#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yjv n GLY 2 N 0.00 -0.47 3.50 3.03 0.00 -1.26 -5.08 105.19 104.92 1yjv n GLY 2 Ca 0.00 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 1yjv n GLY 2 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yjv s ASP 3 N -2.48 -0.07 0.00 1.61 -1.08 -1.26 -5.08 116.67 108.30 1yjv s ASP 3 Ca 0.67 -0.87 0.00 0.00 -0.52 0.00 0.00 52.55 51.83 1yjv s ASP 3 Cb -0.24 0.54 0.00 0.00 -1.46 0.00 0.00 42.92 41.76 1yjv s ASP 3 CO 0.58 -1.06 0.38 0.61 0.52 0.00 0.00 175.17 176.19 1yjv n GLY 4 N -0.33 -0.88 3.71 2.66 0.00 -1.26 -4.42 105.19 104.67 1yjv n GLY 4 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1yjv n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yjv s VAL 5 N -0.25 4.88 -0.18 1.61 1.01 -1.26 -0.89 120.40 125.32 1yjv s VAL 5 Ca 0.00 1.98 -0.07 0.00 0.00 0.00 0.00 61.98 63.89 1yjv s VAL 5 Cb 0.00 -4.29 0.08 0.00 0.00 0.00 0.00 36.38 32.17 1yjv s VAL 5 CO 0.00 0.15 0.39 -0.22 0.00 0.00 0.00 175.10 175.41 1yjv s LEU 6 N 1.15 -0.40 -0.21 3.92 1.98 -0.96 -4.97 118.68 119.18 1yjv s LEU 6 Ca 0.50 0.88 -0.04 0.00 -2.89 0.00 0.00 54.13 52.58 1yjv s LEU 6 Cb -0.20 1.22 -0.01 0.00 0.66 0.00 0.00 46.19 47.86 1yjv s LEU 6 CO 0.25 -0.22 -0.04 -1.83 -1.89 0.00 0.00 176.35 172.62 1yjv s GLU 7 N 2.21 3.43 0.26 1.98 4.04 -1.26 -0.92 118.70 128.44 1yjv s GLU 7 Ca -0.04 -0.61 0.07 0.00 0.04 0.00 0.00 54.97 54.43 1yjv s GLU 7 Cb -0.11 -3.00 -0.03 0.00 0.02 0.00 0.00 34.13 31.01 1yjv s GLU 7 CO -0.12 -0.12 0.26 -0.51 -1.84 0.00 0.00 175.26 172.93 1yjv s LEU 8 N 1.30 3.93 0.22 1.83 1.43 -0.52 -4.14 118.68 122.72 1yjv s LEU 8 Ca 0.04 -0.19 -0.21 0.00 -1.03 0.00 0.00 54.13 52.73 1yjv s LEU 8 Cb -0.14 -2.49 -0.08 0.00 0.03 0.00 0.00 46.19 43.51 1yjv s LEU 8 CO -0.01 -0.10 0.75 -0.69 0.23 0.00 0.00 176.35 176.52 1yjv s VAL 9 N -2.11 4.51 0.02 -1.59 1.01 0.67 -0.00 120.40 122.90 1yjv s VAL 9 Ca 0.35 1.40 0.02 0.00 0.00 0.00 0.00 61.98 63.74 1yjv s VAL 9 Cb -0.08 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 1yjv s VAL 9 CO 0.26 0.27 -0.06 0.54 0.00 0.00 0.00 175.10 176.11 1yjv s VAL 10 N -1.46 0.45 0.15 2.92 0.11 0.38 -0.72 120.40 122.23 1yjv s VAL 10 Ca 0.42 -0.61 -0.07 0.00 -2.93 0.00 0.00 61.98 58.78 1yjv s VAL 10 Cb -0.18 -0.45 -0.01 0.00 -1.53 0.00 0.00 36.38 34.21 1yjv s VAL 10 CO 0.22 -0.12 0.23 0.00 -3.33 0.00 0.00 175.10 172.10 1yjv s ARG 11 N -0.79 1.08 0.00 1.54 1.70 0.31 -4.42 118.95 118.37 1yjv s ARG 11 Ca -0.04 -1.20 0.00 0.00 -0.47 0.00 0.00 55.73 54.02 1yjv s ARG 11 Cb -0.06 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.67 1yjv s ARG 11 CO 0.00 -0.38 0.00 0.41 -1.08 0.00 0.00 175.30 174.25 1yjv n GLY 12 N -0.18 0.55 3.53 3.88 0.00 -1.26 -1.03 105.19 110.69 1yjv n GLY 12 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1yjv n GLY 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1yjv n MET 13 N -1.32 2.13 0.18 1.61 2.81 -1.26 -4.77 117.12 116.50 1yjv n MET 13 Ca 0.00 -2.69 0.13 0.00 -1.81 0.00 0.00 57.70 53.33 1yjv n MET 13 Cb 0.00 -3.60 0.64 0.00 -0.71 0.00 0.00 33.22 29.55 1yjv n MET 13 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1yjv h THR 14 N 5.82 0.00 -2.64 2.03 1.03 -1.98 -3.46 112.91 113.71 1yjv h THR 14 Ca 0.31 -0.13 0.11 0.00 -0.01 0.00 0.00 66.41 66.70 1yjv h THR 14 Cb 0.89 0.80 -0.04 0.00 -1.07 0.00 0.00 68.15 68.74 1yjv h THR 14 CO 1.36 0.00 0.45 0.00 -0.01 0.00 0.00 175.52 177.32 1yjv h ALA 16 N 2.00 1.72 -0.17 0.00 0.00 -1.99 0.12 119.26 120.93 1yjv h ALA 16 Ca -0.27 0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1yjv h ALA 16 Cb 1.23 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1yjv h ALA 16 CO 0.33 -0.15 0.16 0.77 0.00 0.00 0.00 179.25 180.36 1yjv h SER 17 N 0.68 0.00 0.19 0.00 0.02 -1.98 0.08 113.55 112.54 1yjv h SER 17 Ca 0.61 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.55 1yjv h SER 17 Cb 1.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1yjv h SER 17 CO -0.43 0.00 -0.09 0.00 -1.14 0.00 0.00 176.83 175.17 1yjv h VAL 19 N -0.67 0.10 -0.07 0.00 2.07 -0.49 0.21 116.25 117.40 1yjv h VAL 19 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1yjv h VAL 19 Cb 0.19 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1yjv h VAL 19 CO 0.04 0.00 0.04 1.12 0.02 0.00 0.00 177.57 178.79 1yjv h HIS 20 N -0.19 0.09 -0.24 1.57 2.07 -1.29 -2.60 115.15 114.55 1yjv h HIS 20 Ca 0.20 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.55 1yjv h HIS 20 Cb 0.56 -0.03 -0.00 0.00 2.57 0.00 0.00 27.41 30.51 1yjv h HIS 20 CO -0.71 0.07 -0.56 -0.22 -3.07 0.00 0.00 177.93 173.44 1yjv h LYS 21 N 0.10 0.75 0.31 5.12 3.64 -0.76 0.73 116.57 126.45 1yjv h LYS 21 Ca 0.03 -0.48 -0.01 0.00 -1.27 0.00 0.00 60.65 58.92 1yjv h LYS 21 Cb 0.01 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1yjv h LYS 21 CO -0.00 1.10 -0.26 0.82 -2.27 0.00 0.00 179.45 178.84 1yjv h ILE 22 N 0.57 0.00 0.05 2.00 2.04 -1.09 0.18 117.51 121.26 1yjv h ILE 22 Ca 0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1yjv h ILE 22 Cb 1.14 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1yjv h ILE 22 CO 0.12 0.00 -0.42 -0.08 0.00 0.00 0.00 178.15 177.76 1yjv h GLU 23 N -0.56 -0.59 -0.73 2.37 4.57 -1.56 0.15 114.58 118.24 1yjv h GLU 23 Ca -0.04 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.27 1yjv h GLU 23 Cb 0.47 0.13 -0.07 0.00 -0.16 0.00 0.00 28.75 29.12 1yjv h GLU 23 CO -0.00 -0.39 0.38 1.03 -1.18 0.00 0.00 179.01 178.84 1yjv h SER 24 N -0.61 0.50 -0.03 1.04 0.87 -0.80 0.27 113.55 114.79 1yjv h SER 24 Ca 0.03 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1yjv h SER 24 Cb 0.67 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1yjv h SER 24 CO -0.29 0.29 -0.05 -1.28 -0.53 0.00 0.00 176.83 174.97 1yjv h SER 25 N 0.64 0.09 0.08 6.23 0.87 -0.26 -3.36 113.55 117.84 1yjv h SER 25 Ca 0.36 -0.57 -0.00 0.00 -1.23 0.00 0.00 61.79 60.34 1yjv h SER 25 Cb 0.37 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1yjv h SER 25 CO -0.26 0.65 -0.04 0.25 -0.53 0.00 0.00 176.83 176.89 1yjv h LEU 26 N -0.46 -0.09 -2.77 2.23 5.85 -0.32 -3.35 115.31 116.41 1yjv h LEU 26 Ca 0.00 -0.51 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1yjv h LEU 26 Cb 0.63 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1yjv h LEU 26 CO 0.01 0.53 0.02 0.74 -0.34 0.00 0.00 178.44 179.40 1yjv h THR 27 N -0.77 0.17 0.00 1.05 2.02 -0.66 0.14 112.91 114.87 1yjv h THR 27 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1yjv h THR 27 Cb 0.59 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1yjv h THR 27 CO 0.02 0.00 -0.05 0.07 0.37 0.00 0.00 175.52 175.93 1yjv h LYS 28 N 0.00 0.00 -6.06 6.66 2.10 -1.70 -3.41 116.57 114.15 1yjv h LYS 28 Ca 0.00 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 58.11 1yjv h LYS 28 Cb 0.05 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.36 1yjv h LYS 28 CO -0.00 0.05 1.38 -1.01 -2.00 0.00 0.00 179.45 177.87 1yjv s HIS 29 N -4.06 1.57 -0.66 0.07 3.76 0.49 -4.89 115.29 111.57 1yjv s HIS 29 Ca -0.02 0.79 -0.28 0.00 -0.15 0.00 0.00 55.06 55.40 1yjv s HIS 29 Cb 0.12 -4.01 -0.12 0.00 1.11 0.00 0.00 32.58 29.68 1yjv s HIS 29 CO 0.52 -2.89 2.51 0.54 -0.85 0.00 0.00 174.74 174.57 1yjv n ARG 30 N 8.75 0.68 0.00 1.40 1.74 -1.26 -0.56 116.66 127.41 1yjv n ARG 30 Ca 0.25 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 1yjv n ARG 30 Cb 0.49 -2.74 0.00 0.00 -1.02 0.00 0.00 32.46 29.19 1yjv n ARG 30 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yjv n GLY 31 N 6.20 1.88 3.82 -0.13 0.00 -1.26 -4.81 105.19 110.89 1yjv n GLY 31 Ca 0.47 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 46.03 1yjv n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yjv s ILE 32 N 0.00 4.38 -0.08 -0.61 -1.09 0.28 -0.07 121.20 124.01 1yjv s ILE 32 Ca 0.00 1.40 -0.03 0.00 -2.23 0.00 0.00 60.65 59.79 1yjv s ILE 32 Cb 0.00 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.23 1yjv s ILE 32 CO 0.00 -0.40 -0.10 0.18 -1.23 0.00 0.00 174.94 173.39 1yjv n LEU 33 N -0.90 1.13 -3.61 2.97 4.77 0.77 -4.90 117.00 117.24 1yjv n LEU 33 Ca 0.07 0.07 -0.16 0.00 -0.03 0.00 0.00 56.01 55.96 1yjv n LEU 33 Cb 0.54 -0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.32 1yjv n LEU 33 CO 0.39 0.27 0.29 -0.47 -1.33 0.00 0.00 177.39 176.55 1yjv s TYR 34 N -2.15 -0.48 -0.61 -1.77 5.04 -0.76 -4.95 117.35 111.67 1yjv s TYR 34 Ca -0.11 0.79 0.05 0.00 -2.44 0.00 0.00 57.07 55.35 1yjv s TYR 34 Cb 0.04 0.30 0.17 0.00 0.35 0.00 0.00 41.96 42.82 1yjv s TYR 34 CO 0.15 -0.54 0.44 0.00 -1.34 0.00 0.00 175.55 174.26 1yjv n SER 36 N 2.29 4.42 -4.83 0.00 2.88 -0.04 -4.71 113.62 113.63 1yjv n SER 36 Ca 0.22 -2.87 -0.38 0.00 -1.33 0.00 0.00 58.87 54.51 1yjv n SER 36 Cb 0.38 -1.71 -0.06 0.00 -0.75 0.00 0.00 64.21 62.07 1yjv n SER 36 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1yjv s VAL 37 N 5.01 4.88 -0.18 2.46 0.11 -1.26 -1.57 120.40 129.86 1yjv s VAL 37 Ca 0.55 0.98 -0.05 0.00 -2.93 0.00 0.00 61.98 60.53 1yjv s VAL 37 Cb 0.05 -3.79 0.09 0.00 -1.53 0.00 0.00 36.38 31.20 1yjv s VAL 37 CO 0.06 0.50 0.35 0.00 -3.33 0.00 0.00 175.10 172.68 1yjv s ALA 38 N -1.17 -0.88 0.61 1.54 0.00 -1.03 -5.00 121.76 115.83 1yjv s ALA 38 Ca 0.29 1.17 0.34 0.00 0.00 0.00 0.00 51.96 53.75 1yjv s ALA 38 Cb -0.17 -1.25 1.83 0.00 0.00 0.00 0.00 23.12 23.53 1yjv s ALA 38 CO 0.17 -0.79 2.03 1.37 0.00 0.00 0.00 175.76 178.54 1yjv h LEU 39 N 8.22 0.00 -1.28 0.00 8.10 -1.90 0.32 115.31 128.77 1yjv h LEU 39 Ca -0.16 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 57.80 1yjv h LEU 39 Cb 1.12 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.32 1yjv h LEU 39 CO 0.15 0.00 0.07 0.00 -4.11 0.00 0.00 178.44 174.55 1yjv h ALA 40 N 1.56 1.42 -0.00 0.17 0.00 -1.97 -3.25 119.26 117.19 1yjv h ALA 40 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1yjv h ALA 40 Cb 0.43 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1yjv h ALA 40 CO 0.00 0.42 -0.05 -2.37 0.00 0.00 0.00 179.25 177.25 1yjv n THR 41 N -4.32 0.00 -2.08 0.00 5.66 -0.09 -5.01 114.28 108.43 1yjv n THR 41 Ca 0.02 -0.47 -0.20 0.00 -3.05 0.00 0.00 64.05 60.35 1yjv n THR 41 Cb 0.20 1.01 -0.04 0.00 -1.55 0.00 0.00 70.33 69.95 1yjv n THR 41 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1yjv n ASN 42 N -0.83 -5.60 -4.87 1.09 4.13 0.92 -4.97 115.26 105.13 1yjv n ASN 42 Ca 0.00 0.17 -0.21 0.00 1.68 0.00 0.00 54.58 56.22 1yjv n ASN 42 Cb 0.02 -4.71 -0.03 0.00 -1.54 0.00 0.00 39.78 33.51 1yjv n ASN 42 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1yjv s LYS 43 N -4.51 2.95 -0.35 3.52 0.00 -1.23 -0.47 119.74 119.64 1yjv s LYS 43 Ca 0.00 -1.08 -0.00 0.00 0.00 0.00 0.00 55.97 54.89 1yjv s LYS 43 Cb 0.00 -2.60 0.14 0.00 0.00 0.00 0.00 37.83 35.36 1yjv s LYS 43 CO 0.00 0.28 0.21 0.00 0.00 0.00 0.00 175.35 175.84 1yjv s ALA 44 N -2.17 0.94 -1.18 0.59 0.00 1.00 -2.45 121.76 118.49 1yjv s ALA 44 Ca 0.36 -1.84 -0.20 0.00 0.00 0.00 0.00 51.96 50.28 1yjv s ALA 44 Cb -0.08 -1.60 0.05 0.00 0.00 0.00 0.00 23.12 21.49 1yjv s ALA 44 CO 0.26 -2.09 1.66 -1.58 0.00 0.00 0.00 175.76 174.02 1yjv s HIS 45 N 1.10 2.60 0.69 0.00 5.04 -0.61 -1.43 115.29 122.68 1yjv s HIS 45 Ca 0.18 -1.13 -0.10 0.00 -1.54 0.00 0.00 55.06 52.47 1yjv s HIS 45 Cb -0.23 -4.66 0.02 0.00 0.04 0.00 0.00 32.58 27.76 1yjv s HIS 45 CO -0.01 -1.81 1.06 0.96 -2.34 0.00 0.00 174.74 172.60 1yjv s ILE 46 N 5.19 3.35 -0.05 0.89 -4.36 -0.10 -0.87 121.20 125.26 1yjv s ILE 46 Ca 0.53 0.32 0.03 0.00 -0.26 0.00 0.00 60.65 61.27 1yjv s ILE 46 Cb 0.02 -3.41 0.00 0.00 1.25 0.00 0.00 42.46 40.32 1yjv s ILE 46 CO 0.02 -0.52 -0.14 -0.54 0.24 0.00 0.00 174.94 174.00 1yjv s LYS 47 N -5.30 1.63 0.30 0.37 1.02 0.81 -2.28 119.74 116.30 1yjv s LYS 47 Ca 0.58 -0.50 0.00 0.00 0.02 0.00 0.00 55.97 56.07 1yjv s LYS 47 Cb -0.11 -1.40 -0.02 0.00 -0.52 0.00 0.00 37.83 35.78 1yjv s LYS 47 CO 0.50 0.16 0.34 1.52 -0.92 0.00 0.00 175.35 176.95 1yjv s TYR 48 N 0.24 1.27 -0.12 3.18 1.13 -0.07 -0.16 117.35 122.83 1yjv s TYR 48 Ca -0.07 -1.40 -0.01 0.00 -1.41 0.00 0.00 57.07 54.19 1yjv s TYR 48 Cb -0.12 -0.38 -0.02 0.00 -1.10 0.00 0.00 41.96 40.34 1yjv s TYR 48 CO 0.02 -0.93 -0.09 0.34 -2.51 0.00 0.00 175.55 172.38 1yjv s ASP 49 N -3.25 4.41 0.38 -0.18 -1.08 0.91 -4.12 116.67 113.73 1yjv s ASP 49 Ca 0.35 -0.18 0.27 0.00 -0.52 0.00 0.00 52.55 52.47 1yjv s ASP 49 Cb 0.02 -1.51 0.86 0.00 -1.46 0.00 0.00 42.92 40.84 1yjv s ASP 49 CO 0.20 0.22 1.77 1.55 0.52 0.00 0.00 175.17 179.44 1yjv h PRO 50 N 6.27 0.00 0.00 4.34 0.13 -1.77 -2.89 132.00 138.08 1yjv h PRO 50 Ca -0.34 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.57 1yjv h PRO 50 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1yjv h PRO 50 CO 0.57 0.00 -1.22 0.93 -0.23 0.00 0.00 178.00 178.05 1yjv h GLU 51 N 0.00 0.00 -0.04 0.86 5.08 -1.96 -3.39 114.58 115.13 1yjv h GLU 51 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1yjv h GLU 51 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1yjv h GLU 51 CO 0.00 0.98 0.00 0.44 -1.00 0.00 0.00 179.01 179.43 1yjv n ILE 52 N -4.44 0.05 -3.67 3.13 -5.35 -1.25 -4.66 119.36 103.17 1yjv n ILE 52 Ca -0.31 -0.17 -0.09 0.00 -0.27 0.00 0.00 62.75 61.90 1yjv n ILE 52 Cb 0.67 0.10 -0.10 0.00 -1.74 0.00 0.00 39.64 38.58 1yjv n ILE 52 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 1yjv s ILE 53 N -1.95 -0.43 0.48 7.28 -1.16 -1.09 -4.71 121.20 119.62 1yjv s ILE 53 Ca 0.38 0.14 -0.21 0.00 -0.51 0.00 0.00 60.65 60.44 1yjv s ILE 53 Cb 0.19 -0.66 -0.08 0.00 0.61 0.00 0.00 42.46 42.53 1yjv s ILE 53 CO 0.31 0.06 1.09 -0.83 -2.81 0.00 0.00 174.94 172.76 1yjv s GLY 54 N 2.19 2.63 0.21 1.50 0.00 -1.26 -4.23 107.32 108.36 1yjv s GLY 54 Ca -0.04 0.74 -0.09 0.00 0.00 0.00 0.00 44.72 45.33 1yjv s GLY 54 CO -0.13 1.12 1.80 -0.56 0.00 0.00 0.00 173.10 175.33 1yjv h PRO 55 N 1.73 0.66 -0.92 2.90 0.13 -1.92 0.83 132.00 135.40 1yjv h PRO 55 Ca -0.49 -0.04 0.24 0.00 -0.87 0.00 0.00 66.00 64.83 1yjv h PRO 55 Cb 1.24 -0.15 -0.06 0.00 0.13 0.00 0.00 31.00 32.16 1yjv h PRO 55 CO 0.59 0.43 0.63 -0.09 -0.23 0.00 0.00 178.00 179.34 1yjv h ARG 56 N 0.68 0.22 -0.14 0.86 9.65 -1.98 -0.15 114.38 123.51 1yjv h ARG 56 Ca 0.30 -0.01 -0.14 0.00 -1.10 0.00 0.00 59.98 59.03 1yjv h ARG 56 Cb 0.20 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.74 1yjv h ARG 56 CO -0.19 0.14 -0.45 -0.44 2.80 0.00 0.00 179.97 181.84 1yjv h ASP 57 N 0.22 0.64 -0.51 -3.80 3.32 -1.21 0.51 116.42 115.59 1yjv h ASP 57 Ca 0.47 -0.60 0.10 0.00 0.02 0.00 0.00 57.03 57.02 1yjv h ASP 57 Cb 1.46 -0.19 -0.10 0.00 0.22 0.00 0.00 39.33 40.72 1yjv h ASP 57 CO -0.11 1.13 -0.18 0.40 -1.72 0.00 0.00 179.24 178.76 1yjv h ILE 58 N 0.19 0.40 -0.55 0.35 2.04 -0.72 0.20 117.51 119.43 1yjv h ILE 58 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.87 1yjv h ILE 58 Cb 1.07 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 1yjv h ILE 58 CO 0.10 0.00 0.33 0.40 0.00 0.00 0.00 178.15 178.98 1yjv h ILE 59 N -0.06 1.06 -0.70 -0.67 1.08 -0.70 -0.98 117.51 116.53 1yjv h ILE 59 Ca 0.24 -0.22 0.14 0.00 -0.39 0.00 0.00 64.86 64.63 1yjv h ILE 59 Cb 0.43 0.35 -0.10 0.00 -3.07 0.00 0.00 36.82 34.43 1yjv h ILE 59 CO -0.56 0.12 0.19 0.45 -0.69 0.00 0.00 178.15 177.66 1yjv h HIS 60 N 0.65 0.31 0.26 1.37 3.86 0.95 0.16 115.15 122.71 1yjv h HIS 60 Ca 0.22 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.46 1yjv h HIS 60 Cb 0.02 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1yjv h HIS 60 CO -0.06 -0.04 -0.12 1.15 0.86 0.00 0.00 177.93 179.72 1yjv h THR 61 N 0.31 0.80 -0.33 2.45 2.02 -0.35 0.16 112.91 117.95 1yjv h THR 61 Ca 0.39 -0.52 0.07 0.00 0.77 0.00 0.00 66.41 67.13 1yjv h THR 61 Cb 0.62 1.08 -0.08 0.00 -1.74 0.00 0.00 68.15 68.04 1yjv h THR 61 CO -0.46 0.11 -0.20 0.40 0.37 0.00 0.00 175.52 175.74 1yjv h ILE 62 N -0.62 0.44 0.13 3.11 2.04 -0.51 0.43 117.51 122.53 1yjv h ILE 62 Ca -0.04 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1yjv h ILE 62 Cb 0.44 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 1yjv h ILE 62 CO 0.06 0.00 -0.34 -0.33 0.00 0.00 0.00 178.15 177.54 1yjv h GLU 63 N -0.16 -0.55 0.00 2.37 5.08 -0.66 -0.78 114.58 119.88 1yjv h GLU 63 Ca 0.17 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1yjv h GLU 63 Cb 0.42 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1yjv h GLU 63 CO -0.43 -0.37 -0.12 1.03 -1.00 0.00 0.00 179.01 178.13 1yjv h SER 64 N -0.57 0.00 0.00 1.42 0.87 0.35 -3.29 113.55 112.33 1yjv h SER 64 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1yjv h SER 64 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1yjv h SER 64 CO -0.19 0.12 0.00 0.18 -0.53 0.00 0.00 176.83 176.41 1yjv n LEU 65 N -3.85 0.00 -1.69 2.23 4.32 0.04 -5.00 117.00 113.06 1yjv n LEU 65 Ca -0.02 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 55.92 1yjv n LEU 65 Cb 0.22 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.03 1yjv n LEU 65 CO 0.31 0.00 0.47 0.61 -1.22 0.00 0.00 177.39 177.56 1yjv n GLY 66 N 2.40 1.14 3.32 -0.72 0.00 -1.16 -5.10 105.19 105.07 1yjv n GLY 66 Ca 0.00 -0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 1yjv n GLY 66 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yjv s PHE 67 N 0.05 1.53 0.24 1.61 0.08 -0.31 -4.84 117.98 116.34 1yjv s PHE 67 Ca 0.04 -0.83 0.11 0.00 0.12 0.00 0.00 56.93 56.36 1yjv s PHE 67 Cb 0.19 -0.85 -0.05 0.00 -0.57 0.00 0.00 43.02 41.74 1yjv s PHE 67 CO -0.05 0.05 -0.14 -1.21 -0.10 0.00 0.00 175.22 173.77 1yjv s GLU 68 N -3.80 1.88 0.21 0.44 2.02 -0.19 -3.18 118.70 116.07 1yjv s GLU 68 Ca 0.25 -1.52 -0.17 0.00 0.02 0.00 0.00 54.97 53.55 1yjv s GLU 68 Cb 0.04 -1.97 0.02 0.00 0.10 0.00 0.00 34.13 32.33 1yjv s GLU 68 CO 0.07 0.38 0.53 0.00 0.02 0.00 0.00 175.26 176.25 1yjv s ALA 69 N -2.11 -0.89 -0.07 5.21 0.00 -1.26 -0.53 121.76 122.12 1yjv s ALA 69 Ca 0.27 -0.29 -0.22 0.00 0.00 0.00 0.00 51.96 51.71 1yjv s ALA 69 Cb -0.07 0.87 0.05 0.00 0.00 0.00 0.00 23.12 23.97 1yjv s ALA 69 CO 0.15 -0.82 0.51 -1.54 0.00 0.00 0.00 175.76 174.06 1yjv s SER 70 N -2.89 -0.47 -0.03 0.00 1.04 0.10 -4.98 113.70 106.48 1yjv s SER 70 Ca 0.11 0.56 -0.30 0.00 0.48 0.00 0.00 55.95 56.79 1yjv s SER 70 Cb -0.01 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 1yjv s SER 70 CO -0.01 -0.46 1.30 -1.48 0.98 0.00 0.00 173.24 173.57 1yjv s LEU 71 N -0.94 4.30 -0.04 2.42 2.34 -1.26 -0.23 118.68 125.26 1yjv s LEU 71 Ca -0.10 1.96 0.06 0.00 0.06 0.00 0.00 54.13 56.12 1yjv s LEU 71 Cb -0.03 -3.56 -0.02 0.00 -0.56 0.00 0.00 46.19 42.02 1yjv s LEU 71 CO 0.06 -0.66 -0.22 0.54 -1.06 0.00 0.00 176.35 175.01 1yjv s VAL 72 N 2.34 2.34 0.00 1.48 0.11 -1.26 -4.80 120.40 120.61 1yjv s VAL 72 Ca 0.60 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1yjv s VAL 72 Cb -0.28 -1.85 0.00 0.00 -1.53 0.00 0.00 36.38 32.71 1yjv s VAL 72 CO 0.24 0.58 0.00 2.29 -3.33 0.00 0.00 175.10 174.88 1yjv n LYS 73 N 2.55 0.00 -0.12 1.54 0.00 -1.26 -4.82 118.16 116.04 1yjv n LYS 73 Ca -0.17 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 57.92 1yjv n LYS 73 Cb 0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 35.03 35.47 1yjv n LYS 73 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1yjv n ILE 74 N -1.36 1.50 -0.77 0.58 2.08 -1.26 -5.29 119.36 114.83 1yjv n ILE 74 Ca 0.00 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 63.11 1yjv n ILE 74 Cb 0.00 -2.03 0.00 0.00 -0.75 0.00 0.00 39.64 36.86 1yjv n ILE 74 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32