#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 7.40 -1.24 -1.34 2.15 -1.26 -4.98 116.67 117.41 1h0t s ASP 2 Ca 0.00 1.68 -0.15 0.00 0.43 0.00 0.00 52.55 54.51 1h0t s ASP 2 Cb 0.00 -2.55 0.15 0.00 -0.30 0.00 0.00 42.92 40.21 1h0t s ASP 2 CO 0.00 -0.06 1.53 0.59 -0.17 0.00 0.00 175.17 177.06 1h0t n ASN 3 N 2.92 5.14 0.06 -0.34 3.02 -1.26 -4.82 115.26 119.98 1h0t n ASN 3 Ca 0.01 -2.97 0.04 0.00 -0.03 0.00 0.00 54.58 51.64 1h0t n ASN 3 Cb 0.50 -1.61 0.44 0.00 -0.61 0.00 0.00 39.78 38.49 1h0t n ASN 3 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1h0t h LYS 4 N 7.19 0.40 -0.98 3.52 2.10 -2.02 -3.05 116.57 123.74 1h0t h LYS 4 Ca 0.36 -0.04 0.28 0.00 -2.00 0.00 0.00 60.65 59.25 1h0t h LYS 4 Cb 0.86 -0.08 -0.04 0.00 -0.90 0.00 0.00 32.23 32.07 1h0t h LYS 4 CO 1.31 0.33 0.72 0.74 -2.00 0.00 0.00 179.45 180.55 1h0t h PHE 5 N 0.41 0.00 -0.15 0.07 0.04 -1.87 0.11 116.94 115.55 1h0t h PHE 5 Ca 0.10 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.92 1h0t h PHE 5 Cb 0.06 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.17 1h0t h PHE 5 CO 0.00 0.00 -0.11 -0.91 -0.60 0.00 0.00 178.31 176.69 1h0t h ASN 6 N 0.00 -0.35 0.63 2.17 4.21 -1.88 -2.70 115.58 117.66 1h0t h ASN 6 Ca 0.46 0.08 -0.01 0.00 1.21 0.00 0.00 56.30 58.04 1h0t h ASN 6 Cb 1.90 0.18 -0.00 0.00 -1.12 0.00 0.00 38.32 39.28 1h0t h ASN 6 CO -0.00 -0.15 -1.37 1.17 -1.29 0.00 0.00 177.43 175.79 1h0t n LYS 7 N -5.26 0.63 -0.25 0.81 4.81 -0.76 -3.95 118.16 114.19 1h0t n LYS 7 Ca -0.03 0.01 0.06 0.00 -0.87 0.00 0.00 58.31 57.48 1h0t n LYS 7 Cb 0.18 -1.72 0.30 0.00 0.02 0.00 0.00 35.03 33.81 1h0t n LYS 7 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1h0t h GLU 8 N 0.00 0.86 -0.60 1.64 4.39 -0.66 0.95 114.58 121.17 1h0t h GLU 8 Ca -0.01 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.56 1h0t h GLU 8 Cb 1.02 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.46 1h0t h GLU 8 CO 0.00 0.57 0.05 1.96 -1.16 0.00 0.00 179.01 180.43 1h0t h GLN 9 N 0.89 1.02 -0.21 2.33 4.20 -1.63 0.57 115.11 122.27 1h0t h GLN 9 Ca 0.37 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1h0t h GLN 9 Cb 0.27 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1h0t h GLN 9 CO -0.14 0.98 0.11 0.37 -0.67 0.00 0.00 178.83 179.48 1h0t h GLN 10 N 0.92 0.30 -0.17 1.46 5.75 -0.51 0.36 115.11 123.22 1h0t h GLN 10 Ca 0.18 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.52 1h0t h GLN 10 Cb 0.49 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.98 1h0t h GLN 10 CO 0.02 0.31 -0.33 -0.97 -2.65 0.00 0.00 178.83 175.21 1h0t h ASN 11 N 0.22 0.59 -0.58 -0.69 -1.24 0.87 -0.90 115.58 113.84 1h0t h ASN 11 Ca 0.07 -0.55 -0.04 0.00 0.71 0.00 0.00 56.30 56.50 1h0t h ASN 11 Cb 0.10 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 38.96 1h0t h ASN 11 CO -0.01 1.02 0.21 0.00 -1.29 0.00 0.00 177.43 177.36 1h0t h ALA 12 N 0.58 0.76 0.57 1.57 0.00 0.20 0.32 119.26 123.26 1h0t h ALA 12 Ca 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1h0t h ALA 12 Cb 0.92 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1h0t h ALA 12 CO 0.07 0.40 -0.32 0.35 0.00 0.00 0.00 179.25 179.75 1h0t h PHE 13 N 0.81 -0.84 -0.11 0.00 3.57 -0.27 0.37 116.94 120.46 1h0t h PHE 13 Ca 0.19 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1h0t h PHE 13 Cb 0.24 0.29 -0.06 0.00 2.79 0.00 0.00 35.95 39.21 1h0t h PHE 13 CO 0.01 -0.50 -0.36 -0.92 -2.23 0.00 0.00 178.31 174.31 1h0t h TYR 14 N -0.83 -1.02 -0.70 0.41 3.20 -0.95 -0.61 116.97 116.47 1h0t h TYR 14 Ca -0.07 0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1h0t h TYR 14 Cb 0.66 0.46 -0.04 0.00 1.54 0.00 0.00 36.73 39.36 1h0t h TYR 14 CO -0.07 -0.44 0.45 0.93 -1.64 0.00 0.00 178.16 177.39 1h0t h GLU 15 N -0.45 0.88 -0.55 1.82 4.39 -0.23 0.23 114.58 120.68 1h0t h GLU 15 Ca 0.08 -0.05 0.09 0.00 0.34 0.00 0.00 59.36 59.82 1h0t h GLU 15 Cb 0.59 -0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 28.97 1h0t h GLU 15 CO -0.36 0.58 0.15 0.82 -1.16 0.00 0.00 179.01 179.05 1h0t h ILE 16 N 0.91 0.74 -0.49 3.13 2.04 0.55 0.30 117.51 124.69 1h0t h ILE 16 Ca 0.27 -0.11 -0.12 0.00 1.00 0.00 0.00 64.86 65.90 1h0t h ILE 16 Cb -0.05 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1h0t h ILE 16 CO -0.08 0.06 -0.17 -0.07 0.00 0.00 0.00 178.15 177.88 1h0t h LEU 17 N 0.31 0.98 -0.60 1.44 3.38 -0.39 -3.17 115.31 117.26 1h0t h LEU 17 Ca 0.28 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1h0t h LEU 17 Cb 0.36 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1h0t h LEU 17 CO -0.32 1.13 -0.21 0.45 0.09 0.00 0.00 178.44 179.58 1h0t h HIS 18 N 0.85 0.00 -2.11 1.13 3.86 0.61 -3.46 115.15 116.02 1h0t h HIS 18 Ca 0.12 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.73 1h0t h HIS 18 Cb 0.73 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.23 1h0t h HIS 18 CO 0.05 0.21 1.09 1.28 0.86 0.00 0.00 177.93 181.41 1h0t n LEU 19 N -3.23 3.54 0.25 2.43 4.77 0.95 -4.86 117.00 120.85 1h0t n LEU 19 Ca 0.02 0.97 0.17 0.00 -0.03 0.00 0.00 56.01 57.14 1h0t n LEU 19 Cb 0.52 -1.40 0.82 0.00 -2.33 0.00 0.00 43.42 41.02 1h0t n LEU 19 CO 0.34 -0.03 1.01 1.55 -1.33 0.00 0.00 177.39 178.93 1h0t h PRO 20 N 9.07 0.00 -0.27 3.23 0.13 -1.91 -2.87 132.00 139.38 1h0t h PRO 20 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 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 0.94 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.80 1h0t n ASN 21 N -2.80 2.76 -4.66 1.44 3.02 -1.26 -4.96 115.26 108.79 1h0t n ASN 21 Ca -0.01 -2.04 -0.40 0.00 -0.03 0.00 0.00 54.58 52.11 1h0t n ASN 21 Cb 0.17 -0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 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 -1.07 4.15 0.00 3.41 1.43 -1.09 -4.68 118.68 120.83 1h0t s LEU 22 Ca 0.19 0.80 0.01 0.00 -1.03 0.00 0.00 54.13 54.10 1h0t s LEU 22 Cb 0.10 -2.85 0.10 0.00 0.03 0.00 0.00 46.19 43.57 1h0t s LEU 22 CO 0.12 -0.25 0.70 -0.46 0.23 0.00 0.00 176.35 176.70 1h0t n ASN 23 N 4.95 1.09 0.05 2.29 0.23 -1.26 -4.74 115.26 117.86 1h0t n ASN 23 Ca -0.02 -1.88 -0.01 0.00 -0.53 0.00 0.00 54.58 52.13 1h0t n ASN 23 Cb 0.50 -0.44 0.27 0.00 -2.08 0.00 0.00 39.78 38.03 1h0t n ASN 23 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1h0t h GLU 24 N 0.00 0.39 -0.16 -3.83 9.09 -1.97 0.26 114.58 118.36 1h0t h GLU 24 Ca -0.23 -0.12 -0.02 0.00 0.05 0.00 0.00 59.36 59.03 1h0t h GLU 24 Cb 0.89 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.95 1h0t h GLU 24 CO 0.26 0.57 0.02 1.49 0.05 0.00 0.00 179.01 181.40 1h0t h GLU 25 N 0.35 0.28 0.14 1.06 4.81 -1.98 -0.83 114.58 118.41 1h0t h GLU 25 Ca 0.06 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1h0t h GLU 25 Cb 0.54 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1h0t h GLU 25 CO 0.04 0.46 -0.07 1.96 -0.73 0.00 0.00 179.01 180.67 1h0t h GLN 26 N 0.05 -0.19 -0.21 1.92 1.08 -1.91 -2.86 115.11 112.99 1h0t h GLN 26 Ca 0.05 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1h0t h GLN 26 Cb 0.33 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 1h0t h GLN 26 CO 0.00 0.25 0.12 -0.09 -0.95 0.00 0.00 178.83 178.17 1h0t h ARG 27 N -0.88 0.30 -0.45 1.46 1.12 -0.58 -1.48 114.38 113.86 1h0t h ARG 27 Ca -0.02 -0.03 -0.07 0.00 -1.11 0.00 0.00 59.98 58.74 1h0t h ARG 27 Cb 0.53 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 30.41 1h0t h ARG 27 CO 0.03 0.27 0.00 -0.91 -3.11 0.00 0.00 179.97 176.26 1h0t h ASN 28 N 0.24 0.78 -0.76 -3.80 2.35 -1.30 -1.85 115.58 111.24 1h0t h ASN 28 Ca 0.07 -0.31 -0.01 0.00 -0.55 0.00 0.00 56.30 55.51 1h0t h ASN 28 Cb 0.06 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 1h0t h ASN 28 CO -0.01 0.90 0.46 0.00 -1.65 0.00 0.00 177.43 177.12 1h0t h ALA 29 N 0.91 1.36 -0.50 -0.83 0.00 -1.46 -1.43 119.26 117.31 1h0t h ALA 29 Ca 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1h0t h ALA 29 Cb 0.49 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1h0t h ALA 29 CO 0.02 0.55 0.23 0.74 0.00 0.00 0.00 179.25 180.79 1h0t h PHE 30 N 1.06 0.73 0.00 0.00 0.04 -0.94 0.32 116.94 118.15 1h0t h PHE 30 Ca 0.28 -0.04 -0.03 0.00 2.80 0.00 0.00 57.97 60.98 1h0t h PHE 30 Cb -0.04 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 37.89 1h0t h PHE 30 CO 0.00 0.58 -0.14 0.82 -0.60 0.00 0.00 178.31 178.97 1h0t h ILE 31 N 0.66 0.91 -0.01 -0.55 2.04 -0.70 0.65 117.51 120.51 1h0t h ILE 31 Ca 0.17 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1h0t h ILE 31 Cb 0.14 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1h0t h ILE 31 CO -0.02 0.14 -0.05 1.56 0.00 0.00 0.00 178.15 179.78 1h0t h GLN 32 N 0.00 0.05 -0.03 2.37 4.20 -0.18 0.31 115.11 121.83 1h0t h GLN 32 Ca -0.00 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1h0t h GLN 32 Cb 0.29 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1h0t h GLN 32 CO 0.02 0.74 -0.34 0.66 -0.67 0.00 0.00 178.83 179.24 1h0t h SER 33 N -0.63 0.05 0.07 1.46 4.64 -0.64 -2.37 113.55 116.13 1h0t h SER 33 Ca -0.00 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 1h0t h SER 33 Cb 0.76 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.85 1h0t h SER 33 CO 0.01 0.39 -0.49 0.25 -0.87 0.00 0.00 176.83 176.13 1h0t h LEU 34 N 0.05 0.31 -1.17 5.97 5.85 0.28 -1.00 115.31 125.59 1h0t h LEU 34 Ca 0.00 -0.92 -0.08 0.00 0.84 0.00 0.00 57.88 57.73 1h0t h LEU 34 Cb 0.63 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1h0t h LEU 34 CO 0.05 1.20 -0.25 0.11 -0.34 0.00 0.00 178.44 179.21 1h0t h LYS 35 N -0.53 0.26 0.17 1.25 1.57 -0.93 -3.17 116.57 115.19 1h0t h LYS 35 Ca -0.08 -0.09 -0.33 0.00 -1.87 0.00 0.00 60.65 58.28 1h0t h LYS 35 Cb 1.34 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.63 1h0t h LYS 35 CO 0.09 0.50 -1.64 -0.44 -0.57 0.00 0.00 179.45 177.39 1h0t h ASP 36 N 0.24 0.55 -3.77 0.86 5.19 -1.53 -3.44 116.42 114.51 1h0t h ASP 36 Ca 0.04 -0.77 -0.68 0.00 -0.62 0.00 0.00 57.03 55.00 1h0t h ASP 36 Cb 0.58 -0.18 -0.34 0.00 0.18 0.00 0.00 39.33 39.57 1h0t h ASP 36 CO 0.04 1.64 -0.74 -0.62 -3.12 0.00 0.00 179.24 176.44 1h0t s ASP 37 N -7.19 4.66 0.09 6.45 -1.08 -0.38 -5.00 116.67 114.22 1h0t s ASP 37 Ca -0.12 -1.27 -0.14 0.00 -0.52 0.00 0.00 52.55 50.49 1h0t s ASP 37 Cb 0.06 -1.65 -0.14 0.00 -1.46 0.00 0.00 42.92 39.74 1h0t s ASP 37 CO 0.86 -0.22 1.33 1.55 0.52 0.00 0.00 175.17 179.21 1h0t h PRO 38 N 7.92 0.73 -0.00 4.34 0.13 -1.84 -3.26 132.00 140.01 1h0t h PRO 38 Ca -0.22 -0.52 -0.08 0.00 -0.87 0.00 0.00 66.00 64.31 1h0t h PRO 38 Cb 1.06 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1h0t h PRO 38 CO 0.51 1.15 -0.36 0.66 -0.23 0.00 0.00 178.00 179.73 1h0t h SER 39 N 0.45 0.01 0.16 1.44 4.64 -1.93 -2.77 113.55 115.54 1h0t h SER 39 Ca -0.02 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1h0t h SER 39 Cb 1.19 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1h0t h SER 39 CO 0.12 0.36 -0.04 0.00 -0.87 0.00 0.00 176.83 176.40 1h0t n GLN 40 N -4.11 1.01 -0.12 4.77 3.00 -1.24 -4.35 117.38 116.34 1h0t n GLN 40 Ca -0.02 -0.31 -0.05 0.00 -0.01 0.00 0.00 57.00 56.61 1h0t n GLN 40 Cb 0.40 -1.49 0.03 0.00 0.00 0.00 0.00 30.24 29.17 1h0t n GLN 40 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1h0t h SER 41 N 0.76 0.05 -0.31 1.08 4.64 -1.53 0.33 113.55 118.58 1h0t h SER 41 Ca 0.00 0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 1h0t h SER 41 Cb 0.26 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1h0t h SER 41 CO 0.00 0.06 0.17 0.00 -0.87 0.00 0.00 176.83 176.19 1h0t h ALA 42 N 1.29 0.39 -0.81 5.18 0.00 -1.81 0.30 119.26 123.80 1h0t h ALA 42 Ca 0.19 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.09 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 -0.23 -0.08 0.53 -0.91 0.00 0.00 0.00 179.25 178.56 1h0t h ASN 43 N 0.37 0.80 -0.56 0.00 -0.26 -1.72 0.39 115.58 114.59 1h0t h ASN 43 Ca 0.11 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 55.79 1h0t h ASN 43 Cb 0.07 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.14 1h0t h ASN 43 CO -0.02 0.52 0.10 -0.07 -1.06 0.00 0.00 177.43 176.90 1h0t h LEU 44 N 0.91 0.89 -0.31 1.61 3.38 0.60 0.66 115.31 123.05 1h0t h LEU 44 Ca 0.35 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1h0t h LEU 44 Cb 0.21 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1h0t h LEU 44 CO -0.12 0.92 -0.24 0.25 0.09 0.00 0.00 178.44 179.33 1h0t h LEU 45 N 0.82 0.75 -0.43 1.67 5.85 0.08 0.30 115.31 124.35 1h0t h LEU 45 Ca 0.17 -0.45 0.04 0.00 0.84 0.00 0.00 57.88 58.49 1h0t h LEU 45 Cb 0.40 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1h0t h LEU 45 CO 0.01 1.04 0.19 0.00 -0.34 0.00 0.00 178.44 179.34 1h0t h ALA 46 N 0.73 0.53 -0.28 1.25 0.00 0.25 0.92 119.26 122.67 1h0t h ALA 46 Ca 0.06 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1h0t h ALA 46 Cb 0.80 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1h0t h ALA 46 CO 0.06 -0.18 -0.36 1.05 0.00 0.00 0.00 179.25 179.82 1h0t h GLU 47 N 0.38 0.62 -0.56 0.00 4.11 0.44 0.81 114.58 120.38 1h0t h GLU 47 Ca 0.19 -0.30 -0.08 0.00 0.07 0.00 0.00 59.36 59.25 1h0t h GLU 47 Cb 0.14 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1h0t h GLU 47 CO -0.17 0.88 0.04 0.00 0.07 0.00 0.00 179.01 179.84 1h0t h ALA 48 N 1.09 1.00 -0.14 1.06 0.00 0.54 0.47 119.26 123.28 1h0t h ALA 48 Ca 0.05 -0.27 -0.18 0.00 0.00 0.00 0.00 54.91 54.51 1h0t h ALA 48 Cb 0.86 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1h0t h ALA 48 CO 0.07 0.62 -0.65 0.87 0.00 0.00 0.00 179.25 180.16 1h0t h LYS 49 N 0.88 0.55 -0.79 0.00 1.57 0.12 0.15 116.57 119.04 1h0t h LYS 49 Ca 0.17 -0.40 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1h0t h LYS 49 Cb 0.46 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.80 1h0t h LYS 49 CO 0.02 1.02 0.45 -0.22 -0.57 0.00 0.00 179.45 180.14 1h0t h LYS 50 N 0.40 1.09 -0.17 3.15 3.64 0.11 -1.62 116.57 123.17 1h0t h LYS 50 Ca -0.02 -0.11 -0.18 0.00 -1.27 0.00 0.00 60.65 59.07 1h0t h LYS 50 Cb 1.22 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1h0t h LYS 50 CO 0.12 0.79 -0.63 -0.07 -2.27 0.00 0.00 179.45 177.39 1h0t h LEU 51 N 1.10 0.71 -0.77 5.20 4.07 0.39 -1.42 115.31 124.60 1h0t h LEU 51 Ca 0.28 -0.41 0.04 0.00 0.08 0.00 0.00 57.88 57.87 1h0t h LEU 51 Cb 0.01 -0.21 -0.05 0.00 1.08 0.00 0.00 40.66 41.49 1h0t h LEU 51 CO -0.05 1.17 0.48 -1.13 -1.08 0.00 0.00 178.44 177.83 1h0t h ASN 52 N 0.46 0.77 0.32 -0.43 -1.24 0.19 0.42 115.58 116.07 1h0t h ASN 52 Ca -0.01 0.01 -0.33 0.00 0.71 0.00 0.00 56.30 56.68 1h0t h ASN 52 Cb 1.21 -0.16 0.03 0.00 0.73 0.00 0.00 38.32 40.13 1h0t h ASN 52 CO 0.12 0.52 -1.46 0.44 -1.29 0.00 0.00 177.43 175.76 1h0t h ASP 53 N 0.91 0.77 -0.23 1.15 3.32 -1.35 -1.92 116.42 119.07 1h0t h ASP 53 Ca 0.32 -0.84 -0.06 0.00 0.02 0.00 0.00 57.03 56.47 1h0t h ASP 53 Cb 0.07 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1h0t h ASP 53 CO -0.13 1.66 -0.09 0.00 -1.72 0.00 0.00 179.24 178.96 1h0t h ALA 54 N 0.22 0.33 -0.00 3.45 0.00 -1.04 -2.90 119.26 119.32 1h0t h ALA 54 Ca -0.24 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1h0t h ALA 54 Cb 2.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.85 1h0t h ALA 54 CO 0.26 0.15 -0.00 1.04 0.00 0.00 0.00 179.25 180.71 1h0t n GLN 55 N -4.54 0.05 -1.43 0.00 6.02 0.14 -4.90 117.38 112.73 1h0t n GLN 55 Ca -0.04 -0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.61 1h0t n GLN 55 Cb 0.32 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.17 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 -2.95 2.12 0.52 -1.58 0.00 -0.72 -4.99 121.76 114.16 1h0t s ALA 56 Ca 0.16 0.87 -0.20 0.00 0.00 0.00 0.00 51.96 52.79 1h0t s ALA 56 Cb 0.19 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 1h0t s ALA 56 CO 0.52 -1.87 1.08 -1.25 0.00 0.00 0.00 175.76 174.24 1h0t s PRO 57 N -3.92 3.56 0.00 0.00 0.04 -1.26 -5.01 135.00 128.40 1h0t s PRO 57 Ca 0.74 1.46 0.32 0.00 0.04 0.00 0.00 61.00 63.56 1h0t s PRO 57 Cb -0.29 -2.05 1.83 0.00 0.04 0.00 0.00 34.50 34.04 1h0t s PRO 57 CO 0.45 -0.65 2.19 1.17 0.04 0.00 0.00 177.00 180.20