#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fs1 n GLU 2 N 0.00 -0.39 0.00 2.12 2.13 -1.26 -5.03 120.64 118.21 2fs1 n GLU 2 Ca 0.00 0.26 0.00 0.00 0.66 0.00 0.00 57.16 58.08 2fs1 n GLU 2 Cb 0.00 -0.48 0.00 0.00 0.27 0.00 0.00 31.44 31.23 2fs1 n GLU 2 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2fs1 n ALA 3 N -0.31 0.00 0.00 4.31 0.00 -1.26 -5.04 120.51 118.21 2fs1 n ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2fs1 n ALA 3 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.54 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 -0.76 0.00 0.00 0.00 0.31 -1.26 -5.04 118.33 111.58 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 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 2fs1 n VAL 4 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2fs1 n ASP 5 N -1.22 0.00 -0.04 4.52 2.03 -1.26 -4.60 116.55 115.97 2fs1 n ASP 5 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 2fs1 n ASP 5 Cb 0.10 0.00 0.26 0.00 -0.72 0.00 0.00 41.12 40.76 2fs1 n ASP 5 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fs1 h ALA 6 N 0.00 1.32 -0.19 -1.67 0.00 -1.99 -1.68 119.26 115.06 2fs1 h ALA 6 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2fs1 h ALA 6 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2fs1 h ALA 6 CO 0.00 0.47 0.06 -0.97 0.00 0.00 0.00 179.25 178.82 2fs1 h ASN 7 N 0.60 0.26 0.01 0.00 -0.00 -2.00 -2.08 115.58 112.37 2fs1 h ASN 7 Ca 0.13 -0.19 -0.04 0.00 -0.00 0.00 0.00 56.30 56.20 2fs1 h ASN 7 Cb 0.32 -0.07 -0.01 0.00 -0.00 0.00 0.00 38.32 38.56 2fs1 h ASN 7 CO 0.01 0.38 -0.10 -1.28 -0.00 0.00 0.00 177.43 176.44 2fs1 h SER 8 N 0.13 0.20 -0.39 1.15 0.87 -1.88 -2.55 113.55 111.08 2fs1 h SER 8 Ca 0.06 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.57 2fs1 h SER 8 Cb 0.21 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 2fs1 h SER 8 CO -0.00 0.33 0.17 0.25 -0.53 0.00 0.00 176.83 177.04 2fs1 h LEU 9 N 0.21 0.53 -2.03 2.23 6.46 -0.89 -2.28 115.31 119.54 2fs1 h LEU 9 Ca 0.04 -0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.65 2fs1 h LEU 9 Cb 0.31 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 2fs1 h LEU 9 CO 0.02 0.54 0.00 0.00 -0.62 0.00 0.00 178.44 178.37 2fs1 h ALA 10 N 1.01 1.00 0.22 1.25 0.00 -0.96 -2.66 119.26 119.12 2fs1 h ALA 10 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.74 2fs1 h ALA 10 Cb 0.17 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.99 2fs1 h ALA 10 CO -0.01 0.00 -1.36 0.37 0.00 0.00 0.00 179.25 178.24 2fs1 h GLN 11 N 0.00 0.46 -0.94 0.00 4.15 -1.28 0.28 115.11 117.78 2fs1 h GLN 11 Ca 0.00 -0.78 0.19 0.00 0.77 0.00 0.00 58.65 58.83 2fs1 h GLN 11 Cb 0.21 0.29 -0.08 0.00 0.21 0.00 0.00 27.48 28.11 2fs1 h GLN 11 CO 0.00 1.37 0.60 0.00 -1.93 0.00 0.00 178.83 178.88 2fs1 h ALA 12 N 0.12 2.00 0.00 3.38 0.00 -1.22 1.80 119.26 125.33 2fs1 h ALA 12 Ca -0.25 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 2fs1 h ALA 12 Cb 2.02 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 2fs1 h ALA 12 CO 0.23 -0.30 -0.78 1.57 0.00 0.00 0.00 179.25 179.96 2fs1 h LYS 13 N 0.56 0.00 -0.93 0.00 2.10 -1.61 -0.49 116.57 116.21 2fs1 h LYS 13 Ca 0.50 0.00 0.23 0.00 -2.00 0.00 0.00 60.65 59.38 2fs1 h LYS 13 Cb 1.03 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.30 2fs1 h LYS 13 CO -0.24 0.67 0.63 0.93 -2.00 0.00 0.00 179.45 179.44 2fs1 h GLU 14 N -1.00 0.29 0.02 0.07 5.08 -0.04 0.92 114.58 119.92 2fs1 h GLU 14 Ca -0.18 -0.02 -0.27 0.00 -1.00 0.00 0.00 59.36 57.89 2fs1 h GLU 14 Cb 0.96 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.10 2fs1 h GLU 14 CO -0.11 0.19 -1.48 0.00 -1.00 0.00 0.00 179.01 176.61 2fs1 h ALA 15 N 1.59 0.56 0.00 3.43 0.00 0.26 -3.25 119.26 121.86 2fs1 h ALA 15 Ca 0.48 -1.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.05 2fs1 h ALA 15 Cb 1.38 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 2fs1 h ALA 15 CO -0.15 1.41 -0.43 0.00 0.00 0.00 0.00 179.25 180.08 2fs1 h ALA 16 N 0.89 0.98 -0.05 0.00 0.00 0.15 -3.04 119.26 118.19 2fs1 h ALA 16 Ca -0.20 -0.39 -0.22 0.00 0.00 0.00 0.00 54.91 54.09 2fs1 h ALA 16 Cb 1.94 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.67 2fs1 h ALA 16 CO 0.11 0.54 -0.88 0.97 0.00 0.00 0.00 179.25 179.98 2fs1 h ILE 17 N 0.00 1.34 -0.55 0.00 2.10 0.50 -2.43 117.51 118.48 2fs1 h ILE 17 Ca -0.00 -2.24 0.07 0.00 1.08 0.00 0.00 64.86 63.77 2fs1 h ILE 17 Cb 0.96 2.25 -0.03 0.00 -1.09 0.00 0.00 36.82 38.90 2fs1 h ILE 17 CO 0.06 0.68 0.37 0.50 -1.08 0.00 0.00 178.15 178.67 2fs1 h LYS 18 N 0.34 0.45 0.03 2.19 3.11 -1.56 0.69 116.57 121.82 2fs1 h LYS 18 Ca -0.07 -0.03 -0.23 0.00 -2.81 0.00 0.00 60.65 57.51 2fs1 h LYS 18 Cb 1.50 -0.10 0.02 0.00 -1.00 0.00 0.00 32.23 32.65 2fs1 h LYS 18 CO 0.16 0.30 -0.91 1.49 -2.81 0.00 0.00 179.45 177.68 2fs1 h GLU 19 N 0.46 0.57 -0.15 1.90 4.57 -1.51 0.04 114.58 120.46 2fs1 h GLU 19 Ca 0.24 -0.65 -0.00 0.00 -1.18 0.00 0.00 59.36 57.77 2fs1 h GLU 19 Cb 0.36 0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 2fs1 h GLU 19 CO -0.07 1.25 0.07 1.25 -1.18 0.00 0.00 179.01 180.34 2fs1 h LEU 20 N 0.16 0.18 0.18 1.64 5.85 -0.76 0.90 115.31 123.47 2fs1 h LEU 20 Ca -0.12 -0.01 -0.32 0.00 0.84 0.00 0.00 57.88 58.27 2fs1 h LEU 20 Cb 1.59 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 42.59 2fs1 h LEU 20 CO 0.18 0.16 -1.52 0.50 -0.34 0.00 0.00 178.44 177.41 2fs1 h LYS 21 N 0.21 0.38 -0.09 1.25 3.11 -0.88 -1.72 116.57 118.83 2fs1 h LYS 21 Ca 0.05 -0.65 -0.12 0.00 -2.81 0.00 0.00 60.65 57.12 2fs1 h LYS 21 Cb 0.02 0.24 -0.01 0.00 -1.00 0.00 0.00 32.23 31.48 2fs1 h LYS 21 CO -0.01 1.29 -0.50 0.37 -2.81 0.00 0.00 179.45 177.79 2fs1 h GLN 22 N 0.10 0.24 0.03 1.90 4.15 -0.18 -3.12 115.11 118.24 2fs1 h GLN 22 Ca -0.25 -0.14 -0.23 0.00 0.77 0.00 0.00 58.65 58.80 2fs1 h GLN 22 Cb 2.08 0.01 0.02 0.00 0.21 0.00 0.00 27.48 29.80 2fs1 h GLN 22 CO 0.21 0.69 -0.91 1.88 -1.93 0.00 0.00 178.83 178.77 2fs1 h TYR 23 N 0.19 0.85 0.00 3.99 0.05 0.73 -3.48 116.97 119.30 2fs1 h TYR 23 Ca 0.01 -0.49 0.00 0.00 0.05 0.00 0.00 58.73 58.30 2fs1 h TYR 23 Cb 0.95 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.60 2fs1 h TYR 23 CO 0.02 1.32 0.00 0.41 -1.05 0.00 0.00 178.16 178.86 2fs1 n GLY 24 N 1.18 0.87 3.15 3.88 0.00 -0.72 -5.08 105.19 108.47 2fs1 n GLY 24 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.78 0.00 -2.11 -0.61 5.41 -0.78 -4.94 119.36 115.55 2fs1 n ILE 25 Ca 0.00 -0.17 -0.31 0.00 1.00 0.00 0.00 62.75 63.26 2fs1 n ILE 25 Cb 0.00 -0.50 -0.01 0.00 -0.71 0.00 0.00 39.64 38.42 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 -1.81 1.84 0.54 7.39 0.00 -1.26 -4.81 107.32 109.21 2fs1 s GLY 26 Ca 0.47 0.03 0.30 0.00 0.00 0.00 0.00 44.72 45.52 2fs1 s GLY 26 CO 0.55 0.30 2.09 1.29 0.00 0.00 0.00 173.10 177.33 2fs1 h ASP 27 N 0.23 0.00 -0.76 1.64 3.04 -1.94 -2.91 116.42 115.73 2fs1 h ASP 27 Ca -0.45 0.00 0.17 0.00 -3.24 0.00 0.00 57.03 53.51 2fs1 h ASP 27 Cb 1.19 0.00 -0.13 0.00 -1.04 0.00 0.00 39.33 39.35 2fs1 h ASP 27 CO 0.62 0.10 0.05 0.22 -2.04 0.00 0.00 179.24 178.18 2fs1 h TYR 28 N 0.00 0.03 0.00 4.15 5.03 -1.99 0.23 116.97 124.42 2fs1 h TYR 28 Ca -0.00 0.05 -0.05 0.00 2.58 0.00 0.00 58.73 61.31 2fs1 h TYR 28 Cb 0.33 0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.71 2fs1 h TYR 28 CO 0.00 -0.21 -0.23 1.88 -1.32 0.00 0.00 178.16 178.28 2fs1 h TYR 29 N 0.13 0.00 -0.07 -3.82 0.05 -1.91 0.32 116.97 111.66 2fs1 h TYR 29 Ca 0.42 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 59.03 2fs1 h TYR 29 Cb 0.75 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.48 2fs1 h TYR 29 CO -0.38 0.23 -0.69 -0.84 -1.05 0.00 0.00 178.16 175.42 2fs1 h ILE 30 N 0.00 1.39 0.03 -2.88 -0.00 -0.71 -3.03 117.51 112.31 2fs1 h ILE 30 Ca -0.00 -2.12 -0.07 0.00 -0.00 0.00 0.00 64.86 62.67 2fs1 h ILE 30 Cb 0.97 2.09 -0.00 0.00 -0.00 0.00 0.00 36.82 39.89 2fs1 h ILE 30 CO 0.03 0.63 -0.36 0.11 -0.00 0.00 0.00 178.15 178.56 2fs1 h LYS 31 N 0.23 0.06 0.00 0.16 6.56 -0.92 -3.26 116.57 119.41 2fs1 h LYS 31 Ca -0.02 -0.11 0.00 0.00 -1.06 0.00 0.00 60.65 59.46 2fs1 h LYS 31 Cb 1.25 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.95 2fs1 h LYS 31 CO 0.11 1.05 0.41 1.37 -2.06 0.00 0.00 179.45 180.33 2fs1 h LEU 32 N -0.86 0.00 0.11 2.94 -0.00 -0.44 -0.22 115.31 116.84 2fs1 h LEU 32 Ca -0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.79 2fs1 h LEU 32 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.84 2fs1 h LEU 32 CO 0.00 0.00 -0.05 0.40 -0.00 0.00 0.00 178.44 178.79 2fs1 h ILE 33 N 0.00 0.53 -0.24 0.15 2.04 -1.58 -3.27 117.51 115.13 2fs1 h ILE 33 Ca 0.00 -1.20 0.07 0.00 1.00 0.00 0.00 64.86 64.73 2fs1 h ILE 33 Cb 0.82 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 2fs1 h ILE 33 CO 0.00 0.16 0.43 -1.13 0.00 0.00 0.00 178.15 177.61 2fs1 h ASN 34 N -0.99 0.00 0.84 1.72 -0.73 -1.09 0.24 115.58 115.56 2fs1 h ASN 34 Ca -0.01 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.14 2fs1 h ASN 34 Cb 0.38 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.96 2fs1 h ASN 34 CO 0.02 0.00 -0.05 -1.13 -0.37 0.00 0.00 177.43 175.90 2fs1 h ASN 35 N 0.00 0.00 -4.14 1.15 -0.73 -1.51 -3.44 115.58 106.91 2fs1 h ASN 35 Ca 0.12 0.00 -0.53 0.00 1.87 0.00 0.00 56.30 57.76 2fs1 h ASN 35 Cb 0.97 0.00 0.13 0.00 0.27 0.00 0.00 38.32 39.68 2fs1 h ASN 35 CO -0.00 0.05 0.44 0.00 -0.37 0.00 0.00 177.43 177.54 2fs1 s ALA 36 N -3.77 2.38 -0.20 1.57 0.00 0.85 -4.97 121.76 117.62 2fs1 s ALA 36 Ca 0.00 0.92 0.08 0.00 0.00 0.00 0.00 51.96 52.96 2fs1 s ALA 36 Cb 0.10 -3.45 -0.21 0.00 0.00 0.00 0.00 23.12 19.56 2fs1 s ALA 36 CO 0.55 -1.45 0.02 1.63 0.00 0.00 0.00 175.76 176.50 2fs1 n LYS 37 N -2.10 0.67 0.00 0.00 4.01 -1.26 -4.98 118.16 114.50 2fs1 n LYS 37 Ca 0.13 0.11 0.00 0.00 -0.51 0.00 0.00 58.31 58.05 2fs1 n LYS 37 Cb 0.50 -1.56 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 2fs1 n LYS 37 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 2fs1 n THR 38 N -3.07 0.00 0.00 -0.18 -2.24 -1.26 -5.09 114.28 102.43 2fs1 n THR 38 Ca -0.37 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2fs1 n THR 38 Cb 1.06 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 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 -0.28 2.28 3.14 -1.26 -4.63 118.33 117.58 2fs1 n VAL 39 Ca 0.00 0.00 0.31 0.00 -2.96 0.00 0.00 64.34 61.69 2fs1 n VAL 39 Cb 0.00 -0.20 0.70 0.00 -1.06 0.00 0.00 33.84 33.28 2fs1 n VAL 39 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2fs1 h GLU 40 N 0.00 0.06 0.02 1.45 4.39 -1.98 0.34 114.58 118.86 2fs1 h GLU 40 Ca 0.00 -0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.40 2fs1 h GLU 40 Cb 0.10 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 2fs1 h GLU 40 CO 0.00 0.04 -1.65 0.78 -1.16 0.00 0.00 179.01 177.02 2fs1 h GLY 41 N 0.06 0.06 0.73 -3.84 0.00 -1.97 -3.20 103.07 94.91 2fs1 h GLY 41 Ca 0.53 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.73 2fs1 h GLY 41 CO -0.05 0.14 -0.06 -2.08 0.00 0.00 0.00 176.54 174.48 2fs1 h VAL 42 N 0.01 0.82 0.09 4.60 2.07 -0.61 1.03 116.25 124.25 2fs1 h VAL 42 Ca -0.27 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2fs1 h VAL 42 Cb 1.99 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 2fs1 h VAL 42 CO 0.09 0.00 -0.04 1.05 0.02 0.00 0.00 177.57 178.69 2fs1 h GLU 43 N -0.06 -0.11 0.00 1.57 4.11 -1.53 -3.02 114.58 115.54 2fs1 h GLU 43 Ca 0.06 0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.49 2fs1 h GLU 43 Cb 0.15 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2fs1 h GLU 43 CO -0.13 0.34 -0.05 0.66 0.07 0.00 0.00 179.01 179.90 2fs1 h SER 44 N -0.61 0.00 0.76 3.06 4.64 -1.53 -2.38 113.55 117.50 2fs1 h SER 44 Ca -0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2fs1 h SER 44 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 2fs1 h SER 44 CO 0.02 0.05 -0.48 -0.07 -0.87 0.00 0.00 176.83 175.47 2fs1 h LEU 45 N 0.00 -1.23 -0.45 5.97 -0.00 0.12 0.36 115.31 120.08 2fs1 h LEU 45 Ca -0.00 0.07 -0.15 0.00 -0.00 0.00 0.00 57.88 57.80 2fs1 h LEU 45 Cb 0.19 0.36 -0.01 0.00 -0.00 0.00 0.00 40.66 41.20 2fs1 h LEU 45 CO 0.01 -0.74 -0.39 0.50 -0.00 0.00 0.00 178.44 177.82 2fs1 h LYS 46 N -1.17 0.86 0.00 1.13 3.11 -1.55 -1.85 116.57 117.10 2fs1 h LYS 46 Ca -0.10 -0.45 -0.02 0.00 -2.81 0.00 0.00 60.65 57.27 2fs1 h LYS 46 Cb 0.95 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 32.19 2fs1 h LYS 46 CO 0.09 1.09 -0.11 -0.97 -2.81 0.00 0.00 179.45 176.75 2fs1 h ASN 47 N 0.71 0.00 0.63 4.20 -1.24 -1.35 -0.47 115.58 118.05 2fs1 h ASN 47 Ca 0.06 0.00 -0.27 0.00 0.71 0.00 0.00 56.30 56.79 2fs1 h ASN 47 Cb 0.96 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.01 2fs1 h ASN 47 CO 0.09 0.11 -1.25 -0.33 -1.29 0.00 0.00 177.43 174.76 2fs1 h GLU 48 N 0.00 0.26 0.00 6.67 4.39 0.04 -1.92 114.58 124.02 2fs1 h GLU 48 Ca -0.00 -0.45 -0.07 0.00 0.34 0.00 0.00 59.36 59.18 2fs1 h GLU 48 Cb 0.26 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2fs1 h GLU 48 CO 0.01 1.21 -0.32 -0.84 -1.16 0.00 0.00 179.01 177.91 2fs1 h ILE 49 N 0.07 1.12 0.10 3.13 3.07 -0.44 -2.51 117.51 122.05 2fs1 h ILE 49 Ca -0.14 -1.13 -0.27 0.00 1.55 0.00 0.00 64.86 64.88 2fs1 h ILE 49 Cb 1.97 1.63 -0.01 0.00 -0.27 0.00 0.00 36.82 40.14 2fs1 h ILE 49 CO 0.20 0.31 -1.24 -0.07 -1.05 0.00 0.00 178.15 176.30 2fs1 h LEU 50 N 0.00 0.32 -2.78 0.16 3.38 -1.10 -2.90 115.31 112.39 2fs1 h LEU 50 Ca -0.00 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 2fs1 h LEU 50 Cb 0.60 -0.10 -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 0.11 0.09 0.00 0.00 178.44 179.96 2fs1 h LYS 51 N 0.06 0.00 -1.56 1.13 6.56 -0.89 -3.25 116.57 118.62 2fs1 h LYS 51 Ca -0.13 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.01 2fs1 h LYS 51 Cb 1.94 0.00 -0.31 0.00 -0.57 0.00 0.00 32.23 33.29 2fs1 h LYS 51 CO 0.18 0.00 -0.88 0.00 -2.06 0.00 0.00 179.45 176.70 2fs1 n ALA 52 N -2.14 1.23 -2.19 3.86 0.00 -1.14 -5.10 120.51 115.04 2fs1 n ALA 52 Ca -0.03 -2.64 -0.42 0.00 0.00 0.00 0.00 53.44 50.35 2fs1 n ALA 52 Cb 0.09 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 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 -0.55 4.27 -0.84 0.00 1.02 -1.10 -4.86 118.68 116.63 2fs1 s LEU 53 Ca 0.33 2.02 -0.21 0.00 0.02 0.00 0.00 54.13 56.29 2fs1 s LEU 53 Cb 0.13 -3.54 -0.19 0.00 0.02 0.00 0.00 46.19 42.61 2fs1 s LEU 53 CO -0.15 -0.83 2.27 -2.65 0.02 0.00 0.00 176.35 175.00 2fs1 n PRO 54 N 6.65 0.36 -2.69 1.29 -0.02 -1.26 -3.66 135.00 135.68 2fs1 n PRO 54 Ca 0.15 -0.72 -0.01 0.00 -2.02 0.00 0.00 63.50 60.91 2fs1 n PRO 54 Cb 0.44 -3.01 -0.01 0.00 -0.02 0.00 0.00 33.50 30.90 2fs1 n PRO 54 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2fs1 n THR 55 N 7.92-12.05 1.65 3.45 -1.04 -1.26 -5.23 114.28 107.72 2fs1 n THR 55 Ca 0.49 1.94 0.15 0.00 -2.04 0.00 0.00 64.05 64.59 2fs1 n THR 55 Cb 0.37 -6.87 0.65 0.00 -1.82 0.00 0.00 70.33 62.66 2fs1 n THR 55 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64