#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 -0.39 -0.13 1.61 1.04 -1.26 -5.17 113.70 109.40 2yuu s SER 2 Ca 0.00 -0.15 -0.06 0.00 0.48 0.00 0.00 55.95 56.23 2yuu s SER 2 Cb 0.00 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.71 2yuu s SER 2 CO 0.00 -0.90 0.28 -0.44 0.98 0.00 0.00 173.24 173.17 2yuu s SER 3 N -2.73 0.01 1.10 7.02 0.01 -1.26 -5.16 113.70 112.69 2yuu s SER 3 Ca 0.02 0.63 -0.12 0.00 1.31 0.00 0.00 55.95 57.79 2yuu s SER 3 Cb 0.00 0.66 0.17 0.00 0.21 0.00 0.00 66.02 67.07 2yuu s SER 3 CO -0.12 -0.21 0.73 0.61 0.41 0.00 0.00 173.24 174.66 2yuu n GLY 4 N 4.87 -2.18 3.64 3.44 0.00 -1.26 -5.10 105.19 108.60 2yuu n GLY 4 Ca -0.15 -1.56 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 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 -3.59 -0.57 1.38 1.61 0.01 -1.26 -5.17 113.70 106.11 2yuu s SER 5 Ca 0.45 1.02 -0.21 0.00 1.31 0.00 0.00 55.95 58.52 2yuu s SER 5 Cb -0.03 1.10 0.35 0.00 0.21 0.00 0.00 66.02 67.65 2yuu s SER 5 CO 0.33 -0.17 0.84 -0.24 0.41 0.00 0.00 173.24 174.42 2yuu n SER 6 N 2.86 -3.55 -2.90 2.44 2.88 -1.26 -5.04 113.62 109.05 2yuu n SER 6 Ca -0.15 -0.67 -0.10 0.00 -1.33 0.00 0.00 58.87 56.62 2yuu n SER 6 Cb 0.56 -1.04 -0.01 0.00 -0.75 0.00 0.00 64.21 62.97 2yuu n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yuu n GLY 7 N 1.75 0.19 3.17 0.46 0.00 -1.26 -5.15 105.19 104.36 2yuu n GLY 7 Ca 0.10 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2yuu n GLY 7 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2yuu n LYS 8 N 2.70 -3.67 -1.98 1.61 2.85 -1.26 -4.87 118.16 113.54 2yuu n LYS 8 Ca 0.19 -1.08 -0.42 0.00 -1.05 0.00 0.00 58.31 55.95 2yuu n LYS 8 Cb 0.55 -1.78 -0.03 0.00 -0.65 0.00 0.00 35.03 33.12 2yuu n LYS 8 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2yuu s GLN 9 N -4.40 4.24 0.40 -1.58 -1.52 -1.26 -5.01 119.66 110.54 2yuu s GLN 9 Ca 0.56 2.32 0.05 0.00 -1.95 0.00 0.00 55.36 56.34 2yuu s GLN 9 Cb -0.11 -3.15 -0.02 0.00 -0.22 0.00 0.00 33.01 29.51 2yuu s GLN 9 CO 0.50 -0.53 0.17 0.00 -0.25 0.00 0.00 175.29 175.17 2yuu n ALA 10 N 3.42 0.60 -3.09 6.09 0.00 -1.26 -5.18 120.51 121.09 2yuu n ALA 10 Ca 0.11 -2.08 -0.11 0.00 0.00 0.00 0.00 53.44 51.36 2yuu n ALA 10 Cb 0.39 1.44 -0.10 0.00 0.00 0.00 0.00 19.45 21.19 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 -3.55 0.49 -0.15 0.00 -2.85 -1.26 -5.14 119.74 107.29 2yuu s LYS 11 Ca 0.23 -0.42 -0.06 0.00 -1.00 0.00 0.00 55.97 54.73 2yuu s LYS 11 Cb 0.01 0.20 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 2yuu s LYS 11 CO 0.17 -0.12 0.05 0.42 0.10 0.00 0.00 175.35 175.97 2yuu s ILE 12 N -1.44 4.72 -0.52 3.79 1.01 -1.26 -4.15 121.20 123.35 2yuu s ILE 12 Ca -0.14 -0.07 -0.18 0.00 0.00 0.00 0.00 60.65 60.25 2yuu s ILE 12 Cb -0.07 -3.08 0.08 0.00 0.01 0.00 0.00 42.46 39.39 2yuu s ILE 12 CO 0.01 0.52 0.59 -1.00 0.00 0.00 0.00 174.94 175.06 2yuu s HIS 13 N -0.17 3.09 -0.44 3.97 3.76 -0.76 -4.95 115.29 119.79 2yuu s HIS 13 Ca 0.07 -0.76 -0.06 0.00 -0.15 0.00 0.00 55.06 54.16 2yuu s HIS 13 Cb -0.12 -3.58 -0.18 0.00 1.11 0.00 0.00 32.58 29.80 2yuu s HIS 13 CO 0.01 -1.04 3.05 0.66 -0.85 0.00 0.00 174.74 176.58 2yuu n TYR 14 N 5.95 0.66 -3.23 1.40 4.01 -1.25 -3.25 117.16 121.44 2yuu n TYR 14 Ca -0.09 -1.75 -0.35 0.00 -0.16 0.00 0.00 57.90 55.54 2yuu n TYR 14 Cb 0.44 -1.69 -0.06 0.00 -0.31 0.00 0.00 39.34 37.72 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 1.67 4.71 -0.70 -0.72 1.09 -1.25 -4.05 121.20 121.96 2yuu s ILE 15 Ca 0.59 1.04 -0.09 0.00 -1.10 0.00 0.00 60.65 61.09 2yuu s ILE 15 Cb 0.24 -3.78 0.09 0.00 -1.06 0.00 0.00 42.46 37.94 2yuu s ILE 15 CO -0.02 0.20 0.22 0.29 -0.10 0.00 0.00 174.94 175.53 2yuu n LYS 16 N 0.69 -2.17 -3.31 2.79 4.76 -1.26 0.20 118.16 119.85 2yuu n LYS 16 Ca -0.03 0.06 -0.18 0.00 -2.87 0.00 0.00 58.31 55.29 2yuu n LYS 16 Cb 0.52 -4.59 0.06 0.00 -1.84 0.00 0.00 35.03 29.18 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 -1.86 -4.93 -3.96 4.39 4.13 -1.26 -3.30 115.26 108.47 2yuu n ASN 17 Ca 0.04 -0.43 -0.24 0.00 1.68 0.00 0.00 54.58 55.64 2yuu n ASN 17 Cb 0.48 -4.01 -0.05 0.00 -1.54 0.00 0.00 39.78 34.66 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 -4.30 0.80 -2.08 3.10 8.25 0.52 -3.76 115.22 117.75 2yuu n HIS 18 Ca -0.02 -1.83 0.03 0.00 -0.26 0.00 0.00 57.72 55.63 2yuu n HIS 18 Cb 0.56 -0.25 0.11 0.00 1.12 0.00 0.00 29.99 31.53 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 -0.95 1.08 -1.35 -0.41 4.71 -1.25 -3.89 120.64 118.57 2yuu n GLU 19 Ca -0.15 -2.84 -0.54 0.00 -0.01 0.00 0.00 57.16 53.62 2yuu n GLU 19 Cb 0.47 -0.99 -0.10 0.00 -1.01 0.00 0.00 31.44 29.81 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 -0.38 1.33 -4.09 -0.32 3.72 -1.20 -3.92 117.46 112.60 2yuu n PHE 20 Ca 0.15 0.52 -0.35 0.00 -0.05 0.00 0.00 57.45 57.71 2yuu n PHE 20 Cb 0.91 -2.41 -0.12 0.00 -0.94 0.00 0.00 39.48 36.92 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 6.86 4.09 -0.25 4.37 1.01 -0.27 -1.82 121.20 135.19 2yuu s ILE 21 Ca 1.16 -0.27 -0.41 0.00 0.00 0.00 0.00 60.65 61.13 2yuu s ILE 21 Cb -1.17 -2.85 -0.17 0.00 0.01 0.00 0.00 42.46 38.28 2yuu s ILE 21 CO 0.57 0.43 1.59 0.00 0.00 0.00 0.00 174.94 177.53 2yuu n ALA 22 N 4.10 -0.86 -3.15 9.38 0.00 -1.26 -3.28 120.51 125.44 2yuu n ALA 22 Ca -0.17 0.45 -0.13 0.00 0.00 0.00 0.00 53.44 53.60 2yuu n ALA 22 Cb 0.52 -2.09 -0.11 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 2.65 0.02 -0.34 0.00 -1.32 -1.24 -4.96 115.64 110.45 2yuu s THR 23 Ca 0.97 -0.17 -0.15 0.00 -1.21 0.00 0.00 61.69 61.12 2yuu s THR 23 Cb -1.17 -0.41 -0.01 0.00 -1.51 0.00 0.00 72.50 69.40 2yuu s THR 23 CO 0.66 -0.10 0.38 0.12 -2.21 0.00 0.00 174.62 173.47 2yuu s PHE 24 N -0.31 3.21 -0.89 9.09 5.36 -1.26 -2.75 117.98 130.42 2yuu s PHE 24 Ca -0.04 -0.02 -0.18 0.00 -0.96 0.00 0.00 56.93 55.73 2yuu s PHE 24 Cb -0.03 -2.70 0.14 0.00 -0.34 0.00 0.00 43.02 40.10 2yuu s PHE 24 CO 0.01 -0.45 1.04 -0.06 -1.46 0.00 0.00 175.22 174.31 2yuu s PHE 25 N 2.05 3.22 0.61 10.12 0.40 -1.26 -4.87 117.98 128.26 2yuu s PHE 25 Ca 0.12 -1.47 0.29 0.00 -0.60 0.00 0.00 56.93 55.28 2yuu s PHE 25 Cb -0.16 -4.19 1.55 0.00 0.51 0.00 0.00 43.02 40.73 2yuu s PHE 25 CO 0.12 -1.39 1.93 0.78 0.70 0.00 0.00 175.22 177.36 2yuu h GLY 26 N 9.93 0.00 -3.24 4.36 0.00 -1.95 -3.41 103.07 108.75 2yuu h GLY 26 Ca 0.12 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.88 2yuu h GLY 26 CO 1.04 0.00 -0.63 1.20 0.00 0.00 0.00 176.54 178.16 2yuu s GLN 27 N -4.45 2.50 -1.19 4.80 -0.21 -1.26 -5.03 119.66 114.82 2yuu s GLN 27 Ca -0.04 -1.15 -0.23 0.00 0.02 0.00 0.00 55.36 53.96 2yuu s GLN 27 Cb 0.13 -2.37 -0.09 0.00 1.00 0.00 0.00 33.01 31.69 2yuu s GLN 27 CO 0.46 0.43 1.93 -1.25 -2.12 0.00 0.00 175.29 174.74 2yuu s PRO 28 N -3.27 2.50 0.89 2.91 0.04 -1.26 -4.93 135.00 131.88 2yuu s PRO 28 Ca 0.29 -1.18 -0.12 0.00 0.04 0.00 0.00 61.00 60.04 2yuu s PRO 28 Cb -0.08 -5.25 0.13 0.00 0.04 0.00 0.00 34.50 29.34 2yuu s PRO 28 CO 0.20 -3.98 1.12 0.99 0.04 0.00 0.00 177.00 175.37 2yuu s THR 29 N 10.99 2.33 0.33 1.26 2.01 -1.26 -4.72 115.64 126.59 2yuu s THR 29 Ca 0.68 0.11 0.01 0.00 0.31 0.00 0.00 61.69 62.81 2yuu s THR 29 Cb -0.01 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.66 2yuu s THR 29 CO 0.13 -0.14 0.52 0.12 -0.69 0.00 0.00 174.62 174.56 2yuu s PHE 30 N -3.19 3.48 0.30 4.92 5.36 -1.26 -1.85 117.98 125.74 2yuu s PHE 30 Ca 0.63 0.27 0.09 0.00 -0.96 0.00 0.00 56.93 56.96 2yuu s PHE 30 Cb -0.15 -1.85 -0.04 0.00 -0.34 0.00 0.00 43.02 40.63 2yuu s PHE 30 CO 0.54 0.16 0.03 0.00 -1.46 0.00 0.00 175.22 174.50 2yuu n SER 32 N -0.97 2.08 0.01 0.00 2.88 -1.19 -3.55 113.62 112.88 2yuu n SER 32 Ca -0.05 0.03 -0.01 0.00 -1.33 0.00 0.00 58.87 57.51 2yuu n SER 32 Cb 0.60 -0.45 -0.00 0.00 -0.75 0.00 0.00 64.21 63.61 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 -0.30 0.00 0.07 2.46 2.07 -1.92 -3.37 116.25 115.27 2yuu h VAL 33 Ca -0.50 -0.00 -0.32 0.00 0.82 0.00 0.00 66.70 66.69 2yuu h VAL 33 Cb 1.64 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2yuu h VAL 33 CO -0.17 0.00 -1.80 0.00 0.02 0.00 0.00 177.57 175.62 2yuu n LYS 35 N -3.30 -1.98 -4.34 0.00 5.02 -1.23 -5.02 118.16 107.31 2yuu n LYS 35 Ca -0.23 0.31 -0.20 0.00 -2.02 0.00 0.00 58.31 56.16 2yuu n LYS 35 Cb 1.05 -3.54 -0.16 0.00 -0.02 0.00 0.00 35.03 32.36 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 -3.40 1.13 -0.34 4.39 -1.08 -1.26 -4.76 116.67 111.35 2yuu s ASP 36 Ca 0.04 -0.17 -0.31 0.00 -0.52 0.00 0.00 52.55 51.59 2yuu s ASP 36 Cb -0.01 -0.33 -0.13 0.00 -1.46 0.00 0.00 42.92 40.99 2yuu s ASP 36 CO 0.26 0.05 1.25 0.49 0.52 0.00 0.00 175.17 177.74 2yuu n PHE 37 N 3.38 0.99 -0.70 -5.34 3.01 -1.26 -4.31 117.46 113.23 2yuu n PHE 37 Ca -0.19 0.65 -0.06 0.00 1.01 0.00 0.00 57.45 58.87 2yuu n PHE 37 Cb 0.54 -1.52 -0.08 0.00 -0.01 0.00 0.00 39.48 38.41 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 3.49 2.35 -2.23 -4.37 0.31 -0.77 -4.19 118.33 112.91 2yuu n VAL 38 Ca 0.28 -0.93 -0.23 0.00 -0.01 0.00 0.00 64.34 63.45 2yuu n VAL 38 Cb -0.03 -1.72 0.02 0.00 -0.91 0.00 0.00 33.84 31.20 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 2.01 2.81 0.00 3.52 4.27 -1.26 -4.28 117.44 124.51 2yuu n TRP 39 Ca 0.20 -2.51 0.00 0.00 -3.89 0.00 0.00 57.50 51.30 2yuu n TRP 39 Cb 0.66 -0.25 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 -0.61 0.80 0.11 -1.67 0.00 -1.26 -4.88 105.19 97.68 2yuu n GLY 40 Ca 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.38 2yuu n GLY 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yuu n LEU 41 N 0.00 -0.29 -3.78 0.99 4.77 -1.26 -4.11 117.00 113.32 2yuu n LEU 41 Ca 0.00 0.92 -0.27 0.00 -0.03 0.00 0.00 56.01 56.63 2yuu n LEU 41 Cb 0.00 -0.28 -0.17 0.00 -2.33 0.00 0.00 43.42 40.64 2yuu n LEU 41 CO 0.00 -0.61 -0.38 0.20 -1.33 0.00 0.00 177.39 175.26 2yuu s ASN 42 N -3.90 2.75 0.35 -1.43 -0.87 -1.26 -5.01 114.94 105.58 2yuu s ASN 42 Ca -0.03 -0.70 0.17 0.00 -1.57 0.00 0.00 52.86 50.72 2yuu s ASN 42 Cb 0.03 -0.67 1.14 0.00 -0.02 0.00 0.00 41.25 41.73 2yuu s ASN 42 CO 0.17 -0.26 1.66 0.11 -2.57 0.00 0.00 177.10 176.21 2yuu h LYS 43 N 8.21 0.28 -7.11 -0.60 1.57 -1.75 -3.41 116.57 113.76 2yuu h LYS 43 Ca -0.18 -0.02 -0.52 0.00 -1.87 0.00 0.00 60.65 58.06 2yuu h LYS 43 Cb 1.12 -0.06 0.21 0.00 0.08 0.00 0.00 32.23 33.57 2yuu h LYS 43 CO 0.34 0.18 -0.04 0.94 -0.57 0.00 0.00 179.45 180.30 2yuu n GLN 44 N -5.01 -0.54 0.00 3.15 0.00 -1.26 -4.30 117.38 109.42 2yuu n GLN 44 Ca 0.32 -0.10 0.00 0.00 -0.00 0.00 0.00 57.00 57.22 2yuu n GLN 44 Cb 1.04 -2.21 0.00 0.00 0.00 0.00 0.00 30.24 29.07 2yuu n GLN 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2yuu n GLY 45 N 0.69 1.26 2.95 1.69 0.00 -1.11 -4.65 105.19 106.02 2yuu n GLY 45 Ca 0.10 0.23 -0.13 0.00 0.00 0.00 0.00 46.02 46.21 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 1.59 0.34 -0.11 1.61 2.02 -0.79 -3.58 117.35 118.43 2yuu s TYR 46 Ca 0.00 -0.19 -0.05 0.00 -0.37 0.00 0.00 57.07 56.46 2yuu s TYR 46 Cb 0.00 -0.22 0.05 0.00 -0.40 0.00 0.00 41.96 41.39 2yuu s TYR 46 CO 0.00 -0.04 0.24 0.21 -1.57 0.00 0.00 175.55 174.39 2yuu s LYS 47 N -0.51 0.17 -0.24 -0.62 2.20 -1.21 -0.20 119.74 119.32 2yuu s LYS 47 Ca -0.03 0.60 -0.29 0.00 -0.36 0.00 0.00 55.97 55.89 2yuu s LYS 47 Cb -0.04 -0.11 -0.00 0.00 -1.51 0.00 0.00 37.83 36.17 2yuu s LYS 47 CO -0.00 -0.22 1.25 0.00 -0.36 0.00 0.00 175.35 176.03 2yuu n ARG 49 N 6.94 0.83 -0.05 0.00 1.85 -1.25 0.27 116.66 125.24 2yuu n ARG 49 Ca 0.14 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.89 2yuu n ARG 49 Cb 0.46 -1.05 -0.03 0.00 -1.05 0.00 0.00 32.46 30.78 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 -0.55 0.35 0.00 2.89 1.13 -1.26 -4.73 117.38 115.20 2yuu n GLN 50 Ca 0.02 0.14 0.10 0.00 -1.94 0.00 0.00 57.00 55.32 2yuu n GLN 50 Cb 0.01 -1.10 -0.01 0.00 0.11 0.00 0.00 30.24 29.25 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 -0.09 -3.63 -4.17 0.00 4.13 0.14 -4.98 115.26 106.66 2yuu n ASN 52 Ca 0.08 -0.57 -0.39 0.00 1.68 0.00 0.00 54.58 55.38 2yuu n ASN 52 Cb 0.41 -4.52 -0.09 0.00 -1.54 0.00 0.00 39.78 34.04 2yuu n ASN 52 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2yuu s ALA 53 N -3.32 3.44 -0.06 5.41 0.00 -1.21 -4.84 121.76 121.18 2yuu s ALA 53 Ca 0.16 -2.78 -0.24 0.00 0.00 0.00 0.00 51.96 49.10 2yuu s ALA 53 Cb -0.02 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 2yuu s ALA 53 CO 0.63 -1.96 0.74 0.00 0.00 0.00 0.00 175.76 175.18 2yuu s ALA 54 N 0.86 3.31 0.30 0.00 0.00 -1.26 -2.51 121.76 122.46 2yuu s ALA 54 Ca 0.10 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.28 2yuu s ALA 54 Cb -0.23 -3.02 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 2yuu s ALA 54 CO -0.03 -0.12 0.32 0.96 0.00 0.00 0.00 175.76 176.89 2yuu s ILE 55 N 0.83 0.00 0.33 0.00 -4.36 0.71 -3.19 121.20 115.52 2yuu s ILE 55 Ca 0.40 -1.85 -0.23 0.00 -0.26 0.00 0.00 60.65 58.71 2yuu s ILE 55 Cb -0.18 -2.53 -0.10 0.00 1.25 0.00 0.00 42.46 40.90 2yuu s ILE 55 CO 0.20 0.00 0.89 -1.00 0.24 0.00 0.00 174.94 175.27 2yuu s HIS 56 N -3.49 3.57 0.59 1.37 3.76 -1.26 -1.88 115.29 117.94 2yuu s HIS 56 Ca 0.36 1.62 0.29 0.00 -0.15 0.00 0.00 55.06 57.18 2yuu s HIS 56 Cb 0.02 -2.82 1.45 0.00 1.11 0.00 0.00 32.58 32.34 2yuu s HIS 56 CO 0.21 0.15 1.86 -0.22 -0.85 0.00 0.00 174.74 175.89 2yuu h LYS 57 N 2.84 0.00 0.00 1.40 3.64 -1.87 0.42 116.57 123.00 2yuu h LYS 57 Ca -0.48 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.68 2yuu h LYS 57 Cb 1.19 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 2yuu h LYS 57 CO 0.64 0.00 -1.69 0.36 -2.27 0.00 0.00 179.45 176.49 2yuu n LYS 58 N -3.64 0.64 0.22 1.90 2.85 -1.26 -3.95 118.16 114.92 2yuu n LYS 58 Ca 0.09 0.18 0.15 0.00 -1.05 0.00 0.00 58.31 57.68 2yuu n LYS 58 Cb 0.71 -1.74 0.64 0.00 -0.65 0.00 0.00 35.03 33.99 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 1.20 0.00 0.00 2.10 -1.53 -0.24 117.51 119.05 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 0.41 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 36.26 2yuu h ILE 60 CO 0.00 0.20 0.00 0.47 -1.08 0.00 0.00 178.15 177.74 2yuu n ASP 61 N -4.53 0.00 -0.12 2.19 8.00 -1.13 -2.97 116.55 118.00 2yuu n ASP 61 Ca 0.07 -0.77 -0.15 0.00 0.71 0.00 0.00 54.79 54.65 2yuu n ASP 61 Cb 0.03 -0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.00 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 -1.00 0.67 -0.96 -1.24 4.76 -0.17 -5.00 118.16 115.20 2yuu n LYS 62 Ca 0.19 0.09 -0.33 0.00 -2.87 0.00 0.00 58.31 55.39 2yuu n LYS 62 Cb 0.09 -1.52 -0.02 0.00 -1.84 0.00 0.00 35.03 31.74 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 -3.06 1.23 0.00 -0.18 5.41 -0.77 -4.90 119.36 117.09 2yuu n ILE 63 Ca -0.41 -0.35 0.00 0.00 1.00 0.00 0.00 62.75 63.00 2yuu n ILE 63 Cb 1.06 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.99 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 -0.12 0.00 -0.27 1.39 5.41 -1.26 -5.04 119.36 119.47 2yuu n ILE 64 Ca 0.12 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.87 2yuu n ILE 64 Cb 0.19 -0.78 0.00 0.00 -0.71 0.00 0.00 39.64 38.34 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 2.79 -2.76 3.64 7.39 0.00 -1.26 -5.08 105.19 109.92 2yuu n GLY 65 Ca 0.00 -1.37 -0.29 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.31 2.02 0.18 1.61 0.52 -1.26 -4.88 118.95 114.82 2yuu s ARG 66 Ca 0.00 -2.22 -0.25 0.00 -0.52 0.00 0.00 55.73 52.74 2yuu s ARG 66 Cb 0.00 -1.35 -0.08 0.00 0.52 0.00 0.00 34.95 34.04 2yuu s ARG 66 CO 0.00 -0.26 0.79 0.00 0.02 0.00 0.00 175.30 175.85 2yuu n THR 68 N 1.52 1.65 -1.52 0.00 5.66 -1.26 -4.48 114.28 115.84 2yuu n THR 68 Ca -0.05 -0.64 -0.35 0.00 -3.05 0.00 0.00 64.05 59.96 2yuu n THR 68 Cb 0.49 -1.54 -0.04 0.00 -1.55 0.00 0.00 70.33 67.68 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 2.07 4.45 3.79 1.09 0.00 -1.26 -4.92 105.19 110.41 2yuu n GLY 69 Ca -0.37 -1.69 -0.36 0.00 0.00 0.00 0.00 46.02 43.61 2yuu n GLY 69 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2yuu s THR 70 N 0.54 5.43 0.45 2.61 -1.32 -1.26 -4.64 115.64 117.44 2yuu s THR 70 Ca 0.63 0.19 0.07 0.00 -1.21 0.00 0.00 61.69 61.37 2yuu s THR 70 Cb 0.21 -3.42 -0.01 0.00 -1.51 0.00 0.00 72.50 67.77 2yuu s THR 70 CO -0.08 0.52 0.38 0.00 -2.21 0.00 0.00 174.62 173.23 2yuu s ALA 71 N -0.27 4.11 -0.66 11.08 0.00 -1.26 -4.71 121.76 130.04 2yuu s ALA 71 Ca 0.11 -1.80 -0.04 0.00 0.00 0.00 0.00 51.96 50.23 2yuu s ALA 71 Cb -0.11 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.11 2yuu s ALA 71 CO 0.01 -0.29 0.58 0.00 0.00 0.00 0.00 175.76 176.05 2yuu n ALA 72 N -1.58 -0.71 -1.67 0.00 0.00 -1.26 -4.91 120.51 110.38 2yuu n ALA 72 Ca 0.02 0.17 -0.52 0.00 0.00 0.00 0.00 53.44 53.12 2yuu n ALA 72 Cb 0.63 -2.77 -0.06 0.00 0.00 0.00 0.00 19.45 17.25 2yuu n ALA 72 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2yuu n ASN 73 N -0.96 2.98 -3.86 0.00 5.15 -1.26 -4.95 115.26 112.36 2yuu n ASN 73 Ca -0.02 0.95 -0.20 0.00 -0.60 0.00 0.00 54.58 54.71 2yuu n ASN 73 Cb 0.54 -1.29 -0.16 0.00 -0.53 0.00 0.00 39.78 38.34 2yuu n ASN 73 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2yuu s SER 74 N 4.28 0.94 0.58 1.20 0.15 -1.26 -5.13 113.70 114.46 2yuu s SER 74 Ca 0.96 -0.10 -0.18 0.00 0.70 0.00 0.00 55.95 57.33 2yuu s SER 74 Cb -0.83 -0.41 -0.07 0.00 -1.71 0.00 0.00 66.02 63.01 2yuu s SER 74 CO 0.56 -0.08 0.74 -1.14 1.20 0.00 0.00 173.24 174.52 2yuu n ARG 75 N 4.21 0.70 -0.54 5.44 0.63 -1.26 -4.93 116.66 120.91 2yuu n ARG 75 Ca -0.23 0.27 -0.25 0.00 -0.92 0.00 0.00 57.85 56.73 2yuu n ARG 75 Cb 0.51 -1.93 0.18 0.00 0.45 0.00 0.00 32.46 31.66 2yuu n ARG 75 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2yuu n ASP 76 N -0.14 -2.92 -4.54 6.15 9.92 -1.26 -4.66 116.55 119.10 2yuu n ASP 76 Ca 0.13 -0.36 -0.59 0.00 -0.53 0.00 0.00 54.79 53.44 2yuu n ASP 76 Cb 0.47 -0.87 -0.09 0.00 -0.64 0.00 0.00 41.12 40.00 2yuu n ASP 76 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 2yuu n THR 77 N -4.61 0.15 -4.13 -3.53 -1.04 -1.26 -4.93 114.28 94.92 2yuu n THR 77 Ca 0.05 -0.08 -0.12 0.00 -2.04 0.00 0.00 64.05 61.86 2yuu n THR 77 Cb 0.48 -1.00 -0.11 0.00 -1.82 0.00 0.00 70.33 67.89 2yuu n THR 77 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2yuu s SER 78 N 4.91 1.08 -0.43 8.00 0.01 -1.26 -5.10 113.70 120.91 2yuu s SER 78 Ca 1.08 -0.82 0.08 0.00 1.31 0.00 0.00 55.95 57.60 2yuu s SER 78 Cb -1.21 0.06 0.27 0.00 0.21 0.00 0.00 66.02 65.34 2yuu s SER 78 CO 0.65 -0.34 0.73 0.61 0.41 0.00 0.00 173.24 175.30 2yuu n GLY 79 N 0.58 1.73 3.65 3.44 0.00 -1.26 -5.14 105.19 108.19 2yuu n GLY 79 Ca -0.16 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.53 -0.01 0.25 1.61 0.04 -1.26 -4.95 135.00 130.15 2yuu s PRO 80 Ca 0.33 0.38 -0.31 0.00 0.04 0.00 0.00 61.00 61.44 2yuu s PRO 80 Cb 0.22 -1.70 -0.11 0.00 0.04 0.00 0.00 34.50 32.95 2yuu s PRO 80 CO -0.15 -2.99 1.64 -1.12 0.04 0.00 0.00 177.00 174.42 2yuu s SER 81 N -3.53 6.40 0.88 6.66 0.01 -1.26 -4.95 113.70 117.92 2yuu s SER 81 Ca 0.67 2.88 -0.12 0.00 1.31 0.00 0.00 55.95 60.69 2yuu s SER 81 Cb -0.17 -2.62 0.10 0.00 0.21 0.00 0.00 66.02 63.55 2yuu s SER 81 CO 0.57 -0.92 1.02 -0.24 0.41 0.00 0.00 173.24 174.08 2yuu n SER 82 N 3.08 0.08 0.00 2.44 2.88 -1.26 -5.33 113.62 115.51 2yuu n SER 82 Ca 0.12 0.46 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 2yuu n SER 82 Cb 0.37 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 2yuu n SER 82 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42