#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 1.19 0.00 3.17 0.00 0.12 -4.75 105.19 104.92 1yju n GLY 2 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1yju n GLY 2 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yju n ASP 3 N 2.61 0.49 0.00 1.61 5.75 -1.26 -4.91 116.55 120.84 1yju n ASP 3 Ca 0.00 -0.88 0.00 0.00 -0.01 0.00 0.00 54.79 53.90 1yju n ASP 3 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1yju n ASP 3 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yju n GLY 4 N 5.00 3.04 3.05 6.12 0.00 -1.03 -4.79 105.19 116.58 1yju n GLY 4 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1yju n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yju s VAL 5 N -1.28 -0.85 -0.48 1.61 0.11 -1.26 -4.26 120.40 113.99 1yju s VAL 5 Ca 0.00 -0.13 -0.12 0.00 -2.93 0.00 0.00 61.98 58.81 1yju s VAL 5 Cb 0.00 -1.00 0.11 0.00 -1.53 0.00 0.00 36.38 33.96 1yju s VAL 5 CO 0.00 -0.12 0.38 -0.22 -3.33 0.00 0.00 175.10 171.81 1yju s LEU 6 N 2.71 5.73 -0.46 2.54 1.98 0.46 -4.15 118.68 127.49 1yju s LEU 6 Ca 0.10 -1.74 -0.17 0.00 -2.89 0.00 0.00 54.13 49.43 1yju s LEU 6 Cb -0.11 -2.08 0.05 0.00 0.66 0.00 0.00 46.19 44.71 1yju s LEU 6 CO -0.28 -0.71 0.46 -1.61 -1.89 0.00 0.00 176.35 172.32 1yju s GLU 7 N 1.47 3.05 0.03 1.98 2.02 -1.25 -0.76 118.70 125.23 1yju s GLU 7 Ca 0.04 -1.02 -0.01 0.00 0.02 0.00 0.00 54.97 54.00 1yju s GLU 7 Cb -0.26 -4.06 -0.04 0.00 0.10 0.00 0.00 34.13 29.86 1yju s GLU 7 CO 0.02 -1.00 0.20 -0.48 0.02 0.00 0.00 175.26 174.01 1yju s LEU 8 N 2.05 4.36 0.36 1.80 0.05 -0.36 -0.87 118.68 126.08 1yju s LEU 8 Ca 0.09 0.31 -0.25 0.00 0.05 0.00 0.00 54.13 54.34 1yju s LEU 8 Cb -0.20 -2.81 -0.10 0.00 -2.05 0.00 0.00 46.19 41.03 1yju s LEU 8 CO 0.10 0.21 0.96 0.54 -0.55 0.00 0.00 176.35 177.62 1yju s VAL 9 N -1.43 4.16 -0.01 1.48 0.11 0.10 -0.43 120.40 124.39 1yju s VAL 9 Ca 0.32 1.67 0.01 0.00 -2.93 0.00 0.00 61.98 61.05 1yju s VAL 9 Cb -0.13 -3.87 -0.00 0.00 -1.53 0.00 0.00 36.38 30.85 1yju s VAL 9 CO 0.24 0.03 -0.04 0.54 -3.33 0.00 0.00 175.10 172.54 1yju s VAL 10 N -1.73 0.30 0.08 2.04 0.11 0.36 -0.87 120.40 120.69 1yju s VAL 10 Ca 0.54 -0.15 0.03 0.00 -2.93 0.00 0.00 61.98 59.47 1yju s VAL 10 Cb -0.17 -0.26 -0.03 0.00 -1.53 0.00 0.00 36.38 34.38 1yju s VAL 10 CO 0.22 0.09 -0.10 0.00 -3.33 0.00 0.00 175.10 171.99 1yju s ARG 11 N -0.01 0.77 0.00 1.54 1.70 0.02 -4.67 118.95 118.30 1yju s ARG 11 Ca 0.01 -1.04 0.00 0.00 -0.47 0.00 0.00 55.73 54.22 1yju s ARG 11 Cb -0.02 -0.50 0.00 0.00 -0.57 0.00 0.00 34.95 33.86 1yju s ARG 11 CO -0.00 0.08 0.00 0.41 -1.08 0.00 0.00 175.30 174.71 1yju n GLY 12 N 0.84 2.81 3.76 3.88 0.00 -1.26 -1.95 105.19 113.27 1yju n GLY 12 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.49 3.04 0.00 1.61 -1.94 -1.26 -4.96 119.30 115.29 1yju s MET 13 Ca 0.00 1.73 0.00 0.00 -1.71 0.00 0.00 55.69 55.71 1yju s MET 13 Cb 0.00 -1.95 0.00 0.00 2.01 0.00 0.00 34.83 34.89 1yju s MET 13 CO 0.00 -1.13 0.26 -2.37 -0.01 0.00 0.00 175.02 171.77 1yju n THR 14 N -1.61 0.00 -3.59 2.05 5.66 -1.26 -5.10 114.28 110.42 1yju n THR 14 Ca 0.13 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.05 1yju n THR 14 Cb 0.50 0.41 -0.04 0.00 -1.55 0.00 0.00 70.33 69.65 1yju n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yju h ALA 16 N 2.34 3.28 0.09 0.00 0.00 -1.99 -1.04 119.26 121.95 1yju h ALA 16 Ca -0.15 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1yju h ALA 16 Cb 1.17 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1yju h ALA 16 CO 0.28 -1.80 -0.13 0.66 0.00 0.00 0.00 179.25 178.26 1yju h SER 17 N 0.04 -0.37 -0.83 0.00 4.64 -1.98 0.12 113.55 115.17 1yju h SER 17 Ca 0.79 0.03 0.16 0.00 -0.47 0.00 0.00 61.79 62.30 1yju h SER 17 Cb 2.93 0.13 -0.15 0.00 -0.31 0.00 0.00 62.40 65.00 1yju h SER 17 CO -0.13 -0.16 -0.25 0.00 -0.87 0.00 0.00 176.83 175.42 1yju h VAL 19 N -0.02 0.00 0.00 0.00 2.07 -1.39 -1.08 116.25 115.83 1yju h VAL 19 Ca 0.38 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.84 1yju h VAL 19 Cb 0.61 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1yju h VAL 19 CO -0.86 0.00 -0.26 1.12 0.02 0.00 0.00 177.57 177.59 1yju h HIS 20 N -0.27 0.00 0.17 1.57 2.07 0.21 -1.47 115.15 117.44 1yju h HIS 20 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.52 1yju h HIS 20 Cb 0.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.26 1yju h HIS 20 CO -0.42 0.26 -0.08 -0.22 -3.07 0.00 0.00 177.93 174.40 1yju h LYS 21 N 0.00 -0.23 0.08 5.12 3.64 -0.56 0.71 116.57 125.34 1yju h LYS 21 Ca -0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1yju h LYS 21 Cb 0.49 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 1yju h LYS 21 CO 0.03 0.05 -0.23 0.82 -2.27 0.00 0.00 179.45 177.85 1yju h ILE 22 N -0.49 0.00 -0.48 2.00 2.04 -0.86 -1.89 117.51 117.83 1yju h ILE 22 Ca -0.02 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 1yju h ILE 22 Cb 0.37 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1yju h ILE 22 CO 0.04 0.00 -0.02 1.05 0.00 0.00 0.00 178.15 179.22 1yju h GLU 23 N -0.35 0.86 -0.45 2.37 4.11 -1.12 0.14 114.58 120.14 1yju h GLU 23 Ca -0.01 -0.28 0.01 0.00 0.07 0.00 0.00 59.36 59.15 1yju h GLU 23 Cb 0.34 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1yju h GLU 23 CO -0.11 0.91 0.29 1.03 0.07 0.00 0.00 179.01 181.20 1yju h SER 24 N 0.71 0.48 -0.06 3.06 0.87 -0.96 -1.98 113.55 115.67 1yju h SER 24 Ca 0.13 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1yju h SER 24 Cb 0.54 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.38 1yju h SER 24 CO 0.03 0.35 0.02 -1.28 -0.53 0.00 0.00 176.83 175.41 1yju h SER 25 N 0.58 0.01 -0.61 6.23 0.87 -0.28 -2.79 113.55 117.56 1yju h SER 25 Ca 0.17 0.01 0.08 0.00 -1.23 0.00 0.00 61.79 60.82 1yju h SER 25 Cb -0.04 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 61.87 1yju h SER 25 CO -0.05 0.02 0.27 -0.07 -0.53 0.00 0.00 176.83 176.47 1yju h LEU 26 N 0.04 0.33 0.00 2.23 4.07 -0.54 -0.02 115.31 121.43 1yju h LEU 26 Ca 0.02 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1yju h LEU 26 Cb 0.01 0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1yju h LEU 26 CO -0.03 0.21 0.00 0.35 -1.08 0.00 0.00 178.44 177.89 1yju n THR 27 N -4.92 1.30 0.12 0.22 -2.24 -0.77 -0.57 114.28 107.41 1yju n THR 27 Ca 0.08 0.32 0.01 0.00 -2.27 0.00 0.00 64.05 62.19 1yju n THR 27 Cb 0.23 -1.29 0.32 0.00 -2.10 0.00 0.00 70.33 67.49 1yju n THR 27 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1yju h LYS 28 N 0.00 0.21 -6.34 -0.78 1.79 -0.98 -3.44 116.57 107.03 1yju h LYS 28 Ca 0.00 -0.07 -0.54 0.00 -2.18 0.00 0.00 60.65 57.86 1yju h LYS 28 Cb 0.03 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1yju h LYS 28 CO 0.00 0.47 1.10 -1.01 -1.08 0.00 0.00 179.45 178.93 1yju s HIS 29 N -4.42 1.95 -0.00 -1.35 3.76 0.26 -4.86 115.29 110.63 1yju s HIS 29 Ca -0.05 0.08 -0.04 0.00 -0.15 0.00 0.00 55.06 54.90 1yju s HIS 29 Cb 0.14 -4.01 -0.16 0.00 1.11 0.00 0.00 32.58 29.67 1yju s HIS 29 CO 0.75 -4.26 2.98 -2.13 -0.85 0.00 0.00 174.74 171.23 1yju n ARG 30 N 6.77 1.61 -0.40 1.40 0.63 -1.26 -1.99 116.66 123.41 1yju n ARG 30 Ca 0.17 -0.61 -0.00 0.00 -0.92 0.00 0.00 57.85 56.49 1yju n ARG 30 Cb 0.42 -1.61 -0.00 0.00 0.45 0.00 0.00 32.46 31.72 1yju n ARG 30 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1yju n GLY 31 N 2.10 0.75 3.87 5.14 0.00 -1.26 -5.05 105.19 110.73 1yju n GLY 31 Ca 0.26 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 1yju n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yju s ILE 32 N 0.00 5.34 -0.13 -0.61 1.01 -0.84 -2.27 121.20 123.71 1yju s ILE 32 Ca 0.00 0.42 0.05 0.00 0.00 0.00 0.00 60.65 61.11 1yju s ILE 32 Cb 0.00 -3.51 -0.11 0.00 0.01 0.00 0.00 42.46 38.85 1yju s ILE 32 CO 0.00 0.60 -0.06 0.18 0.00 0.00 0.00 174.94 175.66 1yju n LEU 33 N 1.89 1.76 -3.58 2.97 4.77 0.86 -4.96 117.00 120.71 1yju n LEU 33 Ca -0.18 -0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 55.64 1yju n LEU 33 Cb 0.54 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1yju n LEU 33 CO 0.34 0.54 0.23 -0.47 -1.33 0.00 0.00 177.39 176.70 1yju s TYR 34 N -2.27 -0.32 -0.21 -1.77 5.04 -0.15 -4.93 117.35 112.73 1yju s TYR 34 Ca -0.13 0.13 -0.20 0.00 -2.44 0.00 0.00 57.07 54.43 1yju s TYR 34 Cb 0.04 0.33 0.06 0.00 0.35 0.00 0.00 41.96 42.74 1yju s TYR 34 CO 0.37 -0.71 0.57 0.00 -1.34 0.00 0.00 175.55 174.45 1yju s SER 36 N 0.25 -0.74 -1.29 0.00 0.01 -1.21 -5.02 113.70 105.70 1yju s SER 36 Ca -0.00 -0.97 -0.14 0.00 1.31 0.00 0.00 55.95 56.14 1yju s SER 36 Cb -0.04 1.56 0.12 0.00 0.21 0.00 0.00 66.02 67.87 1yju s SER 36 CO 0.01 -0.20 1.75 0.52 0.41 0.00 0.00 173.24 175.72 1yju n VAL 37 N 4.41 4.07 -2.50 3.43 0.31 -1.26 -3.85 118.33 122.94 1yju n VAL 37 Ca 0.11 -4.21 -0.40 0.00 -0.01 0.00 0.00 64.34 59.83 1yju n VAL 37 Cb 0.53 -2.43 -0.03 0.00 -0.91 0.00 0.00 33.84 31.00 1yju n VAL 37 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yju s ALA 38 N 2.27 2.62 0.41 3.52 0.00 -0.14 -4.81 121.76 125.63 1yju s ALA 38 Ca 0.46 -1.89 0.25 0.00 0.00 0.00 0.00 51.96 50.78 1yju s ALA 38 Cb 0.05 -4.45 1.33 0.00 0.00 0.00 0.00 23.12 20.05 1yju s ALA 38 CO 0.01 -3.63 1.64 1.25 0.00 0.00 0.00 175.76 175.03 1yju h LEU 39 N 13.38 0.32 -1.71 0.00 6.46 -1.92 0.13 115.31 131.97 1yju h LEU 39 Ca 0.04 0.16 0.21 0.00 -0.12 0.00 0.00 57.88 58.16 1yju h LEU 39 Cb 1.03 0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 41.04 1yju h LEU 39 CO 1.36 -0.18 0.58 0.00 -0.62 0.00 0.00 178.44 179.58 1yju h ALA 40 N 1.69 2.41 -0.14 1.25 0.00 -1.94 0.10 119.26 122.64 1yju h ALA 40 Ca 0.79 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.70 1yju h ALA 40 Cb 2.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.07 1yju h ALA 40 CO -0.48 -0.67 0.00 -2.37 0.00 0.00 0.00 179.25 175.73 1yju n THR 41 N -4.42 1.24 -4.07 0.00 5.66 0.32 -4.99 114.28 108.01 1yju n THR 41 Ca 0.18 -1.25 -0.33 0.00 -3.05 0.00 0.00 64.05 59.60 1yju n THR 41 Cb 0.75 0.33 -0.06 0.00 -1.55 0.00 0.00 70.33 69.80 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 -0.28 -1.74 -4.26 1.09 4.13 0.36 -4.91 115.26 109.64 1yju n ASN 42 Ca 0.08 -0.85 -0.19 0.00 1.68 0.00 0.00 54.58 55.31 1yju n ASN 42 Cb 0.42 -1.54 -0.11 0.00 -1.54 0.00 0.00 39.78 37.01 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 -6.73 1.08 -0.18 3.52 2.36 -1.04 -0.49 119.74 118.27 1yju s LYS 43 Ca 0.65 -1.28 -0.02 0.00 -2.55 0.00 0.00 55.97 52.76 1yju s LYS 43 Cb -0.38 -1.00 0.05 0.00 -1.05 0.00 0.00 37.83 35.46 1yju s LYS 43 CO 0.79 0.19 0.01 0.00 1.55 0.00 0.00 175.35 177.89 1yju s ALA 44 N -2.15 1.16 -0.71 3.13 0.00 0.43 -0.97 121.76 122.66 1yju s ALA 44 Ca 0.11 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.14 1yju s ALA 44 Cb -0.05 -1.15 0.11 0.00 0.00 0.00 0.00 23.12 22.03 1yju s ALA 44 CO 0.04 -1.02 0.88 -1.58 0.00 0.00 0.00 175.76 174.07 1yju s HIS 45 N 1.78 2.99 -0.05 0.00 5.04 -1.25 -1.22 115.29 122.58 1yju s HIS 45 Ca -0.01 -1.03 -0.16 0.00 -1.54 0.00 0.00 55.06 52.33 1yju s HIS 45 Cb -0.16 -4.14 -0.05 0.00 0.04 0.00 0.00 32.58 28.26 1yju s HIS 45 CO -0.07 -1.42 0.43 0.42 -2.34 0.00 0.00 174.74 171.76 1yju s ILE 46 N 2.88 5.09 -0.18 0.89 1.09 0.06 -3.35 121.20 127.68 1yju s ILE 46 Ca 0.20 0.88 -0.05 0.00 -1.10 0.00 0.00 60.65 60.58 1yju s ILE 46 Cb -0.17 -3.75 -0.03 0.00 -1.06 0.00 0.00 42.46 37.45 1yju s ILE 46 CO 0.03 0.47 -0.01 -0.54 -0.10 0.00 0.00 174.94 174.78 1yju s LYS 47 N -0.32 3.69 0.16 2.79 1.02 0.13 -0.40 119.74 126.81 1yju s LYS 47 Ca 0.24 -0.50 -0.25 0.00 0.02 0.00 0.00 55.97 55.49 1yju s LYS 47 Cb -0.16 -3.02 0.06 0.00 -0.52 0.00 0.00 37.83 34.19 1yju s LYS 47 CO 0.12 0.16 0.90 1.52 -0.92 0.00 0.00 175.35 177.12 1yju s TYR 48 N 0.61 -0.18 -0.28 3.18 1.13 -1.26 -0.10 117.35 120.45 1yju s TYR 48 Ca -0.01 -0.13 -0.18 0.00 -1.41 0.00 0.00 57.07 55.34 1yju s TYR 48 Cb -0.14 0.64 -0.02 0.00 -1.10 0.00 0.00 41.96 41.34 1yju s TYR 48 CO 0.02 -0.86 0.53 0.34 -2.51 0.00 0.00 175.55 173.07 1yju s ASP 49 N -2.88 6.43 0.44 -0.18 2.15 -0.96 -2.45 116.67 119.22 1yju s ASP 49 Ca 0.11 0.45 0.10 0.00 0.43 0.00 0.00 52.55 53.64 1yju s ASP 49 Cb -0.02 -2.29 0.98 0.00 -0.30 0.00 0.00 42.92 41.29 1yju s ASP 49 CO 0.01 -0.34 2.07 1.55 -0.17 0.00 0.00 175.17 178.29 1yju h PRO 50 N 8.09 0.33 -2.00 4.34 0.13 -1.94 -3.31 132.00 137.65 1yju h PRO 50 Ca -0.28 -0.03 -0.33 0.00 -0.87 0.00 0.00 66.00 64.49 1yju h PRO 50 Cb 1.13 -0.07 -0.12 0.00 0.13 0.00 0.00 31.00 32.08 1yju h PRO 50 CO 0.74 0.25 -0.03 0.39 -0.23 0.00 0.00 178.00 179.11 1yju n GLU 51 N -4.47 2.17 0.00 0.86 -0.58 -1.26 -0.23 120.64 117.14 1yju n GLU 51 Ca 0.01 -1.60 0.00 0.00 -0.42 0.00 0.00 57.16 55.14 1yju n GLU 51 Cb 0.10 -2.06 0.00 0.00 -0.57 0.00 0.00 31.44 28.91 1yju n GLU 51 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 1yju n ILE 52 N 1.75 0.00 -0.12 -3.67 0.00 -1.26 -5.00 119.36 111.06 1yju n ILE 52 Ca 0.45 0.00 -0.21 0.00 0.00 0.00 0.00 62.75 62.99 1yju n ILE 52 Cb 0.75 0.00 -0.08 0.00 0.00 0.00 0.00 39.64 40.31 1yju n ILE 52 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1yju n ILE 53 N -1.93 1.51 -1.09 9.51 5.41 -1.02 -5.07 119.36 126.69 1yju n ILE 53 Ca 0.00 -0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1yju n ILE 53 Cb 0.00 -2.07 0.00 0.00 -0.71 0.00 0.00 39.64 36.86 1yju n ILE 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1yju n GLY 54 N 1.35 -3.89 0.36 7.39 0.00 0.68 -3.81 105.19 107.27 1yju n GLY 54 Ca -0.38 -0.92 0.11 0.00 0.00 0.00 0.00 46.02 44.83 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 0.61 0.80 -0.90 1.61 0.13 -1.95 -1.19 132.00 131.10 1yju h PRO 55 Ca 0.00 -0.05 0.20 0.00 -0.87 0.00 0.00 66.00 65.29 1yju h PRO 55 Cb 0.34 -0.18 -0.17 0.00 0.13 0.00 0.00 31.00 31.12 1yju h PRO 55 CO 0.00 0.53 -0.14 0.54 -0.23 0.00 0.00 178.00 178.70 1yju n ARG 56 N -4.70 -0.08 0.01 0.86 1.74 -1.26 -0.67 116.66 112.56 1yju n ARG 56 Ca 0.21 1.38 -0.13 0.00 -0.77 0.00 0.00 57.85 58.55 1yju n ARG 56 Cb 0.50 -2.11 -0.09 0.00 -1.02 0.00 0.00 32.46 29.74 1yju n ARG 56 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1yju h ASP 57 N 0.00 -0.02 0.03 0.55 3.58 -1.31 0.11 116.42 119.36 1yju h ASP 57 Ca 0.47 -0.37 0.02 0.00 0.42 0.00 0.00 57.03 57.57 1yju h ASP 57 Cb 0.82 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.85 1yju h ASP 57 CO -0.90 0.36 -0.17 0.40 -2.88 0.00 0.00 179.24 176.06 1yju h ILE 58 N -0.40 0.60 -0.36 2.25 2.04 -1.46 0.27 117.51 120.45 1yju h ILE 58 Ca -0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.93 1yju h ILE 58 Cb 0.38 0.60 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 1yju h ILE 58 CO 0.00 0.00 -0.14 0.40 0.00 0.00 0.00 178.15 178.42 1yju h ILE 59 N -0.29 0.55 -0.46 -0.67 5.03 -0.81 0.23 117.51 121.09 1yju h ILE 59 Ca 0.04 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.85 1yju h ILE 59 Cb 0.34 0.55 -0.05 0.00 -3.03 0.00 0.00 36.82 34.62 1yju h ILE 59 CO -0.14 0.00 0.15 -0.74 -0.68 0.00 0.00 178.15 176.74 1yju h HIS 60 N -0.06 0.26 -0.16 1.37 2.76 -0.21 0.64 115.15 119.74 1yju h HIS 60 Ca 0.18 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 1yju h HIS 60 Cb 0.34 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 1yju h HIS 60 CO -0.37 0.08 0.11 1.15 -1.30 0.00 0.00 177.93 177.60 1yju h THR 61 N 0.31 1.04 -0.08 6.26 2.02 -0.13 0.17 112.91 122.51 1yju h THR 61 Ca 0.22 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 67.35 1yju h THR 61 Cb 0.24 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1yju h THR 61 CO -0.24 0.04 -0.13 0.40 0.37 0.00 0.00 175.52 175.96 1yju h ILE 62 N 0.22 0.65 0.40 3.11 2.04 0.08 0.20 117.51 124.22 1yju h ILE 62 Ca 0.06 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 1yju h ILE 62 Cb -0.02 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1yju h ILE 62 CO -0.01 0.00 -0.29 -0.33 0.00 0.00 0.00 178.15 177.52 1yju h GLU 63 N -0.18 -0.65 -0.65 2.37 5.08 -0.85 0.22 114.58 119.93 1yju h GLU 63 Ca 0.07 0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1yju h GLU 63 Cb 0.28 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 1yju h GLU 63 CO -0.19 -0.43 0.43 1.03 -1.00 0.00 0.00 179.01 178.85 1yju h SER 64 N -0.68 0.51 0.43 1.42 0.87 -0.34 -1.98 113.55 113.79 1yju h SER 64 Ca -0.04 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 1yju h SER 64 Cb 0.58 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1yju h SER 64 CO 0.01 0.32 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.36 1yju h LEU 65 N 0.58 -0.49 0.00 2.23 4.07 -0.44 -3.48 115.31 117.79 1yju h LEU 65 Ca 0.29 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.17 1yju h LEU 65 Cb 0.38 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.24 1yju h LEU 65 CO -0.09 -0.06 0.00 0.61 -1.08 0.00 0.00 178.44 177.82 1yju n GLY 66 N 0.04 0.21 3.41 0.83 0.00 -0.15 -5.10 105.19 104.41 1yju n GLY 66 Ca -0.09 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.11 2.50 0.44 1.61 0.08 -0.12 -4.89 117.98 116.49 1yju s PHE 67 Ca 0.00 -0.30 -0.20 0.00 0.12 0.00 0.00 56.93 56.54 1yju s PHE 67 Cb 0.00 -1.50 -0.11 0.00 -0.57 0.00 0.00 43.02 40.85 1yju s PHE 67 CO 0.00 0.15 0.96 -1.21 -0.10 0.00 0.00 175.22 175.02 1yju s GLU 68 N -1.06 4.18 0.17 0.44 2.02 -0.82 -3.25 118.70 120.38 1yju s GLU 68 Ca 0.12 1.11 -0.12 0.00 0.02 0.00 0.00 54.97 56.11 1yju s GLU 68 Cb -0.10 -2.17 0.01 0.00 0.10 0.00 0.00 34.13 31.96 1yju s GLU 68 CO 0.02 -0.07 0.36 0.00 0.02 0.00 0.00 175.26 175.59 1yju s ALA 69 N -2.22 -0.35 -0.25 5.21 0.00 -1.26 -0.80 121.76 122.08 1yju s ALA 69 Ca 0.62 -0.63 -0.16 0.00 0.00 0.00 0.00 51.96 51.79 1yju s ALA 69 Cb -0.09 0.83 0.07 0.00 0.00 0.00 0.00 23.12 23.93 1yju s ALA 69 CO 0.15 -0.69 0.64 -1.12 0.00 0.00 0.00 175.76 174.74 1yju s SER 70 N -2.93 -0.82 0.18 0.00 0.01 -0.04 -4.98 113.70 105.12 1yju s SER 70 Ca 0.13 1.37 -0.32 0.00 1.31 0.00 0.00 55.95 58.45 1yju s SER 70 Cb 0.02 1.27 -0.11 0.00 0.21 0.00 0.00 66.02 67.41 1yju s SER 70 CO -0.02 -0.23 1.74 -0.76 0.41 0.00 0.00 173.24 174.39 1yju s LEU 71 N 1.34 4.38 -0.12 2.44 1.43 -1.26 0.00 118.68 126.89 1yju s LEU 71 Ca -0.08 2.82 0.15 0.00 -1.03 0.00 0.00 54.13 55.99 1yju s LEU 71 Cb -0.05 -3.59 0.28 0.00 0.03 0.00 0.00 46.19 42.85 1yju s LEU 71 CO -0.15 -0.97 1.14 1.33 0.23 0.00 0.00 176.35 177.93 1yju n VAL 72 N 4.20 1.52 0.04 -1.59 0.24 -0.05 -4.84 118.33 117.85 1yju n VAL 72 Ca 0.16 -2.01 0.00 0.00 -2.04 0.00 0.00 64.34 60.45 1yju n VAL 72 Cb 0.36 -0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.69 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 -1.01 0.00 -2.72 7.34 4.81 -1.22 -5.02 118.16 120.34 1yju n LYS 73 Ca 0.13 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.55 1yju n LYS 73 Cb 0.69 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.74 1yju n LYS 73 CO 0.00 0.00 0.00 1.51 1.17 0.00 0.00 177.40 180.08 1yju n ILE 74 N -2.59 -0.26 0.08 3.15 0.13 -1.26 -5.01 119.36 113.59 1yju n ILE 74 Ca 0.00 -0.01 0.01 0.00 -1.10 0.00 0.00 62.75 61.65 1yju n ILE 74 Cb 0.00 -0.23 0.04 0.00 -0.84 0.00 0.00 39.64 38.61 1yju n ILE 74 CO 0.00 0.00 0.00 -1.84 2.80 0.00 0.00 176.55 177.51