#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 6.17 0.99 -1.34 1.01 -1.26 -5.02 116.67 117.23 2b89 s ASP 2 Ca 0.00 2.29 -0.12 0.00 0.71 0.00 0.00 52.55 55.43 2b89 s ASP 2 Cb 0.00 -2.60 0.19 0.00 1.01 0.00 0.00 42.92 41.51 2b89 s ASP 2 CO 0.00 -0.91 1.09 0.20 0.21 0.00 0.00 175.17 175.76 2b89 s ASN 3 N -1.38 2.66 0.00 0.27 0.02 -1.26 -4.90 114.94 110.35 2b89 s ASN 3 Ca 0.64 1.23 0.13 0.00 -1.02 0.00 0.00 52.86 53.84 2b89 s ASN 3 Cb -0.28 -1.89 0.80 0.00 0.02 0.00 0.00 41.25 39.89 2b89 s ASN 3 CO 0.34 -3.12 1.43 0.29 0.02 0.00 0.00 177.10 176.06 2b89 n LYS 4 N -4.17 0.88 0.23 -0.60 5.02 -1.26 -4.04 118.16 114.22 2b89 n LYS 4 Ca 0.05 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.18 2b89 n LYS 4 Cb 0.57 -1.24 -0.08 0.00 -0.02 0.00 0.00 35.03 34.26 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 -1.05 -0.27 2.13 -1.00 -1.98 -1.16 116.94 113.62 2b89 h PHE 5 Ca 0.00 0.01 0.03 0.00 2.81 0.00 0.00 57.97 60.82 2b89 h PHE 5 Cb 0.00 0.41 -0.03 0.00 3.61 0.00 0.00 35.95 39.94 2b89 h PHE 5 CO 0.00 -0.53 0.06 -2.95 -1.61 0.00 0.00 178.31 173.28 2b89 h ASN 6 N -0.78 0.03 -0.98 2.17 7.08 -1.97 1.14 115.58 122.27 2b89 h ASN 6 Ca -0.03 0.04 0.01 0.00 -3.08 0.00 0.00 56.30 53.24 2b89 h ASN 6 Cb 0.70 0.05 -0.05 0.00 -2.08 0.00 0.00 38.32 36.94 2b89 h ASN 6 CO -0.08 0.05 0.65 0.50 -2.08 0.00 0.00 177.43 176.47 2b89 h LYS 7 N 0.16 1.30 -0.09 4.14 1.63 -1.81 1.05 116.57 122.95 2b89 h LYS 7 Ca 0.12 -0.08 -0.17 0.00 -0.85 0.00 0.00 60.65 59.67 2b89 h LYS 7 Cb 0.12 -0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 31.45 2b89 h LYS 7 CO -0.15 0.86 -0.69 1.49 -3.45 0.00 0.00 179.45 177.51 2b89 h GLU 8 N 1.34 0.39 -0.03 1.90 4.81 -0.52 -3.12 114.58 119.35 2b89 h GLU 8 Ca 0.36 -0.30 -0.18 0.00 -0.13 0.00 0.00 59.36 59.11 2b89 h GLU 8 Cb -0.15 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2b89 h GLU 8 CO -0.08 0.93 -0.77 0.00 -0.73 0.00 0.00 179.01 178.37 2b89 h ARG 9 N 0.28 0.24 -0.17 1.92 3.08 0.23 -2.11 114.38 117.86 2b89 h ARG 9 Ca -0.02 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.81 2b89 h ARG 9 Cb 1.25 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 2b89 h ARG 9 CO 0.12 0.90 0.09 0.28 -1.07 0.00 0.00 179.97 180.28 2b89 h VAL 10 N 0.15 1.11 -0.14 2.04 2.07 0.11 1.90 116.25 123.50 2b89 h VAL 10 Ca -0.03 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2b89 h VAL 10 Cb 1.35 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2b89 h VAL 10 CO 0.12 0.10 0.09 0.40 0.02 0.00 0.00 177.57 178.30 2b89 h ILE 11 N 0.16 1.05 -0.07 4.57 2.04 -1.58 0.78 117.51 124.46 2b89 h ILE 11 Ca 0.06 -0.11 -0.04 0.00 1.00 0.00 0.00 64.86 65.77 2b89 h ILE 11 Cb 0.08 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 2b89 h ILE 11 CO -0.01 0.05 -0.12 0.00 0.00 0.00 0.00 178.15 178.07 2b89 h ALA 12 N 1.03 0.11 -0.75 1.87 0.00 -1.02 0.46 119.26 120.96 2b89 h ALA 12 Ca 0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2b89 h ALA 12 Cb -0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2b89 h ALA 12 CO -0.01 -0.02 0.40 0.97 0.00 0.00 0.00 179.25 180.60 2b89 h ILE 13 N -0.27 1.22 -0.48 0.00 2.10 0.30 0.66 117.51 121.05 2b89 h ILE 13 Ca 0.01 -0.57 -0.08 0.00 1.08 0.00 0.00 64.86 65.30 2b89 h ILE 13 Cb 0.68 0.22 -0.02 0.00 -1.09 0.00 0.00 36.82 36.61 2b89 h ILE 13 CO 0.03 0.25 -0.01 1.23 -1.08 0.00 0.00 178.15 178.57 2b89 h GLY 14 N 1.09 0.86 0.68 8.18 0.00 -0.79 0.80 103.07 113.89 2b89 h GLY 14 Ca 0.26 -0.58 -0.06 0.00 0.00 0.00 0.00 47.33 46.96 2b89 h GLY 14 CO -0.04 0.54 -0.17 0.83 0.00 0.00 0.00 176.54 177.70 2b89 h GLU 15 N 0.74 0.30 -0.32 4.80 4.39 0.10 -3.13 114.58 121.46 2b89 h GLU 15 Ca 0.14 -0.18 -0.17 0.00 0.34 0.00 0.00 59.36 59.49 2b89 h GLU 15 Cb 0.46 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2b89 h GLU 15 CO 0.02 0.76 -0.48 0.82 -1.16 0.00 0.00 179.01 178.97 2b89 h ILE 16 N -0.13 1.27 0.00 3.13 2.04 0.43 -3.05 117.51 121.20 2b89 h ILE 16 Ca 0.01 -1.66 -0.00 0.00 1.00 0.00 0.00 64.86 64.20 2b89 h ILE 16 Cb 0.74 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.37 2b89 h ILE 16 CO 0.04 0.55 -0.02 0.24 0.00 0.00 0.00 178.15 178.96 2b89 h MET 17 N 0.69 0.00 -0.19 2.37 2.86 0.54 -1.78 114.93 119.42 2b89 h MET 17 Ca 0.03 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.51 2b89 h MET 17 Cb 1.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.74 2b89 h MET 17 CO 0.11 0.02 -0.53 -0.09 1.06 0.00 0.00 176.91 177.48 2b89 h ARG 18 N 0.00 0.57 -5.69 1.72 2.43 -1.47 -3.44 114.38 108.50 2b89 h ARG 18 Ca -0.00 -0.35 -0.62 0.00 -0.81 0.00 0.00 59.98 58.20 2b89 h ARG 18 Cb 0.16 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 2b89 h ARG 18 CO 0.00 0.96 1.52 1.28 -1.51 0.00 0.00 179.97 182.22 2b89 n LEU 19 N -3.97 1.42 0.14 3.80 4.77 -0.67 -4.82 117.00 117.67 2b89 n LEU 19 Ca -0.03 0.27 0.13 0.00 -0.03 0.00 0.00 56.01 56.35 2b89 n LEU 19 Cb 0.60 -1.15 0.34 0.00 -2.33 0.00 0.00 43.42 40.87 2b89 n LEU 19 CO 0.47 -0.86 0.86 1.55 -1.33 0.00 0.00 177.39 178.08 2b89 h PRO 20 N 12.70 0.00 -0.79 3.23 0.14 -1.88 -3.28 132.00 142.12 2b89 h PRO 20 Ca -0.18 0.00 -0.06 0.00 0.14 0.00 0.00 66.00 65.90 2b89 h PRO 20 Cb 1.33 0.00 -0.04 0.00 0.14 0.00 0.00 31.00 32.43 2b89 h PRO 20 CO 1.15 0.00 0.08 0.09 0.14 0.00 0.00 178.00 179.46 2b89 n ASN 21 N -2.49 3.93 -4.12 1.44 3.02 -1.26 -4.86 115.26 110.92 2b89 n ASN 21 Ca 0.05 -2.68 -0.19 0.00 -0.03 0.00 0.00 54.58 51.74 2b89 n ASN 21 Cb 0.46 -0.64 -0.13 0.00 -0.61 0.00 0.00 39.78 38.86 2b89 n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b89 s LEU 22 N -1.83 2.17 0.56 3.41 1.43 -1.24 -4.15 118.68 119.03 2b89 s LEU 22 Ca 0.35 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 2b89 s LEU 22 Cb 0.27 -0.51 -0.05 0.00 0.03 0.00 0.00 46.19 45.94 2b89 s LEU 22 CO 0.10 -0.00 0.96 0.54 0.23 0.00 0.00 176.35 178.17 2b89 s ASN 23 N -1.13 6.34 0.41 2.29 2.20 -1.26 -4.75 114.94 119.04 2b89 s ASN 23 Ca -0.00 1.35 0.19 0.00 -0.94 0.00 0.00 52.86 53.45 2b89 s ASN 23 Cb -0.08 -2.43 1.11 0.00 -2.00 0.00 0.00 41.25 37.85 2b89 s ASN 23 CO 0.01 -0.72 1.81 0.28 -2.94 0.00 0.00 177.10 175.53 2b89 h SER 24 N 0.16 0.41 -0.16 3.54 0.02 -1.97 0.20 113.55 115.76 2b89 h SER 24 Ca -0.45 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2b89 h SER 24 Cb 1.19 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 2b89 h SER 24 CO 0.62 0.12 0.10 -0.07 -1.14 0.00 0.00 176.83 176.46 2b89 h LEU 25 N 0.39 0.18 -0.37 5.07 4.07 -1.96 1.64 115.31 124.33 2b89 h LEU 25 Ca 0.54 -0.02 -0.04 0.00 0.08 0.00 0.00 57.88 58.44 2b89 h LEU 25 Cb 1.39 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 43.07 2b89 h LEU 25 CO -0.23 0.14 0.06 1.56 -1.08 0.00 0.00 178.44 178.89 2b89 h GLN 26 N 0.20 0.61 -0.75 1.13 4.20 -1.28 1.93 115.11 121.16 2b89 h GLN 26 Ca 0.06 -0.16 0.06 0.00 0.06 0.00 0.00 58.65 58.67 2b89 h GLN 26 Cb -0.01 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 27.64 2b89 h GLN 26 CO -0.01 0.67 0.44 0.28 -0.67 0.00 0.00 178.83 179.54 2b89 h VAL 27 N 0.45 0.99 -0.10 -0.54 2.07 -0.34 -0.00 116.25 118.78 2b89 h VAL 27 Ca 0.11 -0.27 -0.18 0.00 0.82 0.00 0.00 66.70 67.18 2b89 h VAL 27 Cb 0.36 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2b89 h VAL 27 CO 0.01 0.15 -0.69 0.58 0.02 0.00 0.00 177.57 177.64 2b89 h VAL 28 N 0.80 1.36 -0.95 2.57 2.07 0.30 -2.67 116.25 119.74 2b89 h VAL 28 Ca 0.33 -2.05 0.12 0.00 0.82 0.00 0.00 66.70 65.92 2b89 h VAL 28 Cb 0.19 2.03 -0.08 0.00 -1.52 0.00 0.00 31.29 31.92 2b89 h VAL 28 CO -0.18 0.62 0.61 0.00 0.02 0.00 0.00 177.57 178.63 2b89 h ALA 29 N 0.95 1.63 -0.29 1.67 0.00 0.47 0.52 119.26 124.22 2b89 h ALA 29 Ca -0.02 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2b89 h ALA 29 Cb 1.25 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2b89 h ALA 29 CO 0.12 0.14 -0.45 0.74 0.00 0.00 0.00 179.25 179.80 2b89 h PHE 30 N 0.89 0.90 -0.89 0.00 0.04 -0.90 0.21 116.94 117.19 2b89 h PHE 30 Ca 0.47 -0.28 0.10 0.00 2.80 0.00 0.00 57.97 61.06 2b89 h PHE 30 Cb 0.54 -0.18 -0.06 0.00 2.20 0.00 0.00 35.95 38.44 2b89 h PHE 30 CO -0.00 1.05 0.57 0.82 -0.60 0.00 0.00 178.31 180.15 2b89 h ILE 31 N 0.59 0.95 -0.39 -0.55 2.04 0.27 0.62 117.51 121.05 2b89 h ILE 31 Ca 0.04 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 2b89 h ILE 31 Cb 1.00 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2b89 h ILE 31 CO 0.10 0.16 -0.05 -1.13 0.00 0.00 0.00 178.15 177.22 2b89 h ASN 32 N 0.86 0.72 -0.58 1.72 -0.73 -0.17 -3.02 115.58 114.38 2b89 h ASN 32 Ca 0.42 -0.34 -0.01 0.00 1.87 0.00 0.00 56.30 58.23 2b89 h ASN 32 Cb 0.44 -0.20 -0.03 0.00 0.27 0.00 0.00 38.32 38.81 2b89 h ASN 32 CO -0.18 0.89 0.31 0.28 -0.37 0.00 0.00 177.43 178.36 2b89 h SER 33 N 0.54 0.74 -0.36 1.15 0.02 0.11 0.34 113.55 116.09 2b89 h SER 33 Ca 0.10 -0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2b89 h SER 33 Cb 0.55 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2b89 h SER 33 CO 0.03 0.61 0.23 -0.07 -1.14 0.00 0.00 176.83 176.50 2b89 h LEU 34 N 0.84 0.40 -0.51 5.07 3.38 -1.01 0.35 115.31 123.82 2b89 h LEU 34 Ca 0.21 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.01 2b89 h LEU 34 Cb 0.05 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2b89 h LEU 34 CO -0.03 0.29 -0.64 0.08 0.09 0.00 0.00 178.44 178.23 2b89 h ARG 35 N 0.47 0.41 0.00 1.13 0.11 -1.44 0.54 114.38 115.61 2b89 h ARG 35 Ca 0.14 -0.29 -0.00 0.00 0.10 0.00 0.00 59.98 59.92 2b89 h ARG 35 Cb -0.04 0.05 -0.00 0.00 1.11 0.00 0.00 29.97 31.09 2b89 h ARG 35 CO -0.04 0.91 -0.02 -0.44 0.10 0.00 0.00 179.97 180.48 2b89 h ASP 36 N 0.30 0.00 -0.36 0.08 3.32 -0.48 -3.40 116.42 115.88 2b89 h ASP 36 Ca -0.01 0.00 0.15 0.00 0.02 0.00 0.00 57.03 57.19 2b89 h ASP 36 Cb 1.18 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.55 2b89 h ASP 36 CO 0.11 0.02 -0.11 -0.62 -1.72 0.00 0.00 179.24 176.92 2b89 s ASP 37 N -5.57 -0.58 0.22 6.45 -1.08 0.12 -5.05 116.67 111.17 2b89 s ASP 37 Ca -0.01 -0.06 0.02 0.00 -0.52 0.00 0.00 52.55 51.97 2b89 s ASP 37 Cb 0.11 1.13 0.19 0.00 -1.46 0.00 0.00 42.92 42.89 2b89 s ASP 37 CO 0.51 -0.09 1.53 -0.65 0.52 0.00 0.00 175.17 176.98 2b89 h PRO 38 N 6.75 0.34 0.00 4.34 0.11 -0.16 -2.77 132.00 140.61 2b89 h PRO 38 Ca -0.06 -0.23 -0.02 0.00 0.11 0.00 0.00 66.00 65.80 2b89 h PRO 38 Cb 1.20 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2b89 h PRO 38 CO -0.05 0.84 -0.09 0.66 -0.21 0.00 0.00 178.00 179.15 2b89 h SER 39 N 0.25 0.00 -0.32 -2.05 4.64 -1.95 0.21 113.55 114.34 2b89 h SER 39 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2b89 h SER 39 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2b89 h SER 39 CO 0.10 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.15 2b89 n GLN 40 N -3.90 2.17 -0.13 4.77 6.02 -1.07 -4.15 117.38 121.09 2b89 n GLN 40 Ca -0.02 -1.77 0.15 0.00 -0.01 0.00 0.00 57.00 55.34 2b89 n GLN 40 Cb 0.19 -1.45 0.52 0.00 1.02 0.00 0.00 30.24 30.51 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 3.43 0.35 -0.56 1.08 4.64 -0.32 0.42 113.55 122.59 2b89 h SER 41 Ca 0.00 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.25 2b89 h SER 41 Cb 0.76 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.77 2b89 h SER 41 CO 0.00 0.19 0.03 0.00 -0.87 0.00 0.00 176.83 176.18 2b89 h ALA 42 N 1.67 0.76 -0.09 5.18 0.00 -1.75 -2.88 119.26 122.14 2b89 h ALA 42 Ca 0.33 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2b89 h ALA 42 Cb 0.78 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2b89 h ALA 42 CO -0.10 0.56 -0.68 -0.91 0.00 0.00 0.00 179.25 178.12 2b89 h ASN 43 N 0.86 0.47 -0.59 0.00 2.35 -0.92 -3.18 115.58 114.56 2b89 h ASN 43 Ca 0.16 -0.29 -0.07 0.00 -0.55 0.00 0.00 56.30 55.56 2b89 h ASN 43 Cb 0.51 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.72 2b89 h ASN 43 CO 0.02 1.01 0.11 -0.07 -1.65 0.00 0.00 177.43 176.86 2b89 h LEU 44 N 0.28 0.92 -1.03 1.61 3.38 -0.17 0.84 115.31 121.15 2b89 h LEU 44 Ca -0.02 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.60 2b89 h LEU 44 Cb 1.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 2b89 h LEU 44 CO 0.12 0.94 -0.38 -0.07 0.09 0.00 0.00 178.44 179.13 2b89 h LEU 45 N 0.87 0.20 -0.42 1.67 -0.00 -1.60 1.29 115.31 117.33 2b89 h LEU 45 Ca 0.18 -0.08 -0.00 0.00 -0.00 0.00 0.00 57.88 57.98 2b89 h LEU 45 Cb 0.40 -0.06 -0.02 0.00 -0.00 0.00 0.00 40.66 40.98 2b89 h LEU 45 CO 0.01 0.57 0.25 0.00 -0.00 0.00 0.00 178.44 179.27 2b89 h ALA 46 N 1.44 0.54 -0.16 1.53 0.00 -1.25 3.08 119.26 124.45 2b89 h ALA 46 Ca 0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2b89 h ALA 46 Cb 0.76 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2b89 h ALA 46 CO 0.06 0.04 0.06 0.93 0.00 0.00 0.00 179.25 180.34 2b89 h GLU 47 N 0.55 0.24 -0.62 0.00 5.08 0.15 0.52 114.58 120.50 2b89 h GLU 47 Ca 0.15 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2b89 h GLU 47 Cb 0.02 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2b89 h GLU 47 CO -0.03 0.34 0.41 0.00 -1.00 0.00 0.00 179.01 178.73 2b89 h ALA 48 N 0.89 0.79 -0.40 3.43 0.00 0.23 1.67 119.26 125.87 2b89 h ALA 48 Ca 0.05 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2b89 h ALA 48 Cb 0.19 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2b89 h ALA 48 CO -0.00 0.21 -0.01 0.87 0.00 0.00 0.00 179.25 180.32 2b89 h LYS 49 N 0.83 0.65 -0.24 0.00 1.57 0.59 1.30 116.57 121.27 2b89 h LYS 49 Ca 0.23 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.72 2b89 h LYS 49 Cb -0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2b89 h LYS 49 CO -0.06 0.67 -0.39 0.87 -0.57 0.00 0.00 179.45 179.97 2b89 h LYS 50 N 0.61 0.56 -0.29 3.15 1.79 0.21 0.16 116.57 122.77 2b89 h LYS 50 Ca 0.13 -0.28 -0.08 0.00 -2.18 0.00 0.00 60.65 58.23 2b89 h LYS 50 Cb 0.39 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.04 2b89 h LYS 50 CO 0.02 0.86 -0.14 -0.07 -1.08 0.00 0.00 179.45 179.04 2b89 h LEU 51 N 0.46 0.62 -0.17 2.94 -0.00 0.39 0.59 115.31 120.14 2b89 h LEU 51 Ca 0.04 -0.41 -0.00 0.00 -0.00 0.00 0.00 57.88 57.51 2b89 h LEU 51 Cb 0.89 -0.17 -0.01 0.00 -0.00 0.00 0.00 40.66 41.37 2b89 h LEU 51 CO 0.08 0.89 0.10 -1.13 -0.00 0.00 0.00 178.44 178.38 2b89 h ASN 52 N 0.35 0.20 0.08 -0.43 -0.73 0.18 0.59 115.58 115.81 2b89 h ASN 52 Ca 0.06 -0.05 -0.14 0.00 1.87 0.00 0.00 56.30 58.05 2b89 h ASN 52 Cb 0.66 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 39.19 2b89 h ASN 52 CO 0.04 0.19 -0.48 0.44 -0.37 0.00 0.00 177.43 177.26 2b89 h ASP 53 N 0.20 0.50 -0.11 1.15 3.32 -0.91 -1.64 116.42 118.93 2b89 h ASP 53 Ca 0.06 -0.24 -0.22 0.00 0.02 0.00 0.00 57.03 56.65 2b89 h ASP 53 Cb 0.02 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.44 2b89 h ASP 53 CO -0.01 0.90 -0.78 0.00 -1.72 0.00 0.00 179.24 177.63 2b89 h ALA 54 N 1.11 0.24 0.02 3.45 0.00 0.69 -3.36 119.26 121.42 2b89 h ALA 54 Ca 0.02 -0.60 -0.09 0.00 0.00 0.00 0.00 54.91 54.24 2b89 h ALA 54 Cb 0.98 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2b89 h ALA 54 CO 0.09 0.62 -0.48 1.96 0.00 0.00 0.00 179.25 181.43 2b89 h GLN 55 N 0.41 0.04 -6.86 0.00 4.20 0.11 -3.48 115.11 109.53 2b89 h GLN 55 Ca -0.07 -0.07 -0.56 0.00 0.06 0.00 0.00 58.65 58.01 2b89 h GLN 55 Cb 1.42 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.22 2b89 h GLN 55 CO 0.16 1.03 -1.03 0.00 -0.67 0.00 0.00 178.83 178.32 2b89 n ALA 56 N -2.84 -2.67 -1.24 3.87 0.00 -0.62 -4.41 120.51 112.60 2b89 n ALA 56 Ca -0.17 -0.49 -0.33 0.00 0.00 0.00 0.00 53.44 52.45 2b89 n ALA 56 Cb 0.59 -2.13 -0.13 0.00 0.00 0.00 0.00 19.45 17.78 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 -4.35 0.00 0.00 0.00 -0.01 -1.26 -5.11 135.00 124.27 2b89 n PRO 57 Ca -0.17 0.00 0.13 0.00 -0.01 0.00 0.00 63.50 63.45 2b89 n PRO 57 Cb 0.60 -1.21 0.78 0.00 -0.01 0.00 0.00 33.50 33.66 2b89 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 175.50 177.12