#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b88 s ASP 2 N 0.00 5.46 -0.16 6.55 1.47 -1.26 -4.98 116.67 123.75 2b88 s ASP 2 Ca 0.00 1.81 0.15 0.00 1.18 0.00 0.00 52.55 55.70 2b88 s ASP 2 Cb 0.00 -2.53 0.34 0.00 -0.34 0.00 0.00 42.92 40.39 2b88 s ASP 2 CO 0.00 -1.39 1.18 0.59 0.68 0.00 0.00 175.17 176.23 2b88 n ASN 3 N -2.46 1.99 0.00 2.11 3.02 -1.26 -4.72 115.26 113.94 2b88 n ASN 3 Ca 0.09 -3.38 0.11 0.00 -0.03 0.00 0.00 54.58 51.37 2b88 n ASN 3 Cb 0.53 -0.46 0.57 0.00 -0.61 0.00 0.00 39.78 39.80 2b88 n ASN 3 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2b88 n LYS 4 N -1.22 0.35 0.14 3.52 2.85 -1.26 -3.09 118.16 119.45 2b88 n LYS 4 Ca 0.17 0.07 0.11 0.00 -1.05 0.00 0.00 58.31 57.61 2b88 n LYS 4 Cb 0.67 -1.50 0.52 0.00 -0.65 0.00 0.00 35.03 34.08 2b88 n LYS 4 CO 0.00 0.00 0.00 1.97 -0.05 0.00 0.00 177.40 179.32 2b88 n PHE 5 N -1.26 0.77 0.05 5.58 -1.74 -1.26 -2.45 117.46 117.15 2b88 n PHE 5 Ca 0.11 0.34 0.19 0.00 -0.56 0.00 0.00 57.45 57.53 2b88 n PHE 5 Cb 0.17 -1.05 0.71 0.00 1.52 0.00 0.00 39.48 40.83 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 -0.97 5.98 -0.26 -1.96 -1.41 115.58 116.97 2b88 h ASN 6 Ca 0.00 0.00 0.10 0.00 -0.56 0.00 0.00 56.30 55.84 2b88 h ASN 6 Cb 0.21 0.00 -0.08 0.00 -1.06 0.00 0.00 38.32 37.39 2b88 h ASN 6 CO 0.00 0.00 0.60 0.50 -1.06 0.00 0.00 177.43 177.47 2b88 h LYS 7 N 0.00 0.97 -0.21 0.81 3.64 -1.78 -0.62 116.57 119.38 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 0.89 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2b88 h LYS 7 CO -0.00 0.64 -0.07 0.93 -2.27 0.00 0.00 179.45 178.69 2b88 h GLU 8 N 1.00 0.32 -0.23 1.90 3.07 -1.50 0.21 114.58 119.36 2b88 h GLU 8 Ca 0.46 -0.07 -0.15 0.00 -0.50 0.00 0.00 59.36 59.11 2b88 h GLU 8 Cb 0.38 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 2b88 h GLU 8 CO -0.24 0.40 -0.47 -0.07 -1.40 0.00 0.00 179.01 177.24 2b88 h LEU 9 N 0.31 0.64 -0.38 1.33 4.07 -1.21 0.59 115.31 120.66 2b88 h LEU 9 Ca 0.07 -0.31 -0.18 0.00 0.08 0.00 0.00 57.88 57.53 2b88 h LEU 9 Cb 0.32 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 2b88 h LEU 9 CO 0.01 1.02 -0.81 1.23 -1.08 0.00 0.00 178.44 178.81 2b88 h GLY 10 N 1.03 0.17 0.91 0.83 0.00 -0.90 -1.37 103.07 103.74 2b88 h GLY 10 Ca 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2b88 h GLY 10 CO 0.09 0.25 -0.12 -0.25 0.00 0.00 0.00 176.54 176.51 2b88 h TRP 11 N 0.09 -0.32 -0.06 5.60 7.01 -0.24 -2.08 115.95 125.95 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 1.41 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 28.57 2b88 h TRP 11 CO 0.02 -0.13 -0.44 0.00 -2.79 0.00 0.00 178.44 175.10 2b88 h ALA 12 N 0.28 1.17 -0.18 2.65 0.00 -0.90 -1.85 119.26 120.43 2b88 h ALA 12 Ca -0.04 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2b88 h ALA 12 Cb 0.34 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2b88 h ALA 12 CO 0.06 0.58 0.12 1.15 0.00 0.00 0.00 179.25 181.16 2b88 h THR 13 N 0.11 1.04 -0.25 0.00 2.02 -1.00 0.39 112.91 115.23 2b88 h THR 13 Ca 0.01 -0.08 -0.14 0.00 0.77 0.00 0.00 66.41 66.96 2b88 h THR 13 Cb 0.82 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 2b88 h THR 13 CO 0.06 0.04 -0.43 4.11 0.37 0.00 0.00 175.52 179.67 2b88 h TRP 14 N 0.24 0.74 -0.29 3.16 5.08 -1.31 0.13 115.95 123.71 2b88 h TRP 14 Ca 0.07 -0.23 0.03 0.00 1.08 0.00 0.00 58.89 59.84 2b88 h TRP 14 Cb -0.03 -0.15 -0.03 0.00 -3.00 0.00 0.00 29.16 25.95 2b88 h TRP 14 CO -0.07 0.94 0.11 0.93 -1.28 0.00 0.00 178.44 179.08 2b88 h GLU 15 N 0.50 0.25 -0.23 0.12 4.39 -0.84 0.40 114.58 119.15 2b88 h GLU 15 Ca 0.04 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.63 2b88 h GLU 15 Cb 0.96 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.55 2b88 h GLU 15 CO 0.09 0.16 -0.19 0.82 -1.16 0.00 0.00 179.01 178.73 2b88 h ILE 16 N 0.25 1.32 0.00 3.13 2.04 -0.89 -2.63 117.51 120.73 2b88 h ILE 16 Ca 0.12 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.65 2b88 h ILE 16 Cb 0.08 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2b88 h ILE 16 CO -0.11 0.41 0.00 -0.26 0.00 0.00 0.00 178.15 178.19 2b88 h PHE 17 N 0.25 0.00 -0.17 1.37 0.04 -0.32 -1.94 116.94 116.16 2b88 h PHE 17 Ca 0.04 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.80 2b88 h PHE 17 Cb 0.73 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.88 2b88 h PHE 17 CO 0.07 0.00 0.01 0.09 -0.60 0.00 0.00 178.31 177.88 2b88 n ASN 18 N -2.88 2.39 -4.74 2.17 5.03 0.14 -4.83 115.26 112.53 2b88 n ASN 18 Ca -0.01 -2.27 -0.38 0.00 0.87 0.00 0.00 54.58 52.79 2b88 n ASN 18 Cb 0.14 -0.56 -0.06 0.00 -1.02 0.00 0.00 39.78 38.28 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 -0.78 4.30 0.00 3.41 1.43 -0.73 -4.98 118.68 121.33 2b88 s LEU 19 Ca 0.15 0.78 0.21 0.00 -1.03 0.00 0.00 54.13 54.24 2b88 s LEU 19 Cb 0.12 -2.62 1.27 0.00 0.03 0.00 0.00 46.19 44.99 2b88 s LEU 19 CO 0.04 0.07 1.69 -0.81 0.23 0.00 0.00 176.35 177.57 2b88 n PRO 20 N 3.37 0.77 0.00 1.29 -0.05 -1.26 -3.61 135.00 135.52 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 -1.43 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 -0.93 0.24 -4.79 3.54 3.02 -1.26 -5.02 115.26 110.06 2b88 n ASN 21 Ca 0.16 -0.58 -0.30 0.00 -0.03 0.00 0.00 54.58 53.83 2b88 n ASN 21 Cb 0.07 0.36 0.09 0.00 -0.61 0.00 0.00 39.78 39.69 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 -0.73 2.73 0.18 3.41 1.43 -1.24 -4.71 118.68 119.77 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 -4.14 -0.04 0.00 0.03 0.00 0.00 46.19 42.03 2b88 s LEU 22 CO 0.00 -1.96 -0.15 0.54 0.23 0.00 0.00 176.35 175.00 2b88 s ASN 23 N -3.72 2.51 0.57 2.29 2.20 -1.26 -4.98 114.94 112.55 2b88 s ASN 23 Ca 0.61 -0.95 0.33 0.00 -0.94 0.00 0.00 52.86 51.90 2b88 s ASN 23 Cb -0.15 -0.13 1.41 0.00 -2.00 0.00 0.00 41.25 40.38 2b88 s ASN 23 CO 0.55 -0.14 1.71 1.23 -2.94 0.00 0.00 177.10 177.51 2b88 h GLY 24 N 2.86 0.00 0.35 0.45 0.00 -1.99 -0.06 103.07 104.68 2b88 h GLY 24 Ca -0.39 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2b88 h GLY 24 CO 0.58 0.00 -0.03 -2.08 0.00 0.00 0.00 176.54 175.01 2b88 h VAL 25 N 0.00 1.54 -0.26 4.60 2.07 -1.98 -2.43 116.25 119.79 2b88 h VAL 25 Ca 0.47 -1.64 -0.07 0.00 0.82 0.00 0.00 66.70 66.29 2b88 h VAL 25 Cb 2.18 2.63 -0.01 0.00 -1.52 0.00 0.00 31.29 34.58 2b88 h VAL 25 CO -0.00 0.43 -0.10 1.56 0.02 0.00 0.00 177.57 179.47 2b88 h GLN 26 N -0.64 0.52 0.10 1.57 4.20 -1.47 -1.24 115.11 118.15 2b88 h GLN 26 Ca -0.00 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.49 2b88 h GLN 26 Cb 0.72 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 2b88 h GLN 26 CO 0.01 0.76 -0.06 0.28 -0.67 0.00 0.00 178.83 179.14 2b88 h VAL 27 N 0.25 0.86 -0.76 -0.54 2.07 -1.29 -1.36 116.25 115.48 2b88 h VAL 27 Ca 0.06 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.71 2b88 h VAL 27 Cb 0.59 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 2b88 h VAL 27 CO 0.03 0.00 0.50 0.11 0.02 0.00 0.00 177.57 178.24 2b88 h LYS 28 N -0.16 0.53 -0.63 1.57 1.79 -1.41 1.46 116.57 119.71 2b88 h LYS 28 Ca -0.01 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.41 2b88 h LYS 28 Cb 0.14 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.64 2b88 h LYS 28 CO 0.00 0.35 0.31 0.00 -1.08 0.00 0.00 179.45 179.04 2b88 h ALA 29 N 1.63 0.81 -0.09 3.86 0.00 -0.26 1.86 119.26 127.08 2b88 h ALA 29 Ca 0.37 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.94 2b88 h ALA 29 Cb 0.67 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2b88 h ALA 29 CO -0.13 0.36 -0.79 0.74 0.00 0.00 0.00 179.25 179.43 2b88 h PHE 30 N 0.87 0.75 -0.36 0.00 0.04 0.52 0.90 116.94 119.65 2b88 h PHE 30 Ca 0.22 -0.35 -0.04 0.00 2.80 0.00 0.00 57.97 60.61 2b88 h PHE 30 Cb 0.10 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 2b88 h PHE 30 CO -0.00 1.14 0.08 0.82 -0.60 0.00 0.00 178.31 179.74 2b88 h ILE 31 N 0.36 1.17 -0.24 -0.55 1.08 0.26 0.49 117.51 120.08 2b88 h ILE 31 Ca -0.05 -0.63 -0.10 0.00 -0.39 0.00 0.00 64.86 63.69 2b88 h ILE 31 Cb 1.39 0.82 -0.00 0.00 -3.07 0.00 0.00 36.82 35.96 2b88 h ILE 31 CO 0.15 0.23 -0.24 0.44 -0.69 0.00 0.00 178.15 178.03 2b88 h ASP 32 N 0.53 0.63 0.06 1.72 3.32 0.33 -2.89 116.42 120.11 2b88 h ASP 32 Ca 0.12 -0.48 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 2b88 h ASP 32 Cb 0.22 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2b88 h ASP 32 CO -0.00 0.98 -0.10 0.77 -1.72 0.00 0.00 179.24 179.17 2b88 h SER 33 N 0.29 0.09 -0.17 6.45 4.64 -0.19 -2.07 113.55 122.60 2b88 h SER 33 Ca 0.04 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.37 2b88 h SER 33 Cb 0.80 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 2b88 h SER 33 CO 0.06 0.21 0.02 -0.07 -0.87 0.00 0.00 176.83 176.18 2b88 h LEU 34 N 0.10 -0.02 -0.44 5.97 -0.00 -0.71 0.29 115.31 120.49 2b88 h LEU 34 Ca 0.02 0.03 -0.05 0.00 -0.00 0.00 0.00 57.88 57.89 2b88 h LEU 34 Cb 0.24 0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 40.93 2b88 h LEU 34 CO 0.01 0.01 0.10 0.03 -0.00 0.00 0.00 178.44 178.60 2b88 h ARG 35 N 0.08 0.72 -0.61 1.13 3.08 -1.39 0.30 114.38 117.70 2b88 h ARG 35 Ca 0.08 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 59.96 2b88 h ARG 35 Cb 0.08 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 2b88 h ARG 35 CO -0.12 0.72 0.41 -0.44 -1.07 0.00 0.00 179.97 179.47 2b88 h ASP 36 N 0.59 0.70 -0.85 7.04 3.32 -1.01 -3.39 116.42 122.82 2b88 h ASP 36 Ca 0.14 -0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.22 2b88 h ASP 36 Cb 0.34 -0.18 -0.20 0.00 0.22 0.00 0.00 39.33 39.51 2b88 h ASP 36 CO 0.00 0.51 -0.32 -0.62 -1.72 0.00 0.00 179.24 177.09 2b88 s ASP 37 N -6.49 -1.37 0.50 6.45 -1.08 0.97 -5.03 116.67 110.62 2b88 s ASP 37 Ca -0.10 -0.00 0.29 0.00 -0.52 0.00 0.00 52.55 52.22 2b88 s ASP 37 Cb 0.18 1.84 1.10 0.00 -1.46 0.00 0.00 42.92 44.57 2b88 s ASP 37 CO 0.76 -0.23 1.89 -0.65 0.52 0.00 0.00 175.17 177.46 2b88 h PRO 38 N 7.61 0.00 0.00 4.34 0.11 -0.60 -2.78 132.00 140.69 2b88 h PRO 38 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2b88 h PRO 38 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2b88 h PRO 38 CO 0.09 0.08 0.00 1.03 -0.21 0.00 0.00 178.00 178.99 2b88 h SER 39 N 0.00 0.00 -0.09 -2.05 0.87 -1.94 -1.93 113.55 108.41 2b88 h SER 39 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2b88 h SER 39 Cb 0.65 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2b88 h SER 39 CO 0.01 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.31 2b88 n GLN 40 N -2.89 1.96 -0.32 2.24 1.13 -1.05 -4.56 117.38 113.90 2b88 n GLN 40 Ca 0.00 -1.41 0.23 0.00 -1.94 0.00 0.00 57.00 53.87 2b88 n GLN 40 Cb 0.23 -1.46 0.43 0.00 0.11 0.00 0.00 30.24 29.54 2b88 n GLN 40 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2b88 n SER 41 N 0.69 0.12 -0.01 1.08 3.41 -0.73 0.23 113.62 118.41 2b88 n SER 41 Ca 0.17 1.60 -0.03 0.00 -0.26 0.00 0.00 58.87 60.36 2b88 n SER 41 Cb 0.45 -0.69 0.22 0.00 -0.26 0.00 0.00 64.21 63.93 2b88 n SER 41 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b88 h ALA 42 N 1.91 1.17 -0.23 7.33 0.00 -1.85 0.38 119.26 127.97 2b88 h ALA 42 Ca 0.70 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 55.14 2b88 h ALA 42 Cb 1.69 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 2b88 h ALA 42 CO -0.81 0.53 -0.56 -0.97 0.00 0.00 0.00 179.25 177.43 2b88 h ASN 43 N 0.50 0.80 -0.38 0.00 -0.73 0.27 0.51 115.58 116.55 2b88 h ASN 43 Ca 0.09 -0.43 -0.09 0.00 1.87 0.00 0.00 56.30 57.74 2b88 h ASN 43 Cb 0.54 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.88 2b88 h ASN 43 CO 0.03 1.19 -0.06 -0.07 -0.37 0.00 0.00 177.43 178.16 2b88 h LEU 44 N 0.54 0.77 -0.47 0.34 3.38 -0.11 1.21 115.31 120.98 2b88 h LEU 44 Ca 0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2b88 h LEU 44 Cb 1.14 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2b88 h LEU 44 CO 0.12 0.88 0.20 -0.07 0.09 0.00 0.00 178.44 179.65 2b88 h LEU 45 N 0.73 0.64 -0.32 1.67 -0.00 0.09 0.69 115.31 118.81 2b88 h LEU 45 Ca 0.13 -0.16 -0.00 0.00 -0.00 0.00 0.00 57.88 57.85 2b88 h LEU 45 Cb 0.53 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.01 2b88 h LEU 45 CO 0.03 0.62 0.19 0.00 -0.00 0.00 0.00 178.44 179.28 2b88 h ALA 46 N 1.04 0.41 -0.17 1.53 0.00 0.19 0.79 119.26 123.05 2b88 h ALA 46 Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2b88 h ALA 46 Cb 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2b88 h ALA 46 CO -0.01 -0.07 -0.13 0.93 0.00 0.00 0.00 179.25 179.96 2b88 h GLU 47 N 0.41 0.28 -0.18 0.00 4.39 0.17 0.26 114.58 119.91 2b88 h GLU 47 Ca 0.12 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 2b88 h GLU 47 Cb 0.04 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2b88 h GLU 47 CO -0.02 0.42 -0.14 0.00 -1.16 0.00 0.00 179.01 178.10 2b88 h ALA 48 N 1.61 0.25 -0.65 3.43 0.00 0.19 0.57 119.26 124.67 2b88 h ALA 48 Ca 0.05 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2b88 h ALA 48 Cb 0.40 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2b88 h ALA 48 CO 0.02 0.13 0.36 0.87 0.00 0.00 0.00 179.25 180.64 2b88 h LYS 49 N 0.07 0.89 -0.41 0.00 1.79 0.11 0.82 116.57 119.84 2b88 h LYS 49 Ca 0.03 -0.09 -0.06 0.00 -2.18 0.00 0.00 60.65 58.35 2b88 h LYS 49 Cb 0.67 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.12 2b88 h LYS 49 CO 0.04 0.66 0.02 -0.22 -1.08 0.00 0.00 179.45 178.86 2b88 h LYS 50 N 0.90 0.71 -0.26 3.15 3.64 -0.15 0.49 116.57 125.05 2b88 h LYS 50 Ca 0.23 -0.21 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 2b88 h LYS 50 Cb 0.02 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2b88 h LYS 50 CO -0.04 0.78 -0.42 -0.07 -2.27 0.00 0.00 179.45 177.43 2b88 h LEU 51 N 0.54 0.82 -0.59 5.20 -0.00 0.13 -0.60 115.31 120.81 2b88 h LEU 51 Ca 0.12 -0.52 -0.06 0.00 -0.00 0.00 0.00 57.88 57.41 2b88 h LEU 51 Cb 0.45 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.85 2b88 h LEU 51 CO 0.02 1.18 0.12 -0.55 -0.00 0.00 0.00 178.44 179.21 2b88 h ASN 52 N 0.47 0.91 -0.81 -0.43 -1.07 0.70 0.22 115.58 115.58 2b88 h ASN 52 Ca 0.02 -0.25 0.01 0.00 0.07 0.00 0.00 56.30 56.15 2b88 h ASN 52 Cb 1.02 -0.24 -0.04 0.00 -2.07 0.00 0.00 38.32 36.99 2b88 h ASN 52 CO 0.10 0.93 0.53 -0.78 0.07 0.00 0.00 177.43 178.27 2b88 h ASP 53 N 0.86 0.93 -0.10 6.14 3.58 0.08 0.78 116.42 128.69 2b88 h ASP 53 Ca 0.18 -0.03 -0.11 0.00 0.42 0.00 0.00 57.03 57.49 2b88 h ASP 53 Cb 0.39 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 2b88 h ASP 53 CO 0.01 0.68 -0.28 0.00 -2.88 0.00 0.00 179.24 176.76 2b88 h ALA 54 N 1.49 0.99 -0.10 -0.78 0.00 -0.31 -2.31 119.26 118.24 2b88 h ALA 54 Ca 0.30 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2b88 h ALA 54 Cb -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2b88 h ALA 54 CO -0.06 0.60 0.00 1.04 0.00 0.00 0.00 179.25 180.82 2b88 n GLN 55 N -4.09 1.74 -2.39 0.00 6.02 0.70 -4.91 117.38 114.44 2b88 n GLN 55 Ca -0.01 -1.09 -0.37 0.00 -0.01 0.00 0.00 57.00 55.52 2b88 n GLN 55 Cb 0.44 -1.44 -0.03 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 -1.89 3.08 0.82 -1.58 0.00 0.25 -4.84 121.76 117.61 2b88 s ALA 56 Ca 0.35 0.84 -0.15 0.00 0.00 0.00 0.00 51.96 53.01 2b88 s ALA 56 Cb 0.19 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 2b88 s ALA 56 CO 0.30 -0.42 0.38 -0.35 0.00 0.00 0.00 175.76 175.67 2b88 n PRO 57 N -0.10 0.05 0.00 0.00 -0.04 -1.26 -5.01 135.00 128.64 2b88 n PRO 57 Ca 0.05 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2b88 n PRO 57 Cb 0.48 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 2b88 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09