#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b89 s ASP 2 N 0.00 -0.01 0.37 4.52 -4.77 -1.26 -5.15 116.67 110.38 2b89 s ASP 2 Ca 0.00 -0.94 -0.27 0.00 -3.30 0.00 0.00 52.55 48.03 2b89 s ASP 2 Cb 0.00 0.71 -0.10 0.00 -1.09 0.00 0.00 42.92 42.45 2b89 s ASP 2 CO 0.00 -1.41 1.34 0.20 0.70 0.00 0.00 175.17 176.00 2b89 s ASN 3 N -3.19 6.48 0.00 2.11 0.02 -1.26 -4.88 114.94 114.23 2b89 s ASN 3 Ca 0.18 2.75 0.13 0.00 -1.02 0.00 0.00 52.86 54.89 2b89 s ASN 3 Cb -0.04 -2.65 0.79 0.00 0.02 0.00 0.00 41.25 39.37 2b89 s ASN 3 CO 0.09 -0.74 1.39 0.29 0.02 0.00 0.00 177.10 178.15 2b89 n LYS 4 N 0.44 0.85 0.22 -0.60 5.02 -1.26 -3.94 118.16 118.89 2b89 n LYS 4 Ca 0.02 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.15 2b89 n LYS 4 Cb 0.42 -1.24 -0.08 0.00 -0.02 0.00 0.00 35.03 34.11 2b89 n LYS 4 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2b89 h PHE 5 N 0.00 -0.97 -0.38 2.13 -1.00 -1.98 -1.44 116.94 113.30 2b89 h PHE 5 Ca 0.00 0.01 0.04 0.00 2.81 0.00 0.00 57.97 60.83 2b89 h PHE 5 Cb 0.00 0.38 -0.04 0.00 3.61 0.00 0.00 35.95 39.90 2b89 h PHE 5 CO 0.00 -0.50 0.16 -0.91 -1.61 0.00 0.00 178.31 175.44 2b89 h ASN 6 N -0.74 0.20 -0.91 2.17 2.35 -1.97 0.90 115.58 117.58 2b89 h ASN 6 Ca -0.02 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 2b89 h ASN 6 Cb 0.67 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.99 2b89 h ASN 6 CO -0.07 0.15 0.60 0.50 -1.65 0.00 0.00 177.43 176.95 2b89 h LYS 7 N 0.33 1.14 -0.15 0.81 1.63 -1.79 1.05 116.57 119.59 2b89 h LYS 7 Ca 0.17 -0.07 -0.20 0.00 -0.85 0.00 0.00 60.65 59.70 2b89 h LYS 7 Cb 0.12 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 31.50 2b89 h LYS 7 CO -0.15 0.75 -0.71 1.49 -3.45 0.00 0.00 179.45 177.38 2b89 h GLU 8 N 1.17 0.65 -0.17 1.90 4.57 -0.63 -3.10 114.58 118.97 2b89 h GLU 8 Ca 0.36 -0.50 -0.09 0.00 -1.18 0.00 0.00 59.36 57.94 2b89 h GLU 8 Cb -0.03 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 2b89 h GLU 8 CO -0.11 1.12 -0.30 0.00 -1.18 0.00 0.00 179.01 178.54 2b89 h ARG 9 N 0.46 0.34 -0.16 1.92 3.08 0.18 -0.28 114.38 119.92 2b89 h ARG 9 Ca -0.03 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 2b89 h ARG 9 Cb 1.31 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 2b89 h ARG 9 CO 0.14 0.61 0.07 0.28 -1.07 0.00 0.00 179.97 180.00 2b89 h VAL 10 N 0.30 1.15 -0.05 2.04 2.07 0.12 1.93 116.25 123.80 2b89 h VAL 10 Ca 0.04 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 2b89 h VAL 10 Cb 0.69 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2b89 h VAL 10 CO 0.05 0.14 0.03 0.40 0.02 0.00 0.00 177.57 178.20 2b89 h ILE 11 N 0.11 1.10 -0.10 4.57 2.04 -1.46 0.07 117.51 123.84 2b89 h ILE 11 Ca 0.05 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 2b89 h ILE 11 Cb 0.15 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2b89 h ILE 11 CO -0.01 0.08 -0.10 0.00 0.00 0.00 0.00 178.15 178.13 2b89 h ALA 12 N 0.91 0.14 -0.74 1.87 0.00 -0.81 0.63 119.26 121.26 2b89 h ALA 12 Ca 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2b89 h ALA 12 Cb 0.11 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2b89 h ALA 12 CO -0.00 -0.02 0.43 0.97 0.00 0.00 0.00 179.25 180.62 2b89 h ILE 13 N -0.18 1.21 -0.48 0.00 2.10 0.30 0.81 117.51 121.28 2b89 h ILE 13 Ca 0.02 -0.50 -0.09 0.00 1.08 0.00 0.00 64.86 65.37 2b89 h ILE 13 Cb 0.61 0.19 -0.02 0.00 -1.09 0.00 0.00 36.82 36.51 2b89 h ILE 13 CO 0.02 0.23 -0.06 1.23 -1.08 0.00 0.00 178.15 178.50 2b89 h GLY 14 N 1.06 0.90 0.69 8.18 0.00 -0.89 0.82 103.07 113.83 2b89 h GLY 14 Ca 0.26 -0.65 -0.08 0.00 0.00 0.00 0.00 47.33 46.86 2b89 h GLY 14 CO -0.05 0.60 -0.25 0.83 0.00 0.00 0.00 176.54 177.67 2b89 h GLU 15 N 0.76 0.33 -0.14 4.80 4.39 0.90 -2.91 114.58 122.71 2b89 h GLU 15 Ca 0.14 -0.23 -0.14 0.00 0.34 0.00 0.00 59.36 59.46 2b89 h GLU 15 Cb 0.54 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2b89 h GLU 15 CO 0.03 0.85 -0.53 0.82 -1.16 0.00 0.00 179.01 179.02 2b89 h ILE 16 N -0.14 1.34 0.00 3.13 2.04 0.68 -2.87 117.51 121.69 2b89 h ILE 16 Ca -0.01 -1.79 -0.05 0.00 1.00 0.00 0.00 64.86 64.02 2b89 h ILE 16 Cb 0.86 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 2b89 h ILE 16 CO 0.05 0.54 -0.24 0.24 0.00 0.00 0.00 178.15 178.75 2b89 h MET 17 N 0.31 0.00 -0.30 2.37 2.86 0.61 -2.55 114.93 118.24 2b89 h MET 17 Ca 0.01 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 2b89 h MET 17 Cb 1.03 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.67 2b89 h MET 17 CO 0.09 0.24 -0.11 -0.09 1.06 0.00 0.00 176.91 178.10 2b89 h ARG 18 N 0.00 0.50 -5.59 1.72 2.43 -1.29 -3.43 114.38 108.72 2b89 h ARG 18 Ca -0.00 -0.14 -0.61 0.00 -0.81 0.00 0.00 59.98 58.42 2b89 h ARG 18 Cb 0.65 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.10 2b89 h ARG 18 CO 0.03 0.61 1.54 1.28 -1.51 0.00 0.00 179.97 181.92 2b89 n LEU 19 N -4.21 1.10 0.07 3.80 4.77 -0.96 -4.80 117.00 116.76 2b89 n LEU 19 Ca 0.01 0.29 0.11 0.00 -0.03 0.00 0.00 56.01 56.38 2b89 n LEU 19 Cb 0.31 -1.08 0.45 0.00 -2.33 0.00 0.00 43.42 40.77 2b89 n LEU 19 CO 0.40 -0.84 0.85 -0.81 -1.33 0.00 0.00 177.39 175.65 2b89 n PRO 20 N 8.22 0.12 -0.04 3.23 -0.05 -1.26 -4.16 135.00 141.06 2b89 n PRO 20 Ca 0.54 0.26 -0.03 0.00 -0.05 0.00 0.00 63.50 64.21 2b89 n PRO 20 Cb 0.12 -1.70 -0.01 0.00 -0.05 0.00 0.00 33.50 31.86 2b89 n PRO 20 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 2b89 n ASN 21 N -1.92 1.07 -4.25 3.54 3.02 -1.26 -4.99 115.26 110.47 2b89 n ASN 21 Ca 0.04 0.40 -0.39 0.00 -0.03 0.00 0.00 54.58 54.60 2b89 n ASN 21 Cb 0.27 -0.70 0.01 0.00 -0.61 0.00 0.00 39.78 38.76 2b89 n ASN 21 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2b89 n LEU 22 N -3.63 -3.56 -4.92 3.41 4.77 -1.26 -4.58 117.00 107.23 2b89 n LEU 22 Ca -0.05 0.66 -0.27 0.00 -0.03 0.00 0.00 56.01 56.33 2b89 n LEU 22 Cb 0.19 -0.86 0.02 0.00 -2.33 0.00 0.00 43.42 40.44 2b89 n LEU 22 CO 0.08 -4.74 0.47 0.54 -1.33 0.00 0.00 177.39 172.41 2b89 s ASN 23 N -1.00 5.89 0.39 -1.43 2.20 -1.26 -4.78 114.94 114.95 2b89 s ASN 23 Ca 0.57 0.76 0.16 0.00 -0.94 0.00 0.00 52.86 53.41 2b89 s ASN 23 Cb -0.50 -1.91 1.02 0.00 -2.00 0.00 0.00 41.25 37.86 2b89 s ASN 23 CO 0.66 -0.83 1.81 0.77 -2.94 0.00 0.00 177.10 176.57 2b89 h SER 24 N 0.04 0.50 -0.13 3.54 4.64 -1.97 0.30 113.55 120.47 2b89 h SER 24 Ca -0.46 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2b89 h SER 24 Cb 1.23 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2b89 h SER 24 CO 0.61 0.16 0.07 -0.07 -0.87 0.00 0.00 176.83 176.73 2b89 h LEU 25 N 0.48 0.17 -0.40 5.97 4.07 -1.96 1.55 115.31 125.18 2b89 h LEU 25 Ca 0.53 -0.11 -0.06 0.00 0.08 0.00 0.00 57.88 58.32 2b89 h LEU 25 Cb 1.23 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.91 2b89 h LEU 25 CO -0.25 0.23 0.03 1.56 -1.08 0.00 0.00 178.44 178.93 2b89 h GLN 26 N 0.10 0.69 -0.71 1.13 4.20 -1.52 2.05 115.11 121.05 2b89 h GLN 26 Ca 0.05 -0.21 0.05 0.00 0.06 0.00 0.00 58.65 58.60 2b89 h GLN 26 Cb 0.11 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.76 2b89 h GLN 26 CO -0.01 0.76 0.42 0.28 -0.67 0.00 0.00 178.83 179.61 2b89 h VAL 27 N 0.53 1.01 -0.08 -0.54 2.07 -0.17 -0.50 116.25 118.56 2b89 h VAL 27 Ca 0.12 -0.27 -0.17 0.00 0.82 0.00 0.00 66.70 67.20 2b89 h VAL 27 Cb 0.43 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 2b89 h VAL 27 CO 0.02 0.14 -0.69 0.58 0.02 0.00 0.00 177.57 177.64 2b89 h VAL 28 N 0.78 1.38 -0.87 2.57 2.07 0.28 -2.89 116.25 119.57 2b89 h VAL 28 Ca 0.31 -2.09 0.15 0.00 0.82 0.00 0.00 66.70 65.89 2b89 h VAL 28 Cb 0.15 2.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.92 2b89 h VAL 28 CO -0.17 0.63 0.56 0.00 0.02 0.00 0.00 177.57 178.61 2b89 h ALA 29 N 1.00 1.90 -0.28 1.67 0.00 0.49 0.79 119.26 124.84 2b89 h ALA 29 Ca -0.02 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 2b89 h ALA 29 Cb 1.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2b89 h ALA 29 CO 0.12 -0.14 -0.57 0.74 0.00 0.00 0.00 179.25 179.40 2b89 h PHE 30 N 0.63 1.09 -0.99 0.00 0.04 -1.11 0.25 116.94 116.85 2b89 h PHE 30 Ca 0.43 -0.40 0.10 0.00 2.80 0.00 0.00 57.97 60.90 2b89 h PHE 30 Cb 0.76 -0.20 -0.08 0.00 2.20 0.00 0.00 35.95 38.63 2b89 h PHE 30 CO -0.00 1.23 0.63 0.82 -0.60 0.00 0.00 178.31 180.38 2b89 h ILE 31 N 0.66 0.99 -0.58 -0.55 2.04 0.60 0.20 117.51 120.87 2b89 h ILE 31 Ca 0.01 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.43 2b89 h ILE 31 Cb 1.18 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2b89 h ILE 31 CO 0.13 0.19 0.05 0.78 0.00 0.00 0.00 178.15 179.30 2b89 h ASN 32 N 1.06 0.96 -0.22 1.72 2.35 -0.06 -2.77 115.58 118.61 2b89 h ASN 32 Ca 0.46 -0.28 -0.08 0.00 -0.55 0.00 0.00 56.30 55.85 2b89 h ASN 32 Cb 0.35 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 2b89 h ASN 32 CO -0.23 1.00 -0.11 0.28 -1.65 0.00 0.00 177.43 176.73 2b89 h SER 33 N 0.88 0.60 -0.52 5.81 0.02 0.13 -1.32 113.55 119.14 2b89 h SER 33 Ca 0.17 -0.16 0.05 0.00 -0.84 0.00 0.00 61.79 61.01 2b89 h SER 33 Cb 0.48 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.81 2b89 h SER 33 CO 0.02 0.74 0.25 -0.07 -1.14 0.00 0.00 176.83 176.63 2b89 h LEU 34 N 0.56 0.33 -0.64 5.07 3.38 -0.44 0.51 115.31 124.09 2b89 h LEU 34 Ca 0.10 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 2b89 h LEU 34 Cb 0.52 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2b89 h LEU 34 CO 0.03 0.23 -0.56 0.08 0.09 0.00 0.00 178.44 178.30 2b89 h ARG 35 N 0.47 0.35 0.00 1.13 0.11 -1.36 0.56 114.38 115.65 2b89 h ARG 35 Ca 0.24 -0.23 -0.02 0.00 0.10 0.00 0.00 59.98 60.07 2b89 h ARG 35 Cb 0.18 0.03 -0.00 0.00 1.11 0.00 0.00 29.97 31.28 2b89 h ARG 35 CO -0.19 0.82 -0.09 -0.44 0.10 0.00 0.00 179.97 180.18 2b89 h ASP 36 N 0.27 0.00 -0.40 0.08 3.32 -0.19 -3.40 116.42 116.10 2b89 h ASP 36 Ca 0.00 0.00 0.15 0.00 0.02 0.00 0.00 57.03 57.20 2b89 h ASP 36 Cb 1.07 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.43 2b89 h ASP 36 CO 0.09 0.09 -0.12 -0.62 -1.72 0.00 0.00 179.24 176.97 2b89 s ASP 37 N -5.87 -0.64 0.25 6.45 -1.08 0.17 -5.04 116.67 110.90 2b89 s ASP 37 Ca -0.01 -0.03 0.04 0.00 -0.52 0.00 0.00 52.55 52.03 2b89 s ASP 37 Cb 0.11 1.24 0.30 0.00 -1.46 0.00 0.00 42.92 43.10 2b89 s ASP 37 CO 0.56 -0.10 1.60 -0.65 0.52 0.00 0.00 175.17 177.09 2b89 h PRO 38 N 6.95 0.26 -0.09 4.34 0.11 -0.12 -2.58 132.00 140.87 2b89 h PRO 38 Ca -0.06 -0.16 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 2b89 h PRO 38 Cb 1.19 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2b89 h PRO 38 CO -0.04 0.74 -0.05 0.77 -0.21 0.00 0.00 178.00 179.20 2b89 h SER 39 N 0.20 0.12 -0.60 -2.05 0.02 -1.95 0.78 113.55 110.07 2b89 h SER 39 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2b89 h SER 39 Cb 1.02 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2b89 h SER 39 CO 0.09 0.19 0.00 0.00 -1.14 0.00 0.00 176.83 175.97 2b89 n GLN 40 N -4.40 2.73 -0.32 3.45 6.02 -1.03 -4.29 117.38 119.54 2b89 n GLN 40 Ca -0.01 -2.30 0.11 0.00 -0.01 0.00 0.00 57.00 54.79 2b89 n GLN 40 Cb 0.18 -1.59 0.33 0.00 1.02 0.00 0.00 30.24 30.18 2b89 n GLN 40 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2b89 h SER 41 N 3.58 0.76 -0.08 1.08 4.64 -0.46 0.80 113.55 123.87 2b89 h SER 41 Ca 0.00 0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.22 2b89 h SER 41 Cb 0.98 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 2b89 h SER 41 CO 0.07 0.36 -0.47 0.00 -0.87 0.00 0.00 176.83 175.92 2b89 h ALA 42 N 1.59 0.72 -0.31 5.18 0.00 -1.77 0.32 119.26 125.00 2b89 h ALA 42 Ca 0.49 -0.48 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2b89 h ALA 42 Cb 0.71 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2b89 h ALA 42 CO -0.26 0.67 -0.39 -0.97 0.00 0.00 0.00 179.25 178.30 2b89 h ASN 43 N 0.50 0.78 -0.29 0.00 -0.73 -0.77 0.68 115.58 115.76 2b89 h ASN 43 Ca 0.03 -0.35 -0.14 0.00 1.87 0.00 0.00 56.30 57.70 2b89 h ASN 43 Cb 1.01 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.37 2b89 h ASN 43 CO 0.09 1.08 -0.35 -0.07 -0.37 0.00 0.00 177.43 177.81 2b89 h LEU 44 N 0.61 0.87 -0.85 0.34 3.38 0.50 0.52 115.31 120.67 2b89 h LEU 44 Ca 0.05 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2b89 h LEU 44 Cb 0.93 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2b89 h LEU 44 CO 0.09 1.13 0.46 0.25 0.09 0.00 0.00 178.44 180.45 2b89 h LEU 45 N 0.68 1.08 -0.53 1.67 6.46 0.16 1.43 115.31 126.26 2b89 h LEU 45 Ca 0.06 -0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.70 2b89 h LEU 45 Cb 0.91 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.54 2b89 h LEU 45 CO 0.08 0.88 0.27 0.00 -0.62 0.00 0.00 178.44 179.05 2b89 h ALA 46 N 1.25 0.69 -0.56 1.25 0.00 0.15 0.44 119.26 122.47 2b89 h ALA 46 Ca 0.30 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 2b89 h ALA 46 Cb 0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2b89 h ALA 46 CO -0.05 0.23 0.08 0.93 0.00 0.00 0.00 179.25 180.45 2b89 h GLU 47 N 0.71 0.94 -0.48 0.00 4.39 0.14 0.13 114.58 120.40 2b89 h GLU 47 Ca 0.18 -0.26 0.03 0.00 0.34 0.00 0.00 59.36 59.66 2b89 h GLU 47 Cb 0.10 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.60 2b89 h GLU 47 CO -0.03 0.90 0.27 0.00 -1.16 0.00 0.00 179.01 178.99 2b89 h ALA 48 N 1.00 0.62 -0.47 3.43 0.00 0.28 2.80 119.26 126.92 2b89 h ALA 48 Ca 0.17 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2b89 h ALA 48 Cb 0.42 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2b89 h ALA 48 CO 0.01 -0.06 -0.02 0.87 0.00 0.00 0.00 179.25 180.05 2b89 h LYS 49 N 0.53 0.78 -0.27 0.00 1.57 0.17 1.00 116.57 120.35 2b89 h LYS 49 Ca 0.20 -0.21 -0.16 0.00 -1.87 0.00 0.00 60.65 58.61 2b89 h LYS 49 Cb 0.07 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2b89 h LYS 49 CO -0.12 0.80 -0.46 0.87 -0.57 0.00 0.00 179.45 179.97 2b89 h LYS 50 N 0.73 0.72 -0.16 3.15 1.57 0.11 -1.07 116.57 121.62 2b89 h LYS 50 Ca 0.14 -0.40 -0.06 0.00 -1.87 0.00 0.00 60.65 58.45 2b89 h LYS 50 Cb 0.47 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 2b89 h LYS 50 CO 0.02 1.02 -0.15 -0.07 -0.57 0.00 0.00 179.45 179.70 2b89 h LEU 51 N 0.57 0.41 -0.19 2.94 -0.00 0.56 0.70 115.31 120.30 2b89 h LEU 51 Ca 0.03 -0.48 -0.00 0.00 -0.00 0.00 0.00 57.88 57.43 2b89 h LEU 51 Cb 1.02 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.55 2b89 h LEU 51 CO 0.10 0.80 0.11 -1.13 -0.00 0.00 0.00 178.44 178.32 2b89 h ASN 52 N 0.02 0.23 -0.04 -0.43 -1.24 0.10 0.13 115.58 114.36 2b89 h ASN 52 Ca 0.03 -0.07 -0.17 0.00 0.71 0.00 0.00 56.30 56.80 2b89 h ASN 52 Cb 0.69 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 39.67 2b89 h ASN 52 CO 0.04 0.23 -0.58 0.44 -1.29 0.00 0.00 177.43 176.26 2b89 h ASP 53 N 0.22 0.72 -0.15 1.15 3.32 -1.20 -2.07 116.42 118.41 2b89 h ASP 53 Ca 0.07 -0.40 -0.22 0.00 0.02 0.00 0.00 57.03 56.50 2b89 h ASP 53 Cb 0.04 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.40 2b89 h ASP 53 CO -0.01 1.14 -0.78 0.00 -1.72 0.00 0.00 179.24 177.87 2b89 h ALA 54 N 0.87 0.30 0.09 3.45 0.00 0.68 -3.35 119.26 121.30 2b89 h ALA 54 Ca 0.00 -0.60 -0.21 0.00 0.00 0.00 0.00 54.91 54.10 2b89 h ALA 54 Cb 1.15 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2b89 h ALA 54 CO 0.11 0.68 -1.04 1.96 0.00 0.00 0.00 179.25 180.97 2b89 h GLN 55 N 0.54 0.19 -7.08 0.00 4.20 -0.84 -3.48 115.11 108.64 2b89 h GLN 55 Ca -0.05 -0.32 -0.62 0.00 0.06 0.00 0.00 58.65 57.72 2b89 h GLN 55 Cb 1.41 0.12 -0.23 0.00 0.30 0.00 0.00 27.48 29.08 2b89 h GLN 55 CO 0.16 1.15 -0.96 0.00 -0.67 0.00 0.00 178.83 178.52 2b89 n ALA 56 N -2.90 -1.90 -0.78 3.87 0.00 -0.78 -4.54 120.51 113.47 2b89 n ALA 56 Ca -0.21 -0.38 -0.29 0.00 0.00 0.00 0.00 53.44 52.56 2b89 n ALA 56 Cb 0.79 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 19.11 2b89 n ALA 56 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2b89 n PRO 57 N -4.51 0.00 0.00 0.00 -0.01 -1.26 -5.09 135.00 124.13 2b89 n PRO 57 Ca -0.27 0.00 0.15 0.00 -0.01 0.00 0.00 63.50 63.37 2b89 n PRO 57 Cb 0.67 -0.85 0.70 0.00 -0.01 0.00 0.00 33.50 34.00 2b89 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 175.50 177.12