#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 0.98 0.08 3.03 0.00 -1.26 -4.87 105.19 103.15 1yju n GLY 2 Ca 0.00 -0.20 0.02 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.50 0.12 -3.68 1.61 9.92 -1.26 -4.77 116.55 117.98 1yju n ASP 3 Ca -0.09 0.34 -0.25 0.00 -0.53 0.00 0.00 54.79 54.26 1yju n ASP 3 Cb 0.43 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 1yju n ASP 3 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1yju n GLY 4 N -1.24 -1.07 3.56 0.44 0.00 -1.16 -1.28 105.19 104.43 1yju n GLY 4 Ca -0.00 0.63 -0.37 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.75 3.73 -0.57 1.61 0.11 -1.26 -2.82 120.40 118.46 1yju s VAL 5 Ca 0.04 -0.42 -0.19 0.00 -2.93 0.00 0.00 61.98 58.48 1yju s VAL 5 Cb -0.00 -4.70 0.10 0.00 -1.53 0.00 0.00 36.38 30.24 1yju s VAL 5 CO 0.84 -1.61 0.66 -0.22 -3.33 0.00 0.00 175.10 171.44 1yju s LEU 6 N 6.65 5.39 -0.26 2.54 2.96 0.47 -4.90 118.68 131.53 1yju s LEU 6 Ca 0.52 -1.37 -0.15 0.00 -0.22 0.00 0.00 54.13 52.91 1yju s LEU 6 Cb -0.04 -2.32 -0.04 0.00 0.50 0.00 0.00 46.19 44.30 1yju s LEU 6 CO -0.02 -1.04 0.38 -1.61 -1.32 0.00 0.00 176.35 172.75 1yju s GLU 7 N 2.54 4.03 0.04 1.98 2.02 -1.26 -0.36 118.70 127.70 1yju s GLU 7 Ca 0.11 0.07 0.01 0.00 0.02 0.00 0.00 54.97 55.18 1yju s GLU 7 Cb -0.24 -3.65 -0.04 0.00 0.10 0.00 0.00 34.13 30.31 1yju s GLU 7 CO 0.07 -0.26 0.13 -0.48 0.02 0.00 0.00 175.26 174.74 1yju s LEU 8 N 2.03 4.06 0.32 1.80 -0.00 -1.13 -0.50 118.68 125.26 1yju s LEU 8 Ca 0.16 0.15 -0.27 0.00 -0.00 0.00 0.00 54.13 54.17 1yju s LEU 8 Cb -0.16 -2.60 -0.10 0.00 -0.00 0.00 0.00 46.19 43.34 1yju s LEU 8 CO 0.10 0.21 0.97 0.54 -0.00 0.00 0.00 176.35 178.16 1yju s VAL 9 N -1.37 4.06 -0.03 1.48 0.11 0.84 -0.89 120.40 124.60 1yju s VAL 9 Ca 0.29 1.77 -0.01 0.00 -2.93 0.00 0.00 61.98 61.11 1yju s VAL 9 Cb -0.12 -4.01 0.03 0.00 -1.53 0.00 0.00 36.38 30.74 1yju s VAL 9 CO 0.22 0.20 0.04 0.54 -3.33 0.00 0.00 175.10 172.77 1yju s VAL 10 N -1.52 -0.07 0.21 2.04 0.11 0.76 -0.46 120.40 121.47 1yju s VAL 10 Ca 0.49 0.27 0.11 0.00 -2.93 0.00 0.00 61.98 59.92 1yju s VAL 10 Cb -0.21 -0.11 -0.04 0.00 -1.53 0.00 0.00 36.38 34.49 1yju s VAL 10 CO 0.27 0.11 -0.19 0.00 -3.33 0.00 0.00 175.10 171.96 1yju s ARG 11 N 1.35 1.72 0.00 1.54 1.70 0.13 -4.54 118.95 120.85 1yju s ARG 11 Ca -0.06 -1.49 0.00 0.00 -0.47 0.00 0.00 55.73 53.71 1yju s ARG 11 Cb -0.13 -1.93 0.00 0.00 -0.57 0.00 0.00 34.95 32.32 1yju s ARG 11 CO -0.03 0.40 0.00 0.41 -1.08 0.00 0.00 175.30 174.99 1yju n GLY 12 N 0.02 1.66 3.62 3.88 0.00 -1.26 -1.61 105.19 111.50 1yju n GLY 12 Ca -0.11 -0.20 -0.49 0.00 0.00 0.00 0.00 46.02 45.22 1yju n GLY 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1yju n MET 13 N 0.00 1.55 -0.37 1.61 2.81 -1.26 -4.87 117.12 116.59 1yju n MET 13 Ca 0.00 0.56 0.00 0.00 -1.81 0.00 0.00 57.70 56.45 1yju n MET 13 Cb 0.00 -2.24 0.00 0.00 -0.71 0.00 0.00 33.22 30.27 1yju n MET 13 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1yju n THR 14 N 2.75 0.00 -3.57 2.03 5.66 -1.26 -5.05 114.28 114.84 1yju n THR 14 Ca 0.17 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.08 1yju n THR 14 Cb 0.24 0.19 -0.05 0.00 -1.55 0.00 0.00 70.33 69.16 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 2.47 2.14 -0.52 0.00 0.00 -2.00 0.24 119.26 121.59 1yju h ALA 16 Ca -0.18 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1yju h ALA 16 Cb 1.17 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1yju h ALA 16 CO 0.30 -0.62 0.00 -1.13 0.00 0.00 0.00 179.25 177.80 1yju n SER 17 N -4.76 0.00 -0.33 0.00 3.41 -1.26 -0.50 113.62 110.18 1yju n SER 17 Ca 0.28 0.91 0.21 0.00 -0.26 0.00 0.00 58.87 60.01 1yju n SER 17 Cb 0.93 -0.41 0.40 0.00 -0.26 0.00 0.00 64.21 64.86 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 -5.40 0.00 0.30 0.00 0.31 0.02 -3.38 118.33 110.19 1yju n VAL 19 Ca 0.29 1.32 0.19 0.00 -0.01 0.00 0.00 64.34 66.13 1yju n VAL 19 Cb 0.95 -2.19 0.88 0.00 -0.91 0.00 0.00 33.84 32.58 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 -0.79 3.52 2.07 0.46 -0.97 115.15 119.45 1yju h HIS 20 Ca 0.00 0.00 0.06 0.00 -2.85 0.00 0.00 60.37 57.58 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 -0.05 0.01 0.48 -0.22 -3.07 0.00 0.00 177.93 175.08 1yju h LYS 21 N 0.00 0.86 0.66 5.12 1.63 -0.77 0.10 116.57 124.18 1yju h LYS 21 Ca -0.00 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 1yju h LYS 21 Cb 0.32 -0.19 0.01 0.00 -0.60 0.00 0.00 32.23 31.76 1yju h LYS 21 CO 0.00 0.57 -0.32 0.82 -3.45 0.00 0.00 179.45 177.07 1yju h ILE 22 N 0.89 0.30 0.21 2.00 2.04 -1.18 0.14 117.51 121.91 1yju h ILE 22 Ca 0.34 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 66.06 1yju h ILE 22 Cb 0.15 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 1yju h ILE 22 CO -0.16 0.02 -0.43 -0.33 0.00 0.00 0.00 178.15 177.24 1yju h GLU 23 N -1.00 -0.70 -0.11 2.37 5.08 -1.56 0.63 114.58 119.29 1yju h GLU 23 Ca -0.09 0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1yju h GLU 23 Cb 0.71 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.06 1yju h GLU 23 CO 0.15 -0.47 -0.28 1.03 -1.00 0.00 0.00 179.01 178.44 1yju h SER 24 N -0.73 -0.88 -1.00 1.42 0.87 -0.83 0.10 113.55 112.50 1yju h SER 24 Ca 0.00 0.13 0.03 0.00 -1.23 0.00 0.00 61.79 60.72 1yju h SER 24 Cb 0.72 0.38 -0.06 0.00 -0.44 0.00 0.00 62.40 63.00 1yju h SER 24 CO -0.20 -0.33 0.66 -1.28 -0.53 0.00 0.00 176.83 175.15 1yju h SER 25 N -0.37 1.11 0.12 6.23 0.87 -0.24 -1.88 113.55 119.39 1yju h SER 25 Ca 0.09 -0.02 -0.20 0.00 -1.23 0.00 0.00 61.79 60.44 1yju h SER 25 Cb 0.51 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1yju h SER 25 CO -0.32 0.77 -0.77 -0.07 -0.53 0.00 0.00 176.83 175.91 1yju h LEU 26 N 1.29 0.65 -6.52 2.23 3.38 -0.55 -3.39 115.31 112.40 1yju h LEU 26 Ca 0.39 -0.44 -0.64 0.00 0.09 0.00 0.00 57.88 57.28 1yju h LEU 26 Cb -0.04 -0.19 0.04 0.00 0.09 0.00 0.00 40.66 40.56 1yju h LEU 26 CO -0.11 1.20 2.28 0.41 0.09 0.00 0.00 178.44 182.31 1yju n THR 27 N -3.86 1.88 0.00 0.22 -1.04 0.32 -1.91 114.28 109.89 1yju n THR 27 Ca -0.06 -1.65 0.00 0.00 -2.04 0.00 0.00 64.05 60.30 1yju n THR 27 Cb 0.73 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 66.92 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 7.02 0.00 0.15 -2.82 -0.00 -1.26 -4.92 118.16 116.34 1yju n LYS 28 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.81 1yju n LYS 28 Cb 0.41 0.00 0.25 0.00 -0.00 0.00 0.00 35.03 35.69 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 0.02 0.00 5.58 3.86 -1.65 -3.47 115.15 119.48 1yju h HIS 29 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1yju h HIS 29 Cb 0.00 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1yju h HIS 29 CO 0.00 0.52 0.00 0.54 0.86 0.00 0.00 177.93 179.85 1yju n ARG 30 N -3.94 0.00 0.06 2.45 3.00 -1.26 -4.75 116.66 112.22 1yju n ARG 30 Ca -0.02 0.00 -0.05 0.00 -0.01 0.00 0.00 57.85 57.77 1yju n ARG 30 Cb 0.52 -3.45 -0.09 0.00 0.00 0.00 0.00 32.46 29.44 1yju n ARG 30 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1yju h GLY 31 N 0.00 0.00 -4.45 -0.13 0.00 -1.90 -3.44 103.07 93.15 1yju h GLY 31 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1yju h GLY 31 CO 0.00 0.00 0.40 -1.50 0.00 0.00 0.00 176.54 175.44 1yju s ILE 32 N -2.75 4.84 -0.12 2.60 2.07 -1.26 -0.65 121.20 125.94 1yju s ILE 32 Ca 0.01 2.05 -0.13 0.00 -1.41 0.00 0.00 60.65 61.17 1yju s ILE 32 Cb 0.09 -4.31 -0.26 0.00 0.13 0.00 0.00 42.46 38.11 1yju s ILE 32 CO 0.81 0.14 0.44 -0.07 -1.91 0.00 0.00 174.94 174.35 1yju h LEU 33 N 6.94 0.37 -7.30 8.50 3.38 -1.02 -3.48 115.31 122.70 1yju h LEU 33 Ca -0.40 -0.85 -0.09 0.00 0.09 0.00 0.00 57.88 56.63 1yju h LEU 33 Cb 1.21 -0.12 -0.19 0.00 0.09 0.00 0.00 40.66 41.65 1yju h LEU 33 CO 0.76 1.72 -0.07 -0.47 0.09 0.00 0.00 178.44 180.47 1yju s TYR 34 N -2.50 -0.37 -0.03 1.13 5.04 -0.28 -4.99 117.35 115.34 1yju s TYR 34 Ca -0.22 0.55 0.01 0.00 -2.44 0.00 0.00 57.07 54.97 1yju s TYR 34 Cb 0.06 0.24 0.02 0.00 0.35 0.00 0.00 41.96 42.63 1yju s TYR 34 CO 0.75 -0.51 -0.00 0.00 -1.34 0.00 0.00 175.55 174.45 1yju s SER 36 N 0.91 3.54 -0.98 0.00 0.15 0.47 -5.00 113.70 112.80 1yju s SER 36 Ca -0.09 -1.28 -0.18 0.00 0.70 0.00 0.00 55.95 55.10 1yju s SER 36 Cb -0.13 -0.67 0.14 0.00 -1.71 0.00 0.00 66.02 63.65 1yju s SER 36 CO -0.01 -0.38 1.17 0.54 1.20 0.00 0.00 173.24 175.76 1yju s VAL 37 N 1.79 4.80 -1.14 4.45 0.11 -1.26 -0.76 120.40 128.39 1yju s VAL 37 Ca 0.06 -1.78 -0.21 0.00 -2.93 0.00 0.00 61.98 57.11 1yju s VAL 37 Cb -0.17 -4.80 0.04 0.00 -1.53 0.00 0.00 36.38 29.92 1yju s VAL 37 CO -0.21 -1.52 1.66 0.00 -3.33 0.00 0.00 175.10 171.70 1yju s ALA 38 N 2.44 2.79 0.41 1.54 0.00 0.14 -4.79 121.76 124.29 1yju s ALA 38 Ca 0.34 -2.46 0.23 0.00 0.00 0.00 0.00 51.96 50.07 1yju s ALA 38 Cb -0.05 -4.60 1.24 0.00 0.00 0.00 0.00 23.12 19.72 1yju s ALA 38 CO -0.08 -3.75 1.70 1.25 0.00 0.00 0.00 175.76 174.88 1yju h LEU 39 N 13.63 0.36 -1.66 0.00 5.85 -1.93 0.10 115.31 131.68 1yju h LEU 39 Ca 0.30 0.12 0.24 0.00 0.84 0.00 0.00 57.88 59.38 1yju h LEU 39 Cb 0.94 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.99 1yju h LEU 39 CO 1.40 -0.06 0.64 0.00 -0.34 0.00 0.00 178.44 180.09 1yju h ALA 40 N 1.64 2.46 -0.11 1.25 0.00 -1.94 0.68 119.26 123.24 1yju h ALA 40 Ca 0.71 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.63 1yju h ALA 40 Cb 1.99 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1yju h ALA 40 CO -0.38 -0.77 0.00 0.25 0.00 0.00 0.00 179.25 178.35 1yju n THR 41 N -4.44 0.45 -4.08 0.00 -2.24 0.18 -5.00 114.28 99.15 1yju n THR 41 Ca 0.21 -0.73 -0.31 0.00 -2.27 0.00 0.00 64.05 60.95 1yju n THR 41 Cb 0.85 0.86 -0.04 0.00 -2.10 0.00 0.00 70.33 69.90 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 0.31 -0.98 -3.90 3.42 4.13 0.23 -4.86 115.26 113.61 1yju n ASN 42 Ca 0.06 -1.15 -0.11 0.00 1.68 0.00 0.00 54.58 55.05 1yju n ASN 42 Cb 0.27 -2.34 -0.13 0.00 -1.54 0.00 0.00 39.78 36.03 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 -6.94 0.10 -0.45 3.52 2.36 -0.74 -0.17 119.74 117.42 1yju s LYS 43 Ca 0.13 -0.17 -0.09 0.00 -2.55 0.00 0.00 55.97 53.29 1yju s LYS 43 Cb -0.06 0.01 0.11 0.00 -1.05 0.00 0.00 37.83 36.84 1yju s LYS 43 CO 0.94 -0.01 0.31 0.00 1.55 0.00 0.00 175.35 178.14 1yju s ALA 44 N -0.39 3.35 -0.59 3.13 0.00 -0.06 0.26 121.76 127.45 1yju s ALA 44 Ca -0.04 -2.44 -0.28 0.00 0.00 0.00 0.00 51.96 49.20 1yju s ALA 44 Cb -0.03 -2.75 0.02 0.00 0.00 0.00 0.00 23.12 20.37 1yju s ALA 44 CO -0.00 -1.84 1.31 -1.58 0.00 0.00 0.00 175.76 173.65 1yju s HIS 45 N 1.36 2.41 -0.20 0.00 2.46 0.06 -2.85 115.29 118.53 1yju s HIS 45 Ca 0.05 0.39 -0.03 0.00 0.47 0.00 0.00 55.06 55.94 1yju s HIS 45 Cb -0.25 -4.47 -0.01 0.00 -0.13 0.00 0.00 32.58 27.72 1yju s HIS 45 CO -0.00 -1.83 -0.07 0.42 -2.47 0.00 0.00 174.74 170.79 1yju s ILE 46 N 5.58 3.26 -0.24 0.89 1.01 0.52 -0.39 121.20 131.82 1yju s ILE 46 Ca 0.46 -0.54 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 1yju s ILE 46 Cb -0.09 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 1yju s ILE 46 CO 0.24 0.45 0.12 -0.54 0.00 0.00 0.00 174.94 175.21 1yju s LYS 47 N 1.27 3.93 0.01 2.79 1.02 0.12 -0.40 119.74 128.48 1yju s LYS 47 Ca 0.03 -0.34 -0.18 0.00 0.02 0.00 0.00 55.97 55.50 1yju s LYS 47 Cb -0.14 -3.45 0.03 0.00 -0.52 0.00 0.00 37.83 33.75 1yju s LYS 47 CO -0.03 -0.00 0.39 1.52 -0.92 0.00 0.00 175.35 176.31 1yju s TYR 48 N 1.19 -0.26 -0.45 3.18 1.13 -0.41 -0.41 117.35 121.33 1yju s TYR 48 Ca 0.06 0.31 -0.18 0.00 -1.41 0.00 0.00 57.07 55.85 1yju s TYR 48 Cb -0.14 0.18 0.04 0.00 -1.10 0.00 0.00 41.96 40.94 1yju s TYR 48 CO 0.05 -0.51 0.51 -0.51 -2.51 0.00 0.00 175.55 172.58 1yju s ASP 49 N -1.69 6.22 0.12 -0.18 1.01 0.18 -2.98 116.67 119.34 1yju s ASP 49 Ca -0.09 -0.75 -0.18 0.00 0.71 0.00 0.00 52.55 52.24 1yju s ASP 49 Cb -0.02 -2.25 -0.04 0.00 1.01 0.00 0.00 42.92 41.61 1yju s ASP 49 CO 0.01 -0.70 1.71 1.55 0.21 0.00 0.00 175.17 177.95 1yju h PRO 50 N 8.82 0.41 -0.99 8.23 0.13 -1.88 -3.07 132.00 143.66 1yju h PRO 50 Ca -0.27 -0.05 0.27 0.00 -0.87 0.00 0.00 66.00 65.08 1yju h PRO 50 Cb 1.10 -0.08 -0.06 0.00 0.13 0.00 0.00 31.00 32.10 1yju h PRO 50 CO 0.86 0.37 0.68 1.05 -0.23 0.00 0.00 178.00 180.74 1yju h GLU 51 N 0.34 0.14 -0.46 0.86 4.11 -1.97 0.56 114.58 118.17 1yju h GLU 51 Ca 0.10 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.52 1yju h GLU 51 Cb 0.09 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1yju h GLU 51 CO -0.01 0.10 0.00 0.44 0.07 0.00 0.00 179.01 179.60 1yju n ILE 52 N -4.36 0.60 0.13 -1.06 -5.35 -1.16 -4.72 119.36 103.43 1yju n ILE 52 Ca 0.21 -0.70 0.00 0.00 -0.27 0.00 0.00 62.75 61.99 1yju n ILE 52 Cb 0.96 0.58 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 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 1.16 0.00 0.00 7.28 3.06 0.01 -4.74 119.36 126.14 1yju n ILE 53 Ca 0.19 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.44 1yju n ILE 53 Cb 0.50 -0.11 0.00 0.00 0.54 0.00 0.00 39.64 40.58 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 -0.86 -2.04 0.37 4.50 0.00 0.18 -4.55 105.19 102.79 1yju n GLY 54 Ca 0.00 -1.28 0.02 0.00 0.00 0.00 0.00 46.02 44.76 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 1.14 -0.46 1.61 0.13 -1.96 -2.68 132.00 129.78 1yju h PRO 55 Ca 0.00 -0.07 0.09 0.00 -0.87 0.00 0.00 66.00 65.15 1yju h PRO 55 Cb 0.00 -0.26 -0.08 0.00 0.13 0.00 0.00 31.00 30.79 1yju h PRO 55 CO 0.00 0.76 -0.13 2.89 -0.23 0.00 0.00 178.00 181.29 1yju n ARG 56 N -4.47 -0.06 -0.03 0.86 1.85 -1.26 -0.56 116.66 113.00 1yju n ARG 56 Ca 0.14 0.72 -0.13 0.00 -1.00 0.00 0.00 57.85 57.58 1yju n ARG 56 Cb 0.15 -1.07 -0.10 0.00 -1.05 0.00 0.00 32.46 30.38 1yju n ARG 56 CO 0.00 0.00 0.00 0.22 -0.01 0.00 0.00 177.63 177.84 1yju h ASP 57 N 0.00 0.03 0.32 2.89 3.58 -1.71 0.13 116.42 121.66 1yju h ASP 57 Ca 0.21 -0.58 -0.01 0.00 0.42 0.00 0.00 57.03 57.07 1yju h ASP 57 Cb 0.32 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 1yju h ASP 57 CO -0.47 0.60 -0.21 0.40 -2.88 0.00 0.00 179.24 176.68 1yju h ILE 58 N -0.54 0.55 0.03 2.25 2.04 -1.35 0.16 117.51 120.64 1yju h ILE 58 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1yju h ILE 58 Cb 0.60 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1yju h ILE 58 CO 0.00 0.00 -0.28 0.40 0.00 0.00 0.00 178.15 178.27 1yju h ILE 59 N -0.52 0.37 -0.66 -0.67 1.08 -0.83 0.11 117.51 116.38 1yju h ILE 59 Ca -0.03 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.54 1yju h ILE 59 Cb 0.44 0.37 -0.08 0.00 -3.07 0.00 0.00 36.82 34.48 1yju h ILE 59 CO 0.02 0.00 0.26 -0.74 -0.69 0.00 0.00 178.15 177.01 1yju h HIS 60 N -0.44 0.46 0.25 1.37 2.76 -0.59 0.65 115.15 119.59 1yju h HIS 60 Ca 0.06 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 1yju h HIS 60 Cb 0.52 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.38 1yju h HIS 60 CO -0.30 0.11 -0.13 1.15 -1.30 0.00 0.00 177.93 177.46 1yju h THR 61 N 0.45 0.74 0.11 6.26 2.02 0.16 0.19 112.91 122.84 1yju h THR 61 Ca 0.34 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.54 1yju h THR 61 Cb 0.44 0.74 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 1yju h THR 61 CO -0.33 0.00 -0.47 0.40 0.37 0.00 0.00 175.52 175.49 1yju h ILE 62 N -0.35 0.08 0.08 3.11 2.04 0.07 0.23 117.51 122.77 1yju h ILE 62 Ca -0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 1yju h ILE 62 Cb 0.27 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 36.38 1yju h ILE 62 CO 0.05 0.00 -0.43 -0.33 0.00 0.00 0.00 178.15 177.44 1yju h GLU 63 N -0.70 -0.61 -0.08 2.37 5.08 -0.84 -2.72 114.58 117.08 1yju h GLU 63 Ca 0.01 0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1yju h GLU 63 Cb 0.72 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1yju h GLU 63 CO -0.27 -0.41 0.08 1.03 -1.00 0.00 0.00 179.01 178.44 1yju h SER 64 N -0.63 0.00 0.00 1.42 0.87 -0.23 -2.32 113.55 112.66 1yju h SER 64 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1yju h SER 64 Cb 0.68 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1yju h SER 64 CO -0.27 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.21 1yju n LEU 65 N -3.93 0.44 -1.33 2.23 4.77 0.04 -4.88 117.00 114.34 1yju n LEU 65 Ca -0.01 0.55 -0.06 0.00 -0.03 0.00 0.00 56.01 56.46 1yju n LEU 65 Cb 0.19 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1yju n LEU 65 CO 0.28 -0.15 0.40 0.61 -1.33 0.00 0.00 177.39 177.20 1yju n GLY 66 N -0.01 0.81 3.40 -0.72 0.00 -1.17 -5.13 105.19 102.35 1yju n GLY 66 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.77 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 0.01 1.70 0.20 1.61 0.08 -0.88 -4.69 117.98 116.01 1yju s PHE 67 Ca 0.02 -1.23 0.11 0.00 0.12 0.00 0.00 56.93 55.95 1yju s PHE 67 Cb 0.09 -1.02 -0.04 0.00 -0.57 0.00 0.00 43.02 41.48 1yju s PHE 67 CO -0.03 -0.33 -0.21 -1.83 -0.10 0.00 0.00 175.22 172.72 1yju s GLU 68 N -3.85 1.48 0.21 0.44 1.03 -0.63 -4.33 118.70 113.05 1yju s GLU 68 Ca 0.34 -1.54 -0.16 0.00 0.03 0.00 0.00 54.97 53.63 1yju s GLU 68 Cb 0.06 -1.67 0.02 0.00 -0.80 0.00 0.00 34.13 31.74 1yju s GLU 68 CO 0.16 0.34 0.52 0.00 -1.33 0.00 0.00 175.26 174.95 1yju s ALA 69 N -1.98 -0.76 -0.22 -0.84 0.00 -1.26 -0.69 121.76 116.01 1yju s ALA 69 Ca 0.21 -0.41 -0.14 0.00 0.00 0.00 0.00 51.96 51.62 1yju s ALA 69 Cb -0.07 0.90 0.07 0.00 0.00 0.00 0.00 23.12 24.02 1yju s ALA 69 CO 0.10 -0.83 0.56 0.45 0.00 0.00 0.00 175.76 176.04 1yju s SER 70 N -2.91 -0.71 0.04 0.00 0.15 0.40 -4.97 113.70 105.69 1yju s SER 70 Ca 0.13 1.20 -0.35 0.00 0.70 0.00 0.00 55.95 57.63 1yju s SER 70 Cb -0.01 1.11 -0.14 0.00 -1.71 0.00 0.00 66.02 65.27 1yju s SER 70 CO 0.01 -0.21 1.67 0.18 1.20 0.00 0.00 173.24 176.08 1yju n LEU 71 N 3.98 3.03 -0.00 3.45 4.32 -1.26 -0.11 117.00 130.41 1yju n LEU 71 Ca -0.20 1.05 -0.00 0.00 -0.02 0.00 0.00 56.01 56.84 1yju n LEU 71 Cb 0.57 -1.37 -0.00 0.00 -1.62 0.00 0.00 43.42 41.00 1yju n LEU 71 CO 0.04 -0.29 -0.50 1.33 -1.22 0.00 0.00 177.39 176.75 1yju n VAL 72 N 4.00 0.00 -2.78 4.08 0.24 0.35 -4.83 118.33 119.38 1yju n VAL 72 Ca 0.20 -0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.48 1yju n VAL 72 Cb 0.27 -1.22 -0.01 0.00 -1.47 0.00 0.00 33.84 31.41 1yju n VAL 72 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1yju n LYS 73 N -2.86 -3.19 -2.18 7.34 5.02 -0.50 -4.64 118.16 117.16 1yju n LYS 73 Ca -0.00 2.58 -0.04 0.00 -2.02 0.00 0.00 58.31 58.84 1yju n LYS 73 Cb 0.50 -4.42 0.02 0.00 -0.02 0.00 0.00 35.03 31.10 1yju n LYS 73 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1yju n ILE 74 N 1.14 -1.72 -0.46 -0.18 2.08 -1.26 -5.01 119.36 113.94 1yju n ILE 74 Ca -0.10 -0.16 0.00 0.00 0.56 0.00 0.00 62.75 63.05 1yju n ILE 74 Cb 0.23 -3.25 0.00 0.00 -0.75 0.00 0.00 39.64 35.87 1yju n ILE 74 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32