#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 1.87 -1.22 -1.34 -4.77 -1.26 -4.89 116.67 105.05 2b87 s ASP 2 Ca 0.00 -0.45 -0.03 0.00 -3.30 0.00 0.00 52.55 48.77 2b87 s ASP 2 Cb 0.00 0.12 -0.01 0.00 -1.09 0.00 0.00 42.92 41.94 2b87 s ASP 2 CO 0.00 -0.35 0.83 0.59 0.70 0.00 0.00 175.17 176.94 2b87 n ASN 3 N 5.30 -2.56 -0.21 2.11 3.02 -1.26 -4.70 115.26 116.96 2b87 n ASN 3 Ca -0.06 -0.76 0.01 0.00 -0.03 0.00 0.00 54.58 53.74 2b87 n ASN 3 Cb 0.49 -4.48 0.12 0.00 -0.61 0.00 0.00 39.78 35.30 2b87 n ASN 3 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2b87 h LYS 4 N -1.77 0.41 -0.12 3.52 3.64 -1.97 0.58 116.57 120.86 2b87 h LYS 4 Ca -0.61 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 58.77 2b87 h LYS 4 Cb 1.35 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 2b87 h LYS 4 CO 0.52 0.27 -0.05 0.35 -2.27 0.00 0.00 179.45 178.27 2b87 h PHE 5 N 0.42 -0.12 -0.57 1.91 3.57 -1.97 1.13 116.94 121.30 2b87 h PHE 5 Ca 0.32 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 2b87 h PHE 5 Cb 0.41 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 2b87 h PHE 5 CO -0.17 -0.09 0.24 -0.97 -2.23 0.00 0.00 178.31 175.09 2b87 h ASN 6 N -0.04 0.78 -0.78 0.41 -1.24 -1.75 1.59 115.58 114.55 2b87 h ASN 6 Ca 0.07 -0.16 0.02 0.00 0.71 0.00 0.00 56.30 56.93 2b87 h ASN 6 Cb 0.14 -0.20 -0.04 0.00 0.73 0.00 0.00 38.32 38.95 2b87 h ASN 6 CO -0.15 0.72 0.51 0.50 -1.29 0.00 0.00 177.43 177.72 2b87 h LYS 7 N 0.78 0.99 -0.11 6.67 3.64 0.78 0.22 116.57 129.54 2b87 h LYS 7 Ca 0.19 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.36 2b87 h LYS 7 Cb 0.18 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2b87 h LYS 7 CO -0.02 0.65 -0.51 0.93 -2.27 0.00 0.00 179.45 178.24 2b87 h GLU 8 N 1.02 0.54 -0.94 1.90 4.39 0.21 0.19 114.58 121.89 2b87 h GLU 8 Ca 0.30 -0.43 0.03 0.00 0.34 0.00 0.00 59.36 59.60 2b87 h GLU 8 Cb -0.06 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.62 2b87 h GLU 8 CO -0.08 1.06 0.62 1.25 -1.16 0.00 0.00 179.01 180.70 2b87 h LEU 9 N 0.16 1.03 -0.25 1.33 5.85 0.26 0.55 115.31 124.24 2b87 h LEU 9 Ca -0.03 -0.01 -0.21 0.00 0.84 0.00 0.00 57.88 58.47 2b87 h LEU 9 Cb 1.15 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.94 2b87 h LEU 9 CO 0.11 0.72 -0.72 1.23 -0.34 0.00 0.00 178.44 179.43 2b87 h GLY 10 N 1.20 0.79 0.52 3.75 0.00 -0.54 -2.88 103.07 105.91 2b87 h GLY 10 Ca 0.37 -1.07 -0.00 0.00 0.00 0.00 0.00 47.33 46.62 2b87 h GLY 10 CO -0.11 0.96 -0.01 -0.25 0.00 0.00 0.00 176.54 177.13 2b87 h TRP 11 N 0.50 -0.04 -0.83 5.60 -0.00 0.67 -1.38 115.95 120.48 2b87 h TRP 11 Ca -0.04 -0.00 0.07 0.00 -0.00 0.00 0.00 58.89 58.92 2b87 h TRP 11 Cb 1.33 0.01 -0.05 0.00 -0.00 0.00 0.00 29.16 30.45 2b87 h TRP 11 CO 0.07 0.43 0.54 0.00 -0.00 0.00 0.00 178.44 179.48 2b87 h ALA 12 N 0.43 1.62 -0.39 2.65 0.00 -0.10 0.14 119.26 123.60 2b87 h ALA 12 Ca -0.00 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2b87 h ALA 12 Cb 0.48 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2b87 h ALA 12 CO 0.01 0.25 0.13 1.15 0.00 0.00 0.00 179.25 180.79 2b87 h THR 13 N 0.89 0.88 -0.29 0.00 2.02 -1.37 -0.29 112.91 114.74 2b87 h THR 13 Ca 0.36 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.42 2b87 h THR 13 Cb 0.26 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2b87 h THR 13 CO -0.13 0.05 0.07 -0.25 0.37 0.00 0.00 175.52 175.63 2b87 h TRP 14 N 0.29 0.48 -0.78 3.16 2.91 0.12 0.18 115.95 122.30 2b87 h TRP 14 Ca 0.18 -0.06 0.00 0.00 1.13 0.00 0.00 58.89 60.14 2b87 h TRP 14 Cb 0.16 -0.14 -0.04 0.00 -0.51 0.00 0.00 29.16 28.64 2b87 h TRP 14 CO -0.15 0.52 0.50 0.93 -1.03 0.00 0.00 178.44 179.21 2b87 h GLU 15 N 0.30 1.05 -0.34 2.65 5.08 -0.49 1.22 114.58 124.04 2b87 h GLU 15 Ca 0.09 -0.08 -0.16 0.00 -1.00 0.00 0.00 59.36 58.22 2b87 h GLU 15 Cb 0.28 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2b87 h GLU 15 CO 0.00 0.71 -0.41 0.82 -1.00 0.00 0.00 179.01 179.14 2b87 h ILE 16 N 1.07 1.28 -0.65 3.13 2.04 -0.84 -2.49 117.51 121.05 2b87 h ILE 16 Ca 0.29 -1.58 -0.07 0.00 1.00 0.00 0.00 64.86 64.49 2b87 h ILE 16 Cb -0.09 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 2b87 h ILE 16 CO -0.06 0.52 0.13 0.15 0.00 0.00 0.00 178.15 178.89 2b87 h PHE 17 N 0.68 1.11 -0.17 1.37 3.57 0.12 -2.81 116.94 120.81 2b87 h PHE 17 Ca 0.05 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2b87 h PHE 17 Cb 0.98 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2b87 h PHE 17 CO 0.06 0.92 0.00 0.09 -2.23 0.00 0.00 178.31 177.15 2b87 n ASN 18 N -4.23 1.41 -4.76 0.41 5.03 0.40 -4.92 115.26 108.61 2b87 n ASN 18 Ca 0.05 -1.72 -0.41 0.00 0.87 0.00 0.00 54.58 53.37 2b87 n ASN 18 Cb 0.27 -0.11 -0.03 0.00 -1.02 0.00 0.00 39.78 38.89 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 -1.46 4.45 0.00 3.41 1.43 -0.95 -4.92 118.68 120.64 2b87 s LEU 19 Ca 0.29 2.50 0.00 0.00 -1.03 0.00 0.00 54.13 55.90 2b87 s LEU 19 Cb 0.15 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.74 2b87 s LEU 19 CO 0.23 -0.45 0.88 -2.65 0.23 0.00 0.00 176.35 174.58 2b87 n PRO 20 N 1.53 0.89 0.00 1.29 -0.02 -1.26 -4.04 135.00 133.39 2b87 n PRO 20 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2b87 n PRO 20 Cb 0.43 -1.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.89 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 -0.48 0.00 -4.83 2.55 3.02 -1.26 -4.99 115.26 109.27 2b87 n ASN 21 Ca 0.00 -0.69 -0.33 0.00 -0.03 0.00 0.00 54.58 53.54 2b87 n ASN 21 Cb 0.01 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.12 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 3.90 0.33 3.41 1.43 -1.26 -4.78 118.68 121.71 2b87 s LEU 22 Ca 0.00 1.62 0.07 0.00 -1.03 0.00 0.00 54.13 54.79 2b87 s LEU 22 Cb 0.00 -4.49 -0.01 0.00 0.03 0.00 0.00 46.19 41.72 2b87 s LEU 22 CO 0.00 -0.38 0.44 0.54 0.23 0.00 0.00 176.35 177.18 2b87 s ASN 23 N -2.35 5.88 0.43 2.29 4.22 -1.26 -4.90 114.94 119.24 2b87 s ASN 23 Ca 0.61 -0.23 0.22 0.00 -2.14 0.00 0.00 52.86 51.32 2b87 s ASN 23 Cb -0.09 -1.21 1.21 0.00 1.28 0.00 0.00 41.25 42.44 2b87 s ASN 23 CO 0.17 -0.41 1.78 1.23 -2.04 0.00 0.00 177.10 177.82 2b87 h GLY 24 N 0.95 0.95 0.37 0.45 0.00 -1.99 -0.68 103.07 103.14 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 0.54 -0.11 -0.04 -2.08 0.00 0.00 0.00 176.54 174.85 2b87 h VAL 25 N 0.30 1.52 -0.62 4.60 2.07 -1.97 -0.72 116.25 121.43 2b87 h VAL 25 Ca 0.59 -1.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 2b87 h VAL 25 Cb 1.67 2.57 -0.03 0.00 -1.52 0.00 0.00 31.29 33.97 2b87 h VAL 25 CO -0.24 0.42 0.36 1.56 0.02 0.00 0.00 177.57 179.69 2b87 h GLN 26 N -0.61 0.84 -0.44 1.57 4.20 -1.72 0.64 115.11 119.59 2b87 h GLN 26 Ca -0.00 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 2b87 h GLN 26 Cb 0.70 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 2b87 h GLN 26 CO 0.01 0.62 0.23 0.28 -0.67 0.00 0.00 178.83 179.29 2b87 h VAL 27 N 0.83 1.17 -0.37 -0.54 2.07 -1.23 0.19 116.25 118.38 2b87 h VAL 27 Ca 0.22 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 2b87 h VAL 27 Cb -0.00 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2b87 h VAL 27 CO -0.04 0.18 0.15 0.11 0.02 0.00 0.00 177.57 177.99 2b87 h LYS 28 N 0.57 0.52 -0.18 1.57 1.57 -0.45 0.36 116.57 120.53 2b87 h LYS 28 Ca 0.15 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 2b87 h LYS 28 Cb 0.08 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2b87 h LYS 28 CO -0.02 0.43 -0.32 0.00 -0.57 0.00 0.00 179.45 178.97 2b87 h ALA 29 N 1.65 0.29 -0.71 3.86 0.00 0.12 0.77 119.26 125.23 2b87 h ALA 29 Ca 0.13 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 2b87 h ALA 29 Cb 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2b87 h ALA 29 CO -0.01 0.32 0.18 0.74 0.00 0.00 0.00 179.25 180.48 2b87 h PHE 30 N 0.20 1.19 -0.00 0.00 0.04 -0.24 0.39 116.94 118.51 2b87 h PHE 30 Ca 0.01 -0.14 -0.00 0.00 2.80 0.00 0.00 57.97 60.64 2b87 h PHE 30 Cb 0.91 -0.34 -0.00 0.00 2.20 0.00 0.00 35.95 38.72 2b87 h PHE 30 CO 0.09 0.96 0.00 0.82 -0.60 0.00 0.00 178.31 179.58 2b87 h ILE 31 N 1.08 1.10 -0.74 -0.55 2.04 -0.11 0.33 117.51 120.66 2b87 h ILE 31 Ca 0.23 -0.28 0.07 0.00 1.00 0.00 0.00 64.86 65.87 2b87 h ILE 31 Cb 0.36 1.29 -0.06 0.00 -0.74 0.00 0.00 36.82 37.67 2b87 h ILE 31 CO 0.00 0.07 0.42 -0.78 0.00 0.00 0.00 178.15 177.87 2b87 h ASP 32 N -0.12 0.63 -0.05 1.72 3.58 0.12 0.28 116.42 122.58 2b87 h ASP 32 Ca 0.00 0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.39 2b87 h ASP 32 Cb 0.12 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 2b87 h ASP 32 CO -0.00 0.39 -0.26 -1.28 -2.88 0.00 0.00 179.24 175.22 2b87 h SER 33 N 0.76 0.49 0.25 2.28 0.87 0.01 0.60 113.55 118.81 2b87 h SER 33 Ca 0.34 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 2b87 h SER 33 Cb 0.22 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2b87 h SER 33 CO -0.20 0.74 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.65 2b87 h LEU 34 N 0.43 -0.28 -0.45 2.23 3.38 0.18 0.68 115.31 121.48 2b87 h LEU 34 Ca 0.06 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2b87 h LEU 34 Cb 0.68 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2b87 h LEU 34 CO 0.05 -0.07 0.24 0.03 0.09 0.00 0.00 178.44 178.78 2b87 h ARG 35 N -0.49 0.63 -0.38 1.13 3.08 -0.42 0.37 114.38 118.30 2b87 h ARG 35 Ca -0.03 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 2b87 h ARG 35 Cb 0.36 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 2b87 h ARG 35 CO 0.06 0.50 0.10 0.22 -1.07 0.00 0.00 179.97 179.78 2b87 h ASP 36 N 0.58 0.51 -1.44 7.04 3.58 -0.77 -3.39 116.42 122.52 2b87 h ASP 36 Ca 0.16 -0.07 -0.13 0.00 0.42 0.00 0.00 57.03 57.41 2b87 h ASP 36 Cb 0.06 -0.13 -0.25 0.00 1.72 0.00 0.00 39.33 40.73 2b87 h ASP 36 CO -0.02 0.51 -0.50 -0.62 -2.88 0.00 0.00 179.24 175.73 2b87 s ASP 37 N -6.70 -0.33 0.41 2.28 -1.08 0.24 -5.02 116.67 106.45 2b87 s ASP 37 Ca -0.08 -0.42 0.19 0.00 -0.52 0.00 0.00 52.55 51.72 2b87 s ASP 37 Cb 0.16 1.41 0.86 0.00 -1.46 0.00 0.00 42.92 43.89 2b87 s ASP 37 CO 0.76 -0.30 1.83 -0.65 0.52 0.00 0.00 175.17 177.32 2b87 h PRO 38 N 7.84 0.00 0.00 4.34 0.11 -0.48 -2.47 132.00 141.34 2b87 h PRO 38 Ca -0.03 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2b87 h PRO 38 Cb 1.14 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2b87 h PRO 38 CO 0.20 0.32 -0.05 1.03 -0.21 0.00 0.00 178.00 179.29 2b87 h SER 39 N 0.00 0.00 0.20 -2.05 0.87 -1.93 0.15 113.55 110.79 2b87 h SER 39 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2b87 h SER 39 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2b87 h SER 39 CO 0.04 0.05 -0.07 0.00 -0.53 0.00 0.00 176.83 176.33 2b87 n GLN 40 N -4.44 0.97 -0.32 2.24 3.00 -0.93 -4.18 117.38 113.72 2b87 n GLN 40 Ca -0.03 -0.36 0.20 0.00 -0.01 0.00 0.00 57.00 56.80 2b87 n GLN 40 Cb 0.14 -1.49 0.46 0.00 0.00 0.00 0.00 30.24 29.34 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 0.87 0.54 -0.51 1.08 4.64 -0.72 0.50 113.55 119.93 2b87 h SER 41 Ca 0.00 0.09 -0.12 0.00 -0.47 0.00 0.00 61.79 61.29 2b87 h SER 41 Cb 0.32 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2b87 h SER 41 CO 0.00 0.13 -0.14 0.00 -0.87 0.00 0.00 176.83 175.95 2b87 h ALA 42 N 1.64 0.71 -0.32 5.18 0.00 -1.78 0.49 119.26 125.18 2b87 h ALA 42 Ca 0.59 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 2b87 h ALA 42 Cb 1.31 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2b87 h ALA 42 CO -0.33 0.64 -0.24 -0.91 0.00 0.00 0.00 179.25 178.42 2b87 h ASN 43 N 0.87 0.63 0.15 0.00 2.35 -0.48 0.25 115.58 119.35 2b87 h ASN 43 Ca 0.13 -0.22 -0.19 0.00 -0.55 0.00 0.00 56.30 55.46 2b87 h ASN 43 Cb 0.71 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 2b87 h ASN 43 CO 0.05 0.86 -0.74 -0.07 -1.65 0.00 0.00 177.43 175.88 2b87 h LEU 44 N 0.55 0.61 -0.78 1.61 3.38 -0.27 0.56 115.31 120.97 2b87 h LEU 44 Ca 0.08 -0.40 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 2b87 h LEU 44 Cb 0.70 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2b87 h LEU 44 CO 0.05 1.15 -0.03 0.25 0.09 0.00 0.00 178.44 179.95 2b87 h LEU 45 N 0.35 0.87 -0.26 1.67 5.85 -0.64 0.82 115.31 123.96 2b87 h LEU 45 Ca -0.04 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.40 2b87 h LEU 45 Cb 1.33 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 2b87 h LEU 45 CO 0.13 0.95 0.00 0.00 -0.34 0.00 0.00 178.44 179.19 2b87 h ALA 46 N 1.14 0.36 -0.52 1.25 0.00 0.08 0.74 119.26 122.30 2b87 h ALA 46 Ca 0.15 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2b87 h ALA 46 Cb 0.53 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2b87 h ALA 46 CO 0.03 0.09 0.05 0.93 0.00 0.00 0.00 179.25 180.35 2b87 h GLU 47 N 0.25 0.84 -0.11 0.00 4.39 0.56 0.11 114.58 120.62 2b87 h GLU 47 Ca 0.07 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 2b87 h GLU 47 Cb 0.42 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2b87 h GLU 47 CO 0.01 0.81 -0.02 0.00 -1.16 0.00 0.00 179.01 178.65 2b87 h ALA 48 N 1.26 0.15 -0.14 3.43 0.00 0.92 0.73 119.26 125.61 2b87 h ALA 48 Ca 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2b87 h ALA 48 Cb 0.40 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2b87 h ALA 48 CO 0.01 -0.13 0.07 0.87 0.00 0.00 0.00 179.25 180.07 2b87 h LYS 49 N -0.11 0.19 -0.20 0.00 1.57 -0.63 1.25 116.57 118.64 2b87 h LYS 49 Ca 0.03 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.61 2b87 h LYS 49 Cb 0.41 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.69 2b87 h LYS 49 CO 0.01 0.16 -0.59 -0.22 -0.57 0.00 0.00 179.45 178.23 2b87 h LYS 50 N 0.20 0.75 -0.35 3.15 3.64 -0.32 0.31 116.57 123.95 2b87 h LYS 50 Ca 0.05 -0.54 -0.15 0.00 -1.27 0.00 0.00 60.65 58.74 2b87 h LYS 50 Cb 0.03 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2b87 h LYS 50 CO -0.01 1.16 -0.35 -0.07 -2.27 0.00 0.00 179.45 177.92 2b87 h LEU 51 N 0.48 0.91 -0.28 5.20 -0.00 0.19 0.24 115.31 122.05 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 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 41.61 2b87 h LEU 51 CO 0.13 1.19 0.04 -1.13 -0.00 0.00 0.00 178.44 178.67 2b87 h ASN 52 N 0.65 0.45 -0.77 -0.43 -1.24 0.15 0.39 115.58 114.79 2b87 h ASN 52 Ca 0.06 -0.26 -0.04 0.00 0.71 0.00 0.00 56.30 56.76 2b87 h ASN 52 Cb 0.93 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 39.83 2b87 h ASN 52 CO 0.09 0.60 0.33 0.44 -1.29 0.00 0.00 177.43 177.59 2b87 h ASP 53 N 0.29 1.05 -0.48 1.15 3.32 -0.28 0.83 116.42 122.30 2b87 h ASP 53 Ca 0.09 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 56.90 2b87 h ASP 53 Cb 0.34 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2b87 h ASP 53 CO 0.01 0.92 -0.02 0.00 -1.72 0.00 0.00 179.24 178.43 2b87 h ALA 54 N 1.24 0.97 -0.00 3.45 0.00 -0.16 -2.09 119.26 122.66 2b87 h ALA 54 Ca 0.26 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2b87 h ALA 54 Cb 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2b87 h ALA 54 CO -0.03 0.62 -0.14 1.04 0.00 0.00 0.00 179.25 180.75 2b87 n GLN 55 N -4.19 0.57 -2.53 0.00 6.02 0.13 -4.87 117.38 112.52 2b87 n GLN 55 Ca 0.03 -0.20 -0.40 0.00 -0.01 0.00 0.00 57.00 56.41 2b87 n GLN 55 Cb 0.33 -1.50 -0.05 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 -2.57 3.38 0.41 -1.58 0.00 0.28 -4.92 121.76 116.76 2b87 s ALA 56 Ca 0.26 0.84 -0.22 0.00 0.00 0.00 0.00 51.96 52.84 2b87 s ALA 56 Cb 0.20 -3.30 -0.14 0.00 0.00 0.00 0.00 23.12 19.87 2b87 s ALA 56 CO 0.50 -0.09 0.26 -0.35 0.00 0.00 0.00 175.76 176.08 2b87 n PRO 57 N 1.21 0.20 0.00 0.00 -0.04 -1.26 -4.97 135.00 130.13 2b87 n PRO 57 Ca -0.01 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2b87 n PRO 57 Cb 0.45 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 2b87 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09