#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 6.79 -0.30 -1.34 2.15 -1.26 -4.99 116.67 117.71 2b89 s ASP 2 Ca 0.00 0.77 0.01 0.00 0.43 0.00 0.00 52.55 53.76 2b89 s ASP 2 Cb 0.00 -2.53 0.09 0.00 -0.30 0.00 0.00 42.92 40.18 2b89 s ASP 2 CO 0.00 -1.01 0.05 0.20 -0.17 0.00 0.00 175.17 174.24 2b89 s ASN 3 N 1.97 4.23 0.00 -0.34 0.02 -1.26 -4.95 114.94 114.61 2b89 s ASN 3 Ca 0.45 -1.70 0.17 0.00 -1.02 0.00 0.00 52.86 50.76 2b89 s ASN 3 Cb -0.10 -1.20 0.66 0.00 0.02 0.00 0.00 41.25 40.63 2b89 s ASN 3 CO 0.22 -0.36 1.47 0.29 0.02 0.00 0.00 177.10 178.74 2b89 n LYS 4 N 4.60 1.59 0.15 -0.60 5.02 -1.26 -4.30 118.16 123.35 2b89 n LYS 4 Ca -0.02 -0.89 -0.14 0.00 -2.02 0.00 0.00 58.31 55.23 2b89 n LYS 4 Cb 0.43 -1.33 -0.07 0.00 -0.02 0.00 0.00 35.03 34.04 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 1.68 -1.02 -0.43 2.13 -1.00 -1.99 -2.21 116.94 114.10 2b89 h PHE 5 Ca 0.00 0.02 0.07 0.00 2.81 0.00 0.00 57.97 60.87 2b89 h PHE 5 Cb 0.37 0.42 -0.06 0.00 3.61 0.00 0.00 35.95 40.30 2b89 h PHE 5 CO 0.11 -0.49 0.09 -2.95 -1.61 0.00 0.00 178.31 173.47 2b89 h ASN 6 N -0.65 0.02 -0.90 2.17 7.08 -1.97 0.99 115.58 122.32 2b89 h ASN 6 Ca 0.01 0.07 0.05 0.00 -3.08 0.00 0.00 56.30 53.36 2b89 h ASN 6 Cb 0.65 0.10 -0.06 0.00 -2.08 0.00 0.00 38.32 36.92 2b89 h ASN 6 CO -0.18 0.05 0.57 0.50 -2.08 0.00 0.00 177.43 176.29 2b89 h LYS 7 N 0.23 1.03 -0.12 4.14 1.63 -1.81 1.37 116.57 123.03 2b89 h LYS 7 Ca 0.21 -0.06 -0.20 0.00 -0.85 0.00 0.00 60.65 59.75 2b89 h LYS 7 Cb 0.26 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 2b89 h LYS 7 CO -0.27 0.68 -0.73 1.49 -3.45 0.00 0.00 179.45 177.17 2b89 h GLU 8 N 1.06 0.59 -0.10 1.90 4.57 -0.66 -3.16 114.58 118.80 2b89 h GLU 8 Ca 0.38 -0.47 -0.13 0.00 -1.18 0.00 0.00 59.36 57.96 2b89 h GLU 8 Cb 0.12 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2b89 h GLU 8 CO -0.16 1.09 -0.53 0.00 -1.18 0.00 0.00 179.01 178.23 2b89 h ARG 9 N 0.41 0.27 -0.24 1.92 3.08 0.22 -1.61 114.38 118.43 2b89 h ARG 9 Ca -0.04 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.85 2b89 h ARG 9 Cb 1.33 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 2b89 h ARG 9 CO 0.14 0.74 0.15 0.28 -1.07 0.00 0.00 179.97 180.21 2b89 h VAL 10 N 0.21 1.08 -0.06 2.04 2.07 0.18 2.25 116.25 124.02 2b89 h VAL 10 Ca 0.00 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2b89 h VAL 10 Cb 1.01 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2b89 h VAL 10 CO 0.08 0.08 0.03 0.40 0.02 0.00 0.00 177.57 178.18 2b89 h ILE 11 N 0.31 1.11 -0.06 4.57 2.04 -1.52 0.46 117.51 124.41 2b89 h ILE 11 Ca 0.09 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 2b89 h ILE 11 Cb -0.00 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2b89 h ILE 11 CO -0.02 0.09 -0.12 0.00 0.00 0.00 0.00 178.15 178.10 2b89 h ALA 12 N 0.91 0.10 -0.76 1.87 0.00 -0.91 -0.20 119.26 120.28 2b89 h ALA 12 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2b89 h ALA 12 Cb 0.12 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2b89 h ALA 12 CO -0.00 -0.02 0.43 0.97 0.00 0.00 0.00 179.25 180.63 2b89 h ILE 13 N -0.29 1.22 -0.55 0.00 2.10 0.37 0.73 117.51 121.08 2b89 h ILE 13 Ca 0.00 -0.52 -0.08 0.00 1.08 0.00 0.00 64.86 65.35 2b89 h ILE 13 Cb 0.69 0.18 -0.02 0.00 -1.09 0.00 0.00 36.82 36.58 2b89 h ILE 13 CO 0.03 0.24 0.04 1.23 -1.08 0.00 0.00 178.15 178.60 2b89 h GLY 14 N 1.08 0.99 0.75 8.18 0.00 -0.86 1.10 103.07 114.31 2b89 h GLY 14 Ca 0.27 -0.67 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 2b89 h GLY 14 CO -0.05 0.62 -0.17 0.83 0.00 0.00 0.00 176.54 177.77 2b89 h GLU 15 N 0.86 0.37 -0.26 4.80 4.39 0.87 -2.85 114.58 122.76 2b89 h GLU 15 Ca 0.17 -0.20 -0.17 0.00 0.34 0.00 0.00 59.36 59.50 2b89 h GLU 15 Cb 0.46 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2b89 h GLU 15 CO 0.02 0.77 -0.50 0.82 -1.16 0.00 0.00 179.01 178.95 2b89 h ILE 16 N -0.01 1.29 0.00 3.13 2.04 0.61 -2.97 117.51 121.61 2b89 h ILE 16 Ca 0.02 -1.71 -0.03 0.00 1.00 0.00 0.00 64.86 64.15 2b89 h ILE 16 Cb 0.71 1.63 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2b89 h ILE 16 CO 0.04 0.55 -0.14 0.24 0.00 0.00 0.00 178.15 178.84 2b89 h MET 17 N 0.58 0.00 -0.25 2.37 2.86 0.12 -2.46 114.93 118.15 2b89 h MET 17 Ca 0.02 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.55 2b89 h MET 17 Cb 1.07 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.72 2b89 h MET 17 CO 0.11 0.14 -0.32 -0.09 1.06 0.00 0.00 176.91 177.80 2b89 h ARG 18 N 0.00 0.52 -5.68 1.72 2.43 -1.33 -3.44 114.38 108.61 2b89 h ARG 18 Ca -0.00 -0.23 -0.63 0.00 -0.81 0.00 0.00 59.98 58.30 2b89 h ARG 18 Cb 0.51 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 2b89 h ARG 18 CO 0.02 0.78 1.50 1.28 -1.51 0.00 0.00 179.97 182.04 2b89 n LEU 19 N -4.07 1.18 0.07 3.80 4.77 -0.93 -4.82 117.00 117.00 2b89 n LEU 19 Ca -0.01 0.34 0.12 0.00 -0.03 0.00 0.00 56.01 56.43 2b89 n LEU 19 Cb 0.46 -1.08 0.46 0.00 -2.33 0.00 0.00 43.42 40.93 2b89 n LEU 19 CO 0.43 -0.82 0.87 -0.81 -1.33 0.00 0.00 177.39 175.73 2b89 n PRO 20 N 8.13 0.15 -0.05 3.23 -0.05 -1.26 -4.21 135.00 140.95 2b89 n PRO 20 Ca 0.52 0.23 -0.03 0.00 -0.05 0.00 0.00 63.50 64.17 2b89 n PRO 20 Cb 0.12 -1.71 -0.01 0.00 -0.05 0.00 0.00 33.50 31.84 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 -1.98 1.23 -4.26 3.54 3.02 -1.26 -4.98 115.26 110.58 2b89 n ASN 21 Ca 0.05 0.49 -0.39 0.00 -0.03 0.00 0.00 54.58 54.69 2b89 n ASN 21 Cb 0.32 -0.75 0.01 0.00 -0.61 0.00 0.00 39.78 38.75 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 -3.86 -3.48 -4.90 3.41 4.77 -1.26 -4.58 117.00 107.10 2b89 n LEU 22 Ca -0.05 0.68 -0.28 0.00 -0.03 0.00 0.00 56.01 56.33 2b89 n LEU 22 Cb 0.19 -0.86 0.01 0.00 -2.33 0.00 0.00 43.42 40.44 2b89 n LEU 22 CO 0.08 -4.68 0.51 0.54 -1.33 0.00 0.00 177.39 172.51 2b89 s ASN 23 N -1.00 6.03 0.40 -1.43 2.20 -1.26 -4.78 114.94 115.09 2b89 s ASN 23 Ca 0.57 0.93 0.17 0.00 -0.94 0.00 0.00 52.86 53.59 2b89 s ASN 23 Cb -0.52 -2.10 1.05 0.00 -2.00 0.00 0.00 41.25 37.69 2b89 s ASN 23 CO 0.65 -0.79 1.82 0.77 -2.94 0.00 0.00 177.10 176.62 2b89 h SER 24 N 0.01 0.46 -0.13 3.54 4.64 -1.97 0.24 113.55 120.34 2b89 h SER 24 Ca -0.46 0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2b89 h SER 24 Cb 1.22 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 2b89 h SER 24 CO 0.61 0.15 0.06 -0.07 -0.87 0.00 0.00 176.83 176.72 2b89 h LEU 25 N 0.44 0.16 -0.41 5.97 4.07 -1.96 1.55 115.31 125.13 2b89 h LEU 25 Ca 0.52 -0.11 -0.05 0.00 0.08 0.00 0.00 57.88 58.33 2b89 h LEU 25 Cb 1.25 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.94 2b89 h LEU 25 CO -0.23 0.22 0.07 1.56 -1.08 0.00 0.00 178.44 178.99 2b89 h GLN 26 N 0.09 0.68 -0.68 1.13 4.20 -1.50 2.15 115.11 121.18 2b89 h GLN 26 Ca 0.04 -0.18 0.05 0.00 0.06 0.00 0.00 58.65 58.62 2b89 h GLN 26 Cb 0.10 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.75 2b89 h GLN 26 CO -0.01 0.72 0.40 0.28 -0.67 0.00 0.00 178.83 179.55 2b89 h VAL 27 N 0.54 1.02 -0.10 -0.54 2.07 -0.29 -0.83 116.25 118.12 2b89 h VAL 27 Ca 0.13 -0.26 -0.17 0.00 0.82 0.00 0.00 66.70 67.21 2b89 h VAL 27 Cb 0.36 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2b89 h VAL 27 CO 0.01 0.14 -0.67 0.58 0.02 0.00 0.00 177.57 177.65 2b89 h VAL 28 N 0.76 1.37 -0.92 2.57 2.07 0.28 -2.81 116.25 119.56 2b89 h VAL 28 Ca 0.29 -2.04 0.14 0.00 0.82 0.00 0.00 66.70 65.91 2b89 h VAL 28 Cb 0.12 2.02 -0.08 0.00 -1.52 0.00 0.00 31.29 31.83 2b89 h VAL 28 CO -0.15 0.61 0.59 0.00 0.02 0.00 0.00 177.57 178.65 2b89 h ALA 29 N 0.99 1.74 -0.30 1.67 0.00 0.48 0.63 119.26 124.47 2b89 h ALA 29 Ca -0.02 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 2b89 h ALA 29 Cb 1.22 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 2b89 h ALA 29 CO 0.12 0.02 -0.52 0.74 0.00 0.00 0.00 179.25 179.60 2b89 h PHE 30 N 0.78 1.08 -0.99 0.00 0.04 -1.08 0.16 116.94 116.93 2b89 h PHE 30 Ca 0.46 -0.38 0.10 0.00 2.80 0.00 0.00 57.97 60.96 2b89 h PHE 30 Cb 0.66 -0.21 -0.08 0.00 2.20 0.00 0.00 35.95 38.52 2b89 h PHE 30 CO -0.00 1.20 0.63 0.82 -0.60 0.00 0.00 178.31 180.36 2b89 h ILE 31 N 0.67 0.97 -0.41 -0.55 2.04 0.32 0.38 117.51 120.94 2b89 h ILE 31 Ca 0.02 -0.35 -0.14 0.00 1.00 0.00 0.00 64.86 65.39 2b89 h ILE 31 Cb 1.12 -0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2b89 h ILE 31 CO 0.12 0.19 -0.28 0.78 0.00 0.00 0.00 178.15 178.95 2b89 h ASN 32 N 1.02 0.92 -0.32 1.72 2.35 -0.06 -3.09 115.58 118.13 2b89 h ASN 32 Ca 0.47 -0.37 -0.10 0.00 -0.55 0.00 0.00 56.30 55.75 2b89 h ASN 32 Cb 0.39 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 2b89 h ASN 32 CO -0.22 1.13 -0.15 0.28 -1.65 0.00 0.00 177.43 176.82 2b89 h SER 33 N 0.75 0.76 -0.60 5.81 0.02 0.12 -2.09 113.55 118.32 2b89 h SER 33 Ca 0.09 -0.24 0.05 0.00 -0.84 0.00 0.00 61.79 60.84 2b89 h SER 33 Cb 0.84 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 63.13 2b89 h SER 33 CO 0.07 0.92 0.34 -0.07 -1.14 0.00 0.00 176.83 176.95 2b89 h LEU 34 N 0.68 0.51 -0.86 5.07 3.38 -0.94 0.21 115.31 123.37 2b89 h LEU 34 Ca 0.11 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 2b89 h LEU 34 Cb 0.63 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2b89 h LEU 34 CO 0.04 0.35 -0.35 0.08 0.09 0.00 0.00 178.44 178.65 2b89 h ARG 35 N 0.65 0.42 0.00 1.13 0.11 -1.48 0.38 114.38 115.59 2b89 h ARG 35 Ca 0.26 -0.19 -0.03 0.00 0.10 0.00 0.00 59.98 60.13 2b89 h ARG 35 Cb 0.12 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.19 2b89 h ARG 35 CO -0.15 0.72 -0.12 0.22 0.10 0.00 0.00 179.97 180.74 2b89 h ASP 36 N 0.36 0.00 -0.45 0.08 1.82 -0.55 -3.41 116.42 114.27 2b89 h ASP 36 Ca 0.04 0.00 0.16 0.00 -0.39 0.00 0.00 57.03 56.84 2b89 h ASP 36 Cb 0.79 0.00 -0.19 0.00 0.68 0.00 0.00 39.33 40.61 2b89 h ASP 36 CO 0.06 0.12 -0.12 -0.62 -1.61 0.00 0.00 179.24 177.07 2b89 s ASP 37 N -5.98 -0.74 0.21 2.28 -1.08 0.64 -5.05 116.67 106.95 2b89 s ASP 37 Ca -0.01 0.05 -0.00 0.00 -0.52 0.00 0.00 52.55 52.07 2b89 s ASP 37 Cb 0.11 1.42 0.17 0.00 -1.46 0.00 0.00 42.92 43.16 2b89 s ASP 37 CO 0.58 -0.13 1.53 -0.65 0.52 0.00 0.00 175.17 177.01 2b89 h PRO 38 N 7.32 0.43 0.00 4.34 0.11 -0.53 -2.68 132.00 140.99 2b89 h PRO 38 Ca -0.06 -0.28 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 2b89 h PRO 38 Cb 1.18 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2b89 h PRO 38 CO -0.03 0.88 -0.12 0.66 -0.21 0.00 0.00 178.00 179.19 2b89 h SER 39 N 0.33 0.00 -0.63 -2.05 4.64 -1.96 0.10 113.55 113.98 2b89 h SER 39 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b89 h SER 39 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2b89 h SER 39 CO 0.10 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.18 2b89 n GLN 40 N -4.06 2.49 -0.28 4.77 6.02 -1.07 -4.29 117.38 120.95 2b89 n GLN 40 Ca -0.02 -2.26 0.03 0.00 -0.01 0.00 0.00 57.00 54.73 2b89 n GLN 40 Cb 0.20 -1.50 0.16 0.00 1.02 0.00 0.00 30.24 30.12 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 3.66 0.64 -0.59 1.08 4.64 -0.46 0.58 113.55 123.11 2b89 h SER 41 Ca 0.00 0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 2b89 h SER 41 Cb 0.86 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.85 2b89 h SER 41 CO 0.01 0.37 0.27 0.00 -0.87 0.00 0.00 176.83 176.60 2b89 h ALA 42 N 1.45 1.30 -0.20 5.18 0.00 -1.76 0.97 119.26 126.20 2b89 h ALA 42 Ca 0.39 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 2b89 h ALA 42 Cb 0.36 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2b89 h ALA 42 CO -0.25 0.53 -0.52 -0.97 0.00 0.00 0.00 179.25 178.03 2b89 h ASN 43 N 0.88 0.62 -0.07 0.00 -1.24 -0.98 0.96 115.58 115.75 2b89 h ASN 43 Ca 0.21 -0.32 -0.06 0.00 0.71 0.00 0.00 56.30 56.84 2b89 h ASN 43 Cb 0.14 -0.18 0.00 0.00 0.73 0.00 0.00 38.32 39.02 2b89 h ASN 43 CO -0.02 1.03 -0.19 -0.07 -1.29 0.00 0.00 177.43 176.89 2b89 h LEU 44 N 0.44 0.28 -1.10 0.34 3.38 0.60 0.93 115.31 120.18 2b89 h LEU 44 Ca 0.01 -0.60 -0.08 0.00 0.09 0.00 0.00 57.88 57.30 2b89 h LEU 44 Cb 1.06 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2b89 h LEU 44 CO 0.10 0.83 -0.26 0.17 0.09 0.00 0.00 178.44 179.37 2b89 h LEU 45 N -0.26 0.31 -0.53 1.67 8.10 0.99 1.58 115.31 127.17 2b89 h LEU 45 Ca -0.00 -0.10 -0.06 0.00 0.11 0.00 0.00 57.88 57.83 2b89 h LEU 45 Cb 0.80 -0.08 -0.02 0.00 -0.44 0.00 0.00 40.66 40.92 2b89 h LEU 45 CO 0.04 0.58 0.11 0.00 -4.11 0.00 0.00 178.44 175.05 2b89 h ALA 46 N 1.45 0.70 -0.44 0.17 0.00 0.12 0.36 119.26 121.62 2b89 h ALA 46 Ca 0.04 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2b89 h ALA 46 Cb 0.62 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2b89 h ALA 46 CO 0.04 0.41 0.01 0.93 0.00 0.00 0.00 179.25 180.65 2b89 h GLU 47 N 0.75 0.78 -0.43 0.00 4.39 0.24 0.83 114.58 121.13 2b89 h GLU 47 Ca 0.16 -0.24 0.04 0.00 0.34 0.00 0.00 59.36 59.66 2b89 h GLU 47 Cb 0.37 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.91 2b89 h GLU 47 CO 0.01 0.83 0.20 0.00 -1.16 0.00 0.00 179.01 178.89 2b89 h ALA 48 N 0.91 0.53 -0.43 3.43 0.00 0.28 2.81 119.26 126.79 2b89 h ALA 48 Ca 0.13 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 2b89 h ALA 48 Cb 0.48 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2b89 h ALA 48 CO 0.02 -0.16 0.03 0.87 0.00 0.00 0.00 179.25 180.02 2b89 h LYS 49 N 0.41 0.67 -0.27 0.00 1.57 -0.04 1.16 116.57 120.08 2b89 h LYS 49 Ca 0.19 -0.15 -0.15 0.00 -1.87 0.00 0.00 60.65 58.67 2b89 h LYS 49 Cb 0.11 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2b89 h LYS 49 CO -0.14 0.67 -0.43 -0.22 -0.57 0.00 0.00 179.45 178.76 2b89 h LYS 50 N 0.64 0.67 -0.18 3.15 3.64 0.15 -0.66 116.57 123.99 2b89 h LYS 50 Ca 0.14 -0.36 -0.07 0.00 -1.27 0.00 0.00 60.65 59.09 2b89 h LYS 50 Cb 0.35 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2b89 h LYS 50 CO 0.01 0.97 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.92 2b89 h LEU 51 N 0.54 0.46 -0.22 5.20 -0.00 0.59 0.72 115.31 122.60 2b89 h LEU 51 Ca 0.04 -0.47 0.01 0.00 -0.00 0.00 0.00 57.88 57.46 2b89 h LEU 51 Cb 0.96 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.48 2b89 h LEU 51 CO 0.09 0.83 0.13 -1.13 -0.00 0.00 0.00 178.44 178.36 2b89 h ASN 52 N 0.09 0.21 -0.09 -0.43 -1.24 0.14 0.40 115.58 114.66 2b89 h ASN 52 Ca 0.03 0.00 -0.18 0.00 0.71 0.00 0.00 56.30 56.86 2b89 h ASN 52 Cb 0.70 -0.04 -0.00 0.00 0.73 0.00 0.00 38.32 39.70 2b89 h ASN 52 CO 0.04 0.16 -0.58 0.44 -1.29 0.00 0.00 177.43 176.19 2b89 h ASP 53 N 0.27 0.77 -0.16 1.15 3.32 -1.10 -1.82 116.42 118.86 2b89 h ASP 53 Ca 0.08 -0.43 -0.22 0.00 0.02 0.00 0.00 57.03 56.48 2b89 h ASP 53 Cb -0.01 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.33 2b89 h ASP 53 CO -0.04 1.19 -0.78 0.00 -1.72 0.00 0.00 179.24 177.89 2b89 h ALA 54 N 0.82 0.31 0.08 3.45 0.00 0.87 -3.35 119.26 121.44 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 1.16 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2b89 h ALA 54 CO 0.12 0.68 -1.08 1.96 0.00 0.00 0.00 179.25 180.93 2b89 h GLN 55 N 0.55 0.17 -7.05 0.00 4.20 -0.31 -3.48 115.11 109.20 2b89 h GLN 55 Ca -0.05 -0.30 -0.61 0.00 0.06 0.00 0.00 58.65 57.75 2b89 h GLN 55 Cb 1.41 0.11 -0.22 0.00 0.30 0.00 0.00 27.48 29.08 2b89 h GLN 55 CO 0.16 1.14 -0.95 0.00 -0.67 0.00 0.00 178.83 178.51 2b89 n ALA 56 N -2.94 -1.91 -0.78 3.87 0.00 -0.68 -4.56 120.51 113.50 2b89 n ALA 56 Ca -0.22 -0.38 -0.31 0.00 0.00 0.00 0.00 53.44 52.53 2b89 n ALA 56 Cb 0.79 -1.07 -0.08 0.00 0.00 0.00 0.00 19.45 19.09 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 63.36 2b89 n PRO 57 Cb 0.67 -0.88 0.70 0.00 -0.01 0.00 0.00 33.50 33.98 2b89 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 175.50 177.12