 0.00 179.01 179.52 1h0t h ALA 48 N 1.12 0.94 -0.57 1.06 0.00 0.16 0.50 119.26 122.47 1h0t h ALA 48 Ca 0.07 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1h0t h ALA 48 Cb 0.79 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1h0t h ALA 48 CO 0.06 0.63 0.07 0.87 0.00 0.00 0.00 179.25 180.88 1h0t h LYS 49 N 0.85 0.97 -0.83 0.00 1.79 0.18 0.13 116.57 119.66 1h0t h LYS 49 Ca 0.15 -0.27 -0.03 0.00 -2.18 0.00 0.00 60.65 58.32 1h0t h LYS 49 Cb 0.55 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 31.05 1h0t h LYS 49 CO 0.03 0.94 0.41 -0.22 -1.08 0.00 0.00 179.45 179.52 1h0t h LYS 50 N 0.86 1.19 -0.17 3.15 3.64 0.11 -2.33 116.57 123.03 1h0t h LYS 50 Ca 0.17 -0.17 -0.16 0.00 -1.27 0.00 0.00 60.65 59.22 1h0t h LYS 50 Cb 0.46 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1h0t h LYS 50 CO 0.02 0.91 -0.57 -0.07 -2.27 0.00 0.00 179.45 177.47 1h0t h LEU 51 N 1.18 0.58 -0.73 5.20 4.07 0.59 -1.31 115.31 124.90 1h0t h LEU 51 Ca 0.29 -0.32 0.03 0.00 0.08 0.00 0.00 57.88 57.96 1h0t h LEU 51 Cb 0.11 -0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.64 1h0t h LEU 51 CO -0.04 1.03 0.46 -1.13 -1.08 0.00 0.00 178.44 177.68 1h0t h ASN 52 N 0.40 0.76 0.27 -0.43 -1.24 -0.22 0.40 115.58 115.52 1h0t h ASN 52 Ca 0.00 -0.00 -0.32 0.00 0.71 0.00 0.00 56.30 56.69 1h0t h ASN 52 Cb 1.11 -0.17 0.03 0.00 0.73 0.00 0.00 38.32 40.02 1h0t h ASN 52 CO 0.10 0.53 -1.40 0.44 -1.29 0.00 0.00 177.43 175.81 1h0t h ASP 53 N 0.90 0.81 -0.33 1.15 3.32 -1.44 -1.86 116.42 118.98 1h0t h ASP 53 Ca 0.29 -0.84 -0.07 0.00 0.02 0.00 0.00 57.03 56.43 1h0t h ASP 53 Cb 0.00 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1h0t h ASP 53 CO -0.10 1.65 -0.08 0.00 -1.72 0.00 0.00 179.24 178.98 1h0t h ALA 54 N 0.24 0.46 -0.00 3.45 0.00 -1.04 -2.84 119.26 119.52 1h0t h ALA 54 Ca -0.23 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1h0t h ALA 54 Cb 2.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1h0t h ALA 54 CO 0.26 0.30 -0.07 1.04 0.00 0.00 0.00 179.25 180.78 1h0t n GLN 55 N -4.43 0.89 -1.67 0.00 6.02 0.14 -4.92 117.38 113.42 1h0t n GLN 55 Ca -0.02 -0.30 -0.34 0.00 -0.01 0.00 0.00 57.00 56.33 1h0t n GLN 55 Cb 0.34 -1.49 0.06 0.00 1.02 0.00 0.00 30.24 30.16 1h0t n GLN 55 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1h0t s ALA 56 N -2.31 2.34 0.33 -1.58 0.00 -0.70 -4.94 121.76 114.89 1h0t s ALA 56 Ca 0.34 0.73 0.12 0.00 0.00 0.00 0.00 51.96 53.15 1h0t s ALA 56 Cb 0.21 -3.39 0.57 0.00 0.00 0.00 0.00 23.12 20.51 1h0t s ALA 56 CO 0.43 -1.49 1.74 -1.00 0.00 0.00 0.00 175.76 175.45 1h0t h PRO 57 N 0.02 0.01 -0.01 0.00 0.13 -1.88 -3.49 132.00 126.78 1h0t h PRO 57 Ca -0.48 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1h0t h PRO 57 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1h0t h PRO 57 CO 0.52 0.47 0.00 1.17 -0.23 0.00 0.00 178.00 179.94