#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f22 n ASP 2 N 0.00 0.00 -3.87 0.00 5.75 -1.26 -4.76 116.55 112.41 1f22 n ASP 2 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 54.79 54.67 1f22 n ASP 2 Cb 0.00 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 39.98 1f22 n ASP 2 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1f22 s VAL 3 N 0.00 0.05 0.23 2.12 0.11 -1.26 -0.26 120.40 121.38 1f22 s VAL 3 Ca 0.00 -0.41 0.02 0.00 -2.93 0.00 0.00 61.98 58.66 1f22 s VAL 3 Cb 0.00 -0.29 -0.05 0.00 -1.53 0.00 0.00 36.38 34.51 1f22 s VAL 3 CO 0.00 -0.23 0.03 -0.69 -3.33 0.00 0.00 175.10 170.88 1f22 s VAL 4 N -0.75 0.79 0.03 2.04 1.01 -0.32 -4.91 120.40 118.29 1f22 s VAL 4 Ca -0.08 -2.01 0.05 0.00 0.00 0.00 0.00 61.98 59.94 1f22 s VAL 4 Cb -0.05 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1f22 s VAL 4 CO 0.01 -0.26 -0.15 0.28 0.00 0.00 0.00 175.10 174.98 1f22 s THR 5 N -3.59 1.15 0.11 3.92 -1.32 -1.26 -0.80 115.64 113.85 1f22 s THR 5 Ca 0.30 -0.93 -0.12 0.00 -1.21 0.00 0.00 61.69 59.73 1f22 s THR 5 Cb 0.07 -1.02 -0.13 0.00 -1.51 0.00 0.00 72.50 69.91 1f22 s THR 5 CO 0.09 0.08 1.35 1.88 -2.21 0.00 0.00 174.62 175.81 1f22 h TYR 6 N 5.10 1.10 -1.16 9.09 0.05 -1.91 -3.48 116.97 125.75 1f22 h TYR 6 Ca -0.38 -0.44 0.00 0.00 0.05 0.00 0.00 58.73 57.96 1f22 h TYR 6 Cb 1.17 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 38.73 1f22 h TYR 6 CO 0.50 1.28 -0.27 -1.91 -1.05 0.00 0.00 178.16 176.71 1f22 n GLU 7 N -3.97 -1.48 -3.55 4.88 2.13 -1.26 -4.95 120.64 112.45 1f22 n GLU 7 Ca -0.06 1.07 -0.16 0.00 0.66 0.00 0.00 57.16 58.67 1f22 n GLU 7 Cb 0.69 -1.18 -0.06 0.00 0.27 0.00 0.00 31.44 31.17 1f22 n GLU 7 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 1f22 s ASN 8 N -1.44 -0.55 0.46 4.31 0.01 -1.26 -4.79 114.94 111.68 1f22 s ASN 8 Ca 0.00 0.45 0.24 0.00 -0.71 0.00 0.00 52.86 52.84 1f22 s ASN 8 Cb 0.00 0.51 1.09 0.00 0.41 0.00 0.00 41.25 43.26 1f22 s ASN 8 CO 0.00 -0.66 1.91 0.50 -1.51 0.00 0.00 177.10 177.34 1f22 h LYS 9 N 2.93 0.00 0.87 -0.60 1.63 -2.01 -1.40 116.57 117.99 1f22 h LYS 9 Ca -0.29 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.47 1f22 h LYS 9 Cb 1.18 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.82 1f22 h LYS 9 CO 0.40 0.21 -0.42 0.87 -3.45 0.00 0.00 179.45 177.06 1f22 h LYS 10 N 0.00 -1.13 0.00 1.90 1.79 -1.98 -3.45 116.57 113.70 1f22 h LYS 10 Ca -0.00 0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1f22 h LYS 10 Cb 0.60 0.26 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 1f22 h LYS 10 CO 0.03 -0.75 0.00 0.41 -1.08 0.00 0.00 179.45 178.06 1f22 n GLY 11 N -1.38 0.00 7.00 3.86 0.00 -1.18 -4.81 105.19 108.68 1f22 n GLY 11 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1f22 n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f22 n ASN 12 N 0.00 -4.81 -3.53 1.61 5.03 -0.53 -1.34 115.26 111.69 1f22 n ASN 12 Ca 0.00 0.00 -0.21 0.00 0.87 0.00 0.00 54.58 55.24 1f22 n ASN 12 Cb 0.00 0.00 -0.14 0.00 -1.02 0.00 0.00 39.78 38.62 1f22 n ASN 12 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1f22 s VAL 13 N 0.00 -0.25 0.02 2.41 1.01 -1.26 -4.27 120.40 118.06 1f22 s VAL 13 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 1f22 s VAL 13 Cb 0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1f22 s VAL 13 CO 0.00 -0.25 1.02 0.28 0.00 0.00 0.00 175.10 176.14 1f22 s THR 14 N 2.26 4.70 -0.10 3.92 -1.32 -1.13 -2.79 115.64 121.18 1f22 s THR 14 Ca 0.06 1.96 -0.01 0.00 -1.21 0.00 0.00 61.69 62.48 1f22 s THR 14 Cb -0.16 -4.25 0.03 0.00 -1.51 0.00 0.00 72.50 66.61 1f22 s THR 14 CO -0.12 0.16 -0.04 0.72 -2.21 0.00 0.00 174.62 173.12 1f22 s PHE 15 N 0.95 1.18 0.26 9.09 -0.71 0.02 -4.90 117.98 123.87 1f22 s PHE 15 Ca 0.53 -0.55 -0.31 0.00 -1.04 0.00 0.00 56.93 55.56 1f22 s PHE 15 Cb -0.23 -1.07 -0.12 0.00 -1.21 0.00 0.00 43.02 40.39 1f22 s PHE 15 CO 0.28 -0.45 1.64 -0.25 -1.34 0.00 0.00 175.22 175.10 1f22 n ASP 16 N 5.02 3.89 0.00 1.98 9.92 -1.26 -1.17 116.55 134.93 1f22 n ASP 16 Ca -0.10 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.27 1f22 n ASP 16 Cb 0.50 -1.58 0.00 0.00 -0.64 0.00 0.00 41.12 39.39 1f22 n ASP 16 CO 0.00 0.00 0.00 1.57 0.13 0.00 0.00 177.20 178.90 1f22 n HIS 17 N 2.80 0.00 0.01 1.24 -0.00 0.64 -4.34 115.22 115.57 1f22 n HIS 17 Ca 0.11 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.19 1f22 n HIS 17 Cb 0.36 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.18 1f22 n HIS 17 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 1f22 h LYS 18 N 0.00 0.04 -0.27 1.57 3.11 -1.58 0.18 116.57 119.63 1f22 h LYS 18 Ca 0.00 -0.00 0.05 0.00 -2.81 0.00 0.00 60.65 57.89 1f22 h LYS 18 Cb 0.00 -0.01 -0.08 0.00 -1.00 0.00 0.00 32.23 31.14 1f22 h LYS 18 CO 0.00 0.03 -0.47 0.00 -2.81 0.00 0.00 179.45 176.20 1f22 h ALA 19 N 1.06 -0.62 -0.92 5.00 0.00 -1.88 0.19 119.26 122.09 1f22 h ALA 19 Ca 0.04 0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.09 1f22 h ALA 19 Cb 0.03 0.92 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 1f22 h ALA 19 CO -0.05 -0.96 0.54 0.45 0.00 0.00 0.00 179.25 179.23 1f22 h HIS 20 N -0.44 0.96 0.07 0.00 3.86 -1.63 -0.65 115.15 117.32 1f22 h HIS 20 Ca 0.09 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1f22 h HIS 20 Cb 0.62 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 1f22 h HIS 20 CO -0.59 0.31 -0.08 0.00 0.86 0.00 0.00 177.93 178.43 1f22 h ALA 21 N 1.55 -0.15 -0.37 2.45 0.00 0.11 0.93 119.26 123.78 1f22 h ALA 21 Ca 0.48 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.29 1f22 h ALA 21 Cb 0.59 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1f22 h ALA 21 CO -0.31 -0.60 -0.12 1.05 0.00 0.00 0.00 179.25 179.27 1f22 h GLU 22 N -0.17 0.73 -0.51 0.00 4.11 -0.20 0.58 114.58 119.11 1f22 h GLU 22 Ca 0.01 -0.29 -0.12 0.00 0.07 0.00 0.00 59.36 59.03 1f22 h GLU 22 Cb 0.17 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1f22 h GLU 22 CO -0.03 0.89 -0.14 0.87 0.07 0.00 0.00 179.01 180.67 1f22 h LYS 23 N 0.52 0.99 0.00 1.06 1.79 -1.01 -3.37 116.57 116.56 1f22 h LYS 23 Ca 0.09 -0.39 -0.13 0.00 -2.18 0.00 0.00 60.65 58.04 1f22 h LYS 23 Cb 0.64 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.22 1f22 h LYS 23 CO 0.04 1.07 -1.21 1.28 -1.08 0.00 0.00 179.45 179.55 1f22 n LEU 24 N -4.16 1.89 0.00 2.94 4.77 0.31 -5.09 117.00 117.66 1f22 n LEU 24 Ca 0.01 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1f22 n LEU 24 Cb 0.42 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 1f22 n LEU 24 CO 0.46 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1f22 n GLY 25 N 1.46 0.22 0.00 -0.72 0.00 0.20 -4.89 105.19 101.47 1f22 n GLY 25 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1f22 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f22 n ASP 27 N 0.00 -0.06 -0.32 0.00 5.75 -1.19 -0.59 116.55 120.13 1f22 n ASP 27 Ca 0.00 0.87 0.23 0.00 -0.01 0.00 0.00 54.79 55.88 1f22 n ASP 27 Cb 0.00 -0.32 0.43 0.00 -1.03 0.00 0.00 41.12 40.20 1f22 n ASP 27 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1f22 n ALA 28 N -3.40 0.75 0.00 2.12 0.00 -1.26 -3.65 120.51 115.06 1f22 n ALA 28 Ca 0.12 1.02 0.00 0.00 0.00 0.00 0.00 53.44 54.58 1f22 n ALA 28 Cb 0.40 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1f22 n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f22 s HIS 30 N -1.64 2.30 0.00 0.00 3.76 0.24 -5.09 115.29 114.86 1f22 s HIS 30 Ca 0.00 -1.34 0.00 0.00 -0.15 0.00 0.00 55.06 53.57 1f22 s HIS 30 Cb 0.00 -1.66 0.00 0.00 1.11 0.00 0.00 32.58 32.03 1f22 s HIS 30 CO 0.00 -0.70 0.00 0.39 -0.85 0.00 0.00 174.74 173.58 1f22 n GLU 31 N 4.74 0.00 -0.35 1.40 1.02 -1.26 -3.18 120.64 123.01 1f22 n GLU 31 Ca -0.17 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.05 1f22 n GLU 31 Cb 0.50 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 32.17 1f22 n GLU 31 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1f22 h GLY 32 N 0.00 1.62 -5.18 0.62 0.00 -1.98 -3.42 103.07 94.73 1f22 h GLY 32 Ca 0.00 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.89 1f22 h GLY 32 CO 0.00 0.07 -0.08 -1.59 0.00 0.00 0.00 176.54 174.94 1f22 s THR 33 N -5.94 -0.00 -0.07 4.70 2.01 -1.26 -5.10 115.64 109.97 1f22 s THR 33 Ca -0.12 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.73 1f22 s THR 33 Cb 0.23 -0.80 -0.13 0.00 0.01 0.00 0.00 72.50 71.81 1f22 s THR 33 CO 0.80 0.01 0.63 1.55 -0.69 0.00 0.00 174.62 176.92 1f22 h PRO 34 N 5.81 -0.17 -6.87 4.92 0.13 -1.91 -3.48 132.00 130.43 1f22 h PRO 34 Ca -0.30 0.01 -0.57 0.00 -0.87 0.00 0.00 66.00 64.28 1f22 h PRO 34 Cb 1.18 0.04 -0.28 0.00 0.13 0.00 0.00 31.00 32.07 1f22 h PRO 34 CO 0.17 0.22 -0.85 0.00 -0.23 0.00 0.00 178.00 177.31 1f22 n ALA 35 N -2.64 -1.46 -2.02 -0.56 0.00 -1.26 -4.41 120.51 108.16 1f22 n ALA 35 Ca -0.06 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1f22 n ALA 35 Cb 0.23 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.08 1f22 n ALA 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1f22 n LYS 36 N -3.98 -5.53 0.00 0.00 0.00 -1.26 -5.07 118.16 102.33 1f22 n LYS 36 Ca -0.07 3.95 0.00 0.00 0.00 0.00 0.00 58.31 62.19 1f22 n LYS 36 Cb 0.51 -4.32 0.00 0.00 0.00 0.00 0.00 35.03 31.22 1f22 n LYS 36 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1f22 n ILE 37 N 1.14 0.00 0.00 3.15 2.08 -1.26 -5.08 119.36 119.39 1f22 n ILE 37 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1f22 n ILE 37 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1f22 n ILE 37 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1f22 n ALA 38 N -3.00 0.00 -1.87 -1.39 0.00 -1.26 -5.12 120.51 107.86 1f22 n ALA 38 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1f22 n ALA 38 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1f22 n ALA 38 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1f22 s ILE 39 N 0.00 3.35 0.35 0.00 -1.09 -1.26 -4.97 121.20 117.59 1f22 s ILE 39 Ca 0.00 0.41 0.08 0.00 -2.23 0.00 0.00 60.65 58.91 1f22 s ILE 39 Cb 0.00 -3.33 -0.05 0.00 -1.58 0.00 0.00 42.46 37.51 1f22 s ILE 39 CO 0.00 -0.11 0.13 1.51 -1.23 0.00 0.00 174.94 175.24 1f22 s ASP 40 N 4.81 4.56 0.17 3.58 -4.77 -1.26 -4.92 116.67 118.84 1f22 s ASP 40 Ca 0.82 -0.85 -0.11 0.00 -3.30 0.00 0.00 52.55 49.11 1f22 s ASP 40 Cb -0.33 -0.65 0.20 0.00 -1.09 0.00 0.00 42.92 41.04 1f22 s ASP 40 CO 0.34 -0.33 1.09 2.29 0.70 0.00 0.00 175.17 179.26 1f22 n LYS 41 N -1.13 -0.14 0.01 2.11 2.85 -1.26 -0.31 118.16 120.28 1f22 n LYS 41 Ca -0.03 1.08 -0.01 0.00 -1.05 0.00 0.00 58.31 58.30 1f22 n LYS 41 Cb 0.62 -1.60 -0.01 0.00 -0.65 0.00 0.00 35.03 33.39 1f22 n LYS 41 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1f22 h LYS 42 N 0.00 -0.05 0.09 -1.58 3.64 -1.98 -2.03 116.57 114.66 1f22 h LYS 42 Ca 0.26 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.66 1f22 h LYS 42 Cb 0.44 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1f22 h LYS 42 CO -0.70 -0.03 -0.17 0.77 -2.27 0.00 0.00 179.45 177.05 1f22 h SER 43 N -0.05 -0.48 -0.72 4.20 0.02 -1.62 0.12 113.55 115.02 1f22 h SER 43 Ca -0.00 0.06 0.06 0.00 -0.84 0.00 0.00 61.79 61.07 1f22 h SER 43 Cb 0.04 0.18 -0.09 0.00 0.14 0.00 0.00 62.40 62.68 1f22 h SER 43 CO -0.00 -0.24 -0.42 0.00 -1.14 0.00 0.00 176.83 175.02 1f22 n ALA 44 N -2.45 -0.46 0.67 3.77 0.00 0.57 -0.51 120.51 122.09 1f22 n ALA 44 Ca -0.06 0.61 0.13 0.00 0.00 0.00 0.00 53.44 54.11 1f22 n ALA 44 Cb 0.21 -0.02 0.34 0.00 0.00 0.00 0.00 19.45 19.99 1f22 n ALA 44 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1f22 n HIS 45 N -4.69 0.65 0.00 0.00 8.25 -0.76 -1.06 115.22 117.61 1f22 n HIS 45 Ca 0.01 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 1f22 n HIS 45 Cb 0.19 -0.76 0.00 0.00 1.12 0.00 0.00 29.99 30.54 1f22 n HIS 45 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1f22 n LYS 46 N -2.09 0.00 -3.05 -0.41 0.00 0.39 -4.82 118.16 108.18 1f22 n LYS 46 Ca 0.05 0.31 -0.01 0.00 0.00 0.00 0.00 58.31 58.66 1f22 n LYS 46 Cb 0.42 -0.80 -0.00 0.00 0.00 0.00 0.00 35.03 34.64 1f22 n LYS 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1f22 s ASP 47 N -2.32 -1.47 0.00 3.14 1.01 0.33 -4.77 116.67 112.59 1f22 s ASP 47 Ca 0.00 -1.15 0.00 0.00 0.71 0.00 0.00 52.55 52.11 1f22 s ASP 47 Cb 0.00 1.92 0.00 0.00 1.01 0.00 0.00 42.92 45.85 1f22 s ASP 47 CO 0.00 -0.13 0.00 0.00 0.21 0.00 0.00 175.17 175.25 1f22 n ALA 48 N 3.87 1.55 -0.08 5.23 0.00 -0.93 -4.77 120.51 125.38 1f22 n ALA 48 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.45 1f22 n ALA 48 Cb 0.56 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.93 1f22 n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f22 n LYS 50 N -4.59 2.89 0.00 0.00 4.81 -0.22 -3.01 118.16 118.04 1f22 n LYS 50 Ca -0.14 -1.69 0.00 0.00 -0.87 0.00 0.00 58.31 55.61 1f22 n LYS 50 Cb 0.42 -2.39 0.00 0.00 0.02 0.00 0.00 35.03 33.07 1f22 n LYS 50 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1f22 n THR 51 N 2.91 0.00 -0.14 3.15 5.66 -1.26 -4.70 114.28 119.90 1f22 n THR 51 Ca 0.60 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 61.52 1f22 n THR 51 Cb 0.57 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 69.40 1f22 n THR 51 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1f22 n HIS 53 N -4.13 1.26 -1.64 0.00 8.25 -1.25 -3.73 115.22 113.97 1f22 n HIS 53 Ca 0.01 -2.13 -0.07 0.00 -0.26 0.00 0.00 57.72 55.27 1f22 n HIS 53 Cb 0.41 -1.88 0.15 0.00 1.12 0.00 0.00 29.99 29.79 1f22 n HIS 53 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1f22 n LYS 54 N 3.36 2.21 -2.78 -0.41 4.01 -1.25 -4.55 118.16 118.75 1f22 n LYS 54 Ca 0.54 -3.48 -0.10 0.00 -0.51 0.00 0.00 58.31 54.77 1f22 n LYS 54 Cb 0.41 -1.88 0.07 0.00 -0.51 0.00 0.00 35.03 33.12 1f22 n LYS 54 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1f22 n SER 55 N -1.02 -2.19 0.00 4.39 3.41 -1.24 -4.93 113.62 112.04 1f22 n SER 55 Ca 0.32 -3.56 0.00 0.00 -0.26 0.00 0.00 58.87 55.37 1f22 n SER 55 Cb 0.88 1.69 0.00 0.00 -0.26 0.00 0.00 64.21 66.52 1f22 n SER 55 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1f22 n ASN 56 N 0.64 0.00 -3.11 4.04 0.23 -1.26 -5.16 115.26 110.64 1f22 n ASN 56 Ca 0.08 0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 54.04 1f22 n ASN 56 Cb 0.68 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.39 1f22 n ASN 56 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1f22 s ASN 57 N 0.00 0.04 -0.26 0.53 3.84 -1.26 -5.15 114.94 112.67 1f22 s ASN 57 Ca 0.00 -1.09 -0.01 0.00 0.21 0.00 0.00 52.86 51.97 1f22 s ASN 57 Cb 0.00 0.82 0.08 0.00 -0.55 0.00 0.00 41.25 41.60 1f22 s ASN 57 CO 0.00 -1.60 0.05 -0.83 -2.79 0.00 0.00 177.10 171.93 1f22 s GLY 58 N -3.06 1.02 0.84 1.21 0.00 -1.26 -4.49 107.32 101.58 1f22 s GLY 58 Ca 0.16 -1.34 -0.12 0.00 0.00 0.00 0.00 44.72 43.42 1f22 s GLY 58 CO 0.11 1.42 1.11 2.56 0.00 0.00 0.00 173.10 178.30 1f22 s PRO 59 N 1.63 1.73 0.13 2.90 0.04 -1.26 -5.01 135.00 135.17 1f22 s PRO 59 Ca 0.04 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1f22 s PRO 59 Cb -0.18 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1f22 s PRO 59 CO -0.16 -1.84 0.00 -2.37 0.04 0.00 0.00 177.00 172.67 1f22 n THR 60 N -3.56 0.00 -2.73 1.26 5.66 -1.26 -5.01 114.28 108.64 1f22 n THR 60 Ca 0.07 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 61.01 1f22 n THR 60 Cb 0.57 -0.36 0.04 0.00 -1.55 0.00 0.00 70.33 69.03 1f22 n THR 60 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1f22 n LYS 61 N -2.87 0.53 0.00 1.09 -0.00 -1.26 -5.12 118.16 110.53 1f22 n LYS 61 Ca 0.00 -1.56 0.00 0.00 -0.00 0.00 0.00 58.31 56.75 1f22 n LYS 61 Cb 0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 35.03 33.93 1f22 n LYS 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1f22 n GLY 63 N 0.00 1.57 0.32 0.00 0.00 -1.26 -4.78 105.19 101.04 1f22 n GLY 63 Ca 0.00 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 45.93 1f22 n GLY 63 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1f22 h GLY 64 N 0.00 0.49 0.00 -0.02 0.00 -1.96 -3.36 103.07 98.22 1f22 h GLY 64 Ca 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.61 1f22 h GLY 64 CO 0.00 -0.30 -1.12 0.00 0.00 0.00 0.00 176.54 175.13 1f22 s HIS 66 N -2.04 3.42 -0.67 0.00 3.76 -1.26 -2.82 115.29 115.68 1f22 s HIS 66 Ca -0.03 1.52 -0.25 0.00 -0.15 0.00 0.00 55.06 56.15 1f22 s HIS 66 Cb 0.01 -3.23 0.04 0.00 1.11 0.00 0.00 32.58 30.51 1f22 s HIS 66 CO 0.04 -0.36 1.13 0.42 -0.85 0.00 0.00 174.74 175.12 1f22 s ILE 67 N 2.66 4.02 0.00 0.60 -1.09 -0.45 -4.43 121.20 122.50 1f22 s ILE 67 Ca 0.46 0.22 0.00 0.00 -2.23 0.00 0.00 60.65 59.10 1f22 s ILE 67 Cb -0.16 -4.78 0.00 0.00 -1.58 0.00 0.00 42.46 35.93 1f22 s ILE 67 CO 0.11 -1.59 0.00 1.17 -1.23 0.00 0.00 174.94 173.40