#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 0.20 -0.21 1.61 0.15 -1.26 -5.17 113.70 109.03 2yuu s SER 2 Ca 0.00 -0.55 -0.16 0.00 0.70 0.00 0.00 55.95 55.94 2yuu s SER 2 Cb 0.00 0.22 0.06 0.00 -1.71 0.00 0.00 66.02 64.58 2yuu s SER 2 CO 0.00 -0.50 0.53 -0.44 1.20 0.00 0.00 173.24 174.03 2yuu s SER 3 N -2.11 -0.61 0.00 5.45 0.01 -1.26 -5.16 113.70 110.02 2yuu s SER 3 Ca -0.05 1.10 0.00 0.00 1.31 0.00 0.00 55.95 58.31 2yuu s SER 3 Cb -0.01 1.06 0.00 0.00 0.21 0.00 0.00 66.02 67.28 2yuu s SER 3 CO -0.05 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.02 2yuu n GLY 4 N 3.38 3.50 3.19 3.44 0.00 -1.26 -5.17 105.19 112.27 2yuu n GLY 4 Ca -0.17 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 2yuu n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yuu s SER 5 N 0.00 -0.26 -0.04 1.61 0.15 -1.26 -5.15 113.70 108.76 2yuu s SER 5 Ca 0.00 0.43 -0.23 0.00 0.70 0.00 0.00 55.95 56.85 2yuu s SER 5 Cb 0.00 0.51 -0.04 0.00 -1.71 0.00 0.00 66.02 64.78 2yuu s SER 5 CO 0.00 -0.20 0.69 -0.44 1.20 0.00 0.00 173.24 174.49 2yuu s SER 6 N -0.28 7.02 -1.18 5.45 0.01 -1.26 -4.99 113.70 118.47 2yuu s SER 6 Ca -0.04 1.22 -0.17 0.00 1.31 0.00 0.00 55.95 58.27 2yuu s SER 6 Cb -0.03 -2.41 0.11 0.00 0.21 0.00 0.00 66.02 63.90 2yuu s SER 6 CO 0.01 -0.05 1.51 -0.83 0.41 0.00 0.00 173.24 174.28 2yuu s GLY 7 N 0.48 1.90 0.42 3.44 0.00 -1.26 -4.99 107.32 107.31 2yuu s GLY 7 Ca 0.36 -2.97 -0.26 0.00 0.00 0.00 0.00 44.72 41.86 2yuu s GLY 7 CO 0.19 2.38 1.40 0.54 0.00 0.00 0.00 173.10 177.61 2yuu s LYS 8 N 3.17 3.86 -0.30 2.90 -0.14 -1.26 -4.99 119.74 122.99 2yuu s LYS 8 Ca 0.46 2.37 -0.11 0.00 -1.36 0.00 0.00 55.97 57.32 2yuu s LYS 8 Cb -0.00 -2.76 -0.03 0.00 -1.68 0.00 0.00 37.83 33.36 2yuu s LYS 8 CO 0.00 -0.65 0.20 -0.65 -0.76 0.00 0.00 175.35 173.49 2yuu s GLN 9 N -2.30 3.70 -0.01 1.68 -1.52 -1.26 -5.07 119.66 114.88 2yuu s GLN 9 Ca 0.58 -0.49 0.01 0.00 -1.95 0.00 0.00 55.36 53.51 2yuu s GLN 9 Cb -0.42 -3.69 0.01 0.00 -0.22 0.00 0.00 33.01 28.69 2yuu s GLN 9 CO 0.55 -0.30 -0.02 0.00 -0.25 0.00 0.00 175.29 175.27 2yuu s ALA 10 N 1.72 0.27 -0.33 6.09 0.00 -1.26 -5.09 121.76 123.16 2yuu s ALA 10 Ca 0.06 -0.05 -0.34 0.00 0.00 0.00 0.00 51.96 51.63 2yuu s ALA 10 Cb -0.17 -0.13 -0.15 0.00 0.00 0.00 0.00 23.12 22.67 2yuu s ALA 10 CO 0.10 0.03 1.14 1.17 0.00 0.00 0.00 175.76 178.20 2yuu n LYS 11 N 3.31 0.00 -4.90 0.00 4.81 -1.26 -4.91 118.16 115.20 2yuu n LYS 11 Ca -0.16 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 56.95 2yuu n LYS 11 Cb 0.57 -1.11 -0.13 0.00 0.02 0.00 0.00 35.03 34.37 2yuu n LYS 11 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2yuu s ILE 12 N 1.98 3.03 -0.52 3.15 1.01 -1.26 -4.32 121.20 124.27 2yuu s ILE 12 Ca 0.77 -0.73 -0.18 0.00 0.00 0.00 0.00 60.65 60.51 2yuu s ILE 12 Cb -1.09 -2.19 0.08 0.00 0.01 0.00 0.00 42.46 39.27 2yuu s ILE 12 CO 0.59 0.59 0.55 -1.00 0.00 0.00 0.00 174.94 175.67 2yuu s HIS 13 N -0.68 3.12 0.00 3.97 3.76 -0.92 -4.94 115.29 119.60 2yuu s HIS 13 Ca 0.10 -0.83 -0.05 0.00 -0.15 0.00 0.00 55.06 54.14 2yuu s HIS 13 Cb -0.11 -3.55 -0.20 0.00 1.11 0.00 0.00 32.58 29.83 2yuu s HIS 13 CO 0.01 -1.01 2.99 0.66 -0.85 0.00 0.00 174.74 176.54 2yuu n TYR 14 N 5.79 0.00 -3.06 1.40 4.01 -1.26 -3.46 117.16 120.58 2yuu n TYR 14 Ca -0.10 -1.22 -0.38 0.00 -0.16 0.00 0.00 57.90 56.04 2yuu n TYR 14 Cb 0.44 -1.31 -0.06 0.00 -0.31 0.00 0.00 39.34 38.10 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 1.19 4.49 -0.44 -0.72 1.09 -1.26 -3.89 121.20 121.66 2yuu s ILE 15 Ca 0.50 1.48 -0.02 0.00 -1.10 0.00 0.00 60.65 61.51 2yuu s ILE 15 Cb 0.24 -3.99 0.02 0.00 -1.06 0.00 0.00 42.46 37.67 2yuu s ILE 15 CO 0.00 0.38 0.06 0.29 -0.10 0.00 0.00 174.94 175.57 2yuu n LYS 16 N 1.20 -2.70 -3.17 2.79 4.76 -1.26 0.15 118.16 119.93 2yuu n LYS 16 Ca -0.05 0.18 -0.17 0.00 -2.87 0.00 0.00 58.31 55.40 2yuu n LYS 16 Cb 0.50 -4.72 0.05 0.00 -1.84 0.00 0.00 35.03 29.02 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 -1.67 -5.09 -3.89 4.39 4.13 -1.25 -2.05 115.26 109.81 2yuu n ASN 17 Ca -0.03 -0.34 -0.20 0.00 1.68 0.00 0.00 54.58 55.69 2yuu n ASN 17 Cb 0.53 -3.75 -0.02 0.00 -1.54 0.00 0.00 39.78 35.00 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 -4.27 -0.23 -2.29 3.10 8.25 0.40 -3.61 115.22 116.56 2yuu n HIS 18 Ca -0.01 -1.63 -0.02 0.00 -0.26 0.00 0.00 57.72 55.79 2yuu n HIS 18 Cb 0.55 -0.28 0.07 0.00 1.12 0.00 0.00 29.99 31.46 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 -1.18 1.50 -1.43 -0.41 1.02 -1.25 -4.07 120.64 114.82 2yuu n GLU 19 Ca -0.06 -3.11 -0.49 0.00 -0.02 0.00 0.00 57.16 53.47 2yuu n GLU 19 Cb 0.43 -1.23 -0.08 0.00 -0.02 0.00 0.00 31.44 30.54 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 -0.39 1.39 -4.34 -0.32 3.72 -1.22 -3.65 117.46 112.63 2yuu n PHE 20 Ca 0.16 0.35 -0.34 0.00 -0.05 0.00 0.00 57.45 57.57 2yuu n PHE 20 Cb 0.92 -2.49 -0.13 0.00 -0.94 0.00 0.00 39.48 36.84 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 7.82 3.57 -0.08 4.37 1.01 -1.03 -2.16 121.20 134.69 2yuu s ILE 21 Ca 1.13 -0.46 -0.39 0.00 0.00 0.00 0.00 60.65 60.94 2yuu s ILE 21 Cb -0.94 -2.57 -0.17 0.00 0.01 0.00 0.00 42.46 38.80 2yuu s ILE 21 CO 0.49 0.48 1.49 0.00 0.00 0.00 0.00 174.94 177.40 2yuu n ALA 22 N 3.91 -0.88 -3.14 9.38 0.00 -1.26 -3.07 120.51 125.45 2yuu n ALA 22 Ca -0.18 0.47 -0.12 0.00 0.00 0.00 0.00 53.44 53.62 2yuu n ALA 22 Cb 0.52 -2.10 -0.10 0.00 0.00 0.00 0.00 19.45 17.77 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 1.72 0.06 -0.34 0.00 -1.32 -1.25 -4.94 115.64 109.56 2yuu s THR 23 Ca 0.91 -0.47 -0.20 0.00 -1.21 0.00 0.00 61.69 60.72 2yuu s THR 23 Cb -1.04 -0.45 -0.00 0.00 -1.51 0.00 0.00 72.50 69.50 2yuu s THR 23 CO 0.56 -0.26 0.62 0.12 -2.21 0.00 0.00 174.62 173.45 2yuu s PHE 24 N -1.00 3.17 -0.99 9.09 5.36 -1.26 -3.78 117.98 128.57 2yuu s PHE 24 Ca -0.11 0.39 -0.15 0.00 -0.96 0.00 0.00 56.93 56.11 2yuu s PHE 24 Cb -0.06 -3.07 0.19 0.00 -0.34 0.00 0.00 43.02 39.74 2yuu s PHE 24 CO 0.02 -0.57 1.08 -0.06 -1.46 0.00 0.00 175.22 174.23 2yuu s PHE 25 N 2.65 3.58 -1.19 10.12 0.40 -1.26 -4.85 117.98 127.43 2yuu s PHE 25 Ca 0.24 -1.94 0.01 0.00 -0.60 0.00 0.00 56.93 54.64 2yuu s PHE 25 Cb -0.15 -4.08 0.04 0.00 0.51 0.00 0.00 43.02 39.34 2yuu s PHE 25 CO 0.14 -1.23 0.93 0.41 0.70 0.00 0.00 175.22 176.17 2yuu n GLY 26 N 4.30 -0.43 3.28 4.36 0.00 -1.26 -4.59 105.19 110.84 2yuu n GLY 26 Ca 0.24 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.81 1.13 -1.15 1.61 -2.07 -1.26 -5.06 119.66 110.04 2yuu s GLN 27 Ca 0.01 -1.27 -0.23 0.00 -1.82 0.00 0.00 55.36 52.05 2yuu s GLN 27 Cb 0.01 -1.16 -0.08 0.00 -1.09 0.00 0.00 33.01 30.68 2yuu s GLN 27 CO 0.01 0.24 1.94 -1.25 -1.32 0.00 0.00 175.29 174.91 2yuu s PRO 28 N -2.50 2.49 0.38 9.60 0.04 -1.26 -4.73 135.00 139.01 2yuu s PRO 28 Ca 0.10 -1.07 -0.24 0.00 0.04 0.00 0.00 61.00 59.83 2yuu s PRO 28 Cb -0.07 -5.22 -0.10 0.00 0.04 0.00 0.00 34.50 29.16 2yuu s PRO 28 CO 0.05 -3.93 1.00 0.99 0.04 0.00 0.00 177.00 175.14 2yuu s THR 29 N 10.98 3.96 0.24 1.26 2.01 -1.25 -4.61 115.64 128.23 2yuu s THR 29 Ca 0.69 1.50 -0.30 0.00 0.31 0.00 0.00 61.69 63.89 2yuu s THR 29 Cb -0.01 -3.77 -0.09 0.00 0.01 0.00 0.00 72.50 68.64 2yuu s THR 29 CO 0.12 0.01 1.06 0.12 -0.69 0.00 0.00 174.62 175.23 2yuu s PHE 30 N -1.71 3.68 0.48 4.92 5.36 -1.26 0.19 117.98 129.63 2yuu s PHE 30 Ca 0.56 1.73 -0.01 0.00 -0.96 0.00 0.00 56.93 58.25 2yuu s PHE 30 Cb -0.19 -3.21 -0.00 0.00 -0.34 0.00 0.00 43.02 39.28 2yuu s PHE 30 CO 0.24 -0.32 0.72 0.00 -1.46 0.00 0.00 175.22 174.41 2yuu n SER 32 N -2.18 2.54 0.03 0.00 2.88 -1.22 -3.68 113.62 111.99 2yuu n SER 32 Ca 0.02 -0.08 -0.01 0.00 -1.33 0.00 0.00 58.87 57.47 2yuu n SER 32 Cb 0.57 -0.10 -0.01 0.00 -0.75 0.00 0.00 64.21 63.92 2yuu n SER 32 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2yuu h VAL 33 N 0.00 0.00 0.00 2.46 2.07 -1.92 -3.36 116.25 115.49 2yuu h VAL 33 Ca -0.38 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 2yuu h VAL 33 Cb 1.62 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2yuu h VAL 33 CO -0.05 0.00 -0.52 0.00 0.02 0.00 0.00 177.57 177.02 2yuu n LYS 35 N -3.00 -5.71 -5.05 0.00 5.02 -1.24 -5.00 118.16 103.17 2yuu n LYS 35 Ca 0.01 0.78 -0.30 0.00 -2.02 0.00 0.00 58.31 56.78 2yuu n LYS 35 Cb 0.62 -5.51 -0.15 0.00 -0.02 0.00 0.00 35.03 29.97 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 -3.00 3.05 -0.45 4.39 2.15 -1.26 -4.70 116.67 116.85 2yuu s ASP 36 Ca 0.39 -0.53 -0.43 0.00 0.43 0.00 0.00 52.55 52.42 2yuu s ASP 36 Cb -0.17 -0.30 -0.18 0.00 -0.30 0.00 0.00 42.92 41.96 2yuu s ASP 36 CO 0.49 0.28 1.46 0.49 -0.17 0.00 0.00 175.17 177.71 2yuu n PHE 37 N 2.07 1.58 -2.09 -5.34 3.01 -1.26 -3.66 117.46 111.77 2yuu n PHE 37 Ca -0.16 1.03 -0.41 0.00 1.01 0.00 0.00 57.45 58.92 2yuu n PHE 37 Cb 0.52 -2.02 -0.00 0.00 -0.01 0.00 0.00 39.48 37.96 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 3.67 5.03 0.00 -4.37 0.31 0.13 -4.20 118.33 118.91 2yuu n VAL 38 Ca 0.29 -4.37 0.00 0.00 -0.01 0.00 0.00 64.34 60.25 2yuu n VAL 38 Cb -0.05 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 30.73 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 2.23 0.00 -1.89 3.52 4.27 -1.26 -3.86 117.44 120.45 2yuu n TRP 39 Ca 0.57 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.77 2yuu n TRP 39 Cb 0.27 0.00 -0.01 0.00 -1.36 0.00 0.00 31.31 30.22 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 2.50 4.78 3.12 -1.67 0.00 -1.26 -4.90 105.19 107.77 2yuu n GLY 40 Ca 0.00 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 2yuu n GLY 40 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yuu s LEU 41 N -0.56 2.00 0.00 0.99 1.98 -1.26 -5.05 118.68 116.78 2yuu s LEU 41 Ca 0.53 -0.57 0.00 0.00 -2.89 0.00 0.00 54.13 51.20 2yuu s LEU 41 Cb 0.16 -1.36 0.00 0.00 0.66 0.00 0.00 46.19 45.65 2yuu s LEU 41 CO -0.06 0.04 0.68 -3.20 -1.89 0.00 0.00 176.35 171.92 2yuu n ASN 42 N 4.27 0.00 -0.02 3.68 2.85 -1.26 -4.21 115.26 120.57 2yuu n ASN 42 Ca -0.20 0.68 -0.02 0.00 -0.11 0.00 0.00 54.58 54.93 2yuu n ASN 42 Cb 0.51 -0.33 -0.01 0.00 1.24 0.00 0.00 39.78 41.19 2yuu n ASN 42 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2yuu n LYS 43 N -2.59 0.12 -3.83 1.20 5.02 -1.26 -5.13 118.16 111.69 2yuu n LYS 43 Ca 0.00 0.05 -0.04 0.00 -2.02 0.00 0.00 58.31 56.30 2yuu n LYS 43 Cb 0.00 -0.67 0.01 0.00 -0.02 0.00 0.00 35.03 34.35 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 -1.46 1.41 0.00 1.97 -2.07 -1.26 -4.90 119.66 113.35 2yuu s GLN 44 Ca -0.07 -0.87 0.00 0.00 -1.82 0.00 0.00 55.36 52.60 2yuu s GLN 44 Cb 0.01 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.35 2yuu s GLN 44 CO 0.10 -0.66 0.00 0.41 -1.32 0.00 0.00 175.29 173.82 2yuu n GLY 45 N -0.59 3.15 2.97 2.60 0.00 -1.25 -4.69 105.19 107.37 2yuu n GLY 45 Ca -0.05 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 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 4.35 0.14 -0.17 1.61 2.02 -0.39 -3.85 117.35 121.06 2yuu s TYR 46 Ca 0.00 -0.29 -0.04 0.00 -0.37 0.00 0.00 57.07 56.37 2yuu s TYR 46 Cb 0.00 -0.11 0.08 0.00 -0.40 0.00 0.00 41.96 41.53 2yuu s TYR 46 CO 0.00 -0.14 0.25 0.21 -1.57 0.00 0.00 175.55 174.30 2yuu s LYS 47 N -0.97 0.18 -0.01 -0.62 2.20 -1.17 -0.52 119.74 118.83 2yuu s LYS 47 Ca -0.11 0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 55.67 2yuu s LYS 47 Cb -0.07 -0.64 -0.07 0.00 -1.51 0.00 0.00 37.83 35.55 2yuu s LYS 47 CO -0.00 -0.50 1.69 0.00 -0.36 0.00 0.00 175.35 176.18 2yuu n ARG 49 N 6.74 1.01 -0.04 0.00 1.85 -1.24 -0.26 116.66 124.71 2yuu n ARG 49 Ca 0.17 -0.01 -0.10 0.00 -1.00 0.00 0.00 57.85 56.91 2yuu n ARG 49 Cb 0.42 -1.23 -0.03 0.00 -1.05 0.00 0.00 32.46 30.57 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 -0.27 0.25 0.00 2.89 1.13 -1.26 -4.78 117.38 115.35 2yuu n GLN 50 Ca 0.00 0.11 0.06 0.00 -1.94 0.00 0.00 57.00 55.23 2yuu n GLN 50 Cb 0.11 -0.93 -0.05 0.00 0.11 0.00 0.00 30.24 29.48 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 -0.86 -3.27 -4.32 0.00 3.02 0.64 -4.98 115.26 105.48 2yuu n ASN 52 Ca 0.04 -0.36 -0.46 0.00 -0.03 0.00 0.00 54.58 53.77 2yuu n ASN 52 Cb 0.24 -3.34 -0.05 0.00 -0.61 0.00 0.00 39.78 36.02 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 -3.21 3.63 -0.13 5.41 0.00 -1.23 -4.83 121.76 121.40 2yuu s ALA 53 Ca 0.17 -2.49 -0.25 0.00 0.00 0.00 0.00 51.96 49.39 2yuu s ALA 53 Cb -0.07 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 2yuu s ALA 53 CO 0.45 -2.03 0.81 0.00 0.00 0.00 0.00 175.76 174.99 2yuu s ALA 54 N 1.70 3.44 0.22 0.00 0.00 -1.26 -2.60 121.76 123.25 2yuu s ALA 54 Ca 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 2yuu s ALA 54 Cb -0.29 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2yuu s ALA 54 CO 0.03 -0.47 0.18 0.96 0.00 0.00 0.00 175.76 176.46 2yuu s ILE 55 N 1.70 0.00 0.41 0.00 -4.36 0.33 -3.43 121.20 115.85 2yuu s ILE 55 Ca 0.39 -1.95 -0.13 0.00 -0.26 0.00 0.00 60.65 58.70 2yuu s ILE 55 Cb -0.17 -2.48 -0.07 0.00 1.25 0.00 0.00 42.46 40.98 2yuu s ILE 55 CO 0.15 0.00 0.81 -1.00 0.24 0.00 0.00 174.94 175.14 2yuu s HIS 56 N -4.04 3.45 0.48 1.37 3.76 -1.26 -1.26 115.29 117.79 2yuu s HIS 56 Ca 0.38 1.17 0.21 0.00 -0.15 0.00 0.00 55.06 56.68 2yuu s HIS 56 Cb 0.06 -2.54 1.25 0.00 1.11 0.00 0.00 32.58 32.46 2yuu s HIS 56 CO 0.14 -0.13 1.95 -0.22 -0.85 0.00 0.00 174.74 175.64 2yuu h LYS 57 N 1.37 0.18 0.00 1.40 3.64 -1.88 0.11 116.57 121.39 2yuu h LYS 57 Ca -0.47 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 58.74 2yuu h LYS 57 Cb 1.18 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 2yuu h LYS 57 CO 0.63 0.12 -1.15 1.57 -2.27 0.00 0.00 179.45 178.35 2yuu h LYS 58 N 0.19 0.00 0.00 1.90 2.10 -1.98 -3.29 116.57 115.49 2yuu h LYS 58 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 2yuu h LYS 58 Cb 0.99 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.32 2yuu h LYS 58 CO -0.06 0.40 0.00 0.00 -2.00 0.00 0.00 179.45 177.79 2yuu h ILE 60 N 0.00 1.26 -0.00 0.00 2.10 -1.49 -1.52 117.51 117.86 2yuu h ILE 60 Ca 0.00 -0.99 0.00 0.00 1.08 0.00 0.00 64.86 64.95 2yuu h ILE 60 Cb 0.39 0.63 0.00 0.00 -1.09 0.00 0.00 36.82 36.76 2yuu h ILE 60 CO 0.00 0.37 0.00 0.47 -1.08 0.00 0.00 178.15 177.91 2yuu n ASP 61 N -4.22 0.00 -0.10 2.19 8.00 -1.11 -3.37 116.55 117.93 2yuu n ASP 61 Ca 0.04 -1.13 -0.13 0.00 0.71 0.00 0.00 54.79 54.28 2yuu n ASP 61 Cb 0.28 -0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.27 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 -0.93 0.73 -1.05 -1.24 4.76 -0.66 -5.02 118.16 114.75 2yuu n LYS 62 Ca 0.21 0.09 -0.35 0.00 -2.87 0.00 0.00 58.31 55.39 2yuu n LYS 62 Cb 0.10 -1.44 -0.01 0.00 -1.84 0.00 0.00 35.03 31.84 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 -3.00 0.83 -0.00 -0.18 5.41 -0.66 -4.94 119.36 116.81 2yuu n ILE 63 Ca -0.36 -0.40 -0.01 0.00 1.00 0.00 0.00 62.75 62.98 2yuu n ILE 63 Cb 0.95 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 39.88 2yuu n ILE 63 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2yuu n ILE 64 N -0.57 0.44 -0.08 1.39 5.41 -1.26 -5.07 119.36 119.63 2yuu n ILE 64 Ca 0.10 0.24 0.00 0.00 1.00 0.00 0.00 62.75 64.10 2yuu n ILE 64 Cb 0.28 -1.45 0.00 0.00 -0.71 0.00 0.00 39.64 37.76 2yuu n ILE 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2yuu n GLY 65 N 2.60 -3.09 1.32 7.39 0.00 -1.26 -5.04 105.19 107.11 2yuu n GLY 65 Ca -0.02 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.62 2yuu n GLY 65 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2yuu n ARG 66 N -0.76 0.71 -2.62 1.61 -4.01 -1.26 -4.85 116.66 105.48 2yuu n ARG 66 Ca 0.00 -1.36 -0.37 0.00 -1.04 0.00 0.00 57.85 55.08 2yuu n ARG 66 Cb 0.00 0.79 -0.05 0.00 -3.04 0.00 0.00 32.46 30.16 2yuu n ARG 66 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2yuu n THR 68 N 0.39 0.34 -3.01 0.00 5.66 -1.26 -4.81 114.28 111.58 2yuu n THR 68 Ca 0.03 -0.48 -0.44 0.00 -3.05 0.00 0.00 64.05 60.10 2yuu n THR 68 Cb 0.49 -0.10 -0.03 0.00 -1.55 0.00 0.00 70.33 69.14 2yuu n THR 68 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2yuu s GLY 69 N -4.27 2.03 -0.96 1.09 0.00 -1.26 -4.95 107.32 98.99 2yuu s GLY 69 Ca -0.07 -2.78 -0.06 0.00 0.00 0.00 0.00 44.72 41.81 2yuu s GLY 69 CO 0.69 1.84 0.90 -0.51 0.00 0.00 0.00 173.10 176.02 2yuu s THR 70 N 2.28 5.15 0.32 0.90 -4.23 -1.26 -4.82 115.64 113.98 2yuu s THR 70 Ca 0.28 -3.48 -0.14 0.00 -1.18 0.00 0.00 61.69 57.17 2yuu s THR 70 Cb -0.08 -4.15 -0.11 0.00 1.34 0.00 0.00 72.50 69.50 2yuu s THR 70 CO -0.07 -1.11 -0.00 0.00 -0.54 0.00 0.00 174.62 172.90 2yuu n ALA 71 N 2.73 -2.57 -3.07 3.99 0.00 -1.26 -2.96 120.51 117.37 2yuu n ALA 71 Ca 0.21 0.04 -0.13 0.00 0.00 0.00 0.00 53.44 53.55 2yuu n ALA 71 Cb 0.39 -1.04 0.06 0.00 0.00 0.00 0.00 19.45 18.86 2yuu n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yuu n ALA 72 N -0.88 -1.34 -2.02 0.00 0.00 -1.26 -5.03 120.51 109.98 2yuu n ALA 72 Ca 0.07 0.02 -0.18 0.00 0.00 0.00 0.00 53.44 53.36 2yuu n ALA 72 Cb 0.31 -2.30 0.02 0.00 0.00 0.00 0.00 19.45 17.49 2yuu n ALA 72 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2yuu s ASN 73 N -3.82 5.52 1.16 0.00 2.47 -1.15 -5.08 114.94 114.03 2yuu s ASN 73 Ca 0.08 -0.53 -0.17 0.00 0.42 0.00 0.00 52.86 52.66 2yuu s ASN 73 Cb -0.04 -0.42 0.18 0.00 -1.45 0.00 0.00 41.25 39.53 2yuu s ASN 73 CO 0.52 -0.91 0.34 -1.54 -3.72 0.00 0.00 177.10 171.80 2yuu n SER 74 N -1.95 -2.45 -3.28 -4.21 3.41 -1.26 -3.56 113.62 100.33 2yuu n SER 74 Ca 0.10 -0.23 -0.24 0.00 -0.26 0.00 0.00 58.87 58.24 2yuu n SER 74 Cb 0.60 -1.01 0.04 0.00 -0.26 0.00 0.00 64.21 63.58 2yuu n SER 74 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2yuu n ARG 75 N -3.09 -5.64 -3.91 4.33 1.74 -1.26 -4.96 116.66 103.87 2yuu n ARG 75 Ca 0.02 0.82 -0.08 0.00 -0.77 0.00 0.00 57.85 57.85 2yuu n ARG 75 Cb 0.58 -5.73 -0.03 0.00 -1.02 0.00 0.00 32.46 26.26 2yuu n ARG 75 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2yuu s ASP 76 N -2.92 -0.17 0.15 0.55 2.15 -1.23 -5.13 116.67 110.08 2yuu s ASP 76 Ca 0.42 -0.77 -0.21 0.00 0.43 0.00 0.00 52.55 52.42 2yuu s ASP 76 Cb -0.19 0.68 -0.13 0.00 -0.30 0.00 0.00 42.92 42.98 2yuu s ASP 76 CO 0.52 -1.29 0.39 1.07 -0.17 0.00 0.00 175.17 175.69 2yuu n THR 77 N -0.44 1.50 -3.89 1.71 5.66 -1.26 -4.95 114.28 112.61 2yuu n THR 77 Ca -0.03 -0.38 -0.22 0.00 -3.05 0.00 0.00 64.05 60.37 2yuu n THR 77 Cb 0.60 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.34 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 -0.76 5.12 0.00 1.09 0.15 -1.26 -4.94 113.70 113.10 2yuu s SER 78 Ca 0.48 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.56 2yuu s SER 78 Cb -0.70 -0.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.70 2yuu s SER 78 CO 0.42 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 175.14 2yuu n GLY 79 N -1.31 -1.80 3.77 9.45 0.00 -1.26 -5.17 105.19 108.88 2yuu n GLY 79 Ca -0.02 0.68 -0.33 0.00 0.00 0.00 0.00 46.02 46.35 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 2.72 0.83 1.61 0.04 -1.26 -5.05 135.00 133.89 2yuu s PRO 80 Ca 0.00 1.35 -0.10 0.00 0.04 0.00 0.00 61.00 62.29 2yuu s PRO 80 Cb 0.00 -1.94 0.14 0.00 0.04 0.00 0.00 34.50 32.74 2yuu s PRO 80 CO 0.00 -1.31 1.17 -1.54 0.04 0.00 0.00 177.00 175.36 2yuu s SER 81 N -2.71 3.92 0.31 6.66 1.04 -1.26 -5.11 113.70 116.54 2yuu s SER 81 Ca 0.66 0.23 -0.16 0.00 0.48 0.00 0.00 55.95 57.15 2yuu s SER 81 Cb -0.20 -0.53 0.02 0.00 0.10 0.00 0.00 66.02 65.41 2yuu s SER 81 CO 0.44 -2.20 0.67 -0.44 0.98 0.00 0.00 173.24 172.69 2yuu s SER 82 N -4.74 -0.06 0.00 7.02 0.01 -1.26 -5.35 113.70 109.32 2yuu s SER 82 Ca 0.68 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 57.05 2yuu s SER 82 Cb -0.06 0.73 0.00 0.00 0.21 0.00 0.00 66.02 66.89 2yuu s SER 82 CO 0.49 -1.40 0.00 0.61 0.41 0.00 0.00 173.24 173.35