#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fs1 s GLU 2 N 0.00 0.14 0.00 0.03 -6.30 -1.26 -5.12 118.70 106.19 2fs1 s GLU 2 Ca 0.00 0.19 0.00 0.00 -2.50 0.00 0.00 54.97 52.66 2fs1 s GLU 2 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 34.13 34.19 2fs1 s GLU 2 CO 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 175.26 175.26 2fs1 n ALA 3 N 2.21 0.00 -1.08 6.30 0.00 -1.26 -5.01 120.51 121.68 2fs1 n ALA 3 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2fs1 n ALA 3 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 2fs1 n ALA 3 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2fs1 n VAL 4 N -0.84 0.00 0.00 0.00 0.31 -1.26 -5.04 118.33 111.50 2fs1 n VAL 4 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2fs1 n VAL 4 Cb 0.00 0.97 0.00 0.00 -0.91 0.00 0.00 33.84 33.90 2fs1 n VAL 4 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2fs1 n ASP 5 N 0.00 0.00 -0.28 4.52 9.92 -1.26 -4.36 116.55 125.09 2fs1 n ASP 5 Ca 0.00 0.00 0.17 0.00 -0.53 0.00 0.00 54.79 54.43 2fs1 n ASP 5 Cb 0.49 0.00 0.45 0.00 -0.64 0.00 0.00 41.12 41.41 2fs1 n ASP 5 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fs1 h ALA 6 N 0.00 2.03 -0.11 2.24 0.00 -1.98 0.87 119.26 122.32 2fs1 h ALA 6 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2fs1 h ALA 6 Cb 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2fs1 h ALA 6 CO 0.00 -0.34 -0.06 -0.97 0.00 0.00 0.00 179.25 177.88 2fs1 h ASN 7 N 0.53 0.24 0.32 0.00 -0.73 -1.99 -2.45 115.58 111.51 2fs1 h ASN 7 Ca 0.51 -0.42 -0.11 0.00 1.87 0.00 0.00 56.30 58.14 2fs1 h ASN 7 Cb 1.08 -0.07 -0.01 0.00 0.27 0.00 0.00 38.32 39.59 2fs1 h ASN 7 CO -0.24 0.61 -0.46 -1.28 -0.37 0.00 0.00 177.43 175.69 2fs1 h SER 8 N -0.12 0.19 -0.42 1.15 0.87 -1.55 -3.03 113.55 110.62 2fs1 h SER 8 Ca 0.02 -0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2fs1 h SER 8 Cb 0.52 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2fs1 h SER 8 CO 0.02 0.63 0.26 0.25 -0.53 0.00 0.00 176.83 177.46 2fs1 h LEU 9 N 0.14 0.50 -1.76 2.23 6.46 0.79 -1.58 115.31 122.10 2fs1 h LEU 9 Ca 0.01 -0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2fs1 h LEU 9 Cb 0.88 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 40.68 2fs1 h LEU 9 CO 0.07 0.40 -0.01 0.00 -0.62 0.00 0.00 178.44 178.28 2fs1 h ALA 10 N 1.13 1.01 0.19 1.25 0.00 -1.33 -3.04 119.26 118.46 2fs1 h ALA 10 Ca 0.15 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.75 2fs1 h ALA 10 Cb -0.02 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.79 2fs1 h ALA 10 CO -0.03 0.01 -1.44 0.37 0.00 0.00 0.00 179.25 178.16 2fs1 h GLN 11 N 0.00 0.39 -0.81 0.00 4.15 -1.27 -0.04 115.11 117.53 2fs1 h GLN 11 Ca -0.00 -0.67 0.17 0.00 0.77 0.00 0.00 58.65 58.91 2fs1 h GLN 11 Cb 0.42 0.25 -0.11 0.00 0.21 0.00 0.00 27.48 28.25 2fs1 h GLN 11 CO 0.00 1.32 0.34 0.00 -1.93 0.00 0.00 178.83 178.56 2fs1 h ALA 12 N 0.08 1.20 0.00 3.38 0.00 -1.19 1.73 119.26 124.46 2fs1 h ALA 12 Ca -0.28 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2fs1 h ALA 12 Cb 1.98 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.87 2fs1 h ALA 12 CO 0.18 -0.24 -0.06 1.57 0.00 0.00 0.00 179.25 180.71 2fs1 h LYS 13 N 0.45 0.00 -1.15 0.00 2.10 -1.66 0.50 116.57 116.80 2fs1 h LYS 13 Ca 0.47 0.00 0.35 0.00 -2.00 0.00 0.00 60.65 59.46 2fs1 h LYS 13 Cb 0.77 0.00 -0.12 0.00 -0.90 0.00 0.00 32.23 31.98 2fs1 h LYS 13 CO -0.45 0.29 0.73 0.93 -2.00 0.00 0.00 179.45 178.96 2fs1 h GLU 14 N -1.00 0.24 0.19 0.07 4.39 -0.68 1.37 114.58 119.17 2fs1 h GLU 14 Ca -0.01 -0.01 -0.34 0.00 0.34 0.00 0.00 59.36 59.34 2fs1 h GLU 14 Cb 0.32 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2fs1 h GLU 14 CO -0.00 0.16 -1.65 0.00 -1.16 0.00 0.00 179.01 176.35 2fs1 h ALA 15 N 1.65 0.10 0.00 3.43 0.00 0.25 -3.20 119.26 121.49 2fs1 h ALA 15 Ca 0.71 -1.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 2fs1 h ALA 15 Cb 1.99 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 20.19 2fs1 h ALA 15 CO -0.40 0.93 -0.17 0.00 0.00 0.00 0.00 179.25 179.61 2fs1 h ALA 16 N 0.10 1.38 0.05 0.00 0.00 0.49 -2.41 119.26 118.87 2fs1 h ALA 16 Ca -0.32 -0.16 -0.23 0.00 0.00 0.00 0.00 54.91 54.19 2fs1 h ALA 16 Cb 2.06 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 2fs1 h ALA 16 CO 0.18 0.22 -1.06 -0.84 0.00 0.00 0.00 179.25 177.75 2fs1 h ILE 17 N 0.00 1.53 -0.99 0.00 3.07 0.14 -3.18 117.51 118.08 2fs1 h ILE 17 Ca -0.00 -2.94 0.16 0.00 1.55 0.00 0.00 64.86 63.63 2fs1 h ILE 17 Cb 0.39 2.73 -0.09 0.00 -0.27 0.00 0.00 36.82 39.58 2fs1 h ILE 17 CO 0.02 0.86 0.62 0.50 -1.05 0.00 0.00 178.15 179.09 2fs1 h LYS 18 N 0.08 0.79 -0.36 0.16 3.64 -1.42 0.53 116.57 120.00 2fs1 h LYS 18 Ca -0.08 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.14 2fs1 h LYS 18 Cb 1.76 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.38 2fs1 h LYS 18 CO 0.17 0.52 -0.23 0.93 -2.27 0.00 0.00 179.45 178.57 2fs1 h GLU 19 N 0.82 0.70 -0.18 1.90 3.07 -1.56 0.18 114.58 119.52 2fs1 h GLU 19 Ca 0.53 -0.28 -0.06 0.00 -0.50 0.00 0.00 59.36 59.06 2fs1 h GLU 19 Cb 0.76 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.62 2fs1 h GLU 19 CO -0.31 0.87 -0.14 1.25 -1.40 0.00 0.00 179.01 179.28 2fs1 h LEU 20 N 0.62 0.27 0.03 1.33 5.85 -0.11 1.05 115.31 124.34 2fs1 h LEU 20 Ca 0.09 -0.06 -0.26 0.00 0.84 0.00 0.00 57.88 58.49 2fs1 h LEU 20 Cb 0.72 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.68 2fs1 h LEU 20 CO 0.06 0.43 -1.15 0.50 -0.34 0.00 0.00 178.44 177.94 2fs1 h LYS 21 N 0.27 0.31 0.00 1.25 3.64 -0.00 0.66 116.57 122.69 2fs1 h LYS 21 Ca 0.05 -0.46 -0.14 0.00 -1.27 0.00 0.00 60.65 58.84 2fs1 h LYS 21 Cb 0.41 0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2fs1 h LYS 21 CO 0.02 1.18 -0.66 0.37 -2.27 0.00 0.00 179.45 178.10 2fs1 h GLN 22 N 0.12 0.00 0.13 1.90 5.75 -0.03 -3.30 115.11 119.67 2fs1 h GLN 22 Ca -0.12 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.14 2fs1 h GLN 22 Cb 1.85 0.00 0.01 0.00 1.07 0.00 0.00 27.48 30.40 2fs1 h GLN 22 CO 0.19 0.66 -1.17 1.88 -2.65 0.00 0.00 178.83 177.74 2fs1 h TYR 23 N 0.00 0.48 0.00 3.99 0.05 0.11 -3.49 116.97 118.11 2fs1 h TYR 23 Ca -0.01 -0.35 0.00 0.00 0.05 0.00 0.00 58.73 58.42 2fs1 h TYR 23 Cb 1.37 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 39.09 2fs1 h TYR 23 CO 0.00 1.46 0.00 0.41 -1.05 0.00 0.00 178.16 178.98 2fs1 n GLY 24 N 1.71 0.74 3.14 3.88 0.00 0.21 -5.06 105.19 109.80 2fs1 n GLY 24 Ca -0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 2fs1 n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2fs1 n ILE 25 N -1.65 0.00 -2.20 -0.61 5.41 -1.12 -4.87 119.36 114.32 2fs1 n ILE 25 Ca 0.00 -0.17 -0.39 0.00 1.00 0.00 0.00 62.75 63.20 2fs1 n ILE 25 Cb 0.00 -0.48 -0.01 0.00 -0.71 0.00 0.00 39.64 38.43 2fs1 n ILE 25 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2fs1 s GLY 26 N -1.78 2.88 0.63 7.39 0.00 -1.26 -4.89 107.32 110.30 2fs1 s GLY 26 Ca 0.46 1.06 0.35 0.00 0.00 0.00 0.00 44.72 46.59 2fs1 s GLY 26 CO 0.54 1.59 2.20 1.29 0.00 0.00 0.00 173.10 178.73 2fs1 h ASP 27 N 2.59 0.00 -0.79 1.64 3.04 -1.96 -2.27 116.42 118.67 2fs1 h ASP 27 Ca -0.49 0.00 0.18 0.00 -3.24 0.00 0.00 57.03 53.48 2fs1 h ASP 27 Cb 1.24 0.00 -0.12 0.00 -1.04 0.00 0.00 39.33 39.41 2fs1 h ASP 27 CO 0.62 0.00 0.18 0.22 -2.04 0.00 0.00 179.24 178.23 2fs1 h TYR 28 N 0.00 0.28 0.12 4.15 3.20 -1.99 -1.68 116.97 121.05 2fs1 h TYR 28 Ca 0.02 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2fs1 h TYR 28 Cb 0.24 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.52 2fs1 h TYR 28 CO 0.00 -0.13 -0.06 1.88 -1.64 0.00 0.00 178.16 178.21 2fs1 h TYR 29 N 0.24 -0.15 -1.14 -3.82 0.05 -1.79 0.70 116.97 111.06 2fs1 h TYR 29 Ca 0.46 -0.00 0.33 0.00 0.05 0.00 0.00 58.73 59.57 2fs1 h TYR 29 Cb 0.84 0.05 -0.05 0.00 1.01 0.00 0.00 36.73 38.58 2fs1 h TYR 29 CO -0.28 0.33 0.83 0.97 -1.05 0.00 0.00 178.16 178.97 2fs1 h ILE 30 N -0.80 0.41 0.00 -2.88 -0.00 -1.58 0.98 117.51 113.64 2fs1 h ILE 30 Ca -0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 64.86 64.73 2fs1 h ILE 30 Cb 0.55 0.42 -0.02 0.00 -0.00 0.00 0.00 36.82 37.77 2fs1 h ILE 30 CO 0.03 0.00 -0.63 0.50 -0.00 0.00 0.00 178.15 178.04 2fs1 h LYS 31 N 0.00 0.00 0.00 2.19 1.63 -1.21 -3.28 116.57 115.91 2fs1 h LYS 31 Ca 0.54 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.33 2fs1 h LYS 31 Cb 2.20 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.84 2fs1 h LYS 31 CO -0.01 1.00 0.33 1.37 -3.45 0.00 0.00 179.45 178.70 2fs1 h LEU 32 N -0.99 0.00 0.00 5.20 -0.00 0.27 -1.30 115.31 118.50 2fs1 h LEU 32 Ca -0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 2fs1 h LEU 32 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.82 2fs1 h LEU 32 CO -0.10 0.00 -0.00 0.40 -0.00 0.00 0.00 178.44 178.74 2fs1 h ILE 33 N 0.00 0.47 -0.26 0.15 2.04 -1.11 -3.32 117.51 115.48 2fs1 h ILE 33 Ca 0.00 -1.35 0.08 0.00 1.00 0.00 0.00 64.86 64.59 2fs1 h ILE 33 Cb 0.67 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2fs1 h ILE 33 CO 0.00 0.16 0.46 -1.13 0.00 0.00 0.00 178.15 177.64 2fs1 h ASN 34 N -1.00 0.00 1.00 1.72 -0.73 -1.30 0.32 115.58 115.59 2fs1 h ASN 34 Ca -0.00 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.16 2fs1 h ASN 34 Cb 0.26 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.85 2fs1 h ASN 34 CO 0.00 0.00 -0.06 -1.13 -0.37 0.00 0.00 177.43 175.87 2fs1 h ASN 35 N 0.00 0.00 -4.19 1.15 -1.24 -1.57 -3.45 115.58 106.28 2fs1 h ASN 35 Ca 0.12 0.00 -0.51 0.00 0.71 0.00 0.00 56.30 56.62 2fs1 h ASN 35 Cb 1.03 0.00 0.19 0.00 0.73 0.00 0.00 38.32 40.28 2fs1 h ASN 35 CO -0.00 0.06 0.21 0.00 -1.29 0.00 0.00 177.43 176.41 2fs1 s ALA 36 N -3.67 1.36 -0.12 1.57 0.00 0.11 -4.98 121.76 116.04 2fs1 s ALA 36 Ca 0.01 0.51 0.09 0.00 0.00 0.00 0.00 51.96 52.57 2fs1 s ALA 36 Cb 0.09 -3.42 -0.13 0.00 0.00 0.00 0.00 23.12 19.66 2fs1 s ALA 36 CO 0.57 -2.79 0.01 1.63 0.00 0.00 0.00 175.76 175.19 2fs1 n LYS 37 N -4.25 1.89 0.00 0.00 5.02 -1.26 -5.02 118.16 114.54 2fs1 n LYS 37 Ca 0.11 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2fs1 n LYS 37 Cb 0.52 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.25 2fs1 n LYS 37 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2fs1 n THR 38 N -2.49 0.00 0.00 -0.18 -2.24 -1.26 -5.10 114.28 103.01 2fs1 n THR 38 Ca -0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2fs1 n THR 38 Cb 0.85 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 2fs1 n THR 38 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2fs1 n VAL 39 N 0.00 0.00 -0.30 2.28 3.14 -1.26 -4.69 118.33 117.50 2fs1 n VAL 39 Ca 0.00 0.00 0.13 0.00 -2.96 0.00 0.00 64.34 61.51 2fs1 n VAL 39 Cb 0.00 -0.21 0.30 0.00 -1.06 0.00 0.00 33.84 32.87 2fs1 n VAL 39 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 2fs1 h GLU 40 N 0.00 0.28 0.00 1.45 4.81 -1.99 0.56 114.58 119.70 2fs1 h GLU 40 Ca 0.00 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 2fs1 h GLU 40 Cb 0.05 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 2fs1 h GLU 40 CO 0.00 0.18 -0.48 0.78 -0.73 0.00 0.00 179.01 178.76 2fs1 h GLY 41 N 0.28 0.00 0.83 1.92 0.00 -1.97 -3.17 103.07 100.96 2fs1 h GLY 41 Ca 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.86 2fs1 h GLY 41 CO -0.60 0.00 -0.22 -2.08 0.00 0.00 0.00 176.54 173.65 2fs1 h VAL 42 N 0.00 0.52 -0.31 4.60 2.07 -0.18 1.05 116.25 124.01 2fs1 h VAL 42 Ca -0.00 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2fs1 h VAL 42 Cb 1.29 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2fs1 h VAL 42 CO 0.06 0.05 0.17 1.05 0.02 0.00 0.00 177.57 178.92 2fs1 h GLU 43 N -0.79 0.43 0.00 1.57 4.11 -1.43 -1.97 114.58 116.50 2fs1 h GLU 43 Ca -0.06 -0.05 -0.04 0.00 0.07 0.00 0.00 59.36 59.28 2fs1 h GLU 43 Cb 0.55 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2fs1 h GLU 43 CO 0.10 0.37 -0.17 1.03 0.07 0.00 0.00 179.01 180.41 2fs1 h SER 44 N 0.37 0.00 0.40 3.06 0.87 -1.56 -2.70 113.55 113.99 2fs1 h SER 44 Ca 0.11 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 2fs1 h SER 44 Cb 0.07 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2fs1 h SER 44 CO -0.02 0.17 -0.41 -0.07 -0.53 0.00 0.00 176.83 175.97 2fs1 h LEU 45 N 0.00 -1.11 -0.32 2.23 -0.00 0.20 1.08 115.31 117.39 2fs1 h LEU 45 Ca -0.00 0.09 -0.12 0.00 -0.00 0.00 0.00 57.88 57.86 2fs1 h LEU 45 Cb 0.70 0.37 -0.01 0.00 -0.00 0.00 0.00 40.66 41.73 2fs1 h LEU 45 CO 0.02 -0.56 -0.26 0.50 -0.00 0.00 0.00 178.44 178.15 2fs1 h LYS 46 N -0.83 0.74 0.00 1.13 3.11 -1.55 -1.53 116.57 117.63 2fs1 h LYS 46 Ca -0.03 -0.37 -0.01 0.00 -2.81 0.00 0.00 60.65 57.43 2fs1 h LYS 46 Cb 0.74 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.97 2fs1 h LYS 46 CO -0.07 0.99 -0.05 -0.97 -2.81 0.00 0.00 179.45 176.54 2fs1 h ASN 47 N 0.50 0.00 0.44 4.20 -1.24 -1.29 0.02 115.58 118.21 2fs1 h ASN 47 Ca 0.06 0.00 -0.24 0.00 0.71 0.00 0.00 56.30 56.82 2fs1 h ASN 47 Cb 0.82 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.88 2fs1 h ASN 47 CO 0.07 0.05 -1.06 -0.33 -1.29 0.00 0.00 177.43 174.87 2fs1 h GLU 48 N 0.00 0.36 0.00 6.67 4.39 0.15 -1.03 114.58 125.12 2fs1 h GLU 48 Ca -0.00 -0.46 -0.06 0.00 0.34 0.00 0.00 59.36 59.18 2fs1 h GLU 48 Cb 0.10 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 2fs1 h GLU 48 CO 0.01 1.15 -0.30 -0.84 -1.16 0.00 0.00 179.01 177.86 2fs1 h ILE 49 N 0.17 1.07 0.09 3.13 3.07 -0.14 -2.52 117.51 122.38 2fs1 h ILE 49 Ca -0.10 -1.09 -0.27 0.00 1.55 0.00 0.00 64.86 64.94 2fs1 h ILE 49 Cb 1.73 1.61 -0.01 0.00 -0.27 0.00 0.00 36.82 39.88 2fs1 h ILE 49 CO 0.18 0.30 -1.31 -0.07 -1.05 0.00 0.00 178.15 176.20 2fs1 h LEU 50 N 0.00 0.29 -2.81 0.16 3.38 -0.96 -2.78 115.31 112.60 2fs1 h LEU 50 Ca -0.00 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 2fs1 h LEU 50 Cb 0.59 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2fs1 h LEU 50 CO 0.04 1.28 -0.00 0.50 0.09 0.00 0.00 178.44 180.35 2fs1 h LYS 51 N 0.05 0.00 -1.54 1.13 3.11 -0.74 -3.16 116.57 115.42 2fs1 h LYS 51 Ca -0.15 0.00 -0.45 0.00 -2.81 0.00 0.00 60.65 57.23 2fs1 h LYS 51 Cb 1.94 0.00 -0.34 0.00 -1.00 0.00 0.00 32.23 32.84 2fs1 h LYS 51 CO 0.16 0.00 -0.99 0.00 -2.81 0.00 0.00 179.45 175.81 2fs1 n ALA 52 N -2.15 1.45 -2.50 5.00 0.00 -1.14 -5.09 120.51 116.08 2fs1 n ALA 52 Ca -0.03 -2.94 -0.43 0.00 0.00 0.00 0.00 53.44 50.04 2fs1 n ALA 52 Cb 0.08 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 2fs1 n ALA 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fs1 s LEU 53 N -1.70 3.68 0.85 0.00 1.43 -1.05 -4.89 118.68 116.99 2fs1 s LEU 53 Ca 0.35 0.73 -0.11 0.00 -1.03 0.00 0.00 54.13 54.07 2fs1 s LEU 53 Cb 0.26 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 43.03 2fs1 s LEU 53 CO -0.11 -1.26 1.10 -2.16 0.23 0.00 0.00 176.35 174.15 2fs1 s PRO 54 N 4.51 1.63 0.23 1.29 0.04 -1.26 -5.06 135.00 136.38 2fs1 s PRO 54 Ca 0.53 1.07 0.07 0.00 0.04 0.00 0.00 61.00 62.71 2fs1 s PRO 54 Cb -0.11 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2fs1 s PRO 54 CO 0.29 -2.05 0.19 0.95 0.04 0.00 0.00 177.00 176.42 2fs1 s THR 55 N -2.87 4.47 -2.14 1.26 -4.23 -1.26 -5.16 115.64 105.71 2fs1 s THR 55 Ca 0.63 -1.33 0.17 0.00 -1.18 0.00 0.00 61.69 59.98 2fs1 s THR 55 Cb -0.18 -3.39 0.14 0.00 1.34 0.00 0.00 72.50 70.40 2fs1 s THR 55 CO 0.57 -0.30 1.04 -0.62 -0.54 0.00 0.00 174.62 174.77