#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b88 n ASP 2 N 0.00 -1.18 -2.59 4.52 5.75 -1.26 -5.02 116.55 116.76 2b88 n ASP 2 Ca 0.00 -1.07 -0.05 0.00 -0.01 0.00 0.00 54.79 53.66 2b88 n ASP 2 Cb 0.00 -0.69 0.04 0.00 -1.03 0.00 0.00 41.12 39.44 2b88 n ASP 2 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2b88 n ASN 3 N -4.06 2.25 0.11 -1.12 2.85 -1.26 -4.85 115.26 109.19 2b88 n ASN 3 Ca 0.11 -2.40 0.09 0.00 -0.11 0.00 0.00 54.58 52.26 2b88 n ASN 3 Cb 0.40 -0.44 0.44 0.00 1.24 0.00 0.00 39.78 41.41 2b88 n ASN 3 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2b88 n LYS 4 N -0.59 0.12 -0.44 1.20 5.02 -1.26 -0.72 118.16 121.48 2b88 n LYS 4 Ca 0.15 0.54 0.11 0.00 -2.02 0.00 0.00 58.31 57.09 2b88 n LYS 4 Cb 0.85 -1.82 0.33 0.00 -0.02 0.00 0.00 35.03 34.37 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 -2.06 1.13 0.10 2.13 -1.74 -1.26 -4.50 117.46 111.26 2b88 n PHE 5 Ca -0.00 -0.53 0.20 0.00 -0.56 0.00 0.00 57.45 56.55 2b88 n PHE 5 Cb 0.08 -0.08 0.76 0.00 1.52 0.00 0.00 39.48 41.76 2b88 n PHE 5 CO 0.00 0.00 0.00 -0.97 -0.56 0.00 0.00 176.76 175.23 2b88 h ASN 6 N 4.19 0.00 -0.94 5.98 -0.73 -1.32 0.29 115.58 123.04 2b88 h ASN 6 Ca 0.00 0.00 0.11 0.00 1.87 0.00 0.00 56.30 58.28 2b88 h ASN 6 Cb 1.13 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.65 2b88 h ASN 6 CO 0.07 0.00 0.60 0.11 -0.37 0.00 0.00 177.43 177.84 2b88 h LYS 7 N 0.00 0.90 -0.13 6.67 6.56 -1.83 0.27 116.57 129.01 2b88 h LYS 7 Ca 0.18 -0.05 -0.10 0.00 -1.06 0.00 0.00 60.65 59.62 2b88 h LYS 7 Cb 0.97 -0.20 -0.01 0.00 -0.57 0.00 0.00 32.23 32.42 2b88 h LYS 7 CO -0.00 0.59 -0.35 0.93 -2.06 0.00 0.00 179.45 178.56 2b88 h GLU 8 N 0.92 0.26 -0.13 3.15 3.07 -1.30 -0.16 114.58 120.39 2b88 h GLU 8 Ca 0.45 -0.11 -0.14 0.00 -0.50 0.00 0.00 59.36 59.07 2b88 h GLU 8 Cb 0.47 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2b88 h GLU 8 CO -0.21 0.58 -0.52 -0.07 -1.40 0.00 0.00 179.01 177.39 2b88 h LEU 9 N 0.22 0.38 -0.47 1.33 4.07 -0.57 -1.73 115.31 118.54 2b88 h LEU 9 Ca 0.03 -0.19 -0.15 0.00 0.08 0.00 0.00 57.88 57.64 2b88 h LEU 9 Cb 0.73 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.34 2b88 h LEU 9 CO 0.06 0.83 -0.71 1.23 -1.08 0.00 0.00 178.44 178.77 2b88 h GLY 10 N 1.26 0.00 0.90 0.83 0.00 -0.71 -2.95 103.07 102.41 2b88 h GLY 10 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 2b88 h GLY 10 CO 0.09 0.00 -0.13 -0.25 0.00 0.00 0.00 176.54 176.24 2b88 h TRP 11 N 0.00 -0.34 -0.16 5.60 7.01 -0.53 -3.06 115.95 124.47 2b88 h TRP 11 Ca -0.01 -0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.84 2b88 h TRP 11 Cb 1.32 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 28.48 2b88 h TRP 11 CO 0.00 -0.14 -0.50 0.00 -2.79 0.00 0.00 178.44 175.01 2b88 h ALA 12 N 0.22 0.84 -0.14 2.65 0.00 -1.38 -2.59 119.26 118.87 2b88 h ALA 12 Ca -0.04 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.40 2b88 h ALA 12 Cb 0.36 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2b88 h ALA 12 CO 0.06 0.67 0.06 1.15 0.00 0.00 0.00 179.25 181.19 2b88 h THR 13 N 0.35 0.99 -0.32 0.00 2.02 -1.50 0.12 112.91 114.55 2b88 h THR 13 Ca 0.02 -0.05 -0.17 0.00 0.77 0.00 0.00 66.41 66.98 2b88 h THR 13 Cb 1.00 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2b88 h THR 13 CO 0.09 0.03 -0.46 -0.25 0.37 0.00 0.00 175.52 175.29 2b88 h TRP 14 N 0.14 1.05 -0.26 3.16 7.01 -1.60 -0.59 115.95 124.85 2b88 h TRP 14 Ca 0.06 -0.34 0.03 0.00 2.11 0.00 0.00 58.89 60.74 2b88 h TRP 14 Cb 0.02 -0.21 -0.03 0.00 -2.10 0.00 0.00 29.16 26.84 2b88 h TRP 14 CO -0.10 1.15 0.09 0.93 -2.79 0.00 0.00 178.44 177.73 2b88 h GLU 15 N 0.68 0.20 -0.43 2.65 4.39 -1.05 0.23 114.58 121.26 2b88 h GLU 15 Ca 0.04 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.61 2b88 h GLU 15 Cb 1.05 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 2b88 h GLU 15 CO 0.10 0.13 -0.17 0.82 -1.16 0.00 0.00 179.01 178.74 2b88 h ILE 16 N 0.21 1.28 0.00 3.13 2.04 -0.80 -2.32 117.51 121.04 2b88 h ILE 16 Ca 0.12 -1.31 -0.00 0.00 1.00 0.00 0.00 64.86 64.67 2b88 h ILE 16 Cb 0.08 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2b88 h ILE 16 CO -0.12 0.44 -0.01 -0.26 0.00 0.00 0.00 178.15 178.21 2b88 h PHE 17 N 0.70 0.00 -0.10 1.37 0.04 -0.61 -2.05 116.94 116.29 2b88 h PHE 17 Ca 0.10 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 2b88 h PHE 17 Cb 0.73 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.88 2b88 h PHE 17 CO 0.05 0.01 0.00 0.09 -0.60 0.00 0.00 178.31 177.86 2b88 n ASN 18 N -3.12 1.33 -4.67 2.17 4.13 0.78 -4.80 115.26 111.09 2b88 n ASN 18 Ca -0.01 -2.09 -0.40 0.00 1.68 0.00 0.00 54.58 53.75 2b88 n ASN 18 Cb 0.18 -0.36 -0.06 0.00 -1.54 0.00 0.00 39.78 38.01 2b88 n ASN 18 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2b88 s LEU 19 N -0.66 4.17 0.00 3.41 1.43 -0.77 -4.95 118.68 121.30 2b88 s LEU 19 Ca 0.09 0.90 0.14 0.00 -1.03 0.00 0.00 54.13 54.23 2b88 s LEU 19 Cb 0.06 -2.94 0.85 0.00 0.03 0.00 0.00 46.19 44.19 2b88 s LEU 19 CO 0.04 -0.27 1.28 -0.81 0.23 0.00 0.00 176.35 176.82 2b88 n PRO 20 N 4.92 0.54 0.00 1.29 -0.05 -1.26 -3.27 135.00 137.17 2b88 n PRO 20 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.44 2b88 n PRO 20 Cb 0.50 -1.42 0.00 0.00 -0.05 0.00 0.00 33.50 32.53 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 0.19 -4.76 3.54 3.02 -1.26 -5.03 115.26 110.05 2b88 n ASN 21 Ca 0.11 -0.53 -0.30 0.00 -0.03 0.00 0.00 54.58 53.83 2b88 n ASN 21 Cb 0.05 0.42 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 -0.84 2.54 0.19 3.41 1.43 -1.20 -4.75 118.68 119.46 2b88 s LEU 22 Ca 0.00 1.50 0.08 0.00 -1.03 0.00 0.00 54.13 54.68 2b88 s LEU 22 Cb 0.00 -4.05 -0.05 0.00 0.03 0.00 0.00 46.19 42.12 2b88 s LEU 22 CO 0.00 -2.27 -0.15 0.54 0.23 0.00 0.00 176.35 174.70 2b88 s ASN 23 N -3.58 2.51 0.57 2.29 2.20 -1.26 -4.99 114.94 112.69 2b88 s ASN 23 Ca 0.62 -0.98 0.33 0.00 -0.94 0.00 0.00 52.86 51.89 2b88 s ASN 23 Cb -0.17 -0.13 1.43 0.00 -2.00 0.00 0.00 41.25 40.39 2b88 s ASN 23 CO 0.56 -0.16 1.75 1.23 -2.94 0.00 0.00 177.10 177.55 2b88 h GLY 24 N 2.74 0.00 0.37 0.45 0.00 -1.98 -0.25 103.07 104.40 2b88 h GLY 24 Ca -0.39 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 2b88 h GLY 24 CO 0.60 0.00 -0.01 -2.08 0.00 0.00 0.00 176.54 175.05 2b88 h VAL 25 N 0.00 1.51 -0.15 4.60 2.07 -1.98 -2.01 116.25 120.29 2b88 h VAL 25 Ca 0.44 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 2b88 h VAL 25 Cb 2.03 2.52 -0.01 0.00 -1.52 0.00 0.00 31.29 34.32 2b88 h VAL 25 CO -0.00 0.39 0.01 1.56 0.02 0.00 0.00 177.57 179.54 2b88 h GLN 26 N -0.62 0.26 -0.17 1.57 4.20 -1.51 -1.06 115.11 117.79 2b88 h GLN 26 Ca -0.00 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.64 2b88 h GLN 26 Cb 0.65 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 2b88 h GLN 26 CO 0.00 0.48 0.08 0.28 -0.67 0.00 0.00 178.83 179.00 2b88 h VAL 27 N 0.01 0.99 -0.72 -0.54 2.07 -1.30 -0.47 116.25 116.29 2b88 h VAL 27 Ca 0.04 -0.06 0.10 0.00 0.82 0.00 0.00 66.70 67.60 2b88 h VAL 27 Cb 0.36 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 2b88 h VAL 27 CO 0.01 0.03 0.47 0.50 0.02 0.00 0.00 177.57 178.60 2b88 h LYS 28 N 0.17 0.58 -0.67 1.57 3.11 -1.31 0.15 116.57 120.17 2b88 h LYS 28 Ca 0.07 -0.03 -0.08 0.00 -2.81 0.00 0.00 60.65 57.79 2b88 h LYS 28 Cb 0.02 -0.13 -0.03 0.00 -1.00 0.00 0.00 32.23 31.09 2b88 h LYS 28 CO -0.05 0.38 0.11 0.00 -2.81 0.00 0.00 179.45 177.08 2b88 h ALA 29 N 1.64 0.89 -0.13 5.00 0.00 0.23 1.67 119.26 128.56 2b88 h ALA 29 Ca 0.33 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 2b88 h ALA 29 Cb 0.49 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.04 2b88 h ALA 29 CO -0.11 0.66 -0.54 0.74 0.00 0.00 0.00 179.25 179.99 2b88 h PHE 30 N 1.04 0.80 -0.15 0.00 0.04 0.18 -0.62 116.94 118.22 2b88 h PHE 30 Ca 0.20 -0.34 -0.09 0.00 2.80 0.00 0.00 57.97 60.54 2b88 h PHE 30 Cb 0.44 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 2b88 h PHE 30 CO 0.03 1.13 -0.32 0.82 -0.60 0.00 0.00 178.31 179.37 2b88 h ILE 31 N 0.24 1.27 -0.61 -0.55 2.04 -0.65 -1.93 117.51 117.32 2b88 h ILE 31 Ca -0.03 -1.32 -0.07 0.00 1.00 0.00 0.00 64.86 64.45 2b88 h ILE 31 Cb 1.18 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 38.75 2b88 h ILE 31 CO 0.11 0.40 0.12 -0.78 0.00 0.00 0.00 178.15 178.01 2b88 h ASP 32 N 0.26 0.93 0.22 1.72 3.58 0.27 -1.71 116.42 121.68 2b88 h ASP 32 Ca 0.03 -0.19 -0.04 0.00 0.42 0.00 0.00 57.03 57.25 2b88 h ASP 32 Cb 0.69 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 2b88 h ASP 32 CO 0.05 0.91 -0.19 -1.28 -2.88 0.00 0.00 179.24 175.86 2b88 h SER 33 N 0.93 0.00 -0.52 2.28 0.87 -0.37 -2.53 113.55 114.21 2b88 h SER 33 Ca 0.19 0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.82 2b88 h SER 33 Cb 0.37 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.27 2b88 h SER 33 CO 0.00 0.19 0.22 0.25 -0.53 0.00 0.00 176.83 176.96 2b88 h LEU 34 N 0.00 0.26 -0.89 2.23 5.85 -0.68 0.14 115.31 122.22 2b88 h LEU 34 Ca -0.00 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2b88 h LEU 34 Cb 0.35 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 2b88 h LEU 34 CO 0.02 0.18 0.57 0.03 -0.34 0.00 0.00 178.44 178.91 2b88 h ARG 35 N 0.42 1.07 -0.60 1.25 -0.00 -1.44 0.77 114.38 115.86 2b88 h ARG 35 Ca 0.24 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.98 59.58 2b88 h ARG 35 Cb 0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 29.97 29.93 2b88 h ARG 35 CO -0.22 0.71 0.07 0.22 0.00 0.00 0.00 179.97 180.75 2b88 h ASP 36 N 1.11 0.94 -0.73 7.04 3.58 -1.20 -3.41 116.42 123.74 2b88 h ASP 36 Ca 0.36 -0.22 0.09 0.00 0.42 0.00 0.00 57.03 57.68 2b88 h ASP 36 Cb 0.02 -0.25 -0.20 0.00 1.72 0.00 0.00 39.33 40.62 2b88 h ASP 36 CO -0.12 0.96 -0.25 -0.62 -2.88 0.00 0.00 179.24 176.32 2b88 s ASP 37 N -6.56 -1.20 0.51 2.28 -1.08 0.36 -5.04 116.67 105.94 2b88 s ASP 37 Ca -0.11 0.12 0.30 0.00 -0.52 0.00 0.00 52.55 52.35 2b88 s ASP 37 Cb 0.15 1.76 1.13 0.00 -1.46 0.00 0.00 42.92 44.49 2b88 s ASP 37 CO 0.83 -0.22 1.90 -0.65 0.52 0.00 0.00 175.17 177.55 2b88 h PRO 38 N 7.71 0.00 0.00 4.34 0.11 0.30 -2.74 132.00 141.72 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 0.06 0.05 0.00 0.66 -0.21 0.00 0.00 178.00 178.57 2b88 h SER 39 N 0.00 0.00 0.10 -2.05 4.64 -1.95 -1.44 113.55 112.85 2b88 h SER 39 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b88 h SER 39 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 2b88 h SER 39 CO 0.01 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 175.94 2b88 n GLN 40 N -3.00 1.12 -0.32 4.77 1.13 -1.03 -4.36 117.38 115.69 2b88 n GLN 40 Ca -0.00 -0.35 0.27 0.00 -1.94 0.00 0.00 57.00 54.97 2b88 n GLN 40 Cb 0.24 -1.49 0.50 0.00 0.11 0.00 0.00 30.24 29.59 2b88 n GLN 40 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2b88 n SER 41 N -0.63 0.22 0.02 1.08 2.88 -0.55 0.25 113.62 116.90 2b88 n SER 41 Ca 0.20 1.62 -0.04 0.00 -1.33 0.00 0.00 58.87 59.32 2b88 n SER 41 Cb 0.23 -0.74 0.18 0.00 -0.75 0.00 0.00 64.21 63.13 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 1.94 1.05 -0.24 -1.46 0.00 -1.85 0.26 119.26 118.95 2b88 h ALA 42 Ca 0.76 -0.38 -0.19 0.00 0.00 0.00 0.00 54.91 55.11 2b88 h ALA 42 Cb 1.93 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2b88 h ALA 42 CO -0.79 0.58 -0.60 -0.97 0.00 0.00 0.00 179.25 177.47 2b88 h ASN 43 N 0.39 0.91 -0.48 0.00 -0.73 0.30 0.33 115.58 116.30 2b88 h ASN 43 Ca 0.05 -0.51 -0.06 0.00 1.87 0.00 0.00 56.30 57.65 2b88 h ASN 43 Cb 0.75 -0.26 -0.02 0.00 0.27 0.00 0.00 38.32 39.05 2b88 h ASN 43 CO 0.06 1.30 0.09 -0.07 -0.37 0.00 0.00 177.43 178.44 2b88 h LEU 44 N 0.60 0.80 -0.52 0.34 3.38 -0.06 1.16 115.31 121.02 2b88 h LEU 44 Ca -0.00 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 2b88 h LEU 44 Cb 1.20 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 2b88 h LEU 44 CO 0.13 0.81 0.26 -0.07 0.09 0.00 0.00 178.44 179.65 2b88 h LEU 45 N 0.81 0.68 -0.25 1.67 -0.00 -0.16 0.84 115.31 118.90 2b88 h LEU 45 Ca 0.17 -0.12 -0.00 0.00 -0.00 0.00 0.00 57.88 57.92 2b88 h LEU 45 Cb 0.35 -0.17 -0.01 0.00 -0.00 0.00 0.00 40.66 40.83 2b88 h LEU 45 CO 0.01 0.61 0.14 0.00 -0.00 0.00 0.00 178.44 179.20 2b88 h ALA 46 N 1.09 0.33 -0.14 1.53 0.00 0.23 0.82 119.26 123.12 2b88 h ALA 46 Ca 0.18 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2b88 h ALA 46 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2b88 h ALA 46 CO -0.02 -0.15 -0.19 0.93 0.00 0.00 0.00 179.25 179.82 2b88 h GLU 47 N 0.30 0.22 -0.26 0.00 4.39 0.16 0.12 114.58 119.52 2b88 h GLU 47 Ca 0.09 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 2b88 h GLU 47 Cb 0.06 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2b88 h GLU 47 CO -0.01 0.42 -0.14 0.00 -1.16 0.00 0.00 179.01 178.12 2b88 h ALA 48 N 1.60 0.37 -0.77 3.43 0.00 0.20 0.43 119.26 124.52 2b88 h ALA 48 Ca 0.04 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2b88 h ALA 48 Cb 0.46 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2b88 h ALA 48 CO 0.03 0.24 0.45 0.87 0.00 0.00 0.00 179.25 180.85 2b88 h LYS 49 N 0.28 1.04 -0.53 0.00 1.79 0.13 0.87 116.57 120.16 2b88 h LYS 49 Ca 0.06 -0.10 -0.06 0.00 -2.18 0.00 0.00 60.65 58.37 2b88 h LYS 49 Cb 0.65 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 31.06 2b88 h LYS 49 CO 0.04 0.74 0.08 0.87 -1.08 0.00 0.00 179.45 180.10 2b88 h LYS 50 N 1.06 0.88 -0.26 3.15 1.57 -0.33 0.81 116.57 123.44 2b88 h LYS 50 Ca 0.27 -0.24 -0.13 0.00 -1.87 0.00 0.00 60.65 58.68 2b88 h LYS 50 Cb -0.03 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 2b88 h LYS 50 CO -0.05 0.86 -0.36 -0.07 -0.57 0.00 0.00 179.45 179.26 2b88 h LEU 51 N 0.76 0.77 -0.41 2.94 -0.00 0.97 0.13 115.31 120.47 2b88 h LEU 51 Ca 0.16 -0.51 -0.01 0.00 -0.00 0.00 0.00 57.88 57.53 2b88 h LEU 51 Cb 0.41 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.83 2b88 h LEU 51 CO 0.01 1.13 0.23 -1.13 -0.00 0.00 0.00 178.44 178.68 2b88 h ASN 52 N 0.44 0.51 -0.80 -0.43 -1.24 0.92 0.57 115.58 115.55 2b88 h ASN 52 Ca 0.03 -0.08 -0.01 0.00 0.71 0.00 0.00 56.30 56.95 2b88 h ASN 52 Cb 0.95 -0.13 -0.04 0.00 0.73 0.00 0.00 38.32 39.83 2b88 h ASN 52 CO 0.08 0.45 0.48 0.44 -1.29 0.00 0.00 177.43 177.59 2b88 h ASP 53 N 0.54 0.97 0.04 1.15 3.32 0.75 0.89 116.42 124.07 2b88 h ASP 53 Ca 0.15 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 57.02 2b88 h ASP 53 Cb 0.04 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 2b88 h ASP 53 CO -0.02 0.75 -0.37 0.00 -1.72 0.00 0.00 179.24 177.88 2b88 h ALA 54 N 1.41 0.99 -0.05 3.45 0.00 0.10 -2.45 119.26 122.72 2b88 h ALA 54 Ca 0.29 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2b88 h ALA 54 Cb -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2b88 h ALA 54 CO -0.05 0.61 0.00 1.04 0.00 0.00 0.00 179.25 180.84 2b88 n GLN 55 N -4.05 1.77 -2.51 0.00 6.02 0.19 -4.91 117.38 113.89 2b88 n GLN 55 Ca -0.01 -1.12 -0.38 0.00 -0.01 0.00 0.00 57.00 55.47 2b88 n GLN 55 Cb 0.48 -1.47 -0.04 0.00 1.02 0.00 0.00 30.24 30.23 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 -1.95 3.24 0.87 -1.58 0.00 0.29 -4.84 121.76 117.79 2b88 s ALA 56 Ca 0.36 0.79 -0.14 0.00 0.00 0.00 0.00 51.96 52.97 2b88 s ALA 56 Cb 0.20 -3.30 0.01 0.00 0.00 0.00 0.00 23.12 20.04 2b88 s ALA 56 CO 0.32 -0.18 0.44 -0.35 0.00 0.00 0.00 175.76 175.99 2b88 n PRO 57 N 0.54 -0.08 0.00 0.00 -0.04 -1.26 -4.99 135.00 129.17 2b88 n PRO 57 Ca 0.02 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.63 2b88 n PRO 57 Cb 0.47 -1.85 0.30 0.00 -0.04 0.00 0.00 33.50 32.38 2b88 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09