#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 -0.51 3.68 3.03 0.00 -1.26 -4.84 105.19 105.29 1yjv n GLY 2 Ca 0.00 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.41 6.65 -0.37 1.61 -4.77 -1.26 -4.51 116.67 111.60 1yjv s ASP 3 Ca 0.17 2.36 -0.28 0.00 -3.30 0.00 0.00 52.55 51.50 1yjv s ASP 3 Cb -0.07 -2.55 -0.02 0.00 -1.09 0.00 0.00 42.92 39.18 1yjv s ASP 3 CO 0.20 -0.89 1.85 -0.83 0.70 0.00 0.00 175.17 176.20 1yjv s GLY 4 N 2.78 0.64 -0.19 2.12 0.00 0.12 -4.73 107.32 108.06 1yjv s GLY 4 Ca 0.73 0.13 -0.29 0.00 0.00 0.00 0.00 44.72 45.29 1yjv s GLY 4 CO 0.31 3.35 1.10 0.54 0.00 0.00 0.00 173.10 178.39 1yjv s VAL 5 N 7.49 4.58 -0.17 1.40 0.11 -1.26 -1.28 120.40 131.27 1yjv s VAL 5 Ca 0.79 1.90 -0.02 0.00 -2.93 0.00 0.00 61.98 61.72 1yjv s VAL 5 Cb -0.21 -4.22 0.05 0.00 -1.53 0.00 0.00 36.38 30.47 1yjv s VAL 5 CO 0.31 -0.14 0.01 -0.22 -3.33 0.00 0.00 175.10 171.73 1yjv s LEU 6 N 3.11 1.24 -0.39 2.54 1.98 0.39 -5.00 118.68 122.55 1yjv s LEU 6 Ca 0.48 -0.68 -0.23 0.00 -2.89 0.00 0.00 54.13 50.81 1yjv s LEU 6 Cb -0.17 -0.66 0.01 0.00 0.66 0.00 0.00 46.19 46.03 1yjv s LEU 6 CO 0.10 -0.26 0.77 -1.61 -1.89 0.00 0.00 176.35 173.46 1yjv s GLU 7 N 1.81 3.65 0.07 1.98 2.02 -1.26 -1.09 118.70 125.88 1yjv s GLU 7 Ca 0.00 0.17 0.01 0.00 0.02 0.00 0.00 54.97 55.17 1yjv s GLU 7 Cb -0.16 -3.84 -0.04 0.00 0.10 0.00 0.00 34.13 30.19 1yjv s GLU 7 CO -0.07 -0.91 0.19 -0.51 0.02 0.00 0.00 175.26 173.97 1yjv s LEU 8 N 3.12 4.23 0.20 1.80 1.02 0.21 -0.99 118.68 128.28 1yjv s LEU 8 Ca 0.30 0.20 -0.28 0.00 0.02 0.00 0.00 54.13 54.37 1yjv s LEU 8 Cb -0.13 -2.85 -0.08 0.00 0.02 0.00 0.00 46.19 43.15 1yjv s LEU 8 CO 0.18 0.16 0.87 -0.69 0.02 0.00 0.00 176.35 176.89 1yjv s VAL 9 N -1.51 4.21 -0.05 -1.59 1.01 0.64 -0.02 120.40 123.10 1yjv s VAL 9 Ca 0.34 1.92 0.03 0.00 0.00 0.00 0.00 61.98 64.26 1yjv s VAL 9 Cb -0.13 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 32.02 1yjv s VAL 9 CO 0.27 0.51 -0.12 0.54 0.00 0.00 0.00 175.10 176.29 1yjv s VAL 10 N -1.13 1.04 0.16 2.92 0.11 0.34 -1.02 120.40 122.83 1yjv s VAL 10 Ca 0.39 -0.47 0.06 0.00 -2.93 0.00 0.00 61.98 59.03 1yjv s VAL 10 Cb -0.25 -0.94 -0.04 0.00 -1.53 0.00 0.00 36.38 33.62 1yjv s VAL 10 CO 0.29 0.32 -0.13 -0.13 -3.33 0.00 0.00 175.10 172.13 1yjv s ARG 11 N 0.39 1.16 0.00 1.54 0.52 0.26 -4.48 118.95 118.33 1yjv s ARG 11 Ca -0.08 -1.45 0.00 0.00 -0.52 0.00 0.00 55.73 53.67 1yjv s ARG 11 Cb -0.12 -0.89 0.00 0.00 0.52 0.00 0.00 34.95 34.46 1yjv s ARG 11 CO 0.02 0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.89 1yjv n GLY 12 N -0.09 3.08 2.92 -3.53 0.00 -1.26 -0.81 105.19 105.50 1yjv n GLY 12 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1yjv n GLY 12 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1yjv n MET 13 N -2.00 2.11 0.24 1.61 0.00 -1.26 -4.80 117.12 113.01 1yjv n MET 13 Ca 0.00 -2.14 0.16 0.00 0.00 0.00 0.00 57.70 55.72 1yjv n MET 13 Cb 0.00 -3.05 0.83 0.00 0.00 0.00 0.00 33.22 31.00 1yjv n MET 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1yjv h THR 14 N 4.22 0.00 -2.95 3.17 1.03 -1.97 -3.44 112.91 112.96 1yjv h THR 14 Ca 0.49 -0.07 -0.01 0.00 -0.01 0.00 0.00 66.41 66.81 1yjv h THR 14 Cb 0.63 0.83 0.01 0.00 -1.07 0.00 0.00 68.15 68.55 1yjv h THR 14 CO 1.91 0.00 0.31 0.00 -0.01 0.00 0.00 175.52 177.73 1yjv h ALA 16 N 2.00 1.20 0.00 0.00 0.00 -1.99 0.19 119.26 120.66 1yjv h ALA 16 Ca -0.33 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1yjv h ALA 16 Cb 1.24 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 1yjv h ALA 16 CO 0.42 -0.34 -0.05 0.77 0.00 0.00 0.00 179.25 180.05 1yjv h SER 17 N 0.34 0.00 0.19 0.00 0.02 -1.97 -0.09 113.55 112.04 1yjv h SER 17 Ca 0.49 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.43 1yjv h SER 17 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1yjv h SER 17 CO -0.53 0.05 -0.09 0.00 -1.14 0.00 0.00 176.83 175.13 1yjv n VAL 19 N -3.78 -0.35 0.21 0.00 0.31 -0.29 -0.68 118.33 113.76 1yjv n VAL 19 Ca -0.03 1.82 0.05 0.00 -0.01 0.00 0.00 64.34 66.17 1yjv n VAL 19 Cb 0.10 -2.31 0.48 0.00 -0.91 0.00 0.00 33.84 31.20 1yjv n VAL 19 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 1yjv h HIS 20 N 0.00 0.00 -0.11 3.52 2.07 -1.28 -1.00 115.15 118.34 1yjv h HIS 20 Ca 0.08 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.54 1yjv h HIS 20 Cb 0.21 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.19 1yjv h HIS 20 CO -0.90 0.24 -0.17 -0.22 -3.07 0.00 0.00 177.93 173.82 1yjv h LYS 21 N 0.00 0.32 0.37 5.12 3.64 -1.16 0.14 116.57 125.00 1yjv h LYS 21 Ca -0.00 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1yjv h LYS 21 Cb 0.44 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1yjv h LYS 21 CO 0.03 0.76 -0.44 0.82 -2.27 0.00 0.00 179.45 178.35 1yjv h ILE 22 N -0.10 0.12 0.33 2.00 2.04 -0.31 0.11 117.51 121.70 1yjv h ILE 22 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 1yjv h ILE 22 Cb 0.72 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1yjv h ILE 22 CO 0.04 0.00 -0.19 -0.33 0.00 0.00 0.00 178.15 177.67 1yjv h GLU 23 N -0.85 -0.47 -0.61 2.37 5.08 -1.20 0.10 114.58 119.00 1yjv h GLU 23 Ca -0.03 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1yjv h GLU 23 Cb 0.77 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 30.05 1yjv h GLU 23 CO -0.10 -0.31 0.23 1.03 -1.00 0.00 0.00 179.01 178.86 1yjv h SER 24 N -0.49 0.24 0.06 1.42 0.87 -0.69 0.18 113.55 115.13 1yjv h SER 24 Ca -0.04 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1yjv h SER 24 Cb 0.40 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1yjv h SER 24 CO 0.05 0.14 -0.03 -1.28 -0.53 0.00 0.00 176.83 175.18 1yjv h SER 25 N 0.42 -0.07 -0.50 6.23 0.87 -0.43 -2.91 113.55 117.16 1yjv h SER 25 Ca 0.31 -0.28 0.10 0.00 -1.23 0.00 0.00 61.79 60.69 1yjv h SER 25 Cb 0.38 0.02 -0.10 0.00 -0.44 0.00 0.00 62.40 62.26 1yjv h SER 25 CO -0.31 0.24 -0.21 -0.07 -0.53 0.00 0.00 176.83 175.96 1yjv h LEU 26 N -0.38 -0.73 -1.18 2.23 3.38 -0.34 0.54 115.31 118.82 1yjv h LEU 26 Ca -0.01 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1yjv h LEU 26 Cb 0.34 0.41 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1yjv h LEU 26 CO 0.01 -0.24 0.08 0.35 0.09 0.00 0.00 178.44 178.73 1yjv n THR 27 N -5.40 0.99 0.21 0.22 -2.24 0.01 -0.82 114.28 107.25 1yjv n THR 27 Ca 0.04 0.72 0.06 0.00 -2.27 0.00 0.00 64.05 62.60 1yjv n THR 27 Cb 0.31 -1.72 0.46 0.00 -2.10 0.00 0.00 70.33 67.28 1yjv n THR 27 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1yjv h LYS 28 N 0.00 0.00 -5.37 -0.78 5.09 -0.82 -3.39 116.57 111.29 1yjv h LYS 28 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 60.65 60.09 1yjv h LYS 28 Cb 0.16 0.00 -0.15 0.00 0.10 0.00 0.00 32.23 32.34 1yjv h LYS 28 CO 0.00 0.29 0.31 -1.01 -2.09 0.00 0.00 179.45 176.95 1yjv s HIS 29 N -4.19 2.91 0.58 0.07 0.09 -0.00 -4.91 115.29 109.84 1yjv s HIS 29 Ca -0.03 -0.33 0.29 0.00 -0.00 0.00 0.00 55.06 54.99 1yjv s HIS 29 Cb 0.14 -3.84 1.46 0.00 -0.00 0.00 0.00 32.58 30.33 1yjv s HIS 29 CO 0.68 -1.23 1.88 -0.09 -0.00 0.00 0.00 174.74 175.98 1yjv h ARG 30 N 9.18 0.00 -0.98 1.40 1.12 -1.84 0.46 114.38 123.72 1yjv h ARG 30 Ca -0.27 0.00 0.23 0.00 -1.11 0.00 0.00 59.98 58.83 1yjv h ARG 30 Cb 1.08 0.00 -0.12 0.00 -0.01 0.00 0.00 29.97 30.92 1yjv h ARG 30 CO 1.04 0.00 0.55 0.78 -3.11 0.00 0.00 179.97 179.23 1yjv h GLY 31 N 0.00 1.80 -5.21 2.80 0.00 -1.90 -3.35 103.07 97.21 1yjv h GLY 31 Ca 0.24 -0.29 -0.58 0.00 0.00 0.00 0.00 47.33 46.71 1yjv h GLY 31 CO -0.00 -0.22 0.49 -0.26 0.00 0.00 0.00 176.54 176.55 1yjv s ILE 32 N -5.82 4.83 0.05 2.60 -5.25 0.15 -1.04 121.20 116.72 1yjv s ILE 32 Ca -0.11 1.78 -0.11 0.00 -0.99 0.00 0.00 60.65 61.21 1yjv s ILE 32 Cb 0.26 -4.20 -0.33 0.00 2.95 0.00 0.00 42.46 41.14 1yjv s ILE 32 CO 0.79 -0.01 1.06 0.25 -1.79 0.00 0.00 174.94 175.24 1yjv h LEU 33 N 8.47 0.69 -7.47 0.37 5.85 -0.25 -3.46 115.31 119.50 1yjv h LEU 33 Ca -0.28 -0.74 -0.09 0.00 0.84 0.00 0.00 57.88 57.62 1yjv h LEU 33 Cb 1.12 -0.23 -0.17 0.00 0.37 0.00 0.00 40.66 41.76 1yjv h LEU 33 CO 0.86 1.58 -0.19 -0.47 -0.34 0.00 0.00 178.44 179.88 1yjv s TYR 34 N -2.63 -0.18 0.04 1.25 5.04 -0.56 -4.97 117.35 115.34 1yjv s TYR 34 Ca -0.07 0.11 0.03 0.00 -2.44 0.00 0.00 57.07 54.71 1yjv s TYR 34 Cb 0.05 0.15 -0.02 0.00 0.35 0.00 0.00 41.96 42.49 1yjv s TYR 34 CO 0.92 -0.52 -0.10 0.00 -1.34 0.00 0.00 175.55 174.52 1yjv s SER 36 N -1.31 -0.35 0.54 0.00 0.15 0.83 -4.98 113.70 108.59 1yjv s SER 36 Ca -0.05 -0.21 -0.00 0.00 0.70 0.00 0.00 55.95 56.39 1yjv s SER 36 Cb -0.08 1.44 0.02 0.00 -1.71 0.00 0.00 66.02 65.69 1yjv s SER 36 CO 0.01 -0.33 0.78 0.68 1.20 0.00 0.00 173.24 175.58 1yjv s VAL 37 N 2.61 3.11 -0.22 4.45 -7.23 -1.26 -1.02 120.40 120.85 1yjv s VAL 37 Ca 0.10 -0.51 -0.14 0.00 -1.81 0.00 0.00 61.98 59.62 1yjv s VAL 37 Cb -0.11 -3.18 0.07 0.00 0.56 0.00 0.00 36.38 33.71 1yjv s VAL 37 CO -0.28 -0.14 0.54 0.00 -0.31 0.00 0.00 175.10 174.91 1yjv s ALA 38 N -2.77 -1.43 0.18 1.32 0.00 0.10 -4.92 121.76 114.24 1yjv s ALA 38 Ca 0.55 1.89 -0.17 0.00 0.00 0.00 0.00 51.96 54.23 1yjv s ALA 38 Cb -0.10 -1.12 0.14 0.00 0.00 0.00 0.00 23.12 22.03 1yjv s ALA 38 CO 0.39 -0.31 1.64 -0.07 0.00 0.00 0.00 175.76 177.42 1yjv h LEU 39 N 6.76 -0.57 -0.41 0.00 3.38 -1.91 0.87 115.31 123.44 1yjv h LEU 39 Ca -0.33 0.16 0.08 0.00 0.09 0.00 0.00 57.88 57.88 1yjv h LEU 39 Cb 1.20 0.34 -0.09 0.00 0.09 0.00 0.00 40.66 42.20 1yjv h LEU 39 CO 0.22 -0.20 -0.29 0.00 0.09 0.00 0.00 178.44 178.26 1yjv h ALA 40 N 1.36 -0.08 -0.02 1.53 0.00 -1.96 0.58 119.26 120.67 1yjv h ALA 40 Ca 0.23 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1yjv h ALA 40 Cb 0.40 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1yjv h ALA 40 CO -0.51 -0.67 -0.16 0.25 0.00 0.00 0.00 179.25 178.15 1yjv n THR 41 N -5.41 0.00 -4.02 0.00 -2.24 -1.22 -4.95 114.28 96.44 1yjv n THR 41 Ca 0.02 -0.26 -0.33 0.00 -2.27 0.00 0.00 64.05 61.21 1yjv n THR 41 Cb 0.33 0.77 -0.00 0.00 -2.10 0.00 0.00 70.33 69.33 1yjv n THR 41 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1yjv n ASN 42 N 0.08 -4.10 -4.73 3.42 5.03 0.20 -4.92 115.26 110.23 1yjv n ASN 42 Ca 0.14 -0.86 -0.25 0.00 0.87 0.00 0.00 54.58 54.48 1yjv n ASN 42 Cb 0.42 -3.31 -0.08 0.00 -1.02 0.00 0.00 39.78 35.79 1yjv n ASN 42 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1yjv s LYS 43 N -6.73 2.20 -0.32 3.52 0.00 -0.12 -0.51 119.74 117.78 1yjv s LYS 43 Ca 0.69 -1.89 0.02 0.00 0.00 0.00 0.00 55.97 54.80 1yjv s LYS 43 Cb -0.36 -1.94 0.16 0.00 0.00 0.00 0.00 37.83 35.69 1yjv s LYS 43 CO 0.85 -0.13 0.41 0.00 0.00 0.00 0.00 175.35 176.48 1yjv s ALA 44 N -2.62 -1.05 -0.57 0.59 0.00 0.97 -0.73 121.76 118.35 1yjv s ALA 44 Ca 0.39 -0.11 -0.28 0.00 0.00 0.00 0.00 51.96 51.96 1yjv s ALA 44 Cb 0.04 -2.10 0.03 0.00 0.00 0.00 0.00 23.12 21.09 1yjv s ALA 44 CO 0.22 -1.87 1.22 -1.58 0.00 0.00 0.00 175.76 173.74 1yjv s HIS 45 N 2.22 2.56 -0.01 0.00 5.04 -0.19 -0.62 115.29 124.30 1yjv s HIS 45 Ca 0.12 0.43 -0.02 0.00 -1.54 0.00 0.00 55.06 54.04 1yjv s HIS 45 Cb -0.13 -4.50 -0.04 0.00 0.04 0.00 0.00 32.58 27.95 1yjv s HIS 45 CO -0.23 -1.64 0.14 0.42 -2.34 0.00 0.00 174.74 171.09 1yjv s ILE 46 N 5.09 5.15 -0.13 0.89 1.09 -0.25 -0.12 121.20 132.93 1yjv s ILE 46 Ca 0.44 -0.24 0.00 0.00 -1.10 0.00 0.00 60.65 59.75 1yjv s ILE 46 Cb -0.08 -3.38 -0.01 0.00 -1.06 0.00 0.00 42.46 37.93 1yjv s ILE 46 CO 0.26 0.35 -0.14 -0.54 -0.10 0.00 0.00 174.94 174.77 1yjv s LYS 47 N -1.81 3.36 0.01 2.79 1.02 0.15 -0.46 119.74 124.80 1yjv s LYS 47 Ca 0.25 -0.70 0.01 0.00 0.02 0.00 0.00 55.97 55.55 1yjv s LYS 47 Cb -0.12 -2.62 -0.01 0.00 -0.52 0.00 0.00 37.83 34.55 1yjv s LYS 47 CO 0.16 0.19 -0.04 1.52 -0.92 0.00 0.00 175.35 176.26 1yjv s TYR 48 N 0.41 0.34 -0.22 3.18 -0.85 -0.40 0.34 117.35 120.14 1yjv s TYR 48 Ca -0.11 -0.26 -0.29 0.00 -0.52 0.00 0.00 57.07 55.89 1yjv s TYR 48 Cb -0.16 -0.21 -0.01 0.00 0.38 0.00 0.00 41.96 41.96 1yjv s TYR 48 CO 0.05 -0.07 1.28 -0.51 -1.52 0.00 0.00 175.55 174.79 1yjv s ASP 49 N -0.73 6.82 -1.03 -0.18 1.01 -0.21 0.13 116.67 122.48 1yjv s ASP 49 Ca -0.05 1.48 -0.08 0.00 0.71 0.00 0.00 52.55 54.61 1yjv s ASP 49 Cb -0.05 -2.54 -0.14 0.00 1.01 0.00 0.00 42.92 41.20 1yjv s ASP 49 CO -0.00 -0.90 3.17 -0.81 0.21 0.00 0.00 175.17 176.83 1yjv n PRO 50 N 6.92 3.13 0.07 8.23 -0.04 -1.26 -2.79 135.00 149.26 1yjv n PRO 50 Ca 0.14 -1.85 0.00 0.00 -0.04 0.00 0.00 63.50 61.76 1yjv n PRO 50 Cb 0.46 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 1yjv n PRO 50 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1yjv n GLU 51 N 3.07 0.00 0.08 0.54 1.02 -1.26 -4.93 120.64 119.16 1yjv n GLU 51 Ca 0.65 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.71 1yjv n GLU 51 Cb 0.47 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.93 1yjv n GLU 51 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1yjv h ILE 52 N 0.00 1.44 -3.07 -3.67 2.04 -1.86 -3.44 117.51 108.95 1yjv h ILE 52 Ca 0.00 -2.35 -0.16 0.00 1.00 0.00 0.00 64.86 63.35 1yjv h ILE 52 Cb 0.00 2.27 -0.26 0.00 -0.74 0.00 0.00 36.82 38.09 1yjv h ILE 52 CO 0.00 0.69 -0.41 -0.51 0.00 0.00 0.00 178.15 177.92 1yjv s ILE 53 N -3.44 -0.01 0.50 -0.67 2.07 -1.24 -4.87 121.20 113.54 1yjv s ILE 53 Ca -0.04 0.02 0.02 0.00 -1.41 0.00 0.00 60.65 59.25 1yjv s ILE 53 Cb 0.11 -0.38 0.02 0.00 0.13 0.00 0.00 42.46 42.33 1yjv s ILE 53 CO 0.82 0.01 0.71 -0.83 -1.91 0.00 0.00 174.94 173.74 1yjv s GLY 54 N 0.33 1.76 0.15 1.50 0.00 -1.26 -4.52 107.32 105.28 1yjv s GLY 54 Ca -0.02 -1.30 -0.14 0.00 0.00 0.00 0.00 44.72 43.27 1yjv s GLY 54 CO -0.01 -1.07 1.67 -0.56 0.00 0.00 0.00 173.10 173.13 1yjv h PRO 55 N 0.27 0.77 -0.70 2.90 0.13 -1.99 -1.19 132.00 132.18 1yjv h PRO 55 Ca -0.43 -0.17 0.10 0.00 -0.87 0.00 0.00 66.00 64.63 1yjv h PRO 55 Cb 1.28 -0.11 -0.07 0.00 0.13 0.00 0.00 31.00 32.23 1yjv h PRO 55 CO 0.53 0.72 0.34 -0.09 -0.23 0.00 0.00 178.00 179.27 1yjv h ARG 56 N 0.66 0.55 -0.21 0.86 2.43 -1.99 -0.01 114.38 116.67 1yjv h ARG 56 Ca 0.16 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1yjv h ARG 56 Cb 0.28 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1yjv h ARG 56 CO -0.00 0.37 0.07 -0.44 -1.51 0.00 0.00 179.97 178.45 1yjv h ASP 57 N 0.57 0.31 -0.20 -3.80 3.32 -1.79 0.19 116.42 115.01 1yjv h ASP 57 Ca 0.35 -0.20 0.05 0.00 0.02 0.00 0.00 57.03 57.26 1yjv h ASP 57 Cb 0.39 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.80 1yjv h ASP 57 CO -0.28 0.43 -0.20 0.40 -1.72 0.00 0.00 179.24 177.86 1yjv h ILE 58 N 0.17 0.48 -0.05 0.35 2.04 -0.85 0.29 117.51 119.95 1yjv h ILE 58 Ca 0.07 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.96 1yjv h ILE 58 Cb 0.23 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.74 1yjv h ILE 58 CO -0.00 0.00 -0.22 0.40 0.00 0.00 0.00 178.15 178.33 1yjv h ILE 59 N -0.22 0.48 -0.47 -0.67 2.04 -0.62 -0.33 117.51 117.73 1yjv h ILE 59 Ca 0.12 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.05 1yjv h ILE 59 Cb 0.40 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 1yjv h ILE 59 CO -0.33 0.00 0.32 -0.74 0.00 0.00 0.00 178.15 177.40 1yjv h HIS 60 N -0.32 0.33 -0.04 1.37 -0.00 -0.21 0.11 115.15 116.40 1yjv h HIS 60 Ca 0.07 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.45 1yjv h HIS 60 Cb 0.43 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.41 27.73 1yjv h HIS 60 CO -0.28 0.17 0.01 1.15 -0.00 0.00 0.00 177.93 178.98 1yjv h THR 61 N 0.33 1.21 -0.90 6.26 2.02 0.90 0.13 112.91 122.86 1yjv h THR 61 Ca 0.21 -0.63 0.11 0.00 0.77 0.00 0.00 66.41 66.86 1yjv h THR 61 Cb 0.40 1.57 -0.08 0.00 -1.74 0.00 0.00 68.15 68.30 1yjv h THR 61 CO -0.05 0.17 0.54 0.40 0.37 0.00 0.00 175.52 176.95 1yjv h ILE 62 N -0.19 0.89 0.33 3.11 2.04 0.34 0.84 117.51 124.87 1yjv h ILE 62 Ca 0.01 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 1yjv h ILE 62 Cb 0.27 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1yjv h ILE 62 CO 0.00 0.16 -0.26 -0.33 0.00 0.00 0.00 178.15 177.71 1yjv h GLU 63 N 0.86 -0.58 -0.23 2.37 5.08 -0.62 -1.25 114.58 120.22 1yjv h GLU 63 Ca 0.45 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.91 1yjv h GLU 63 Cb 0.45 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1yjv h GLU 63 CO -0.27 -0.39 0.17 0.77 -1.00 0.00 0.00 179.01 178.30 1yjv h SER 64 N -0.60 0.00 0.00 1.42 0.02 0.91 -2.95 113.55 112.34 1yjv h SER 64 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1yjv h SER 64 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1yjv h SER 64 CO -0.02 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.85 1yjv n LEU 65 N -4.34 0.05 -0.71 5.07 4.32 0.13 -4.97 117.00 116.54 1yjv n LEU 65 Ca 0.02 0.02 -0.03 0.00 -0.02 0.00 0.00 56.01 56.00 1yjv n LEU 65 Cb 0.32 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.09 1yjv n LEU 65 CO 0.34 0.00 0.28 0.61 -1.22 0.00 0.00 177.39 177.40 1yjv n GLY 66 N 0.83 0.68 3.44 -0.72 0.00 -1.10 -5.10 105.19 103.21 1yjv n GLY 66 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 1.75 0.10 1.61 0.08 -0.49 -4.92 117.98 116.12 1yjv s PHE 67 Ca 0.00 -1.27 0.07 0.00 0.12 0.00 0.00 56.93 55.85 1yjv s PHE 67 Cb 0.00 -1.07 -0.04 0.00 -0.57 0.00 0.00 43.02 41.34 1yjv s PHE 67 CO 0.00 -0.33 -0.09 -2.00 -0.10 0.00 0.00 175.22 172.70 1yjv s GLU 68 N -3.77 2.17 0.15 0.44 2.12 0.01 -3.55 118.70 116.27 1yjv s GLU 68 Ca 0.30 -1.00 -0.17 0.00 0.36 0.00 0.00 54.97 54.45 1yjv s GLU 68 Cb 0.04 -2.33 0.04 0.00 0.26 0.00 0.00 34.13 32.14 1yjv s GLU 68 CO 0.16 0.51 0.47 0.00 -0.54 0.00 0.00 175.26 175.86 1yjv s ALA 69 N -1.21 -1.02 -0.03 6.30 0.00 -1.26 -0.57 121.76 123.96 1yjv s ALA 69 Ca 0.21 -0.03 -0.18 0.00 0.00 0.00 0.00 51.96 51.97 1yjv s ALA 69 Cb -0.11 0.78 0.03 0.00 0.00 0.00 0.00 23.12 23.82 1yjv s ALA 69 CO 0.14 -0.71 0.39 0.45 0.00 0.00 0.00 175.76 176.03 1yjv s SER 70 N -2.82 -0.30 0.45 0.00 0.15 -0.18 -4.99 113.70 106.00 1yjv s SER 70 Ca 0.05 0.26 -0.24 0.00 0.70 0.00 0.00 55.95 56.72 1yjv s SER 70 Cb 0.01 0.39 -0.10 0.00 -1.71 0.00 0.00 66.02 64.61 1yjv s SER 70 CO -0.09 -0.46 1.03 0.00 1.20 0.00 0.00 173.24 174.92 1yjv n LEU 71 N 1.31 2.89 -4.09 3.45 -0.00 -1.26 -0.26 117.00 119.03 1yjv n LEU 71 Ca -0.21 1.01 -0.27 0.00 -0.00 0.00 0.00 56.01 56.55 1yjv n LEU 71 Cb 0.56 -1.37 -0.17 0.00 -0.00 0.00 0.00 43.42 42.44 1yjv n LEU 71 CO 0.22 -1.45 -0.50 0.54 -0.00 0.00 0.00 177.39 176.19 1yjv s VAL 72 N -1.30 1.43 0.01 1.47 0.11 -0.16 -4.58 120.40 117.38 1yjv s VAL 72 Ca 0.65 -0.66 0.00 0.00 -2.93 0.00 0.00 61.98 59.03 1yjv s VAL 72 Cb -0.53 -1.27 0.00 0.00 -1.53 0.00 0.00 36.38 33.05 1yjv s VAL 72 CO 0.56 0.42 0.00 1.17 -3.33 0.00 0.00 175.10 173.92 1yjv n LYS 73 N 3.64 0.00 -2.65 1.54 3.00 -1.26 -4.74 118.16 117.69 1yjv n LYS 73 Ca -0.21 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.68 1yjv n LYS 73 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.52 1yjv n LYS 73 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1yjv s ILE 74 N -2.00 4.07 0.00 3.15 1.01 -1.26 -5.27 121.20 120.91 1yjv s ILE 74 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.28 1yjv s ILE 74 Cb 0.00 -4.71 0.00 0.00 0.01 0.00 0.00 42.46 37.76 1yjv s ILE 74 CO 0.00 -1.37 0.00 -0.62 0.00 0.00 0.00 174.94 172.95