#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 0.05 3.34 3.03 0.00 -1.26 -5.09 105.19 105.27 1yjv n GLY 2 Ca 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 1yjv n GLY 2 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1yjv s ASP 3 N -4.00 -0.32 -0.12 1.61 1.47 -1.26 -4.57 116.67 109.48 1yjv s ASP 3 Ca 0.00 -0.22 0.01 0.00 1.18 0.00 0.00 52.55 53.51 1yjv s ASP 3 Cb 0.00 0.51 0.02 0.00 -0.34 0.00 0.00 42.92 43.11 1yjv s ASP 3 CO 0.00 -0.88 -0.13 -0.83 0.68 0.00 0.00 175.17 174.01 1yjv s GLY 4 N -2.77 0.98 -0.47 2.12 0.00 0.14 -4.82 107.32 102.49 1yjv s GLY 4 Ca 0.02 -0.69 -0.25 0.00 0.00 0.00 0.00 44.72 43.79 1yjv s GLY 4 CO -0.12 0.45 0.93 0.54 0.00 0.00 0.00 173.10 174.90 1yjv s VAL 5 N 1.28 4.46 -0.84 1.40 0.11 -1.26 -2.16 120.40 123.39 1yjv s VAL 5 Ca -0.01 0.68 -0.09 0.00 -2.93 0.00 0.00 61.98 59.62 1yjv s VAL 5 Cb -0.14 -4.45 0.22 0.00 -1.53 0.00 0.00 36.38 30.48 1yjv s VAL 5 CO -0.05 -0.88 0.75 -0.76 -3.33 0.00 0.00 175.10 170.83 1yjv s LEU 6 N 3.79 6.19 -0.95 2.54 2.01 0.38 -4.97 118.68 127.67 1yjv s LEU 6 Ca 0.36 -3.01 -0.23 0.00 0.01 0.00 0.00 54.13 51.26 1yjv s LEU 6 Cb -0.10 -2.09 0.06 0.00 0.01 0.00 0.00 46.19 44.07 1yjv s LEU 6 CO 0.25 -0.43 1.35 -0.70 1.01 0.00 0.00 176.35 177.83 1yjv s GLU 7 N -0.32 3.51 0.21 1.70 2.12 -1.26 -0.48 118.70 124.18 1yjv s GLU 7 Ca 0.21 -1.09 0.06 0.00 0.36 0.00 0.00 54.97 54.51 1yjv s GLU 7 Cb -0.12 -5.06 -0.04 0.00 0.26 0.00 0.00 34.13 29.17 1yjv s GLU 7 CO -0.08 -2.11 0.18 -0.48 -0.54 0.00 0.00 175.26 172.24 1yjv s LEU 8 N 4.64 3.85 0.27 2.70 0.05 -0.44 -4.20 118.68 125.54 1yjv s LEU 8 Ca 0.41 -0.17 -0.29 0.00 0.05 0.00 0.00 54.13 54.13 1yjv s LEU 8 Cb -0.03 -2.41 -0.09 0.00 -2.05 0.00 0.00 46.19 41.60 1yjv s LEU 8 CO -0.05 0.01 0.97 -0.69 -0.55 0.00 0.00 176.35 176.03 1yjv s VAL 9 N -1.95 4.00 -0.12 1.48 1.01 0.47 -0.52 120.40 124.77 1yjv s VAL 9 Ca 0.32 1.93 0.01 0.00 0.00 0.00 0.00 61.98 64.25 1yjv s VAL 9 Cb -0.09 -4.20 0.02 0.00 0.00 0.00 0.00 36.38 32.11 1yjv s VAL 9 CO 0.25 0.40 -0.14 -0.69 0.00 0.00 0.00 175.10 174.91 1yjv s VAL 10 N -1.27 1.47 0.15 2.92 1.01 0.59 -0.47 120.40 124.78 1yjv s VAL 10 Ca 0.44 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.89 1yjv s VAL 10 Cb -0.25 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 1yjv s VAL 10 CO 0.32 0.44 -0.06 -0.13 0.00 0.00 0.00 175.10 175.66 1yjv s ARG 11 N 1.15 2.21 0.00 2.72 0.52 0.07 -4.02 118.95 121.60 1yjv s ARG 11 Ca -0.03 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.06 1yjv s ARG 11 Cb -0.14 -2.29 0.00 0.00 0.52 0.00 0.00 34.95 33.04 1yjv s ARG 11 CO -0.04 0.47 0.00 0.41 0.02 0.00 0.00 175.30 176.16 1yjv n GLY 12 N 0.25 0.32 3.32 -3.53 0.00 -1.26 -0.64 105.19 103.65 1yjv n GLY 12 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.00 1.51 0.02 1.61 2.81 -1.26 -4.73 117.12 115.08 1yjv n MET 13 Ca 0.00 -2.10 -0.03 0.00 -1.81 0.00 0.00 57.70 53.75 1yjv n MET 13 Cb 0.00 -3.27 0.20 0.00 -0.71 0.00 0.00 33.22 29.45 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 5.23 1.27 -3.59 2.03 1.03 -1.98 -3.47 112.91 113.42 1yjv h THR 14 Ca 0.33 -1.28 -0.08 0.00 -0.01 0.00 0.00 66.41 65.37 1yjv h THR 14 Cb 0.79 1.37 -0.07 0.00 -1.07 0.00 0.00 68.15 69.16 1yjv h THR 14 CO 1.64 0.40 -0.05 0.00 -0.01 0.00 0.00 175.52 177.51 1yjv h ALA 16 N 2.17 1.39 -0.42 0.00 0.00 -1.98 0.15 119.26 120.56 1yjv h ALA 16 Ca -0.27 0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1yjv h ALA 16 Cb 1.25 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1yjv h ALA 16 CO 0.35 -0.53 0.28 0.77 0.00 0.00 0.00 179.25 180.13 1yjv h SER 17 N 0.18 0.38 0.33 0.00 0.02 -1.99 0.40 113.55 112.86 1yjv h SER 17 Ca 0.60 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.53 1yjv h SER 17 Cb 1.26 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1yjv h SER 17 CO -0.70 0.26 -0.16 0.00 -1.14 0.00 0.00 176.83 175.10 1yjv h VAL 19 N -0.99 0.00 0.00 0.00 2.07 -0.60 -0.13 116.25 116.60 1yjv h VAL 19 Ca -0.04 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.41 1yjv h VAL 19 Cb 0.49 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1yjv h VAL 19 CO 0.07 0.00 -0.33 1.12 0.02 0.00 0.00 177.57 178.46 1yjv h HIS 20 N -0.59 0.00 -0.43 1.57 2.07 -1.15 -2.70 115.15 113.92 1yjv h HIS 20 Ca 0.02 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.40 1yjv h HIS 20 Cb 0.65 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.62 1yjv h HIS 20 CO -0.54 0.33 -0.27 -0.22 -3.07 0.00 0.00 177.93 174.16 1yjv h LYS 21 N 0.00 0.92 0.62 5.12 1.63 -1.25 0.65 116.57 124.27 1yjv h LYS 21 Ca -0.00 -0.42 -0.03 0.00 -0.85 0.00 0.00 60.65 59.36 1yjv h LYS 21 Cb 0.64 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.24 1yjv h LYS 21 CO 0.04 1.07 -0.44 0.82 -3.45 0.00 0.00 179.45 177.50 1yjv h ILE 22 N 0.78 0.00 -0.40 2.00 2.04 -0.75 0.32 117.51 121.50 1yjv h ILE 22 Ca 0.09 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.00 1yjv h ILE 22 Cb 0.84 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.84 1yjv h ILE 22 CO 0.07 0.00 -0.55 -0.33 0.00 0.00 0.00 178.15 177.34 1yjv h GLU 23 N -1.01 -0.38 -0.95 2.37 5.08 -1.45 0.11 114.58 118.34 1yjv h GLU 23 Ca -0.08 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.39 1yjv h GLU 23 Cb 0.83 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.10 1yjv h GLU 23 CO 0.05 -0.26 0.61 1.03 -1.00 0.00 0.00 179.01 179.44 1yjv h SER 24 N -0.40 0.93 0.26 1.42 0.87 -0.80 0.31 113.55 116.14 1yjv h SER 24 Ca 0.08 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1yjv h SER 24 Cb 0.60 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1yjv h SER 24 CO -0.59 0.57 -0.12 -1.28 -0.53 0.00 0.00 176.83 174.87 1yjv h SER 25 N 1.03 -0.30 -0.38 6.23 0.87 0.48 -3.30 113.55 118.18 1yjv h SER 25 Ca 0.43 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.72 1yjv h SER 25 Cb 0.29 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 1yjv h SER 25 CO -0.18 0.17 0.12 -0.07 -0.53 0.00 0.00 176.83 176.34 1yjv h LEU 26 N -0.87 0.61 -6.26 2.23 4.07 -0.46 -3.17 115.31 111.45 1yjv h LEU 26 Ca -0.04 -0.09 -0.57 0.00 0.08 0.00 0.00 57.88 57.27 1yjv h LEU 26 Cb 0.51 -0.16 0.05 0.00 1.08 0.00 0.00 40.66 42.14 1yjv h LEU 26 CO 0.06 0.60 2.28 0.41 -1.08 0.00 0.00 178.44 180.71 1yjv n THR 27 N -4.32 1.79 0.00 0.22 -1.04 0.07 -2.10 114.28 108.91 1yjv n THR 27 Ca 0.03 -1.42 0.00 0.00 -2.04 0.00 0.00 64.05 60.62 1yjv n THR 27 Cb 0.19 -2.24 0.00 0.00 -1.82 0.00 0.00 70.33 66.47 1yjv n THR 27 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1yjv n LYS 28 N 6.38 0.00 -1.94 -2.82 2.85 -1.20 -4.93 118.16 116.51 1yjv n LYS 28 Ca 0.47 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 57.30 1yjv n LYS 28 Cb 0.33 -0.03 -0.03 0.00 -0.65 0.00 0.00 35.03 34.66 1yjv n LYS 28 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1yjv s HIS 29 N -1.26 1.73 0.44 5.58 3.76 -0.89 -4.83 115.29 119.82 1yjv s HIS 29 Ca 0.00 0.56 0.39 0.00 -0.15 0.00 0.00 55.06 55.87 1yjv s HIS 29 Cb 0.00 -4.08 2.10 0.00 1.11 0.00 0.00 32.58 31.71 1yjv s HIS 29 CO 0.00 -3.22 2.20 0.00 -0.85 0.00 0.00 174.74 172.87 1yjv h ARG 30 N 12.86 0.00 -1.00 1.40 3.08 -1.98 0.90 114.38 129.64 1yjv h ARG 30 Ca -0.35 0.00 0.18 0.00 0.07 0.00 0.00 59.98 59.87 1yjv h ARG 30 Cb 1.18 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.13 1yjv h ARG 30 CO 1.01 0.00 0.62 0.78 -1.07 0.00 0.00 179.97 181.31 1yjv h GLY 31 N 0.16 1.71 -3.02 0.04 0.00 -1.88 -3.43 103.07 96.65 1yjv h GLY 31 Ca 0.00 -0.36 -0.50 0.00 0.00 0.00 0.00 47.33 46.47 1yjv h GLY 31 CO 0.00 -0.02 -0.19 -0.26 0.00 0.00 0.00 176.54 176.07 1yjv s ILE 32 N -5.84 5.09 -0.18 2.60 -5.25 0.31 -3.62 121.20 114.30 1yjv s ILE 32 Ca -0.11 -0.24 0.01 0.00 -0.99 0.00 0.00 60.65 59.32 1yjv s ILE 32 Cb 0.24 -3.79 -0.12 0.00 2.95 0.00 0.00 42.46 41.74 1yjv s ILE 32 CO 0.80 -0.42 -0.16 0.18 -1.79 0.00 0.00 174.94 173.55 1yjv n LEU 33 N -1.31 2.94 -3.64 0.37 4.77 0.62 -4.89 117.00 115.86 1yjv n LEU 33 Ca -0.03 -0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 55.74 1yjv n LEU 33 Cb 0.55 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 1yjv n LEU 33 CO 0.49 0.80 0.16 -0.47 -1.33 0.00 0.00 177.39 177.04 1yjv s TYR 34 N -2.36 -0.25 -0.01 -1.77 5.04 -0.11 -4.97 117.35 112.91 1yjv s TYR 34 Ca -0.25 0.10 0.00 0.00 -2.44 0.00 0.00 57.07 54.49 1yjv s TYR 34 Cb 0.06 0.24 0.01 0.00 0.35 0.00 0.00 41.96 42.63 1yjv s TYR 34 CO 0.42 -0.63 0.01 0.00 -1.34 0.00 0.00 175.55 174.01 1yjv s SER 36 N 0.50 -0.21 0.36 0.00 0.15 -0.06 -4.92 113.70 109.52 1yjv s SER 36 Ca -0.04 0.30 0.08 0.00 0.70 0.00 0.00 55.95 56.99 1yjv s SER 36 Cb -0.06 0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 64.64 1yjv s SER 36 CO -0.01 -0.25 0.13 0.68 1.20 0.00 0.00 173.24 174.98 1yjv s VAL 37 N -0.55 2.71 -0.05 4.45 -7.23 -1.26 -0.14 120.40 118.33 1yjv s VAL 37 Ca -0.07 -1.75 -0.05 0.00 -1.81 0.00 0.00 61.98 58.30 1yjv s VAL 37 Cb -0.04 -2.94 0.01 0.00 0.56 0.00 0.00 36.38 33.97 1yjv s VAL 37 CO 0.02 -0.13 0.14 0.00 -0.31 0.00 0.00 175.10 174.82 1yjv s ALA 38 N -2.50 -0.35 -0.03 1.32 0.00 -0.07 -4.96 121.76 115.18 1yjv s ALA 38 Ca 0.38 0.41 -0.11 0.00 0.00 0.00 0.00 51.96 52.64 1yjv s ALA 38 Cb -0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 23.12 22.82 1yjv s ALA 38 CO 0.22 -0.07 0.56 -0.07 0.00 0.00 0.00 175.76 176.40 1yjv h LEU 39 N 5.96 -0.32 -0.51 0.00 4.07 -1.94 -0.47 115.31 122.09 1yjv h LEU 39 Ca -0.25 0.01 0.05 0.00 0.08 0.00 0.00 57.88 57.77 1yjv h LEU 39 Cb 1.20 0.08 -0.05 0.00 1.08 0.00 0.00 40.66 42.97 1yjv h LEU 39 CO 0.42 -0.02 0.25 0.00 -1.08 0.00 0.00 178.44 178.00 1yjv h ALA 40 N -1.41 0.66 0.00 1.53 0.00 -1.98 0.92 119.26 118.98 1yjv h ALA 40 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1yjv h ALA 40 Cb 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1yjv h ALA 40 CO 0.06 -0.11 0.00 1.15 0.00 0.00 0.00 179.25 180.35 1yjv h THR 41 N 0.48 0.00 -5.79 0.00 2.02 -2.00 -3.48 112.91 104.14 1yjv h THR 41 Ca 0.23 -0.62 -0.28 0.00 0.77 0.00 0.00 66.41 66.51 1yjv h THR 41 Cb 0.16 1.59 0.11 0.00 -1.74 0.00 0.00 68.15 68.28 1yjv h THR 41 CO -0.18 0.00 -0.74 0.59 0.37 0.00 0.00 175.52 175.56 1yjv n ASN 42 N -2.59 -6.30 -4.20 4.18 4.13 0.32 -4.84 115.26 105.96 1yjv n ASN 42 Ca 0.04 -0.71 -0.12 0.00 1.68 0.00 0.00 54.58 55.47 1yjv n ASN 42 Cb 0.43 -4.35 -0.10 0.00 -1.54 0.00 0.00 39.78 34.22 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 -4.73 0.93 -0.15 3.52 -2.85 -0.27 -0.30 119.74 115.90 1yjv s LYS 43 Ca 0.35 -1.40 -0.03 0.00 -1.00 0.00 0.00 55.97 53.89 1yjv s LYS 43 Cb -0.08 -0.31 0.05 0.00 -2.06 0.00 0.00 37.83 35.43 1yjv s LYS 43 CO 0.80 -0.02 0.05 0.00 0.10 0.00 0.00 175.35 176.28 1yjv s ALA 44 N -3.56 0.67 -0.91 0.59 0.00 0.32 -0.89 121.76 117.98 1yjv s ALA 44 Ca 0.15 -0.37 -0.25 0.00 0.00 0.00 0.00 51.96 51.50 1yjv s ALA 44 Cb 0.05 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 22.22 1yjv s ALA 44 CO -0.02 -0.97 1.40 -1.58 0.00 0.00 0.00 175.76 174.59 1yjv s HIS 45 N 2.01 2.42 -0.06 0.00 2.46 0.81 -1.33 115.29 121.59 1yjv s HIS 45 Ca 0.02 -0.51 -0.17 0.00 0.47 0.00 0.00 55.06 54.87 1yjv s HIS 45 Cb -0.15 -4.65 -0.05 0.00 -0.13 0.00 0.00 32.58 27.59 1yjv s HIS 45 CO -0.07 -1.99 0.46 0.42 -2.47 0.00 0.00 174.74 171.08 1yjv s ILE 46 N 5.40 5.09 -0.19 0.89 -1.09 0.36 -0.88 121.20 130.78 1yjv s ILE 46 Ca 0.43 0.93 0.00 0.00 -2.23 0.00 0.00 60.65 59.78 1yjv s ILE 46 Cb -0.03 -3.78 0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1yjv s ILE 46 CO -0.00 0.44 -0.17 -0.54 -1.23 0.00 0.00 174.94 173.43 1yjv s LYS 47 N -0.17 3.05 0.05 2.79 -0.14 0.22 -0.47 119.74 125.06 1yjv s LYS 47 Ca 0.25 -0.80 -0.04 0.00 -1.36 0.00 0.00 55.97 54.02 1yjv s LYS 47 Cb -0.16 -2.64 -0.02 0.00 -1.68 0.00 0.00 37.83 33.33 1yjv s LYS 47 CO 0.12 -0.21 0.06 1.52 -0.76 0.00 0.00 175.35 176.08 1yjv s TYR 48 N 1.32 0.29 -0.33 3.18 -0.85 -0.92 -0.28 117.35 119.77 1yjv s TYR 48 Ca 0.05 -0.68 -0.21 0.00 -0.52 0.00 0.00 57.07 55.71 1yjv s TYR 48 Cb -0.13 -0.21 -0.00 0.00 0.38 0.00 0.00 41.96 42.00 1yjv s TYR 48 CO -0.11 -0.37 0.68 0.34 -1.52 0.00 0.00 175.55 174.57 1yjv s ASP 49 N -2.37 6.52 -0.88 -0.18 -1.08 -1.24 0.24 116.67 117.68 1yjv s ASP 49 Ca -0.02 0.40 -0.21 0.00 -0.52 0.00 0.00 52.55 52.20 1yjv s ASP 49 Cb 0.01 -2.35 -0.13 0.00 -1.46 0.00 0.00 42.92 38.99 1yjv s ASP 49 CO -0.06 -0.57 1.97 -0.81 0.52 0.00 0.00 175.17 176.22 1yjv n PRO 50 N 6.05 1.72 0.13 4.34 -0.04 -1.26 -2.43 135.00 143.51 1yjv n PRO 50 Ca 0.00 -1.97 0.00 0.00 -0.04 0.00 0.00 63.50 61.49 1yjv n PRO 50 Cb 0.49 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 30.96 1yjv n PRO 50 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1yjv n GLU 51 N 6.87 0.00 0.01 0.54 2.13 -1.26 -4.73 120.64 124.21 1yjv n GLU 51 Ca 0.50 0.00 0.12 0.00 0.66 0.00 0.00 57.16 58.44 1yjv n GLU 51 Cb 0.40 0.00 0.26 0.00 0.27 0.00 0.00 31.44 32.37 1yjv n GLU 51 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 1yjv n ILE 52 N -3.02 0.08 -3.51 6.31 -5.35 -1.02 -4.87 119.36 107.98 1yjv n ILE 52 Ca 0.00 -0.07 -0.14 0.00 -0.27 0.00 0.00 62.75 62.28 1yjv n ILE 52 Cb 0.00 0.10 -0.04 0.00 -1.74 0.00 0.00 39.64 37.96 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 -3.04 0.01 0.52 7.28 2.07 -1.20 -4.67 121.20 122.16 1yjv s ILE 53 Ca 0.10 -0.12 0.08 0.00 -1.41 0.00 0.00 60.65 59.30 1yjv s ILE 53 Cb 0.17 -1.00 0.08 0.00 0.13 0.00 0.00 42.46 41.83 1yjv s ILE 53 CO 0.69 -0.07 0.65 0.61 -1.91 0.00 0.00 174.94 174.92 1yjv n GLY 54 N 0.14 2.11 0.28 1.50 0.00 -1.26 -4.16 105.19 103.80 1yjv n GLY 54 Ca -0.18 -2.23 -0.11 0.00 0.00 0.00 0.00 46.02 43.50 1yjv n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yjv h PRO 55 N 0.00 0.96 -0.92 1.61 0.13 -2.00 -3.30 132.00 128.48 1yjv h PRO 55 Ca -0.26 -0.37 0.10 0.00 -0.87 0.00 0.00 66.00 64.61 1yjv h PRO 55 Cb 1.13 -0.05 -0.07 0.00 0.13 0.00 0.00 31.00 32.14 1yjv h PRO 55 CO 0.38 1.04 0.59 -0.09 -0.23 0.00 0.00 178.00 179.69 1yjv h ARG 56 N 0.82 0.87 0.04 0.86 1.12 -1.98 -0.69 114.38 115.42 1yjv h ARG 56 Ca 0.12 -0.05 -0.00 0.00 -1.11 0.00 0.00 59.98 58.94 1yjv h ARG 56 Cb 0.69 -0.20 0.00 0.00 -0.01 0.00 0.00 29.97 30.45 1yjv h ARG 56 CO 0.05 0.58 -0.02 -0.44 -3.11 0.00 0.00 179.97 177.03 1yjv h ASP 57 N 0.90 -0.05 -0.24 -3.80 5.19 -1.98 0.43 116.42 116.88 1yjv h ASP 57 Ca 0.43 -0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 1yjv h ASP 57 Cb 0.44 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.96 1yjv h ASP 57 CO -0.20 0.14 0.16 0.40 -3.12 0.00 0.00 179.24 176.62 1yjv h ILE 58 N -0.23 1.07 -0.75 0.35 5.03 -1.55 0.24 117.51 121.67 1yjv h ILE 58 Ca -0.01 -0.15 0.09 0.00 -0.12 0.00 0.00 64.86 64.67 1yjv h ILE 58 Cb 0.21 0.74 -0.07 0.00 -3.03 0.00 0.00 36.82 34.67 1yjv h ILE 58 CO 0.01 0.07 0.40 0.40 -0.68 0.00 0.00 178.15 178.35 1yjv h ILE 59 N 0.32 0.88 -0.13 -0.67 2.04 -0.96 0.60 117.51 119.59 1yjv h ILE 59 Ca 0.09 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.65 1yjv h ILE 59 Cb -0.02 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.20 1yjv h ILE 59 CO -0.02 0.12 -0.23 -0.74 0.00 0.00 0.00 178.15 177.28 1yjv h HIS 60 N 0.68 0.24 -0.13 1.37 -0.00 0.68 0.68 115.15 118.67 1yjv h HIS 60 Ca 0.36 -0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.68 1yjv h HIS 60 Cb 0.35 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.69 1yjv h HIS 60 CO -0.09 0.45 0.04 1.15 -0.00 0.00 0.00 177.93 179.48 1yjv h THR 61 N 0.20 1.17 -0.56 6.26 2.02 0.12 0.22 112.91 122.35 1yjv h THR 61 Ca 0.03 -0.52 0.08 0.00 0.77 0.00 0.00 66.41 66.77 1yjv h THR 61 Cb 0.53 1.27 -0.07 0.00 -1.74 0.00 0.00 68.15 68.15 1yjv h THR 61 CO 0.04 0.16 0.20 0.40 0.37 0.00 0.00 175.52 176.68 1yjv h ILE 62 N 0.04 0.79 0.13 3.11 2.04 -0.37 -0.21 117.51 123.04 1yjv h ILE 62 Ca 0.04 -0.13 0.02 0.00 1.00 0.00 0.00 64.86 65.79 1yjv h ILE 62 Cb 0.21 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1yjv h ILE 62 CO -0.00 0.07 -0.26 -0.33 0.00 0.00 0.00 178.15 177.63 1yjv h GLU 63 N 0.38 -0.46 -0.87 2.37 5.08 -0.69 -1.15 114.58 119.23 1yjv h GLU 63 Ca 0.28 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.75 1yjv h GLU 63 Cb 0.32 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.62 1yjv h GLU 63 CO -0.28 -0.31 0.57 1.03 -1.00 0.00 0.00 179.01 179.02 1yjv h SER 64 N -0.48 0.82 0.00 1.42 0.87 0.61 -3.23 113.55 113.57 1yjv h SER 64 Ca 0.03 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1yjv h SER 64 Cb 0.50 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1yjv h SER 64 CO -0.14 0.51 0.00 0.18 -0.53 0.00 0.00 176.83 176.85 1yjv n LEU 65 N -4.51 0.00 -1.00 2.23 7.99 -0.20 -4.96 117.00 116.55 1yjv n LEU 65 Ca 0.14 0.00 -0.07 0.00 -0.01 0.00 0.00 56.01 56.07 1yjv n LEU 65 Cb 0.25 0.00 -0.06 0.00 -0.11 0.00 0.00 43.42 43.50 1yjv n LEU 65 CO 0.32 0.00 0.34 0.61 -1.51 0.00 0.00 177.39 177.15 1yjv n GLY 66 N 0.78 0.48 3.29 -0.72 0.00 -1.19 -5.11 105.19 102.71 1yjv n GLY 66 Ca 0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 1.45 0.15 1.61 0.08 -0.44 -4.89 117.98 115.95 1yjv s PHE 67 Ca 0.00 -0.72 0.04 0.00 0.12 0.00 0.00 56.93 56.38 1yjv s PHE 67 Cb 0.01 -0.73 -0.04 0.00 -0.57 0.00 0.00 43.02 41.69 1yjv s PHE 67 CO -0.00 0.16 0.16 -1.21 -0.10 0.00 0.00 175.22 174.23 1yjv s GLU 68 N -3.73 3.00 0.10 0.44 2.02 0.19 -3.21 118.70 117.52 1yjv s GLU 68 Ca 0.20 -0.80 0.06 0.00 0.02 0.00 0.00 54.97 54.45 1yjv s GLU 68 Cb 0.02 -2.71 -0.03 0.00 0.10 0.00 0.00 34.13 31.50 1yjv s GLU 68 CO 0.04 0.50 -0.16 0.00 0.02 0.00 0.00 175.26 175.66 1yjv s ALA 69 N -1.71 1.48 -0.27 5.21 0.00 -1.26 -0.75 121.76 124.45 1yjv s ALA 69 Ca 0.31 -1.18 -0.00 0.00 0.00 0.00 0.00 51.96 51.10 1yjv s ALA 69 Cb -0.10 -0.13 0.15 0.00 0.00 0.00 0.00 23.12 23.03 1yjv s ALA 69 CO 0.24 0.20 0.41 -1.12 0.00 0.00 0.00 175.76 175.49 1yjv s SER 70 N -2.05 0.23 0.21 0.00 0.01 0.37 -4.95 113.70 107.54 1yjv s SER 70 Ca 0.04 -0.06 -0.32 0.00 1.31 0.00 0.00 55.95 56.93 1yjv s SER 70 Cb -0.08 1.16 -0.12 0.00 0.21 0.00 0.00 66.02 67.19 1yjv s SER 70 CO 0.03 -0.33 1.69 0.00 0.41 0.00 0.00 173.24 175.05 1yjv n LEU 71 N 5.36 3.94 -3.57 2.44 -0.00 -1.26 -0.39 117.00 123.52 1yjv n LEU 71 Ca -0.01 1.08 -0.40 0.00 -0.00 0.00 0.00 56.01 56.67 1yjv n LEU 71 Cb 0.50 -1.56 -0.02 0.00 -0.00 0.00 0.00 43.42 42.34 1yjv n LEU 71 CO 0.02 0.12 2.80 0.52 -0.00 0.00 0.00 177.39 180.85 1yjv n VAL 72 N 3.66 3.44 -0.11 1.47 0.31 -1.26 -3.81 118.33 122.02 1yjv n VAL 72 Ca 0.15 -2.63 -0.23 0.00 -0.01 0.00 0.00 64.34 61.62 1yjv n VAL 72 Cb 0.34 -2.55 -0.08 0.00 -0.91 0.00 0.00 33.84 30.65 1yjv n VAL 72 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1yjv n LYS 73 N 5.40 0.46 -4.09 5.55 4.01 -1.26 -5.00 118.16 123.22 1yjv n LYS 73 Ca 0.59 0.20 -0.17 0.00 -0.51 0.00 0.00 58.31 58.41 1yjv n LYS 73 Cb 0.33 -1.27 -0.15 0.00 -0.51 0.00 0.00 35.03 33.43 1yjv n LYS 73 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1yjv s ILE 74 N -2.39 0.37 0.00 -0.18 1.01 -1.25 -5.28 121.20 113.47 1yjv s ILE 74 Ca -0.30 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1yjv s ILE 74 Cb 0.11 -0.38 0.00 0.00 0.01 0.00 0.00 42.46 42.21 1yjv s ILE 74 CO 0.38 0.15 0.15 -0.62 0.00 0.00 0.00 174.94 175.00