#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 5.28 0.20 1.61 0.15 -1.26 -5.12 113.70 114.55 2yuu s SER 2 Ca 0.00 0.04 0.10 0.00 0.70 0.00 0.00 55.95 56.79 2yuu s SER 2 Cb 0.00 -1.42 -0.04 0.00 -1.71 0.00 0.00 66.02 62.84 2yuu s SER 2 CO 0.00 0.28 -0.19 -0.94 1.20 0.00 0.00 173.24 173.59 2yuu s SER 3 N -1.57 3.02 0.31 5.45 1.04 -1.26 -5.04 113.70 115.65 2yuu s SER 3 Ca 0.20 -0.92 -0.00 0.00 0.48 0.00 0.00 55.95 55.71 2yuu s SER 3 Cb -0.12 -0.21 0.50 0.00 0.10 0.00 0.00 66.02 66.30 2yuu s SER 3 CO 0.11 -0.00 1.95 1.23 0.98 0.00 0.00 173.24 177.51 2yuu h GLY 4 N 2.96 1.19 -6.41 7.32 0.00 -2.09 -3.46 103.07 102.58 2yuu h GLY 4 Ca -0.42 -0.41 -0.48 0.00 0.00 0.00 0.00 47.33 46.01 2yuu h GLY 4 CO 0.53 0.36 -0.88 1.44 0.00 0.00 0.00 176.54 178.00 2yuu n SER 5 N -4.44 -0.49 -4.17 0.19 7.64 -1.26 -4.84 113.62 106.26 2yuu n SER 5 Ca 0.11 -0.97 -0.38 0.00 1.01 0.00 0.00 58.87 58.64 2yuu n SER 5 Cb 0.10 -3.25 0.02 0.00 -1.01 0.00 0.00 64.21 60.07 2yuu n SER 5 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2yuu n SER 6 N -3.00 -4.43 -2.01 6.43 3.41 -1.26 -4.99 113.62 107.76 2yuu n SER 6 Ca -0.31 0.50 -0.01 0.00 -0.26 0.00 0.00 58.87 58.80 2yuu n SER 6 Cb 0.68 -0.82 -0.00 0.00 -0.26 0.00 0.00 64.21 63.81 2yuu n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yuu n GLY 7 N 2.83 4.18 3.75 5.00 0.00 -1.26 -5.17 105.19 114.52 2yuu n GLY 7 Ca 0.05 -2.19 -0.28 0.00 0.00 0.00 0.00 46.02 43.59 2yuu n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yuu n LYS 8 N -0.02 0.71 -1.49 1.61 4.76 -1.26 -5.11 118.16 117.36 2yuu n LYS 8 Ca -0.00 -3.52 -0.35 0.00 -2.87 0.00 0.00 58.31 51.56 2yuu n LYS 8 Cb 0.01 0.57 0.09 0.00 -1.84 0.00 0.00 35.03 33.86 2yuu n LYS 8 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2yuu s GLN 9 N -4.12 2.19 0.22 1.97 -2.07 -1.26 -5.02 119.66 111.58 2yuu s GLN 9 Ca 0.21 1.90 -0.18 0.00 -1.82 0.00 0.00 55.36 55.46 2yuu s GLN 9 Cb -0.02 -1.82 0.07 0.00 -1.09 0.00 0.00 33.01 30.15 2yuu s GLN 9 CO 0.13 -1.83 0.89 0.00 -1.32 0.00 0.00 175.29 173.17 2yuu n ALA 10 N -2.50 -2.26 -2.26 2.60 0.00 -1.26 -5.10 120.51 109.73 2yuu n ALA 10 Ca 0.15 -1.01 -0.09 0.00 0.00 0.00 0.00 53.44 52.48 2yuu n ALA 10 Cb 0.49 0.64 -0.09 0.00 0.00 0.00 0.00 19.45 20.49 2yuu n ALA 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2yuu s LYS 11 N -2.06 0.93 -0.15 0.00 0.00 -1.26 -5.09 119.74 112.12 2yuu s LYS 11 Ca 0.19 -1.35 -0.06 0.00 0.00 0.00 0.00 55.97 54.76 2yuu s LYS 11 Cb -0.03 0.27 -0.04 0.00 0.00 0.00 0.00 37.83 38.03 2yuu s LYS 11 CO 0.07 -0.27 0.06 0.42 0.00 0.00 0.00 175.35 175.63 2yuu s ILE 12 N -4.01 4.80 -0.51 3.79 1.01 -1.26 -4.00 121.20 121.02 2yuu s ILE 12 Ca 0.20 -0.04 -0.16 0.00 0.00 0.00 0.00 60.65 60.65 2yuu s ILE 12 Cb 0.07 -3.11 0.10 0.00 0.01 0.00 0.00 42.46 39.52 2yuu s ILE 12 CO -0.00 0.53 0.47 -1.00 0.00 0.00 0.00 174.94 174.94 2yuu s HIS 13 N -0.20 3.22 -0.76 3.97 3.76 -0.88 -4.96 115.29 119.45 2yuu s HIS 13 Ca 0.08 -1.08 -0.07 0.00 -0.15 0.00 0.00 55.06 53.84 2yuu s HIS 13 Cb -0.12 -3.52 -0.14 0.00 1.11 0.00 0.00 32.58 29.90 2yuu s HIS 13 CO 0.01 -0.94 2.85 0.66 -0.85 0.00 0.00 174.74 176.48 2yuu n TYR 14 N 5.33 1.13 -3.31 1.40 4.01 -1.25 -3.41 117.16 121.06 2yuu n TYR 14 Ca -0.13 -2.04 -0.38 0.00 -0.16 0.00 0.00 57.90 55.18 2yuu n TYR 14 Cb 0.42 -1.84 -0.06 0.00 -0.31 0.00 0.00 39.34 37.55 2yuu n TYR 14 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2yuu s ILE 15 N 2.06 4.88 -0.67 -0.72 1.09 -1.25 -4.03 121.20 122.56 2yuu s ILE 15 Ca 0.57 1.12 0.00 0.00 -1.10 0.00 0.00 60.65 61.24 2yuu s ILE 15 Cb 0.20 -3.86 0.00 0.00 -1.06 0.00 0.00 42.46 37.74 2yuu s ILE 15 CO -0.03 0.51 0.00 0.29 -0.10 0.00 0.00 174.94 175.61 2yuu n LYS 16 N 2.15 -1.88 -2.41 2.79 4.76 -1.26 0.14 118.16 122.46 2yuu n LYS 16 Ca -0.10 0.38 -0.06 0.00 -2.87 0.00 0.00 58.31 55.66 2yuu n LYS 16 Cb 0.51 -4.73 0.01 0.00 -1.84 0.00 0.00 35.03 28.98 2yuu n LYS 16 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2yuu n ASN 17 N -0.76 -2.65 -4.89 4.39 5.15 -1.26 -2.91 115.26 112.33 2yuu n ASN 17 Ca -0.08 -0.06 -0.28 0.00 -0.60 0.00 0.00 54.58 53.56 2yuu n ASN 17 Cb 0.40 -1.64 -0.01 0.00 -0.53 0.00 0.00 39.78 38.01 2yuu n ASN 17 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2yuu s HIS 18 N -2.64 1.52 -0.12 1.20 3.76 0.38 -3.85 115.29 115.54 2yuu s HIS 18 Ca 0.07 -0.91 0.15 0.00 -0.15 0.00 0.00 55.06 54.22 2yuu s HIS 18 Cb -0.03 -1.84 0.35 0.00 1.11 0.00 0.00 32.58 32.17 2yuu s HIS 18 CO 0.08 -0.42 1.17 0.39 -0.85 0.00 0.00 174.74 175.11 2yuu n GLU 19 N -1.73 0.98 -1.27 1.40 4.71 -1.25 -3.82 120.64 119.65 2yuu n GLU 19 Ca -0.05 -2.59 -0.51 0.00 -0.01 0.00 0.00 57.16 53.99 2yuu n GLU 19 Cb 0.65 -1.10 -0.12 0.00 -1.01 0.00 0.00 31.44 29.86 2yuu n GLU 19 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 2yuu n PHE 20 N -0.69 0.91 -4.01 -0.32 3.72 -1.22 -4.11 117.46 111.74 2yuu n PHE 20 Ca 0.13 0.61 -0.35 0.00 -0.05 0.00 0.00 57.45 57.79 2yuu n PHE 20 Cb 0.79 -2.21 -0.11 0.00 -0.94 0.00 0.00 39.48 37.00 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 6.69 4.48 -0.27 4.37 1.01 -1.00 -2.06 121.20 134.43 2yuu s ILE 21 Ca 1.20 -0.13 -0.40 0.00 0.00 0.00 0.00 60.65 61.31 2yuu s ILE 21 Cb -1.35 -3.03 -0.16 0.00 0.01 0.00 0.00 42.46 37.92 2yuu s ILE 21 CO 0.58 0.43 1.74 0.00 0.00 0.00 0.00 174.94 177.68 2yuu n ALA 22 N 3.96 -0.20 -2.94 9.38 0.00 -1.26 -3.38 120.51 126.07 2yuu n ALA 22 Ca -0.17 0.39 -0.11 0.00 0.00 0.00 0.00 53.44 53.55 2yuu n ALA 22 Cb 0.52 -2.22 -0.13 0.00 0.00 0.00 0.00 19.45 17.62 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 3.47 0.04 -0.37 0.00 -1.32 -1.26 -4.97 115.64 111.23 2yuu s THR 23 Ca 0.98 -0.34 -0.21 0.00 -1.21 0.00 0.00 61.69 60.91 2yuu s THR 23 Cb -1.06 -0.15 0.01 0.00 -1.51 0.00 0.00 72.50 69.79 2yuu s THR 23 CO 0.65 -0.19 0.65 0.12 -2.21 0.00 0.00 174.62 173.64 2yuu s PHE 24 N -0.56 3.13 -0.16 9.09 5.36 -1.26 -3.89 117.98 129.69 2yuu s PHE 24 Ca -0.06 0.27 -0.13 0.00 -0.96 0.00 0.00 56.93 56.05 2yuu s PHE 24 Cb -0.04 -3.20 -0.09 0.00 -0.34 0.00 0.00 43.02 39.35 2yuu s PHE 24 CO -0.00 -0.69 0.02 0.74 -1.46 0.00 0.00 175.22 173.83 2yuu h PHE 25 N 8.56 0.00 0.00 10.12 0.04 -1.92 -3.48 116.94 130.26 2yuu h PHE 25 Ca -0.26 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.51 2yuu h PHE 25 Cb 1.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.26 2yuu h PHE 25 CO 0.75 0.51 0.00 0.41 -0.60 0.00 0.00 178.31 179.38 2yuu n GLY 26 N 1.58 1.04 3.90 -1.45 0.00 -1.26 -4.92 105.19 104.08 2yuu n GLY 26 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 3.66 -1.09 1.61 -2.07 -1.26 -4.88 119.66 115.63 2yuu s GLN 27 Ca 0.00 0.07 -0.23 0.00 -1.82 0.00 0.00 55.36 53.38 2yuu s GLN 27 Cb 0.00 -2.64 -0.07 0.00 -1.09 0.00 0.00 33.01 29.21 2yuu s GLN 27 CO 0.00 0.22 1.94 -1.25 -1.32 0.00 0.00 175.29 174.88 2yuu s PRO 28 N -3.44 2.52 0.81 9.60 0.04 -1.26 -4.40 135.00 138.87 2yuu s PRO 28 Ca 0.45 -0.87 -0.12 0.00 0.04 0.00 0.00 61.00 60.50 2yuu s PRO 28 Cb -0.11 -5.18 0.08 0.00 0.04 0.00 0.00 34.50 29.33 2yuu s PRO 28 CO 0.29 -3.77 1.17 0.99 0.04 0.00 0.00 177.00 175.71 2yuu s THR 29 N 10.68 2.02 -0.22 1.26 2.01 -1.23 -4.61 115.64 125.55 2yuu s THR 29 Ca 0.69 -0.02 -0.13 0.00 0.31 0.00 0.00 61.69 62.53 2yuu s THR 29 Cb -0.03 -3.00 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 2yuu s THR 29 CO 0.08 0.00 0.27 0.12 -0.69 0.00 0.00 174.62 174.41 2yuu s PHE 30 N -3.56 3.34 0.60 4.92 5.36 -1.26 -0.36 117.98 127.01 2yuu s PHE 30 Ca 0.62 0.40 -0.08 0.00 -0.96 0.00 0.00 56.93 56.92 2yuu s PHE 30 Cb -0.11 -2.39 -0.01 0.00 -0.34 0.00 0.00 43.02 40.17 2yuu s PHE 30 CO 0.49 0.02 0.94 0.00 -1.46 0.00 0.00 175.22 175.21 2yuu n SER 32 N -2.64 1.72 0.00 0.00 2.88 -1.22 -3.51 113.62 110.85 2yuu n SER 32 Ca 0.04 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 2yuu n SER 32 Cb 0.56 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 -2.96 0.00 0.05 2.46 0.31 -1.26 -4.41 118.33 112.52 2yuu n VAL 33 Ca -0.35 0.88 0.03 0.00 -0.01 0.00 0.00 64.34 64.89 2yuu n VAL 33 Cb 0.97 -1.87 -0.07 0.00 -0.91 0.00 0.00 33.84 31.96 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 -2.81 -5.48 -5.01 0.00 5.02 -1.23 -4.99 118.16 103.66 2yuu n LYS 35 Ca -0.08 0.74 -0.28 0.00 -2.02 0.00 0.00 58.31 56.67 2yuu n LYS 35 Cb 0.77 -5.42 -0.16 0.00 -0.02 0.00 0.00 35.03 30.20 2yuu n LYS 35 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2yuu s ASP 36 N -4.12 2.49 -0.52 4.39 -1.08 -1.26 -4.67 116.67 111.91 2yuu s ASP 36 Ca 0.03 -0.41 -0.21 0.00 -0.52 0.00 0.00 52.55 51.44 2yuu s ASP 36 Cb -0.00 -0.59 -0.13 0.00 -1.46 0.00 0.00 42.92 40.74 2yuu s ASP 36 CO 0.64 0.20 1.53 0.49 0.52 0.00 0.00 175.17 178.55 2yuu n PHE 37 N 2.95 0.44 -1.82 -5.34 3.01 -1.26 -4.16 117.46 111.28 2yuu n PHE 37 Ca -0.17 0.30 -0.42 0.00 1.01 0.00 0.00 57.45 58.16 2yuu n PHE 37 Cb 0.53 -1.42 -0.01 0.00 -0.01 0.00 0.00 39.48 38.57 2yuu n PHE 37 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2yuu n VAL 38 N 4.35 3.33 0.00 -4.37 0.31 0.51 -4.14 118.33 118.32 2yuu n VAL 38 Ca 0.38 -3.03 0.00 0.00 -0.01 0.00 0.00 64.34 61.68 2yuu n VAL 38 Cb 0.01 -2.53 0.00 0.00 -0.91 0.00 0.00 33.84 30.41 2yuu n VAL 38 CO 0.00 0.00 0.00 -2.67 -1.32 0.00 0.00 176.83 172.84 2yuu n TRP 39 N 6.82 0.00 0.00 3.52 4.27 -1.26 -3.53 117.44 127.26 2yuu n TRP 39 Ca 0.51 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 54.12 2yuu n TRP 39 Cb 0.41 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.36 2yuu n TRP 39 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2yuu n GLY 40 N 2.05 0.60 2.89 -1.67 0.00 -1.26 -4.50 105.19 103.30 2yuu n GLY 40 Ca 0.00 -0.42 -0.28 0.00 0.00 0.00 0.00 46.02 45.32 2yuu n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yuu s LEU 41 N 0.00 1.62 -1.87 0.99 1.43 -1.26 -4.81 118.68 114.78 2yuu s LEU 41 Ca 0.00 -0.66 -0.24 0.00 -1.03 0.00 0.00 54.13 52.20 2yuu s LEU 41 Cb 0.00 -0.92 0.24 0.00 0.03 0.00 0.00 46.19 45.54 2yuu s LEU 41 CO 0.00 -0.18 0.59 -0.46 0.23 0.00 0.00 176.35 176.53 2yuu n ASN 42 N 4.87 -1.81 -3.96 2.29 6.94 -1.26 -4.89 115.26 117.43 2yuu n ASN 42 Ca -0.12 -1.23 -0.12 0.00 -0.02 0.00 0.00 54.58 53.09 2yuu n ASN 42 Cb 0.48 -1.59 -0.13 0.00 -2.36 0.00 0.00 39.78 36.19 2yuu n ASN 42 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2yuu s LYS 43 N -7.20 0.29 0.44 -3.83 1.02 -1.26 -5.17 119.74 104.03 2yuu s LYS 43 Ca 0.83 -0.40 0.08 0.00 0.02 0.00 0.00 55.97 56.51 2yuu s LYS 43 Cb -0.48 -0.09 0.02 0.00 -0.52 0.00 0.00 37.83 36.75 2yuu s LYS 43 CO 1.02 0.01 0.59 1.14 -0.92 0.00 0.00 175.35 177.19 2yuu s GLN 44 N -0.85 2.75 0.00 1.68 0.00 -1.26 -4.74 119.66 117.24 2yuu s GLN 44 Ca -0.07 -1.30 0.00 0.00 -0.00 0.00 0.00 55.36 53.98 2yuu s GLN 44 Cb -0.06 -2.73 0.00 0.00 0.00 0.00 0.00 33.01 30.22 2yuu s GLN 44 CO -0.00 -0.34 0.00 0.41 0.00 0.00 0.00 175.29 175.35 2yuu n GLY 45 N -1.89 3.14 3.08 2.60 0.00 -1.25 -4.62 105.19 106.25 2yuu n GLY 45 Ca 0.09 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.60 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 3.93 -0.09 -0.18 1.61 2.02 -0.63 -4.20 117.35 119.81 2yuu s TYR 46 Ca 0.00 0.21 -0.04 0.00 -0.37 0.00 0.00 57.07 56.87 2yuu s TYR 46 Cb 0.00 0.02 0.08 0.00 -0.40 0.00 0.00 41.96 41.66 2yuu s TYR 46 CO 0.00 -0.18 0.24 0.21 -1.57 0.00 0.00 175.55 174.25 2yuu s LYS 47 N -0.55 0.18 -0.07 -0.62 2.20 -1.22 -0.58 119.74 119.08 2yuu s LYS 47 Ca -0.06 0.41 -0.30 0.00 -0.36 0.00 0.00 55.97 55.66 2yuu s LYS 47 Cb -0.04 -0.76 -0.06 0.00 -1.51 0.00 0.00 37.83 35.47 2yuu s LYS 47 CO 0.01 -0.53 1.72 0.00 -0.36 0.00 0.00 175.35 176.19 2yuu n ARG 49 N 7.33 0.83 -0.06 0.00 1.85 -1.26 0.21 116.66 125.56 2yuu n ARG 49 Ca 0.18 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.94 2yuu n ARG 49 Cb 0.43 -1.08 -0.03 0.00 -1.05 0.00 0.00 32.46 30.73 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 -0.58 0.37 0.00 2.89 1.13 -1.26 -4.73 117.38 115.20 2yuu n GLN 50 Ca 0.03 0.15 0.10 0.00 -1.94 0.00 0.00 57.00 55.34 2yuu n GLN 50 Cb 0.01 -1.14 -0.07 0.00 0.11 0.00 0.00 30.24 29.15 2yuu n GLN 50 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2yuu n ASN 52 N -0.88 -2.53 -4.23 0.00 3.02 0.13 -4.99 115.26 105.79 2yuu n ASN 52 Ca 0.06 -0.51 -0.41 0.00 -0.03 0.00 0.00 54.58 53.69 2yuu n ASN 52 Cb 0.37 -4.26 -0.09 0.00 -0.61 0.00 0.00 39.78 35.20 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 -3.30 3.39 -0.18 5.41 0.00 -1.22 -4.85 121.76 121.01 2yuu s ALA 53 Ca 0.05 -2.46 -0.25 0.00 0.00 0.00 0.00 51.96 49.31 2yuu s ALA 53 Cb -0.01 -2.82 -0.01 0.00 0.00 0.00 0.00 23.12 20.28 2yuu s ALA 53 CO 0.59 -1.86 0.80 0.00 0.00 0.00 0.00 175.76 175.30 2yuu s ALA 54 N 1.39 3.54 0.27 0.00 0.00 -1.26 -2.72 121.76 122.98 2yuu s ALA 54 Ca 0.05 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.01 2yuu s ALA 54 Cb -0.26 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 2yuu s ALA 54 CO 0.00 -0.67 0.19 0.96 0.00 0.00 0.00 175.76 176.24 2yuu s ILE 55 N 2.21 0.07 0.47 0.00 -4.36 0.26 -3.44 121.20 116.40 2yuu s ILE 55 Ca 0.37 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.63 2yuu s ILE 55 Cb -0.16 -2.50 -0.07 0.00 1.25 0.00 0.00 42.46 40.98 2yuu s ILE 55 CO 0.11 0.00 0.88 -1.00 0.24 0.00 0.00 174.94 175.17 2yuu s HIS 56 N -3.76 3.48 0.51 1.37 3.76 -1.26 -1.60 115.29 117.79 2yuu s HIS 56 Ca 0.39 1.22 0.22 0.00 -0.15 0.00 0.00 55.06 56.74 2yuu s HIS 56 Cb 0.05 -2.60 1.31 0.00 1.11 0.00 0.00 32.58 32.45 2yuu s HIS 56 CO 0.19 -0.27 2.01 -0.22 -0.85 0.00 0.00 174.74 175.61 2yuu h LYS 57 N 0.94 0.07 0.00 1.40 3.64 -1.86 -0.20 116.57 120.56 2yuu h LYS 57 Ca -0.47 -0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.67 2yuu h LYS 57 Cb 1.19 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 2yuu h LYS 57 CO 0.63 0.05 -1.46 1.57 -2.27 0.00 0.00 179.45 177.97 2yuu h LYS 58 N 0.07 0.00 0.00 1.90 2.10 -1.97 -3.31 116.57 115.36 2yuu h LYS 58 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 2yuu h LYS 58 Cb 0.80 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.13 2yuu h LYS 58 CO -0.02 0.50 0.00 0.00 -2.00 0.00 0.00 179.45 177.93 2yuu h ILE 60 N 0.00 1.21 -0.05 0.00 2.10 -1.50 -1.20 117.51 118.07 2yuu h ILE 60 Ca 0.00 -0.80 0.00 0.00 1.08 0.00 0.00 64.86 65.14 2yuu h ILE 60 Cb 0.35 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 2yuu h ILE 60 CO 0.00 0.28 0.00 -0.67 -1.08 0.00 0.00 178.15 176.68 2yuu n ASP 61 N -4.28 0.95 -0.07 2.19 2.03 -1.03 -3.56 116.55 112.79 2yuu n ASP 61 Ca 0.02 -1.44 -0.04 0.00 0.52 0.00 0.00 54.79 53.85 2yuu n ASP 61 Cb 0.24 -0.03 -0.13 0.00 -0.72 0.00 0.00 41.12 40.48 2yuu n ASP 61 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2yuu n LYS 62 N -0.21 1.14 -1.44 -0.67 4.76 -0.53 -5.01 118.16 116.21 2yuu n LYS 62 Ca 0.18 -0.04 -0.45 0.00 -2.87 0.00 0.00 58.31 55.13 2yuu n LYS 62 Cb 0.24 -1.42 -0.02 0.00 -1.84 0.00 0.00 35.03 31.99 2yuu n LYS 62 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2yuu n ILE 63 N -2.50 1.79 -3.75 -0.18 5.41 -0.75 -4.96 119.36 114.42 2yuu n ILE 63 Ca -0.22 -0.50 -0.30 0.00 1.00 0.00 0.00 62.75 62.73 2yuu n ILE 63 Cb 0.91 -0.31 -0.15 0.00 -0.71 0.00 0.00 39.64 39.38 2yuu n ILE 63 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2yuu s ILE 64 N -1.18 1.03 -3.31 1.39 1.01 -1.26 -5.06 121.20 113.82 2yuu s ILE 64 Ca 0.62 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 59.66 2yuu s ILE 64 Cb -0.79 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 39.91 2yuu s ILE 64 CO 0.58 -0.70 0.00 0.61 0.00 0.00 0.00 174.94 175.43 2yuu n GLY 65 N 4.64 0.42 3.34 6.18 0.00 -1.26 -5.14 105.19 113.38 2yuu n GLY 65 Ca -0.00 -1.33 -0.20 0.00 0.00 0.00 0.00 46.02 44.49 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 -2.00 1.72 -0.03 1.61 0.52 -1.26 -4.77 118.95 114.74 2yuu s ARG 66 Ca 0.00 -2.00 -0.25 0.00 -0.52 0.00 0.00 55.73 52.96 2yuu s ARG 66 Cb 0.00 0.04 -0.04 0.00 0.52 0.00 0.00 34.95 35.47 2yuu s ARG 66 CO 0.00 -0.55 0.76 0.00 0.02 0.00 0.00 175.30 175.53 2yuu n THR 68 N 3.55 2.53 -2.17 0.00 5.66 -1.26 -4.64 114.28 117.95 2yuu n THR 68 Ca -0.00 -4.33 -0.02 0.00 -3.05 0.00 0.00 64.05 56.65 2yuu n THR 68 Cb 0.51 -1.17 -0.03 0.00 -1.55 0.00 0.00 70.33 68.10 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 -0.67 0.72 3.87 1.09 0.00 -1.26 -4.95 105.19 103.99 2yuu n GLY 69 Ca 0.44 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 5.11 -0.52 2.61 -4.23 -1.26 -3.82 115.64 113.53 2yuu s THR 70 Ca 0.11 -0.48 0.02 0.00 -1.18 0.00 0.00 61.69 60.17 2yuu s THR 70 Cb 0.13 -3.47 0.44 0.00 1.34 0.00 0.00 72.50 70.94 2yuu s THR 70 CO -0.06 0.16 1.62 0.00 -0.54 0.00 0.00 174.62 175.81 2yuu n ALA 71 N 0.44 5.74 -2.62 3.99 0.00 -1.26 -4.88 120.51 121.92 2yuu n ALA 71 Ca -0.07 -3.75 -0.41 0.00 0.00 0.00 0.00 53.44 49.21 2yuu n ALA 71 Cb 0.51 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 2yuu n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yuu s ALA 72 N -3.74 2.83 -1.34 0.00 0.00 -1.26 -3.98 121.76 114.28 2yuu s ALA 72 Ca 0.57 -1.91 -0.08 0.00 0.00 0.00 0.00 51.96 50.54 2yuu s ALA 72 Cb 0.45 -4.31 0.01 0.00 0.00 0.00 0.00 23.12 19.28 2yuu s ALA 72 CO -0.05 -3.34 1.15 0.09 0.00 0.00 0.00 175.76 173.62 2yuu n ASN 73 N 8.74 -5.67 -3.69 0.00 4.13 -1.26 -5.00 115.26 112.52 2yuu n ASN 73 Ca 0.16 -0.56 -0.10 0.00 1.68 0.00 0.00 54.58 55.77 2yuu n ASN 73 Cb 0.49 -5.03 -0.10 0.00 -1.54 0.00 0.00 39.78 33.60 2yuu n ASN 73 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2yuu s SER 74 N -3.49 -0.58 -0.81 6.41 1.04 -1.26 -5.11 113.70 109.92 2yuu s SER 74 Ca 0.49 0.98 -0.15 0.00 0.48 0.00 0.00 55.95 57.75 2yuu s SER 74 Cb -0.22 0.86 0.19 0.00 0.10 0.00 0.00 66.02 66.95 2yuu s SER 74 CO 0.73 -0.20 0.79 -0.60 0.98 0.00 0.00 173.24 174.95 2yuu s ARG 75 N 1.42 3.53 -0.85 4.02 6.06 -1.26 -4.71 118.95 127.16 2yuu s ARG 75 Ca -0.09 -2.25 -0.14 0.00 -2.50 0.00 0.00 55.73 50.75 2yuu s ARG 75 Cb -0.08 -4.48 0.22 0.00 0.06 0.00 0.00 34.95 30.67 2yuu s ARG 75 CO -0.14 -1.37 0.79 0.34 -2.50 0.00 0.00 175.30 172.42 2yuu s ASP 76 N 2.57 6.81 0.14 -2.12 2.15 -1.26 -4.93 116.67 120.03 2yuu s ASP 76 Ca 0.18 -2.76 -0.27 0.00 0.43 0.00 0.00 52.55 50.13 2yuu s ASP 76 Cb -0.12 -2.21 -0.02 0.00 -0.30 0.00 0.00 42.92 40.27 2yuu s ASP 76 CO -0.07 -0.55 1.59 0.74 -0.17 0.00 0.00 175.17 176.71 2yuu h THR 77 N 4.70 0.19 -6.17 1.71 2.02 -2.04 -3.44 112.91 109.88 2yuu h THR 77 Ca 0.11 0.00 -0.46 0.00 0.77 0.00 0.00 66.41 66.84 2yuu h THR 77 Cb 1.03 0.19 -0.26 0.00 -1.74 0.00 0.00 68.15 67.37 2yuu h THR 77 CO 0.77 0.00 -0.67 -1.54 0.37 0.00 0.00 175.52 174.45 2yuu n SER 78 N -5.42 -0.90 0.00 4.18 3.41 -1.26 -4.50 113.62 109.12 2yuu n SER 78 Ca -0.03 -0.92 0.00 0.00 -0.26 0.00 0.00 58.87 57.67 2yuu n SER 78 Cb 0.35 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 2yuu n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yuu n GLY 79 N -1.18 0.85 3.60 5.00 0.00 -1.26 -5.10 105.19 107.10 2yuu n GLY 79 Ca 0.02 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2yuu n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yuu s PRO 80 N 0.00 3.38 -0.33 1.61 0.04 -1.26 -4.97 135.00 133.47 2yuu s PRO 80 Ca 0.00 1.30 0.04 0.00 0.04 0.00 0.00 61.00 62.38 2yuu s PRO 80 Cb 0.00 -4.16 0.09 0.00 0.04 0.00 0.00 34.50 30.47 2yuu s PRO 80 CO 0.00 -1.80 0.03 -1.12 0.04 0.00 0.00 177.00 174.15 2yuu s SER 81 N 5.61 4.73 0.11 6.66 0.01 -1.26 -5.08 113.70 124.48 2yuu s SER 81 Ca 0.75 -2.02 -0.29 0.00 1.31 0.00 0.00 55.95 55.70 2yuu s SER 81 Cb -0.20 -1.62 -0.16 0.00 0.21 0.00 0.00 66.02 64.24 2yuu s SER 81 CO 0.33 -0.35 0.66 -1.54 0.41 0.00 0.00 173.24 172.75 2yuu n SER 82 N 4.30 -0.72 0.00 2.44 3.41 -1.26 -5.28 113.62 116.50 2yuu n SER 82 Ca 0.01 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.65 2yuu n SER 82 Cb 0.42 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 63.52 2yuu n SER 82 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49