#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 1.64 0.04 3.03 0.00 -1.26 -4.93 105.19 103.71 1yjv n GLY 2 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1yjv n GLY 2 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yjv n ASP 3 N 3.17 0.00 -4.55 1.61 8.00 -1.26 -4.76 116.55 118.76 1yjv n ASP 3 Ca 0.00 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.17 1yjv n ASP 3 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1yjv n ASP 3 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yjv n GLY 4 N 0.16 1.57 3.73 0.44 0.00 -0.19 -4.92 105.19 105.98 1yjv n GLY 4 Ca 0.00 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 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 8.72 4.04 -0.06 1.61 1.01 -1.26 -0.52 120.40 133.93 1yjv s VAL 5 Ca 0.63 1.65 -0.01 0.00 0.00 0.00 0.00 61.98 64.25 1yjv s VAL 5 Cb 0.01 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.37 1yjv s VAL 5 CO 0.12 0.23 0.01 -0.22 0.00 0.00 0.00 175.10 175.24 1yjv s LEU 6 N 0.10 0.61 -0.87 3.92 2.96 0.19 -4.98 118.68 120.61 1yjv s LEU 6 Ca 0.52 -0.06 0.01 0.00 -0.22 0.00 0.00 54.13 54.37 1yjv s LEU 6 Cb -0.28 -0.39 0.28 0.00 0.50 0.00 0.00 46.19 46.29 1yjv s LEU 6 CO 0.33 -0.19 1.11 -0.62 -1.32 0.00 0.00 176.35 175.66 1yjv n GLU 7 N 5.05 3.50 -2.73 1.98 1.02 -1.25 -0.90 120.64 127.31 1yjv n GLU 7 Ca -0.09 -4.61 -0.33 0.00 -0.02 0.00 0.00 57.16 52.11 1yjv n GLU 7 Cb 0.50 -2.39 -0.06 0.00 -0.02 0.00 0.00 31.44 29.47 1yjv n GLU 7 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 1yjv s LEU 8 N -2.56 3.91 0.14 -4.62 -0.00 -1.03 -4.51 118.68 110.01 1yjv s LEU 8 Ca 0.35 1.77 -0.30 0.00 -0.00 0.00 0.00 54.13 55.95 1yjv s LEU 8 Cb 0.08 -4.54 -0.07 0.00 -0.00 0.00 0.00 46.19 41.67 1yjv s LEU 8 CO 0.04 -0.50 1.01 -0.69 -0.00 0.00 0.00 176.35 176.21 1yjv s VAL 9 N -2.11 4.26 -0.06 1.48 1.01 0.73 -0.42 120.40 125.29 1yjv s VAL 9 Ca 0.64 1.92 0.03 0.00 0.00 0.00 0.00 61.98 64.57 1yjv s VAL 9 Cb -0.12 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.05 1yjv s VAL 9 CO 0.15 0.31 -0.16 0.54 0.00 0.00 0.00 175.10 175.94 1yjv s VAL 10 N -0.13 1.42 0.28 2.92 0.11 0.37 -0.67 120.40 124.70 1yjv s VAL 10 Ca 0.48 -0.67 0.08 0.00 -2.93 0.00 0.00 61.98 58.94 1yjv s VAL 10 Cb -0.26 -1.25 -0.06 0.00 -1.53 0.00 0.00 36.38 33.29 1yjv s VAL 10 CO 0.32 0.41 -0.10 -0.13 -3.33 0.00 0.00 175.10 172.27 1yjv s ARG 11 N 0.39 1.60 0.00 1.54 0.52 -0.34 -4.34 118.95 118.32 1yjv s ARG 11 Ca -0.12 -1.79 0.00 0.00 -0.52 0.00 0.00 55.73 53.30 1yjv s ARG 11 Cb -0.15 -1.37 0.00 0.00 0.52 0.00 0.00 34.95 33.95 1yjv s ARG 11 CO 0.04 0.13 0.00 0.41 0.02 0.00 0.00 175.30 175.90 1yjv n GLY 12 N -0.61 2.09 3.47 -3.53 0.00 -1.26 -0.78 105.19 104.57 1yjv n GLY 12 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 1.64 0.13 1.61 2.81 -1.26 -4.76 117.12 115.30 1yjv n MET 13 Ca 0.00 -2.35 0.12 0.00 -1.81 0.00 0.00 57.70 53.66 1yjv n MET 13 Cb 0.00 -3.53 0.49 0.00 -0.71 0.00 0.00 33.22 29.48 1yjv n MET 13 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1yjv n THR 14 N 7.32 0.81 -3.83 2.03 5.66 -1.26 -4.76 114.28 120.24 1yjv n THR 14 Ca 0.46 0.20 -0.06 0.00 -3.05 0.00 0.00 64.05 61.60 1yjv n THR 14 Cb 0.45 -1.14 -0.02 0.00 -1.55 0.00 0.00 70.33 68.08 1yjv n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yjv h ALA 16 N 2.00 2.12 -1.03 0.00 0.00 -2.00 0.14 119.26 120.49 1yjv h ALA 16 Ca -0.20 0.05 0.28 0.00 0.00 0.00 0.00 54.91 55.04 1yjv h ALA 16 Cb 1.25 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.91 1yjv h ALA 16 CO 0.24 -0.49 0.62 0.77 0.00 0.00 0.00 179.25 180.39 1yjv h SER 17 N 0.47 0.56 0.21 0.00 0.02 -1.98 0.19 113.55 113.02 1yjv h SER 17 Ca 0.56 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.63 1yjv h SER 17 Cb 1.31 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1yjv h SER 17 CO -0.29 0.04 -0.10 0.00 -1.14 0.00 0.00 176.83 175.34 1yjv h VAL 19 N -0.85 0.00 0.00 0.00 2.07 -0.95 0.84 116.25 117.36 1yjv h VAL 19 Ca -0.03 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1yjv h VAL 19 Cb 0.51 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1yjv h VAL 19 CO 0.05 0.00 -0.26 1.12 0.02 0.00 0.00 177.57 178.50 1yjv h HIS 20 N -0.58 0.00 0.07 1.57 2.07 -1.22 -0.49 115.15 116.57 1yjv h HIS 20 Ca 0.02 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.54 1yjv h HIS 20 Cb 0.66 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.64 1yjv h HIS 20 CO -0.55 0.26 -0.04 -0.22 -3.07 0.00 0.00 177.93 174.31 1yjv h LYS 21 N 0.00 -0.10 0.21 5.12 3.64 -1.25 0.63 116.57 124.82 1yjv h LYS 21 Ca -0.00 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1yjv h LYS 21 Cb 0.56 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 1yjv h LYS 21 CO 0.03 0.15 -0.45 0.82 -2.27 0.00 0.00 179.45 177.73 1yjv h ILE 22 N -0.33 0.11 -0.18 2.00 2.04 -0.39 0.99 117.51 121.74 1yjv h ILE 22 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1yjv h ILE 22 Cb 0.29 0.11 -0.07 0.00 -0.74 0.00 0.00 36.82 36.41 1yjv h ILE 22 CO 0.02 0.00 -0.45 -0.08 0.00 0.00 0.00 178.15 177.64 1yjv h GLU 23 N -0.75 -0.46 -0.76 2.37 4.22 -0.98 0.20 114.58 118.42 1yjv h GLU 23 Ca -0.00 0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.44 1yjv h GLU 23 Cb 0.73 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.05 1yjv h GLU 23 CO -0.20 -0.31 0.38 1.03 -2.18 0.00 0.00 179.01 177.72 1yjv h SER 24 N -0.48 0.99 -0.27 1.04 0.87 -0.83 -0.43 113.55 114.43 1yjv h SER 24 Ca 0.08 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.46 1yjv h SER 24 Cb 0.63 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1yjv h SER 24 CO -0.44 0.84 -0.04 -1.28 -0.53 0.00 0.00 176.83 175.38 1yjv h SER 25 N 1.07 0.50 -0.02 6.23 0.87 -0.02 -3.24 113.55 118.94 1yjv h SER 25 Ca 0.26 -0.35 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 1yjv h SER 25 Cb 0.11 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1yjv h SER 25 CO -0.03 0.73 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.89 1yjv h LEU 26 N 0.27 0.07 -2.10 2.23 -0.00 -0.37 -3.21 115.31 112.19 1yjv h LEU 26 Ca 0.07 -0.54 0.08 0.00 -0.00 0.00 0.00 57.88 57.49 1yjv h LEU 26 Cb 0.50 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.13 1yjv h LEU 26 CO 0.02 0.60 0.32 0.71 -0.00 0.00 0.00 178.44 180.09 1yjv h THR 27 N -0.46 0.40 -0.89 0.22 1.35 -1.15 0.23 112.91 112.62 1yjv h THR 27 Ca 0.00 0.00 0.24 0.00 -0.55 0.00 0.00 66.41 66.10 1yjv h THR 27 Cb 0.58 0.74 -0.14 0.00 -1.73 0.00 0.00 68.15 67.61 1yjv h THR 27 CO 0.01 0.00 0.25 0.50 -0.25 0.00 0.00 175.52 176.03 1yjv h LYS 28 N 0.00 0.20 -6.26 4.72 1.63 -1.57 -3.41 116.57 111.88 1yjv h LYS 28 Ca 0.13 -0.01 -0.55 0.00 -0.85 0.00 0.00 60.65 59.37 1yjv h LYS 28 Cb 0.77 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.35 1yjv h LYS 28 CO -0.00 0.13 1.19 -1.01 -3.45 0.00 0.00 179.45 176.31 1yjv s HIS 29 N -5.92 1.72 0.00 1.91 3.76 0.82 -4.86 115.29 112.71 1yjv s HIS 29 Ca -0.12 0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.93 1yjv s HIS 29 Cb 0.26 -4.02 0.00 0.00 1.11 0.00 0.00 32.58 29.93 1yjv s HIS 29 CO 0.77 -4.13 1.22 -2.13 -0.85 0.00 0.00 174.74 169.62 1yjv n ARG 30 N 7.57 0.76 0.00 1.40 0.63 -1.26 -1.43 116.66 124.34 1yjv n ARG 30 Ca 0.20 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 1yjv n ARG 30 Cb 0.43 -1.12 0.00 0.00 0.45 0.00 0.00 32.46 32.22 1yjv n ARG 30 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1yjv n GLY 31 N 1.23 0.61 3.57 5.14 0.00 -1.26 -4.95 105.19 109.52 1yjv n GLY 31 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.22 4.38 0.04 -0.61 -1.09 -0.51 -0.99 121.20 122.20 1yjv s ILE 32 Ca 0.00 0.82 -0.13 0.00 -2.23 0.00 0.00 60.65 59.10 1yjv s ILE 32 Cb 0.00 -4.50 -0.33 0.00 -1.58 0.00 0.00 42.46 36.05 1yjv s ILE 32 CO 0.00 -0.93 1.04 -0.07 -1.23 0.00 0.00 174.94 173.76 1yjv h LEU 33 N 10.82 0.77 -7.34 2.97 3.38 -0.52 -3.48 115.31 121.91 1yjv h LEU 33 Ca -0.24 -0.81 -0.06 0.00 0.09 0.00 0.00 57.88 56.87 1yjv h LEU 33 Cb 1.07 -0.25 -0.14 0.00 0.09 0.00 0.00 40.66 41.43 1yjv h LEU 33 CO 1.06 1.63 -0.04 -0.47 0.09 0.00 0.00 178.44 180.71 1yjv s TYR 34 N -2.66 -0.27 -0.01 1.13 5.04 -0.37 -4.96 117.35 115.25 1yjv s TYR 34 Ca -0.08 0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.62 1yjv s TYR 34 Cb 0.05 0.28 0.01 0.00 0.35 0.00 0.00 41.96 42.66 1yjv s TYR 34 CO 0.93 -0.68 0.01 0.00 -1.34 0.00 0.00 175.55 174.47 1yjv s SER 36 N 0.54 2.87 0.44 0.00 0.15 0.95 -4.98 113.70 113.66 1yjv s SER 36 Ca -0.05 -2.82 -0.21 0.00 0.70 0.00 0.00 55.95 53.58 1yjv s SER 36 Cb -0.07 -0.74 -0.10 0.00 -1.71 0.00 0.00 66.02 63.39 1yjv s SER 36 CO -0.01 -0.22 0.97 0.68 1.20 0.00 0.00 173.24 175.85 1yjv s VAL 37 N 0.21 4.25 -0.21 4.45 -7.23 -1.26 -1.58 120.40 119.02 1yjv s VAL 37 Ca 0.24 1.42 -0.14 0.00 -1.81 0.00 0.00 61.98 61.69 1yjv s VAL 37 Cb -0.12 -3.58 0.06 0.00 0.56 0.00 0.00 36.38 33.30 1yjv s VAL 37 CO -0.08 -0.28 0.53 0.00 -0.31 0.00 0.00 175.10 174.95 1yjv s ALA 38 N -2.11 -1.39 0.23 1.32 0.00 0.26 -4.96 121.76 115.10 1yjv s ALA 38 Ca 0.63 1.83 -0.01 0.00 0.00 0.00 0.00 51.96 54.41 1yjv s ALA 38 Cb -0.11 -1.09 0.22 0.00 0.00 0.00 0.00 23.12 22.15 1yjv s ALA 38 CO 0.15 -0.30 1.59 1.37 0.00 0.00 0.00 175.76 178.56 1yjv h LEU 39 N 6.68 0.54 -1.42 0.00 8.10 -1.86 0.82 115.31 128.18 1yjv h LEU 39 Ca -0.33 -0.25 0.13 0.00 0.11 0.00 0.00 57.88 57.54 1yjv h LEU 39 Cb 1.20 -0.15 -0.06 0.00 -0.44 0.00 0.00 40.66 41.21 1yjv h LEU 39 CO 0.22 0.91 0.52 0.00 -4.11 0.00 0.00 178.44 175.99 1yjv h ALA 40 N 1.11 1.91 -0.02 0.17 0.00 -1.95 0.46 119.26 120.94 1yjv h ALA 40 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1yjv h ALA 40 Cb 0.94 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1yjv h ALA 40 CO 0.08 -0.11 0.00 2.41 0.00 0.00 0.00 179.25 181.63 1yjv n THR 41 N -4.51 1.74 -3.75 0.00 -1.04 -1.24 -5.01 114.28 100.47 1yjv n THR 41 Ca 0.15 -2.00 -0.23 0.00 -2.04 0.00 0.00 64.05 59.94 1yjv n THR 41 Cb 0.44 -0.10 -0.07 0.00 -1.82 0.00 0.00 70.33 68.79 1yjv n THR 41 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1yjv n ASN 42 N -1.18 0.45 -4.34 8.00 4.13 0.15 -4.90 115.26 117.57 1yjv n ASN 42 Ca 0.13 -0.89 -0.18 0.00 1.68 0.00 0.00 54.58 55.33 1yjv n ASN 42 Cb 0.58 -1.11 -0.10 0.00 -1.54 0.00 0.00 39.78 37.61 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 -5.98 1.32 -0.28 3.52 0.00 0.16 -0.47 119.74 118.00 1yjv s LYS 43 Ca 0.07 -1.63 -0.01 0.00 0.00 0.00 0.00 55.97 54.40 1yjv s LYS 43 Cb -0.04 -0.85 0.13 0.00 0.00 0.00 0.00 37.83 37.07 1yjv s LYS 43 CO 0.70 0.04 0.28 0.00 0.00 0.00 0.00 175.35 176.36 1yjv s ALA 44 N -3.20 -0.36 -0.73 0.59 0.00 0.44 -0.58 121.76 117.93 1yjv s ALA 44 Ca 0.25 -0.33 -0.27 0.00 0.00 0.00 0.00 51.96 51.61 1yjv s ALA 44 Cb 0.03 -1.73 0.03 0.00 0.00 0.00 0.00 23.12 21.46 1yjv s ALA 44 CO 0.07 -1.66 1.26 -1.58 0.00 0.00 0.00 175.76 173.85 1yjv s HIS 45 N 2.34 2.32 -0.08 0.00 5.04 -0.62 -2.46 115.29 121.83 1yjv s HIS 45 Ca 0.09 -0.04 -0.14 0.00 -1.54 0.00 0.00 55.06 53.43 1yjv s HIS 45 Cb -0.14 -4.61 -0.05 0.00 0.04 0.00 0.00 32.58 27.82 1yjv s HIS 45 CO -0.32 -2.03 0.37 0.42 -2.34 0.00 0.00 174.74 170.84 1yjv s ILE 46 N 5.63 5.17 -0.32 0.89 1.09 -0.08 -0.04 121.20 133.55 1yjv s ILE 46 Ca 0.35 0.73 -0.12 0.00 -1.10 0.00 0.00 60.65 60.51 1yjv s ILE 46 Cb -0.08 -3.68 -0.03 0.00 -1.06 0.00 0.00 42.46 37.60 1yjv s ILE 46 CO 0.16 0.48 0.21 -0.54 -0.10 0.00 0.00 174.94 175.15 1yjv s LYS 47 N -0.32 3.64 0.40 2.79 -0.14 0.12 -0.64 119.74 125.58 1yjv s LYS 47 Ca 0.21 -0.54 0.08 0.00 -1.36 0.00 0.00 55.97 54.36 1yjv s LYS 47 Cb -0.15 -3.73 -0.06 0.00 -1.68 0.00 0.00 37.83 32.21 1yjv s LYS 47 CO 0.09 -0.35 0.07 1.52 -0.76 0.00 0.00 175.35 175.92 1yjv s TYR 48 N 1.72 2.55 -0.09 3.18 -0.85 0.32 0.24 117.35 124.42 1yjv s TYR 48 Ca 0.06 -0.59 -0.15 0.00 -0.52 0.00 0.00 57.07 55.87 1yjv s TYR 48 Cb -0.17 -1.77 -0.05 0.00 0.38 0.00 0.00 41.96 40.35 1yjv s TYR 48 CO 0.10 0.37 0.38 0.16 -1.52 0.00 0.00 175.55 175.04 1yjv s ASP 49 N -3.77 6.64 0.04 -0.18 1.47 -0.16 -1.02 116.67 119.67 1yjv s ASP 49 Ca 0.37 0.76 0.19 0.00 1.18 0.00 0.00 52.55 55.05 1yjv s ASP 49 Cb 0.06 -2.23 0.82 0.00 -0.34 0.00 0.00 42.92 41.22 1yjv s ASP 49 CO 0.20 0.16 1.62 -0.81 0.68 0.00 0.00 175.17 177.02 1yjv n PRO 50 N 2.92 0.03 -0.04 2.11 -0.04 -1.25 -2.20 135.00 136.53 1yjv n PRO 50 Ca -0.11 0.21 -0.18 0.00 -0.04 0.00 0.00 63.50 63.37 1yjv n PRO 50 Cb 0.52 -1.55 -0.13 0.00 -0.04 0.00 0.00 33.50 32.30 1yjv n PRO 50 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1yjv h GLU 51 N 0.00 0.11 0.16 0.54 4.39 -1.96 -3.38 114.58 114.45 1yjv h GLU 51 Ca 0.00 -0.19 -0.31 0.00 0.34 0.00 0.00 59.36 59.20 1yjv h GLU 51 Cb 0.34 0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1yjv h GLU 51 CO 0.00 1.09 -1.44 0.82 -1.16 0.00 0.00 179.01 178.33 1yjv h ILE 52 N -0.72 1.29 -3.25 3.13 1.08 -1.93 -3.45 117.51 113.66 1yjv h ILE 52 Ca -0.16 -2.85 -0.48 0.00 -0.39 0.00 0.00 64.86 60.98 1yjv h ILE 52 Cb 1.35 2.89 -0.38 0.00 -3.07 0.00 0.00 36.82 37.61 1yjv h ILE 52 CO 0.00 0.85 -0.78 -0.63 -0.69 0.00 0.00 178.15 176.90 1yjv s ILE 53 N -2.62 0.58 0.80 -0.67 -1.09 -0.93 -4.83 121.20 112.43 1yjv s ILE 53 Ca -0.08 -0.12 -0.07 0.00 -2.23 0.00 0.00 60.65 58.15 1yjv s ILE 53 Cb 0.06 -0.77 0.14 0.00 -1.58 0.00 0.00 42.46 40.32 1yjv s ILE 53 CO 0.89 0.20 1.11 -0.83 -1.23 0.00 0.00 174.94 175.07 1yjv s GLY 54 N 1.88 1.76 0.18 6.18 0.00 -1.26 -3.91 107.32 112.14 1yjv s GLY 54 Ca 0.04 -1.43 -0.11 0.00 0.00 0.00 0.00 44.72 43.22 1yjv s GLY 54 CO -0.06 -0.81 1.72 -0.56 0.00 0.00 0.00 173.10 173.39 1yjv h PRO 55 N -0.93 0.93 -0.71 2.90 0.13 -1.97 -3.00 132.00 129.35 1yjv h PRO 55 Ca -0.40 -0.18 0.12 0.00 -0.87 0.00 0.00 66.00 64.66 1yjv h PRO 55 Cb 1.26 -0.15 -0.13 0.00 0.13 0.00 0.00 31.00 32.12 1yjv h PRO 55 CO 0.42 0.81 -0.38 0.00 -0.23 0.00 0.00 178.00 178.62 1yjv h ARG 56 N 0.87 -0.12 0.05 0.86 -0.00 -1.98 -0.80 114.38 113.25 1yjv h ARG 56 Ca 0.20 0.01 0.03 0.00 -0.50 0.00 0.00 59.98 59.72 1yjv h ARG 56 Cb 0.24 0.03 -0.05 0.00 0.00 0.00 0.00 29.97 30.19 1yjv h ARG 56 CO -0.01 -0.08 -0.35 -0.44 0.00 0.00 0.00 179.97 179.09 1yjv h ASP 57 N -0.12 -1.02 0.32 7.04 5.19 -1.91 0.19 116.42 126.10 1yjv h ASP 57 Ca 0.25 0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 56.77 1yjv h ASP 57 Cb 0.56 0.40 0.00 0.00 0.18 0.00 0.00 39.33 40.47 1yjv h ASP 57 CO -0.78 -0.42 -0.16 0.40 -3.12 0.00 0.00 179.24 175.17 1yjv h ILE 58 N -0.53 0.67 0.00 0.35 2.04 -1.50 0.19 117.51 118.73 1yjv h ILE 58 Ca 0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.94 1yjv h ILE 58 Cb 0.59 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.30 1yjv h ILE 58 CO -0.25 0.00 -0.29 0.40 0.00 0.00 0.00 178.15 178.02 1yjv h ILE 59 N -0.44 0.36 -0.93 -0.67 2.04 -0.95 0.38 117.51 117.31 1yjv h ILE 59 Ca -0.04 0.00 0.16 0.00 1.00 0.00 0.00 64.86 65.98 1yjv h ILE 59 Cb 0.34 0.36 -0.10 0.00 -0.74 0.00 0.00 36.82 36.69 1yjv h ILE 59 CO 0.07 0.00 0.53 -0.74 0.00 0.00 0.00 178.15 178.00 1yjv h HIS 60 N -0.43 0.93 -0.06 1.37 2.76 -0.47 0.78 115.15 120.03 1yjv h HIS 60 Ca 0.06 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1yjv h HIS 60 Cb 0.52 -0.27 -0.00 0.00 1.55 0.00 0.00 27.41 29.21 1yjv h HIS 60 CO -0.31 0.23 -0.06 1.15 -1.30 0.00 0.00 177.93 177.64 1yjv h THR 61 N 0.72 1.38 -0.39 6.26 2.02 0.14 0.13 112.91 123.17 1yjv h THR 61 Ca 0.51 -1.22 0.08 0.00 0.77 0.00 0.00 66.41 66.56 1yjv h THR 61 Cb 0.73 2.06 -0.08 0.00 -1.74 0.00 0.00 68.15 69.13 1yjv h THR 61 CO -0.36 0.33 -0.13 0.40 0.37 0.00 0.00 175.52 176.13 1yjv h ILE 62 N -0.30 0.54 0.26 3.11 2.04 -0.34 -0.39 117.51 122.43 1yjv h ILE 62 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1yjv h ILE 62 Cb 0.57 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1yjv h ILE 62 CO 0.01 0.00 -0.31 -0.33 0.00 0.00 0.00 178.15 177.53 1yjv h GLU 63 N -0.05 -0.59 -0.18 2.37 5.08 -0.79 -2.78 114.58 117.64 1yjv h GLU 63 Ca 0.19 0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1yjv h GLU 63 Cb 0.34 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1yjv h GLU 63 CO -0.43 -0.39 -0.02 0.66 -1.00 0.00 0.00 179.01 177.82 1yjv h SER 64 N -0.61 0.24 0.00 1.42 4.64 -0.23 -3.24 113.55 115.76 1yjv h SER 64 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1yjv h SER 64 Cb 0.58 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1yjv h SER 64 CO -0.09 0.31 0.00 0.18 -0.87 0.00 0.00 176.83 176.36 1yjv n LEU 65 N -4.36 0.00 -0.75 5.97 7.99 -0.20 -4.91 117.00 120.73 1yjv n LEU 65 Ca -0.00 0.23 -0.04 0.00 -0.01 0.00 0.00 56.01 56.19 1yjv n LEU 65 Cb 0.19 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.47 1yjv n LEU 65 CO 0.37 0.00 0.28 0.61 -1.51 0.00 0.00 177.39 177.14 1yjv n GLY 66 N -0.24 0.63 3.33 -0.72 0.00 -1.17 -5.12 105.19 101.90 1yjv n GLY 66 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 1.68 0.24 1.61 0.08 -1.06 -4.84 117.98 115.68 1yjv s PHE 67 Ca 0.00 -1.51 0.11 0.00 0.12 0.00 0.00 56.93 55.65 1yjv s PHE 67 Cb 0.00 -0.82 -0.05 0.00 -0.57 0.00 0.00 43.02 41.58 1yjv s PHE 67 CO 0.00 -0.67 -0.21 -1.21 -0.10 0.00 0.00 175.22 173.03 1yjv s GLU 68 N -3.63 1.59 0.02 0.44 2.02 0.04 -4.01 118.70 115.17 1yjv s GLU 68 Ca 0.36 -1.66 -0.08 0.00 0.02 0.00 0.00 54.97 53.62 1yjv s GLU 68 Cb 0.03 -1.76 -0.00 0.00 0.10 0.00 0.00 34.13 32.50 1yjv s GLU 68 CO 0.22 0.35 0.16 0.00 0.02 0.00 0.00 175.26 176.00 1yjv s ALA 69 N -2.18 -0.29 -0.23 5.21 0.00 -1.26 -1.20 121.76 121.81 1yjv s ALA 69 Ca 0.26 -0.27 -0.17 0.00 0.00 0.00 0.00 51.96 51.77 1yjv s ALA 69 Cb -0.06 0.21 0.06 0.00 0.00 0.00 0.00 23.12 23.33 1yjv s ALA 69 CO 0.12 -0.29 0.58 -1.12 0.00 0.00 0.00 175.76 175.05 1yjv s SER 70 N -1.83 -0.68 0.02 0.00 0.01 0.16 -4.99 113.70 106.38 1yjv s SER 70 Ca -0.09 1.22 -0.09 0.00 1.31 0.00 0.00 55.95 58.30 1yjv s SER 70 Cb -0.03 1.17 -0.04 0.00 0.21 0.00 0.00 66.02 67.33 1yjv s SER 70 CO -0.02 -0.21 1.14 -0.07 0.41 0.00 0.00 173.24 174.49 1yjv h LEU 71 N 6.05 -0.36 0.00 2.44 4.07 -1.88 0.21 115.31 125.84 1yjv h LEU 71 Ca -0.30 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1yjv h LEU 71 Cb 1.19 0.13 0.00 0.00 1.08 0.00 0.00 40.66 43.05 1yjv h LEU 71 CO 0.17 -0.15 0.00 0.55 -1.08 0.00 0.00 178.44 177.93 1yjv n VAL 72 N -3.11 0.00 -1.83 1.22 3.14 -1.26 -3.72 118.33 112.76 1yjv n VAL 72 Ca -0.03 0.00 -0.21 0.00 -2.96 0.00 0.00 64.34 61.15 1yjv n VAL 72 Cb 0.11 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.83 1yjv n VAL 72 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1yjv s LYS 73 N 0.00 2.08 1.18 1.45 2.20 -1.26 -4.96 119.74 120.43 1yjv s LYS 73 Ca 0.00 -0.03 -0.14 0.00 -0.36 0.00 0.00 55.97 55.43 1yjv s LYS 73 Cb 0.00 -4.96 0.25 0.00 -1.51 0.00 0.00 37.83 31.61 1yjv s LYS 73 CO 0.00 -3.98 0.74 0.44 -0.36 0.00 0.00 175.35 172.20 1yjv n ILE 74 N 8.31 0.00 0.00 5.43 -5.35 -1.26 -5.03 119.36 121.47 1yjv n ILE 74 Ca 0.43 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1yjv n ILE 74 Cb 0.45 -0.89 0.00 0.00 -1.74 0.00 0.00 39.64 37.46 1yjv n ILE 74 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17