#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 0.00 -0.50 -1.34 5.75 -1.26 -4.91 116.55 114.30 2b87 n ASP 2 Ca 0.00 -0.19 0.01 0.00 -0.01 0.00 0.00 54.79 54.60 2b87 n ASP 2 Cb 0.00 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.13 2b87 n ASP 2 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2b87 n ASN 3 N -0.58 1.17 -0.21 -1.12 5.03 -1.26 -4.16 115.26 114.13 2b87 n ASN 3 Ca 0.00 -2.07 -0.02 0.00 0.87 0.00 0.00 54.58 53.36 2b87 n ASN 3 Cb 0.00 -0.38 0.09 0.00 -1.02 0.00 0.00 39.78 38.47 2b87 n ASN 3 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2b87 h LYS 4 N 0.41 0.57 -0.90 3.52 1.63 -1.98 0.42 116.57 120.24 2b87 h LYS 4 Ca 0.00 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 2b87 h LYS 4 Cb 0.49 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.95 2b87 h LYS 4 CO 0.04 0.37 0.53 0.27 -3.45 0.00 0.00 179.45 177.21 2b87 h PHE 5 N 0.58 1.19 -0.37 1.91 -0.00 -1.96 0.45 116.94 118.74 2b87 h PHE 5 Ca 0.28 -0.01 -0.05 0.00 -0.00 0.00 0.00 57.97 58.19 2b87 h PHE 5 Cb 0.22 -0.39 -0.01 0.00 -0.00 0.00 0.00 35.95 35.76 2b87 h PHE 5 CO -0.10 0.80 0.03 -0.97 -0.00 0.00 0.00 178.31 178.07 2b87 h ASN 6 N 1.24 0.62 -0.64 -0.68 -1.24 -1.43 1.72 115.58 115.17 2b87 h ASN 6 Ca 0.32 -0.29 0.00 0.00 0.71 0.00 0.00 56.30 57.05 2b87 h ASN 6 Cb -0.04 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 38.82 2b87 h ASN 6 CO -0.06 0.75 0.40 0.50 -1.29 0.00 0.00 177.43 177.73 2b87 h LYS 7 N 0.47 0.85 -0.13 6.67 3.64 0.39 0.16 116.57 128.63 2b87 h LYS 7 Ca 0.11 -0.07 -0.19 0.00 -1.27 0.00 0.00 60.65 59.23 2b87 h LYS 7 Cb 0.41 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2b87 h LYS 7 CO 0.01 0.59 -0.71 0.93 -2.27 0.00 0.00 179.45 178.00 2b87 h GLU 8 N 0.87 0.57 -0.82 1.90 5.08 0.20 0.11 114.58 122.49 2b87 h GLU 8 Ca 0.23 -0.44 0.02 0.00 -1.00 0.00 0.00 59.36 58.17 2b87 h GLU 8 Cb -0.06 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 2b87 h GLU 8 CO -0.05 1.07 0.54 1.25 -1.00 0.00 0.00 179.01 180.82 2b87 h LEU 9 N 0.40 0.92 -0.19 1.33 5.85 0.32 1.21 115.31 125.14 2b87 h LEU 9 Ca -0.03 -0.02 -0.20 0.00 0.84 0.00 0.00 57.88 58.47 2b87 h LEU 9 Cb 1.30 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 42.12 2b87 h LEU 9 CO 0.13 0.65 -0.66 1.23 -0.34 0.00 0.00 178.44 179.45 2b87 h GLY 10 N 1.08 0.86 0.54 3.75 0.00 -0.60 -2.69 103.07 106.02 2b87 h GLY 10 Ca 0.31 -1.15 -0.01 0.00 0.00 0.00 0.00 47.33 46.48 2b87 h GLY 10 CO -0.08 1.02 -0.03 -0.25 0.00 0.00 0.00 176.54 177.21 2b87 h TRP 11 N 0.52 0.07 -0.88 5.60 -0.00 0.21 -1.21 115.95 120.26 2b87 h TRP 11 Ca -0.03 -0.02 0.07 0.00 -0.00 0.00 0.00 58.89 58.91 2b87 h TRP 11 Cb 1.29 -0.02 -0.06 0.00 -0.00 0.00 0.00 29.16 30.37 2b87 h TRP 11 CO 0.09 0.54 0.57 0.00 -0.00 0.00 0.00 178.44 179.64 2b87 h ALA 12 N 0.52 1.57 -0.40 2.65 0.00 0.13 0.51 119.26 124.25 2b87 h ALA 12 Ca 0.00 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2b87 h ALA 12 Cb 0.53 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2b87 h ALA 12 CO 0.01 0.29 0.13 1.15 0.00 0.00 0.00 179.25 180.83 2b87 h THR 13 N 0.96 0.87 -0.28 0.00 2.02 -1.33 0.15 112.91 115.31 2b87 h THR 13 Ca 0.39 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.43 2b87 h THR 13 Cb 0.26 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2b87 h THR 13 CO -0.15 0.05 0.02 -0.25 0.37 0.00 0.00 175.52 175.56 2b87 h TRP 14 N 0.28 0.51 -0.81 3.16 2.91 0.41 0.26 115.95 122.67 2b87 h TRP 14 Ca 0.18 -0.08 0.00 0.00 1.13 0.00 0.00 58.89 60.12 2b87 h TRP 14 Cb 0.18 -0.14 -0.04 0.00 -0.51 0.00 0.00 29.16 28.65 2b87 h TRP 14 CO -0.16 0.60 0.51 0.93 -1.03 0.00 0.00 178.44 179.29 2b87 h GLU 15 N 0.28 1.09 -0.22 2.65 5.08 0.32 1.03 114.58 124.80 2b87 h GLU 15 Ca 0.08 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 2b87 h GLU 15 Cb 0.38 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2b87 h GLU 15 CO 0.01 0.75 -0.50 0.82 -1.00 0.00 0.00 179.01 179.09 2b87 h ILE 16 N 1.11 1.31 -0.56 3.13 2.04 -0.53 -1.95 117.51 122.07 2b87 h ILE 16 Ca 0.29 -1.71 -0.06 0.00 1.00 0.00 0.00 64.86 64.38 2b87 h ILE 16 Cb -0.08 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2b87 h ILE 16 CO -0.06 0.54 0.09 0.15 0.00 0.00 0.00 178.15 178.87 2b87 h PHE 17 N 0.48 0.94 -0.29 1.37 3.57 0.15 -2.77 116.94 120.39 2b87 h PHE 17 Ca 0.02 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.41 2b87 h PHE 17 Cb 1.04 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.51 2b87 h PHE 17 CO 0.05 0.81 0.00 0.09 -2.23 0.00 0.00 178.31 177.02 2b87 n ASN 18 N -4.24 2.21 -4.74 0.41 5.03 0.34 -4.93 115.26 109.34 2b87 n ASN 18 Ca 0.04 -1.85 -0.41 0.00 0.87 0.00 0.00 54.58 53.22 2b87 n ASN 18 Cb 0.27 -0.19 -0.03 0.00 -1.02 0.00 0.00 39.78 38.81 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 -0.75 -4.91 118.68 120.87 2b87 s LEU 19 Ca 0.33 2.46 0.00 0.00 -1.03 0.00 0.00 54.13 55.89 2b87 s LEU 19 Cb 0.18 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.79 2b87 s LEU 19 CO 0.25 -0.59 0.80 -2.65 0.23 0.00 0.00 176.35 174.40 2b87 n PRO 20 N 2.71 0.89 0.00 1.29 -0.02 -1.26 -3.99 135.00 134.62 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 0.42 -1.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.81 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 -0.39 0.00 -4.82 2.55 3.02 -1.26 -4.99 115.26 109.37 2b87 n ASN 21 Ca 0.00 -0.61 -0.33 0.00 -0.03 0.00 0.00 54.58 53.60 2b87 n ASN 21 Cb 0.04 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.15 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 4.00 0.39 3.41 1.43 -1.26 -4.76 118.68 121.89 2b87 s LEU 22 Ca 0.00 1.67 0.03 0.00 -1.03 0.00 0.00 54.13 54.80 2b87 s LEU 22 Cb 0.00 -4.43 -0.01 0.00 0.03 0.00 0.00 46.19 41.78 2b87 s LEU 22 CO 0.00 -0.31 0.57 0.54 0.23 0.00 0.00 176.35 177.38 2b87 s ASN 23 N -2.11 5.95 0.45 2.29 4.22 -1.26 -4.88 114.94 119.60 2b87 s ASN 23 Ca 0.60 0.11 0.26 0.00 -2.14 0.00 0.00 52.86 51.68 2b87 s ASN 23 Cb -0.10 -1.48 1.29 0.00 1.28 0.00 0.00 41.25 42.23 2b87 s ASN 23 CO 0.15 -0.53 1.77 1.23 -2.04 0.00 0.00 177.10 177.67 2b87 h GLY 24 N 0.65 0.82 0.37 0.45 0.00 -1.99 -1.01 103.07 102.37 2b87 h GLY 24 Ca -0.47 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 2b87 h GLY 24 CO 0.56 -0.12 -0.09 -2.08 0.00 0.00 0.00 176.54 174.82 2b87 h VAL 25 N 0.23 1.55 -0.54 4.60 2.07 -1.97 -1.41 116.25 120.78 2b87 h VAL 25 Ca 0.61 -1.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.39 2b87 h VAL 25 Cb 1.87 2.67 -0.03 0.00 -1.52 0.00 0.00 31.29 34.29 2b87 h VAL 25 CO -0.21 0.46 0.32 1.56 0.02 0.00 0.00 177.57 179.72 2b87 h GLN 26 N -0.60 0.74 -0.52 1.57 4.20 -1.67 0.72 115.11 119.55 2b87 h GLN 26 Ca -0.01 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 2b87 h GLN 26 Cb 0.80 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 2b87 h GLN 26 CO 0.02 0.54 0.26 0.28 -0.67 0.00 0.00 178.83 179.26 2b87 h VAL 27 N 0.73 1.19 -0.52 -0.54 2.07 -1.32 0.34 116.25 118.19 2b87 h VAL 27 Ca 0.19 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 2b87 h VAL 27 Cb -0.01 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 2b87 h VAL 27 CO -0.04 0.21 0.24 0.50 0.02 0.00 0.00 177.57 178.50 2b87 h LYS 28 N 0.69 0.73 -0.20 1.57 3.64 -0.62 0.17 116.57 122.55 2b87 h LYS 28 Ca 0.18 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.35 2b87 h LYS 28 Cb 0.09 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2b87 h LYS 28 CO -0.03 0.58 -0.32 0.00 -2.27 0.00 0.00 179.45 177.41 2b87 h ALA 29 N 1.53 0.31 -0.60 5.00 0.00 0.14 0.37 119.26 126.01 2b87 h ALA 29 Ca 0.18 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2b87 h ALA 29 Cb 0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2b87 h ALA 29 CO -0.02 0.35 0.20 0.74 0.00 0.00 0.00 179.25 180.51 2b87 h PHE 30 N 0.25 0.91 -0.05 0.00 0.04 0.04 0.51 116.94 118.64 2b87 h PHE 30 Ca 0.02 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 60.71 2b87 h PHE 30 Cb 0.91 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.78 2b87 h PHE 30 CO 0.09 0.73 0.02 0.82 -0.60 0.00 0.00 178.31 179.37 2b87 h ILE 31 N 0.87 1.16 -0.81 -0.55 2.04 -0.44 0.28 117.51 120.07 2b87 h ILE 31 Ca 0.20 -0.48 0.08 0.00 1.00 0.00 0.00 64.86 65.66 2b87 h ILE 31 Cb 0.24 1.39 -0.07 0.00 -0.74 0.00 0.00 36.82 37.64 2b87 h ILE 31 CO -0.01 0.13 0.47 0.44 0.00 0.00 0.00 178.15 179.18 2b87 h ASP 32 N -0.10 0.70 -0.25 1.72 3.32 0.71 0.26 116.42 122.78 2b87 h ASP 32 Ca 0.02 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.01 2b87 h ASP 32 Cb 0.20 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2b87 h ASP 32 CO -0.00 0.42 -0.16 0.28 -1.72 0.00 0.00 179.24 178.06 2b87 h SER 33 N 0.82 0.68 0.27 6.45 0.02 0.24 0.51 113.55 122.55 2b87 h SER 33 Ca 0.37 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2b87 h SER 33 Cb 0.28 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.64 2b87 h SER 33 CO -0.21 0.85 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.12 2b87 h LEU 34 N 0.61 -0.31 -0.45 5.07 3.38 0.17 0.82 115.31 124.60 2b87 h LEU 34 Ca 0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2b87 h LEU 34 Cb 0.62 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2b87 h LEU 34 CO 0.04 -0.12 0.23 0.03 0.09 0.00 0.00 178.44 178.72 2b87 h ARG 35 N -0.49 0.65 -0.36 1.13 3.08 -0.49 0.34 114.38 118.24 2b87 h ARG 35 Ca -0.04 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 2b87 h ARG 35 Cb 0.36 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2b87 h ARG 35 CO 0.06 0.53 0.06 0.22 -1.07 0.00 0.00 179.97 179.77 2b87 h ASP 36 N 0.59 0.50 -1.77 7.04 3.58 -0.77 -3.38 116.42 122.21 2b87 h ASP 36 Ca 0.16 -0.08 -0.27 0.00 0.42 0.00 0.00 57.03 57.26 2b87 h ASP 36 Cb 0.09 -0.13 -0.29 0.00 1.72 0.00 0.00 39.33 40.72 2b87 h ASP 36 CO -0.02 0.53 -0.61 -0.62 -2.88 0.00 0.00 179.24 175.64 2b87 s ASP 37 N -6.72 0.62 0.28 2.28 -1.08 0.28 -5.02 116.67 107.32 2b87 s ASP 37 Ca -0.08 -1.06 0.09 0.00 -0.52 0.00 0.00 52.55 50.98 2b87 s ASP 37 Cb 0.16 0.90 0.40 0.00 -1.46 0.00 0.00 42.92 42.92 2b87 s ASP 37 CO 0.76 -0.29 1.64 -0.65 0.52 0.00 0.00 175.17 177.16 2b87 h PRO 38 N 7.47 0.09 -0.04 4.34 0.11 -0.54 -2.63 132.00 140.80 2b87 h PRO 38 Ca -0.00 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.02 2b87 h PRO 38 Cb 1.09 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2b87 h PRO 38 CO 0.22 0.62 -0.12 0.77 -0.21 0.00 0.00 178.00 179.27 2b87 h SER 39 N 0.07 0.06 0.15 -2.05 0.02 -1.90 0.55 113.55 110.45 2b87 h SER 39 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2b87 h SER 39 Cb 0.99 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2b87 h SER 39 CO 0.08 0.19 -0.04 1.67 -1.14 0.00 0.00 176.83 177.59 2b87 n GLN 40 N -4.36 1.02 -0.32 3.45 7.27 -1.00 -4.23 117.38 119.21 2b87 n GLN 40 Ca -0.02 -0.32 0.19 0.00 0.07 0.00 0.00 57.00 56.92 2b87 n GLN 40 Cb 0.21 -1.49 0.44 0.00 2.41 0.00 0.00 30.24 31.81 2b87 n GLN 40 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2b87 h SER 41 N 0.79 0.57 -0.46 1.69 4.64 -0.76 0.40 113.55 120.41 2b87 h SER 41 Ca 0.00 0.09 -0.09 0.00 -0.47 0.00 0.00 61.79 61.32 2b87 h SER 41 Cb 0.27 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 2b87 h SER 41 CO 0.00 0.14 -0.04 0.00 -0.87 0.00 0.00 176.83 176.07 2b87 h ALA 42 N 1.65 0.96 -0.24 5.18 0.00 -1.79 0.90 119.26 125.92 2b87 h ALA 42 Ca 0.59 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 55.07 2b87 h ALA 42 Cb 1.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2b87 h ALA 42 CO -0.34 0.62 -0.36 -0.91 0.00 0.00 0.00 179.25 178.27 2b87 h ASN 43 N 0.82 0.56 -0.02 0.00 2.35 -0.60 0.21 115.58 118.90 2b87 h ASN 43 Ca 0.15 -0.23 -0.21 0.00 -0.55 0.00 0.00 56.30 55.46 2b87 h ASN 43 Cb 0.54 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2b87 h ASN 43 CO 0.03 0.87 -0.75 -0.07 -1.65 0.00 0.00 177.43 175.86 2b87 h LEU 44 N 0.45 0.79 -0.98 1.61 3.38 -0.62 0.49 115.31 120.44 2b87 h LEU 44 Ca 0.05 -0.51 -0.05 0.00 0.09 0.00 0.00 57.88 57.46 2b87 h LEU 44 Cb 0.83 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 2b87 h LEU 44 CO 0.07 1.29 0.21 0.25 0.09 0.00 0.00 178.44 180.34 2b87 h LEU 45 N 0.46 0.88 -0.27 1.67 5.85 -0.62 0.66 115.31 123.94 2b87 h LEU 45 Ca -0.04 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 2b87 h LEU 45 Cb 1.36 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 2b87 h LEU 45 CO 0.15 0.82 0.04 0.00 -0.34 0.00 0.00 178.44 179.10 2b87 h ALA 46 N 1.30 0.36 -0.63 1.25 0.00 0.07 0.32 119.26 121.93 2b87 h ALA 46 Ca 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2b87 h ALA 46 Cb 0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2b87 h ALA 46 CO -0.01 0.05 0.28 0.93 0.00 0.00 0.00 179.25 180.50 2b87 h GLU 47 N 0.26 0.90 -0.13 0.00 4.39 0.70 0.24 114.58 120.94 2b87 h GLU 47 Ca 0.08 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2b87 h GLU 47 Cb 0.34 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2b87 h GLU 47 CO 0.01 0.72 -0.06 0.00 -1.16 0.00 0.00 179.01 178.52 2b87 h ALA 48 N 1.41 0.19 -0.15 3.43 0.00 0.76 0.76 119.26 125.67 2b87 h ALA 48 Ca 0.22 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2b87 h ALA 48 Cb 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2b87 h ALA 48 CO -0.02 -0.03 0.10 0.87 0.00 0.00 0.00 179.25 180.16 2b87 h LYS 49 N -0.06 0.16 -0.05 0.00 1.79 0.14 1.37 116.57 119.91 2b87 h LYS 49 Ca 0.03 -0.01 -0.21 0.00 -2.18 0.00 0.00 60.65 58.28 2b87 h LYS 49 Cb 0.51 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.14 2b87 h LYS 49 CO 0.02 0.11 -0.79 0.87 -1.08 0.00 0.00 179.45 178.57 2b87 h LYS 50 N 0.17 0.63 -0.26 3.15 1.57 0.06 0.16 116.57 122.05 2b87 h LYS 50 Ca 0.06 -0.61 -0.11 0.00 -1.87 0.00 0.00 60.65 58.12 2b87 h LYS 50 Cb 0.03 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2b87 h LYS 50 CO -0.01 1.22 -0.28 -0.07 -0.57 0.00 0.00 179.45 179.74 2b87 h LEU 51 N 0.27 0.70 -0.36 2.94 -0.00 0.19 0.29 115.31 119.33 2b87 h LEU 51 Ca -0.08 -0.48 -0.02 0.00 -0.00 0.00 0.00 57.88 57.30 2b87 h LEU 51 Cb 1.45 -0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 41.90 2b87 h LEU 51 CO 0.16 1.03 0.15 -1.13 -0.00 0.00 0.00 178.44 178.65 2b87 h ASN 52 N 0.37 0.50 -0.67 -0.43 -1.24 0.17 0.36 115.58 114.63 2b87 h ASN 52 Ca 0.04 -0.16 -0.03 0.00 0.71 0.00 0.00 56.30 56.86 2b87 h ASN 52 Cb 0.85 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 39.74 2b87 h ASN 52 CO 0.07 0.52 0.32 -0.78 -1.29 0.00 0.00 177.43 176.27 2b87 h ASP 53 N 0.44 0.89 -0.67 1.15 3.58 -0.57 1.08 116.42 122.32 2b87 h ASP 53 Ca 0.12 -0.13 -0.04 0.00 0.42 0.00 0.00 57.03 57.40 2b87 h ASP 53 Cb 0.18 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.97 2b87 h ASP 53 CO -0.01 0.77 0.28 0.00 -2.88 0.00 0.00 179.24 177.41 2b87 h ALA 54 N 1.15 1.20 -0.01 -0.78 0.00 0.02 -1.07 119.26 119.77 2b87 h ALA 54 Ca 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2b87 h ALA 54 Cb 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2b87 h ALA 54 CO -0.03 0.59 -0.10 1.04 0.00 0.00 0.00 179.25 180.75 2b87 n GLN 55 N -4.30 1.06 -2.60 0.00 6.02 0.12 -4.89 117.38 112.80 2b87 n GLN 55 Ca 0.06 -0.50 -0.38 0.00 -0.01 0.00 0.00 57.00 56.16 2b87 n GLN 55 Cb 0.17 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.89 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 -2.28 3.26 -0.43 -1.58 0.00 0.36 -4.90 121.76 116.19 2b87 s ALA 56 Ca 0.33 0.72 -0.44 0.00 0.00 0.00 0.00 51.96 52.57 2b87 s ALA 56 Cb 0.20 -3.26 -0.18 0.00 0.00 0.00 0.00 23.12 19.88 2b87 s ALA 56 CO 0.43 -0.05 1.76 -0.35 0.00 0.00 0.00 175.76 177.55 2b87 n PRO 57 N 0.72 0.41 0.00 0.00 -0.04 -1.26 -4.97 135.00 129.86 2b87 n PRO 57 Ca 0.01 0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2b87 n PRO 57 Cb 0.48 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 2b87 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09