#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 0.82 5.00 3.03 0.00 -1.26 -5.07 105.19 107.72 1yju n GLY 2 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1yju n GLY 2 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yju n ASP 3 N 0.00 0.00 -3.57 1.61 8.00 -1.26 -4.65 116.55 116.68 1yju n ASP 3 Ca 0.00 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.31 1yju n ASP 3 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.16 1yju n ASP 3 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yju n GLY 4 N 0.00 -0.32 3.49 0.44 0.00 -1.26 -3.83 105.19 103.70 1yju n GLY 4 Ca 0.00 0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1yju n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yju s VAL 5 N -3.52 4.38 -0.33 1.61 1.01 -1.26 -0.79 120.40 121.50 1yju s VAL 5 Ca 0.01 -1.07 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 1yju s VAL 5 Cb -0.00 -4.86 0.03 0.00 0.00 0.00 0.00 36.38 31.54 1yju s VAL 5 CO 0.77 -1.65 0.11 -0.22 0.00 0.00 0.00 175.10 174.12 1yju s LEU 6 N 3.71 4.24 0.08 3.92 2.96 0.47 -4.97 118.68 129.09 1yju s LEU 6 Ca 0.35 -0.99 -0.26 0.00 -0.22 0.00 0.00 54.13 53.01 1yju s LEU 6 Cb -0.05 -1.90 -0.06 0.00 0.50 0.00 0.00 46.19 44.68 1yju s LEU 6 CO -0.06 -0.30 0.82 -1.61 -1.32 0.00 0.00 176.35 173.88 1yju s GLU 7 N 1.46 4.56 -0.16 1.98 2.02 -1.26 -0.98 118.70 126.32 1yju s GLU 7 Ca 0.00 1.18 -0.05 0.00 0.02 0.00 0.00 54.97 56.12 1yju s GLU 7 Cb -0.19 -3.36 -0.03 0.00 0.10 0.00 0.00 34.13 30.66 1yju s GLU 7 CO 0.03 0.30 -0.01 -0.51 0.02 0.00 0.00 175.26 175.10 1yju s LEU 8 N -0.17 3.44 0.02 1.80 1.02 0.25 -0.38 118.68 124.66 1yju s LEU 8 Ca 0.40 -0.05 -0.30 0.00 0.02 0.00 0.00 54.13 54.20 1yju s LEU 8 Cb -0.22 -1.84 -0.04 0.00 0.02 0.00 0.00 46.19 44.11 1yju s LEU 8 CO 0.25 0.18 1.10 0.68 0.02 0.00 0.00 176.35 178.58 1yju s VAL 9 N 0.32 4.42 0.13 -1.59 -7.23 0.50 -0.37 120.40 116.57 1yju s VAL 9 Ca -0.02 1.73 0.07 0.00 -1.81 0.00 0.00 61.98 61.95 1yju s VAL 9 Cb -0.14 -4.11 -0.04 0.00 0.56 0.00 0.00 36.38 32.65 1yju s VAL 9 CO 0.02 0.12 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.19 1yju s VAL 10 N 1.15 3.62 0.03 1.32 1.01 0.11 -0.48 120.40 127.17 1yju s VAL 10 Ca 0.55 -1.27 0.05 0.00 0.00 0.00 0.00 61.98 61.32 1yju s VAL 10 Cb -0.25 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 1yju s VAL 10 CO 0.28 0.04 -0.14 0.00 0.00 0.00 0.00 175.10 175.27 1yju s ARG 11 N -2.48 1.01 0.00 2.72 1.70 0.22 -4.80 118.95 117.32 1yju s ARG 11 Ca 0.24 -0.70 0.00 0.00 -0.47 0.00 0.00 55.73 54.80 1yju s ARG 11 Cb -0.11 -1.02 0.00 0.00 -0.57 0.00 0.00 34.95 33.26 1yju s ARG 11 CO 0.16 0.26 0.00 0.41 -1.08 0.00 0.00 175.30 175.05 1yju n GLY 12 N 2.11 0.84 3.74 3.88 0.00 -1.26 -2.67 105.19 111.83 1yju n GLY 12 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.62 2.12 -0.29 1.61 -1.94 -1.26 -4.96 119.30 113.97 1yju s MET 13 Ca 0.00 1.38 -0.15 0.00 -1.71 0.00 0.00 55.69 55.20 1yju s MET 13 Cb 0.00 -1.87 0.12 0.00 2.01 0.00 0.00 34.83 35.09 1yju s MET 13 CO 0.00 -1.77 0.83 -0.08 -0.01 0.00 0.00 175.02 173.99 1yju s THR 14 N -2.59 -0.12 0.34 2.05 -1.32 -1.26 -5.08 115.64 107.66 1yju s THR 14 Ca 0.65 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.13 1yju s THR 14 Cb -0.21 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.78 1yju s THR 14 CO 0.51 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.92 1yju h ALA 16 N -1.21 2.08 -0.12 0.00 0.00 -2.00 -3.19 119.26 114.82 1yju h ALA 16 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1yju h ALA 16 Cb 1.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1yju h ALA 16 CO 0.02 -0.39 0.00 -1.13 0.00 0.00 0.00 179.25 177.74 1yju n SER 17 N -4.09 0.00 -0.31 0.00 3.41 -1.26 -0.68 113.62 110.70 1yju n SER 17 Ca 0.04 0.98 0.12 0.00 -0.26 0.00 0.00 58.87 59.75 1yju n SER 17 Cb 0.40 -0.48 0.29 0.00 -0.26 0.00 0.00 64.21 64.16 1yju n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yju n VAL 19 N -4.96 0.00 0.20 0.00 0.31 -1.14 -0.81 118.33 111.93 1yju n VAL 19 Ca 0.21 1.42 0.04 0.00 -0.01 0.00 0.00 64.34 66.00 1yju n VAL 19 Cb 0.60 -2.21 0.41 0.00 -0.91 0.00 0.00 33.84 31.73 1yju n VAL 19 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 1yju h HIS 20 N 0.00 0.00 0.24 3.52 2.07 -0.57 -1.33 115.15 119.08 1yju h HIS 20 Ca 0.00 0.00 0.01 0.00 -2.85 0.00 0.00 60.37 57.53 1yju h HIS 20 Cb 0.00 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 29.95 1yju h HIS 20 CO -0.22 0.32 -0.35 -0.22 -3.07 0.00 0.00 177.93 174.39 1yju h LYS 21 N 0.00 -0.64 0.25 5.12 1.63 -0.72 0.97 116.57 123.19 1yju h LYS 21 Ca -0.00 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1yju h LYS 21 Cb 0.60 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.36 1yju h LYS 21 CO 0.04 -0.42 -0.23 0.82 -3.45 0.00 0.00 179.45 176.21 1yju h ILE 22 N -0.66 0.51 -0.22 2.00 2.04 -0.30 0.14 117.51 121.02 1yju h ILE 22 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1yju h ILE 22 Cb 0.64 0.51 -0.07 0.00 -0.74 0.00 0.00 36.82 37.15 1yju h ILE 22 CO -0.13 0.00 -0.32 -0.33 0.00 0.00 0.00 178.15 177.37 1yju h GLU 23 N -0.50 -0.33 0.09 2.37 5.08 -1.11 0.37 114.58 120.54 1yju h GLU 23 Ca -0.01 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1yju h GLU 23 Cb 0.46 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1yju h GLU 23 CO -0.04 -0.22 -0.38 1.03 -1.00 0.00 0.00 179.01 178.40 1yju h SER 24 N -0.35 -1.13 -0.16 1.42 0.87 -0.73 -0.77 113.55 112.72 1yju h SER 24 Ca 0.12 0.13 0.05 0.00 -1.23 0.00 0.00 61.79 60.86 1yju h SER 24 Cb 0.54 0.43 -0.07 0.00 -0.44 0.00 0.00 62.40 62.86 1yju h SER 24 CO -0.41 -0.45 -0.39 0.28 -0.53 0.00 0.00 176.83 175.33 1yju h SER 25 N -0.60 -1.22 -0.14 6.23 0.02 0.39 -2.01 113.55 116.23 1yju h SER 25 Ca 0.03 0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 61.07 1yju h SER 25 Cb 0.64 0.51 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 1yju h SER 25 CO -0.24 -0.40 -0.22 -0.07 -1.14 0.00 0.00 176.83 174.76 1yju h LEU 26 N -0.45 0.44 -1.39 5.07 -0.00 -0.93 -3.10 115.31 114.96 1yju h LEU 26 Ca 0.09 -0.53 0.19 0.00 -0.00 0.00 0.00 57.88 57.63 1yju h LEU 26 Cb 0.60 -0.12 -0.07 0.00 -0.00 0.00 0.00 40.66 41.06 1yju h LEU 26 CO -0.40 0.88 0.60 0.74 -0.00 0.00 0.00 178.44 180.26 1yju h THR 27 N 0.00 0.70 -0.38 0.22 2.02 -0.88 0.12 112.91 114.71 1yju h THR 27 Ca 0.01 -0.18 0.11 0.00 0.77 0.00 0.00 66.41 67.13 1yju h THR 27 Cb 0.79 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 1yju h THR 27 CO 0.05 0.09 0.39 0.11 0.37 0.00 0.00 175.52 176.53 1yju h LYS 28 N 0.51 0.00 0.00 6.66 1.79 -1.29 -0.52 116.57 123.73 1yju h LYS 28 Ca 0.49 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.93 1yju h LYS 28 Cb 1.06 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.71 1yju h LYS 28 CO -0.22 0.00 -0.15 0.45 -1.08 0.00 0.00 179.45 178.45 1yju h HIS 29 N 0.00 0.00 0.00 -1.35 3.86 -0.89 -3.46 115.15 113.31 1yju h HIS 29 Ca 0.18 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1yju h HIS 29 Cb 0.96 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.43 1yju h HIS 29 CO 0.00 0.15 0.00 0.54 0.86 0.00 0.00 177.93 179.48 1yju n ARG 30 N -4.25 0.00 0.06 2.45 1.74 -0.20 -4.78 116.66 111.68 1yju n ARG 30 Ca -0.02 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.97 1yju n ARG 30 Cb 0.22 -3.01 -0.12 0.00 -1.02 0.00 0.00 32.46 28.53 1yju n ARG 30 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1yju h GLY 31 N 0.00 0.05 -5.73 -0.13 0.00 -1.86 -3.43 103.07 91.97 1yju h GLY 31 Ca 0.00 -0.12 -0.57 0.00 0.00 0.00 0.00 47.33 46.64 1yju h GLY 31 CO 0.00 0.11 0.86 -0.42 0.00 0.00 0.00 176.54 177.08 1yju s ILE 32 N -2.70 4.47 0.10 2.60 1.09 -1.26 -3.60 121.20 121.90 1yju s ILE 32 Ca -0.00 1.69 -0.01 0.00 -1.10 0.00 0.00 60.65 61.22 1yju s ILE 32 Cb 0.09 -4.41 -0.24 0.00 -1.06 0.00 0.00 42.46 36.84 1yju s ILE 32 CO 0.83 -0.50 1.22 -0.07 -0.10 0.00 0.00 174.94 176.31 1yju h LEU 33 N 10.18 0.34 -7.26 2.97 3.38 -0.80 -3.45 115.31 120.67 1yju h LEU 33 Ca -0.21 -0.34 -0.09 0.00 0.09 0.00 0.00 57.88 57.33 1yju h LEU 33 Cb 1.06 -0.11 -0.21 0.00 0.09 0.00 0.00 40.66 41.50 1yju h LEU 33 CO 1.04 1.23 -0.09 -0.47 0.09 0.00 0.00 178.44 180.24 1yju s TYR 34 N -2.81 -0.45 -0.02 1.13 5.04 -0.61 -4.98 117.35 114.67 1yju s TYR 34 Ca -0.03 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 55.49 1yju s TYR 34 Cb 0.08 0.22 0.03 0.00 0.35 0.00 0.00 41.96 42.64 1yju s TYR 34 CO 0.86 -0.41 0.02 0.00 -1.34 0.00 0.00 175.55 174.69 1yju s SER 36 N 0.98 0.79 -0.78 0.00 0.01 0.14 -4.97 113.70 109.87 1yju s SER 36 Ca -0.08 0.26 -0.03 0.00 1.31 0.00 0.00 55.95 57.41 1yju s SER 36 Cb -0.12 0.48 0.20 0.00 0.21 0.00 0.00 66.02 66.79 1yju s SER 36 CO -0.03 -0.27 0.64 -0.69 0.41 0.00 0.00 173.24 173.30 1yju s VAL 37 N 2.36 4.19 -0.88 3.43 1.01 -1.26 -0.63 120.40 128.61 1yju s VAL 37 Ca 0.04 -3.38 -0.22 0.00 0.00 0.00 0.00 61.98 58.42 1yju s VAL 37 Cb -0.13 -3.65 0.08 0.00 0.00 0.00 0.00 36.38 32.68 1yju s VAL 37 CO -0.09 -0.99 1.22 0.00 0.00 0.00 0.00 175.10 175.24 1yju s ALA 38 N -0.69 3.01 0.35 5.51 0.00 0.66 -4.82 121.76 125.78 1yju s ALA 38 Ca 0.22 -2.21 0.15 0.00 0.00 0.00 0.00 51.96 50.12 1yju s ALA 38 Cb -0.13 -4.20 1.10 0.00 0.00 0.00 0.00 23.12 19.89 1yju s ALA 38 CO -0.08 -3.20 1.66 1.25 0.00 0.00 0.00 175.76 175.40 1yju h LEU 39 N 11.77 0.51 -1.99 0.00 6.46 -1.94 0.96 115.31 131.07 1yju h LEU 39 Ca 0.02 0.19 0.23 0.00 -0.12 0.00 0.00 57.88 58.20 1yju h LEU 39 Cb 1.03 0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 41.07 1yju h LEU 39 CO 1.25 -0.14 0.58 0.00 -0.62 0.00 0.00 178.44 179.52 1yju h ALA 40 N 1.84 2.76 0.00 1.25 0.00 -1.95 0.22 119.26 123.37 1yju h ALA 40 Ca 0.74 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.62 1yju h ALA 40 Cb 1.71 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1yju h ALA 40 CO -0.60 -0.99 -0.04 -2.37 0.00 0.00 0.00 179.25 175.25 1yju n THR 41 N -4.30 1.19 -3.61 0.00 5.66 0.16 -5.02 114.28 108.36 1yju n THR 41 Ca 0.16 -1.34 -0.19 0.00 -3.05 0.00 0.00 64.05 59.63 1yju n THR 41 Cb 0.87 0.25 -0.03 0.00 -1.55 0.00 0.00 70.33 69.87 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 -0.79 -0.38 -4.01 1.09 4.13 0.06 -4.89 115.26 110.47 1yju n ASN 42 Ca 0.06 -0.68 -0.18 0.00 1.68 0.00 0.00 54.58 55.46 1yju n ASN 42 Cb 0.46 -0.84 -0.15 0.00 -1.54 0.00 0.00 39.78 37.72 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 -5.66 0.65 -0.44 3.52 2.36 -1.10 -0.71 119.74 118.36 1yju s LYS 43 Ca 0.09 -0.30 -0.08 0.00 -2.55 0.00 0.00 55.97 53.13 1yju s LYS 43 Cb -0.05 -0.63 0.11 0.00 -1.05 0.00 0.00 37.83 36.21 1yju s LYS 43 CO 0.52 0.17 0.29 0.00 1.55 0.00 0.00 175.35 177.88 1yju s ALA 44 N -0.22 3.30 -0.53 3.13 0.00 0.50 -0.24 121.76 127.70 1yju s ALA 44 Ca 0.03 -2.42 -0.28 0.00 0.00 0.00 0.00 51.96 49.28 1yju s ALA 44 Cb -0.03 -2.67 0.02 0.00 0.00 0.00 0.00 23.12 20.44 1yju s ALA 44 CO -0.00 -1.80 1.30 -1.58 0.00 0.00 0.00 175.76 173.67 1yju s HIS 45 N 1.33 2.49 -0.23 0.00 2.46 0.20 -0.58 115.29 120.95 1yju s HIS 45 Ca 0.05 0.53 -0.03 0.00 0.47 0.00 0.00 55.06 56.08 1yju s HIS 45 Cb -0.25 -4.43 -0.00 0.00 -0.13 0.00 0.00 32.58 27.78 1yju s HIS 45 CO -0.01 -1.74 -0.05 0.42 -2.47 0.00 0.00 174.74 170.89 1yju s ILE 46 N 5.35 3.25 -0.28 0.89 1.01 -0.15 -0.68 121.20 130.58 1yju s ILE 46 Ca 0.50 -0.61 -0.15 0.00 0.00 0.00 0.00 60.65 60.39 1yju s ILE 46 Cb -0.10 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.83 1yju s ILE 46 CO 0.28 0.37 0.36 -0.54 0.00 0.00 0.00 174.94 175.41 1yju s LYS 47 N 1.45 3.93 -0.27 2.79 1.02 0.26 -0.40 119.74 128.53 1yju s LYS 47 Ca 0.05 -0.05 -0.13 0.00 0.02 0.00 0.00 55.97 55.85 1yju s LYS 47 Cb -0.15 -3.68 0.09 0.00 -0.52 0.00 0.00 37.83 33.57 1yju s LYS 47 CO -0.04 -0.32 0.63 1.52 -0.92 0.00 0.00 175.35 176.23 1yju s TYR 48 N 2.06 -1.06 0.07 3.18 -0.85 0.03 -0.12 117.35 120.65 1yju s TYR 48 Ca 0.14 2.05 -0.31 0.00 -0.52 0.00 0.00 57.07 58.43 1yju s TYR 48 Cb -0.16 0.61 -0.07 0.00 0.38 0.00 0.00 41.96 42.73 1yju s TYR 48 CO 0.10 -0.53 1.38 -0.51 -1.52 0.00 0.00 175.55 174.47 1yju s ASP 49 N 1.92 6.86 0.07 -0.18 1.11 -1.24 -4.28 116.67 120.92 1yju s ASP 49 Ca -0.09 2.22 -0.24 0.00 0.18 0.00 0.00 52.55 54.62 1yju s ASP 49 Cb -0.07 -2.58 -0.16 0.00 1.07 0.00 0.00 42.92 41.18 1yju s ASP 49 CO -0.19 -0.66 1.64 1.55 1.18 0.00 0.00 175.17 178.69 1yju h PRO 50 N 7.22 -0.06 -0.05 8.23 0.13 -1.92 -3.23 132.00 142.32 1yju h PRO 50 Ca -0.41 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.74 1yju h PRO 50 Cb 1.20 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1yju h PRO 50 CO 0.87 0.05 0.15 1.05 -0.23 0.00 0.00 178.00 179.90 1yju h GLU 51 N -0.16 0.00 -0.02 0.86 4.11 -1.98 0.50 114.58 117.89 1yju h GLU 51 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1yju h GLU 51 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1yju h GLU 51 CO 0.01 0.00 -0.14 0.44 0.07 0.00 0.00 179.01 179.39 1yju n ILE 52 N -3.27 0.00 0.00 -1.06 -5.35 -1.22 -4.78 119.36 103.68 1yju n ILE 52 Ca -0.01 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 1yju n ILE 52 Cb 0.23 0.87 0.00 0.00 -1.74 0.00 0.00 39.64 39.00 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 0.27 0.00 0.00 7.28 3.06 0.04 -4.78 119.36 125.23 1yju n ILE 53 Ca 0.15 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.40 1yju n ILE 53 Cb 0.44 -0.10 0.00 0.00 0.54 0.00 0.00 39.64 40.51 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 -0.72 -1.93 0.13 4.50 0.00 0.15 -4.47 105.19 102.86 1yju n GLY 54 Ca 0.00 -1.36 -0.08 0.00 0.00 0.00 0.00 46.02 44.58 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 0.00 0.31 -0.85 1.61 0.13 -1.96 -3.17 132.00 128.07 1yju h PRO 55 Ca 0.00 -0.02 0.21 0.00 -0.87 0.00 0.00 66.00 65.32 1yju h PRO 55 Cb 0.00 -0.07 -0.12 0.00 0.13 0.00 0.00 31.00 30.94 1yju h PRO 55 CO 0.00 0.21 0.30 -0.09 -0.23 0.00 0.00 178.00 178.19 1yju h ARG 56 N 0.32 0.32 0.38 0.86 9.65 -1.99 0.08 114.38 124.01 1yju h ARG 56 Ca 0.11 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.96 1yju h ARG 56 Cb 0.01 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 1yju h ARG 56 CO -0.06 0.21 -0.18 0.22 2.80 0.00 0.00 179.97 182.95 1yju h ASP 57 N 0.33 -0.43 0.18 -3.80 3.58 -1.77 0.21 116.42 114.72 1yju h ASP 57 Ca 0.52 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.96 1yju h ASP 57 Cb 0.97 0.11 -0.01 0.00 1.72 0.00 0.00 39.33 42.12 1yju h ASP 57 CO -0.55 -0.27 -0.16 0.40 -2.88 0.00 0.00 179.24 175.78 1yju h ILE 58 N -0.55 0.65 -0.36 2.25 2.04 -1.36 0.15 117.51 120.33 1yju h ILE 58 Ca -0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.84 1yju h ILE 58 Cb 0.42 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1yju h ILE 58 CO 0.09 0.00 0.15 0.40 0.00 0.00 0.00 178.15 178.78 1yju h ILE 59 N -0.36 0.93 -0.83 -0.67 2.04 -0.98 0.62 117.51 118.28 1yju h ILE 59 Ca -0.00 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.77 1yju h ILE 59 Cb 0.33 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 1yju h ILE 59 CO -0.03 0.06 0.54 -0.74 0.00 0.00 0.00 178.15 177.98 1yju h HIS 60 N 0.31 1.01 -0.35 1.37 2.76 -0.28 0.91 115.15 120.89 1yju h HIS 60 Ca 0.16 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.33 1yju h HIS 60 Cb 0.11 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 28.71 1yju h HIS 60 CO -0.12 0.60 0.15 1.15 -1.30 0.00 0.00 177.93 178.40 1yju h THR 61 N 1.06 1.18 -0.01 6.26 2.02 0.21 0.16 112.91 123.79 1yju h THR 61 Ca 0.32 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1yju h THR 61 Cb -0.03 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1yju h THR 61 CO -0.10 0.19 0.00 0.40 0.37 0.00 0.00 175.52 176.39 1yju h ILE 62 N 0.42 1.01 -0.04 3.11 2.04 -0.14 0.11 117.51 124.02 1yju h ILE 62 Ca 0.12 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.96 1yju h ILE 62 Cb 0.17 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 1yju h ILE 62 CO -0.01 0.01 -0.51 -0.33 0.00 0.00 0.00 178.15 177.31 1yju h GLU 63 N -0.01 -0.60 -0.45 2.37 5.08 -0.61 0.66 114.58 121.02 1yju h GLU 63 Ca 0.00 0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 1yju h GLU 63 Cb 0.01 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.33 1yju h GLU 63 CO -0.00 -0.40 0.01 1.03 -1.00 0.00 0.00 179.01 178.65 1yju h SER 64 N -0.63 -0.16 0.49 1.42 0.87 -0.32 -1.88 113.55 113.34 1yju h SER 64 Ca 0.03 0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 1yju h SER 64 Cb 0.70 0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1yju h SER 64 CO -0.37 -0.04 -0.27 -0.07 -0.53 0.00 0.00 176.83 175.54 1yju h LEU 65 N 0.13 -0.67 0.00 2.23 3.38 -0.68 -3.46 115.31 116.24 1yju h LEU 65 Ca 0.22 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1yju h LEU 65 Cb 0.32 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1yju h LEU 65 CO -0.36 -0.44 0.00 0.61 0.09 0.00 0.00 178.44 178.34 1yju n GLY 66 N -1.41 0.31 3.18 0.83 0.00 -0.50 -5.11 105.19 102.49 1yju n GLY 66 Ca -0.12 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.02 2.14 0.09 1.61 0.08 0.11 -4.89 117.98 116.09 1yju s PHE 67 Ca 0.00 -0.75 -0.30 0.00 0.12 0.00 0.00 56.93 56.00 1yju s PHE 67 Cb 0.00 -1.44 -0.05 0.00 -0.57 0.00 0.00 43.02 40.96 1yju s PHE 67 CO 0.00 -0.29 1.02 -1.21 -0.10 0.00 0.00 175.22 174.65 1yju s GLU 68 N 0.20 4.61 -0.04 0.44 8.01 -1.09 -2.65 118.70 128.19 1yju s GLU 68 Ca -0.11 1.53 -0.08 0.00 0.01 0.00 0.00 54.97 56.32 1yju s GLU 68 Cb -0.15 -3.38 0.01 0.00 -4.31 0.00 0.00 34.13 26.31 1yju s GLU 68 CO 0.05 0.06 0.19 0.00 0.01 0.00 0.00 175.26 175.57 1yju s ALA 69 N 0.34 -0.46 -0.18 5.21 0.00 -1.26 -0.61 121.76 124.79 1yju s ALA 69 Ca 0.50 0.25 -0.03 0.00 0.00 0.00 0.00 51.96 52.68 1yju s ALA 69 Cb -0.25 -0.10 0.06 0.00 0.00 0.00 0.00 23.12 22.83 1yju s ALA 69 CO 0.30 -0.16 0.05 0.45 0.00 0.00 0.00 175.76 176.40 1yju s SER 70 N -0.69 2.69 -0.39 0.00 0.15 0.37 -4.96 113.70 110.88 1yju s SER 70 Ca -0.08 -0.72 -0.42 0.00 0.70 0.00 0.00 55.95 55.43 1yju s SER 70 Cb -0.04 -0.50 -0.17 0.00 -1.71 0.00 0.00 66.02 63.60 1yju s SER 70 CO 0.01 -0.31 1.86 0.00 1.20 0.00 0.00 173.24 176.00 1yju n LEU 71 N 5.11 1.75 -4.76 3.45 -0.00 -1.26 -0.37 117.00 120.92 1yju n LEU 71 Ca -0.08 0.93 -0.35 0.00 -0.00 0.00 0.00 56.01 56.51 1yju n LEU 71 Cb 0.48 -1.05 0.04 0.00 -0.00 0.00 0.00 43.42 42.89 1yju n LEU 71 CO 0.12 -0.64 0.79 0.68 -0.00 0.00 0.00 177.39 178.34 1yju s VAL 72 N 4.48 2.85 -0.94 1.47 -7.23 0.49 -4.87 120.40 116.65 1yju s VAL 72 Ca 1.06 0.47 -0.10 0.00 -1.81 0.00 0.00 61.98 61.60 1yju s VAL 72 Cb -1.23 -3.09 0.24 0.00 0.56 0.00 0.00 36.38 32.86 1yju s VAL 72 CO 0.67 -0.17 0.88 -0.54 -0.31 0.00 0.00 175.10 175.64 1yju s LYS 73 N -3.63 3.73 -0.04 4.82 3.01 -1.26 -4.76 119.74 121.61 1yju s LYS 73 Ca 0.73 -2.88 -0.23 0.00 -1.01 0.00 0.00 55.97 52.58 1yju s LYS 73 Cb -0.26 -4.37 -0.23 0.00 -1.01 0.00 0.00 37.83 31.96 1yju s LYS 73 CO 0.36 -1.26 1.05 -0.84 0.51 0.00 0.00 175.35 175.17 1yju h ILE 74 N 4.28 1.52 0.00 2.17 3.07 -1.96 -3.55 117.51 123.04 1yju h ILE 74 Ca 0.13 -1.97 0.00 0.00 1.55 0.00 0.00 64.86 64.57 1yju h ILE 74 Cb 0.94 2.72 0.00 0.00 -0.27 0.00 0.00 36.82 40.21 1yju h ILE 74 CO 0.87 0.55 0.00 -0.62 -1.05 0.00 0.00 178.15 177.90