#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b87 s ASP 2 N 0.00 7.24 -0.92 4.52 2.15 -1.26 -4.95 116.67 123.45 2b87 s ASP 2 Ca 0.00 1.76 -0.24 0.00 0.43 0.00 0.00 52.55 54.50 2b87 s ASP 2 Cb 0.00 -2.57 -0.01 0.00 -0.30 0.00 0.00 42.92 40.04 2b87 s ASP 2 CO 0.00 -0.37 1.72 0.20 -0.17 0.00 0.00 175.17 176.55 2b87 s ASN 3 N 1.08 5.71 0.19 -0.34 0.01 -1.26 -4.82 114.94 115.50 2b87 s ASN 3 Ca 0.54 -0.88 -0.12 0.00 -0.71 0.00 0.00 52.86 51.68 2b87 s ASN 3 Cb -0.23 -2.56 0.13 0.00 0.41 0.00 0.00 41.25 39.00 2b87 s ASN 3 CO 0.27 -2.21 1.82 0.50 -1.51 0.00 0.00 177.10 175.96 2b87 h LYS 4 N 10.93 0.63 -0.62 -0.60 1.63 -1.98 0.30 116.57 126.87 2b87 h LYS 4 Ca 0.09 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.83 2b87 h LYS 4 Cb 1.02 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.48 2b87 h LYS 4 CO 1.30 0.42 0.30 0.27 -3.45 0.00 0.00 179.45 178.29 2b87 h PHE 5 N 0.65 0.88 -0.32 1.91 -0.00 -1.95 0.65 116.94 118.76 2b87 h PHE 5 Ca 0.23 -0.04 -0.06 0.00 -0.00 0.00 0.00 57.97 58.10 2b87 h PHE 5 Cb 0.05 -0.27 -0.01 0.00 -0.00 0.00 0.00 35.95 35.71 2b87 h PHE 5 CO -0.07 0.66 -0.02 -0.97 -0.00 0.00 0.00 178.31 177.92 2b87 h ASN 6 N 0.84 0.57 -0.66 -0.68 -1.24 -1.82 1.16 115.58 113.76 2b87 h ASN 6 Ca 0.21 -0.32 -0.02 0.00 0.71 0.00 0.00 56.30 56.88 2b87 h ASN 6 Cb 0.11 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 38.97 2b87 h ASN 6 CO -0.03 0.76 0.33 0.50 -1.29 0.00 0.00 177.43 177.70 2b87 h LYS 7 N 0.38 0.94 -0.39 6.67 3.64 -0.17 0.33 116.57 127.96 2b87 h LYS 7 Ca 0.09 -0.13 -0.14 0.00 -1.27 0.00 0.00 60.65 59.20 2b87 h LYS 7 Cb 0.47 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2b87 h LYS 7 CO 0.02 0.73 -0.31 1.49 -2.27 0.00 0.00 179.45 179.11 2b87 h GLU 8 N 0.91 0.87 -0.79 1.90 4.81 0.58 1.17 114.58 124.03 2b87 h GLU 8 Ca 0.23 -0.41 0.01 0.00 -0.13 0.00 0.00 59.36 59.06 2b87 h GLU 8 Cb 0.09 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 2b87 h GLU 8 CO -0.03 1.06 0.52 1.25 -0.73 0.00 0.00 179.01 181.08 2b87 h LEU 9 N 0.73 0.89 -0.15 1.64 5.85 0.20 0.93 115.31 125.41 2b87 h LEU 9 Ca 0.08 -0.02 -0.23 0.00 0.84 0.00 0.00 57.88 58.55 2b87 h LEU 9 Cb 0.88 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 41.69 2b87 h LEU 9 CO 0.08 0.64 -0.92 1.23 -0.34 0.00 0.00 178.44 179.13 2b87 h GLY 10 N 1.06 0.61 0.57 3.75 0.00 -0.05 -2.68 103.07 106.34 2b87 h GLY 10 Ca 0.29 -1.01 -0.00 0.00 0.00 0.00 0.00 47.33 46.61 2b87 h GLY 10 CO -0.07 0.90 -0.04 -0.25 0.00 0.00 0.00 176.54 177.08 2b87 h TRP 11 N 0.33 -0.10 -0.84 5.60 -0.00 0.24 -0.92 115.95 120.27 2b87 h TRP 11 Ca -0.08 -0.00 0.05 0.00 -0.00 0.00 0.00 58.89 58.85 2b87 h TRP 11 Cb 1.55 0.03 -0.05 0.00 -0.00 0.00 0.00 29.16 30.70 2b87 h TRP 11 CO 0.07 0.31 0.55 0.00 -0.00 0.00 0.00 178.44 179.38 2b87 h ALA 12 N 0.34 1.52 -0.39 2.65 0.00 0.74 0.15 119.26 124.27 2b87 h ALA 12 Ca -0.01 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2b87 h ALA 12 Cb 0.45 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 2b87 h ALA 12 CO 0.02 0.38 0.11 1.15 0.00 0.00 0.00 179.25 180.90 2b87 h THR 13 N 1.00 0.84 -0.37 0.00 2.02 -1.32 0.25 112.91 115.34 2b87 h THR 13 Ca 0.35 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.43 2b87 h THR 13 Cb 0.11 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2b87 h THR 13 CO -0.11 0.05 0.20 -0.25 0.37 0.00 0.00 175.52 175.77 2b87 h TRP 14 N 0.25 0.50 -0.68 3.16 2.91 0.40 0.25 115.95 122.74 2b87 h TRP 14 Ca 0.18 -0.01 -0.07 0.00 1.13 0.00 0.00 58.89 60.12 2b87 h TRP 14 Cb 0.20 -0.16 -0.03 0.00 -0.51 0.00 0.00 29.16 28.66 2b87 h TRP 14 CO -0.17 0.39 0.15 0.93 -1.03 0.00 0.00 178.44 178.71 2b87 h GLU 15 N 0.46 1.09 -0.34 2.65 5.08 -0.24 0.70 114.58 123.99 2b87 h GLU 15 Ca 0.13 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 58.10 2b87 h GLU 15 Cb 0.06 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2b87 h GLU 15 CO -0.02 0.97 -0.29 0.82 -1.00 0.00 0.00 179.01 179.49 2b87 h ILE 16 N 1.03 1.28 -0.24 3.13 2.04 -0.27 -1.72 117.51 122.75 2b87 h ILE 16 Ca 0.21 -1.41 -0.08 0.00 1.00 0.00 0.00 64.86 64.58 2b87 h ILE 16 Cb 0.38 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 2b87 h ILE 16 CO 0.00 0.46 -0.20 0.15 0.00 0.00 0.00 178.15 178.56 2b87 h PHE 17 N 0.61 0.47 -0.03 1.37 3.57 0.25 -2.60 116.94 120.58 2b87 h PHE 17 Ca 0.07 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2b87 h PHE 17 Cb 0.79 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2b87 h PHE 17 CO 0.04 0.61 0.00 0.09 -2.23 0.00 0.00 178.31 176.82 2b87 n ASN 18 N -4.16 1.11 -4.73 0.41 3.02 0.24 -4.91 115.26 106.23 2b87 n ASN 18 Ca -0.00 -1.40 -0.42 0.00 -0.03 0.00 0.00 54.58 52.73 2b87 n ASN 18 Cb 0.36 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.49 2b87 n ASN 18 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b87 s LEU 19 N -1.94 4.40 0.00 3.41 1.43 -0.70 -4.92 118.68 120.37 2b87 s LEU 19 Ca 0.39 2.36 0.00 0.00 -1.03 0.00 0.00 54.13 55.85 2b87 s LEU 19 Cb 0.21 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.82 2b87 s LEU 19 CO 0.33 -0.55 0.86 -2.65 0.23 0.00 0.00 176.35 174.57 2b87 n PRO 20 N 3.02 0.93 0.00 1.29 -0.02 -1.26 -4.03 135.00 134.93 2b87 n PRO 20 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 2b87 n PRO 20 Cb 0.43 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 2b87 n PRO 20 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2b87 n ASN 21 N -0.42 0.00 -4.81 2.55 3.02 -1.26 -5.00 115.26 109.34 2b87 n ASN 21 Ca 0.00 -0.63 -0.34 0.00 -0.03 0.00 0.00 54.58 53.58 2b87 n ASN 21 Cb 0.04 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.14 2b87 n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b87 s LEU 22 N 0.00 4.11 0.40 3.41 1.43 -1.26 -4.77 118.68 122.00 2b87 s LEU 22 Ca 0.00 1.68 0.03 0.00 -1.03 0.00 0.00 54.13 54.81 2b87 s LEU 22 Cb 0.00 -4.26 -0.00 0.00 0.03 0.00 0.00 46.19 41.95 2b87 s LEU 22 CO 0.00 -0.22 0.58 0.54 0.23 0.00 0.00 176.35 177.48 2b87 s ASN 23 N -1.97 5.88 0.43 2.29 4.22 -1.26 -4.86 114.94 119.67 2b87 s ASN 23 Ca 0.56 0.07 0.23 0.00 -2.14 0.00 0.00 52.86 51.58 2b87 s ASN 23 Cb -0.13 -1.39 1.23 0.00 1.28 0.00 0.00 41.25 42.25 2b87 s ASN 23 CO 0.17 -0.59 1.74 1.23 -2.04 0.00 0.00 177.10 177.62 2b87 h GLY 24 N 0.61 1.07 0.35 0.45 0.00 -1.98 0.10 103.07 103.67 2b87 h GLY 24 Ca -0.46 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 2b87 h GLY 24 CO 0.55 -0.17 -0.04 -2.08 0.00 0.00 0.00 176.54 174.80 2b87 h VAL 25 N 0.28 1.54 -0.66 4.60 2.07 -1.97 -1.00 116.25 121.10 2b87 h VAL 25 Ca 0.64 -1.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 2b87 h VAL 25 Cb 1.83 2.63 -0.03 0.00 -1.52 0.00 0.00 31.29 34.19 2b87 h VAL 25 CO -0.28 0.43 0.36 1.56 0.02 0.00 0.00 177.57 179.66 2b87 h GLN 26 N -0.63 0.93 -0.42 1.57 4.20 -1.65 0.84 115.11 119.95 2b87 h GLN 26 Ca -0.00 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 2b87 h GLN 26 Cb 0.73 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2b87 h GLN 26 CO 0.01 0.70 0.22 0.28 -0.67 0.00 0.00 178.83 179.37 2b87 h VAL 27 N 0.91 1.16 -0.37 -0.54 2.07 -1.10 0.35 116.25 118.72 2b87 h VAL 27 Ca 0.23 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 2b87 h VAL 27 Cb 0.05 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2b87 h VAL 27 CO -0.04 0.17 0.06 0.11 0.02 0.00 0.00 177.57 177.89 2b87 h LYS 28 N 0.54 0.56 -0.27 1.57 1.57 -0.59 0.18 116.57 120.13 2b87 h LYS 28 Ca 0.15 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 2b87 h LYS 28 Cb 0.07 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2b87 h LYS 28 CO -0.02 0.54 -0.21 0.00 -0.57 0.00 0.00 179.45 179.19 2b87 h ALA 29 N 1.53 0.39 -0.66 3.86 0.00 0.16 0.73 119.26 125.27 2b87 h ALA 29 Ca 0.12 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 2b87 h ALA 29 Cb 0.26 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2b87 h ALA 29 CO 0.00 0.34 0.13 0.74 0.00 0.00 0.00 179.25 180.46 2b87 h PHE 30 N 0.35 1.13 -0.39 0.00 0.04 0.01 0.71 116.94 118.80 2b87 h PHE 30 Ca 0.05 -0.14 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 2b87 h PHE 30 Cb 0.76 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.57 2b87 h PHE 30 CO 0.07 0.94 0.19 0.82 -0.60 0.00 0.00 178.31 179.72 2b87 h ILE 31 N 1.01 1.17 -0.69 -0.55 2.04 -0.36 0.44 117.51 120.57 2b87 h ILE 31 Ca 0.21 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 2b87 h ILE 31 Cb 0.40 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 2b87 h ILE 31 CO 0.01 0.18 0.20 0.44 0.00 0.00 0.00 178.15 178.98 2b87 h ASP 32 N 0.49 1.02 -0.40 1.72 3.32 0.13 0.48 116.42 123.18 2b87 h ASP 32 Ca 0.13 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 56.89 2b87 h ASP 32 Cb 0.12 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2b87 h ASP 32 CO -0.02 0.96 -0.09 0.28 -1.72 0.00 0.00 179.24 178.65 2b87 h SER 33 N 1.04 0.83 0.12 6.45 0.02 0.80 0.32 113.55 123.13 2b87 h SER 33 Ca 0.22 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2b87 h SER 33 Cb 0.32 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.64 2b87 h SER 33 CO -0.00 0.95 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.51 2b87 h LEU 34 N 0.76 -0.13 -0.57 5.07 3.38 0.69 0.61 115.31 125.12 2b87 h LEU 34 Ca 0.13 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2b87 h LEU 34 Cb 0.59 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2b87 h LEU 34 CO 0.04 -0.07 0.37 0.03 0.09 0.00 0.00 178.44 178.90 2b87 h ARG 35 N -0.18 0.73 -0.57 1.13 3.08 0.29 0.23 114.38 119.09 2b87 h ARG 35 Ca -0.02 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 2b87 h ARG 35 Cb 0.14 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 2b87 h ARG 35 CO 0.03 0.48 -0.02 0.22 -1.07 0.00 0.00 179.97 179.61 2b87 h ASP 36 N 0.75 0.99 -2.13 7.04 3.58 -0.07 -3.40 116.42 123.19 2b87 h ASP 36 Ca 0.21 -0.29 -0.37 0.00 0.42 0.00 0.00 57.03 57.01 2b87 h ASP 36 Cb -0.06 -0.27 -0.33 0.00 1.72 0.00 0.00 39.33 40.39 2b87 h ASP 36 CO -0.06 1.06 -0.68 -0.62 -2.88 0.00 0.00 179.24 176.06 2b87 s ASP 37 N -6.61 1.64 0.37 2.28 -1.08 0.21 -5.01 116.67 108.47 2b87 s ASP 37 Ca -0.11 -1.20 0.15 0.00 -0.52 0.00 0.00 52.55 50.86 2b87 s ASP 37 Cb 0.14 0.43 0.72 0.00 -1.46 0.00 0.00 42.92 42.75 2b87 s ASP 37 CO 0.85 -0.33 1.80 -0.65 0.52 0.00 0.00 175.17 177.35 2b87 h PRO 38 N 7.71 0.00 -0.02 4.34 0.11 -0.75 -2.44 132.00 140.94 2b87 h PRO 38 Ca -0.05 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 2b87 h PRO 38 Cb 1.06 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2b87 h PRO 38 CO 0.28 0.39 -0.14 0.77 -0.21 0.00 0.00 178.00 179.09 2b87 h SER 39 N 0.00 0.03 0.03 -2.05 0.02 -1.89 0.13 113.55 109.82 2b87 h SER 39 Ca -0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2b87 h SER 39 Cb 0.75 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2b87 h SER 39 CO 0.05 0.17 -0.01 0.00 -1.14 0.00 0.00 176.83 175.90 2b87 n GLN 40 N -4.36 1.25 -0.32 3.45 3.00 -0.92 -4.23 117.38 115.25 2b87 n GLN 40 Ca -0.02 -0.43 0.23 0.00 -0.01 0.00 0.00 57.00 56.76 2b87 n GLN 40 Cb 0.22 -1.49 0.51 0.00 0.00 0.00 0.00 30.24 29.48 2b87 n GLN 40 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2b87 h SER 41 N 1.05 0.44 -0.55 1.08 4.64 -0.93 0.58 113.55 119.85 2b87 h SER 41 Ca 0.00 0.08 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 2b87 h SER 41 Cb 0.24 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 2b87 h SER 41 CO 0.00 0.09 -0.09 0.00 -0.87 0.00 0.00 176.83 175.96 2b87 h ALA 42 N 1.62 0.76 -0.24 5.18 0.00 -1.80 0.88 119.26 125.65 2b87 h ALA 42 Ca 0.58 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 2b87 h ALA 42 Cb 1.48 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2b87 h ALA 42 CO -0.28 0.67 -0.29 -0.91 0.00 0.00 0.00 179.25 178.44 2b87 h ASN 43 N 0.92 0.50 0.10 0.00 2.35 -0.29 0.18 115.58 119.34 2b87 h ASN 43 Ca 0.15 -0.18 -0.22 0.00 -0.55 0.00 0.00 56.30 55.50 2b87 h ASN 43 Cb 0.66 -0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.90 2b87 h ASN 43 CO 0.05 0.77 -0.84 -0.07 -1.65 0.00 0.00 177.43 175.68 2b87 h LEU 44 N 0.42 0.72 -1.00 1.61 3.38 -0.45 0.33 115.31 120.33 2b87 h LEU 44 Ca 0.06 -0.51 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 2b87 h LEU 44 Cb 0.72 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2b87 h LEU 44 CO 0.06 1.29 0.17 0.25 0.09 0.00 0.00 178.44 180.30 2b87 h LEU 45 N 0.37 0.84 -0.29 1.67 5.85 -0.57 0.64 115.31 123.82 2b87 h LEU 45 Ca -0.07 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 2b87 h LEU 45 Cb 1.46 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 2b87 h LEU 45 CO 0.16 0.80 0.04 0.00 -0.34 0.00 0.00 178.44 179.10 2b87 h ALA 46 N 1.32 0.38 -0.75 1.25 0.00 -0.08 0.27 119.26 121.64 2b87 h ALA 46 Ca 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2b87 h ALA 46 Cb 0.27 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2b87 h ALA 46 CO -0.01 0.07 0.38 0.93 0.00 0.00 0.00 179.25 180.63 2b87 h GLU 47 N 0.30 1.06 -0.13 0.00 4.39 0.40 0.18 114.58 120.78 2b87 h GLU 47 Ca 0.09 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 2b87 h GLU 47 Cb 0.34 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2b87 h GLU 47 CO 0.01 0.80 -0.01 0.00 -1.16 0.00 0.00 179.01 178.65 2b87 h ALA 48 N 1.36 0.18 -0.26 3.43 0.00 0.71 0.68 119.26 125.36 2b87 h ALA 48 Ca 0.26 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2b87 h ALA 48 Cb 0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2b87 h ALA 48 CO -0.04 -0.11 0.17 0.87 0.00 0.00 0.00 179.25 180.14 2b87 h LYS 49 N -0.04 0.29 -0.18 0.00 1.57 0.01 1.28 116.57 119.51 2b87 h LYS 49 Ca 0.04 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.62 2b87 h LYS 49 Cb 0.39 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.64 2b87 h LYS 49 CO 0.01 0.19 -0.58 -0.22 -0.57 0.00 0.00 179.45 178.27 2b87 h LYS 50 N 0.30 0.71 -0.34 3.15 3.64 0.08 0.26 116.57 124.36 2b87 h LYS 50 Ca 0.10 -0.53 -0.14 0.00 -1.27 0.00 0.00 60.65 58.81 2b87 h LYS 50 Cb 0.04 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2b87 h LYS 50 CO -0.02 1.14 -0.33 -0.07 -2.27 0.00 0.00 179.45 177.90 2b87 h LEU 51 N 0.41 0.89 -0.30 5.20 -0.00 0.18 0.20 115.31 121.89 2b87 h LEU 51 Ca -0.02 -0.47 -0.03 0.00 -0.00 0.00 0.00 57.88 57.36 2b87 h LEU 51 Cb 1.21 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 41.61 2b87 h LEU 51 CO 0.12 1.17 0.06 -1.13 -0.00 0.00 0.00 178.44 178.66 2b87 h ASN 52 N 0.62 0.46 -0.80 -0.43 -1.24 0.16 0.36 115.58 114.71 2b87 h ASN 52 Ca 0.06 -0.25 -0.04 0.00 0.71 0.00 0.00 56.30 56.78 2b87 h ASN 52 Cb 0.91 -0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.81 2b87 h ASN 52 CO 0.08 0.59 0.35 0.44 -1.29 0.00 0.00 177.43 177.61 2b87 h ASP 53 N 0.32 1.08 -0.47 1.15 3.32 -0.39 0.69 116.42 122.11 2b87 h ASP 53 Ca 0.09 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 2b87 h ASP 53 Cb 0.32 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2b87 h ASP 53 CO 0.00 0.93 0.00 0.00 -1.72 0.00 0.00 179.24 178.46 2b87 h ALA 54 N 1.22 1.01 -0.01 3.45 0.00 -0.23 -2.01 119.26 122.69 2b87 h ALA 54 Ca 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2b87 h ALA 54 Cb 0.17 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2b87 h ALA 54 CO -0.03 0.61 -0.03 1.04 0.00 0.00 0.00 179.25 180.84 2b87 n GLN 55 N -4.20 1.36 -2.32 0.00 6.02 0.12 -4.90 117.38 113.46 2b87 n GLN 55 Ca 0.03 -0.63 -0.40 0.00 -0.01 0.00 0.00 57.00 55.98 2b87 n GLN 55 Cb 0.32 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.06 2b87 n GLN 55 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b87 s ALA 56 N -2.08 3.45 0.53 -1.58 0.00 0.23 -4.90 121.76 117.40 2b87 s ALA 56 Ca 0.39 1.05 -0.18 0.00 0.00 0.00 0.00 51.96 53.22 2b87 s ALA 56 Cb 0.21 -3.39 -0.14 0.00 0.00 0.00 0.00 23.12 19.80 2b87 s ALA 56 CO 0.37 -0.36 0.01 -0.35 0.00 0.00 0.00 175.76 175.42 2b87 n PRO 57 N 1.07 0.11 0.00 0.00 -0.04 -1.26 -5.00 135.00 129.87 2b87 n PRO 57 Ca -0.01 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2b87 n PRO 57 Cb 0.44 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 2b87 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09