#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yju n GLY 2 N 0.00 1.31 3.68 3.03 0.00 -1.26 -4.83 105.19 107.12 1yju n GLY 2 Ca 0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1yju n GLY 2 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1yju s ASP 3 N 0.00 2.40 -0.29 1.61 -4.77 -1.26 -4.94 116.67 109.42 1yju s ASP 3 Ca 0.00 1.03 -0.29 0.00 -3.30 0.00 0.00 52.55 49.99 1yju s ASP 3 Cb 0.00 -1.60 -0.02 0.00 -1.09 0.00 0.00 42.92 40.21 1yju s ASP 3 CO 0.00 -3.25 1.70 -0.83 0.70 0.00 0.00 175.17 173.49 1yju s GLY 4 N -3.63 0.99 0.35 2.12 0.00 -0.71 -4.90 107.32 101.53 1yju s GLY 4 Ca 0.66 0.33 -0.25 0.00 0.00 0.00 0.00 44.72 45.46 1yju s GLY 4 CO 0.57 3.13 0.95 0.54 0.00 0.00 0.00 173.10 178.30 1yju s VAL 5 N 6.10 4.20 -0.37 1.40 0.11 -1.26 -0.30 120.40 130.28 1yju s VAL 5 Ca 0.76 1.73 0.00 0.00 -2.93 0.00 0.00 61.98 61.54 1yju s VAL 5 Cb -0.23 -3.92 0.13 0.00 -1.53 0.00 0.00 36.38 30.84 1yju s VAL 5 CO 0.32 0.06 0.21 -0.22 -3.33 0.00 0.00 175.10 172.13 1yju s LEU 6 N -2.28 1.53 -0.46 2.54 1.98 0.57 -4.91 118.68 117.64 1yju s LEU 6 Ca 0.53 -2.23 -0.15 0.00 -2.89 0.00 0.00 54.13 49.38 1yju s LEU 6 Cb -0.17 -0.61 0.07 0.00 0.66 0.00 0.00 46.19 46.14 1yju s LEU 6 CO 0.22 -0.31 0.38 -1.61 -1.89 0.00 0.00 176.35 173.14 1yju s GLU 7 N 0.95 2.96 0.06 1.98 2.02 -1.26 -0.57 118.70 124.84 1yju s GLU 7 Ca 0.17 -1.32 0.05 0.00 0.02 0.00 0.00 54.97 53.88 1yju s GLU 7 Cb -0.23 -4.10 -0.04 0.00 0.10 0.00 0.00 34.13 29.86 1yju s GLU 7 CO -0.03 -1.00 -0.04 -0.48 0.02 0.00 0.00 175.26 173.73 1yju s LEU 8 N 1.64 3.28 0.12 1.80 0.05 -0.66 -0.54 118.68 124.36 1yju s LEU 8 Ca 0.04 -0.20 -0.30 0.00 0.05 0.00 0.00 54.13 53.72 1yju s LEU 8 Cb -0.24 -1.99 -0.06 0.00 -2.05 0.00 0.00 46.19 41.85 1yju s LEU 8 CO 0.07 0.22 1.09 -0.69 -0.55 0.00 0.00 176.35 176.48 1yju s VAL 9 N -1.18 4.13 -0.04 1.48 1.01 0.88 -0.43 120.40 126.26 1yju s VAL 9 Ca 0.22 1.70 0.06 0.00 0.00 0.00 0.00 61.98 63.96 1yju s VAL 9 Cb -0.11 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 1yju s VAL 9 CO 0.13 0.23 -0.21 0.54 0.00 0.00 0.00 175.10 175.79 1yju s VAL 10 N 0.28 1.71 0.03 2.92 0.11 0.33 -0.43 120.40 125.35 1yju s VAL 10 Ca 0.52 -0.89 -0.00 0.00 -2.93 0.00 0.00 61.98 58.67 1yju s VAL 10 Cb -0.27 -1.44 -0.03 0.00 -1.53 0.00 0.00 36.38 33.11 1yju s VAL 10 CO 0.32 0.48 -0.03 -0.13 -3.33 0.00 0.00 175.10 172.41 1yju s ARG 11 N -0.23 0.41 0.00 1.54 0.52 0.09 -4.51 118.95 116.77 1yju s ARG 11 Ca 0.01 -0.81 0.00 0.00 -0.52 0.00 0.00 55.73 54.41 1yju s ARG 11 Cb -0.11 0.14 0.00 0.00 0.52 0.00 0.00 34.95 35.50 1yju s ARG 11 CO 0.01 -0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.67 1yju n GLY 12 N 1.11 3.04 3.53 -3.53 0.00 -1.26 -0.71 105.19 107.38 1yju n GLY 12 Ca -0.21 -0.84 -0.55 0.00 0.00 0.00 0.00 46.02 44.43 1yju n GLY 12 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1yju n MET 13 N 0.00 1.00 -3.42 1.61 0.00 -1.26 -4.96 117.12 110.08 1yju n MET 13 Ca 0.00 0.32 -0.40 0.00 0.00 0.00 0.00 57.70 57.62 1yju n MET 13 Cb 0.00 -2.20 -0.10 0.00 0.00 0.00 0.00 33.22 30.93 1yju n MET 13 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1yju s THR 14 N 5.54 5.19 0.20 3.17 -4.23 -1.26 -4.95 115.64 119.29 1yju s THR 14 Ca 1.06 0.07 0.00 0.00 -1.18 0.00 0.00 61.69 61.64 1yju s THR 14 Cb -1.03 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.03 1yju s THR 14 CO 0.58 -0.05 0.00 0.00 -0.54 0.00 0.00 174.62 174.62 1yju n ALA 16 N -2.06 1.04 0.29 0.00 0.00 -1.26 -0.88 120.51 117.63 1yju n ALA 16 Ca -0.00 0.81 -0.15 0.00 0.00 0.00 0.00 53.44 54.10 1yju n ALA 16 Cb 0.35 -0.90 -0.08 0.00 0.00 0.00 0.00 19.45 18.82 1yju n ALA 16 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1yju h SER 17 N 0.00 -0.63 -0.12 0.00 4.64 -2.00 0.88 113.55 116.33 1yju h SER 17 Ca 0.75 -0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.92 1yju h SER 17 Cb 2.21 0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 64.45 1yju h SER 17 CO -0.53 -0.30 -0.25 0.00 -0.87 0.00 0.00 176.83 174.88 1yju h VAL 19 N 0.50 0.00 0.00 0.00 2.07 -1.01 -0.17 116.25 117.64 1yju h VAL 19 Ca 0.07 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.53 1yju h VAL 19 Cb 0.69 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1yju h VAL 19 CO 0.05 0.00 -0.27 1.12 0.02 0.00 0.00 177.57 178.49 1yju h HIS 20 N -0.17 0.00 0.37 1.57 2.07 -0.67 -1.87 115.15 116.45 1yju h HIS 20 Ca 0.01 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.52 1yju h HIS 20 Cb 0.21 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.19 1yju h HIS 20 CO -0.52 0.27 -0.19 -0.22 -3.07 0.00 0.00 177.93 174.20 1yju h LYS 21 N 0.00 -0.49 0.41 5.12 1.63 -0.75 0.14 116.57 122.64 1yju h LYS 21 Ca -0.00 0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.82 1yju h LYS 21 Cb 0.65 0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.37 1yju h LYS 21 CO 0.03 -0.33 -0.48 0.82 -3.45 0.00 0.00 179.45 176.04 1yju h ILE 22 N -0.51 0.00 -0.01 2.00 2.04 -0.56 0.62 117.51 121.09 1yju h ILE 22 Ca -0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.84 1yju h ILE 22 Cb 0.40 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 1yju h ILE 22 CO 0.07 0.00 -0.19 -0.33 0.00 0.00 0.00 178.15 177.70 1yju h GLU 23 N -0.91 -0.30 -0.74 2.37 5.08 -1.30 0.83 114.58 119.61 1yju h GLU 23 Ca -0.05 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 1yju h GLU 23 Cb 0.81 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.07 1yju h GLU 23 CO -0.10 -0.20 0.45 1.03 -1.00 0.00 0.00 179.01 179.19 1yju h SER 24 N -0.31 0.71 -0.15 1.42 0.87 -0.67 0.65 113.55 116.07 1yju h SER 24 Ca 0.06 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1yju h SER 24 Cb 0.39 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1yju h SER 24 CO -0.19 0.47 0.07 -1.28 -0.53 0.00 0.00 176.83 175.38 1yju h SER 25 N 0.84 0.20 -0.18 6.23 0.87 -0.15 -3.21 113.55 118.15 1yju h SER 25 Ca 0.31 -0.11 -0.15 0.00 -1.23 0.00 0.00 61.79 60.60 1yju h SER 25 Cb 0.10 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1yju h SER 25 CO -0.15 0.26 -0.44 -0.07 -0.53 0.00 0.00 176.83 175.90 1yju h LEU 26 N 0.12 0.79 -5.62 2.23 4.07 -0.31 -3.29 115.31 113.30 1yju h LEU 26 Ca 0.05 -0.37 -0.42 0.00 0.08 0.00 0.00 57.88 57.22 1yju h LEU 26 Cb 0.11 -0.22 0.02 0.00 1.08 0.00 0.00 40.66 41.65 1yju h LEU 26 CO -0.01 1.11 2.55 0.41 -1.08 0.00 0.00 178.44 181.43 1yju n THR 27 N -4.02 2.32 0.00 0.22 -1.04 0.17 -3.66 114.28 108.26 1yju n THR 27 Ca -0.02 -1.47 0.00 0.00 -2.04 0.00 0.00 64.05 60.52 1yju n THR 27 Cb 0.55 -2.16 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 1yju n THR 27 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1yju n LYS 28 N 4.69 0.00 -1.79 -2.82 4.76 -1.24 -4.97 118.16 116.79 1yju n LYS 28 Ca 0.45 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.46 1yju n LYS 28 Cb 0.18 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.34 1yju n LYS 28 CO 0.00 0.00 0.00 -3.38 -1.37 0.00 0.00 177.40 172.65 1yju s HIS 29 N -1.00 1.48 0.00 2.13 -3.43 -1.24 -4.83 115.29 108.40 1yju s HIS 29 Ca 0.00 0.43 -0.04 0.00 -0.80 0.00 0.00 55.06 54.66 1yju s HIS 29 Cb 0.00 -4.03 -0.17 0.00 -1.43 0.00 0.00 32.58 26.95 1yju s HIS 29 CO 0.00 -3.82 2.87 0.54 -2.00 0.00 0.00 174.74 172.33 1yju n ARG 30 N 8.37 1.54 0.00 -0.38 1.74 -1.26 -3.03 116.66 123.63 1yju n ARG 30 Ca 0.25 -0.64 0.00 0.00 -0.77 0.00 0.00 57.85 56.69 1yju n ARG 30 Cb 0.45 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1yju n ARG 30 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yju n GLY 31 N 2.26 -0.17 3.57 -0.13 0.00 -1.26 -4.93 105.19 104.52 1yju n GLY 31 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 1yju n GLY 31 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1yju s ILE 32 N -0.12 5.05 -0.10 -0.61 -1.16 -1.17 -0.93 121.20 122.17 1yju s ILE 32 Ca 0.00 0.39 -0.16 0.00 -0.51 0.00 0.00 60.65 60.37 1yju s ILE 32 Cb 0.00 -3.92 -0.27 0.00 0.61 0.00 0.00 42.46 38.88 1yju s ILE 32 CO 0.00 -0.15 0.58 -0.07 -2.81 0.00 0.00 174.94 172.49 1yju h LEU 33 N 8.99 0.39 -7.66 8.50 3.38 -0.91 -3.48 115.31 124.52 1yju h LEU 33 Ca -0.28 -0.86 -0.15 0.00 0.09 0.00 0.00 57.88 56.67 1yju h LEU 33 Cb 1.13 -0.13 -0.22 0.00 0.09 0.00 0.00 40.66 41.53 1yju h LEU 33 CO 0.75 1.61 -0.47 -0.47 0.09 0.00 0.00 178.44 179.95 1yju s TYR 34 N -2.48 -0.05 -0.02 1.13 5.04 -0.33 -4.96 117.35 115.68 1yju s TYR 34 Ca -0.19 0.10 0.02 0.00 -2.44 0.00 0.00 57.07 54.55 1yju s TYR 34 Cb 0.04 0.00 0.01 0.00 0.35 0.00 0.00 41.96 42.36 1yju s TYR 34 CO 0.77 -0.24 -0.06 0.00 -1.34 0.00 0.00 175.55 174.69 1yju s SER 36 N 0.38 0.49 -0.93 0.00 0.15 0.48 -4.98 113.70 109.28 1yju s SER 36 Ca -0.05 -0.15 -0.17 0.00 0.70 0.00 0.00 55.95 56.29 1yju s SER 36 Cb -0.09 1.03 0.17 0.00 -1.71 0.00 0.00 66.02 65.42 1yju s SER 36 CO -0.00 -0.33 1.05 0.54 1.20 0.00 0.00 173.24 175.70 1yju s VAL 37 N 2.52 5.06 -1.27 4.45 0.11 -1.26 -0.80 120.40 129.21 1yju s VAL 37 Ca 0.11 -2.00 -0.19 0.00 -2.93 0.00 0.00 61.98 56.97 1yju s VAL 37 Cb -0.14 -4.70 0.04 0.00 -1.53 0.00 0.00 36.38 30.06 1yju s VAL 37 CO -0.24 -1.37 1.76 0.00 -3.33 0.00 0.00 175.10 171.92 1yju s ALA 38 N 1.71 3.04 0.38 1.54 0.00 0.15 -4.77 121.76 123.82 1yju s ALA 38 Ca 0.29 -2.77 0.21 0.00 0.00 0.00 0.00 51.96 49.70 1yju s ALA 38 Cb -0.06 -4.65 1.27 0.00 0.00 0.00 0.00 23.12 19.68 1yju s ALA 38 CO -0.08 -3.64 1.62 1.25 0.00 0.00 0.00 175.76 174.91 1yju h LEU 39 N 13.45 0.38 -1.50 0.00 6.46 -1.93 0.16 115.31 132.32 1yju h LEU 39 Ca 0.40 0.20 0.20 0.00 -0.12 0.00 0.00 57.88 58.56 1yju h LEU 39 Cb 0.89 0.18 -0.07 0.00 -0.73 0.00 0.00 40.66 40.93 1yju h LEU 39 CO 1.42 -0.26 0.59 0.00 -0.62 0.00 0.00 178.44 179.57 1yju h ALA 40 N 1.84 2.18 -0.37 1.25 0.00 -1.93 0.16 119.26 122.40 1yju h ALA 40 Ca 0.80 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.73 1yju h ALA 40 Cb 2.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.87 1yju h ALA 40 CO -0.61 -0.47 0.00 0.25 0.00 0.00 0.00 179.25 178.42 1yju n THR 41 N -4.51 0.85 -4.26 0.00 -2.24 0.40 -4.98 114.28 99.54 1yju n THR 41 Ca 0.19 -0.93 -0.34 0.00 -2.27 0.00 0.00 64.05 60.71 1yju n THR 41 Cb 0.68 0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 69.47 1yju n THR 41 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1yju n ASN 42 N 0.75 -0.98 -4.00 3.42 4.13 0.55 -4.91 115.26 114.22 1yju n ASN 42 Ca 0.13 -1.14 -0.19 0.00 1.68 0.00 0.00 54.58 55.06 1yju n ASN 42 Cb 0.45 -2.22 -0.15 0.00 -1.54 0.00 0.00 39.78 36.31 1yju n ASN 42 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1yju s LYS 43 N -7.05 0.77 -0.45 3.52 2.36 -0.50 -0.52 119.74 117.88 1yju s LYS 43 Ca 0.36 -0.28 -0.16 0.00 -2.55 0.00 0.00 55.97 53.33 1yju s LYS 43 Cb -0.20 -0.74 0.04 0.00 -1.05 0.00 0.00 37.83 35.88 1yju s LYS 43 CO 0.96 0.14 0.41 0.00 1.55 0.00 0.00 175.35 178.41 1yju s ALA 44 N 0.01 3.48 -0.77 3.13 0.00 0.43 0.35 121.76 128.39 1yju s ALA 44 Ca 0.00 -1.79 -0.24 0.00 0.00 0.00 0.00 51.96 49.93 1yju s ALA 44 Cb -0.06 -3.06 0.06 0.00 0.00 0.00 0.00 23.12 20.07 1yju s ALA 44 CO -0.00 -1.66 1.17 -1.58 0.00 0.00 0.00 175.76 173.70 1yju s HIS 45 N 1.92 2.55 0.25 0.00 2.46 0.02 -1.65 115.29 120.85 1yju s HIS 45 Ca 0.08 -0.50 -0.04 0.00 0.47 0.00 0.00 55.06 55.07 1yju s HIS 45 Cb -0.20 -4.48 -0.05 0.00 -0.13 0.00 0.00 32.58 27.72 1yju s HIS 45 CO 0.10 -1.84 0.49 0.42 -2.47 0.00 0.00 174.74 171.45 1yju s ILE 46 N 4.67 5.09 0.04 0.89 1.09 0.26 -0.39 121.20 132.85 1yju s ILE 46 Ca 0.32 -0.07 0.05 0.00 -1.10 0.00 0.00 60.65 59.85 1yju s ILE 46 Cb -0.10 -3.73 -0.02 0.00 -1.06 0.00 0.00 42.46 37.55 1yju s ILE 46 CO 0.07 -0.26 -0.16 -0.54 -0.10 0.00 0.00 174.94 173.95 1yju s LYS 47 N -3.43 1.07 0.31 2.79 1.02 0.73 -0.32 119.74 121.91 1yju s LYS 47 Ca 0.42 -0.78 -0.20 0.00 0.02 0.00 0.00 55.97 55.43 1yju s LYS 47 Cb -0.11 -1.10 0.03 0.00 -0.52 0.00 0.00 37.83 36.13 1yju s LYS 47 CO 0.29 0.28 0.75 1.52 -0.92 0.00 0.00 175.35 177.27 1yju s TYR 48 N -0.79 -0.10 -0.48 3.18 1.13 0.59 -0.19 117.35 120.69 1yju s TYR 48 Ca 0.03 -0.41 -0.10 0.00 -1.41 0.00 0.00 57.07 55.18 1yju s TYR 48 Cb -0.08 0.74 0.12 0.00 -1.10 0.00 0.00 41.96 41.65 1yju s TYR 48 CO 0.01 -1.32 0.36 -0.51 -2.51 0.00 0.00 175.55 171.58 1yju s ASP 49 N -2.96 5.77 -0.96 -0.18 1.01 -0.10 -1.74 116.67 117.50 1yju s ASP 49 Ca 0.12 -1.89 -0.17 0.00 0.71 0.00 0.00 52.55 51.33 1yju s ASP 49 Cb -0.06 -2.04 -0.10 0.00 1.01 0.00 0.00 42.92 41.74 1yju s ASP 49 CO 0.08 -0.71 2.06 -0.81 0.21 0.00 0.00 175.17 176.00 1yju n PRO 50 N 4.95 1.95 0.00 8.23 -0.04 -1.26 -2.96 135.00 145.88 1yju n PRO 50 Ca -0.09 -1.91 0.00 0.00 -0.04 0.00 0.00 63.50 61.46 1yju n PRO 50 Cb 0.41 -2.88 0.00 0.00 -0.04 0.00 0.00 33.50 30.98 1yju n PRO 50 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1yju n GLU 51 N 6.13 0.00 0.13 0.54 0.28 -1.26 -4.92 120.64 121.54 1yju n GLU 51 Ca 0.50 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.62 1yju n GLU 51 Cb 0.34 0.00 0.20 0.00 1.43 0.00 0.00 31.44 33.41 1yju n GLU 51 CO 0.00 0.00 0.00 -0.84 -0.16 0.00 0.00 177.13 176.13 1yju h ILE 52 N 0.00 0.00 -3.40 3.84 3.07 -1.91 -3.45 117.51 115.65 1yju h ILE 52 Ca 0.00 -0.73 -0.10 0.00 1.55 0.00 0.00 64.86 65.58 1yju h ILE 52 Cb 0.00 1.52 -0.17 0.00 -0.27 0.00 0.00 36.82 37.90 1yju h ILE 52 CO 0.00 0.00 -0.31 -0.51 -1.05 0.00 0.00 178.15 176.28 1yju s ILE 53 N -3.20 0.09 0.46 0.16 2.07 -1.18 -4.74 121.20 114.87 1yju s ILE 53 Ca 0.06 -0.76 0.03 0.00 -1.41 0.00 0.00 60.65 58.57 1yju s ILE 53 Cb 0.10 -0.92 0.01 0.00 0.13 0.00 0.00 42.46 41.79 1yju s ILE 53 CO 0.69 -0.42 0.65 -0.83 -1.91 0.00 0.00 174.94 173.12 1yju s GLY 54 N -2.05 1.75 0.26 1.50 0.00 -1.26 -4.09 107.32 103.42 1yju s GLY 54 Ca -0.05 -1.35 -0.04 0.00 0.00 0.00 0.00 44.72 43.27 1yju s GLY 54 CO -0.03 -1.15 1.92 -0.56 0.00 0.00 0.00 173.10 173.27 1yju h PRO 55 N 0.41 1.25 -0.71 2.90 0.13 -1.97 -3.02 132.00 130.98 1yju h PRO 55 Ca -0.43 -0.08 0.13 0.00 -0.87 0.00 0.00 66.00 64.75 1yju h PRO 55 Cb 1.28 -0.28 -0.13 0.00 0.13 0.00 0.00 31.00 31.99 1yju h PRO 55 CO 0.52 0.83 -0.28 0.00 -0.23 0.00 0.00 178.00 178.84 1yju h ARG 56 N 1.28 -0.07 0.01 0.86 -0.00 -1.98 -0.05 114.38 114.43 1yju h ARG 56 Ca 0.39 0.00 0.02 0.00 -0.50 0.00 0.00 59.98 59.89 1yju h ARG 56 Cb -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 29.97 29.91 1yju h ARG 56 CO -0.11 -0.05 -0.16 -0.44 0.00 0.00 0.00 179.97 179.22 1yju h ASP 57 N -0.08 -0.45 0.53 7.04 5.19 -1.92 0.21 116.42 126.95 1yju h ASP 57 Ca 0.30 0.06 -0.02 0.00 -0.62 0.00 0.00 57.03 56.76 1yju h ASP 57 Cb 0.56 0.19 -0.00 0.00 0.18 0.00 0.00 39.33 40.25 1yju h ASP 57 CO -0.76 -0.22 -0.31 0.40 -3.12 0.00 0.00 179.24 175.23 1yju h ILE 58 N -0.26 0.36 -0.20 0.35 5.03 -1.52 0.10 117.51 121.37 1yju h ILE 58 Ca 0.05 0.00 0.05 0.00 -0.12 0.00 0.00 64.86 64.84 1yju h ILE 58 Cb 0.32 0.36 -0.07 0.00 -3.03 0.00 0.00 36.82 34.40 1yju h ILE 58 CO -0.14 0.00 -0.38 0.40 -0.68 0.00 0.00 178.15 177.35 1yju h ILE 59 N -0.79 0.20 -0.39 -0.67 2.04 -0.78 0.46 117.51 117.58 1yju h ILE 59 Ca -0.06 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.87 1yju h ILE 59 Cb 0.64 0.20 -0.07 0.00 -0.74 0.00 0.00 36.82 36.84 1yju h ILE 59 CO 0.08 0.00 -0.06 -0.74 0.00 0.00 0.00 178.15 177.43 1yju h HIS 60 N -0.41 -0.13 -0.46 1.37 2.76 -0.49 -0.34 115.15 117.45 1yju h HIS 60 Ca 0.10 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.33 1yju h HIS 60 Cb 0.59 0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 1yju h HIS 60 CO -0.49 -0.13 0.27 1.15 -1.30 0.00 0.00 177.93 177.43 1yju h THR 61 N 0.04 1.04 0.30 6.26 2.02 0.21 0.16 112.91 122.95 1yju h THR 61 Ca 0.19 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1yju h THR 61 Cb 0.29 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 1yju h THR 61 CO -0.37 0.10 -0.23 0.40 0.37 0.00 0.00 175.52 175.79 1yju h ILE 62 N 0.54 0.00 -0.51 3.11 2.04 -0.02 -2.40 117.51 120.27 1yju h ILE 62 Ca 0.19 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.13 1yju h ILE 62 Cb 0.03 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.04 1yju h ILE 62 CO -0.09 0.00 0.15 1.05 0.00 0.00 0.00 178.15 179.26 1yju h GLU 63 N -0.51 0.30 0.00 2.37 4.11 -0.96 -1.66 114.58 118.23 1yju h GLU 63 Ca -0.04 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.37 1yju h GLU 63 Cb 0.42 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1yju h GLU 63 CO 0.01 0.20 -0.00 1.03 0.07 0.00 0.00 179.01 180.32 1yju h SER 64 N 0.31 0.00 0.00 3.06 0.87 -0.65 0.24 113.55 117.38 1yju h SER 64 Ca 0.25 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1yju h SER 64 Cb 0.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1yju h SER 64 CO -0.29 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.19 1yju n LEU 65 N -3.12 0.29 -0.97 2.23 4.77 -0.62 -4.88 117.00 114.70 1yju n LEU 65 Ca -0.03 0.69 -0.06 0.00 -0.03 0.00 0.00 56.01 56.58 1yju n LEU 65 Cb 0.08 -0.33 -0.06 0.00 -2.33 0.00 0.00 43.42 40.78 1yju n LEU 65 CO 0.21 -0.33 0.34 0.61 -1.33 0.00 0.00 177.39 176.89 1yju n GLY 66 N 0.02 0.55 3.59 -0.72 0.00 -1.05 -5.15 105.19 102.42 1yju n GLY 66 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1yju n GLY 66 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yju s PHE 67 N 0.00 2.16 0.01 1.61 0.08 0.05 -4.70 117.98 117.19 1yju s PHE 67 Ca 0.01 -0.87 -0.00 0.00 0.12 0.00 0.00 56.93 56.19 1yju s PHE 67 Cb 0.01 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.87 1yju s PHE 67 CO -0.00 0.21 0.10 -2.00 -0.10 0.00 0.00 175.22 173.42 1yju s GLU 68 N -3.79 3.09 -0.13 0.44 2.56 0.11 -4.36 118.70 116.62 1yju s GLU 68 Ca 0.29 -0.50 -0.11 0.00 0.00 0.00 0.00 54.97 54.65 1yju s GLU 68 Cb 0.07 -2.87 0.04 0.00 2.00 0.00 0.00 34.13 33.37 1yju s GLU 68 CO 0.14 0.64 0.35 0.00 -0.56 0.00 0.00 175.26 175.82 1yju s ALA 69 N -1.25 -0.86 -0.28 6.30 0.00 -1.26 -0.73 121.76 123.68 1yju s ALA 69 Ca 0.25 1.05 -0.03 0.00 0.00 0.00 0.00 51.96 53.23 1yju s ALA 69 Cb -0.12 -0.62 0.16 0.00 0.00 0.00 0.00 23.12 22.54 1yju s ALA 69 CO 0.16 -0.18 0.53 -1.12 0.00 0.00 0.00 175.76 175.16 1yju s SER 70 N 0.42 -0.84 -0.07 0.00 0.01 0.43 -4.98 113.70 108.67 1yju s SER 70 Ca -0.02 0.78 -0.39 0.00 1.31 0.00 0.00 55.95 57.63 1yju s SER 70 Cb -0.04 1.84 -0.19 0.00 0.21 0.00 0.00 66.02 67.84 1yju s SER 70 CO -0.02 -0.26 1.11 0.18 0.41 0.00 0.00 173.24 174.65 1yju n LEU 71 N 5.41 0.17 -4.17 2.44 4.77 -1.26 -0.09 117.00 124.28 1yju n LEU 71 Ca -0.03 1.12 -0.23 0.00 -0.03 0.00 0.00 56.01 56.84 1yju n LEU 71 Cb 0.50 -0.88 -0.14 0.00 -2.33 0.00 0.00 43.42 40.57 1yju n LEU 71 CO 0.03 -1.68 -0.49 0.68 -1.33 0.00 0.00 177.39 174.60 1yju s VAL 72 N 0.44 1.31 -1.09 4.08 -7.23 0.29 -4.80 120.40 113.40 1yju s VAL 72 Ca 0.90 -0.89 -0.22 0.00 -1.81 0.00 0.00 61.98 59.95 1yju s VAL 72 Cb -1.25 -1.13 -0.00 0.00 0.56 0.00 0.00 36.38 34.56 1yju s VAL 72 CO 0.58 0.22 1.76 -0.54 -0.31 0.00 0.00 175.10 176.82 1yju s LYS 73 N -0.78 3.15 0.62 4.82 -0.14 -1.26 -4.64 119.74 121.50 1yju s LYS 73 Ca 0.05 -1.11 -0.18 0.00 -1.36 0.00 0.00 55.97 53.38 1yju s LYS 73 Cb -0.07 -5.29 -0.02 0.00 -1.68 0.00 0.00 37.83 30.76 1yju s LYS 73 CO 0.00 -2.95 1.18 -1.50 -0.76 0.00 0.00 175.35 171.32 1yju s ILE 74 N 7.59 2.77 0.00 2.17 2.07 -1.26 -5.21 121.20 129.33 1yju s ILE 74 Ca 0.59 0.44 0.00 0.00 -1.41 0.00 0.00 60.65 60.28 1yju s ILE 74 Cb -0.01 -3.10 0.00 0.00 0.13 0.00 0.00 42.46 39.47 1yju s ILE 74 CO 0.02 -0.14 0.35 -0.62 -1.91 0.00 0.00 174.94 172.64