#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 4.12 0.49 4.52 1.01 -1.26 -4.92 116.67 120.64 2b88 s ASP 2 Ca 0.00 1.17 0.25 0.00 0.71 0.00 0.00 52.55 54.68 2b88 s ASP 2 Cb 0.00 -1.85 1.32 0.00 1.01 0.00 0.00 42.92 43.40 2b88 s ASP 2 CO 0.00 -2.19 1.91 -0.55 0.21 0.00 0.00 175.17 174.55 2b88 h ASN 3 N -1.24 0.14 -3.32 0.27 -1.07 -2.06 -3.38 115.58 104.93 2b88 h ASN 3 Ca -0.48 0.01 -0.60 0.00 0.07 0.00 0.00 56.30 55.30 2b88 h ASN 3 Cb 1.29 -0.01 -0.11 0.00 -2.07 0.00 0.00 38.32 37.42 2b88 h ASN 3 CO 0.60 0.06 -0.41 -0.75 0.07 0.00 0.00 177.43 177.01 2b88 s LYS 4 N -5.15 4.21 0.00 4.14 2.47 -1.26 -5.01 119.74 119.15 2b88 s LYS 4 Ca -0.06 -0.07 -0.25 0.00 -1.56 0.00 0.00 55.97 54.03 2b88 s LYS 4 Cb 0.21 -3.44 -0.16 0.00 -1.46 0.00 0.00 37.83 32.98 2b88 s LYS 4 CO 0.76 0.24 1.19 0.35 0.16 0.00 0.00 175.35 178.05 2b88 h PHE 5 N 6.78 -0.44 -0.64 4.03 3.57 -1.99 -3.17 116.94 125.07 2b88 h PHE 5 Ca -0.41 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.27 2b88 h PHE 5 Cb 1.16 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 40.02 2b88 h PHE 5 CO 0.60 -0.11 0.50 -0.97 -2.23 0.00 0.00 178.31 176.10 2b88 h ASN 6 N -0.83 0.00 -0.88 0.41 -0.73 -1.95 0.48 115.58 112.09 2b88 h ASN 6 Ca -0.05 0.00 0.10 0.00 1.87 0.00 0.00 56.30 58.23 2b88 h ASN 6 Cb 0.53 0.00 -0.06 0.00 0.27 0.00 0.00 38.32 39.05 2b88 h ASN 6 CO 0.08 0.00 0.57 0.50 -0.37 0.00 0.00 177.43 178.21 2b88 h LYS 7 N 0.00 0.81 -0.12 6.67 3.64 -1.94 0.23 116.57 125.86 2b88 h LYS 7 Ca 0.31 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.54 2b88 h LYS 7 Cb 1.30 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2b88 h LYS 7 CO -0.00 0.54 -0.34 0.93 -2.27 0.00 0.00 179.45 178.30 2b88 h GLU 8 N 0.84 0.24 -0.37 1.90 3.07 -1.03 0.37 114.58 119.59 2b88 h GLU 8 Ca 0.41 -0.10 -0.12 0.00 -0.50 0.00 0.00 59.36 59.05 2b88 h GLU 8 Cb 0.46 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2b88 h GLU 8 CO -0.18 0.56 -0.26 -0.07 -1.40 0.00 0.00 179.01 177.66 2b88 h LEU 9 N 0.21 0.79 -0.41 1.33 4.07 -0.58 0.17 115.31 120.88 2b88 h LEU 9 Ca 0.03 -0.30 -0.17 0.00 0.08 0.00 0.00 57.88 57.51 2b88 h LEU 9 Cb 0.71 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.21 2b88 h LEU 9 CO 0.05 1.01 -0.80 1.23 -1.08 0.00 0.00 178.44 178.86 2b88 h GLY 10 N 0.96 0.08 0.86 0.83 0.00 -0.97 -2.26 103.07 102.56 2b88 h GLY 10 Ca 0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 2b88 h GLY 10 CO 0.06 0.12 -0.10 -0.25 0.00 0.00 0.00 176.54 176.38 2b88 h TRP 11 N 0.04 -0.25 -0.04 5.60 7.01 -0.40 -2.70 115.95 125.21 2b88 h TRP 11 Ca -0.02 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 60.88 2b88 h TRP 11 Cb 1.40 0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 28.53 2b88 h TRP 11 CO 0.01 -0.04 -0.40 0.00 -2.79 0.00 0.00 178.44 175.22 2b88 h ALA 12 N 0.35 1.26 -0.18 2.65 0.00 -0.70 -1.60 119.26 121.04 2b88 h ALA 12 Ca -0.03 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2b88 h ALA 12 Cb 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2b88 h ALA 12 CO 0.05 0.53 0.11 1.15 0.00 0.00 0.00 179.25 181.09 2b88 h THR 13 N 0.07 1.02 -0.23 0.00 2.02 -1.25 0.11 112.91 114.66 2b88 h THR 13 Ca 0.01 -0.08 -0.15 0.00 0.77 0.00 0.00 66.41 66.95 2b88 h THR 13 Cb 0.74 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 2b88 h THR 13 CO 0.06 0.04 -0.49 4.11 0.37 0.00 0.00 175.52 179.61 2b88 h TRP 14 N 0.23 0.77 -0.23 3.16 5.08 -1.38 0.39 115.95 123.96 2b88 h TRP 14 Ca 0.07 -0.25 0.02 0.00 1.08 0.00 0.00 58.89 59.81 2b88 h TRP 14 Cb -0.01 -0.15 -0.02 0.00 -3.00 0.00 0.00 29.16 25.97 2b88 h TRP 14 CO -0.08 0.99 0.08 0.93 -1.28 0.00 0.00 178.44 179.09 2b88 h GLU 15 N 0.50 0.18 -0.21 0.12 4.39 -0.75 0.32 114.58 119.13 2b88 h GLU 15 Ca 0.02 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 2b88 h GLU 15 Cb 1.03 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 2b88 h GLU 15 CO 0.10 0.12 -0.05 0.82 -1.16 0.00 0.00 179.01 178.84 2b88 h ILE 16 N 0.19 1.29 0.00 3.13 2.04 -0.78 -2.43 117.51 120.95 2b88 h ILE 16 Ca 0.10 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.92 2b88 h ILE 16 Cb 0.07 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2b88 h ILE 16 CO -0.10 0.32 0.00 -0.26 0.00 0.00 0.00 178.15 178.11 2b88 h PHE 17 N 0.14 0.00 -0.77 1.37 0.04 -0.53 -2.48 116.94 114.72 2b88 h PHE 17 Ca 0.05 0.00 -0.50 0.00 2.80 0.00 0.00 57.97 60.32 2b88 h PHE 17 Cb 0.51 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 38.44 2b88 h PHE 17 CO 0.05 0.00 0.65 0.09 -0.60 0.00 0.00 178.31 178.50 2b88 n ASN 18 N -3.05 7.08 -4.80 2.17 4.13 0.11 -4.92 115.26 115.98 2b88 n ASN 18 Ca -0.02 -3.42 -0.34 0.00 1.68 0.00 0.00 54.58 52.47 2b88 n ASN 18 Cb 0.10 -1.03 -0.07 0.00 -1.54 0.00 0.00 39.78 37.25 2b88 n ASN 18 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2b88 s LEU 19 N -2.82 4.01 0.28 3.41 1.43 -0.94 -5.01 118.68 119.04 2b88 s LEU 19 Ca 0.48 0.25 0.23 0.00 -1.03 0.00 0.00 54.13 54.06 2b88 s LEU 19 Cb 0.38 -2.16 1.04 0.00 0.03 0.00 0.00 46.19 45.47 2b88 s LEU 19 CO -0.02 0.33 1.69 -0.81 0.23 0.00 0.00 176.35 177.76 2b88 n PRO 20 N 1.56 0.17 -0.11 1.29 -0.05 -1.26 -3.85 135.00 132.75 2b88 n PRO 20 Ca -0.16 0.50 0.00 0.00 -0.05 0.00 0.00 63.50 63.79 2b88 n PRO 20 Cb 0.53 -1.90 0.00 0.00 -0.05 0.00 0.00 33.50 32.09 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 -2.24 0.04 -4.80 3.54 3.02 -1.26 -5.00 115.26 108.56 2b88 n ASN 21 Ca 0.01 -1.24 -0.31 0.00 -0.03 0.00 0.00 54.58 53.01 2b88 n ASN 21 Cb 0.16 -0.04 0.06 0.00 -0.61 0.00 0.00 39.78 39.35 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 -0.03 3.13 0.13 3.41 1.43 -1.25 -4.73 118.68 120.78 2b88 s LEU 22 Ca 0.00 1.73 0.09 0.00 -1.03 0.00 0.00 54.13 54.91 2b88 s LEU 22 Cb 0.00 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.67 2b88 s LEU 22 CO 0.00 -1.66 -0.14 0.20 0.23 0.00 0.00 176.35 174.99 2b88 s ASN 23 N -3.51 4.11 0.59 2.29 0.01 -1.26 -4.97 114.94 112.20 2b88 s ASN 23 Ca 0.60 -0.53 0.29 0.00 -0.71 0.00 0.00 52.86 52.51 2b88 s ASN 23 Cb -0.16 -0.66 1.45 0.00 0.41 0.00 0.00 41.25 42.29 2b88 s ASN 23 CO 0.53 0.15 1.86 1.23 -1.51 0.00 0.00 177.10 179.37 2b88 h GLY 24 N 3.44 0.00 0.50 0.66 0.00 -1.98 0.17 103.07 105.86 2b88 h GLY 24 Ca -0.49 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 2b88 h GLY 24 CO 0.50 0.00 -0.10 -2.08 0.00 0.00 0.00 176.54 174.86 2b88 h VAL 25 N 0.00 1.46 -0.25 4.60 2.07 -1.98 -2.25 116.25 119.90 2b88 h VAL 25 Ca 0.22 -1.49 -0.09 0.00 0.82 0.00 0.00 66.70 66.16 2b88 h VAL 25 Cb 1.27 2.37 -0.01 0.00 -1.52 0.00 0.00 31.29 33.40 2b88 h VAL 25 CO -0.00 0.41 -0.17 1.56 0.02 0.00 0.00 177.57 179.38 2b88 h GLN 26 N -0.43 0.57 0.13 1.57 4.20 -1.18 -1.52 115.11 118.46 2b88 h GLN 26 Ca -0.00 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.43 2b88 h GLN 26 Cb 0.71 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 2b88 h GLN 26 CO 0.02 0.85 -0.08 0.28 -0.67 0.00 0.00 178.83 179.22 2b88 h VAL 27 N 0.28 0.82 -0.71 -0.54 2.07 -0.96 -0.72 116.25 116.50 2b88 h VAL 27 Ca 0.05 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.70 2b88 h VAL 27 Cb 0.70 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 2b88 h VAL 27 CO 0.05 0.00 0.48 0.11 0.02 0.00 0.00 177.57 178.22 2b88 h LYS 28 N -0.21 0.41 -0.54 1.57 1.57 -1.41 1.41 116.57 119.37 2b88 h LYS 28 Ca -0.01 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2b88 h LYS 28 Cb 0.18 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2b88 h LYS 28 CO 0.01 0.27 0.23 0.00 -0.57 0.00 0.00 179.45 179.39 2b88 h ALA 29 N 1.66 0.70 -0.11 3.86 0.00 -0.14 1.59 119.26 126.82 2b88 h ALA 29 Ca 0.34 -0.15 -0.21 0.00 0.00 0.00 0.00 54.91 54.90 2b88 h ALA 29 Cb 0.76 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2b88 h ALA 29 CO -0.11 0.30 -0.77 0.74 0.00 0.00 0.00 179.25 179.42 2b88 h PHE 30 N 0.73 0.80 -0.35 0.00 0.04 0.10 1.00 116.94 119.27 2b88 h PHE 30 Ca 0.18 -0.36 -0.04 0.00 2.80 0.00 0.00 57.97 60.55 2b88 h PHE 30 Cb 0.18 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 2b88 h PHE 30 CO 0.00 1.15 0.03 0.82 -0.60 0.00 0.00 178.31 179.72 2b88 h ILE 31 N 0.40 1.19 -0.39 -0.55 1.08 0.22 -0.49 117.51 118.96 2b88 h ILE 31 Ca -0.04 -0.72 -0.16 0.00 -0.39 0.00 0.00 64.86 63.55 2b88 h ILE 31 Cb 1.37 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 36.01 2b88 h ILE 31 CO 0.14 0.25 -0.37 -0.78 -0.69 0.00 0.00 178.15 176.70 2b88 h ASP 32 N 0.51 1.00 -0.14 1.72 3.58 0.27 -2.76 116.42 120.59 2b88 h ASP 32 Ca 0.11 -0.45 -0.02 0.00 0.42 0.00 0.00 57.03 57.09 2b88 h ASP 32 Cb 0.28 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2b88 h ASP 32 CO 0.01 1.25 0.04 0.28 -2.88 0.00 0.00 179.24 177.94 2b88 h SER 33 N 0.77 0.27 -0.50 2.28 0.02 0.16 -1.42 113.55 115.14 2b88 h SER 33 Ca 0.07 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 2b88 h SER 33 Cb 0.96 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.40 2b88 h SER 33 CO 0.09 0.29 0.28 -0.07 -1.14 0.00 0.00 176.83 176.28 2b88 h LEU 34 N 0.30 0.42 -0.70 5.07 -0.00 -0.83 0.34 115.31 119.92 2b88 h LEU 34 Ca 0.07 0.02 -0.10 0.00 -0.00 0.00 0.00 57.88 57.87 2b88 h LEU 34 Cb 0.14 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 40.71 2b88 h LEU 34 CO -0.00 0.30 -0.09 0.03 -0.00 0.00 0.00 178.44 178.67 2b88 h ARG 35 N 0.55 0.91 -0.22 1.13 2.47 -1.31 0.11 114.38 118.02 2b88 h ARG 35 Ca 0.21 -0.31 -0.06 0.00 -1.26 0.00 0.00 59.98 58.56 2b88 h ARG 35 Cb 0.08 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.31 2b88 h ARG 35 CO -0.12 0.96 -0.12 -0.44 0.56 0.00 0.00 179.97 180.80 2b88 h ASP 36 N 0.82 0.34 -0.88 7.04 3.32 -0.39 -3.40 116.42 123.26 2b88 h ASP 36 Ca 0.14 -0.08 0.08 0.00 0.02 0.00 0.00 57.03 57.18 2b88 h ASP 36 Cb 0.61 -0.09 -0.21 0.00 0.22 0.00 0.00 39.33 39.87 2b88 h ASP 36 CO 0.04 0.50 -0.29 -0.62 -1.72 0.00 0.00 179.24 177.15 2b88 s ASP 37 N -6.83 -1.38 0.50 6.45 -1.08 0.11 -5.04 116.67 109.40 2b88 s ASP 37 Ca -0.06 0.33 0.29 0.00 -0.52 0.00 0.00 52.55 52.58 2b88 s ASP 37 Cb 0.15 1.94 1.10 0.00 -1.46 0.00 0.00 42.92 44.66 2b88 s ASP 37 CO 0.75 -0.25 1.89 -0.65 0.52 0.00 0.00 175.17 177.43 2b88 h PRO 38 N 7.91 0.00 0.00 4.34 0.11 -1.00 -2.77 132.00 140.59 2b88 h PRO 38 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2b88 h PRO 38 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2b88 h PRO 38 CO 0.13 0.10 0.00 0.43 -0.21 0.00 0.00 178.00 178.45 2b88 n SER 39 N -3.22 0.00 -0.69 -2.05 7.64 -1.26 -3.21 113.62 110.83 2b88 n SER 39 Ca 0.01 0.13 0.12 0.00 1.01 0.00 0.00 58.87 60.14 2b88 n SER 39 Cb 0.38 -0.37 0.21 0.00 -1.01 0.00 0.00 64.21 63.42 2b88 n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b88 n GLN 40 N -1.37 1.82 -0.31 1.43 1.13 -1.04 -4.60 117.38 114.43 2b88 n GLN 40 Ca 0.11 -1.38 0.23 0.00 -1.94 0.00 0.00 57.00 54.02 2b88 n GLN 40 Cb 0.26 -1.47 0.44 0.00 0.11 0.00 0.00 30.24 29.58 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 0.62 0.14 -0.02 1.08 3.41 -1.20 0.23 113.62 117.88 2b88 n SER 41 Ca 0.14 1.59 -0.04 0.00 -0.26 0.00 0.00 58.87 60.30 2b88 n SER 41 Cb 0.49 -0.69 0.18 0.00 -0.26 0.00 0.00 64.21 63.94 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 1.89 1.08 -0.27 7.33 0.00 -1.89 0.25 119.26 127.65 2b88 h ALA 42 Ca 0.70 -0.32 -0.19 0.00 0.00 0.00 0.00 54.91 55.10 2b88 h ALA 42 Cb 1.72 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2b88 h ALA 42 CO -0.80 0.56 -0.57 -0.97 0.00 0.00 0.00 179.25 177.47 2b88 h ASN 43 N 0.53 0.94 -0.51 0.00 -0.73 0.26 0.26 115.58 116.32 2b88 h ASN 43 Ca 0.08 -0.51 -0.06 0.00 1.87 0.00 0.00 56.30 57.68 2b88 h ASN 43 Cb 0.62 -0.27 -0.03 0.00 0.27 0.00 0.00 38.32 38.91 2b88 h ASN 43 CO 0.04 1.31 0.11 -0.07 -0.37 0.00 0.00 177.43 178.45 2b88 h LEU 44 N 0.63 0.83 -0.50 0.34 3.38 -0.11 1.16 115.31 121.04 2b88 h LEU 44 Ca 0.01 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2b88 h LEU 44 Cb 1.18 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 2b88 h LEU 44 CO 0.12 0.83 0.28 -0.07 0.09 0.00 0.00 178.44 179.69 2b88 h LEU 45 N 0.84 0.61 -0.25 1.67 -0.00 -0.22 0.71 115.31 118.67 2b88 h LEU 45 Ca 0.18 -0.08 -0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2b88 h LEU 45 Cb 0.34 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 40.83 2b88 h LEU 45 CO 0.00 0.52 0.14 0.00 -0.00 0.00 0.00 178.44 179.10 2b88 h ALA 46 N 1.12 0.32 -0.18 1.53 0.00 0.21 0.69 119.26 122.94 2b88 h ALA 46 Ca 0.18 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2b88 h ALA 46 Cb 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2b88 h ALA 46 CO -0.03 -0.16 -0.10 0.93 0.00 0.00 0.00 179.25 179.89 2b88 h GLU 47 N 0.30 0.29 -0.24 0.00 4.39 0.16 0.13 114.58 119.61 2b88 h GLU 47 Ca 0.09 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 2b88 h GLU 47 Cb 0.04 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2b88 h GLU 47 CO -0.02 0.40 -0.14 0.00 -1.16 0.00 0.00 179.01 178.10 2b88 h ALA 48 N 1.63 0.35 -0.70 3.43 0.00 0.17 0.42 119.26 124.55 2b88 h ALA 48 Ca 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2b88 h ALA 48 Cb 0.36 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2b88 h ALA 48 CO 0.02 0.22 0.42 0.87 0.00 0.00 0.00 179.25 180.78 2b88 h LYS 49 N 0.24 0.95 -0.49 0.00 1.79 0.11 0.74 116.57 119.92 2b88 h LYS 49 Ca 0.05 -0.08 -0.09 0.00 -2.18 0.00 0.00 60.65 58.35 2b88 h LYS 49 Cb 0.65 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 31.08 2b88 h LYS 49 CO 0.04 0.67 -0.03 0.87 -1.08 0.00 0.00 179.45 179.92 2b88 h LYS 50 N 0.97 0.88 -0.25 3.15 1.57 -0.35 0.63 116.57 123.17 2b88 h LYS 50 Ca 0.25 -0.30 -0.14 0.00 -1.87 0.00 0.00 60.65 58.59 2b88 h LYS 50 Cb -0.03 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 2b88 h LYS 50 CO -0.05 0.93 -0.40 -0.07 -0.57 0.00 0.00 179.45 179.30 2b88 h LEU 51 N 0.74 0.78 -0.38 2.94 -0.00 0.99 -0.08 115.31 120.30 2b88 h LEU 51 Ca 0.13 -0.52 -0.05 0.00 -0.00 0.00 0.00 57.88 57.44 2b88 h LEU 51 Cb 0.56 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.98 2b88 h LEU 51 CO 0.03 1.15 0.03 -0.55 -0.00 0.00 0.00 178.44 179.10 2b88 h ASN 52 N 0.43 0.64 -0.91 -0.43 -1.07 0.55 0.26 115.58 115.05 2b88 h ASN 52 Ca 0.02 -0.28 0.01 0.00 0.07 0.00 0.00 56.30 56.12 2b88 h ASN 52 Cb 0.99 -0.17 -0.05 0.00 -2.07 0.00 0.00 38.32 37.03 2b88 h ASN 52 CO 0.09 0.76 0.60 -0.78 0.07 0.00 0.00 177.43 178.18 2b88 h ASP 53 N 0.49 1.04 -0.16 6.14 3.58 0.31 1.02 116.42 128.84 2b88 h ASP 53 Ca 0.11 -0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.46 2b88 h ASP 53 Cb 0.42 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 2b88 h ASP 53 CO 0.01 0.75 -0.13 0.00 -2.88 0.00 0.00 179.24 177.00 2b88 h ALA 54 N 1.34 1.21 -0.01 -0.78 0.00 -0.64 -1.64 119.26 118.75 2b88 h ALA 54 Ca 0.34 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2b88 h ALA 54 Cb -0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2b88 h ALA 54 CO -0.08 0.51 -0.12 1.04 0.00 0.00 0.00 179.25 180.60 2b88 n GLN 55 N -4.19 1.09 -2.49 0.00 6.02 0.90 -4.89 117.38 113.81 2b88 n GLN 55 Ca 0.01 -0.56 -0.26 0.00 -0.01 0.00 0.00 57.00 56.18 2b88 n GLN 55 Cb 0.33 -1.49 0.03 0.00 1.02 0.00 0.00 30.24 30.13 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 -2.30 3.38 -0.87 -1.58 0.00 0.33 -4.84 121.76 115.89 2b88 s ALA 56 Ca 0.31 -0.75 0.01 0.00 0.00 0.00 0.00 51.96 51.53 2b88 s ALA 56 Cb 0.20 -2.53 0.05 0.00 0.00 0.00 0.00 23.12 20.84 2b88 s ALA 56 CO 0.44 -0.72 0.62 -0.35 0.00 0.00 0.00 175.76 175.75 2b88 n PRO 57 N -2.49 1.22 -0.15 0.00 -0.05 -1.26 -4.96 135.00 127.30 2b88 n PRO 57 Ca 0.04 -0.19 0.00 0.00 -0.05 0.00 0.00 63.50 63.30 2b88 n PRO 57 Cb 0.57 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 32.52 2b88 n PRO 57 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08