#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b87 n ASP 2 N 0.00 -0.81 -4.55 4.52 5.75 -1.26 -4.91 116.55 115.28 2b87 n ASP 2 Ca 0.00 -1.21 -0.37 0.00 -0.01 0.00 0.00 54.79 53.20 2b87 n ASP 2 Cb 0.00 -0.79 -0.03 0.00 -1.03 0.00 0.00 41.12 39.27 2b87 n ASP 2 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 2b87 s ASN 3 N -4.34 5.67 0.16 -1.12 0.02 -1.26 -4.84 114.94 109.22 2b87 s ASN 3 Ca 0.57 -0.40 -0.16 0.00 -1.02 0.00 0.00 52.86 51.86 2b87 s ASN 3 Cb -0.03 -2.55 0.04 0.00 0.02 0.00 0.00 41.25 38.73 2b87 s ASN 3 CO 0.42 -2.19 1.81 0.50 0.02 0.00 0.00 177.10 177.66 2b87 h LYS 4 N 12.01 0.52 -0.91 -0.60 3.64 -1.98 0.20 116.57 129.44 2b87 h LYS 4 Ca -0.10 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2b87 h LYS 4 Cb 1.07 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.73 2b87 h LYS 4 CO 1.27 0.35 0.55 0.27 -2.27 0.00 0.00 179.45 179.62 2b87 h PHE 5 N 0.54 1.20 -0.48 1.91 -0.00 -1.97 0.40 116.94 118.54 2b87 h PHE 5 Ca 0.16 -0.00 -0.04 0.00 -0.00 0.00 0.00 57.97 58.09 2b87 h PHE 5 Cb -0.02 -0.39 -0.02 0.00 -0.00 0.00 0.00 35.95 35.51 2b87 h PHE 5 CO -0.06 0.79 0.13 -0.97 -0.00 0.00 0.00 178.31 178.20 2b87 h ASN 6 N 1.25 0.72 -0.76 -0.68 -1.24 -1.81 1.21 115.58 114.27 2b87 h ASN 6 Ca 0.33 -0.22 -0.01 0.00 0.71 0.00 0.00 56.30 57.11 2b87 h ASN 6 Cb -0.06 -0.19 -0.04 0.00 0.73 0.00 0.00 38.32 38.76 2b87 h ASN 6 CO -0.06 0.75 0.45 0.50 -1.29 0.00 0.00 177.43 177.78 2b87 h LYS 7 N 0.65 1.04 -0.20 6.67 3.64 0.11 0.39 116.57 128.88 2b87 h LYS 7 Ca 0.15 -0.10 -0.17 0.00 -1.27 0.00 0.00 60.65 59.26 2b87 h LYS 7 Cb 0.31 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2b87 h LYS 7 CO -0.00 0.74 -0.57 0.93 -2.27 0.00 0.00 179.45 178.29 2b87 h GLU 8 N 1.04 0.62 -0.81 1.90 3.07 0.33 1.12 114.58 121.86 2b87 h GLU 8 Ca 0.27 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 2b87 h GLU 8 Cb -0.02 0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 27.90 2b87 h GLU 8 CO -0.05 1.02 0.52 1.25 -1.40 0.00 0.00 179.01 180.35 2b87 h LEU 9 N 0.47 0.94 -0.02 1.33 5.85 0.23 1.21 115.31 125.32 2b87 h LEU 9 Ca 0.01 -0.04 -0.17 0.00 0.84 0.00 0.00 57.88 58.52 2b87 h LEU 9 Cb 1.13 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 41.94 2b87 h LEU 9 CO 0.11 0.69 -0.66 1.23 -0.34 0.00 0.00 178.44 179.47 2b87 h GLY 10 N 1.10 0.55 0.86 3.75 0.00 -0.02 -2.41 103.07 106.89 2b87 h GLY 10 Ca 0.29 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 2b87 h GLY 10 CO -0.06 0.81 0.04 -0.25 0.00 0.00 0.00 176.54 177.08 2b87 h TRP 11 N 0.04 0.17 -0.99 5.60 -0.00 0.19 0.16 115.95 121.13 2b87 h TRP 11 Ca -0.08 -0.01 0.02 0.00 -0.00 0.00 0.00 58.89 58.82 2b87 h TRP 11 Cb 1.35 -0.05 -0.05 0.00 -0.00 0.00 0.00 29.16 30.41 2b87 h TRP 11 CO 0.13 0.28 0.65 0.00 -0.00 0.00 0.00 178.44 179.51 2b87 h ALA 12 N 0.87 1.32 -0.43 2.65 0.00 0.14 0.44 119.26 124.24 2b87 h ALA 12 Ca 0.04 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.95 2b87 h ALA 12 Cb 0.19 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 2b87 h ALA 12 CO -0.00 0.61 0.13 1.15 0.00 0.00 0.00 179.25 181.14 2b87 h THR 13 N 1.30 0.83 -0.23 0.00 2.02 -0.88 0.91 112.91 116.87 2b87 h THR 13 Ca 0.37 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.42 2b87 h THR 13 Cb -0.10 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 2b87 h THR 13 CO -0.09 0.05 0.01 -0.25 0.37 0.00 0.00 175.52 175.61 2b87 h TRP 14 N 0.29 0.44 -0.62 3.16 2.91 0.93 0.29 115.95 123.34 2b87 h TRP 14 Ca 0.21 -0.07 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 2b87 h TRP 14 Cb 0.22 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 28.72 2b87 h TRP 14 CO -0.17 0.56 0.30 0.93 -1.03 0.00 0.00 178.44 179.03 2b87 h GLU 15 N 0.18 0.87 -0.27 2.65 4.39 0.18 1.01 114.58 123.60 2b87 h GLU 15 Ca 0.07 -0.11 -0.15 0.00 0.34 0.00 0.00 59.36 59.51 2b87 h GLU 15 Cb 0.38 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2b87 h GLU 15 CO 0.01 0.68 -0.44 0.82 -1.16 0.00 0.00 179.01 178.92 2b87 h ILE 16 N 0.87 1.30 -0.58 3.13 2.04 -0.67 -1.69 117.51 121.91 2b87 h ILE 16 Ca 0.22 -1.63 -0.07 0.00 1.00 0.00 0.00 64.86 64.38 2b87 h ILE 16 Cb 0.09 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 2b87 h ILE 16 CO -0.03 0.52 0.08 0.15 0.00 0.00 0.00 178.15 178.87 2b87 h PHE 17 N 0.54 0.99 -0.27 1.37 3.57 0.14 -2.80 116.94 120.48 2b87 h PHE 17 Ca 0.04 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.41 2b87 h PHE 17 Cb 0.98 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.44 2b87 h PHE 17 CO 0.05 0.85 0.00 0.09 -2.23 0.00 0.00 178.31 177.07 2b87 n ASN 18 N -4.23 2.08 -4.73 0.41 5.03 0.33 -4.93 115.26 109.22 2b87 n ASN 18 Ca 0.04 -1.83 -0.42 0.00 0.87 0.00 0.00 54.58 53.24 2b87 n ASN 18 Cb 0.28 -0.17 -0.03 0.00 -1.02 0.00 0.00 39.78 38.83 2b87 n ASN 18 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2b87 s LEU 19 N -1.39 4.40 0.00 3.41 1.43 -0.65 -4.92 118.68 120.96 2b87 s LEU 19 Ca 0.32 2.37 0.00 0.00 -1.03 0.00 0.00 54.13 55.79 2b87 s LEU 19 Cb 0.17 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.79 2b87 s LEU 19 CO 0.25 -0.55 0.82 -2.65 0.23 0.00 0.00 176.35 174.45 2b87 n PRO 20 N 2.97 0.90 0.00 1.29 -0.02 -1.26 -4.00 135.00 134.88 2b87 n PRO 20 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2b87 n PRO 20 Cb 0.43 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 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 -0.41 0.00 -4.82 2.55 3.02 -1.26 -5.00 115.26 109.35 2b87 n ASN 21 Ca 0.00 -0.71 -0.34 0.00 -0.03 0.00 0.00 54.58 53.51 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 4.06 0.41 3.41 1.43 -1.26 -4.77 118.68 121.97 2b87 s LEU 22 Ca 0.00 1.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 2b87 s LEU 22 Cb 0.00 -4.31 -0.01 0.00 0.03 0.00 0.00 46.19 41.91 2b87 s LEU 22 CO 0.00 -0.25 0.60 0.54 0.23 0.00 0.00 176.35 177.46 2b87 s ASN 23 N -2.05 5.90 0.45 2.29 4.22 -1.26 -4.87 114.94 119.62 2b87 s ASN 23 Ca 0.57 0.14 0.26 0.00 -2.14 0.00 0.00 52.86 51.69 2b87 s ASN 23 Cb -0.12 -1.46 1.29 0.00 1.28 0.00 0.00 41.25 42.24 2b87 s ASN 23 CO 0.16 -0.59 1.76 1.23 -2.04 0.00 0.00 177.10 177.62 2b87 h GLY 24 N 0.58 0.84 0.31 0.45 0.00 -1.99 -0.97 103.07 102.30 2b87 h GLY 24 Ca -0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 2b87 h GLY 24 CO 0.56 -0.13 -0.05 -2.08 0.00 0.00 0.00 176.54 174.84 2b87 h VAL 25 N 0.23 1.57 -0.54 4.60 2.07 -1.97 -1.52 116.25 120.69 2b87 h VAL 25 Ca 0.62 -1.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.38 2b87 h VAL 25 Cb 1.90 2.74 -0.03 0.00 -1.52 0.00 0.00 31.29 34.39 2b87 h VAL 25 CO -0.22 0.46 0.33 1.56 0.02 0.00 0.00 177.57 179.72 2b87 h GLN 26 N -0.67 0.73 -0.38 1.57 4.20 -1.68 0.72 115.11 119.59 2b87 h GLN 26 Ca -0.01 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 2b87 h GLN 26 Cb 0.78 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.39 2b87 h GLN 26 CO 0.01 0.52 0.20 0.28 -0.67 0.00 0.00 178.83 179.17 2b87 h VAL 27 N 0.72 1.15 -0.55 -0.54 2.07 -1.32 0.22 116.25 118.01 2b87 h VAL 27 Ca 0.19 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 2b87 h VAL 27 Cb -0.02 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2b87 h VAL 27 CO -0.04 0.16 0.32 0.50 0.02 0.00 0.00 177.57 178.54 2b87 h LYS 28 N 0.48 0.74 -0.23 1.57 3.64 -0.70 0.96 116.57 123.02 2b87 h LYS 28 Ca 0.13 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.34 2b87 h LYS 28 Cb 0.07 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 2b87 h LYS 28 CO -0.02 0.52 -0.29 0.00 -2.27 0.00 0.00 179.45 177.39 2b87 h ALA 29 N 1.61 0.35 -0.64 5.00 0.00 0.13 0.39 119.26 126.09 2b87 h ALA 29 Ca 0.20 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 2b87 h ALA 29 Cb -0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2b87 h ALA 29 CO -0.04 0.36 0.19 0.74 0.00 0.00 0.00 179.25 180.51 2b87 h PHE 30 N 0.31 1.01 -0.35 0.00 0.04 -0.11 0.43 116.94 118.27 2b87 h PHE 30 Ca 0.03 -0.09 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 2b87 h PHE 30 Cb 0.86 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 2b87 h PHE 30 CO 0.08 0.81 0.03 0.82 -0.60 0.00 0.00 178.31 179.45 2b87 h ILE 31 N 0.95 1.25 -0.60 -0.55 2.04 -0.62 0.20 117.51 120.18 2b87 h ILE 31 Ca 0.21 -0.91 0.04 0.00 1.00 0.00 0.00 64.86 65.20 2b87 h ILE 31 Cb 0.28 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 2b87 h ILE 31 CO -0.01 0.30 0.34 0.44 0.00 0.00 0.00 178.15 179.22 2b87 h ASP 32 N 0.42 0.52 -0.53 1.72 3.32 0.72 0.16 116.42 122.74 2b87 h ASP 32 Ca 0.10 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 2b87 h ASP 32 Cb 0.41 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 2b87 h ASP 32 CO 0.01 0.35 0.11 0.28 -1.72 0.00 0.00 179.24 178.28 2b87 h SER 33 N 0.65 0.87 0.24 6.45 0.02 0.06 -0.55 113.55 121.29 2b87 h SER 33 Ca 0.25 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2b87 h SER 33 Cb 0.11 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2b87 h SER 33 CO -0.14 0.86 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.22 2b87 h LEU 34 N 0.87 -0.30 -0.48 5.07 3.38 0.78 0.58 115.31 125.22 2b87 h LEU 34 Ca 0.18 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.19 2b87 h LEU 34 Cb 0.36 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2b87 h LEU 34 CO 0.00 -0.21 0.29 0.03 0.09 0.00 0.00 178.44 178.64 2b87 h ARG 35 N -0.34 0.56 -0.57 1.13 3.08 -0.51 0.75 114.38 118.48 2b87 h ARG 35 Ca -0.03 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2b87 h ARG 35 Cb 0.26 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 2b87 h ARG 35 CO 0.05 0.37 0.18 0.22 -1.07 0.00 0.00 179.97 179.71 2b87 h ASP 36 N 0.57 0.79 -1.81 7.04 3.58 -0.83 -3.39 116.42 122.38 2b87 h ASP 36 Ca 0.19 -0.13 -0.26 0.00 0.42 0.00 0.00 57.03 57.26 2b87 h ASP 36 Cb 0.01 -0.21 -0.29 0.00 1.72 0.00 0.00 39.33 40.57 2b87 h ASP 36 CO -0.09 0.75 -0.59 -0.62 -2.88 0.00 0.00 179.24 175.81 2b87 s ASP 37 N -6.55 0.72 0.31 2.28 -1.08 0.20 -5.01 116.67 107.54 2b87 s ASP 37 Ca -0.10 -0.85 0.10 0.00 -0.52 0.00 0.00 52.55 51.18 2b87 s ASP 37 Cb 0.16 0.90 0.52 0.00 -1.46 0.00 0.00 42.92 43.03 2b87 s ASP 37 CO 0.80 -0.32 1.71 -0.65 0.52 0.00 0.00 175.17 177.23 2b87 h PRO 38 N 7.76 0.06 0.00 4.34 0.11 -1.08 -2.39 132.00 140.80 2b87 h PRO 38 Ca -0.04 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.02 2b87 h PRO 38 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2b87 h PRO 38 CO 0.25 0.53 -0.09 0.77 -0.21 0.00 0.00 178.00 179.24 2b87 h SER 39 N 0.05 0.00 0.11 -2.05 0.02 -1.91 0.11 113.55 109.87 2b87 h SER 39 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2b87 h SER 39 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 2b87 h SER 39 CO 0.06 0.09 -0.07 1.67 -1.14 0.00 0.00 176.83 177.44 2b87 n GLN 40 N -4.19 1.20 -0.34 3.45 -0.06 -0.91 -4.33 117.38 112.21 2b87 n GLN 40 Ca -0.03 -0.57 0.18 0.00 -2.00 0.00 0.00 57.00 54.58 2b87 n GLN 40 Cb 0.17 -1.49 0.40 0.00 -4.06 0.00 0.00 30.24 25.26 2b87 n GLN 40 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2b87 h SER 41 N 1.39 0.65 -0.13 1.69 4.64 -0.69 0.52 113.55 121.61 2b87 h SER 41 Ca 0.00 0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 61.35 2b87 h SER 41 Cb 0.39 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 2b87 h SER 41 CO 0.00 0.13 -0.18 0.00 -0.87 0.00 0.00 176.83 175.91 2b87 h ALA 42 N 1.69 1.14 -0.22 5.18 0.00 -1.78 0.52 119.26 125.78 2b87 h ALA 42 Ca 0.62 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 2b87 h ALA 42 Cb 1.22 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2b87 h ALA 42 CO -0.42 0.54 -0.37 -0.97 0.00 0.00 0.00 179.25 178.03 2b87 h ASN 43 N 0.48 0.52 0.14 0.00 -0.73 -0.33 0.51 115.58 116.16 2b87 h ASN 43 Ca 0.08 -0.22 -0.21 0.00 1.87 0.00 0.00 56.30 57.82 2b87 h ASN 43 Cb 0.59 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 39.04 2b87 h ASN 43 CO 0.04 0.85 -0.82 -0.07 -0.37 0.00 0.00 177.43 177.06 2b87 h LEU 44 N 0.42 0.67 -0.79 0.34 3.38 -0.66 0.69 115.31 119.35 2b87 h LEU 44 Ca 0.04 -0.47 -0.09 0.00 0.09 0.00 0.00 57.88 57.45 2b87 h LEU 44 Cb 0.84 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2b87 h LEU 44 CO 0.07 1.24 -0.11 0.25 0.09 0.00 0.00 178.44 179.99 2b87 h LEU 45 N 0.35 0.80 -0.29 1.67 5.85 -0.68 0.72 115.31 123.73 2b87 h LEU 45 Ca -0.06 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.40 2b87 h LEU 45 Cb 1.43 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 2b87 h LEU 45 CO 0.15 0.93 0.07 0.00 -0.34 0.00 0.00 178.44 179.25 2b87 h ALA 46 N 1.15 0.38 -0.63 1.25 0.00 0.68 0.38 119.26 122.48 2b87 h ALA 46 Ca 0.12 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2b87 h ALA 46 Cb 0.60 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2b87 h ALA 46 CO 0.04 0.04 0.11 0.93 0.00 0.00 0.00 179.25 180.37 2b87 h GLU 47 N 0.30 1.01 -0.19 0.00 4.39 0.81 0.67 114.58 121.57 2b87 h GLU 47 Ca 0.09 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.50 2b87 h GLU 47 Cb 0.29 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2b87 h GLU 47 CO 0.00 0.92 -0.03 0.00 -1.16 0.00 0.00 179.01 178.75 2b87 h ALA 48 N 1.16 0.26 -0.22 3.43 0.00 0.80 0.79 119.26 125.48 2b87 h ALA 48 Ca 0.19 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2b87 h ALA 48 Cb 0.40 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2b87 h ALA 48 CO 0.01 0.01 0.11 0.87 0.00 0.00 0.00 179.25 180.24 2b87 h LYS 49 N 0.08 0.30 -0.14 0.00 1.79 0.00 1.12 116.57 119.72 2b87 h LYS 49 Ca 0.05 -0.02 -0.21 0.00 -2.18 0.00 0.00 60.65 58.29 2b87 h LYS 49 Cb 0.45 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 31.05 2b87 h LYS 49 CO 0.02 0.23 -0.72 -0.22 -1.08 0.00 0.00 179.45 177.67 2b87 h LYS 50 N 0.30 0.73 -0.34 3.15 3.64 -0.16 0.16 116.57 124.05 2b87 h LYS 50 Ca 0.08 -0.60 -0.14 0.00 -1.27 0.00 0.00 60.65 58.72 2b87 h LYS 50 Cb 0.03 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2b87 h LYS 50 CO -0.01 1.21 -0.33 -0.07 -2.27 0.00 0.00 179.45 177.98 2b87 h LEU 51 N 0.43 0.88 -0.29 5.20 -0.00 0.18 0.25 115.31 121.95 2b87 h LEU 51 Ca -0.05 -0.47 -0.03 0.00 -0.00 0.00 0.00 57.88 57.33 2b87 h LEU 51 Cb 1.36 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 41.76 2b87 h LEU 51 CO 0.15 1.16 0.06 -1.13 -0.00 0.00 0.00 178.44 178.68 2b87 h ASN 52 N 0.61 0.46 -0.80 -0.43 -1.24 0.12 0.36 115.58 114.66 2b87 h ASN 52 Ca 0.06 -0.25 -0.04 0.00 0.71 0.00 0.00 56.30 56.77 2b87 h ASN 52 Cb 0.91 -0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.80 2b87 h ASN 52 CO 0.08 0.59 0.34 0.44 -1.29 0.00 0.00 177.43 177.59 2b87 h ASP 53 N 0.30 1.10 -0.49 1.15 3.32 -0.57 0.71 116.42 121.94 2b87 h ASP 53 Ca 0.09 -0.16 -0.08 0.00 0.02 0.00 0.00 57.03 56.90 2b87 h ASP 53 Cb 0.32 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2b87 h ASP 53 CO 0.00 0.96 0.01 0.00 -1.72 0.00 0.00 179.24 178.50 2b87 h ALA 54 N 1.20 1.00 -0.01 3.45 0.00 -0.16 -2.03 119.26 122.71 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 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2b87 h ALA 54 CO -0.02 0.61 -0.10 1.04 0.00 0.00 0.00 179.25 180.78 2b87 n GLN 55 N -4.20 0.97 -2.35 0.00 6.02 0.12 -4.88 117.38 113.06 2b87 n GLN 55 Ca 0.03 -0.41 -0.41 0.00 -0.01 0.00 0.00 57.00 56.20 2b87 n GLN 55 Cb 0.31 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.05 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 -2.31 3.45 0.46 -1.58 0.00 0.24 -4.91 121.76 117.11 2b87 s ALA 56 Ca 0.33 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 53.10 2b87 s ALA 56 Cb 0.20 -3.40 -0.14 0.00 0.00 0.00 0.00 23.12 19.79 2b87 s ALA 56 CO 0.44 -0.35 0.13 -0.35 0.00 0.00 0.00 175.76 175.63 2b87 n PRO 57 N 1.57 0.15 0.00 0.00 -0.04 -1.26 -4.99 135.00 130.42 2b87 n PRO 57 Ca 0.01 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2b87 n PRO 57 Cb 0.44 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 2b87 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09