#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 -0.52 3.53 -5.12 0.00 -1.26 -4.38 105.19 97.44 1yju n GLY 2 Ca 0.00 -0.98 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 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 6.32 0.35 1.61 -4.77 -1.26 -4.97 116.67 109.95 1yju s ASP 3 Ca 0.00 -0.99 -0.27 0.00 -3.30 0.00 0.00 52.55 47.99 1yju s ASP 3 Cb 0.00 -2.53 -0.12 0.00 -1.09 0.00 0.00 42.92 39.17 1yju s ASP 3 CO 0.00 -1.61 1.14 0.61 0.70 0.00 0.00 175.17 176.01 1yju n GLY 4 N 5.90 0.15 3.13 2.12 0.00 -1.26 -4.82 105.19 110.43 1yju n GLY 4 Ca 0.14 0.28 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 1yju n GLY 4 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yju s VAL 5 N -1.13 1.70 -0.13 1.61 -7.23 -1.26 -0.39 120.40 113.58 1yju s VAL 5 Ca 0.58 -0.80 -0.00 0.00 -1.81 0.00 0.00 61.98 59.96 1yju s VAL 5 Cb -0.60 -1.50 0.02 0.00 0.56 0.00 0.00 36.38 34.86 1yju s VAL 5 CO 0.60 0.48 -0.11 -0.76 -0.31 0.00 0.00 175.10 175.00 1yju s LEU 6 N 0.57 1.42 -0.42 1.32 2.01 0.39 -4.97 118.68 119.00 1yju s LEU 6 Ca -0.15 -0.38 -0.14 0.00 0.01 0.00 0.00 54.13 53.47 1yju s LEU 6 Cb -0.17 -0.99 0.05 0.00 0.01 0.00 0.00 46.19 45.09 1yju s LEU 6 CO 0.05 -0.09 0.30 -0.70 1.01 0.00 0.00 176.35 176.93 1yju s GLU 7 N 1.58 2.89 0.10 1.70 2.56 -1.26 -1.19 118.70 125.08 1yju s GLU 7 Ca 0.04 -1.19 0.09 0.00 0.00 0.00 0.00 54.97 53.91 1yju s GLU 7 Cb -0.13 -3.95 -0.04 0.00 2.00 0.00 0.00 34.13 32.02 1yju s GLU 7 CO -0.09 -0.85 -0.22 -0.48 -0.56 0.00 0.00 175.26 173.06 1yju s LEU 8 N 1.61 2.51 0.46 2.70 0.05 -0.20 -2.60 118.68 123.21 1yju s LEU 8 Ca 0.04 -0.60 -0.20 0.00 0.05 0.00 0.00 54.13 53.42 1yju s LEU 8 Cb -0.21 -1.41 -0.10 0.00 -2.05 0.00 0.00 46.19 42.41 1yju s LEU 8 CO 0.07 0.20 0.96 0.54 -0.55 0.00 0.00 176.35 177.58 1yju s VAL 9 N -1.04 4.39 -0.41 1.48 0.11 0.12 -0.19 120.40 124.85 1yju s VAL 9 Ca 0.15 1.40 0.02 0.00 -2.93 0.00 0.00 61.98 60.62 1yju s VAL 9 Cb -0.10 -3.62 0.15 0.00 -1.53 0.00 0.00 36.38 31.27 1yju s VAL 9 CO 0.07 -0.41 0.27 0.68 -3.33 0.00 0.00 175.10 172.38 1yju s VAL 10 N -2.29 0.73 -0.50 2.04 -7.23 0.43 -2.74 120.40 110.84 1yju s VAL 10 Ca 0.61 -2.36 -0.23 0.00 -1.81 0.00 0.00 61.98 58.19 1yju s VAL 10 Cb -0.10 -1.52 0.04 0.00 0.56 0.00 0.00 36.38 35.37 1yju s VAL 10 CO 0.18 -1.03 0.84 0.00 -0.31 0.00 0.00 175.10 174.79 1yju s ARG 11 N 0.44 3.34 0.00 4.82 1.70 0.28 -3.97 118.95 125.56 1yju s ARG 11 Ca 0.22 -0.27 0.00 0.00 -0.47 0.00 0.00 55.73 55.21 1yju s ARG 11 Cb -0.15 -4.01 0.00 0.00 -0.57 0.00 0.00 34.95 30.22 1yju s ARG 11 CO -0.06 -1.30 0.00 0.41 -1.08 0.00 0.00 175.30 173.27 1yju n GLY 12 N 5.07 0.16 3.51 3.88 0.00 -1.26 -1.43 105.19 115.12 1yju n GLY 12 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 -0.82 0.00 1.61 -1.94 -1.25 -4.89 119.30 112.01 1yju s MET 13 Ca 0.00 0.76 0.00 0.00 -1.71 0.00 0.00 55.69 54.74 1yju s MET 13 Cb 0.00 -1.57 0.00 0.00 2.01 0.00 0.00 34.83 35.27 1yju s MET 13 CO 0.00 -3.64 0.00 -2.37 -0.01 0.00 0.00 175.02 169.00 1yju n THR 14 N -4.85 0.00 -4.17 2.05 5.66 -1.26 -5.08 114.28 106.63 1yju n THR 14 Ca 0.03 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.93 1yju n THR 14 Cb 0.55 -0.01 -0.10 0.00 -1.55 0.00 0.00 70.33 69.21 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 2.85 2.19 -2.28 0.00 0.00 -2.02 -0.13 119.26 119.87 1yju h ALA 16 Ca -0.35 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1yju h ALA 16 Cb 1.19 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1yju h ALA 16 CO 0.61 -0.80 0.00 -1.13 0.00 0.00 0.00 179.25 177.93 1yju n SER 17 N -4.94 0.00 -0.32 0.00 3.41 -1.26 -0.48 113.62 110.03 1yju n SER 17 Ca 0.33 0.62 0.23 0.00 -0.26 0.00 0.00 58.87 59.79 1yju n SER 17 Cb 1.10 -0.12 0.44 0.00 -0.26 0.00 0.00 64.21 65.38 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 -5.22 0.00 0.31 0.00 0.31 -0.15 -3.34 118.33 110.24 1yju n VAL 19 Ca 0.30 1.39 0.16 0.00 -0.01 0.00 0.00 64.34 66.18 1yju n VAL 19 Cb 0.98 -2.22 0.73 0.00 -0.91 0.00 0.00 33.84 32.43 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 -0.52 3.52 2.07 0.65 -1.53 115.15 119.34 1yju h HIS 20 Ca 0.00 0.00 0.07 0.00 -2.85 0.00 0.00 60.37 57.59 1yju h HIS 20 Cb 0.00 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 29.92 1yju h HIS 20 CO -0.13 0.00 0.19 -0.22 -3.07 0.00 0.00 177.93 174.70 1yju h LYS 21 N 0.00 0.36 0.81 5.12 1.63 -0.80 0.17 116.57 123.86 1yju h LYS 21 Ca 0.00 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.74 1yju h LYS 21 Cb 0.30 -0.08 0.01 0.00 -0.60 0.00 0.00 32.23 31.86 1yju h LYS 21 CO 0.00 0.24 -0.39 0.82 -3.45 0.00 0.00 179.45 176.67 1yju h ILE 22 N 0.37 0.00 -0.01 2.00 2.04 -1.28 0.94 117.51 121.57 1yju h ILE 22 Ca 0.25 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1yju h ILE 22 Cb 0.28 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.30 1yju h ILE 22 CO -0.26 0.00 -0.46 -0.33 0.00 0.00 0.00 178.15 177.11 1yju h GLU 23 N -1.23 -0.58 -0.61 2.37 5.08 -1.60 0.22 114.58 118.22 1yju h GLU 23 Ca -0.11 0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.39 1yju h GLU 23 Cb 0.84 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 1yju h GLU 23 CO 0.18 -0.39 0.41 1.03 -1.00 0.00 0.00 179.01 179.24 1yju h SER 24 N -0.61 0.37 0.26 1.42 0.87 -0.66 0.35 113.55 115.55 1yju h SER 24 Ca 0.04 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1yju h SER 24 Cb 0.68 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1yju h SER 24 CO -0.34 0.22 -0.13 -1.28 -0.53 0.00 0.00 176.83 174.78 1yju h SER 25 N 0.41 -0.30 -0.02 6.23 0.87 0.09 -3.37 113.55 117.46 1yju h SER 25 Ca 0.28 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.79 1yju h SER 25 Cb 0.57 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 1yju h SER 25 CO -0.08 -0.07 -0.15 -0.07 -0.53 0.00 0.00 176.83 175.93 1yju h LEU 26 N -0.65 0.31 -1.64 2.23 4.07 -0.13 -0.06 115.31 119.44 1yju h LEU 26 Ca -0.04 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1yju h LEU 26 Cb 0.27 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.93 1yju h LEU 26 CO 0.06 0.49 0.13 0.71 -1.08 0.00 0.00 178.44 178.75 1yju h THR 27 N 0.31 0.00 -0.47 0.22 1.35 -1.12 0.15 112.91 113.34 1yju h THR 27 Ca 0.06 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.88 1yju h THR 27 Cb 0.45 0.55 -0.02 0.00 -1.73 0.00 0.00 68.15 67.39 1yju h THR 27 CO 0.03 0.00 0.13 0.11 -0.25 0.00 0.00 175.52 175.54 1yju h LYS 28 N 0.00 0.70 -6.45 4.72 1.79 -1.15 -3.40 116.57 112.78 1yju h LYS 28 Ca 0.00 -0.12 -0.57 0.00 -2.18 0.00 0.00 60.65 57.78 1yju h LYS 28 Cb 0.25 -0.12 -0.05 0.00 -1.58 0.00 0.00 32.23 30.74 1yju h LYS 28 CO 0.00 0.63 1.13 -1.01 -1.08 0.00 0.00 179.45 179.12 1yju s HIS 29 N -5.21 2.22 -1.63 -1.35 3.76 0.53 -4.83 115.29 108.77 1yju s HIS 29 Ca -0.09 0.65 0.09 0.00 -0.15 0.00 0.00 55.06 55.56 1yju s HIS 29 Cb 0.16 -4.26 0.49 0.00 1.11 0.00 0.00 32.58 30.07 1yju s HIS 29 CO 0.78 -2.27 1.11 -2.13 -0.85 0.00 0.00 174.74 171.38 1yju n ARG 30 N 8.22 0.18 0.25 1.40 0.63 -1.26 -0.98 116.66 125.10 1yju n ARG 30 Ca 0.18 0.13 0.11 0.00 -0.92 0.00 0.00 57.85 57.36 1yju n ARG 30 Cb 0.48 -1.50 0.66 0.00 0.45 0.00 0.00 32.46 32.54 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 1.47 0.00 -3.71 5.14 0.00 -1.88 -3.44 103.07 100.65 1yju h GLY 31 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1yju h GLY 31 CO 0.00 0.00 -0.45 -0.26 0.00 0.00 0.00 176.54 175.83 1yju s ILE 32 N -4.16 5.30 -0.17 2.60 -5.25 -0.15 -3.86 121.20 115.51 1yju s ILE 32 Ca -0.02 -0.79 0.03 0.00 -0.99 0.00 0.00 60.65 58.88 1yju s ILE 32 Cb 0.13 -3.79 -0.13 0.00 2.95 0.00 0.00 42.46 41.63 1yju s ILE 32 CO 0.61 -0.19 -0.12 0.18 -1.79 0.00 0.00 174.94 173.63 1yju n LEU 33 N -0.89 2.46 -3.58 0.37 4.77 0.86 -4.96 117.00 116.03 1yju n LEU 33 Ca -0.08 -0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 55.70 1yju n LEU 33 Cb 0.55 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1yju n LEU 33 CO 0.47 0.72 0.24 -0.47 -1.33 0.00 0.00 177.39 177.03 1yju s TYR 34 N -2.35 -0.35 -0.02 -1.77 5.04 0.29 -4.95 117.35 113.22 1yju s TYR 34 Ca -0.21 0.24 -0.01 0.00 -2.44 0.00 0.00 57.07 54.66 1yju s TYR 34 Cb 0.06 0.33 0.03 0.00 0.35 0.00 0.00 41.96 42.73 1yju s TYR 34 CO 0.44 -0.68 0.05 0.00 -1.34 0.00 0.00 175.55 174.02 1yju s SER 36 N 0.91 3.33 -0.44 0.00 0.15 0.65 -4.94 113.70 113.36 1yju s SER 36 Ca -0.07 -1.41 -0.14 0.00 0.70 0.00 0.00 55.95 55.03 1yju s SER 36 Cb -0.11 -0.30 0.06 0.00 -1.71 0.00 0.00 66.02 63.96 1yju s SER 36 CO -0.03 -0.41 0.34 0.54 1.20 0.00 0.00 173.24 174.88 1yju s VAL 37 N 1.94 5.04 -0.61 4.45 0.11 -1.26 -0.76 120.40 129.32 1yju s VAL 37 Ca 0.11 -1.01 -0.15 0.00 -2.93 0.00 0.00 61.98 57.99 1yju s VAL 37 Cb -0.17 -3.96 0.15 0.00 -1.53 0.00 0.00 36.38 30.87 1yju s VAL 37 CO -0.30 -0.49 0.56 0.00 -3.33 0.00 0.00 175.10 171.54 1yju s ALA 38 N 1.61 3.75 0.31 1.54 0.00 0.48 -4.92 121.76 124.52 1yju s ALA 38 Ca 0.04 -2.72 0.08 0.00 0.00 0.00 0.00 51.96 49.36 1yju s ALA 38 Cb -0.23 -3.32 0.85 0.00 0.00 0.00 0.00 23.12 20.42 1yju s ALA 38 CO 0.07 -2.08 1.74 1.25 0.00 0.00 0.00 175.76 176.73 1yju h LEU 39 N 8.62 0.67 -1.71 0.00 6.46 -1.94 0.30 115.31 127.72 1yju h LEU 39 Ca -0.20 0.13 0.44 0.00 -0.12 0.00 0.00 57.88 58.13 1yju h LEU 39 Cb 1.09 0.03 -0.09 0.00 -0.73 0.00 0.00 40.66 40.95 1yju h LEU 39 CO 0.97 0.13 1.00 0.00 -0.62 0.00 0.00 178.44 179.92 1yju h ALA 40 N 1.71 3.11 0.00 1.25 0.00 -1.96 0.44 119.26 123.81 1yju h ALA 40 Ca 0.63 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.56 1yju h ALA 40 Cb 1.15 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1yju h ALA 40 CO -0.46 -1.63 -0.05 -2.37 0.00 0.00 0.00 179.25 174.73 1yju n THR 41 N -4.35 0.95 -3.81 0.00 5.66 -0.06 -5.02 114.28 107.65 1yju n THR 41 Ca 0.36 -1.05 -0.23 0.00 -3.05 0.00 0.00 64.05 60.08 1yju n THR 41 Cb 1.51 0.39 -0.07 0.00 -1.55 0.00 0.00 70.33 70.61 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 -0.61 0.54 -4.20 1.09 4.13 0.14 -4.91 115.26 111.45 1yju n ASN 42 Ca 0.04 -0.93 -0.26 0.00 1.68 0.00 0.00 54.58 55.11 1yju n ASN 42 Cb 0.45 -1.15 -0.16 0.00 -1.54 0.00 0.00 39.78 37.38 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 -6.14 1.61 -0.39 3.52 2.36 -1.09 -0.43 119.74 119.19 1yju s LYS 43 Ca 0.05 -0.70 -0.16 0.00 -2.55 0.00 0.00 55.97 52.60 1yju s LYS 43 Cb -0.03 -1.55 0.01 0.00 -1.05 0.00 0.00 37.83 35.21 1yju s LYS 43 CO 0.73 0.41 0.40 0.00 1.55 0.00 0.00 175.35 178.44 1yju s ALA 44 N -0.43 3.46 -0.67 3.13 0.00 0.73 -0.39 121.76 127.59 1yju s ALA 44 Ca 0.07 -1.39 -0.27 0.00 0.00 0.00 0.00 51.96 50.36 1yju s ALA 44 Cb -0.08 -2.96 0.03 0.00 0.00 0.00 0.00 23.12 20.11 1yju s ALA 44 CO -0.01 -1.38 1.30 -1.58 0.00 0.00 0.00 175.76 174.09 1yju s HIS 45 N 2.08 2.34 -0.21 0.00 2.46 0.06 -1.03 115.29 120.98 1yju s HIS 45 Ca 0.12 0.17 -0.06 0.00 0.47 0.00 0.00 55.06 55.75 1yju s HIS 45 Cb -0.17 -4.55 -0.03 0.00 -0.13 0.00 0.00 32.58 27.70 1yju s HIS 45 CO 0.13 -1.95 0.03 0.42 -2.47 0.00 0.00 174.74 170.90 1yju s ILE 46 N 5.71 4.24 -0.35 0.89 1.01 -0.33 -0.25 121.20 132.12 1yju s ILE 46 Ca 0.40 -0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.69 1yju s ILE 46 Cb -0.08 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.44 1yju s ILE 46 CO 0.19 0.41 0.35 -0.54 0.00 0.00 0.00 174.94 175.36 1yju s LYS 47 N 1.01 3.50 -0.01 2.79 1.02 0.40 -0.46 119.74 127.99 1yju s LYS 47 Ca 0.03 -0.48 -0.22 0.00 0.02 0.00 0.00 55.97 55.32 1yju s LYS 47 Cb -0.14 -3.82 0.05 0.00 -0.52 0.00 0.00 37.83 33.39 1yju s LYS 47 CO 0.02 -0.55 0.48 1.52 -0.92 0.00 0.00 175.35 175.91 1yju s TYR 48 N 1.99 -0.39 -0.16 3.18 -0.85 0.48 -0.10 117.35 121.50 1yju s TYR 48 Ca 0.11 0.57 -0.04 0.00 -0.52 0.00 0.00 57.07 57.19 1yju s TYR 48 Cb -0.17 0.26 -0.03 0.00 0.38 0.00 0.00 41.96 42.40 1yju s TYR 48 CO 0.12 -0.53 -0.03 0.34 -1.52 0.00 0.00 175.55 173.93 1yju s ASP 49 N -1.51 4.86 0.39 -0.18 -1.08 -1.25 -3.99 116.67 113.91 1yju s ASP 49 Ca -0.10 -0.12 0.09 0.00 -0.52 0.00 0.00 52.55 51.90 1yju s ASP 49 Cb -0.02 -1.80 0.86 0.00 -1.46 0.00 0.00 42.92 40.50 1yju s ASP 49 CO 0.04 0.16 1.96 1.55 0.52 0.00 0.00 175.17 179.40 1yju h PRO 50 N 6.77 0.60 -0.02 4.34 0.13 -1.93 -0.21 132.00 141.68 1yju h PRO 50 Ca -0.32 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 64.78 1yju h PRO 50 Cb 1.19 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 1yju h PRO 50 CO 0.63 0.40 0.02 1.05 -0.23 0.00 0.00 178.00 179.87 1yju h GLU 51 N 0.62 0.00 0.00 0.86 4.11 -1.97 -3.07 114.58 115.13 1yju h GLU 51 Ca 0.30 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.56 1yju h GLU 51 Cb 0.39 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1yju h GLU 51 CO -0.10 0.00 -1.84 0.44 0.07 0.00 0.00 179.01 177.59 1yju n ILE 52 N -3.93 0.64 -3.69 -1.06 -5.35 -0.23 -4.99 119.36 100.75 1yju n ILE 52 Ca -0.02 -0.49 -0.11 0.00 -0.27 0.00 0.00 62.75 61.86 1yju n ILE 52 Cb 0.11 -0.40 -0.10 0.00 -1.74 0.00 0.00 39.64 37.51 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 -2.53 -0.02 0.79 7.28 2.07 -0.41 -4.68 121.20 123.71 1yju s ILE 53 Ca -0.06 0.06 -0.12 0.00 -1.41 0.00 0.00 60.65 59.12 1yju s ILE 53 Cb 0.06 -0.67 0.07 0.00 0.13 0.00 0.00 42.46 42.04 1yju s ILE 53 CO 0.56 0.03 1.12 -0.83 -1.91 0.00 0.00 174.94 173.91 1yju s GLY 54 N 1.21 1.61 0.05 1.50 0.00 -1.25 -3.81 107.32 106.63 1yju s GLY 54 Ca -0.08 -0.40 -0.29 0.00 0.00 0.00 0.00 44.72 43.94 1yju s GLY 54 CO -0.11 0.04 1.51 -0.56 0.00 0.00 0.00 173.10 173.98 1yju h PRO 55 N -1.01 -0.66 -0.51 2.90 0.13 -1.97 -3.07 132.00 127.82 1yju h PRO 55 Ca -0.47 0.04 0.08 0.00 -0.87 0.00 0.00 66.00 64.79 1yju h PRO 55 Cb 1.29 0.15 -0.03 0.00 0.13 0.00 0.00 31.00 32.54 1yju h PRO 55 CO 0.63 -0.39 0.35 -0.09 -0.23 0.00 0.00 178.00 178.26 1yju h ARG 56 N -0.78 0.33 0.18 0.86 2.43 -1.98 -0.26 114.38 115.16 1yju h ARG 56 Ca -0.07 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1yju h ARG 56 Cb 0.57 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 1yju h ARG 56 CO 0.11 0.22 -0.38 -0.44 -1.51 0.00 0.00 179.97 177.97 1yju h ASP 57 N 0.34 -1.10 -0.19 -3.80 5.19 -1.93 0.28 116.42 115.21 1yju h ASP 57 Ca 0.23 0.12 0.04 0.00 -0.62 0.00 0.00 57.03 56.80 1yju h ASP 57 Cb 0.47 0.40 -0.04 0.00 0.18 0.00 0.00 39.33 40.34 1yju h ASP 57 CO -0.06 -0.48 -0.07 0.40 -3.12 0.00 0.00 179.24 175.92 1yju h ILE 58 N -0.65 0.76 -0.54 0.35 1.08 -1.04 -2.32 117.51 115.14 1yju h ILE 58 Ca 0.01 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.58 1yju h ILE 58 Cb 0.66 0.76 -0.07 0.00 -3.07 0.00 0.00 36.82 35.09 1yju h ILE 58 CO -0.19 0.00 0.13 0.40 -0.69 0.00 0.00 178.15 177.80 1yju h ILE 59 N -0.04 0.71 -0.25 -0.67 1.08 -0.63 -0.01 117.51 117.71 1yju h ILE 59 Ca 0.10 -0.09 0.06 0.00 -0.39 0.00 0.00 64.86 64.53 1yju h ILE 59 Cb 0.18 0.41 -0.06 0.00 -3.07 0.00 0.00 36.82 34.28 1yju h ILE 59 CO -0.22 0.05 -0.17 0.45 -0.69 0.00 0.00 178.15 177.58 1yju h HIS 60 N 0.27 -0.42 0.14 1.37 3.86 0.06 0.14 115.15 120.58 1yju h HIS 60 Ca 0.28 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.53 1yju h HIS 60 Cb 0.37 0.22 -0.05 0.00 1.06 0.00 0.00 27.41 29.02 1yju h HIS 60 CO -0.22 -0.24 -0.46 1.15 0.86 0.00 0.00 177.93 179.02 1yju h THR 61 N -0.15 0.10 0.30 2.45 2.02 -0.76 0.12 112.91 116.99 1yju h THR 61 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1yju h THR 61 Cb 0.36 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 1yju h THR 61 CO -0.34 0.00 -0.31 0.40 0.37 0.00 0.00 175.52 175.63 1yju h ILE 62 N -0.71 0.34 -0.62 3.11 2.04 -0.26 -0.84 117.51 120.58 1yju h ILE 62 Ca 0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.97 1yju h ILE 62 Cb 0.72 0.34 -0.07 0.00 -0.74 0.00 0.00 36.82 37.07 1yju h ILE 62 CO -0.25 0.00 0.23 -0.33 0.00 0.00 0.00 178.15 177.80 1yju h GLU 63 N -0.65 0.40 0.00 2.37 4.39 -0.76 -0.86 114.58 119.48 1yju h GLU 63 Ca -0.01 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1yju h GLU 63 Cb 0.60 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 1yju h GLU 63 CO -0.07 0.26 0.00 0.45 -1.16 0.00 0.00 179.01 178.49 1yju n SER 64 N -5.00 0.00 0.00 1.42 2.88 0.43 -3.41 113.62 109.94 1yju n SER 64 Ca 0.09 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 1yju n SER 64 Cb 0.28 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.25 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 -1.49 0.00 -2.50 2.46 7.99 -0.33 -5.04 117.00 118.08 1yju n LEU 65 Ca 0.03 0.00 -0.02 0.00 -0.01 0.00 0.00 56.01 56.00 1yju n LEU 65 Cb 0.12 0.00 0.10 0.00 -0.11 0.00 0.00 43.42 43.53 1yju n LEU 65 CO 0.09 0.00 0.57 0.61 -1.51 0.00 0.00 177.39 177.16 1yju n GLY 66 N 4.09 1.88 2.90 -0.72 0.00 -1.20 -5.10 105.19 107.05 1yju n GLY 66 Ca 0.00 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.08 1.28 0.09 1.61 0.08 -1.23 -4.64 117.98 115.08 1yju s PHE 67 Ca 0.09 -0.56 -0.30 0.00 0.12 0.00 0.00 56.93 56.28 1yju s PHE 67 Cb 0.40 -1.08 -0.05 0.00 -0.57 0.00 0.00 43.02 41.72 1yju s PHE 67 CO -0.11 -0.41 0.97 -2.00 -0.10 0.00 0.00 175.22 173.56 1yju s GLU 68 N 1.49 4.67 0.19 0.44 2.12 -0.51 -3.55 118.70 123.54 1yju s GLU 68 Ca -0.00 1.45 0.06 0.00 0.36 0.00 0.00 54.97 56.84 1yju s GLU 68 Cb -0.13 -3.39 -0.05 0.00 0.26 0.00 0.00 34.13 30.82 1yju s GLU 68 CO -0.05 0.15 -0.10 0.00 -0.54 0.00 0.00 175.26 174.72 1yju s ALA 69 N 0.22 1.77 -0.25 6.30 0.00 -1.26 -0.56 121.76 127.99 1yju s ALA 69 Ca 0.48 -1.62 -0.21 0.00 0.00 0.00 0.00 51.96 50.61 1yju s ALA 69 Cb -0.23 0.07 0.07 0.00 0.00 0.00 0.00 23.12 23.03 1yju s ALA 69 CO 0.30 -0.06 0.65 -1.12 0.00 0.00 0.00 175.76 175.53 1yju s SER 70 N -3.26 -0.72 -0.10 0.00 0.01 -1.11 -4.98 113.70 103.54 1yju s SER 70 Ca 0.21 1.34 -0.05 0.00 1.31 0.00 0.00 55.95 58.76 1yju s SER 70 Cb 0.02 1.32 -0.15 0.00 0.21 0.00 0.00 66.02 67.42 1yju s SER 70 CO 0.05 -0.23 3.18 0.18 0.41 0.00 0.00 173.24 176.83 1yju n LEU 71 N 3.09 5.54 -0.57 2.44 4.32 -1.26 0.12 117.00 130.68 1yju n LEU 71 Ca -0.15 -3.25 0.45 0.00 -0.02 0.00 0.00 56.01 53.04 1yju n LEU 71 Cb 0.56 -1.33 0.75 0.00 -1.62 0.00 0.00 43.42 41.78 1yju n LEU 71 CO 0.04 1.59 1.36 -0.37 -1.22 0.00 0.00 177.39 178.79 1yju h VAL 72 N 1.82 0.07 -0.00 4.08 -1.51 -1.88 0.28 116.25 119.11 1yju h VAL 72 Ca 0.21 -0.01 -0.17 0.00 -1.23 0.00 0.00 66.70 65.50 1yju h VAL 72 Cb 1.27 0.04 -0.02 0.00 -2.13 0.00 0.00 31.29 30.46 1yju h VAL 72 CO 0.34 0.00 -0.78 0.11 -1.23 0.00 0.00 177.57 176.02 1yju h LYS 73 N 0.02 0.07 -2.68 5.19 6.56 -1.82 -3.40 116.57 120.52 1yju h LYS 73 Ca 0.87 -0.07 -0.60 0.00 -1.06 0.00 0.00 60.65 59.79 1yju h LYS 73 Cb 3.17 0.02 -0.39 0.00 -0.57 0.00 0.00 32.23 34.45 1yju h LYS 73 CO -0.21 0.81 -0.83 0.42 -2.06 0.00 0.00 179.45 177.58 1yju s ILE 74 N -3.30 1.00 0.00 1.86 1.09 1.00 -5.05 121.20 117.79 1yju s ILE 74 Ca -0.01 -2.72 0.00 0.00 -1.10 0.00 0.00 60.65 56.82 1yju s ILE 74 Cb 0.11 -1.69 0.00 0.00 -1.06 0.00 0.00 42.46 39.83 1yju s ILE 74 CO 0.80 -1.07 0.13 -0.62 -0.10 0.00 0.00 174.94 174.08