#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b89 n ASP 2 N 0.00 0.19 -3.56 -1.34 5.75 -1.26 -5.17 116.55 111.17 2b89 n ASP 2 Ca 0.00 -0.60 -0.30 0.00 -0.01 0.00 0.00 54.79 53.87 2b89 n ASP 2 Cb 0.00 0.00 0.26 0.00 -1.03 0.00 0.00 41.12 40.35 2b89 n ASP 2 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 2b89 s ASN 3 N -0.21 0.06 0.00 -1.12 0.01 -1.26 -4.86 114.94 107.56 2b89 s ASN 3 Ca 0.00 0.61 0.14 0.00 -0.71 0.00 0.00 52.86 52.89 2b89 s ASN 3 Cb 0.00 -0.81 0.82 0.00 0.41 0.00 0.00 41.25 41.67 2b89 s ASN 3 CO 0.00 -4.65 1.35 0.29 -1.51 0.00 0.00 177.10 172.58 2b89 n LYS 4 N -5.12 0.75 0.32 -0.60 5.02 -1.26 -3.86 118.16 113.42 2b89 n LYS 4 Ca 0.14 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.26 2b89 n LYS 4 Cb 0.60 -1.28 -0.09 0.00 -0.02 0.00 0.00 35.03 34.24 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 -1.02 -0.25 2.13 -1.00 -1.98 -1.09 116.94 113.73 2b89 h PHE 5 Ca 0.00 -0.01 0.03 0.00 2.81 0.00 0.00 57.97 60.80 2b89 h PHE 5 Cb 0.00 0.37 -0.03 0.00 3.61 0.00 0.00 35.95 39.90 2b89 h PHE 5 CO 0.00 -0.57 0.07 -0.91 -1.61 0.00 0.00 178.31 175.30 2b89 h ASN 6 N -0.91 0.07 -0.76 2.17 2.35 -1.95 0.92 115.58 117.47 2b89 h ASN 6 Ca -0.07 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 55.73 2b89 h ASN 6 Cb 0.75 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.11 2b89 h ASN 6 CO 0.04 0.07 0.50 0.50 -1.65 0.00 0.00 177.43 176.89 2b89 h LYS 7 N 0.18 0.98 -0.26 0.81 1.63 -1.80 1.55 116.57 119.66 2b89 h LYS 7 Ca 0.11 -0.06 -0.13 0.00 -0.85 0.00 0.00 60.65 59.72 2b89 h LYS 7 Cb 0.09 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.48 2b89 h LYS 7 CO -0.12 0.65 -0.36 1.49 -3.45 0.00 0.00 179.45 177.66 2b89 h GLU 8 N 1.01 0.58 -0.01 1.90 4.81 -0.63 -2.79 114.58 119.44 2b89 h GLU 8 Ca 0.28 -0.28 -0.20 0.00 -0.13 0.00 0.00 59.36 59.03 2b89 h GLU 8 Cb -0.09 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2b89 h GLU 8 CO -0.07 0.86 -0.86 0.00 -0.73 0.00 0.00 179.01 178.20 2b89 h ARG 9 N 0.49 0.30 -0.07 1.92 3.08 0.19 -2.30 114.38 117.99 2b89 h ARG 9 Ca 0.05 -0.31 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 2b89 h ARG 9 Cb 0.85 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.98 2b89 h ARG 9 CO 0.07 1.00 0.02 0.28 -1.07 0.00 0.00 179.97 180.27 2b89 h VAL 10 N 0.18 1.18 -0.01 2.04 2.07 0.23 1.70 116.25 123.64 2b89 h VAL 10 Ca -0.05 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 2b89 h VAL 10 Cb 1.48 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 32.66 2b89 h VAL 10 CO 0.14 0.15 0.00 0.40 0.02 0.00 0.00 177.57 178.29 2b89 h ILE 11 N -0.08 1.04 -0.09 4.57 2.04 -1.58 0.10 117.51 123.51 2b89 h ILE 11 Ca 0.02 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 2b89 h ILE 11 Cb 0.23 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2b89 h ILE 11 CO -0.00 0.03 -0.11 0.00 0.00 0.00 0.00 178.15 178.07 2b89 h ALA 12 N 0.95 0.14 -0.69 1.87 0.00 -1.26 -1.07 119.26 119.20 2b89 h ALA 12 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2b89 h ALA 12 Cb 0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2b89 h ALA 12 CO -0.00 -0.01 0.45 0.97 0.00 0.00 0.00 179.25 180.66 2b89 h ILE 13 N -0.19 1.18 -0.74 0.00 2.10 0.25 0.50 117.51 120.62 2b89 h ILE 13 Ca 0.01 -0.34 -0.05 0.00 1.08 0.00 0.00 64.86 65.56 2b89 h ILE 13 Cb 0.65 0.17 -0.03 0.00 -1.09 0.00 0.00 36.82 36.52 2b89 h ILE 13 CO 0.03 0.18 0.26 1.23 -1.08 0.00 0.00 178.15 178.76 2b89 h GLY 14 N 0.94 1.20 0.83 8.18 0.00 -0.68 1.13 103.07 114.67 2b89 h GLY 14 Ca 0.25 -0.68 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 2b89 h GLY 14 CO -0.05 0.64 -0.19 0.83 0.00 0.00 0.00 176.54 177.76 2b89 h GLU 15 N 1.09 0.48 -0.39 4.80 4.39 0.47 -2.71 114.58 122.70 2b89 h GLU 15 Ca 0.24 -0.25 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 2b89 h GLU 15 Cb 0.26 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2b89 h GLU 15 CO -0.01 0.82 -0.36 0.82 -1.16 0.00 0.00 179.01 179.12 2b89 h ILE 16 N 0.15 1.27 0.00 3.13 2.04 0.24 -2.87 117.51 121.47 2b89 h ILE 16 Ca 0.03 -1.53 -0.04 0.00 1.00 0.00 0.00 64.86 64.32 2b89 h ILE 16 Cb 0.73 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2b89 h ILE 16 CO 0.05 0.51 -0.19 0.24 0.00 0.00 0.00 178.15 178.76 2b89 h MET 17 N 0.76 0.00 -0.21 2.37 2.86 0.13 -2.36 114.93 118.48 2b89 h MET 17 Ca 0.07 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.58 2b89 h MET 17 Cb 0.94 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 2b89 h MET 17 CO 0.09 0.19 -0.41 -0.09 1.06 0.00 0.00 176.91 177.74 2b89 h ARG 18 N 0.00 0.48 -5.71 1.72 2.43 -1.25 -3.44 114.38 108.61 2b89 h ARG 18 Ca -0.00 -0.24 -0.64 0.00 -0.81 0.00 0.00 59.98 58.28 2b89 h ARG 18 Cb 0.51 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2b89 h ARG 18 CO 0.02 0.81 1.49 1.28 -1.51 0.00 0.00 179.97 182.07 2b89 n LEU 19 N -4.02 1.24 0.07 3.80 4.77 -0.89 -4.82 117.00 117.14 2b89 n LEU 19 Ca -0.02 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 2b89 n LEU 19 Cb 0.51 -1.09 0.46 0.00 -2.33 0.00 0.00 43.42 40.97 2b89 n LEU 19 CO 0.44 -0.82 0.86 -0.81 -1.33 0.00 0.00 177.39 175.74 2b89 n PRO 20 N 8.12 0.13 -0.05 3.23 -0.05 -1.26 -4.19 135.00 140.94 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 -1.69 -0.01 0.00 -0.05 0.00 0.00 33.50 31.87 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 -1.93 1.16 -4.29 3.54 3.02 -1.26 -4.97 115.26 110.53 2b89 n ASN 21 Ca 0.05 0.50 -0.40 0.00 -0.03 0.00 0.00 54.58 54.70 2b89 n ASN 21 Cb 0.30 -0.74 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 -3.77 -2.93 -4.91 3.41 4.77 -1.26 -4.58 117.00 107.73 2b89 n LEU 22 Ca -0.05 0.70 -0.28 0.00 -0.03 0.00 0.00 56.01 56.36 2b89 n LEU 22 Cb 0.17 -0.90 0.01 0.00 -2.33 0.00 0.00 43.42 40.38 2b89 n LEU 22 CO 0.07 -4.43 0.52 0.54 -1.33 0.00 0.00 177.39 172.75 2b89 s ASN 23 N -1.02 5.99 0.39 -1.43 2.20 -1.26 -4.77 114.94 115.04 2b89 s ASN 23 Ca 0.59 0.91 0.16 0.00 -0.94 0.00 0.00 52.86 53.58 2b89 s ASN 23 Cb -0.52 -2.07 1.02 0.00 -2.00 0.00 0.00 41.25 37.68 2b89 s ASN 23 CO 0.64 -0.81 1.81 0.77 -2.94 0.00 0.00 177.10 176.57 2b89 h SER 24 N -0.01 0.49 -0.13 3.54 4.64 -1.97 0.27 113.55 120.39 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 1.22 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 2b89 h SER 24 CO 0.61 0.16 0.07 -0.07 -0.87 0.00 0.00 176.83 176.74 2b89 h LEU 25 N 0.47 0.16 -0.42 5.97 4.07 -1.96 1.58 115.31 125.18 2b89 h LEU 25 Ca 0.53 -0.08 -0.07 0.00 0.08 0.00 0.00 57.88 58.35 2b89 h LEU 25 Cb 1.23 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.92 2b89 h LEU 25 CO -0.25 0.19 0.00 1.56 -1.08 0.00 0.00 178.44 178.86 2b89 h GLN 26 N 0.12 0.74 -0.73 1.13 4.20 -1.49 2.15 115.11 121.23 2b89 h GLN 26 Ca 0.05 -0.24 0.05 0.00 0.06 0.00 0.00 58.65 58.57 2b89 h GLN 26 Cb 0.07 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.72 2b89 h GLN 26 CO -0.01 0.82 0.43 0.28 -0.67 0.00 0.00 178.83 179.68 2b89 h VAL 27 N 0.58 1.02 -0.10 -0.54 2.07 -0.21 -0.38 116.25 118.69 2b89 h VAL 27 Ca 0.12 -0.28 -0.18 0.00 0.82 0.00 0.00 66.70 67.19 2b89 h VAL 27 Cb 0.48 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2b89 h VAL 27 CO 0.02 0.15 -0.69 0.58 0.02 0.00 0.00 177.57 177.65 2b89 h VAL 28 N 0.80 1.37 -0.89 2.57 2.07 0.29 -2.76 116.25 119.70 2b89 h VAL 28 Ca 0.32 -2.06 0.14 0.00 0.82 0.00 0.00 66.70 65.91 2b89 h VAL 28 Cb 0.15 2.04 -0.07 0.00 -1.52 0.00 0.00 31.29 31.89 2b89 h VAL 28 CO -0.16 0.62 0.57 0.00 0.02 0.00 0.00 177.57 178.62 2b89 h ALA 29 N 0.95 1.80 -0.22 1.67 0.00 0.51 0.65 119.26 124.62 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 1.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2b89 h ALA 29 CO 0.12 -0.03 -0.63 0.74 0.00 0.00 0.00 179.25 179.45 2b89 h PHE 30 N 0.72 0.99 -0.95 0.00 0.04 -1.00 0.63 116.94 117.38 2b89 h PHE 30 Ca 0.44 -0.38 0.10 0.00 2.80 0.00 0.00 57.97 60.93 2b89 h PHE 30 Cb 0.67 -0.17 -0.07 0.00 2.20 0.00 0.00 35.95 38.58 2b89 h PHE 30 CO -0.00 1.20 0.61 0.82 -0.60 0.00 0.00 178.31 180.33 2b89 h ILE 31 N 0.57 0.98 -0.43 -0.55 2.04 0.42 0.64 117.51 121.18 2b89 h ILE 31 Ca -0.01 -0.33 -0.13 0.00 1.00 0.00 0.00 64.86 65.39 2b89 h ILE 31 Cb 1.24 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2b89 h ILE 31 CO 0.13 0.18 -0.25 0.78 0.00 0.00 0.00 178.15 178.99 2b89 h ASN 32 N 0.97 0.91 -0.23 1.72 2.35 -0.15 -3.01 115.58 118.15 2b89 h ASN 32 Ca 0.44 -0.35 -0.10 0.00 -0.55 0.00 0.00 56.30 55.74 2b89 h ASN 32 Cb 0.38 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 2b89 h ASN 32 CO -0.20 1.11 -0.19 0.28 -1.65 0.00 0.00 177.43 176.78 2b89 h SER 33 N 0.76 0.67 -0.41 5.81 0.02 0.12 -1.65 113.55 118.86 2b89 h SER 33 Ca 0.10 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2b89 h SER 33 Cb 0.80 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.12 2b89 h SER 33 CO 0.07 0.86 0.20 -0.07 -1.14 0.00 0.00 176.83 176.75 2b89 h LEU 34 N 0.60 0.29 -0.54 5.07 3.38 -0.84 0.29 115.31 123.56 2b89 h LEU 34 Ca 0.09 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.92 2b89 h LEU 34 Cb 0.66 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2b89 h LEU 34 CO 0.05 0.21 -0.62 0.08 0.09 0.00 0.00 178.44 178.25 2b89 h ARG 35 N 0.41 0.39 0.00 1.13 0.11 -1.48 0.73 114.38 115.68 2b89 h ARG 35 Ca 0.18 -0.27 -0.00 0.00 0.10 0.00 0.00 59.98 59.98 2b89 h ARG 35 Cb 0.09 0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.21 2b89 h ARG 35 CO -0.13 0.89 -0.02 -0.44 0.10 0.00 0.00 179.97 180.37 2b89 h ASP 36 N 0.29 0.00 -0.29 0.08 3.32 -0.70 -3.40 116.42 115.73 2b89 h ASP 36 Ca -0.01 0.00 0.16 0.00 0.02 0.00 0.00 57.03 57.20 2b89 h ASP 36 Cb 1.15 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.52 2b89 h ASP 36 CO 0.11 0.02 -0.09 -0.62 -1.72 0.00 0.00 179.24 176.93 2b89 s ASP 37 N -5.55 -0.46 0.24 6.45 -1.08 0.98 -5.04 116.67 112.21 2b89 s ASP 37 Ca -0.01 -0.09 0.02 0.00 -0.52 0.00 0.00 52.55 51.95 2b89 s ASP 37 Cb 0.11 0.93 0.27 0.00 -1.46 0.00 0.00 42.92 42.77 2b89 s ASP 37 CO 0.50 -0.07 1.59 -0.65 0.52 0.00 0.00 175.17 177.07 2b89 h PRO 38 N 6.42 0.37 -0.05 4.34 0.11 0.24 -2.42 132.00 141.01 2b89 h PRO 38 Ca -0.06 -0.21 0.02 0.00 0.11 0.00 0.00 66.00 65.85 2b89 h PRO 38 Cb 1.20 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2b89 h PRO 38 CO -0.07 0.79 0.04 0.77 -0.21 0.00 0.00 178.00 179.31 2b89 h SER 39 N 0.29 0.00 -0.30 -2.05 0.02 -1.95 0.43 113.55 109.98 2b89 h SER 39 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2b89 h SER 39 Cb 0.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2b89 h SER 39 CO 0.08 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.77 2b89 n GLN 40 N -4.52 2.10 -0.30 3.45 1.13 -0.95 -4.11 117.38 114.18 2b89 n GLN 40 Ca -0.02 -1.67 0.07 0.00 -1.94 0.00 0.00 57.00 53.44 2b89 n GLN 40 Cb 0.14 -1.44 0.28 0.00 0.11 0.00 0.00 30.24 29.33 2b89 n GLN 40 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2b89 h SER 41 N 3.22 0.84 -0.55 1.08 4.64 0.25 1.09 113.55 124.11 2b89 h SER 41 Ca 0.00 0.03 0.04 0.00 -0.47 0.00 0.00 61.79 61.39 2b89 h SER 41 Cb 0.71 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.61 2b89 h SER 41 CO 0.00 0.49 0.30 0.00 -0.87 0.00 0.00 176.83 176.75 2b89 h ALA 42 N 1.54 0.72 -0.18 5.18 0.00 -1.72 1.11 119.26 125.90 2b89 h ALA 42 Ca 0.43 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 55.16 2b89 h ALA 42 Cb 0.41 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2b89 h ALA 42 CO -0.19 -0.03 -0.66 -0.91 0.00 0.00 0.00 179.25 177.46 2b89 h ASN 43 N 0.58 0.81 -0.06 0.00 2.35 -0.93 -0.44 115.58 117.90 2b89 h ASN 43 Ca 0.24 -0.48 -0.04 0.00 -0.55 0.00 0.00 56.30 55.47 2b89 h ASN 43 Cb 0.12 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.25 2b89 h ASN 43 CO -0.15 1.25 -0.12 -0.07 -1.65 0.00 0.00 177.43 176.70 2b89 h LEU 44 N 0.51 0.20 -1.13 1.61 3.38 0.17 1.89 115.31 121.93 2b89 h LEU 44 Ca -0.02 -0.57 -0.08 0.00 0.09 0.00 0.00 57.88 57.30 2b89 h LEU 44 Cb 1.26 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2b89 h LEU 44 CO 0.13 0.74 -0.29 0.17 0.09 0.00 0.00 178.44 179.28 2b89 h LEU 45 N -0.33 0.24 -0.29 1.67 -0.00 0.12 1.17 115.31 117.90 2b89 h LEU 45 Ca 0.00 -0.08 -0.08 0.00 -0.00 0.00 0.00 57.88 57.72 2b89 h LEU 45 Cb 0.71 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 41.29 2b89 h LEU 45 CO 0.03 0.53 -0.14 0.00 -0.00 0.00 0.00 178.44 178.86 2b89 h ALA 46 N 1.49 0.41 -0.70 0.17 0.00 -0.86 0.84 119.26 120.61 2b89 h ALA 46 Ca 0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2b89 h ALA 46 Cb 0.63 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2b89 h ALA 46 CO 0.05 0.29 0.43 0.93 0.00 0.00 0.00 179.25 180.94 2b89 h GLU 47 N 0.35 0.95 -0.28 0.00 5.08 0.41 0.35 114.58 121.44 2b89 h GLU 47 Ca 0.06 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2b89 h GLU 47 Cb 0.66 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2b89 h GLU 47 CO 0.04 0.67 0.16 0.00 -1.00 0.00 0.00 179.01 178.88 2b89 h ALA 48 N 1.22 0.35 -0.51 3.43 0.00 0.16 1.82 119.26 125.73 2b89 h ALA 48 Ca 0.25 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2b89 h ALA 48 Cb -0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2b89 h ALA 48 CO -0.05 -0.22 0.24 0.87 0.00 0.00 0.00 179.25 180.09 2b89 h LYS 49 N 0.33 0.72 -0.36 0.00 1.57 -0.06 1.16 116.57 119.93 2b89 h LYS 49 Ca 0.11 -0.09 -0.15 0.00 -1.87 0.00 0.00 60.65 58.65 2b89 h LYS 49 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 2b89 h LYS 49 CO -0.06 0.56 -0.38 0.87 -0.57 0.00 0.00 179.45 179.88 2b89 h LYS 50 N 0.72 0.85 -0.33 3.15 1.57 0.16 -1.44 116.57 121.25 2b89 h LYS 50 Ca 0.18 -0.44 -0.16 0.00 -1.87 0.00 0.00 60.65 58.36 2b89 h LYS 50 Cb 0.09 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2b89 h LYS 50 CO -0.02 1.08 -0.43 -0.07 -0.57 0.00 0.00 179.45 179.44 2b89 h LEU 51 N 0.70 0.95 -0.25 2.94 4.07 0.41 1.66 115.31 125.78 2b89 h LEU 51 Ca 0.06 -0.49 0.02 0.00 0.08 0.00 0.00 57.88 57.54 2b89 h LEU 51 Cb 0.95 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2b89 h LEU 51 CO 0.09 1.25 0.11 -1.13 -1.08 0.00 0.00 178.44 177.68 2b89 h ASN 52 N 0.66 0.15 -0.18 -0.43 -1.24 0.14 1.04 115.58 115.72 2b89 h ASN 52 Ca 0.04 0.02 -0.21 0.00 0.71 0.00 0.00 56.30 56.86 2b89 h ASN 52 Cb 1.03 -0.01 0.01 0.00 0.73 0.00 0.00 38.32 40.07 2b89 h ASN 52 CO 0.10 0.12 -0.69 0.44 -1.29 0.00 0.00 177.43 176.12 2b89 h ASP 53 N 0.24 0.94 -0.14 1.15 3.32 -1.15 -2.15 116.42 118.62 2b89 h ASP 53 Ca 0.11 -0.57 -0.22 0.00 0.02 0.00 0.00 57.03 56.37 2b89 h ASP 53 Cb 0.05 -0.27 0.01 0.00 0.22 0.00 0.00 39.33 39.34 2b89 h ASP 53 CO -0.09 1.36 -0.76 0.00 -1.72 0.00 0.00 179.24 178.03 2b89 h ALA 54 N 0.63 0.33 0.09 3.45 0.00 0.30 -3.34 119.26 120.72 2b89 h ALA 54 Ca -0.03 -0.60 -0.20 0.00 0.00 0.00 0.00 54.91 54.09 2b89 h ALA 54 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2b89 h ALA 54 CO 0.14 0.69 -0.98 1.96 0.00 0.00 0.00 179.25 181.06 2b89 h GLN 55 N 0.54 0.19 -6.99 0.00 4.20 0.99 -3.48 115.11 110.57 2b89 h GLN 55 Ca -0.05 -0.33 -0.59 0.00 0.06 0.00 0.00 58.65 57.75 2b89 h GLN 55 Cb 1.39 0.12 -0.20 0.00 0.30 0.00 0.00 27.48 29.10 2b89 h GLN 55 CO 0.16 1.16 -0.92 0.00 -0.67 0.00 0.00 178.83 178.55 2b89 n ALA 56 N -2.87 -1.97 -0.98 3.87 0.00 -0.81 -4.64 120.51 113.11 2b89 n ALA 56 Ca -0.20 -0.40 -0.38 0.00 0.00 0.00 0.00 53.44 52.46 2b89 n ALA 56 Cb 0.78 -0.77 -0.05 0.00 0.00 0.00 0.00 19.45 19.41 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 -4.42 0.00 0.00 0.00 -0.01 -1.26 -5.09 135.00 124.22 2b89 n PRO 57 Ca -0.31 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.18 2b89 n PRO 57 Cb 0.66 -0.92 0.00 0.00 -0.01 0.00 0.00 33.50 33.24 2b89 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 175.50 177.12