#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 2.09 3.46 3.03 0.00 -1.26 -4.30 105.19 108.21 1yju n GLY 2 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 -4.00 -0.57 -1.08 1.61 1.47 -1.26 -5.08 116.67 107.76 1yju s ASP 3 Ca 0.00 0.99 -0.23 0.00 1.18 0.00 0.00 52.55 54.50 1yju s ASP 3 Cb 0.00 1.00 -0.05 0.00 -0.34 0.00 0.00 42.92 43.53 1yju s ASP 3 CO 0.00 -0.28 1.89 -0.83 0.68 0.00 0.00 175.17 176.63 1yju s GLY 4 N -0.06 0.39 0.03 2.12 0.00 -1.24 -4.93 107.32 103.63 1yju s GLY 4 Ca -0.03 -2.00 -0.30 0.00 0.00 0.00 0.00 44.72 42.38 1yju s GLY 4 CO 0.02 3.39 1.16 0.54 0.00 0.00 0.00 173.10 178.22 1yju s VAL 5 N 9.62 4.21 -0.28 1.40 0.11 -1.26 -0.66 120.40 133.53 1yju s VAL 5 Ca 0.66 1.58 -0.04 0.00 -2.93 0.00 0.00 61.98 61.25 1yju s VAL 5 Cb -0.02 -4.01 0.10 0.00 -1.53 0.00 0.00 36.38 30.91 1yju s VAL 5 CO 0.06 0.11 0.14 -0.22 -3.33 0.00 0.00 175.10 171.85 1yju s LEU 6 N 1.21 0.46 -0.50 2.54 1.98 0.26 -4.95 118.68 119.68 1yju s LEU 6 Ca 0.57 -1.18 -0.20 0.00 -2.89 0.00 0.00 54.13 50.43 1yju s LEU 6 Cb -0.27 -0.28 0.05 0.00 0.66 0.00 0.00 46.19 46.35 1yju s LEU 6 CO 0.28 -0.43 0.65 -0.70 -1.89 0.00 0.00 176.35 174.26 1yju s GLU 7 N 2.12 3.15 -0.06 1.98 2.56 -1.26 -0.62 118.70 126.57 1yju s GLU 7 Ca 0.08 -0.78 0.03 0.00 0.00 0.00 0.00 54.97 54.30 1yju s GLU 7 Cb -0.16 -4.07 -0.03 0.00 2.00 0.00 0.00 34.13 31.87 1yju s GLU 7 CO -0.34 -1.21 -0.12 -0.48 -0.56 0.00 0.00 175.26 172.56 1yju s LEU 8 N 2.74 2.88 0.32 2.70 0.05 -0.50 -0.71 118.68 126.15 1yju s LEU 8 Ca 0.17 -0.15 -0.27 0.00 0.05 0.00 0.00 54.13 53.94 1yju s LEU 8 Cb -0.18 -1.60 -0.10 0.00 -2.05 0.00 0.00 46.19 42.26 1yju s LEU 8 CO 0.13 0.34 0.96 0.54 -0.55 0.00 0.00 176.35 177.78 1yju s VAL 9 N -0.70 4.10 0.19 1.48 0.11 0.78 -0.44 120.40 125.92 1yju s VAL 9 Ca 0.11 1.79 0.07 0.00 -2.93 0.00 0.00 61.98 61.01 1yju s VAL 9 Cb -0.11 -4.01 -0.04 0.00 -1.53 0.00 0.00 36.38 30.69 1yju s VAL 9 CO 0.01 0.18 0.04 -0.69 -3.33 0.00 0.00 175.10 171.32 1yju s VAL 10 N -1.54 3.89 -0.05 2.04 1.01 -0.18 -0.86 120.40 124.72 1yju s VAL 10 Ca 0.50 -1.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1yju s VAL 10 Cb -0.21 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.21 1yju s VAL 10 CO 0.26 -0.17 0.03 -0.13 0.00 0.00 0.00 175.10 175.09 1yju s ARG 11 N -3.17 0.18 0.00 2.72 1.81 0.72 -4.77 118.95 116.44 1yju s ARG 11 Ca 0.29 0.24 0.00 0.00 -1.72 0.00 0.00 55.73 54.54 1yju s ARG 11 Cb -0.09 -0.62 0.00 0.00 -0.45 0.00 0.00 34.95 33.79 1yju s ARG 11 CO 0.20 -0.28 0.00 0.41 -0.68 0.00 0.00 175.30 174.95 1yju n GLY 12 N 5.00 3.63 3.70 -3.53 0.00 -1.26 -0.21 105.19 112.52 1yju n GLY 12 Ca -0.10 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 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 2.12 -0.48 1.61 0.00 -1.26 -4.90 117.12 114.20 1yju n MET 13 Ca 0.00 0.74 -0.01 0.00 0.00 0.00 0.00 57.70 58.43 1yju n MET 13 Cb 0.00 -2.35 -0.01 0.00 0.00 0.00 0.00 33.22 30.86 1yju n MET 13 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 1yju n THR 14 N 0.26 0.00 -3.60 3.17 5.66 -1.26 -5.03 114.28 113.48 1yju n THR 14 Ca 0.05 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.95 1yju n THR 14 Cb 0.37 0.10 -0.06 0.00 -1.55 0.00 0.00 70.33 69.19 1yju n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yju n ALA 16 N 1.12 0.82 -0.94 0.00 0.00 -1.26 -0.70 120.51 119.55 1yju n ALA 16 Ca -0.10 0.89 0.00 0.00 0.00 0.00 0.00 53.44 54.23 1yju n ALA 16 Cb 0.57 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1yju n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yju n SER 17 N -5.00 0.00 -0.33 0.00 3.41 -1.26 -0.75 113.62 109.69 1yju n SER 17 Ca 0.31 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.56 1yju n SER 17 Cb 1.05 -0.03 0.24 0.00 -0.26 0.00 0.00 64.21 65.21 1yju n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yju h VAL 19 N 0.02 0.00 0.00 0.00 2.07 -0.93 -1.43 116.25 115.99 1yju h VAL 19 Ca 0.55 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.07 1yju h VAL 19 Cb 1.05 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1yju h VAL 19 CO -0.90 0.00 0.00 1.12 0.02 0.00 0.00 177.57 177.81 1yju h HIS 20 N -0.15 0.00 -0.21 1.57 2.07 0.85 -2.99 115.15 116.29 1yju h HIS 20 Ca 0.02 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.47 1yju h HIS 20 Cb 0.21 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.18 1yju h HIS 20 CO -0.60 0.00 -0.16 -0.22 -3.07 0.00 0.00 177.93 173.89 1yju h LYS 21 N 0.00 0.49 0.02 5.12 3.64 0.25 0.48 116.57 126.57 1yju h LYS 21 Ca 0.00 -0.23 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1yju h LYS 21 Cb 0.43 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1yju h LYS 21 CO 0.00 0.80 -0.03 0.82 -2.27 0.00 0.00 179.45 178.76 1yju h ILE 22 N 0.18 0.00 -0.27 2.00 2.04 -1.14 0.66 117.51 120.97 1yju h ILE 22 Ca 0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.95 1yju h ILE 22 Cb 0.68 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.68 1yju h ILE 22 CO 0.04 0.00 -0.52 1.05 0.00 0.00 0.00 178.15 178.73 1yju h GLU 23 N -0.06 -0.45 -0.88 2.37 -0.00 -1.60 0.11 114.58 114.08 1yju h GLU 23 Ca -0.00 0.03 0.10 0.00 -0.00 0.00 0.00 59.36 59.49 1yju h GLU 23 Cb 0.05 0.10 -0.08 0.00 -0.00 0.00 0.00 28.75 28.83 1yju h GLU 23 CO -0.01 -0.30 0.51 1.03 -0.00 0.00 0.00 179.01 180.24 1yju h SER 24 N -0.47 0.74 0.85 3.06 0.87 -0.92 0.40 113.55 118.08 1yju h SER 24 Ca 0.07 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 1yju h SER 24 Cb 0.63 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 62.51 1yju h SER 24 CO -0.51 0.41 -0.41 -1.28 -0.53 0.00 0.00 176.83 174.51 1yju h SER 25 N 0.84 -0.96 -0.43 6.23 0.87 -0.09 -3.29 113.55 116.71 1yju h SER 25 Ca 0.43 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.99 1yju h SER 25 Cb 0.41 0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1yju h SER 25 CO -0.26 -0.66 0.18 -0.07 -0.53 0.00 0.00 176.83 175.50 1yju h LEU 26 N -1.20 0.63 -1.07 2.23 3.38 -0.04 -0.56 115.31 118.69 1yju h LEU 26 Ca -0.12 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1yju h LEU 26 Cb 0.87 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1yju h LEU 26 CO 0.19 0.58 0.07 0.41 0.09 0.00 0.00 178.44 179.79 1yju n THR 27 N -4.35 1.08 -0.30 0.22 -1.04 0.06 -0.10 114.28 109.85 1yju n THR 27 Ca 0.04 0.70 -0.05 0.00 -2.04 0.00 0.00 64.05 62.70 1yju n THR 27 Cb 0.16 -1.70 0.07 0.00 -1.82 0.00 0.00 70.33 67.04 1yju n THR 27 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1yju h LYS 28 N 0.00 1.17 -6.33 -2.82 1.79 -1.17 -3.42 116.57 105.79 1yju h LYS 28 Ca 0.00 -0.15 -0.54 0.00 -2.18 0.00 0.00 60.65 57.77 1yju h LYS 28 Cb 0.15 -0.22 -0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1yju h LYS 28 CO 0.00 0.88 1.00 -1.01 -1.08 0.00 0.00 179.45 179.24 1yju s HIS 29 N -5.77 2.34 -0.03 -1.35 3.76 0.86 -4.89 115.29 110.21 1yju s HIS 29 Ca -0.13 0.42 -0.05 0.00 -0.15 0.00 0.00 55.06 55.15 1yju s HIS 29 Cb 0.16 -3.84 -0.20 0.00 1.11 0.00 0.00 32.58 29.80 1yju s HIS 29 CO 0.82 -3.40 3.31 0.54 -0.85 0.00 0.00 174.74 175.16 1yju n ARG 30 N 6.32 1.86 0.00 1.40 1.74 -1.26 -3.06 116.66 123.65 1yju n ARG 30 Ca 0.16 -0.92 0.00 0.00 -0.77 0.00 0.00 57.85 56.32 1yju n ARG 30 Cb 0.43 -1.84 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 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 2.23 0.02 3.77 -0.13 0.00 -1.26 -5.04 105.19 104.76 1yju n GLY 31 Ca 0.36 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.00 3.97 -0.19 -0.61 2.07 -1.17 -3.85 121.20 120.41 1yju s ILE 32 Ca 0.00 1.80 0.10 0.00 -1.41 0.00 0.00 60.65 61.13 1yju s ILE 32 Cb 0.00 -4.07 -0.18 0.00 0.13 0.00 0.00 42.46 38.33 1yju s ILE 32 CO 0.00 0.29 -0.05 0.18 -1.91 0.00 0.00 174.94 173.46 1yju n LEU 33 N 0.93 1.24 -3.62 8.50 4.77 0.86 -4.97 117.00 124.70 1yju n LEU 33 Ca 0.00 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.80 1yju n LEU 33 Cb 0.48 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.44 1yju n LEU 33 CO 0.48 0.61 0.21 -0.47 -1.33 0.00 0.00 177.39 176.89 1yju s TYR 34 N -2.43 -0.33 -0.50 -1.77 5.04 -0.11 -4.91 117.35 112.35 1yju s TYR 34 Ca -0.17 0.30 0.06 0.00 -2.44 0.00 0.00 57.07 54.82 1yju s TYR 34 Cb 0.06 0.28 0.19 0.00 0.35 0.00 0.00 41.96 42.84 1yju s TYR 34 CO 0.63 -0.62 0.65 0.00 -1.34 0.00 0.00 175.55 174.87 1yju s SER 36 N 0.71 6.29 -1.25 0.00 0.01 0.25 -4.69 113.70 115.02 1yju s SER 36 Ca 0.31 -1.14 -0.16 0.00 1.31 0.00 0.00 55.95 56.27 1yju s SER 36 Cb 0.01 -2.45 0.12 0.00 0.21 0.00 0.00 66.02 63.91 1yju s SER 36 CO -0.08 -1.45 1.58 -0.69 0.41 0.00 0.00 173.24 173.01 1yju s VAL 37 N 4.18 4.60 -0.84 3.43 1.01 -1.26 -0.79 120.40 130.73 1yju s VAL 37 Ca 0.29 -2.28 -0.21 0.00 0.00 0.00 0.00 61.98 59.77 1yju s VAL 37 Cb -0.12 -5.05 0.09 0.00 0.00 0.00 0.00 36.38 31.31 1yju s VAL 37 CO 0.05 -1.81 1.13 0.00 0.00 0.00 0.00 175.10 174.46 1yju s ALA 38 N 2.85 3.15 0.43 5.51 0.00 0.89 -4.86 121.76 129.73 1yju s ALA 38 Ca 0.48 -2.31 0.24 0.00 0.00 0.00 0.00 51.96 50.37 1yju s ALA 38 Cb 0.00 -4.06 1.25 0.00 0.00 0.00 0.00 23.12 20.31 1yju s ALA 38 CO 0.04 -3.02 1.73 1.25 0.00 0.00 0.00 175.76 175.76 1yju h LEU 39 N 11.21 0.33 -1.96 0.00 6.46 -1.93 0.64 115.31 130.06 1yju h LEU 39 Ca -0.01 0.09 0.19 0.00 -0.12 0.00 0.00 57.88 58.02 1yju h LEU 39 Cb 1.04 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.98 1yju h LEU 39 CO 1.19 -0.00 0.47 0.00 -0.62 0.00 0.00 178.44 179.48 1yju h ALA 40 N 1.58 2.57 0.00 1.25 0.00 -1.94 0.47 119.26 123.20 1yju h ALA 40 Ca 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.55 1yju h ALA 40 Cb 1.92 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1yju h ALA 40 CO -0.30 -0.76 -0.01 -2.37 0.00 0.00 0.00 179.25 175.81 1yju n THR 41 N -4.36 1.23 -2.97 0.00 5.66 0.05 -5.01 114.28 108.89 1yju n THR 41 Ca 0.13 -1.35 -0.18 0.00 -3.05 0.00 0.00 64.05 59.60 1yju n THR 41 Cb 0.71 0.28 -0.00 0.00 -1.55 0.00 0.00 70.33 69.77 1yju n THR 41 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1yju n ASN 42 N -0.77 -3.69 -4.01 1.09 4.05 0.16 -4.91 115.26 107.17 1yju n ASN 42 Ca 0.05 -0.12 -0.13 0.00 0.45 0.00 0.00 54.58 54.83 1yju n ASN 42 Cb 0.39 -3.10 -0.12 0.00 1.23 0.00 0.00 39.78 38.18 1yju n ASN 42 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1yju s LYS 43 N -5.59 0.43 -0.41 1.20 2.36 -1.01 -1.01 119.74 115.71 1yju s LYS 43 Ca 0.23 -0.57 -0.13 0.00 -2.55 0.00 0.00 55.97 52.94 1yju s LYS 43 Cb -0.12 -0.22 0.04 0.00 -1.05 0.00 0.00 37.83 36.48 1yju s LYS 43 CO 0.28 0.04 0.29 0.00 1.55 0.00 0.00 175.35 177.51 1yju s ALA 44 N -1.07 3.42 -1.08 3.13 0.00 0.41 -0.08 121.76 126.49 1yju s ALA 44 Ca -0.08 -1.83 -0.22 0.00 0.00 0.00 0.00 51.96 49.83 1yju s ALA 44 Cb -0.08 -2.82 0.04 0.00 0.00 0.00 0.00 23.12 20.27 1yju s ALA 44 CO -0.00 -1.51 1.57 -1.58 0.00 0.00 0.00 175.76 174.24 1yju s HIS 45 N 1.61 2.52 0.44 0.00 2.46 0.03 -1.41 115.29 120.95 1yju s HIS 45 Ca 0.04 -0.88 -0.21 0.00 0.47 0.00 0.00 55.06 54.48 1yju s HIS 45 Cb -0.20 -4.65 -0.11 0.00 -0.13 0.00 0.00 32.58 27.49 1yju s HIS 45 CO 0.08 -1.88 0.96 0.42 -2.47 0.00 0.00 174.74 171.85 1yju s ILE 46 N 5.35 4.36 -0.12 0.89 1.01 0.20 -0.58 121.20 132.31 1yju s ILE 46 Ca 0.50 1.45 0.01 0.00 0.00 0.00 0.00 60.65 62.61 1yju s ILE 46 Cb 0.00 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.90 1yju s ILE 46 CO -0.04 -0.34 -0.12 -0.54 0.00 0.00 0.00 174.94 173.89 1yju s LYS 47 N -3.24 1.98 -0.10 2.79 1.02 0.15 -0.57 119.74 121.78 1yju s LYS 47 Ca 0.62 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 56.11 1yju s LYS 47 Cb -0.10 -1.82 0.05 0.00 -0.52 0.00 0.00 37.83 35.44 1yju s LYS 47 CO 0.15 -0.17 0.22 1.52 -0.92 0.00 0.00 175.35 176.14 1yju s TYR 48 N 1.33 -0.28 -0.21 3.18 1.13 0.17 -0.10 117.35 122.56 1yju s TYR 48 Ca -0.00 0.71 -0.25 0.00 -1.41 0.00 0.00 57.07 56.11 1yju s TYR 48 Cb -0.14 -0.01 -0.01 0.00 -1.10 0.00 0.00 41.96 40.71 1yju s TYR 48 CO -0.06 -0.23 0.85 -0.51 -2.51 0.00 0.00 175.55 173.09 1yju s ASP 49 N 1.37 6.91 0.14 -0.18 1.11 -1.25 -3.69 116.67 121.08 1yju s ASP 49 Ca -0.08 1.12 -0.17 0.00 0.18 0.00 0.00 52.55 53.60 1yju s ASP 49 Cb -0.11 -2.45 -0.01 0.00 1.07 0.00 0.00 42.92 41.42 1yju s ASP 49 CO -0.08 -0.48 1.80 1.55 1.18 0.00 0.00 175.17 179.15 1yju h PRO 50 N 7.51 0.45 0.00 8.23 0.13 -1.92 -3.24 132.00 143.15 1yju h PRO 50 Ca -0.25 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1yju h PRO 50 Cb 1.11 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1yju h PRO 50 CO 0.87 0.30 0.07 -0.85 -0.23 0.00 0.00 178.00 178.15 1yju n GLU 51 N -4.85 0.00 -0.00 0.86 0.00 -1.26 -0.69 120.64 114.70 1yju n GLU 51 Ca -0.01 0.38 0.02 0.00 0.00 0.00 0.00 57.16 57.55 1yju n GLU 51 Cb 0.03 -1.57 -0.03 0.00 0.00 0.00 0.00 31.44 29.87 1yju n GLU 51 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1yju n ILE 52 N -1.37 0.00 0.00 3.84 -5.35 -1.22 -4.92 119.36 110.34 1yju n ILE 52 Ca 0.00 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1yju n ILE 52 Cb 0.07 0.99 0.00 0.00 -1.74 0.00 0.00 39.64 38.96 1yju n ILE 52 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yju n ILE 53 N -1.13 0.00 -0.24 7.28 3.06 -0.18 -4.91 119.36 123.24 1yju n ILE 53 Ca 0.01 0.00 0.01 0.00 -2.50 0.00 0.00 62.75 60.27 1yju n ILE 53 Cb 0.08 -0.07 -0.01 0.00 0.54 0.00 0.00 39.64 40.18 1yju n ILE 53 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1yju n GLY 54 N 0.17 -2.91 0.23 4.50 0.00 0.13 -4.48 105.19 102.84 1yju n GLY 54 Ca 0.00 -1.28 -0.06 0.00 0.00 0.00 0.00 46.02 44.68 1yju n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yju h PRO 55 N -0.06 0.55 -0.92 1.61 0.13 -1.96 -3.24 132.00 128.10 1yju h PRO 55 Ca -0.01 -0.25 0.17 0.00 -0.87 0.00 0.00 66.00 65.04 1yju h PRO 55 Cb 0.18 -0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.22 1yju h PRO 55 CO 0.00 0.81 0.59 -0.09 -0.23 0.00 0.00 178.00 179.09 1yju h ARG 56 N 0.46 0.63 0.56 0.86 2.43 -1.99 0.03 114.38 117.37 1yju h ARG 56 Ca 0.05 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1yju h ARG 56 Cb 0.81 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 1yju h ARG 56 CO 0.07 0.42 -0.41 0.22 -1.51 0.00 0.00 179.97 178.75 1yju h ASP 57 N 0.65 -1.08 -0.45 -3.80 1.82 -1.78 0.14 116.42 111.92 1yju h ASP 57 Ca 0.48 0.07 0.09 0.00 -0.39 0.00 0.00 57.03 57.28 1yju h ASP 57 Cb 0.85 0.34 -0.08 0.00 0.68 0.00 0.00 39.33 41.11 1yju h ASP 57 CO -0.23 -0.61 -0.09 0.40 -1.61 0.00 0.00 179.24 177.10 1yju h ILE 58 N -0.95 0.57 -0.09 2.25 5.03 -1.34 -1.22 117.51 121.77 1yju h ILE 58 Ca -0.06 -0.01 0.04 0.00 -0.12 0.00 0.00 64.86 64.71 1yju h ILE 58 Cb 0.79 0.54 -0.06 0.00 -3.03 0.00 0.00 36.82 35.07 1yju h ILE 58 CO 0.02 0.00 -0.27 0.40 -0.68 0.00 0.00 178.15 177.62 1yju h ILE 59 N 0.02 0.37 -0.46 -0.67 1.08 -0.76 -0.68 117.51 116.41 1yju h ILE 59 Ca 0.22 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.78 1yju h ILE 59 Cb 0.33 0.37 -0.10 0.00 -3.07 0.00 0.00 36.82 34.36 1yju h ILE 59 CO -0.45 0.00 -0.22 0.45 -0.69 0.00 0.00 178.15 177.24 1yju h HIS 60 N -0.37 -0.57 -0.07 1.37 3.86 0.18 -1.23 115.15 118.33 1yju h HIS 60 Ca 0.09 0.05 0.03 0.00 -1.16 0.00 0.00 60.37 59.38 1yju h HIS 60 Cb 0.49 0.32 -0.03 0.00 1.06 0.00 0.00 27.41 29.25 1yju h HIS 60 CO -0.34 -0.31 -0.12 1.15 0.86 0.00 0.00 177.93 179.17 1yju h THR 61 N -0.13 0.68 -0.39 2.45 2.02 -0.66 0.21 112.91 117.09 1yju h THR 61 Ca 0.22 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.45 1yju h THR 61 Cb 0.47 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 1yju h THR 61 CO -0.54 0.00 0.10 0.40 0.37 0.00 0.00 175.52 175.85 1yju h ILE 62 N -0.17 0.83 -0.28 3.11 2.04 -0.03 0.25 117.51 123.26 1yju h ILE 62 Ca 0.07 -0.08 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 1yju h ILE 62 Cb 0.27 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1yju h ILE 62 CO -0.17 0.04 -0.15 1.05 0.00 0.00 0.00 178.15 178.93 1yju h GLU 63 N 0.24 0.59 0.00 2.37 -0.00 -1.12 -1.40 114.58 115.27 1yju h GLU 63 Ca 0.19 -0.26 0.00 0.00 -0.00 0.00 0.00 59.36 59.28 1yju h GLU 63 Cb 0.20 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.94 1yju h GLU 63 CO -0.22 0.84 0.00 1.03 -0.00 0.00 0.00 179.01 180.66 1yju h SER 64 N 0.33 0.00 0.00 3.06 0.87 0.09 -2.50 113.55 115.40 1yju h SER 64 Ca 0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1yju h SER 64 Cb 0.67 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1yju h SER 64 CO 0.04 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.52 1yju n LEU 65 N -2.39 0.10 -0.50 2.23 7.99 0.81 -5.00 117.00 120.24 1yju n LEU 65 Ca 0.01 0.02 -0.00 0.00 -0.01 0.00 0.00 56.01 56.02 1yju n LEU 65 Cb 0.18 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.49 1yju n LEU 65 CO 0.18 0.00 0.25 0.61 -1.51 0.00 0.00 177.39 176.92 1yju n GLY 66 N 1.52 0.96 3.22 -0.72 0.00 -0.94 -5.10 105.19 104.12 1yju n GLY 66 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 1.91 0.25 1.61 0.08 -0.54 -4.82 117.98 116.47 1yju s PHE 67 Ca 0.00 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.35 1yju s PHE 67 Cb 0.00 -1.24 -0.09 0.00 -0.57 0.00 0.00 43.02 41.12 1yju s PHE 67 CO 0.00 -0.06 1.02 -1.21 -0.10 0.00 0.00 175.22 174.86 1yju s GLU 68 N -0.40 4.75 0.07 0.44 0.41 0.71 -2.79 118.70 121.89 1yju s GLU 68 Ca 0.06 1.64 0.09 0.00 -0.41 0.00 0.00 54.97 56.34 1yju s GLU 68 Cb -0.09 -3.24 -0.03 0.00 -1.78 0.00 0.00 34.13 28.98 1yju s GLU 68 CO -0.00 0.35 -0.22 0.00 -0.49 0.00 0.00 175.26 174.90 1yju s ALA 69 N -1.08 2.47 -0.24 5.21 0.00 -1.26 -0.20 121.76 126.65 1yju s ALA 69 Ca 0.43 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 51.06 1yju s ALA 69 Cb -0.29 -0.58 0.13 0.00 0.00 0.00 0.00 23.12 22.39 1yju s ALA 69 CO 0.36 0.56 0.43 -1.12 0.00 0.00 0.00 175.76 175.99 1yju s SER 70 N -1.61 -0.15 -0.08 0.00 0.01 -0.04 -5.00 113.70 106.83 1yju s SER 70 Ca 0.14 0.52 -0.35 0.00 1.31 0.00 0.00 55.95 57.57 1yju s SER 70 Cb -0.10 1.36 -0.13 0.00 0.21 0.00 0.00 66.02 67.36 1yju s SER 70 CO 0.05 -0.28 1.82 0.18 0.41 0.00 0.00 173.24 175.43 1yju n LEU 71 N 5.38 3.24 -0.11 2.44 4.32 -1.26 -0.16 117.00 130.86 1yju n LEU 71 Ca -0.04 1.00 -0.17 0.00 -0.02 0.00 0.00 56.01 56.78 1yju n LEU 71 Cb 0.50 -1.34 -0.09 0.00 -1.62 0.00 0.00 43.42 40.87 1yju n LEU 71 CO 0.04 -0.15 -1.20 1.33 -1.22 0.00 0.00 177.39 176.19 1yju n VAL 72 N 4.85 1.20 -3.25 4.08 0.24 0.11 -4.85 118.33 120.71 1yju n VAL 72 Ca 0.22 -0.42 -0.21 0.00 -2.04 0.00 0.00 64.34 61.90 1yju n VAL 72 Cb 0.27 -1.38 0.02 0.00 -1.47 0.00 0.00 33.84 31.28 1yju n VAL 72 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1yju n LYS 73 N -3.34 -1.73 -1.59 7.34 0.00 -0.00 -4.88 118.16 113.96 1yju n LYS 73 Ca -0.39 1.50 -0.38 0.00 0.00 0.00 0.00 58.31 59.05 1yju n LYS 73 Cb 0.87 -2.69 0.05 0.00 0.00 0.00 0.00 35.03 33.27 1yju n LYS 73 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1yju n ILE 74 N 0.25 3.52 -1.82 3.15 -0.00 -1.26 -5.03 119.36 118.17 1yju n ILE 74 Ca -0.02 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.23 1yju n ILE 74 Cb 0.54 -1.06 0.00 0.00 -0.00 0.00 0.00 39.64 39.12 1yju n ILE 74 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93