#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b88 h ASP 2 N 0.00 0.66 -3.29 -1.34 3.32 -2.10 -3.41 116.42 110.25 2b88 h ASP 2 Ca 0.00 -0.03 -0.57 0.00 0.02 0.00 0.00 57.03 56.45 2b88 h ASP 2 Cb 0.00 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.33 2b88 h ASP 2 CO 0.00 0.50 -0.01 0.20 -1.72 0.00 0.00 179.24 178.21 2b88 s ASN 3 N -6.54 7.02 -0.24 6.45 0.01 -1.26 -4.97 114.94 115.41 2b88 s ASN 3 Ca -0.09 1.22 0.04 0.00 -0.71 0.00 0.00 52.86 53.31 2b88 s ASN 3 Cb 0.17 -2.37 0.43 0.00 0.41 0.00 0.00 41.25 39.89 2b88 s ASN 3 CO 0.76 0.16 1.49 0.29 -1.51 0.00 0.00 177.10 178.29 2b88 n LYS 4 N 2.39 2.11 0.14 -0.60 5.02 -1.26 -4.42 118.16 121.54 2b88 n LYS 4 Ca -0.08 -1.84 0.10 0.00 -2.02 0.00 0.00 58.31 54.47 2b88 n LYS 4 Cb 0.51 -1.77 0.52 0.00 -0.02 0.00 0.00 35.03 34.27 2b88 n LYS 4 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 2b88 n PHE 5 N -0.31 0.68 0.06 2.13 -1.74 -1.26 -2.19 117.46 114.82 2b88 n PHE 5 Ca 0.32 0.34 0.19 0.00 -0.56 0.00 0.00 57.45 57.74 2b88 n PHE 5 Cb 1.13 -1.04 0.72 0.00 1.52 0.00 0.00 39.48 41.81 2b88 n PHE 5 CO 0.00 0.00 0.00 -0.91 -0.56 0.00 0.00 176.76 175.29 2b88 h ASN 6 N 0.00 0.00 -0.91 5.98 -0.26 -2.00 -1.16 115.58 117.24 2b88 h ASN 6 Ca 0.00 0.00 0.09 0.00 -0.56 0.00 0.00 56.30 55.83 2b88 h ASN 6 Cb 0.06 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 37.26 2b88 h ASN 6 CO 0.00 0.00 0.59 0.50 -1.06 0.00 0.00 177.43 177.46 2b88 h LYS 7 N 0.00 0.92 -0.20 0.81 3.64 -1.83 -0.75 116.57 119.15 2b88 h LYS 7 Ca 0.21 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2b88 h LYS 7 Cb 0.90 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2b88 h LYS 7 CO -0.00 0.61 -0.07 0.93 -2.27 0.00 0.00 179.45 178.65 2b88 h GLU 8 N 0.95 0.31 -0.19 1.90 3.07 -1.45 0.23 114.58 119.39 2b88 h GLU 8 Ca 0.42 -0.06 -0.15 0.00 -0.50 0.00 0.00 59.36 59.06 2b88 h GLU 8 Cb 0.35 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 2b88 h GLU 8 CO -0.18 0.40 -0.51 -0.07 -1.40 0.00 0.00 179.01 177.25 2b88 h LEU 9 N 0.30 0.57 -0.34 1.33 4.07 -1.24 0.18 115.31 120.17 2b88 h LEU 9 Ca 0.06 -0.29 -0.19 0.00 0.08 0.00 0.00 57.88 57.55 2b88 h LEU 9 Cb 0.32 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 2b88 h LEU 9 CO 0.01 0.97 -0.84 1.23 -1.08 0.00 0.00 178.44 178.74 2b88 h GLY 10 N 1.10 0.18 0.85 0.83 0.00 -1.03 -1.48 103.07 103.53 2b88 h GLY 10 Ca 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2b88 h GLY 10 CO 0.09 0.28 -0.13 -0.25 0.00 0.00 0.00 176.54 176.54 2b88 h TRP 11 N 0.10 -0.33 -0.09 5.60 7.01 -0.20 -2.68 115.95 125.36 2b88 h TRP 11 Ca -0.03 -0.01 -0.10 0.00 2.11 0.00 0.00 58.89 60.86 2b88 h TRP 11 Cb 1.45 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 28.60 2b88 h TRP 11 CO 0.02 -0.09 -0.40 0.00 -2.79 0.00 0.00 178.44 175.18 2b88 h ALA 12 N 0.18 1.17 -0.38 2.65 0.00 -0.67 -2.24 119.26 119.97 2b88 h ALA 12 Ca -0.04 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.51 2b88 h ALA 12 Cb 0.38 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2b88 h ALA 12 CO 0.06 0.56 0.18 1.15 0.00 0.00 0.00 179.25 181.21 2b88 h THR 13 N 0.16 0.97 -0.24 0.00 2.02 -1.10 0.25 112.91 114.97 2b88 h THR 13 Ca 0.01 -0.13 -0.14 0.00 0.77 0.00 0.00 66.41 66.92 2b88 h THR 13 Cb 0.78 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 2b88 h THR 13 CO 0.06 0.07 -0.43 4.11 0.37 0.00 0.00 175.52 179.69 2b88 h TRP 14 N 0.38 0.70 -0.24 3.16 5.08 -1.40 -0.83 115.95 122.80 2b88 h TRP 14 Ca 0.16 -0.21 0.02 0.00 1.08 0.00 0.00 58.89 59.93 2b88 h TRP 14 Cb 0.08 -0.15 -0.02 0.00 -3.00 0.00 0.00 29.16 26.07 2b88 h TRP 14 CO -0.10 0.92 0.11 0.93 -1.28 0.00 0.00 178.44 179.02 2b88 h GLU 15 N 0.48 0.23 0.08 0.12 5.08 -0.60 0.45 114.58 120.41 2b88 h GLU 15 Ca 0.03 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2b88 h GLU 15 Cb 0.95 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2b88 h GLU 15 CO 0.09 0.15 -0.04 0.82 -1.00 0.00 0.00 179.01 179.03 2b88 h ILE 16 N 0.24 1.01 0.00 3.13 1.08 -0.51 -2.13 117.51 120.33 2b88 h ILE 16 Ca 0.10 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.27 2b88 h ILE 16 Cb 0.03 1.21 0.00 0.00 -3.07 0.00 0.00 36.82 34.99 2b88 h ILE 16 CO -0.07 0.07 0.00 -0.26 -0.69 0.00 0.00 178.15 177.20 2b88 h PHE 17 N -0.24 0.00 -0.05 1.37 0.04 -0.83 -2.17 116.94 115.06 2b88 h PHE 17 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2b88 h PHE 17 Cb 0.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.35 2b88 h PHE 17 CO -0.03 0.00 0.00 0.09 -0.60 0.00 0.00 178.31 177.77 2b88 n ASN 18 N -2.78 1.17 -4.71 2.17 5.03 0.15 -4.78 115.26 111.51 2b88 n ASN 18 Ca -0.02 -2.06 -0.37 0.00 0.87 0.00 0.00 54.58 53.00 2b88 n ASN 18 Cb 0.10 -0.42 -0.07 0.00 -1.02 0.00 0.00 39.78 38.37 2b88 n ASN 18 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2b88 s LEU 19 N -0.37 4.23 0.00 3.41 1.43 -0.82 -4.98 118.68 121.58 2b88 s LEU 19 Ca 0.04 0.62 0.18 0.00 -1.03 0.00 0.00 54.13 53.94 2b88 s LEU 19 Cb 0.03 -2.53 1.06 0.00 0.03 0.00 0.00 46.19 44.78 2b88 s LEU 19 CO 0.02 0.01 1.48 -0.81 0.23 0.00 0.00 176.35 177.28 2b88 n PRO 20 N 3.88 0.66 0.00 1.29 -0.05 -1.26 -3.51 135.00 136.01 2b88 n PRO 20 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.36 2b88 n PRO 20 Cb 0.52 -1.42 0.00 0.00 -0.05 0.00 0.00 33.50 32.54 2b88 n PRO 20 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 2b88 n ASN 21 N -0.92 0.22 -4.76 3.54 3.02 -1.26 -5.04 115.26 110.05 2b88 n ASN 21 Ca 0.13 -0.55 -0.30 0.00 -0.03 0.00 0.00 54.58 53.83 2b88 n ASN 21 Cb 0.06 0.41 0.11 0.00 -0.61 0.00 0.00 39.78 39.75 2b88 n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b88 s LEU 22 N -0.83 2.57 0.18 3.41 1.43 -1.23 -4.77 118.68 119.43 2b88 s LEU 22 Ca 0.00 1.49 0.08 0.00 -1.03 0.00 0.00 54.13 54.66 2b88 s LEU 22 Cb 0.00 -4.05 -0.04 0.00 0.03 0.00 0.00 46.19 42.12 2b88 s LEU 22 CO 0.00 -2.22 -0.15 0.54 0.23 0.00 0.00 176.35 174.75 2b88 s ASN 23 N -3.61 2.48 0.58 2.29 2.20 -1.26 -4.99 114.94 112.63 2b88 s ASN 23 Ca 0.62 -0.94 0.31 0.00 -0.94 0.00 0.00 52.86 51.91 2b88 s ASN 23 Cb -0.16 -0.13 1.38 0.00 -2.00 0.00 0.00 41.25 40.34 2b88 s ASN 23 CO 0.56 -0.13 1.71 1.23 -2.94 0.00 0.00 177.10 177.53 2b88 h GLY 24 N 2.93 0.00 0.34 0.45 0.00 -1.98 -0.31 103.07 104.51 2b88 h GLY 24 Ca -0.40 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 2b88 h GLY 24 CO 0.57 0.00 -0.04 -2.08 0.00 0.00 0.00 176.54 174.99 2b88 h VAL 25 N 0.00 1.55 -0.27 4.60 2.07 -1.98 -2.18 116.25 120.04 2b88 h VAL 25 Ca 0.41 -1.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.21 2b88 h VAL 25 Cb 2.02 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 34.42 2b88 h VAL 25 CO -0.00 0.43 -0.06 1.56 0.02 0.00 0.00 177.57 179.52 2b88 h GLN 26 N -0.64 0.52 0.03 1.57 4.20 -1.51 -0.86 115.11 118.42 2b88 h GLN 26 Ca -0.00 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.51 2b88 h GLN 26 Cb 0.73 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2b88 h GLN 26 CO 0.01 0.73 -0.04 0.28 -0.67 0.00 0.00 178.83 179.14 2b88 h VAL 27 N 0.28 0.91 -0.81 -0.54 2.07 -1.33 -1.39 116.25 115.44 2b88 h VAL 27 Ca 0.07 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.72 2b88 h VAL 27 Cb 0.54 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 2b88 h VAL 27 CO 0.03 0.00 0.53 0.50 0.02 0.00 0.00 177.57 178.65 2b88 h LYS 28 N -0.08 0.57 -0.53 1.57 1.63 -1.33 1.35 116.57 119.75 2b88 h LYS 28 Ca 0.01 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.75 2b88 h LYS 28 Cb 0.08 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2b88 h LYS 28 CO -0.02 0.38 0.24 0.00 -3.45 0.00 0.00 179.45 176.60 2b88 h ALA 29 N 1.62 0.69 -0.09 5.00 0.00 -0.14 1.20 119.26 127.54 2b88 h ALA 29 Ca 0.39 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 54.96 2b88 h ALA 29 Cb 0.70 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2b88 h ALA 29 CO -0.15 0.27 -0.79 0.74 0.00 0.00 0.00 179.25 179.32 2b88 h PHE 30 N 0.72 0.75 -0.42 0.00 0.04 0.30 0.29 116.94 118.61 2b88 h PHE 30 Ca 0.18 -0.34 -0.01 0.00 2.80 0.00 0.00 57.97 60.60 2b88 h PHE 30 Cb 0.15 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 2b88 h PHE 30 CO -0.00 1.13 0.21 0.82 -0.60 0.00 0.00 178.31 179.88 2b88 h ILE 31 N 0.36 1.14 -0.41 -0.55 1.08 0.22 0.15 117.51 119.51 2b88 h ILE 31 Ca -0.05 -0.38 -0.15 0.00 -0.39 0.00 0.00 64.86 63.89 2b88 h ILE 31 Cb 1.39 0.59 -0.01 0.00 -3.07 0.00 0.00 36.82 35.72 2b88 h ILE 31 CO 0.14 0.16 -0.34 0.44 -0.69 0.00 0.00 178.15 177.87 2b88 h ASP 32 N 0.58 0.98 -0.17 1.72 3.32 0.19 -2.64 116.42 120.40 2b88 h ASP 32 Ca 0.15 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 56.74 2b88 h ASP 32 Cb 0.05 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 2b88 h ASP 32 CO -0.02 1.22 0.01 0.28 -1.72 0.00 0.00 179.24 179.01 2b88 h SER 33 N 0.78 0.37 -0.44 6.45 0.02 0.65 -1.90 113.55 119.47 2b88 h SER 33 Ca 0.07 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2b88 h SER 33 Cb 0.92 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.33 2b88 h SER 33 CO 0.09 0.43 0.23 -0.07 -1.14 0.00 0.00 176.83 176.36 2b88 h LEU 34 N 0.40 0.33 -0.53 5.07 -0.00 -0.41 0.14 115.31 120.31 2b88 h LEU 34 Ca 0.09 0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 57.95 2b88 h LEU 34 Cb 0.24 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 40.84 2b88 h LEU 34 CO 0.00 0.24 0.16 0.03 -0.00 0.00 0.00 178.44 178.87 2b88 h ARG 35 N 0.45 0.82 -0.67 1.13 3.08 -1.24 0.21 114.38 118.16 2b88 h ARG 35 Ca 0.19 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2b88 h ARG 35 Cb 0.08 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 2b88 h ARG 35 CO -0.12 0.76 0.37 0.22 -1.07 0.00 0.00 179.97 180.12 2b88 h ASP 36 N 0.72 0.83 -0.81 7.04 3.58 -0.75 -3.40 116.42 123.62 2b88 h ASP 36 Ca 0.17 -0.06 0.08 0.00 0.42 0.00 0.00 57.03 57.63 2b88 h ASP 36 Cb 0.29 -0.21 -0.20 0.00 1.72 0.00 0.00 39.33 40.92 2b88 h ASP 36 CO -0.00 0.67 -0.28 -0.62 -2.88 0.00 0.00 179.24 176.13 2b88 s ASP 37 N -6.44 -1.32 0.50 2.28 -1.08 0.42 -5.03 116.67 105.99 2b88 s ASP 37 Ca -0.11 0.19 0.29 0.00 -0.52 0.00 0.00 52.55 52.41 2b88 s ASP 37 Cb 0.17 1.85 1.06 0.00 -1.46 0.00 0.00 42.92 44.54 2b88 s ASP 37 CO 0.79 -0.24 1.87 -0.65 0.52 0.00 0.00 175.17 177.46 2b88 h PRO 38 N 7.83 0.00 0.00 4.34 0.11 -0.79 -2.83 132.00 140.66 2b88 h PRO 38 Ca -0.04 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2b88 h PRO 38 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2b88 h PRO 38 CO 0.09 0.07 -0.01 0.77 -0.21 0.00 0.00 178.00 178.71 2b88 h SER 39 N 0.00 0.00 -0.03 -2.05 0.02 -1.94 -1.92 113.55 107.63 2b88 h SER 39 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2b88 h SER 39 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2b88 h SER 39 CO 0.01 0.01 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 2b88 n GLN 40 N -3.13 1.65 -0.31 3.45 6.02 -1.07 -4.51 117.38 119.49 2b88 n GLN 40 Ca -0.01 -0.95 0.19 0.00 -0.01 0.00 0.00 57.00 56.22 2b88 n GLN 40 Cb 0.24 -1.47 0.37 0.00 1.02 0.00 0.00 30.24 30.40 2b88 n GLN 40 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2b88 n SER 41 N 0.16 0.04 -0.11 1.08 2.88 -0.72 0.25 113.62 117.20 2b88 n SER 41 Ca 0.19 1.57 -0.03 0.00 -1.33 0.00 0.00 58.87 59.26 2b88 n SER 41 Cb 0.35 -0.64 0.19 0.00 -0.75 0.00 0.00 64.21 63.36 2b88 n SER 41 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b88 h ALA 42 N 1.86 1.19 -0.25 -1.46 0.00 -1.85 0.69 119.26 119.43 2b88 h ALA 42 Ca 0.64 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 55.15 2b88 h ALA 42 Cb 1.49 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2b88 h ALA 42 CO -0.82 0.54 -0.55 -0.97 0.00 0.00 0.00 179.25 177.45 2b88 h ASN 43 N 0.76 0.85 -0.40 0.00 -0.73 0.29 0.43 115.58 116.79 2b88 h ASN 43 Ca 0.16 -0.46 -0.08 0.00 1.87 0.00 0.00 56.30 57.80 2b88 h ASN 43 Cb 0.35 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.67 2b88 h ASN 43 CO 0.01 1.23 -0.01 -0.07 -0.37 0.00 0.00 177.43 178.21 2b88 h LEU 44 N 0.58 0.76 -0.54 0.34 3.38 0.34 1.22 115.31 121.39 2b88 h LEU 44 Ca 0.01 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2b88 h LEU 44 Cb 1.14 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2b88 h LEU 44 CO 0.12 0.84 0.17 -0.07 0.09 0.00 0.00 178.44 179.58 2b88 h LEU 45 N 0.74 0.79 -0.28 1.67 -0.00 0.73 0.44 115.31 119.40 2b88 h LEU 45 Ca 0.14 -0.21 -0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2b88 h LEU 45 Cb 0.47 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 40.90 2b88 h LEU 45 CO 0.02 0.79 0.16 0.00 -0.00 0.00 0.00 178.44 179.41 2b88 h ALA 46 N 1.03 0.36 -0.36 1.53 0.00 0.20 0.58 119.26 122.60 2b88 h ALA 46 Ca 0.17 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2b88 h ALA 46 Cb 0.28 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2b88 h ALA 46 CO -0.00 -0.12 0.06 0.93 0.00 0.00 0.00 179.25 180.11 2b88 h GLU 47 N 0.34 0.53 -0.28 0.00 4.39 0.17 0.12 114.58 119.85 2b88 h GLU 47 Ca 0.10 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 2b88 h GLU 47 Cb 0.06 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2b88 h GLU 47 CO -0.02 0.52 -0.01 0.00 -1.16 0.00 0.00 179.01 178.34 2b88 h ALA 48 N 1.55 0.38 -0.63 3.43 0.00 0.12 0.24 119.26 124.33 2b88 h ALA 48 Ca 0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2b88 h ALA 48 Cb 0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2b88 h ALA 48 CO 0.00 0.13 0.32 0.87 0.00 0.00 0.00 179.25 180.57 2b88 h LYS 49 N 0.28 0.89 -0.68 0.00 1.57 0.88 0.88 116.57 120.40 2b88 h LYS 49 Ca 0.08 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 2b88 h LYS 49 Cb 0.44 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 2b88 h LYS 49 CO 0.02 0.68 0.26 0.87 -0.57 0.00 0.00 179.45 180.70 2b88 h LYS 50 N 0.89 1.02 -0.22 3.15 6.56 -0.26 1.20 116.57 128.92 2b88 h LYS 50 Ca 0.22 -0.20 -0.12 0.00 -1.06 0.00 0.00 60.65 59.49 2b88 h LYS 50 Cb 0.07 -0.16 -0.00 0.00 -0.57 0.00 0.00 32.23 31.57 2b88 h LYS 50 CO -0.03 0.86 -0.35 -0.07 -2.06 0.00 0.00 179.45 177.80 2b88 h LEU 51 N 0.97 0.68 -0.42 2.94 -0.00 0.86 0.48 115.31 120.82 2b88 h LEU 51 Ca 0.22 -0.52 -0.01 0.00 -0.00 0.00 0.00 57.88 57.57 2b88 h LEU 51 Cb 0.23 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 40.68 2b88 h LEU 51 CO -0.02 1.07 0.24 -1.13 -0.00 0.00 0.00 178.44 178.61 2b88 h ASN 52 N 0.31 0.52 -0.96 -0.43 -1.24 0.10 0.55 115.58 114.43 2b88 h ASN 52 Ca 0.02 -0.08 0.01 0.00 0.71 0.00 0.00 56.30 56.96 2b88 h ASN 52 Cb 0.94 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 39.81 2b88 h ASN 52 CO 0.08 0.45 0.64 0.44 -1.29 0.00 0.00 177.43 177.75 2b88 h ASP 53 N 0.55 1.10 0.09 1.15 3.32 0.15 0.90 116.42 123.68 2b88 h ASP 53 Ca 0.15 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.05 2b88 h ASP 53 Cb 0.04 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2b88 h ASP 53 CO -0.02 0.80 -0.41 0.00 -1.72 0.00 0.00 179.24 177.88 2b88 h ALA 54 N 1.40 0.97 -0.09 3.45 0.00 -0.14 -2.46 119.26 122.39 2b88 h ALA 54 Ca 0.35 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2b88 h ALA 54 Cb -0.14 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2b88 h ALA 54 CO -0.08 0.62 0.00 1.04 0.00 0.00 0.00 179.25 180.83 2b88 n GLN 55 N -4.02 1.75 -1.56 0.00 6.02 0.19 -4.92 117.38 114.83 2b88 n GLN 55 Ca -0.02 -1.10 -0.30 0.00 -0.01 0.00 0.00 57.00 55.58 2b88 n GLN 55 Cb 0.50 -1.45 0.09 0.00 1.02 0.00 0.00 30.24 30.41 2b88 n GLN 55 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b88 s ALA 56 N -1.90 2.23 0.00 -1.58 0.00 0.29 -4.84 121.76 115.97 2b88 s ALA 56 Ca 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.07 2b88 s ALA 56 Cb 0.20 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2b88 s ALA 56 CO 0.30 -1.76 1.20 -0.35 0.00 0.00 0.00 175.76 175.15 2b88 n PRO 57 N -3.45 0.98 -0.25 0.00 -0.05 -1.26 -5.01 135.00 125.96 2b88 n PRO 57 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.52 2b88 n PRO 57 Cb 0.57 -1.01 0.00 0.00 -0.05 0.00 0.00 33.50 33.00 2b88 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08