#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h0t n ASP 2 N 0.00 0.00 -0.16 4.52 5.68 -1.26 -5.03 116.55 120.29 1h0t n ASP 2 Ca 0.00 -0.98 -0.06 0.00 -0.50 0.00 0.00 54.79 53.25 1h0t n ASP 2 Cb 0.00 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.09 1h0t n ASP 2 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1h0t h ASN 3 N 0.00 0.89 0.00 -1.12 7.08 -2.05 -3.45 115.58 116.93 1h0t h ASN 3 Ca 0.00 -0.21 0.00 0.00 -3.08 0.00 0.00 56.30 53.01 1h0t h ASN 3 Cb 0.00 -0.24 0.00 0.00 -2.08 0.00 0.00 38.32 36.00 1h0t h ASN 3 CO 0.00 0.92 0.00 2.29 -2.08 0.00 0.00 177.43 178.56 1h0t n LYS 4 N -4.22 0.00 -0.39 4.14 2.85 -1.26 -4.95 118.16 114.34 1h0t n LYS 4 Ca 0.03 0.00 0.38 0.00 -1.05 0.00 0.00 58.31 57.68 1h0t n LYS 4 Cb 0.29 -0.10 0.76 0.00 -0.65 0.00 0.00 35.03 35.34 1h0t n LYS 4 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 177.40 178.09 1h0t h PHE 5 N 0.00 0.01 0.04 5.58 0.04 -1.86 0.38 116.94 121.12 1h0t h PHE 5 Ca 0.00 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.80 1h0t h PHE 5 Cb 0.00 -0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.10 1h0t h PHE 5 CO 0.00 -0.00 -0.41 -0.97 -0.60 0.00 0.00 178.31 176.33 1h0t h ASN 6 N 0.00 -1.23 0.68 2.17 -1.24 -1.90 -2.14 115.58 111.92 1h0t h ASN 6 Ca 0.63 0.15 -0.01 0.00 0.71 0.00 0.00 56.30 57.78 1h0t h ASN 6 Cb 2.52 0.48 -0.00 0.00 0.73 0.00 0.00 38.32 42.04 1h0t h ASN 6 CO -0.01 -0.46 -1.33 1.17 -1.29 0.00 0.00 177.43 175.51 1h0t n LYS 7 N -5.45 0.62 -0.27 6.67 4.81 -0.88 -3.88 118.16 119.79 1h0t n LYS 7 Ca -0.06 0.03 0.05 0.00 -0.87 0.00 0.00 58.31 57.45 1h0t n LYS 7 Cb 0.37 -1.73 0.27 0.00 0.02 0.00 0.00 35.03 33.96 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 0.92 -0.64 1.64 4.39 -0.81 0.98 114.58 121.05 1h0t h GLU 8 Ca -0.01 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 1h0t h GLU 8 Cb 1.02 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.44 1h0t h GLU 8 CO 0.00 0.61 0.04 1.96 -1.16 0.00 0.00 179.01 180.46 1h0t h GLN 9 N 0.95 1.09 -0.09 2.33 4.20 -1.53 0.51 115.11 122.57 1h0t h GLN 9 Ca 0.37 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1h0t h GLN 9 Cb 0.22 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1h0t h GLN 9 CO -0.13 1.04 0.04 0.37 -0.67 0.00 0.00 178.83 179.47 1h0t h GLN 10 N 1.01 0.13 -0.26 1.46 5.75 -0.55 0.51 115.11 123.16 1h0t h GLN 10 Ca 0.19 -0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.57 1h0t h GLN 10 Cb 0.52 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.04 1h0t h GLN 10 CO 0.02 0.25 -0.20 -0.97 -2.65 0.00 0.00 178.83 175.28 1h0t h ASN 11 N -0.01 0.63 -0.44 -0.69 -1.24 0.90 -0.08 115.58 114.65 1h0t h ASN 11 Ca 0.03 -0.45 -0.03 0.00 0.71 0.00 0.00 56.30 56.56 1h0t h ASN 11 Cb 0.16 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 39.02 1h0t h ASN 11 CO -0.00 0.95 0.14 0.00 -1.29 0.00 0.00 177.43 177.22 1h0t h ALA 12 N 0.70 0.57 0.49 1.57 0.00 0.08 0.34 119.26 123.02 1h0t h ALA 12 Ca 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1h0t h ALA 12 Cb 0.74 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1h0t h ALA 12 CO 0.05 0.22 -0.33 0.35 0.00 0.00 0.00 179.25 179.55 1h0t h PHE 13 N 0.57 -0.88 -0.09 0.00 3.57 0.07 0.36 116.94 120.54 1h0t h PHE 13 Ca 0.14 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.68 1h0t h PHE 13 Cb 0.26 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.27 1h0t h PHE 13 CO 0.01 -0.50 -0.23 -0.92 -2.23 0.00 0.00 178.31 174.44 1h0t h TYR 14 N -0.79 -0.62 -0.76 0.41 3.20 -0.83 -1.09 116.97 116.49 1h0t h TYR 14 Ca -0.05 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1h0t h TYR 14 Cb 0.66 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 39.18 1h0t h TYR 14 CO -0.12 -0.32 0.49 0.93 -1.64 0.00 0.00 178.16 177.50 1h0t h GLU 15 N -0.32 1.02 -0.60 1.82 5.08 -0.13 0.45 114.58 121.89 1h0t h GLU 15 Ca 0.09 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1h0t h GLU 15 Cb 0.45 -0.22 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 1h0t h GLU 15 CO -0.27 0.69 0.22 0.82 -1.00 0.00 0.00 179.01 179.46 1h0t h ILE 16 N 1.04 0.76 -0.15 3.13 2.04 0.36 0.54 117.51 125.23 1h0t h ILE 16 Ca 0.28 -0.13 -0.16 0.00 1.00 0.00 0.00 64.86 65.85 1h0t h ILE 16 Cb -0.09 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1h0t h ILE 16 CO -0.06 0.07 -0.56 -0.07 0.00 0.00 0.00 178.15 177.53 1h0t h LEU 17 N 0.39 0.52 -1.06 1.44 3.38 -0.36 -3.23 115.31 116.40 1h0t h LEU 17 Ca 0.31 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1h0t h LEU 17 Cb 0.38 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1h0t h LEU 17 CO -0.31 0.98 0.00 1.41 0.09 0.00 0.00 178.44 180.60 1h0t n HIS 18 N -3.94 0.02 -2.23 1.13 8.25 0.15 -4.90 115.22 113.70 1h0t n HIS 18 Ca -0.03 -0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 57.00 1h0t n HIS 18 Cb 0.61 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 1h0t n HIS 18 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1h0t s LEU 19 N -1.96 4.34 0.46 2.41 1.43 0.18 -4.91 118.68 120.64 1h0t s LEU 19 Ca 0.37 2.17 0.32 0.00 -1.03 0.00 0.00 54.13 55.96 1h0t s LEU 19 Cb 0.21 -3.57 1.61 0.00 0.03 0.00 0.00 46.19 44.47 1h0t s LEU 19 CO 0.33 -0.67 1.96 1.55 0.23 0.00 0.00 176.35 179.75 1h0t h PRO 20 N 7.38 0.00 -0.00 1.29 0.13 -1.90 -3.00 132.00 135.90 1h0t h PRO 20 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1h0t h PRO 20 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h0t h PRO 20 CO 0.88 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.74 1h0t n ASN 21 N -2.66 2.09 -4.77 1.44 3.02 -1.26 -5.02 115.26 108.11 1h0t n ASN 21 Ca -0.01 -2.26 -0.39 0.00 -0.03 0.00 0.00 54.58 51.89 1h0t n ASN 21 Cb 0.11 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.12 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 -1.45 4.41 0.00 3.41 1.43 -1.13 -4.71 118.68 120.64 1h0t s LEU 22 Ca 0.08 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 1h0t s LEU 22 Cb 0.07 -2.84 0.00 0.00 0.03 0.00 0.00 46.19 43.45 1h0t s LEU 22 CO 0.01 0.12 0.01 -0.46 0.23 0.00 0.00 176.35 176.26 1h0t n ASN 23 N 2.70 1.13 0.03 2.29 6.94 -1.26 -4.81 115.26 122.28 1h0t n ASN 23 Ca -0.08 -1.04 0.01 0.00 -0.02 0.00 0.00 54.58 53.45 1h0t n ASN 23 Cb 0.51 0.00 0.33 0.00 -2.36 0.00 0.00 39.78 38.26 1h0t n ASN 23 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 1h0t h GLU 24 N 0.00 0.45 0.17 -3.83 4.11 -1.97 0.19 114.58 113.70 1h0t h GLU 24 Ca -0.01 -0.09 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 1h0t h GLU 24 Cb 0.03 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1h0t h GLU 24 CO 0.01 0.49 -0.08 1.49 0.07 0.00 0.00 179.01 180.99 1h0t h GLU 25 N 0.44 -0.22 0.15 1.06 4.81 -1.98 -2.48 114.58 116.35 1h0t h GLU 25 Ca 0.10 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1h0t h GLU 25 Cb 0.31 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1h0t h GLU 25 CO 0.01 0.10 -0.07 1.96 -0.73 0.00 0.00 179.01 180.28 1h0t h GLN 26 N -0.55 -0.19 -0.26 1.92 1.08 -1.93 -2.94 115.11 112.24 1h0t h GLN 26 Ca -0.02 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1h0t h GLN 26 Cb 0.42 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.87 1h0t h GLN 26 CO 0.04 0.23 0.14 -0.09 -0.95 0.00 0.00 178.83 178.19 1h0t h ARG 27 N -0.91 0.28 -0.38 1.46 2.43 -0.77 -1.19 114.38 115.31 1h0t h ARG 27 Ca -0.02 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.06 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 0.03 0.19 -0.04 -0.91 -1.51 0.00 0.00 179.97 177.73 1h0t h ASN 28 N 0.29 0.69 -0.67 -3.80 2.35 -1.58 -1.97 115.58 110.89 1h0t h ASN 28 Ca 0.11 -0.34 -0.02 0.00 -0.55 0.00 0.00 56.30 55.50 1h0t h ASN 28 Cb 0.02 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 1h0t h ASN 28 CO -0.06 0.86 0.37 0.00 -1.65 0.00 0.00 177.43 176.94 1h0t h ALA 29 N 0.85 1.35 -0.50 -0.83 0.00 -1.44 -1.76 119.26 116.94 1h0t h ALA 29 Ca 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1h0t h ALA 29 Cb 0.53 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1h0t h ALA 29 CO 0.03 0.53 0.25 0.74 0.00 0.00 0.00 179.25 180.79 1h0t h PHE 30 N 0.96 0.70 0.00 0.00 0.04 -0.94 0.82 116.94 118.52 1h0t h PHE 30 Ca 0.24 -0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.94 1h0t h PHE 30 Cb 0.04 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 37.96 1h0t h PHE 30 CO 0.01 0.54 -0.20 0.82 -0.60 0.00 0.00 178.31 178.88 1h0t h ILE 31 N 0.66 1.08 -0.05 -0.55 2.04 -0.85 0.67 117.51 120.51 1h0t h ILE 31 Ca 0.17 -0.70 -0.09 0.00 1.00 0.00 0.00 64.86 65.25 1h0t h ILE 31 Cb 0.09 1.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1h0t h ILE 31 CO -0.02 0.20 -0.31 1.56 0.00 0.00 0.00 178.15 179.57 1h0t h GLN 32 N 0.00 0.30 -0.02 2.37 4.20 -0.40 0.04 115.11 121.61 1h0t h GLN 32 Ca -0.00 -0.26 -0.11 0.00 0.06 0.00 0.00 58.65 58.34 1h0t h GLN 32 Cb 0.37 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1h0t h GLN 32 CO 0.03 0.91 -0.50 0.66 -0.67 0.00 0.00 178.83 179.26 1h0t h SER 33 N -0.24 0.04 0.12 1.46 4.64 -0.53 -2.86 113.55 116.19 1h0t h SER 33 Ca -0.03 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.09 1h0t h SER 33 Cb 0.99 -0.01 0.02 0.00 -0.31 0.00 0.00 62.40 63.08 1h0t h SER 33 CO 0.06 0.54 -0.80 0.25 -0.87 0.00 0.00 176.83 176.01 1h0t h LEU 34 N 0.03 0.49 -1.10 5.97 5.85 0.31 -1.09 115.31 125.77 1h0t h LEU 34 Ca -0.00 -0.92 -0.08 0.00 0.84 0.00 0.00 57.88 57.71 1h0t h LEU 34 Cb 0.89 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1h0t h LEU 34 CO 0.07 1.38 -0.27 0.11 -0.34 0.00 0.00 178.44 179.38 1h0t h LYS 35 N -0.31 0.29 0.00 1.25 1.57 -1.02 -3.18 116.57 115.17 1h0t h LYS 35 Ca -0.14 -0.10 -0.26 0.00 -1.87 0.00 0.00 60.65 58.28 1h0t h LYS 35 Cb 1.61 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.86 1h0t h LYS 35 CO 0.15 0.55 -1.71 -0.25 -0.57 0.00 0.00 179.45 177.62 1h0t n ASP 36 N -4.13 0.73 -4.02 0.86 8.00 -1.08 -4.76 116.55 112.14 1h0t n ASP 36 Ca -0.01 0.34 -0.31 0.00 0.71 0.00 0.00 54.79 55.52 1h0t n ASP 36 Cb 0.39 0.21 -0.15 0.00 -0.02 0.00 0.00 41.12 41.54 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 -5.87 4.76 0.22 -2.24 -1.08 -0.41 -4.98 116.67 107.07 1h0t s ASP 37 Ca -0.05 -2.20 -0.02 0.00 -0.52 0.00 0.00 52.55 49.76 1h0t s ASP 37 Cb 0.08 -1.64 0.21 0.00 -1.46 0.00 0.00 42.92 40.11 1h0t s ASP 37 CO 0.82 -0.38 1.60 1.55 0.52 0.00 0.00 175.17 179.28 1h0t h PRO 38 N 7.56 0.60 -0.54 4.34 0.13 -1.83 -3.20 132.00 139.06 1h0t h PRO 38 Ca -0.04 -0.29 -0.09 0.00 -0.87 0.00 0.00 66.00 64.70 1h0t h PRO 38 Cb 1.01 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1h0t h PRO 38 CO 0.53 0.88 -0.01 1.03 -0.23 0.00 0.00 178.00 180.21 1h0t h SER 39 N 0.50 0.90 -0.07 1.44 0.87 -1.93 -2.69 113.55 112.57 1h0t h SER 39 Ca 0.05 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1h0t h SER 39 Cb 0.88 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1h0t h SER 39 CO 0.08 0.96 0.00 1.67 -0.53 0.00 0.00 176.83 179.01 1h0t n GLN 40 N -4.19 1.31 -0.17 2.24 -0.06 -1.23 -4.32 117.38 110.96 1h0t n GLN 40 Ca 0.03 -0.46 -0.04 0.00 -2.00 0.00 0.00 57.00 54.53 1h0t n GLN 40 Cb 0.33 -1.34 0.06 0.00 -4.06 0.00 0.00 30.24 25.22 1h0t n GLN 40 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1h0t h SER 41 N 0.95 0.32 -0.33 1.69 4.64 -1.47 0.48 113.55 119.83 1h0t h SER 41 Ca 0.00 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1h0t h SER 41 Cb 0.21 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1h0t h SER 41 CO 0.00 0.22 0.12 0.00 -0.87 0.00 0.00 176.83 176.30 1h0t h ALA 42 N 1.30 0.43 -0.78 5.18 0.00 -1.81 -0.72 119.26 122.87 1h0t h ALA 42 Ca 0.23 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1h0t h ALA 42 Cb 0.17 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1h0t h ALA 42 CO -0.18 0.05 0.51 -0.91 0.00 0.00 0.00 179.25 178.72 1h0t h ASN 43 N 0.39 0.74 -0.62 0.00 -0.26 -1.70 0.33 115.58 114.46 1h0t h ASN 43 Ca 0.11 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.80 1h0t h ASN 43 Cb 0.21 -0.16 -0.03 0.00 -1.06 0.00 0.00 38.32 37.29 1h0t h ASN 43 CO -0.01 0.48 0.18 -0.07 -1.06 0.00 0.00 177.43 176.96 1h0t h LEU 44 N 0.85 0.91 -0.27 1.61 3.38 0.74 0.72 115.31 123.25 1h0t h LEU 44 Ca 0.33 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1h0t h LEU 44 Cb 0.22 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1h0t h LEU 44 CO -0.11 0.89 -0.21 0.25 0.09 0.00 0.00 178.44 179.35 1h0t h LEU 45 N 0.89 0.65 -0.51 1.67 5.85 0.04 0.32 115.31 124.23 1h0t h LEU 45 Ca 0.20 -0.45 0.05 0.00 0.84 0.00 0.00 57.88 58.52 1h0t h LEU 45 Cb 0.31 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1h0t h LEU 45 CO -0.00 0.96 0.24 0.00 -0.34 0.00 0.00 178.44 179.30 1h0t h ALA 46 N 0.71 0.64 -0.24 1.25 0.00 0.16 0.94 119.26 122.72 1h0t h ALA 46 Ca 0.05 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1h0t h ALA 46 Cb 0.75 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1h0t h ALA 46 CO 0.05 -0.11 -0.41 1.05 0.00 0.00 0.00 179.25 179.83 1h0t h GLU 47 N 0.48 0.58 -0.48 0.00 4.11 0.55 0.83 114.58 120.64 1h0t h GLU 47 Ca 0.23 -0.30 -0.09 0.00 0.07 0.00 0.00 59.36 59.27 1h0t h GLU 47 Cb 0.15 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1h0t h GLU 47 CO -0.17 0.89 -0.05 0.00 0.07 0.00 0.00 179.01 179.75 1h0t h ALA 48 N 1.08 1.00 -0.07 1.06 0.00 0.63 0.49 119.26 123.45 1h0t h ALA 48 Ca 0.04 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1h0t h ALA 48 Cb 0.92 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1h0t h ALA 48 CO 0.08 0.61 -0.72 0.87 0.00 0.00 0.00 179.25 180.08 1h0t h LYS 49 N 0.77 0.37 -0.75 0.00 1.57 0.13 0.13 116.57 118.80 1h0t h LYS 49 Ca 0.14 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.57 1h0t h LYS 49 Cb 0.54 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.88 1h0t h LYS 49 CO 0.03 0.95 0.30 -0.22 -0.57 0.00 0.00 179.45 179.93 1h0t h LYS 50 N 0.25 1.11 -0.18 3.15 3.64 0.11 -2.02 116.57 122.63 1h0t h LYS 50 Ca -0.03 -0.19 -0.17 0.00 -1.27 0.00 0.00 60.65 58.99 1h0t h LYS 50 Cb 1.29 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1h0t h LYS 50 CO 0.12 0.90 -0.59 -0.07 -2.27 0.00 0.00 179.45 177.54 1h0t h LEU 51 N 1.08 0.66 -0.96 5.20 4.07 0.34 -1.19 115.31 124.51 1h0t h LEU 51 Ca 0.25 -0.37 0.08 0.00 0.08 0.00 0.00 57.88 57.92 1h0t h LEU 51 Cb 0.20 -0.19 -0.07 0.00 1.08 0.00 0.00 40.66 41.68 1h0t h LEU 51 CO -0.02 1.10 0.61 -1.13 -1.08 0.00 0.00 178.44 177.92 1h0t h ASN 52 N 0.44 0.94 0.11 -0.43 -1.24 -0.04 0.24 115.58 115.60 1h0t h ASN 52 Ca -0.00 0.03 -0.25 0.00 0.71 0.00 0.00 56.30 56.78 1h0t h ASN 52 Cb 1.15 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 40.03 1h0t h ASN 52 CO 0.11 0.56 -1.27 -0.78 -1.29 0.00 0.00 177.43 174.77 1h0t h ASP 53 N 1.05 0.38 0.04 1.15 3.58 -1.39 -2.32 116.42 118.90 1h0t h ASP 53 Ca 0.44 -0.86 -0.00 0.00 0.42 0.00 0.00 57.03 57.02 1h0t h ASP 53 Cb 0.28 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.20 1h0t h ASP 53 CO -0.21 1.56 -0.02 0.00 -2.88 0.00 0.00 179.24 177.70 1h0t h ALA 54 N -0.04 -0.05 0.00 -0.78 0.00 -1.06 -2.35 119.26 114.98 1h0t h ALA 54 Ca -0.27 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1h0t h ALA 54 Cb 1.71 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 1h0t h ALA 54 CO 0.07 -0.51 -0.38 1.96 0.00 0.00 0.00 179.25 180.39 1h0t h GLN 55 N -0.08 0.00 -6.98 0.00 4.20 -0.70 -3.45 115.11 108.10 1h0t h GLN 55 Ca -0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.14 1h0t h GLN 55 Cb 0.07 0.00 0.16 0.00 0.30 0.00 0.00 27.48 28.02 1h0t h GLN 55 CO 0.01 0.38 0.30 0.00 -0.67 0.00 0.00 178.83 178.84 1h0t n ALA 56 N -2.34 0.56 -1.77 3.87 0.00 -0.87 -4.96 120.51 115.00 1h0t n ALA 56 Ca -0.01 -0.03 -0.39 0.00 0.00 0.00 0.00 53.44 53.02 1h0t n ALA 56 Cb 0.47 -2.21 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 1h0t n ALA 56 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1h0t s PRO 57 N -3.14 4.22 0.00 0.00 0.04 -1.26 -4.96 135.00 129.90 1h0t s PRO 57 Ca 0.79 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.66 1h0t s PRO 57 Cb -0.39 -2.81 0.00 0.00 0.04 0.00 0.00 34.50 31.35 1h0t s PRO 57 CO 0.44 -0.17 0.02 1.63 0.04 0.00 0.00 177.00 178.96