#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yju s GLY 2 N 0.00 -0.14 1.00 3.03 0.00 -1.26 -5.17 107.32 104.79 1yju s GLY 2 Ca 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 44.72 44.52 1yju s GLY 2 CO 0.00 0.15 0.63 1.22 0.00 0.00 0.00 173.10 175.10 1yju n ASP 3 N -0.58 -1.41 -4.85 1.64 9.92 -1.26 -5.07 116.55 114.94 1yju n ASP 3 Ca -0.05 0.21 -0.24 0.00 -0.53 0.00 0.00 54.79 54.17 1yju n ASP 3 Cb 0.60 -1.25 0.07 0.00 -0.64 0.00 0.00 41.12 39.91 1yju n ASP 3 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1yju s GLY 4 N -2.22 1.75 -0.22 0.44 0.00 -1.24 -5.07 107.32 100.77 1yju s GLY 4 Ca 0.61 -1.22 -0.14 0.00 0.00 0.00 0.00 44.72 43.97 1yju s GLY 4 CO 0.64 -0.81 0.56 0.54 0.00 0.00 0.00 173.10 174.03 1yju s VAL 5 N -3.10 -0.01 -0.13 1.40 0.11 -1.26 -4.49 120.40 112.92 1yju s VAL 5 Ca 0.61 0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.72 1yju s VAL 5 Cb -0.09 -0.81 0.01 0.00 -1.53 0.00 0.00 36.38 33.96 1yju s VAL 5 CO 0.43 0.01 -0.19 -0.22 -3.33 0.00 0.00 175.10 171.80 1yju s LEU 6 N 1.28 1.97 -0.08 2.54 0.20 0.42 -4.90 118.68 120.11 1yju s LEU 6 Ca -0.08 -0.55 0.01 0.00 0.69 0.00 0.00 54.13 54.21 1yju s LEU 6 Cb -0.06 -1.33 0.02 0.00 -0.43 0.00 0.00 46.19 44.39 1yju s LEU 6 CO -0.13 0.05 -0.10 -0.70 -0.29 0.00 0.00 176.35 175.17 1yju s GLU 7 N 0.95 1.58 0.00 1.98 2.12 -1.26 -0.12 118.70 123.95 1yju s GLU 7 Ca -0.05 -0.34 -0.01 0.00 0.36 0.00 0.00 54.97 54.92 1yju s GLU 7 Cb -0.15 -1.42 -0.01 0.00 0.26 0.00 0.00 34.13 32.82 1yju s GLU 7 CO -0.03 -0.07 0.02 -0.48 -0.54 0.00 0.00 175.26 174.16 1yju s LEU 8 N 0.99 1.99 0.23 2.70 0.05 -0.39 -0.45 118.68 123.79 1yju s LEU 8 Ca -0.09 -0.19 -0.30 0.00 0.05 0.00 0.00 54.13 53.61 1yju s LEU 8 Cb -0.15 0.17 -0.09 0.00 -2.05 0.00 0.00 46.19 44.07 1yju s LEU 8 CO -0.00 -0.16 0.98 0.54 -0.55 0.00 0.00 176.35 177.15 1yju s VAL 9 N -0.71 4.00 -0.34 1.48 0.11 0.81 -0.45 120.40 125.30 1yju s VAL 9 Ca -0.08 1.97 0.03 0.00 -2.93 0.00 0.00 61.98 60.97 1yju s VAL 9 Cb -0.05 -4.25 0.10 0.00 -1.53 0.00 0.00 36.38 30.65 1yju s VAL 9 CO -0.00 0.45 0.07 0.68 -3.33 0.00 0.00 175.10 172.97 1yju s VAL 10 N -1.02 1.95 0.17 2.04 -7.23 0.39 -1.09 120.40 115.60 1yju s VAL 10 Ca 0.43 -2.16 -0.24 0.00 -1.81 0.00 0.00 61.98 58.20 1yju s VAL 10 Cb -0.27 -2.44 -0.08 0.00 0.56 0.00 0.00 36.38 34.15 1yju s VAL 10 CO 0.33 -0.63 0.75 -0.13 -0.31 0.00 0.00 175.10 175.11 1yju s ARG 11 N 1.02 4.47 0.00 4.82 0.52 0.52 -4.13 118.95 126.16 1yju s ARG 11 Ca 0.11 1.06 0.00 0.00 -0.52 0.00 0.00 55.73 56.39 1yju s ARG 11 Cb -0.19 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.10 1yju s ARG 11 CO -0.12 0.54 0.00 0.41 0.02 0.00 0.00 175.30 176.16 1yju n GLY 12 N 1.43 1.04 3.77 -3.53 0.00 -1.26 -0.96 105.19 105.67 1yju n GLY 12 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 1yju n GLY 12 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1yju s MET 13 N -0.55 3.56 -0.20 1.61 -1.94 -1.26 -4.94 119.30 115.57 1yju s MET 13 Ca 0.00 1.85 -0.27 0.00 -1.71 0.00 0.00 55.69 55.56 1yju s MET 13 Cb 0.00 -2.32 0.08 0.00 2.01 0.00 0.00 34.83 34.61 1yju s MET 13 CO 0.00 -0.74 0.78 -0.08 -0.01 0.00 0.00 175.02 174.98 1yju s THR 14 N -1.52 0.00 0.31 2.05 -1.32 -1.26 -5.04 115.64 108.86 1yju s THR 14 Ca 0.67 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.15 1yju s THR 14 Cb -0.31 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.68 1yju s THR 14 CO 0.36 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.77 1yju h ALA 16 N 0.46 3.32 -3.00 0.00 0.00 -2.01 -2.71 119.26 115.32 1yju h ALA 16 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1yju h ALA 16 Cb 0.29 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1yju h ALA 16 CO 0.00 -1.87 0.00 -1.13 0.00 0.00 0.00 179.25 176.25 1yju n SER 17 N -4.27 0.00 -0.30 0.00 3.41 -1.26 -0.52 113.62 110.68 1yju n SER 17 Ca 0.39 0.41 0.14 0.00 -0.26 0.00 0.00 58.87 59.55 1yju n SER 17 Cb 1.67 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 65.94 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 0.25 0.00 0.00 0.00 2.07 -1.52 -2.33 116.25 114.71 1yju h VAL 19 Ca 0.58 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 68.10 1yju h VAL 19 Cb 1.18 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1yju h VAL 19 CO -0.63 0.00 -0.01 1.12 0.02 0.00 0.00 177.57 178.07 1yju h HIS 20 N -0.26 0.00 -0.78 1.57 2.07 0.75 -3.13 115.15 115.37 1yju h HIS 20 Ca 0.01 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.49 1yju h HIS 20 Cb 0.29 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.24 1yju h HIS 20 CO -0.47 0.01 0.33 -0.22 -3.07 0.00 0.00 177.93 174.51 1yju h LYS 21 N 0.00 1.16 0.16 5.12 1.63 0.00 0.10 116.57 124.74 1yju h LYS 21 Ca -0.00 -0.20 -0.01 0.00 -0.85 0.00 0.00 60.65 59.59 1yju h LYS 21 Cb 0.45 -0.19 -0.00 0.00 -0.60 0.00 0.00 32.23 31.89 1yju h LYS 21 CO 0.00 0.93 -0.12 0.82 -3.45 0.00 0.00 179.45 177.63 1yju h ILE 22 N 1.12 0.00 -0.11 2.00 2.04 -1.46 0.15 117.51 121.25 1yju h ILE 22 Ca 0.26 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.14 1yju h ILE 22 Cb 0.19 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.23 1yju h ILE 22 CO -0.02 0.00 -0.32 1.05 0.00 0.00 0.00 178.15 178.86 1yju h GLU 23 N -0.27 -0.31 -0.68 2.37 -0.00 -1.64 0.96 114.58 115.01 1yju h GLU 23 Ca -0.02 0.02 0.15 0.00 -0.00 0.00 0.00 59.36 59.51 1yju h GLU 23 Cb 0.22 0.07 -0.11 0.00 -0.00 0.00 0.00 28.75 28.93 1yju h GLU 23 CO 0.01 -0.20 0.04 0.77 -0.00 0.00 0.00 179.01 179.62 1yju h SER 24 N -0.32 -0.24 -0.51 3.06 0.02 -0.87 0.20 113.55 114.89 1yju h SER 24 Ca 0.02 0.16 -0.13 0.00 -0.84 0.00 0.00 61.79 61.01 1yju h SER 24 Cb 0.39 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 1yju h SER 24 CO -0.28 -0.12 -0.18 -1.28 -1.14 0.00 0.00 176.83 173.84 1yju h SER 25 N 0.14 1.04 -0.04 3.07 0.87 -0.17 -3.05 113.55 115.40 1yju h SER 25 Ca 0.37 -0.38 -0.18 0.00 -1.23 0.00 0.00 61.79 60.37 1yju h SER 25 Cb 0.62 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1yju h SER 25 CO -0.57 1.18 -0.62 -0.07 -0.53 0.00 0.00 176.83 176.23 1yju h LEU 26 N 0.89 0.74 -7.00 2.23 3.38 0.06 -3.39 115.31 112.21 1yju h LEU 26 Ca 0.12 -0.43 -0.54 0.00 0.09 0.00 0.00 57.88 57.13 1yju h LEU 26 Cb 0.75 -0.21 0.03 0.00 0.09 0.00 0.00 40.66 41.32 1yju h LEU 26 CO 0.06 1.18 1.79 0.41 0.09 0.00 0.00 178.44 181.97 1yju n THR 27 N -3.95 1.60 0.00 0.22 -1.04 0.61 -0.99 114.28 110.73 1yju n THR 27 Ca -0.04 -1.49 0.00 0.00 -2.04 0.00 0.00 64.05 60.48 1yju n THR 27 Cb 0.65 -2.23 0.00 0.00 -1.82 0.00 0.00 70.33 66.93 1yju n THR 27 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1yju n LYS 28 N 7.50 0.00 -0.34 -2.82 -0.00 -1.26 -4.92 118.16 116.32 1yju n LYS 28 Ca 0.48 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.86 1yju n LYS 28 Cb 0.43 0.00 0.23 0.00 -0.00 0.00 0.00 35.03 35.68 1yju n LYS 28 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1yju h HIS 29 N 0.00 1.04 0.00 5.58 3.86 -1.33 -3.46 115.15 120.84 1yju h HIS 29 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1yju h HIS 29 Cb 0.00 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.15 1yju h HIS 29 CO 0.00 0.38 0.00 -2.13 0.86 0.00 0.00 177.93 177.04 1yju n ARG 30 N -4.68 0.00 0.07 2.45 0.63 -1.26 -4.87 116.66 109.00 1yju n ARG 30 Ca 0.18 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 57.00 1yju n ARG 30 Cb 0.37 -2.22 -0.03 0.00 0.45 0.00 0.00 32.46 31.03 1yju n ARG 30 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 1yju h GLY 31 N 0.00 0.36 -4.83 5.14 0.00 -1.88 -3.43 103.07 98.43 1yju h GLY 31 Ca 0.00 -0.63 -0.56 0.00 0.00 0.00 0.00 47.33 46.14 1yju h GLY 31 CO 0.00 0.56 0.05 -1.50 0.00 0.00 0.00 176.54 175.65 1yju s ILE 32 N -3.24 4.88 -0.19 2.60 -1.16 -1.26 -0.72 121.20 122.12 1yju s ILE 32 Ca -0.05 1.39 0.13 0.00 -0.51 0.00 0.00 60.65 61.62 1yju s ILE 32 Cb 0.09 -4.00 -0.21 0.00 0.61 0.00 0.00 42.46 38.95 1yju s ILE 32 CO 0.85 0.37 0.01 0.18 -2.81 0.00 0.00 174.94 173.55 1yju n LEU 33 N 2.94 0.56 -3.62 8.50 4.77 0.58 -4.91 117.00 125.83 1yju n LEU 33 Ca -0.05 -0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.77 1yju n LEU 33 Cb 0.51 0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.75 1yju n LEU 33 CO 0.45 0.53 0.23 -0.47 -1.33 0.00 0.00 177.39 176.80 1yju s TYR 34 N -2.44 -0.38 -0.32 -1.77 5.04 -0.94 -4.98 117.35 111.56 1yju s TYR 34 Ca -0.13 0.46 0.02 0.00 -2.44 0.00 0.00 57.07 54.98 1yju s TYR 34 Cb 0.06 0.29 0.15 0.00 0.35 0.00 0.00 41.96 42.81 1yju s TYR 34 CO 0.70 -0.59 0.38 0.00 -1.34 0.00 0.00 175.55 174.71 1yju s SER 36 N 2.08 6.21 -1.13 0.00 0.01 0.33 -4.80 113.70 116.41 1yju s SER 36 Ca 0.12 -1.06 -0.14 0.00 1.31 0.00 0.00 55.95 56.19 1yju s SER 36 Cb -0.13 -2.28 0.18 0.00 0.21 0.00 0.00 66.02 64.00 1yju s SER 36 CO -0.21 -0.91 1.30 -0.69 0.41 0.00 0.00 173.24 173.14 1yju s VAL 37 N 2.54 5.14 -0.99 3.43 1.01 -1.26 -0.64 120.40 129.63 1yju s VAL 37 Ca 0.13 -2.55 -0.22 0.00 0.00 0.00 0.00 61.98 59.34 1yju s VAL 37 Cb -0.21 -4.82 0.07 0.00 0.00 0.00 0.00 36.38 31.42 1yju s VAL 37 CO 0.10 -1.51 1.37 0.00 0.00 0.00 0.00 175.10 175.07 1yju s ALA 38 N 1.31 2.86 0.49 5.51 0.00 0.82 -4.81 121.76 127.92 1yju s ALA 38 Ca 0.38 -2.36 0.31 0.00 0.00 0.00 0.00 51.96 50.29 1yju s ALA 38 Cb -0.05 -4.42 1.40 0.00 0.00 0.00 0.00 23.12 20.06 1yju s ALA 38 CO -0.03 -3.47 1.77 1.25 0.00 0.00 0.00 175.76 175.28 1yju h LEU 39 N 12.27 0.17 -1.74 0.00 6.46 -1.92 0.70 115.31 131.24 1yju h LEU 39 Ca 0.18 0.04 0.22 0.00 -0.12 0.00 0.00 57.88 58.20 1yju h LEU 39 Cb 1.01 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.91 1yju h LEU 39 CO 1.35 0.01 0.60 0.00 -0.62 0.00 0.00 178.44 179.79 1yju h ALA 40 N 1.48 2.49 0.00 1.25 0.00 -1.94 0.51 119.26 123.06 1yju h ALA 40 Ca 0.61 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1yju h ALA 40 Cb 2.10 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.91 1yju h ALA 40 CO -0.14 -0.76 -0.05 -2.37 0.00 0.00 0.00 179.25 175.93 1yju n THR 41 N -4.41 1.50 -4.05 0.00 5.66 0.08 -5.01 114.28 108.05 1yju n THR 41 Ca 0.18 -1.77 -0.31 0.00 -3.05 0.00 0.00 64.05 59.11 1yju n THR 41 Cb 0.80 -0.01 -0.08 0.00 -1.55 0.00 0.00 70.33 69.50 1yju n THR 41 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1yju n ASN 42 N -1.10 -0.33 -3.97 1.09 4.13 0.17 -4.91 115.26 110.34 1yju n ASN 42 Ca 0.11 -1.06 -0.13 0.00 1.68 0.00 0.00 54.58 55.17 1yju n ASN 42 Cb 0.58 -1.34 -0.13 0.00 -1.54 0.00 0.00 39.78 37.34 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 -6.48 0.36 -0.38 3.52 2.36 -0.89 -0.46 119.74 117.76 1yju s LYS 43 Ca 0.34 -0.36 -0.17 0.00 -2.55 0.00 0.00 55.97 53.23 1yju s LYS 43 Cb -0.20 -0.23 0.00 0.00 -1.05 0.00 0.00 37.83 36.35 1yju s LYS 43 CO 0.85 0.05 0.43 0.00 1.55 0.00 0.00 175.35 178.24 1yju s ALA 44 N -0.61 3.46 -0.55 3.13 0.00 0.40 -0.13 121.76 127.45 1yju s ALA 44 Ca -0.04 -1.29 -0.24 0.00 0.00 0.00 0.00 51.96 50.38 1yju s ALA 44 Cb -0.05 -2.97 0.04 0.00 0.00 0.00 0.00 23.12 20.14 1yju s ALA 44 CO -0.00 -1.34 0.95 -1.58 0.00 0.00 0.00 175.76 173.79 1yju s HIS 45 N 2.17 2.79 -0.35 0.00 2.46 0.18 -1.27 115.29 121.27 1yju s HIS 45 Ca 0.14 -0.01 -0.00 0.00 0.47 0.00 0.00 55.06 55.65 1yju s HIS 45 Cb -0.16 -4.09 0.09 0.00 -0.13 0.00 0.00 32.58 28.29 1yju s HIS 45 CO 0.13 -1.36 0.09 0.42 -2.47 0.00 0.00 174.74 171.55 1yju s ILE 46 N 3.97 2.88 -1.18 0.89 1.01 0.82 -0.51 121.20 129.08 1yju s ILE 46 Ca 0.30 -1.90 -0.20 0.00 0.00 0.00 0.00 60.65 58.85 1yju s ILE 46 Cb -0.13 -2.89 0.04 0.00 0.01 0.00 0.00 42.46 39.49 1yju s ILE 46 CO 0.19 -0.45 1.68 -0.54 0.00 0.00 0.00 174.94 175.82 1yju s LYS 47 N 1.11 3.63 0.51 2.79 -0.14 0.67 -0.43 119.74 127.88 1yju s LYS 47 Ca 0.04 -1.55 -0.02 0.00 -1.36 0.00 0.00 55.97 53.08 1yju s LYS 47 Cb -0.21 -5.43 0.00 0.00 -1.68 0.00 0.00 37.83 30.52 1yju s LYS 47 CO -0.04 -2.49 0.77 1.52 -0.76 0.00 0.00 175.35 174.34 1yju s TYR 48 N 5.51 3.21 -0.45 3.18 1.13 -1.26 -0.31 117.35 128.36 1yju s TYR 48 Ca 0.54 0.37 -0.08 0.00 -1.41 0.00 0.00 57.07 56.49 1yju s TYR 48 Cb 0.02 -2.51 0.11 0.00 -1.10 0.00 0.00 41.96 38.47 1yju s TYR 48 CO 0.03 -0.58 0.30 0.34 -2.51 0.00 0.00 175.55 173.13 1yju s ASP 49 N -4.27 5.60 -1.37 -0.18 2.15 0.11 -3.64 116.67 115.07 1yju s ASP 49 Ca 0.51 -1.84 -0.09 0.00 0.43 0.00 0.00 52.55 51.56 1yju s ASP 49 Cb -0.10 -1.97 -0.07 0.00 -0.30 0.00 0.00 42.92 40.47 1yju s ASP 49 CO 0.41 -0.63 2.63 -0.81 -0.17 0.00 0.00 175.17 176.60 1yju n PRO 50 N 4.85 3.10 0.00 4.34 -0.04 -1.26 -3.15 135.00 142.84 1yju n PRO 50 Ca -0.07 -1.97 0.00 0.00 -0.04 0.00 0.00 63.50 61.42 1yju n PRO 50 Cb 0.41 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 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 3.96 0.00 0.08 0.54 0.28 -1.26 -4.88 120.64 119.36 1yju n GLU 51 Ca 0.66 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.78 1yju n GLU 51 Cb 0.21 -0.07 0.46 0.00 1.43 0.00 0.00 31.44 33.47 1yju n GLU 51 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 1yju n ILE 52 N -1.51 0.60 -3.76 3.84 -5.35 -1.19 -4.75 119.36 107.26 1yju n ILE 52 Ca 0.00 -0.03 -0.13 0.00 -0.27 0.00 0.00 62.75 62.32 1yju n ILE 52 Cb 0.00 -0.78 -0.10 0.00 -1.74 0.00 0.00 39.64 37.02 1yju n ILE 52 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 1yju s ILE 53 N -3.14 0.03 0.25 7.28 2.07 -1.23 -4.83 121.20 121.64 1yju s ILE 53 Ca 0.09 -0.22 -0.13 0.00 -1.41 0.00 0.00 60.65 58.97 1yju s ILE 53 Cb 0.12 -0.54 -0.08 0.00 0.13 0.00 0.00 42.46 42.09 1yju s ILE 53 CO 0.49 -0.12 0.63 -0.83 -1.91 0.00 0.00 174.94 173.20 1yju s GLY 54 N -0.53 2.36 0.22 1.50 0.00 -1.26 -4.42 107.32 105.18 1yju s GLY 54 Ca -0.06 -0.09 -0.08 0.00 0.00 0.00 0.00 44.72 44.48 1yju s GLY 54 CO 0.02 0.11 1.84 -0.56 0.00 0.00 0.00 173.10 174.51 1yju h PRO 55 N 2.66 0.82 -0.98 2.90 0.13 -1.97 0.23 132.00 135.79 1yju h PRO 55 Ca -0.48 -0.05 0.36 0.00 -0.87 0.00 0.00 66.00 64.97 1yju h PRO 55 Cb 1.18 -0.19 -0.18 0.00 0.13 0.00 0.00 31.00 31.94 1yju h PRO 55 CO 0.67 0.54 0.35 2.89 -0.23 0.00 0.00 178.00 182.22 1yju n ARG 56 N -4.69 -0.07 -0.11 0.86 -4.01 -1.26 -1.01 116.66 106.37 1yju n ARG 56 Ca 0.10 1.39 -0.13 0.00 -1.04 0.00 0.00 57.85 58.17 1yju n ARG 56 Cb 0.15 -2.40 -0.03 0.00 -3.04 0.00 0.00 32.46 27.14 1yju n ARG 56 CO 0.00 0.00 0.00 -0.44 -3.04 0.00 0.00 177.63 174.15 1yju h ASP 57 N 0.00 0.86 -0.06 2.89 3.32 -1.33 0.99 116.42 123.09 1yju h ASP 57 Ca 0.75 -0.45 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 1yju h ASP 57 Cb 1.86 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 41.17 1yju h ASP 57 CO -0.81 1.12 0.02 0.40 -1.72 0.00 0.00 179.24 178.25 1yju h ILE 58 N 0.60 1.15 -0.15 0.35 2.04 -1.12 0.26 117.51 120.64 1yju h ILE 58 Ca 0.07 -0.45 0.05 0.00 1.00 0.00 0.00 64.86 65.52 1yju h ILE 58 Cb 0.85 1.35 -0.07 0.00 -0.74 0.00 0.00 36.82 38.21 1yju h ILE 58 CO 0.07 0.13 -0.41 0.40 0.00 0.00 0.00 178.15 178.34 1yju h ILE 59 N -0.08 0.16 -0.33 -0.67 5.03 -0.86 0.11 117.51 120.87 1yju h ILE 59 Ca 0.02 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.83 1yju h ILE 59 Cb 0.19 0.16 -0.07 0.00 -3.03 0.00 0.00 36.82 34.06 1yju h ILE 59 CO -0.00 0.00 -0.18 0.45 -0.68 0.00 0.00 178.15 177.74 1yju h HIS 60 N -0.47 -0.44 0.20 1.37 3.86 -0.67 -0.28 115.15 118.71 1yju h HIS 60 Ca 0.08 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1yju h HIS 60 Cb 0.62 0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.32 1yju h HIS 60 CO -0.49 -0.25 -0.14 1.15 0.86 0.00 0.00 177.93 179.06 1yju h THR 61 N -0.13 0.70 0.09 2.45 2.02 -0.24 0.86 112.91 118.66 1yju h THR 61 Ca 0.17 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.36 1yju h THR 61 Cb 0.39 0.70 -0.05 0.00 -1.74 0.00 0.00 68.15 67.46 1yju h THR 61 CO -0.41 0.00 -0.51 0.40 0.37 0.00 0.00 175.52 175.37 1yju h ILE 62 N -0.33 0.00 -0.59 3.11 2.04 -0.30 -1.06 117.51 120.37 1yju h ILE 62 Ca -0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 1yju h ILE 62 Cb 0.29 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.32 1yju h ILE 62 CO 0.00 0.00 0.30 -0.33 0.00 0.00 0.00 178.15 178.12 1yju h GLU 63 N -0.70 0.54 0.00 2.37 5.08 -0.96 -0.38 114.58 120.54 1yju h GLU 63 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1yju h GLU 63 Cb 0.71 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1yju h GLU 63 CO -0.29 0.36 0.00 0.45 -1.00 0.00 0.00 179.01 178.53 1yju n SER 64 N -4.87 0.00 0.00 1.42 2.88 0.28 -1.65 113.62 111.68 1yju n SER 64 Ca 0.07 0.45 0.00 0.00 -1.33 0.00 0.00 58.87 58.05 1yju n SER 64 Cb 0.18 -0.46 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 1yju n SER 64 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1yju n LEU 65 N -1.46 0.37 -2.68 2.46 7.99 -0.15 -4.96 117.00 118.56 1yju n LEU 65 Ca 0.01 0.08 -0.03 0.00 -0.01 0.00 0.00 56.01 56.06 1yju n LEU 65 Cb 0.05 0.00 0.12 0.00 -0.11 0.00 0.00 43.42 43.48 1yju n LEU 65 CO 0.04 0.00 0.58 0.61 -1.51 0.00 0.00 177.39 177.11 1yju n GLY 66 N 1.18 1.87 3.50 -0.72 0.00 -0.94 -5.13 105.19 104.94 1yju n GLY 66 Ca 0.00 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.02 2.06 -0.17 1.61 0.08 -0.66 -4.82 117.98 116.06 1yju s PHE 67 Ca 0.13 -0.92 0.00 0.00 0.12 0.00 0.00 56.93 56.26 1yju s PHE 67 Cb 0.43 -1.38 0.01 0.00 -0.57 0.00 0.00 43.02 41.51 1yju s PHE 67 CO -0.12 0.08 -0.16 -2.00 -0.10 0.00 0.00 175.22 172.92 1yju s GLU 68 N -3.84 3.13 0.19 0.44 2.12 -0.14 -4.36 118.70 116.24 1yju s GLU 68 Ca 0.34 -0.77 0.09 0.00 0.36 0.00 0.00 54.97 54.99 1yju s GLU 68 Cb 0.08 -2.65 -0.04 0.00 0.26 0.00 0.00 34.13 31.79 1yju s GLU 68 CO 0.16 -0.11 -0.08 0.00 -0.54 0.00 0.00 175.26 174.69 1yju s ALA 69 N 1.10 3.00 -0.25 6.30 0.00 -1.26 -0.36 121.76 130.29 1yju s ALA 69 Ca 0.00 -1.47 -0.09 0.00 0.00 0.00 0.00 51.96 50.40 1yju s ALA 69 Cb -0.14 -0.78 0.11 0.00 0.00 0.00 0.00 23.12 22.31 1yju s ALA 69 CO -0.06 0.46 0.54 -1.12 0.00 0.00 0.00 175.76 175.58 1yju s SER 70 N -2.90 -0.72 0.17 0.00 0.01 -0.25 -4.98 113.70 105.02 1yju s SER 70 Ca 0.26 1.29 -0.32 0.00 1.31 0.00 0.00 55.95 58.48 1yju s SER 70 Cb -0.09 1.74 -0.12 0.00 0.21 0.00 0.00 66.02 67.76 1yju s SER 70 CO 0.16 -0.22 1.72 -0.11 0.41 0.00 0.00 173.24 175.19 1yju n LEU 71 N 5.26 3.75 -4.50 2.44 0.00 -1.26 -0.13 117.00 122.55 1yju n LEU 71 Ca -0.12 1.05 -0.25 0.00 0.00 0.00 0.00 56.01 56.69 1yju n LEU 71 Cb 0.50 -1.52 -0.10 0.00 0.00 0.00 0.00 43.42 42.30 1yju n LEU 71 CO -0.01 0.05 -0.46 0.68 0.00 0.00 0.00 177.39 177.64 1yju s VAL 72 N 1.54 2.68 -1.30 1.96 -7.23 0.40 -4.85 120.40 113.60 1yju s VAL 72 Ca 0.78 -2.18 -0.11 0.00 -1.81 0.00 0.00 61.98 58.66 1yju s VAL 72 Cb -0.55 -2.38 0.14 0.00 0.56 0.00 0.00 36.38 34.15 1yju s VAL 72 CO 0.35 -0.31 1.83 0.29 -0.31 0.00 0.00 175.10 176.96 1yju n LYS 73 N -0.41 3.42 0.00 4.82 4.76 -1.26 -4.45 118.16 125.04 1yju n LYS 73 Ca -0.07 -3.43 0.00 0.00 -2.87 0.00 0.00 58.31 51.93 1yju n LYS 73 Cb 0.59 -3.04 0.00 0.00 -1.84 0.00 0.00 35.03 30.73 1yju n LYS 73 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1yju n ILE 74 N 4.06 0.00 0.00 -0.18 2.08 -1.26 -5.15 119.36 118.91 1yju n ILE 74 Ca 0.42 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.73 1yju n ILE 74 Cb 0.39 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.28 1yju n ILE 74 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49