#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuu s SER 2 N 0.00 -0.55 0.12 1.61 0.15 -1.26 -5.18 113.70 108.59 2yuu s SER 2 Ca 0.00 0.84 -0.24 0.00 0.70 0.00 0.00 55.95 57.25 2yuu s SER 2 Cb 0.00 0.78 0.07 0.00 -1.71 0.00 0.00 66.02 65.17 2yuu s SER 2 CO 0.00 -0.33 0.64 -0.94 1.20 0.00 0.00 173.24 173.81 2yuu s SER 3 N -0.41 -0.56 0.00 5.45 1.04 -1.26 -5.17 113.70 112.79 2yuu s SER 3 Ca -0.02 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2yuu s SER 3 Cb -0.03 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2yuu s SER 3 CO 0.01 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 173.95 2yuu n GLY 4 N -0.21 -0.63 3.27 7.32 0.00 -1.26 -5.12 105.19 108.56 2yuu n GLY 4 Ca -0.16 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 2yuu n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuu s SER 5 N -4.00 4.00 0.01 1.61 0.01 -1.26 -5.10 113.70 108.97 2yuu s SER 5 Ca 0.00 -0.45 -0.01 0.00 1.31 0.00 0.00 55.95 56.80 2yuu s SER 5 Cb 0.00 -1.67 -0.01 0.00 0.21 0.00 0.00 66.02 64.55 2yuu s SER 5 CO 0.00 -0.01 -0.00 -0.94 0.41 0.00 0.00 173.24 172.70 2yuu s SER 6 N 1.39 0.16 -0.27 2.44 1.04 -1.26 -5.14 113.70 112.06 2yuu s SER 6 Ca 0.05 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.13 2yuu s SER 6 Cb -0.14 0.10 0.05 0.00 0.10 0.00 0.00 66.02 66.13 2yuu s SER 6 CO -0.05 -0.25 -0.06 -0.83 0.98 0.00 0.00 173.24 173.03 2yuu s GLY 7 N -1.14 1.68 -0.30 7.32 0.00 -1.26 -5.05 107.32 108.57 2yuu s GLY 7 Ca -0.12 -1.70 -0.08 0.00 0.00 0.00 0.00 44.72 42.82 2yuu s GLY 7 CO -0.01 0.62 0.78 1.25 0.00 0.00 0.00 173.10 175.75 2yuu s LYS 8 N 1.21 0.43 -0.39 2.90 2.47 -1.26 -5.13 119.74 119.97 2yuu s LYS 8 Ca -0.06 0.88 -0.14 0.00 -1.56 0.00 0.00 55.97 55.10 2yuu s LYS 8 Cb -0.19 0.50 0.02 0.00 -1.46 0.00 0.00 37.83 36.70 2yuu s LYS 8 CO -0.04 -0.36 0.27 -0.65 0.16 0.00 0.00 175.35 174.73 2yuu s GLN 9 N 2.82 3.03 0.73 4.03 -1.52 -1.26 -5.08 119.66 122.41 2yuu s GLN 9 Ca 0.07 -0.97 -0.09 0.00 -1.95 0.00 0.00 55.36 52.43 2yuu s GLN 9 Cb -0.12 -3.89 0.06 0.00 -0.22 0.00 0.00 33.01 28.84 2yuu s GLN 9 CO -0.18 -0.68 1.07 0.00 -0.25 0.00 0.00 175.29 175.24 2yuu s ALA 10 N 1.66 2.99 -0.01 6.09 0.00 -1.26 -5.11 121.76 126.12 2yuu s ALA 10 Ca 0.04 -0.78 -0.18 0.00 0.00 0.00 0.00 51.96 51.05 2yuu s ALA 10 Cb -0.19 -2.75 0.03 0.00 0.00 0.00 0.00 23.12 20.22 2yuu s ALA 10 CO 0.09 -1.38 0.38 -1.59 0.00 0.00 0.00 175.76 173.27 2yuu s LYS 11 N -5.34 0.77 -0.14 0.00 -2.85 -1.26 -5.12 119.74 105.80 2yuu s LYS 11 Ca 0.60 -0.17 -0.05 0.00 -1.00 0.00 0.00 55.97 55.36 2yuu s LYS 11 Cb -0.11 0.35 -0.03 0.00 -2.06 0.00 0.00 37.83 35.97 2yuu s LYS 11 CO 0.47 -0.23 0.02 0.42 0.10 0.00 0.00 175.35 176.13 2yuu s ILE 12 N -1.55 4.46 -0.48 3.79 1.01 -1.26 -4.07 121.20 123.09 2yuu s ILE 12 Ca -0.11 -0.17 -0.17 0.00 0.00 0.00 0.00 60.65 60.20 2yuu s ILE 12 Cb -0.03 -2.95 0.07 0.00 0.01 0.00 0.00 42.46 39.56 2yuu s ILE 12 CO 0.04 0.53 0.46 -1.00 0.00 0.00 0.00 174.94 174.97 2yuu s HIS 13 N -0.14 3.19 -0.34 3.97 3.76 -0.85 -4.95 115.29 119.93 2yuu s HIS 13 Ca 0.05 -0.81 -0.06 0.00 -0.15 0.00 0.00 55.06 54.09 2yuu s HIS 13 Cb -0.12 -3.27 -0.19 0.00 1.11 0.00 0.00 32.58 30.10 2yuu s HIS 13 CO 0.02 -0.86 3.02 0.66 -0.85 0.00 0.00 174.74 176.73 2yuu n TYR 14 N 5.49 0.51 -3.25 1.40 4.02 -1.25 -3.25 117.16 120.82 2yuu n TYR 14 Ca -0.11 -1.62 -0.36 0.00 -0.01 0.00 0.00 57.90 55.80 2yuu n TYR 14 Cb 0.44 -1.61 -0.06 0.00 -0.02 0.00 0.00 39.34 38.09 2yuu n TYR 14 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2yuu s ILE 15 N 1.63 4.74 -0.82 -0.72 1.09 -1.25 -4.07 121.20 121.81 2yuu s ILE 15 Ca 0.57 1.04 -0.10 0.00 -1.10 0.00 0.00 60.65 61.06 2yuu s ILE 15 Cb 0.24 -3.80 0.10 0.00 -1.06 0.00 0.00 42.46 37.94 2yuu s ILE 15 CO -0.01 0.26 0.26 0.29 -0.10 0.00 0.00 174.94 175.64 2yuu n LYS 16 N 0.87 -2.10 -3.31 2.79 4.76 -1.26 0.19 118.16 120.11 2yuu n LYS 16 Ca -0.05 0.08 -0.18 0.00 -2.87 0.00 0.00 58.31 55.30 2yuu n LYS 16 Cb 0.51 -4.62 0.06 0.00 -1.84 0.00 0.00 35.03 29.14 2yuu n LYS 16 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2yuu n ASN 17 N -1.92 -5.12 -4.09 4.39 4.13 -1.26 -2.98 115.26 108.41 2yuu n ASN 17 Ca 0.05 -0.41 -0.26 0.00 1.68 0.00 0.00 54.58 55.64 2yuu n ASN 17 Cb 0.48 -3.93 -0.05 0.00 -1.54 0.00 0.00 39.78 34.74 2yuu n ASN 17 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2yuu n HIS 18 N -4.33 0.91 -2.21 3.10 8.25 0.52 -3.25 115.22 118.21 2yuu n HIS 18 Ca -0.01 -1.98 0.01 0.00 -0.26 0.00 0.00 57.72 55.49 2yuu n HIS 18 Cb 0.55 -0.26 0.09 0.00 1.12 0.00 0.00 29.99 31.49 2yuu n HIS 18 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2yuu n GLU 19 N -0.99 1.11 -1.32 -0.41 1.02 -1.24 -3.78 120.64 115.02 2yuu n GLU 19 Ca -0.16 -2.85 -0.58 0.00 -0.02 0.00 0.00 57.16 53.54 2yuu n GLU 19 Cb 0.51 -0.97 -0.11 0.00 -0.02 0.00 0.00 31.44 30.85 2yuu n GLU 19 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2yuu n PHE 20 N -0.29 1.30 -4.14 -0.32 3.72 -1.20 -4.16 117.46 112.37 2yuu n PHE 20 Ca 0.14 0.68 -0.35 0.00 -0.05 0.00 0.00 57.45 57.87 2yuu n PHE 20 Cb 0.94 -2.34 -0.12 0.00 -0.94 0.00 0.00 39.48 37.02 2yuu n PHE 20 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2yuu s ILE 21 N 6.08 4.14 -0.08 4.37 1.01 -1.05 -2.01 121.20 133.66 2yuu s ILE 21 Ca 1.17 -0.26 -0.38 0.00 0.00 0.00 0.00 60.65 61.18 2yuu s ILE 21 Cb -1.35 -2.86 -0.16 0.00 0.01 0.00 0.00 42.46 38.10 2yuu s ILE 21 CO 0.63 0.45 1.59 0.00 0.00 0.00 0.00 174.94 177.60 2yuu n ALA 22 N 3.93 -0.28 -2.95 9.38 0.00 -1.26 -3.28 120.51 126.05 2yuu n ALA 22 Ca -0.17 0.43 -0.10 0.00 0.00 0.00 0.00 53.44 53.60 2yuu n ALA 22 Cb 0.52 -2.20 -0.10 0.00 0.00 0.00 0.00 19.45 17.67 2yuu n ALA 22 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2yuu s THR 23 N 2.19 0.11 -0.44 0.00 -1.32 -1.24 -4.97 115.64 109.97 2yuu s THR 23 Ca 0.91 -0.88 -0.16 0.00 -1.21 0.00 0.00 61.69 60.35 2yuu s THR 23 Cb -0.96 -0.53 0.04 0.00 -1.51 0.00 0.00 72.50 69.54 2yuu s THR 23 CO 0.55 -0.48 0.37 0.12 -2.21 0.00 0.00 174.62 172.96 2yuu s PHE 24 N -1.78 3.22 -0.09 9.09 5.36 -1.26 -3.66 117.98 128.86 2yuu s PHE 24 Ca -0.12 -0.70 -0.04 0.00 -0.96 0.00 0.00 56.93 55.11 2yuu s PHE 24 Cb -0.06 -2.91 -0.01 0.00 -0.34 0.00 0.00 43.02 39.70 2yuu s PHE 24 CO -0.01 -0.71 -0.07 0.74 -1.46 0.00 0.00 175.22 173.71 2yuu h PHE 25 N 8.71 0.00 0.00 10.12 -1.00 -1.94 -3.48 116.94 129.35 2yuu h PHE 25 Ca -0.28 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.50 2yuu h PHE 25 Cb 1.11 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.67 2yuu h PHE 25 CO 0.60 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.71 2yuu n GLY 26 N 1.73 1.40 3.90 -1.45 0.00 -1.26 -4.96 105.19 104.56 2yuu n GLY 26 Ca -0.03 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 2yuu n GLY 26 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2yuu s GLN 27 N 0.00 3.65 -1.04 1.61 -2.07 -1.26 -3.84 119.66 116.71 2yuu s GLN 27 Ca 0.00 0.02 -0.24 0.00 -1.82 0.00 0.00 55.36 53.32 2yuu s GLN 27 Cb 0.00 -2.66 -0.07 0.00 -1.09 0.00 0.00 33.01 29.19 2yuu s GLN 27 CO 0.00 0.24 1.94 -1.25 -1.32 0.00 0.00 175.29 174.90 2yuu s PRO 28 N -3.43 2.52 0.67 9.60 0.04 -1.25 -4.16 135.00 138.99 2yuu s PRO 28 Ca 0.44 -0.70 -0.05 0.00 0.04 0.00 0.00 61.00 60.73 2yuu s PRO 28 Cb -0.11 -5.15 0.06 0.00 0.04 0.00 0.00 34.50 29.34 2yuu s PRO 28 CO 0.29 -3.67 0.95 0.99 0.04 0.00 0.00 177.00 175.60 2yuu s THR 29 N 10.54 2.37 -0.04 1.26 2.01 -0.67 -4.59 115.64 126.52 2yuu s THR 29 Ca 0.69 -0.37 -0.18 0.00 0.31 0.00 0.00 61.69 62.14 2yuu s THR 29 Cb -0.04 -3.00 -0.05 0.00 0.01 0.00 0.00 72.50 69.42 2yuu s THR 29 CO 0.06 0.00 0.51 0.12 -0.69 0.00 0.00 174.62 174.62 2yuu s PHE 30 N -3.13 3.64 0.32 4.92 5.36 -1.26 0.07 117.98 127.91 2yuu s PHE 30 Ca 0.60 1.05 0.02 0.00 -0.96 0.00 0.00 56.93 57.64 2yuu s PHE 30 Cb -0.11 -2.51 -0.03 0.00 -0.34 0.00 0.00 43.02 40.04 2yuu s PHE 30 CO 0.43 0.37 0.49 0.00 -1.46 0.00 0.00 175.22 175.05 2yuu n SER 32 N -1.67 1.38 0.00 0.00 2.88 -1.21 -3.44 113.62 111.55 2yuu n SER 32 Ca -0.05 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 2yuu n SER 32 Cb 0.57 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.15 2yuu n SER 32 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2yuu n VAL 33 N -3.03 0.00 0.01 2.46 0.31 -1.26 -4.45 118.33 112.36 2yuu n VAL 33 Ca -0.39 0.82 -0.06 0.00 -0.01 0.00 0.00 64.34 64.70 2yuu n VAL 33 Cb 1.03 -1.82 -0.12 0.00 -0.91 0.00 0.00 33.84 32.02 2yuu n VAL 33 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2yuu n LYS 35 N -3.06 -4.32 -4.50 0.00 5.02 -1.22 -4.98 118.16 105.10 2yuu n LYS 35 Ca -0.13 0.64 -0.26 0.00 -2.02 0.00 0.00 58.31 56.54 2yuu n LYS 35 Cb 0.98 -4.96 -0.10 0.00 -0.02 0.00 0.00 35.03 30.93 2yuu n LYS 35 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2yuu s ASP 36 N -3.88 3.93 -0.87 4.39 1.11 -1.26 -4.68 116.67 115.42 2yuu s ASP 36 Ca 0.07 -1.22 -0.24 0.00 0.18 0.00 0.00 52.55 51.34 2yuu s ASP 36 Cb -0.01 -0.41 -0.18 0.00 1.07 0.00 0.00 42.92 43.39 2yuu s ASP 36 CO 0.55 -0.34 2.25 0.49 1.18 0.00 0.00 175.17 179.30 2yuu n PHE 37 N -0.93 0.95 -1.39 4.23 3.72 -1.26 -3.62 117.46 119.15 2yuu n PHE 37 Ca -0.04 -0.06 -0.32 0.00 -0.05 0.00 0.00 57.45 56.97 2yuu n PHE 37 Cb 0.65 -2.37 -0.09 0.00 -0.94 0.00 0.00 39.48 36.73 2yuu n PHE 37 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2yuu n VAL 38 N 8.48 1.00 -4.33 -4.37 0.31 0.11 -4.75 118.33 114.78 2yuu n VAL 38 Ca 0.45 -0.97 -0.20 0.00 -0.01 0.00 0.00 64.34 63.60 2yuu n VAL 38 Cb 0.42 -2.13 -0.11 0.00 -0.91 0.00 0.00 33.84 31.12 2yuu n VAL 38 CO 0.00 0.00 0.00 -1.66 -1.32 0.00 0.00 176.83 173.85 2yuu s TRP 39 N 10.34 1.75 -0.30 3.52 1.48 -1.26 -1.68 118.94 132.80 2yuu s TRP 39 Ca 0.69 -0.50 -0.20 0.00 -1.06 0.00 0.00 56.10 55.03 2yuu s TRP 39 Cb 0.05 -0.86 0.21 0.00 -1.16 0.00 0.00 33.47 31.71 2yuu s TRP 39 CO 0.19 0.32 1.35 0.20 -4.06 0.00 0.00 176.95 174.96 2yuu s GLY 40 N -2.83 0.57 0.01 3.67 0.00 -1.25 -4.98 107.32 102.50 2yuu s GLY 40 Ca 0.17 3.77 -0.25 0.00 0.00 0.00 0.00 44.72 48.41 2yuu s GLY 40 CO 0.06 2.46 1.29 1.41 0.00 0.00 0.00 173.10 178.31 2yuu h LEU 41 N 4.28 -0.20 0.00 0.66 3.38 -2.01 -3.39 115.31 118.03 2yuu h LEU 41 Ca -0.27 -0.25 -0.19 0.00 0.09 0.00 0.00 57.88 57.26 2yuu h LEU 41 Cb 1.17 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 2yuu h LEU 41 CO 0.22 0.17 -1.55 0.59 0.09 0.00 0.00 178.44 177.95 2yuu n ASN 42 N -5.04 1.11 -4.61 -0.43 4.13 -1.26 -4.98 115.26 104.18 2yuu n ASN 42 Ca -0.09 0.19 -0.44 0.00 1.68 0.00 0.00 54.58 55.92 2yuu n ASN 42 Cb 0.23 -0.44 -0.01 0.00 -1.54 0.00 0.00 39.78 38.02 2yuu n ASN 42 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2yuu n LYS 43 N -3.71 1.52 -4.49 3.52 5.02 -1.26 -5.00 118.16 113.76 2yuu n LYS 43 Ca -0.24 0.53 -0.29 0.00 -2.02 0.00 0.00 58.31 56.29 2yuu n LYS 43 Cb 0.62 -1.95 -0.08 0.00 -0.02 0.00 0.00 35.03 33.60 2yuu n LYS 43 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 2yuu s GLN 44 N -1.63 2.14 0.00 1.97 0.00 -1.26 -4.51 119.66 116.36 2yuu s GLN 44 Ca 0.58 -2.15 0.00 0.00 -0.00 0.00 0.00 55.36 53.78 2yuu s GLN 44 Cb -0.67 -1.72 0.00 0.00 0.00 0.00 0.00 33.01 30.62 2yuu s GLN 44 CO 0.60 -0.25 0.00 0.41 0.00 0.00 0.00 175.29 176.06 2yuu n GLY 45 N -1.23 5.70 3.09 2.60 0.00 -1.24 -4.23 105.19 109.89 2yuu n GLY 45 Ca -0.09 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.09 2yuu n GLY 45 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yuu s TYR 46 N 1.31 0.90 -0.15 1.61 2.02 -0.19 -3.59 117.35 119.27 2yuu s TYR 46 Ca 0.00 -0.38 -0.04 0.00 -0.37 0.00 0.00 57.07 56.28 2yuu s TYR 46 Cb 0.00 -0.54 0.07 0.00 -0.40 0.00 0.00 41.96 41.10 2yuu s TYR 46 CO 0.00 -0.01 0.25 0.21 -1.57 0.00 0.00 175.55 174.43 2yuu s LYS 47 N -1.23 0.15 0.01 -0.62 2.20 -1.21 -0.07 119.74 118.98 2yuu s LYS 47 Ca -0.03 0.61 -0.30 0.00 -0.36 0.00 0.00 55.97 55.88 2yuu s LYS 47 Cb -0.08 -0.32 -0.07 0.00 -1.51 0.00 0.00 37.83 35.85 2yuu s LYS 47 CO 0.01 -0.38 1.61 0.00 -0.36 0.00 0.00 175.35 176.22 2yuu n ARG 49 N 6.12 0.99 0.00 0.00 1.85 -1.26 -0.84 116.66 123.53 2yuu n ARG 49 Ca 0.16 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.99 2yuu n ARG 49 Cb 0.42 -1.15 -0.01 0.00 -1.05 0.00 0.00 32.46 30.68 2yuu n ARG 49 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 2yuu n GLN 50 N -0.35 0.12 0.00 2.89 6.02 -1.26 -4.78 117.38 120.01 2yuu n GLN 50 Ca 0.00 0.05 0.11 0.00 -0.01 0.00 0.00 57.00 57.15 2yuu n GLN 50 Cb 0.07 -0.60 0.10 0.00 1.02 0.00 0.00 30.24 30.84 2yuu n GLN 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2yuu n ASN 52 N -1.44 -3.14 -4.24 0.00 3.02 -0.02 -4.99 115.26 104.44 2yuu n ASN 52 Ca 0.05 -0.44 -0.42 0.00 -0.03 0.00 0.00 54.58 53.73 2yuu n ASN 52 Cb 0.34 -3.67 -0.07 0.00 -0.61 0.00 0.00 39.78 35.76 2yuu n ASN 52 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yuu s ALA 53 N -3.25 3.48 -0.26 5.41 0.00 -1.23 -4.84 121.76 121.06 2yuu s ALA 53 Ca 0.11 -2.56 -0.25 0.00 0.00 0.00 0.00 51.96 49.26 2yuu s ALA 53 Cb -0.01 -2.96 -0.00 0.00 0.00 0.00 0.00 23.12 20.14 2yuu s ALA 53 CO 0.50 -1.95 0.83 0.00 0.00 0.00 0.00 175.76 175.14 2yuu s ALA 54 N 1.39 3.61 0.34 0.00 0.00 -1.26 -2.55 121.76 123.29 2yuu s ALA 54 Ca 0.05 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.85 2yuu s ALA 54 Cb -0.27 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 2yuu s ALA 54 CO 0.00 -1.04 0.18 0.96 0.00 0.00 0.00 175.76 175.87 2yuu s ILE 55 N 2.92 0.33 0.37 0.00 -4.36 0.90 -3.35 121.20 118.02 2yuu s ILE 55 Ca 0.35 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.57 2yuu s ILE 55 Cb -0.15 -2.46 -0.10 0.00 1.25 0.00 0.00 42.46 41.01 2yuu s ILE 55 CO 0.09 0.00 0.83 -1.00 0.24 0.00 0.00 174.94 175.10 2yuu s HIS 56 N -3.44 3.35 0.61 1.37 3.76 -1.26 -1.03 115.29 118.66 2yuu s HIS 56 Ca 0.33 1.37 0.30 0.00 -0.15 0.00 0.00 55.06 56.91 2yuu s HIS 56 Cb 0.03 -2.66 1.65 0.00 1.11 0.00 0.00 32.58 32.72 2yuu s HIS 56 CO 0.19 -0.01 2.02 -0.22 -0.85 0.00 0.00 174.74 175.87 2yuu h LYS 57 N 2.05 0.00 0.00 1.40 3.64 -1.86 0.13 116.57 121.93 2yuu h LYS 57 Ca -0.48 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 58.67 2yuu h LYS 57 Cb 1.18 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 2yuu h LYS 57 CO 0.64 0.00 -1.83 0.36 -2.27 0.00 0.00 179.45 176.35 2yuu n LYS 58 N -3.50 0.65 0.19 1.90 2.85 -1.26 -4.02 118.16 114.96 2yuu n LYS 58 Ca 0.02 0.11 0.14 0.00 -1.05 0.00 0.00 58.31 57.53 2yuu n LYS 58 Cb 0.42 -1.68 0.59 0.00 -0.65 0.00 0.00 35.03 33.70 2yuu n LYS 58 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2yuu h ILE 60 N 0.00 1.18 -0.02 0.00 2.10 -1.57 0.27 117.51 119.47 2yuu h ILE 60 Ca 0.00 -0.41 0.00 0.00 1.08 0.00 0.00 64.86 65.53 2yuu h ILE 60 Cb 0.39 -0.12 0.00 0.00 -1.09 0.00 0.00 36.82 36.00 2yuu h ILE 60 CO 0.00 0.22 0.00 0.47 -1.08 0.00 0.00 178.15 177.76 2yuu n ASP 61 N -4.48 0.31 -0.51 2.19 8.00 -1.13 -2.98 116.55 117.96 2yuu n ASP 61 Ca 0.12 -1.31 0.05 0.00 0.71 0.00 0.00 54.79 54.35 2yuu n ASP 61 Cb 0.07 -0.01 0.10 0.00 -0.02 0.00 0.00 41.12 41.26 2yuu n ASP 61 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2yuu n LYS 62 N -0.66 2.02 -2.38 -1.24 4.76 0.05 -5.02 118.16 115.69 2yuu n LYS 62 Ca 0.18 -1.68 -0.33 0.00 -2.87 0.00 0.00 58.31 53.61 2yuu n LYS 62 Cb 0.13 -1.22 -0.02 0.00 -1.84 0.00 0.00 35.03 32.08 2yuu n LYS 62 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2yuu s ILE 63 N -0.94 3.88 -0.13 -0.18 1.01 -0.98 -5.02 121.20 118.84 2yuu s ILE 63 Ca 0.17 1.05 -0.04 0.00 0.00 0.00 0.00 60.65 61.84 2yuu s ILE 63 Cb 0.10 -3.45 0.06 0.00 0.01 0.00 0.00 42.46 39.18 2yuu s ILE 63 CO 0.13 -0.36 0.20 -0.63 0.00 0.00 0.00 174.94 174.28 2yuu s ILE 64 N -2.19 -0.31 -1.24 2.92 1.01 -1.26 -5.03 121.20 115.10 2yuu s ILE 64 Ca 0.65 0.20 0.00 0.00 0.00 0.00 0.00 60.65 61.50 2yuu s ILE 64 Cb -0.15 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 41.88 2yuu s ILE 64 CO 0.26 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.85 2yuu n GLY 65 N 5.33 0.38 3.27 6.18 0.00 -1.26 -5.11 105.19 113.98 2yuu n GLY 65 Ca -0.05 -1.66 -0.10 0.00 0.00 0.00 0.00 46.02 44.20 2yuu n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yuu s ARG 66 N -1.10 1.16 0.30 1.61 0.52 -1.26 -4.74 118.95 115.45 2yuu s ARG 66 Ca 0.00 -1.43 -0.25 0.00 -0.52 0.00 0.00 55.73 53.53 2yuu s ARG 66 Cb 0.00 0.31 -0.09 0.00 0.52 0.00 0.00 34.95 35.69 2yuu s ARG 66 CO 0.00 -0.39 0.90 0.00 0.02 0.00 0.00 175.30 175.82 2yuu n THR 68 N 0.66 2.14 -2.38 0.00 5.66 -1.26 -4.75 114.28 114.35 2yuu n THR 68 Ca 0.01 -3.51 -0.16 0.00 -3.05 0.00 0.00 64.05 57.34 2yuu n THR 68 Cb 0.50 -0.45 0.03 0.00 -1.55 0.00 0.00 70.33 68.86 2yuu n THR 68 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2yuu n GLY 69 N -0.80 4.55 3.31 1.09 0.00 -1.26 -4.88 105.19 107.20 2yuu n GLY 69 Ca 0.28 -2.08 -0.27 0.00 0.00 0.00 0.00 46.02 43.95 2yuu n GLY 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yuu s THR 70 N -4.36 1.92 -1.12 2.61 -4.23 -1.26 -4.58 115.64 104.62 2yuu s THR 70 Ca 0.41 -1.39 -0.17 0.00 -1.18 0.00 0.00 61.69 59.37 2yuu s THR 70 Cb 0.38 -1.67 0.13 0.00 1.34 0.00 0.00 72.50 72.69 2yuu s THR 70 CO -0.01 0.21 1.38 0.00 -0.54 0.00 0.00 174.62 175.65 2yuu s ALA 71 N -0.89 3.60 -0.29 3.99 0.00 -1.26 -4.89 121.76 122.02 2yuu s ALA 71 Ca 0.10 -3.02 -0.14 0.00 0.00 0.00 0.00 51.96 48.89 2yuu s ALA 71 Cb -0.10 -4.21 0.13 0.00 0.00 0.00 0.00 23.12 18.94 2yuu s ALA 71 CO 0.03 -2.98 0.81 0.00 0.00 0.00 0.00 175.76 173.62 2yuu s ALA 72 N 2.58 -2.21 -0.41 0.00 0.00 -1.26 -5.12 121.76 115.35 2yuu s ALA 72 Ca 0.41 2.27 -0.28 0.00 0.00 0.00 0.00 51.96 54.37 2yuu s ALA 72 Cb -0.02 -1.73 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 2yuu s ALA 72 CO -0.03 -0.65 1.77 0.54 0.00 0.00 0.00 175.76 177.39 2yuu s ASN 73 N 2.10 5.78 -0.30 0.00 2.20 -1.26 -4.91 114.94 118.56 2yuu s ASN 73 Ca -0.07 1.01 -0.05 0.00 -0.94 0.00 0.00 52.86 52.81 2yuu s ASN 73 Cb -0.07 -2.53 0.19 0.00 -2.00 0.00 0.00 41.25 36.84 2yuu s ASN 73 CO -0.18 -1.85 0.73 -0.55 -2.94 0.00 0.00 177.10 172.31 2yuu s SER 74 N 6.37 -1.12 0.37 3.54 0.15 -1.26 -5.17 113.70 116.58 2yuu s SER 74 Ca 0.75 0.72 -0.06 0.00 0.70 0.00 0.00 55.95 58.06 2yuu s SER 74 Cb -0.19 1.95 0.02 0.00 -1.71 0.00 0.00 66.02 66.09 2yuu s SER 74 CO 0.30 -0.21 0.58 -0.13 1.20 0.00 0.00 173.24 174.98 2yuu s ARG 75 N 2.88 2.06 -0.02 5.44 0.52 -1.26 -5.17 118.95 123.39 2yuu s ARG 75 Ca 0.14 -1.70 0.04 0.00 -0.52 0.00 0.00 55.73 53.70 2yuu s ARG 75 Cb -0.14 0.50 -0.01 0.00 0.52 0.00 0.00 34.95 35.83 2yuu s ARG 75 CO -0.18 -0.89 -0.15 0.16 0.02 0.00 0.00 175.30 174.25 2yuu s ASP 76 N -3.20 1.89 -0.51 0.23 -4.77 -1.26 -5.05 116.67 103.99 2yuu s ASP 76 Ca 0.26 -0.30 -0.29 0.00 -3.30 0.00 0.00 52.55 48.92 2yuu s ASP 76 Cb -0.02 -0.36 -0.15 0.00 -1.09 0.00 0.00 42.92 41.30 2yuu s ASP 76 CO 0.18 0.16 1.76 1.07 0.70 0.00 0.00 175.17 179.05 2yuu n THR 77 N 2.93 0.00 -3.61 2.11 5.66 -1.26 -4.83 114.28 115.28 2yuu n THR 77 Ca -0.16 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.77 2yuu n THR 77 Cb 0.54 -0.37 -0.05 0.00 -1.55 0.00 0.00 70.33 68.90 2yuu n THR 77 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2yuu s SER 78 N 5.32 -0.23 -0.37 1.09 0.15 -1.26 -5.10 113.70 113.29 2yuu s SER 78 Ca 0.94 0.26 0.05 0.00 0.70 0.00 0.00 55.95 57.90 2yuu s SER 78 Cb -1.06 0.20 0.31 0.00 -1.71 0.00 0.00 66.02 63.76 2yuu s SER 78 CO 0.45 -0.20 1.28 0.61 1.20 0.00 0.00 173.24 176.57 2yuu n GLY 79 N 0.71 -0.58 0.07 9.45 0.00 -1.26 -5.03 105.19 108.55 2yuu n GLY 79 Ca -0.06 0.46 -0.13 0.00 0.00 0.00 0.00 46.02 46.29 2yuu n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuu h PRO 80 N 2.35 -0.04 -1.34 1.61 0.13 -2.01 -3.48 132.00 129.22 2yuu h PRO 80 Ca -0.27 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 65.07 2yuu h PRO 80 Cb 1.18 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 32.09 2yuu h PRO 80 CO 0.02 0.43 0.80 0.45 -0.23 0.00 0.00 178.00 179.47 2yuu s SER 81 N -5.64 -0.16 0.19 1.44 0.15 -1.26 -5.18 113.70 103.25 2yuu s SER 81 Ca -0.16 0.12 0.07 0.00 0.70 0.00 0.00 55.95 56.68 2yuu s SER 81 Cb 0.02 0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 64.43 2yuu s SER 81 CO 0.65 -0.19 0.08 -0.94 1.20 0.00 0.00 173.24 174.05 2yuu s SER 82 N -1.43 5.14 0.00 5.45 1.04 -1.26 -5.26 113.70 117.38 2yuu s SER 82 Ca 0.06 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.20 2yuu s SER 82 Cb -0.01 -1.22 0.00 0.00 0.10 0.00 0.00 66.02 64.89 2yuu s SER 82 CO -0.04 0.06 0.00 0.61 0.98 0.00 0.00 173.24 174.84