#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 -1.86 3.60 3.03 0.00 -1.26 -4.78 105.19 103.91 1yju n GLY 2 Ca 0.00 -1.24 -0.48 0.00 0.00 0.00 0.00 46.02 44.30 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 -3.56 3.02 -4.61 1.61 9.92 -1.26 -4.92 116.55 116.76 1yju n ASP 3 Ca 0.00 0.64 -0.43 0.00 -0.53 0.00 0.00 54.79 54.47 1yju n ASP 3 Cb 0.51 -1.38 -0.02 0.00 -0.64 0.00 0.00 41.12 39.59 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 5.95 1.02 0.15 0.44 0.00 0.14 -4.89 107.32 110.13 1yju s GLY 4 Ca 0.99 0.12 -0.28 0.00 0.00 0.00 0.00 44.72 45.55 1yju s GLY 4 CO 0.48 2.98 0.89 0.54 0.00 0.00 0.00 173.10 177.99 1yju s VAL 5 N 5.86 4.37 -0.43 1.40 0.11 -1.26 -0.49 120.40 129.96 1yju s VAL 5 Ca 0.70 1.95 0.05 0.00 -2.93 0.00 0.00 61.98 61.74 1yju s VAL 5 Cb -0.19 -4.26 0.18 0.00 -1.53 0.00 0.00 36.38 30.58 1yju s VAL 5 CO 0.32 0.42 0.43 -0.11 -3.33 0.00 0.00 175.10 172.84 1yju n LEU 6 N 2.15 -1.11 -4.56 2.54 7.94 0.50 -4.96 117.00 119.50 1yju n LEU 6 Ca -0.01 -4.07 -0.41 0.00 -1.11 0.00 0.00 56.01 50.40 1yju n LEU 6 Cb 0.49 0.60 -0.03 0.00 0.53 0.00 0.00 43.42 45.01 1yju n LEU 6 CO 0.49 1.89 1.17 -0.70 -1.11 0.00 0.00 177.39 179.13 1yju s GLU 7 N 0.18 3.27 -0.03 1.96 2.56 -1.26 -0.49 118.70 124.89 1yju s GLU 7 Ca 0.32 -0.02 0.04 0.00 0.00 0.00 0.00 54.97 55.31 1yju s GLU 7 Cb 0.04 -4.14 -0.03 0.00 2.00 0.00 0.00 34.13 32.00 1yju s GLU 7 CO -0.17 -2.03 -0.12 -0.48 -0.56 0.00 0.00 175.26 171.90 1yju s LEU 8 N 5.67 2.85 0.28 2.70 0.05 -0.29 -0.97 118.68 128.97 1yju s LEU 8 Ca 0.40 -0.19 -0.29 0.00 0.05 0.00 0.00 54.13 54.10 1yju s LEU 8 Cb -0.08 -1.61 -0.09 0.00 -2.05 0.00 0.00 46.19 42.35 1yju s LEU 8 CO 0.19 0.33 1.04 -0.69 -0.55 0.00 0.00 176.35 176.66 1yju s VAL 9 N -0.81 3.72 -0.30 1.48 1.01 0.77 -0.28 120.40 125.99 1yju s VAL 9 Ca 0.13 1.67 0.01 0.00 0.00 0.00 0.00 61.98 63.79 1yju s VAL 9 Cb -0.11 -4.04 0.07 0.00 0.00 0.00 0.00 36.38 32.30 1yju s VAL 9 CO 0.02 0.35 -0.02 -0.69 0.00 0.00 0.00 175.10 174.77 1yju s VAL 10 N -1.24 2.59 0.20 2.92 1.01 0.12 -0.24 120.40 125.76 1yju s VAL 10 Ca 0.45 -1.70 -0.30 0.00 0.00 0.00 0.00 61.98 60.43 1yju s VAL 10 Cb -0.28 -2.59 -0.08 0.00 0.00 0.00 0.00 36.38 33.42 1yju s VAL 10 CO 0.36 -0.21 1.00 -0.13 0.00 0.00 0.00 175.10 176.12 1yju s ARG 11 N 1.13 4.73 0.00 2.72 0.52 -0.04 -4.32 118.95 123.69 1yju s ARG 11 Ca -0.03 1.58 0.00 0.00 -0.52 0.00 0.00 55.73 56.76 1yju s ARG 11 Cb -0.20 -3.29 0.00 0.00 0.52 0.00 0.00 34.95 31.98 1yju s ARG 11 CO -0.04 0.31 0.00 0.41 0.02 0.00 0.00 175.30 176.00 1yju n GLY 12 N 1.73 3.10 3.74 -3.53 0.00 -1.26 -1.71 105.19 107.25 1yju n GLY 12 Ca 0.00 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.64 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 2.07 -3.81 1.61 0.00 -1.26 -5.03 117.12 110.70 1yju n MET 13 Ca 0.00 0.74 -0.12 0.00 0.00 0.00 0.00 57.70 58.32 1yju n MET 13 Cb 0.00 -2.53 -0.11 0.00 0.00 0.00 0.00 33.22 30.58 1yju n MET 13 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 175.97 175.89 1yju s THR 14 N -1.21 0.02 0.30 3.17 -1.32 -1.26 -5.02 115.64 110.32 1yju s THR 14 Ca 0.62 -0.13 0.00 0.00 -1.21 0.00 0.00 61.69 60.97 1yju s THR 14 Cb -0.47 -0.34 0.00 0.00 -1.51 0.00 0.00 72.50 70.19 1yju s THR 14 CO 0.57 -0.07 0.00 0.00 -2.21 0.00 0.00 174.62 172.91 1yju h ALA 16 N -0.75 2.64 -1.50 0.00 0.00 -2.00 -0.88 119.26 116.77 1yju h ALA 16 Ca -0.08 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yju h ALA 16 Cb 0.73 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1yju h ALA 16 CO 0.03 -1.18 0.00 -1.13 0.00 0.00 0.00 179.25 176.98 1yju n SER 17 N -4.61 0.00 -0.28 0.00 3.41 -1.26 -0.60 113.62 110.28 1yju n SER 17 Ca 0.33 0.75 0.11 0.00 -0.26 0.00 0.00 58.87 59.80 1yju n SER 17 Cb 1.26 -0.25 0.35 0.00 -0.26 0.00 0.00 64.21 65.31 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 0.75 0.00 0.00 0.00 2.07 -1.18 -0.63 116.25 117.25 1yju h VAL 19 Ca 0.45 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.95 1yju h VAL 19 Cb 0.65 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1yju h VAL 19 CO -0.21 0.00 -0.10 1.12 0.02 0.00 0.00 177.57 178.40 1yju h HIS 20 N -0.28 0.00 0.63 1.57 2.07 0.25 -1.38 115.15 118.01 1yju h HIS 20 Ca 0.01 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.50 1yju h HIS 20 Cb 0.31 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.29 1yju h HIS 20 CO -0.47 0.10 -0.30 -0.22 -3.07 0.00 0.00 177.93 173.97 1yju h LYS 21 N 0.00 -0.81 0.65 5.12 1.63 -0.40 0.20 116.57 122.97 1yju h LYS 21 Ca -0.00 0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 1yju h LYS 21 Cb 0.48 0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.29 1yju h LYS 21 CO 0.01 -0.54 -0.44 0.82 -3.45 0.00 0.00 179.45 175.86 1yju h ILE 22 N -0.86 0.12 0.40 2.00 2.04 -0.58 -0.02 117.51 120.61 1yju h ILE 22 Ca -0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1yju h ILE 22 Cb 0.65 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1yju h ILE 22 CO 0.14 0.00 -0.34 -0.33 0.00 0.00 0.00 178.15 177.62 1yju h GLU 23 N -1.04 -0.72 -0.90 2.37 5.08 -1.27 0.13 114.58 118.24 1yju h GLU 23 Ca -0.08 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1yju h GLU 23 Cb 0.85 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 30.22 1yju h GLU 23 CO 0.06 -0.48 0.60 1.03 -1.00 0.00 0.00 179.01 179.22 1yju h SER 24 N -0.75 1.00 0.65 1.42 0.87 -0.61 -0.40 113.55 115.73 1yju h SER 24 Ca -0.03 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 1yju h SER 24 Cb 0.65 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 62.38 1yju h SER 24 CO -0.03 0.70 -0.31 -1.28 -0.53 0.00 0.00 176.83 175.39 1yju h SER 25 N 1.17 -0.73 0.11 6.23 0.87 -0.69 -3.34 113.55 117.17 1yju h SER 25 Ca 0.35 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.87 1yju h SER 25 Cb -0.05 0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 1yju h SER 25 CO -0.09 -0.41 -0.20 -0.07 -0.53 0.00 0.00 176.83 175.52 1yju h LEU 26 N -1.09 0.17 -0.14 2.23 -0.00 -0.48 -2.28 115.31 113.71 1yju h LEU 26 Ca -0.09 -0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.75 1yju h LEU 26 Cb 0.67 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.28 1yju h LEU 26 CO 0.15 0.39 0.00 0.35 -0.00 0.00 0.00 178.44 179.33 1yju n THR 27 N -4.22 1.87 0.27 0.22 -2.24 -0.18 -0.51 114.28 109.48 1yju n THR 27 Ca -0.01 0.51 0.16 0.00 -2.27 0.00 0.00 64.05 62.44 1yju n THR 27 Cb 0.31 -1.50 0.69 0.00 -2.10 0.00 0.00 70.33 67.73 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 0.00 -6.27 -0.78 1.79 -1.57 -3.44 116.57 106.30 1yju h LYS 28 Ca 0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 1yju h LYS 28 Cb 0.01 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.64 1yju h LYS 28 CO 0.00 0.05 1.12 -1.01 -1.08 0.00 0.00 179.45 178.53 1yju s HIS 29 N -3.75 2.11 0.00 -1.35 3.76 0.33 -4.88 115.29 111.51 1yju s HIS 29 Ca 0.00 0.52 -0.03 0.00 -0.15 0.00 0.00 55.06 55.40 1yju s HIS 29 Cb 0.10 -3.96 -0.16 0.00 1.11 0.00 0.00 32.58 29.67 1yju s HIS 29 CO 0.55 -2.99 2.83 0.54 -0.85 0.00 0.00 174.74 174.82 1yju n ARG 30 N 7.57 1.51 -0.48 1.40 1.74 -1.26 -2.10 116.66 125.05 1yju n ARG 30 Ca 0.18 -0.58 -0.02 0.00 -0.77 0.00 0.00 57.85 56.67 1yju n ARG 30 Cb 0.45 -1.62 -0.02 0.00 -1.02 0.00 0.00 32.46 30.26 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 2.16 0.27 3.45 -0.13 0.00 -1.26 -4.96 105.19 104.71 1yju n GLY 31 Ca 0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 4.16 -0.03 -0.61 2.07 -0.89 -0.72 121.20 125.18 1yju s ILE 32 Ca 0.00 -0.23 -0.08 0.00 -1.41 0.00 0.00 60.65 58.93 1yju s ILE 32 Cb 0.00 -2.92 -0.30 0.00 0.13 0.00 0.00 42.46 39.37 1yju s ILE 32 CO 0.00 0.38 0.72 -0.07 -1.91 0.00 0.00 174.94 174.06 1yju h LEU 33 N 7.89 0.54 -7.28 8.50 3.38 -0.62 -3.48 115.31 124.25 1yju h LEU 33 Ca -0.38 -0.80 -0.06 0.00 0.09 0.00 0.00 57.88 56.73 1yju h LEU 33 Cb 1.17 -0.18 -0.15 0.00 0.09 0.00 0.00 40.66 41.60 1yju h LEU 33 CO 0.60 1.68 -0.01 -0.47 0.09 0.00 0.00 178.44 180.32 1yju s TYR 34 N -2.59 -0.34 -0.40 1.13 5.04 0.01 -4.92 117.35 115.29 1yju s TYR 34 Ca -0.14 0.26 0.10 0.00 -2.44 0.00 0.00 57.07 54.86 1yju s TYR 34 Cb 0.06 0.31 0.34 0.00 0.35 0.00 0.00 41.96 43.02 1yju s TYR 34 CO 0.85 -0.65 0.87 0.00 -1.34 0.00 0.00 175.55 175.28 1yju s SER 36 N -2.05 5.94 -1.10 0.00 0.15 0.62 -4.71 113.70 112.56 1yju s SER 36 Ca 0.34 -0.75 -0.15 0.00 0.70 0.00 0.00 55.95 56.09 1yju s SER 36 Cb 0.33 -2.56 0.16 0.00 -1.71 0.00 0.00 66.02 62.24 1yju s SER 36 CO -0.07 -1.98 1.30 0.54 1.20 0.00 0.00 173.24 174.23 1yju s VAL 37 N 6.84 4.96 -1.09 4.45 0.11 -1.26 -0.75 120.40 133.66 1yju s VAL 37 Ca 0.51 -2.27 -0.22 0.00 -2.93 0.00 0.00 61.98 57.07 1yju s VAL 37 Cb -0.05 -4.85 0.04 0.00 -1.53 0.00 0.00 36.38 29.99 1yju s VAL 37 CO 0.03 -1.56 1.58 0.00 -3.33 0.00 0.00 175.10 171.82 1yju s ALA 38 N 1.88 2.77 0.33 1.54 0.00 0.11 -4.79 121.76 123.60 1yju s ALA 38 Ca 0.38 -2.38 0.09 0.00 0.00 0.00 0.00 51.96 50.06 1yju s ALA 38 Cb -0.04 -4.57 0.98 0.00 0.00 0.00 0.00 23.12 19.49 1yju s ALA 38 CO -0.04 -3.67 1.58 1.25 0.00 0.00 0.00 175.76 174.88 1yju h LEU 39 N 13.26 -0.17 -1.17 0.00 7.12 -1.92 0.11 115.31 132.54 1yju h LEU 39 Ca 0.26 0.27 0.42 0.00 0.13 0.00 0.00 57.88 58.96 1yju h LEU 39 Cb 0.97 0.40 -0.14 0.00 -0.53 0.00 0.00 40.66 41.37 1yju h LEU 39 CO 1.42 -0.38 0.73 0.00 -0.13 0.00 0.00 178.44 180.07 1yju n ALA 40 N -2.80 1.17 -1.95 1.25 0.00 -1.26 -0.63 120.51 116.28 1yju n ALA 40 Ca 0.29 0.82 0.04 0.00 0.00 0.00 0.00 53.44 54.59 1yju n ALA 40 Cb 0.96 -0.95 0.08 0.00 0.00 0.00 0.00 19.45 19.53 1yju n ALA 40 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1yju n THR 41 N -4.65 0.79 -3.55 0.00 -2.24 0.26 -5.02 114.28 99.87 1yju n THR 41 Ca 0.36 -1.45 -0.18 0.00 -2.27 0.00 0.00 64.05 60.51 1yju n THR 41 Cb 1.36 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 69.97 1yju n THR 41 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1yju n ASN 42 N -0.29 -0.23 -3.89 3.42 4.13 0.20 -4.89 115.26 113.72 1yju n ASN 42 Ca 0.09 -0.64 -0.10 0.00 1.68 0.00 0.00 54.58 55.61 1yju n ASN 42 Cb 0.86 -0.79 -0.09 0.00 -1.54 0.00 0.00 39.78 38.22 1yju n ASN 42 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1yju s LYS 43 N -5.48 0.63 -0.40 3.52 0.00 -0.83 -0.70 119.74 116.48 1yju s LYS 43 Ca 0.07 -0.68 -0.10 0.00 0.00 0.00 0.00 55.97 55.27 1yju s LYS 43 Cb -0.04 0.25 0.06 0.00 0.00 0.00 0.00 37.83 38.11 1yju s LYS 43 CO 0.49 -0.17 0.24 0.00 0.00 0.00 0.00 175.35 175.91 1yju s ALA 44 N -2.52 3.27 -1.20 0.59 0.00 0.61 0.06 121.76 122.58 1yju s ALA 44 Ca -0.06 -2.00 -0.20 0.00 0.00 0.00 0.00 51.96 49.71 1yju s ALA 44 Cb -0.01 -2.62 0.05 0.00 0.00 0.00 0.00 23.12 20.53 1yju s ALA 44 CO -0.04 -1.56 1.68 -1.58 0.00 0.00 0.00 175.76 174.27 1yju s HIS 45 N 1.46 2.61 0.35 0.00 2.46 0.07 -1.14 115.29 121.11 1yju s HIS 45 Ca 0.02 -1.16 -0.25 0.00 0.47 0.00 0.00 55.06 54.14 1yju s HIS 45 Cb -0.22 -4.65 -0.10 0.00 -0.13 0.00 0.00 32.58 27.48 1yju s HIS 45 CO 0.04 -1.79 0.97 0.42 -2.47 0.00 0.00 174.74 171.90 1yju s ILE 46 N 5.21 4.14 -0.04 0.89 1.01 0.36 -0.27 121.20 132.50 1yju s ILE 46 Ca 0.54 1.68 0.04 0.00 0.00 0.00 0.00 60.65 62.90 1yju s ILE 46 Cb 0.02 -3.89 -0.00 0.00 0.01 0.00 0.00 42.46 38.60 1yju s ILE 46 CO 0.03 0.05 -0.16 -0.54 0.00 0.00 0.00 174.94 174.32 1yju s LYS 47 N -2.30 1.76 0.28 2.79 1.02 0.05 -0.37 119.74 122.98 1yju s LYS 47 Ca 0.53 -0.58 -0.13 0.00 0.02 0.00 0.00 55.97 55.81 1yju s LYS 47 Cb -0.18 -1.52 0.01 0.00 -0.52 0.00 0.00 37.83 35.62 1yju s LYS 47 CO 0.23 0.22 0.56 1.52 -0.92 0.00 0.00 175.35 176.96 1yju s TYR 48 N 0.10 0.32 -0.92 3.18 1.13 0.36 0.15 117.35 121.67 1yju s TYR 48 Ca -0.05 -0.73 -0.04 0.00 -1.41 0.00 0.00 57.07 54.84 1yju s TYR 48 Cb -0.12 0.33 0.23 0.00 -1.10 0.00 0.00 41.96 41.30 1yju s TYR 48 CO 0.02 -1.13 0.83 -0.51 -2.51 0.00 0.00 175.55 172.24 1yju s ASP 49 N -3.04 6.28 0.41 -0.18 1.01 0.10 -0.69 116.67 120.57 1yju s ASP 49 Ca 0.20 -3.56 0.18 0.00 0.71 0.00 0.00 52.55 50.09 1yju s ASP 49 Cb -0.02 -1.99 1.09 0.00 1.01 0.00 0.00 42.92 43.01 1yju s ASP 49 CO 0.11 -0.24 1.82 1.55 0.21 0.00 0.00 175.17 178.61 1yju h PRO 50 N 6.35 0.39 -0.03 8.23 0.13 -1.91 0.54 132.00 145.71 1yju h PRO 50 Ca 0.14 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.26 1yju h PRO 50 Cb 0.85 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 1yju h PRO 50 CO 0.87 0.26 0.31 1.05 -0.23 0.00 0.00 178.00 180.26 1yju h GLU 51 N 0.40 0.00 0.00 0.86 9.09 -1.97 -3.17 114.58 119.79 1yju h GLU 51 Ca 0.52 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.93 1yju h GLU 51 Cb 1.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.43 1yju h GLU 51 CO -0.22 0.00 -0.25 0.44 0.05 0.00 0.00 179.01 179.03 1yju n ILE 52 N -2.97 0.91 0.03 -1.06 -5.35 0.08 -4.94 119.36 106.06 1yju n ILE 52 Ca -0.01 0.30 -0.18 0.00 -0.27 0.00 0.00 62.75 62.59 1yju n ILE 52 Cb 0.37 -1.54 -0.14 0.00 -1.74 0.00 0.00 39.64 36.58 1yju n ILE 52 CO 0.00 0.00 0.00 -0.29 -1.76 0.00 0.00 176.55 174.50 1yju h ILE 53 N 0.00 0.89 -0.67 7.28 6.09 -1.38 -3.51 117.51 126.21 1yju h ILE 53 Ca 0.00 -2.58 0.00 0.00 -1.37 0.00 0.00 64.86 60.91 1yju h ILE 53 Cb 0.25 2.62 0.00 0.00 0.47 0.00 0.00 36.82 40.16 1yju h ILE 53 CO 0.00 0.80 -0.17 0.61 -3.07 0.00 0.00 178.15 176.31 1yju n GLY 54 N 1.79 -3.02 0.24 8.18 0.00 -1.20 -4.38 105.19 106.80 1yju n GLY 54 Ca -0.23 -1.22 -0.14 0.00 0.00 0.00 0.00 46.02 44.43 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 0.03 0.81 -0.90 1.61 0.13 -1.94 -3.22 132.00 128.52 1yju h PRO 55 Ca 0.00 -0.47 0.13 0.00 -0.87 0.00 0.00 66.00 64.79 1yju h PRO 55 Cb 0.17 0.04 -0.07 0.00 0.13 0.00 0.00 31.00 31.27 1yju h PRO 55 CO 0.00 1.10 0.58 -0.09 -0.23 0.00 0.00 178.00 179.36 1yju h ARG 56 N 0.58 0.74 0.75 0.86 2.43 -1.99 -0.94 114.38 116.82 1yju h ARG 56 Ca 0.03 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1yju h ARG 56 Cb 1.01 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1yju h ARG 56 CO 0.10 0.49 -0.39 0.22 -1.51 0.00 0.00 179.97 178.88 1yju h ASP 57 N 0.77 -0.93 -0.62 -3.80 3.58 -1.75 0.18 116.42 113.84 1yju h ASP 57 Ca 0.44 0.04 0.09 0.00 0.42 0.00 0.00 57.03 58.02 1yju h ASP 57 Cb 0.62 0.25 -0.07 0.00 1.72 0.00 0.00 39.33 41.85 1yju h ASP 57 CO -0.20 -0.64 0.26 0.40 -2.88 0.00 0.00 179.24 176.18 1yju h ILE 58 N -1.04 0.81 -0.05 2.25 5.03 -1.55 -1.85 117.51 121.11 1yju h ILE 58 Ca -0.10 -0.16 0.03 0.00 -0.12 0.00 0.00 64.86 64.51 1yju h ILE 58 Cb 0.81 0.31 -0.03 0.00 -3.03 0.00 0.00 36.82 34.88 1yju h ILE 58 CO 0.15 0.08 -0.12 0.40 -0.68 0.00 0.00 178.15 177.99 1yju h ILE 59 N 0.46 0.69 -0.67 -0.67 2.04 -0.94 -1.30 117.51 117.12 1yju h ILE 59 Ca 0.31 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.31 1yju h ILE 59 Cb 0.35 0.69 -0.11 0.00 -0.74 0.00 0.00 36.82 37.01 1yju h ILE 59 CO -0.28 0.00 0.08 0.45 0.00 0.00 0.00 178.15 178.40 1yju h HIS 60 N -0.18 0.10 -0.03 1.37 3.86 -0.05 -0.47 115.15 119.75 1yju h HIS 60 Ca 0.06 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1yju h HIS 60 Cb 0.26 0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.79 1yju h HIS 60 CO -0.20 -0.13 0.02 1.15 0.86 0.00 0.00 177.93 179.63 1yju h THR 61 N 0.19 1.05 -0.12 2.45 2.02 -0.68 0.10 112.91 117.92 1yju h THR 61 Ca 0.36 -0.15 0.03 0.00 0.77 0.00 0.00 66.41 67.42 1yju h THR 61 Cb 0.60 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 1yju h THR 61 CO -0.52 0.04 -0.05 0.40 0.37 0.00 0.00 175.52 175.76 1yju h ILE 62 N -0.01 0.83 -0.26 3.11 2.04 -0.11 0.17 117.51 123.27 1yju h ILE 62 Ca 0.01 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 1yju h ILE 62 Cb 0.06 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1yju h ILE 62 CO -0.00 0.00 0.08 1.05 0.00 0.00 0.00 178.15 179.28 1yju h GLU 63 N -0.04 0.40 -0.60 2.37 -0.00 -1.06 -0.52 114.58 115.13 1yju h GLU 63 Ca 0.06 -0.08 0.04 0.00 -0.00 0.00 0.00 59.36 59.38 1yju h GLU 63 Cb 0.13 -0.06 -0.05 0.00 -0.00 0.00 0.00 28.75 28.78 1yju h GLU 63 CO -0.14 0.46 0.34 1.03 -0.00 0.00 0.00 179.01 180.70 1yju h SER 64 N 0.25 0.51 0.43 3.06 0.87 -0.46 -2.02 113.55 116.20 1yju h SER 64 Ca 0.08 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1yju h SER 64 Cb 0.23 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1yju h SER 64 CO -0.00 0.35 -0.22 -0.07 -0.53 0.00 0.00 176.83 176.36 1yju h LEU 65 N 0.65 -0.52 0.00 2.23 3.38 -0.61 -3.46 115.31 116.97 1yju h LEU 65 Ca 0.26 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1yju h LEU 65 Cb 0.11 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1yju h LEU 65 CO -0.15 -0.36 0.00 0.61 0.09 0.00 0.00 178.44 178.63 1yju n GLY 66 N -1.35 0.10 3.24 0.83 0.00 -0.63 -5.11 105.19 102.27 1yju n GLY 66 Ca -0.11 -0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.21 2.36 -0.58 1.61 0.08 -0.30 -4.91 117.98 115.03 1yju s PHE 67 Ca 0.00 -0.74 -0.28 0.00 0.12 0.00 0.00 56.93 56.03 1yju s PHE 67 Cb 0.00 -1.56 0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1yju s PHE 67 CO 0.00 -0.24 1.43 -1.21 -0.10 0.00 0.00 175.22 175.10 1yju s GLU 68 N -0.06 3.25 0.53 0.44 8.01 -0.70 -3.27 118.70 126.90 1yju s GLU 68 Ca -0.06 0.40 -0.17 0.00 0.01 0.00 0.00 54.97 55.16 1yju s GLU 68 Cb -0.14 -4.15 -0.07 0.00 -4.31 0.00 0.00 34.13 25.46 1yju s GLU 68 CO 0.04 -2.01 1.00 0.00 0.01 0.00 0.00 175.26 174.30 1yju s ALA 69 N 6.21 3.01 -0.28 5.21 0.00 -1.26 -0.86 121.76 133.80 1yju s ALA 69 Ca 0.52 0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.71 1yju s ALA 69 Cb -0.11 -3.14 0.16 0.00 0.00 0.00 0.00 23.12 20.03 1yju s ALA 69 CO 0.24 -0.32 0.42 -1.12 0.00 0.00 0.00 175.76 174.98 1yju s SER 70 N -2.99 0.10 -0.58 0.00 0.01 0.67 -4.94 113.70 105.97 1yju s SER 70 Ca 0.60 -0.07 -0.25 0.00 1.31 0.00 0.00 55.95 57.54 1yju s SER 70 Cb -0.11 1.24 -0.23 0.00 0.21 0.00 0.00 66.02 67.13 1yju s SER 70 CO 0.32 -0.33 1.83 0.00 0.41 0.00 0.00 173.24 175.47 1yju n LEU 71 N 5.37 2.88 -0.05 2.44 -0.00 -1.26 -0.16 117.00 126.22 1yju n LEU 71 Ca -0.01 -2.46 -0.08 0.00 -0.00 0.00 0.00 56.01 53.46 1yju n LEU 71 Cb 0.50 -1.01 -0.02 0.00 -0.00 0.00 0.00 43.42 42.88 1yju n LEU 71 CO 0.01 -1.19 0.83 -0.37 -0.00 0.00 0.00 177.39 176.67 1yju h VAL 72 N 4.91 0.79 -2.42 1.47 -1.51 -1.91 -3.48 116.25 114.11 1yju h VAL 72 Ca 0.33 -0.00 0.07 0.00 -1.23 0.00 0.00 66.70 65.87 1yju h VAL 72 Cb 0.72 0.78 -0.04 0.00 -2.13 0.00 0.00 31.29 30.63 1yju h VAL 72 CO 1.87 0.00 -0.70 0.29 -1.23 0.00 0.00 177.57 177.80 1yju n LYS 73 N -5.20 -2.56 0.07 5.19 5.02 -0.15 -4.76 118.16 115.76 1yju n LYS 73 Ca -0.02 2.02 -0.13 0.00 -2.02 0.00 0.00 58.31 58.16 1yju n LYS 73 Cb 0.13 -2.62 -0.09 0.00 -0.02 0.00 0.00 35.03 32.44 1yju n LYS 73 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1yju h ILE 74 N -0.20 1.02 0.00 -0.18 5.03 -1.96 -3.49 117.51 117.73 1yju h ILE 74 Ca -0.04 -0.73 0.00 0.00 -0.12 0.00 0.00 64.86 63.97 1yju h ILE 74 Cb 0.72 1.47 0.00 0.00 -3.03 0.00 0.00 36.82 35.98 1yju h ILE 74 CO 0.02 0.17 0.00 1.21 -0.68 0.00 0.00 178.15 178.87