#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfb s LEU 24 N 0.00 3.76 -0.13 0.64 1.43 -1.26 -5.06 118.68 118.06 1pfb s LEU 24 Ca 0.00 1.70 -0.09 0.00 -1.03 0.00 0.00 54.13 54.71 1pfb s LEU 24 Cb 0.00 -4.53 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 1pfb s LEU 24 CO 0.00 -0.61 0.18 -0.69 0.23 0.00 0.00 176.35 175.46 1pfb s VAL 25 N -2.34 5.42 0.16 -1.59 1.01 -1.26 -5.10 120.40 116.70 1pfb s VAL 25 Ca 0.62 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.90 1pfb s VAL 25 Cb -0.11 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1pfb s VAL 25 CO 0.24 0.56 0.05 -0.31 0.00 0.00 0.00 175.10 175.64 1pfb s TYR 26 N -0.62 1.06 -0.19 5.22 2.02 -1.26 -5.12 117.35 118.45 1pfb s TYR 26 Ca 0.15 -1.18 -0.29 0.00 -0.37 0.00 0.00 57.07 55.37 1pfb s TYR 26 Cb -0.12 -0.59 0.00 0.00 -0.40 0.00 0.00 41.96 40.85 1pfb s TYR 26 CO 0.04 -0.43 1.02 0.00 -1.57 0.00 0.00 175.55 174.61 1pfb s ALA 27 N -3.92 3.60 -0.15 3.71 0.00 -1.26 -5.02 121.76 118.72 1pfb s ALA 27 Ca 0.27 0.22 -0.08 0.00 0.00 0.00 0.00 51.96 52.37 1pfb s ALA 27 Cb 0.07 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 1pfb s ALA 27 CO 0.05 -0.91 0.13 0.00 0.00 0.00 0.00 175.76 175.03 1pfb s ALA 28 N 2.82 3.80 -0.12 0.00 0.00 -1.26 -1.43 121.76 125.57 1pfb s ALA 28 Ca 0.45 -0.66 -0.18 0.00 0.00 0.00 0.00 51.96 51.57 1pfb s ALA 28 Cb -0.16 -2.04 -0.16 0.00 0.00 0.00 0.00 23.12 20.76 1pfb s ALA 28 CO 0.10 0.44 0.51 1.49 0.00 0.00 0.00 175.76 178.29 1pfb h GLU 29 N 5.64 -0.02 -2.19 0.00 4.81 -0.91 -3.43 114.58 118.48 1pfb h GLU 29 Ca -0.49 0.00 0.17 0.00 -0.13 0.00 0.00 59.36 58.91 1pfb h GLU 29 Cb 1.20 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.47 1pfb h GLU 29 CO 0.65 0.57 0.54 -1.59 -0.73 0.00 0.00 179.01 178.44 1pfb s LYS 30 N -2.10 0.94 -0.15 1.92 -2.85 -1.05 -5.01 119.74 111.44 1pfb s LYS 30 Ca -0.12 -0.46 -0.08 0.00 -1.00 0.00 0.00 55.97 54.31 1pfb s LYS 30 Cb -0.02 0.36 -0.04 0.00 -2.06 0.00 0.00 37.83 36.07 1pfb s LYS 30 CO 0.42 -0.42 0.13 0.42 0.10 0.00 0.00 175.35 175.99 1pfb s ILE 31 N -3.10 5.38 -0.19 3.79 1.01 -1.26 -0.87 121.20 125.96 1pfb s ILE 31 Ca 0.10 0.17 0.07 0.00 0.00 0.00 0.00 60.65 60.98 1pfb s ILE 31 Cb -0.01 -3.38 -0.08 0.00 0.01 0.00 0.00 42.46 39.00 1pfb s ILE 31 CO -0.03 0.55 0.22 2.30 0.00 0.00 0.00 174.94 177.99 1pfb n ILE 32 N 2.55 0.00 -3.70 2.92 -5.35 -0.13 -4.84 119.36 110.80 1pfb n ILE 32 Ca -0.19 -0.27 -0.11 0.00 -0.27 0.00 0.00 62.75 61.92 1pfb n ILE 32 Cb 0.54 0.73 -0.06 0.00 -1.74 0.00 0.00 39.64 39.11 1pfb n ILE 32 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1pfb s GLN 33 N -1.96 0.95 -0.02 6.28 -0.21 -1.25 -4.98 119.66 118.47 1pfb s GLN 33 Ca 0.00 -0.61 0.04 0.00 0.02 0.00 0.00 55.36 54.82 1pfb s GLN 33 Cb 0.05 0.41 -0.01 0.00 1.00 0.00 0.00 33.01 34.46 1pfb s GLN 33 CO 0.27 -0.34 -0.14 0.21 -2.12 0.00 0.00 175.29 173.18 1pfb s LYS 34 N -3.20 1.20 -0.04 2.91 2.20 -1.26 -1.12 119.74 120.43 1pfb s LYS 34 Ca -0.01 -0.49 0.01 0.00 -0.36 0.00 0.00 55.97 55.12 1pfb s LYS 34 Cb 0.01 -1.13 0.02 0.00 -1.51 0.00 0.00 37.83 35.22 1pfb s LYS 34 CO -0.08 0.27 -0.02 0.50 -0.36 0.00 0.00 175.35 175.67 1pfb s ARG 35 N -0.21 0.56 -0.16 4.03 3.52 0.15 -5.00 118.95 121.83 1pfb s ARG 35 Ca 0.03 -0.00 0.01 0.00 -0.13 0.00 0.00 55.73 55.63 1pfb s ARG 35 Cb -0.07 -0.67 0.02 0.00 -1.56 0.00 0.00 34.95 32.68 1pfb s ARG 35 CO -0.00 -0.12 -0.15 0.08 -0.81 0.00 0.00 175.30 174.30 1pfb s VAL 36 N 1.03 1.71 -0.07 7.11 1.01 -1.26 -0.74 120.40 129.19 1pfb s VAL 36 Ca -0.10 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.12 1pfb s VAL 36 Cb -0.14 -1.61 0.03 0.00 0.00 0.00 0.00 36.38 34.66 1pfb s VAL 36 CO -0.01 0.44 -0.01 -0.54 0.00 0.00 0.00 175.10 174.98 1pfb s LYS 37 N 1.42 0.66 -1.49 2.72 1.02 -0.65 -4.84 119.74 118.57 1pfb s LYS 37 Ca 0.04 0.06 -0.06 0.00 0.02 0.00 0.00 55.97 56.03 1pfb s LYS 37 Cb -0.13 -0.95 0.05 0.00 -0.52 0.00 0.00 37.83 36.28 1pfb s LYS 37 CO -0.11 -0.26 0.58 1.63 -0.92 0.00 0.00 175.35 176.27 1pfb n LYS 38 N 4.92 -3.54 -0.47 1.68 5.02 -1.26 -0.88 118.16 123.62 1pfb n LYS 38 Ca -0.11 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 1pfb n LYS 38 Cb 0.50 -4.80 0.00 0.00 -0.02 0.00 0.00 35.03 30.71 1pfb n LYS 38 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pfb n GLY 39 N -1.79 1.82 3.61 0.72 0.00 -1.26 -4.99 105.19 103.29 1pfb n GLY 39 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1pfb n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pfb s VAL 40 N -3.25 5.02 -0.20 1.61 1.01 -0.06 -5.05 120.40 119.47 1pfb s VAL 40 Ca 0.00 0.87 -0.12 0.00 0.00 0.00 0.00 61.98 62.73 1pfb s VAL 40 Cb 0.00 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 1pfb s VAL 40 CO 0.00 0.00 0.23 -0.69 0.00 0.00 0.00 175.10 174.64 1pfb s VAL 41 N 2.42 5.33 0.10 2.92 1.01 -1.26 -1.64 120.40 129.27 1pfb s VAL 41 Ca 0.23 0.37 0.05 0.00 0.00 0.00 0.00 61.98 62.62 1pfb s VAL 41 Cb -0.15 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1pfb s VAL 41 CO 0.10 0.37 -0.12 -1.61 0.00 0.00 0.00 175.10 173.84 1pfb s GLU 42 N 0.75 0.89 -0.01 2.72 2.02 0.08 -1.42 118.70 123.73 1pfb s GLU 42 Ca 0.12 -1.13 0.04 0.00 0.02 0.00 0.00 54.97 54.02 1pfb s GLU 42 Cb -0.13 -0.71 -0.01 0.00 0.10 0.00 0.00 34.13 33.39 1pfb s GLU 42 CO 0.03 0.13 -0.12 0.71 0.02 0.00 0.00 175.26 176.03 1pfb s TYR 43 N -2.07 1.08 -0.33 1.61 2.02 -0.07 -0.67 117.35 118.93 1pfb s TYR 43 Ca 0.05 -0.21 -0.21 0.00 -0.37 0.00 0.00 57.07 56.33 1pfb s TYR 43 Cb -0.05 -0.70 -0.00 0.00 -0.40 0.00 0.00 41.96 40.81 1pfb s TYR 43 CO 0.01 -0.02 0.67 0.50 -1.57 0.00 0.00 175.55 175.14 1pfb s ARG 44 N -0.27 3.82 -0.16 -0.62 6.06 -0.27 -0.68 118.95 126.82 1pfb s ARG 44 Ca 0.04 0.26 -0.07 0.00 -2.50 0.00 0.00 55.73 53.46 1pfb s ARG 44 Cb -0.05 -3.76 -0.04 0.00 0.06 0.00 0.00 34.95 31.16 1pfb s ARG 44 CO -0.00 -0.66 0.07 0.08 -2.50 0.00 0.00 175.30 172.29 1pfb s VAL 45 N 2.73 4.92 -0.30 7.11 1.01 0.56 -0.96 120.40 135.47 1pfb s VAL 45 Ca 0.26 0.01 -0.12 0.00 0.00 0.00 0.00 61.98 62.13 1pfb s VAL 45 Cb -0.14 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1pfb s VAL 45 CO 0.13 0.50 0.24 -0.75 0.00 0.00 0.00 175.10 175.23 1pfb s LYS 46 N -0.00 3.81 0.10 2.72 2.47 -0.05 -2.11 119.74 126.68 1pfb s LYS 46 Ca 0.07 -0.36 -0.20 0.00 -1.56 0.00 0.00 55.97 53.92 1pfb s LYS 46 Cb -0.12 -3.71 -0.07 0.00 -1.46 0.00 0.00 37.83 32.47 1pfb s LYS 46 CO 0.01 -0.29 0.62 -1.58 0.16 0.00 0.00 175.35 174.26 1pfb s TRP 47 N 1.82 3.82 0.14 4.03 0.52 -1.26 -0.29 118.94 127.71 1pfb s TRP 47 Ca 0.08 1.35 -0.31 0.00 0.02 0.00 0.00 56.10 57.24 1pfb s TRP 47 Cb -0.16 -2.55 -0.10 0.00 -1.15 0.00 0.00 33.47 29.50 1pfb s TRP 47 CO 0.11 0.56 1.65 0.21 0.02 0.00 0.00 176.95 179.49 1pfb s LYS 48 N -1.18 4.19 0.00 4.98 2.20 -0.51 -2.11 119.74 127.31 1pfb s LYS 48 Ca 0.31 2.42 0.00 0.00 -0.36 0.00 0.00 55.97 58.34 1pfb s LYS 48 Cb -0.20 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 1pfb s LYS 48 CO 0.21 -0.69 0.00 0.41 -0.36 0.00 0.00 175.35 174.91 1pfb n GLY 49 N 3.91 0.87 3.29 5.54 0.00 -1.26 -4.89 105.19 112.65 1pfb n GLY 49 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1pfb n GLY 49 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pfb s TRP 50 N -3.44 2.61 0.46 1.61 0.52 -0.90 -5.10 118.94 114.70 1pfb s TRP 50 Ca 0.00 -0.80 -0.23 0.00 0.02 0.00 0.00 56.10 55.09 1pfb s TRP 50 Cb 0.00 -1.71 -0.10 0.00 -1.15 0.00 0.00 33.47 30.50 1pfb s TRP 50 CO 0.00 -0.28 0.87 -1.71 0.02 0.00 0.00 176.95 175.85 1pfb n ASN 51 N 3.31 0.56 0.13 2.95 2.85 -1.26 -4.56 115.26 119.24 1pfb n ASN 51 Ca -0.18 0.95 0.10 0.00 -0.11 0.00 0.00 54.58 55.34 1pfb n ASN 51 Cb 0.53 -1.29 0.49 0.00 1.24 0.00 0.00 39.78 40.74 1pfb n ASN 51 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pfb n GLN 52 N 0.06 0.13 0.20 1.20 10.64 -1.26 -1.01 117.38 127.34 1pfb n GLN 52 Ca 0.11 0.56 0.14 0.00 -1.83 0.00 0.00 57.00 55.98 1pfb n GLN 52 Cb 0.41 -1.87 0.65 0.00 -0.86 0.00 0.00 30.24 28.56 1pfb n GLN 52 CO 0.00 0.00 0.00 0.07 -1.83 0.00 0.00 177.06 175.30 1pfb h ARG 53 N 0.00 0.00 -0.62 2.61 0.11 -2.01 -1.67 114.38 112.80 1pfb h ARG 53 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1pfb h ARG 53 Cb 0.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 1pfb h ARG 53 CO 0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 1pfb n TYR 54 N -2.53 0.87 -1.55 4.08 4.01 -0.18 -4.96 117.16 116.89 1pfb n TYR 54 Ca 0.00 -0.42 -0.36 0.00 -0.16 0.00 0.00 57.90 56.96 1pfb n TYR 54 Cb 0.18 -0.02 0.08 0.00 -0.31 0.00 0.00 39.34 39.27 1pfb n TYR 54 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1pfb n ASN 55 N 1.28 1.26 -4.16 7.72 3.02 -0.63 -4.86 115.26 118.88 1pfb n ASN 55 Ca 0.21 0.76 -0.12 0.00 -0.03 0.00 0.00 54.58 55.39 1pfb n ASN 55 Cb 0.54 -1.47 -0.10 0.00 -0.61 0.00 0.00 39.78 38.13 1pfb n ASN 55 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1pfb s THR 56 N -1.59 0.76 -0.13 3.41 -4.23 -0.90 -4.94 115.64 108.02 1pfb s THR 56 Ca 0.78 -1.72 -0.18 0.00 -1.18 0.00 0.00 61.69 59.39 1pfb s THR 56 Cb -0.37 -1.42 -0.04 0.00 1.34 0.00 0.00 72.50 72.01 1pfb s THR 56 CO 0.45 -0.70 0.48 0.26 -0.54 0.00 0.00 174.62 174.57 1pfb s TRP 57 N -2.91 3.49 0.01 3.99 0.52 -1.26 -0.33 118.94 122.46 1pfb s TRP 57 Ca 0.07 0.87 0.06 0.00 0.02 0.00 0.00 56.10 57.11 1pfb s TRP 57 Cb 0.00 -2.56 -0.02 0.00 -1.15 0.00 0.00 33.47 29.74 1pfb s TRP 57 CO -0.02 0.13 -0.17 -1.21 0.02 0.00 0.00 176.95 175.70 1pfb s GLU 58 N 0.77 1.28 0.67 4.98 0.41 0.14 -4.93 118.70 122.01 1pfb s GLU 58 Ca 0.26 -0.72 -0.15 0.00 -0.41 0.00 0.00 54.97 53.94 1pfb s GLU 58 Cb -0.15 -1.29 0.00 0.00 -1.78 0.00 0.00 34.13 30.92 1pfb s GLU 58 CO 0.10 0.34 1.14 -1.25 -0.49 0.00 0.00 175.26 175.10 1pfb s PRO 59 N -0.74 2.68 0.39 0.39 0.04 -1.26 -0.89 135.00 135.60 1pfb s PRO 59 Ca 0.06 1.52 0.15 0.00 0.04 0.00 0.00 61.00 62.77 1pfb s PRO 59 Cb -0.07 -1.92 1.00 0.00 0.04 0.00 0.00 34.50 33.55 1pfb s PRO 59 CO 0.00 -1.37 1.83 1.49 0.04 0.00 0.00 177.00 178.99 1pfb h GLU 60 N 0.07 0.48 0.00 4.56 4.81 -1.60 0.88 114.58 123.79 1pfb h GLU 60 Ca -0.47 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1pfb h GLU 60 Cb 1.26 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 1pfb h GLU 60 CO 0.53 0.32 -0.02 -0.24 -0.73 0.00 0.00 179.01 178.87 1pfb h VAL 61 N 0.49 0.21 -0.00 0.32 3.04 -1.90 -1.28 116.25 117.13 1pfb h VAL 61 Ca 0.51 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 66.08 1pfb h VAL 61 Cb 1.13 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.51 1pfb h VAL 61 CO -0.23 0.02 -0.27 0.59 -1.01 0.00 0.00 177.57 176.66 1pfb n ASN 62 N -3.35 0.31 -4.50 3.17 4.13 0.30 -4.45 115.26 110.87 1pfb n ASN 62 Ca -0.03 0.01 -0.43 0.00 1.68 0.00 0.00 54.58 55.81 1pfb n ASN 62 Cb 0.12 -0.07 -0.01 0.00 -1.54 0.00 0.00 39.78 38.28 1pfb n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1pfb s ILE 63 N -2.96 4.67 0.15 2.41 -1.09 -0.48 -4.81 121.20 119.09 1pfb s ILE 63 Ca 0.14 -2.16 -0.16 0.00 -2.23 0.00 0.00 60.65 56.24 1pfb s ILE 63 Cb 0.18 -4.98 0.02 0.00 -1.58 0.00 0.00 42.46 36.10 1pfb s ILE 63 CO 0.61 -1.73 1.78 -0.07 -1.23 0.00 0.00 174.94 174.30 1pfb h LEU 64 N 10.78 0.52 -8.57 2.97 3.38 -1.83 -3.39 115.31 119.16 1pfb h LEU 64 Ca 0.32 -0.06 -0.66 0.00 0.09 0.00 0.00 57.88 57.57 1pfb h LEU 64 Cb 0.90 -0.13 -0.16 0.00 0.09 0.00 0.00 40.66 41.37 1pfb h LEU 64 CO 1.29 0.42 0.11 -0.62 0.09 0.00 0.00 178.44 179.74 1pfb s ASP 65 N -5.67 6.31 0.63 -0.43 -1.08 -1.26 -4.93 116.67 110.24 1pfb s ASP 65 Ca -0.13 -0.41 0.37 0.00 -0.52 0.00 0.00 52.55 51.86 1pfb s ASP 65 Cb 0.11 -2.31 2.09 0.00 -1.46 0.00 0.00 42.92 41.34 1pfb s ASP 65 CO 0.74 -0.79 2.27 -0.09 0.52 0.00 0.00 175.17 177.82 1pfb h ARG 66 N 8.89 0.00 -0.57 4.34 2.43 -2.02 -1.78 114.38 125.66 1pfb h ARG 66 Ca -0.26 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 59.05 1pfb h ARG 66 Cb 1.10 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.62 1pfb h ARG 66 CO 0.90 0.00 0.40 0.00 -1.51 0.00 0.00 179.97 179.76 1pfb h ARG 67 N 0.00 0.18 -0.84 0.20 3.08 -1.95 0.22 114.38 115.27 1pfb h ARG 67 Ca 0.01 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.07 1pfb h ARG 67 Cb 0.10 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1pfb h ARG 67 CO -0.00 0.12 0.55 -0.07 -1.07 0.00 0.00 179.97 179.50 1pfb h LEU 68 N 0.19 0.93 0.09 3.04 3.38 -1.72 0.22 115.31 121.43 1pfb h LEU 68 Ca 0.27 -0.01 -0.29 0.00 0.09 0.00 0.00 57.88 57.94 1pfb h LEU 68 Cb 0.83 -0.22 0.03 0.00 0.09 0.00 0.00 40.66 41.39 1pfb h LEU 68 CO -0.05 0.65 -1.18 0.40 0.09 0.00 0.00 178.44 178.36 1pfb h ILE 69 N 1.09 1.29 -0.51 1.22 2.04 -1.25 -2.80 117.51 118.58 1pfb h ILE 69 Ca 0.33 -2.40 0.03 0.00 1.00 0.00 0.00 64.86 63.81 1pfb h ILE 69 Cb -0.05 2.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.64 1pfb h ILE 69 CO -0.10 0.73 0.30 0.44 0.00 0.00 0.00 178.15 179.53 1pfb h ASP 70 N 0.27 0.49 -0.60 1.72 3.32 -0.76 0.55 116.42 121.42 1pfb h ASP 70 Ca -0.17 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 1pfb h ASP 70 Cb 1.85 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 41.28 1pfb h ASP 70 CO 0.23 0.34 0.19 0.40 -1.72 0.00 0.00 179.24 178.68 1pfb h ILE 71 N 0.60 1.24 -0.47 0.35 2.04 -1.04 -2.57 117.51 117.66 1pfb h ILE 71 Ca 0.21 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1pfb h ILE 71 Cb 0.03 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 1pfb h ILE 71 CO -0.10 0.31 0.30 0.22 0.00 0.00 0.00 178.15 178.88 1pfb h TYR 72 N 0.85 0.61 0.00 1.37 3.20 -1.13 -2.30 116.97 119.57 1pfb h TYR 72 Ca 0.19 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.07 1pfb h TYR 72 Cb 0.29 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.35 1pfb h TYR 72 CO 0.02 0.41 0.00 0.39 -1.64 0.00 0.00 178.16 177.34 1pfb n GLU 73 N -4.73 0.17 0.24 1.82 1.02 0.13 -2.27 120.64 117.03 1pfb n GLU 73 Ca 0.02 0.50 0.11 0.00 -0.02 0.00 0.00 57.16 57.77 1pfb n GLU 73 Cb 0.04 -1.90 0.61 0.00 -0.02 0.00 0.00 31.44 30.17 1pfb n GLU 73 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1pfb h GLN 74 N 0.00 0.00 0.00 3.49 4.20 -1.02 -3.19 115.11 118.59 1pfb h GLN 74 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1pfb h GLN 74 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1pfb h GLN 74 CO 0.00 0.18 -0.15 0.25 -0.67 0.00 0.00 178.83 178.44 1pfb n THR 75 N -3.58 1.00 -3.48 -0.54 -2.24 -0.96 -4.93 114.28 99.55 1pfb n THR 75 Ca -0.01 -1.17 -0.28 0.00 -2.27 0.00 0.00 64.05 60.31 1pfb n THR 75 Cb 0.32 0.22 -0.13 0.00 -2.10 0.00 0.00 70.33 68.64 1pfb n THR 75 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1pfb s ASN 76 N -1.74 3.02 0.00 3.42 0.01 -1.04 -5.13 114.94 113.47 1pfb s ASN 76 Ca 0.14 -1.89 0.16 0.00 -0.71 0.00 0.00 52.86 50.56 1pfb s ASN 76 Cb 0.13 -0.32 0.93 0.00 0.41 0.00 0.00 41.25 42.39 1pfb s ASN 76 CO 0.01 -0.34 1.34 2.29 -1.51 0.00 0.00 177.10 178.89