#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ljz s VAL 2 N 0.00 5.30 -0.12 1.39 1.01 -1.26 -2.10 120.40 124.61 1ljz s VAL 2 Ca 0.00 -0.59 -0.09 0.00 0.00 0.00 0.00 61.98 61.31 1ljz s VAL 2 Cb 0.00 -3.73 0.04 0.00 0.00 0.00 0.00 36.38 32.69 1ljz s VAL 2 CO 0.00 -0.10 0.31 0.00 0.00 0.00 0.00 175.10 175.31 1ljz s HIS 4 N 0.73 3.24 -0.08 0.00 3.76 -1.26 -0.56 115.29 121.12 1ljz s HIS 4 Ca -0.05 0.77 -0.31 0.00 -0.15 0.00 0.00 55.06 55.32 1ljz s HIS 4 Cb -0.06 -2.92 0.12 0.00 1.11 0.00 0.00 32.58 30.83 1ljz s HIS 4 CO -0.05 -1.03 1.04 -0.08 -0.85 0.00 0.00 174.74 173.77 1ljz s THR 5 N -3.16 0.00 -0.37 1.30 -1.32 0.45 -2.88 115.64 109.66 1ljz s THR 5 Ca 0.56 -0.03 0.03 0.00 -1.21 0.00 0.00 61.69 61.04 1ljz s THR 5 Cb -0.11 -1.07 0.11 0.00 -1.51 0.00 0.00 72.50 69.92 1ljz s THR 5 CO 0.48 0.00 0.11 0.42 -2.21 0.00 0.00 174.62 173.41 1ljz s THR 6 N -2.81 1.96 0.00 5.08 -4.23 -1.02 0.16 115.64 114.77 1ljz s THR 6 Ca 0.07 -2.31 0.00 0.00 -1.18 0.00 0.00 61.69 58.28 1ljz s THR 6 Cb -0.01 -2.43 0.00 0.00 1.34 0.00 0.00 72.50 71.40 1ljz s THR 6 CO -0.07 -0.67 0.00 0.00 -0.54 0.00 0.00 174.62 173.35 1ljz n ALA 7 N 4.16 0.58 -1.28 3.99 0.00 -1.26 -4.74 120.51 121.95 1ljz n ALA 7 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1ljz n ALA 7 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1ljz n ALA 7 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1ljz n THR 8 N -1.66 0.00 0.25 0.00 5.66 -1.26 -4.98 114.28 112.29 1ljz n THR 8 Ca 0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.88 1ljz n THR 8 Cb 0.00 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.72 1ljz n THR 8 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1ljz h SER 9 N 0.00 -0.59 -3.64 1.09 0.02 -2.01 -3.46 113.55 104.96 1ljz h SER 9 Ca 0.00 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1ljz h SER 9 Cb 0.00 0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1ljz h SER 9 CO 0.00 -0.18 -0.00 -0.81 -1.14 0.00 0.00 176.83 174.70 1ljz n PRO 10 N -5.25 1.37 -1.89 3.45 -0.04 -1.26 -5.05 135.00 126.33 1ljz n PRO 10 Ca -0.10 -0.02 -0.42 0.00 -0.04 0.00 0.00 63.50 62.92 1ljz n PRO 10 Cb 0.30 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.74 1ljz n PRO 10 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ljz s ILE 11 N 0.22 2.42 0.12 0.52 1.09 -1.26 -4.40 121.20 119.92 1ljz s ILE 11 Ca 0.00 0.33 -0.01 0.00 -1.10 0.00 0.00 60.65 59.87 1ljz s ILE 11 Cb -0.00 -3.21 -0.04 0.00 -1.06 0.00 0.00 42.46 38.15 1ljz s ILE 11 CO 0.00 0.04 0.30 -0.94 -0.10 0.00 0.00 174.94 174.24 1ljz s SER 12 N 0.80 6.39 -0.04 3.58 1.04 0.42 -4.89 113.70 121.00 1ljz s SER 12 Ca 0.66 0.34 -0.01 0.00 0.48 0.00 0.00 55.95 57.42 1ljz s SER 12 Cb -0.45 -1.99 0.03 0.00 0.10 0.00 0.00 66.02 63.71 1ljz s SER 12 CO 0.38 0.08 0.05 0.00 0.98 0.00 0.00 173.24 174.73 1ljz s ALA 13 N -1.66 0.21 0.02 5.32 0.00 -1.26 0.17 121.76 124.56 1ljz s ALA 13 Ca 0.37 0.21 -0.00 0.00 0.00 0.00 0.00 51.96 52.54 1ljz s ALA 13 Cb -0.12 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1ljz s ALA 13 CO 0.28 -0.36 -0.03 0.14 0.00 0.00 0.00 175.76 175.78 1ljz s VAL 14 N 1.80 0.11 -0.05 0.00 -7.23 0.27 -4.92 120.40 110.39 1ljz s VAL 14 Ca 0.00 -0.91 -0.21 0.00 -1.81 0.00 0.00 61.98 59.05 1ljz s VAL 14 Cb -0.12 -0.26 -0.05 0.00 0.56 0.00 0.00 36.38 36.51 1ljz s VAL 14 CO -0.03 -0.50 0.60 0.42 -0.31 0.00 0.00 175.10 175.28 1ljz s THR 15 N -1.46 5.02 -1.19 5.32 -4.23 -1.26 -1.15 115.64 116.68 1ljz s THR 15 Ca -0.16 1.25 -0.11 0.00 -1.18 0.00 0.00 61.69 61.48 1ljz s THR 15 Cb -0.10 -3.94 0.20 0.00 1.34 0.00 0.00 72.50 70.00 1ljz s THR 15 CO -0.01 0.34 1.42 0.00 -0.54 0.00 0.00 174.62 175.83 1ljz h PRO 17 N 6.75 0.42 0.00 0.00 0.13 -1.87 -3.41 132.00 134.02 1ljz h PRO 17 Ca 0.29 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 1ljz h PRO 17 Cb 0.83 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1ljz h PRO 17 CO 1.24 0.28 0.00 -2.30 -0.23 0.00 0.00 178.00 176.99 1ljz n PRO 18 N -4.47 -1.52 0.18 1.56 -0.02 -1.26 -4.90 135.00 124.57 1ljz n PRO 18 Ca 0.10 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.61 1ljz n PRO 18 Cb 0.37 0.00 0.33 0.00 -0.02 0.00 0.00 33.50 34.18 1ljz n PRO 18 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ljz h GLY 19 N -0.80 0.00 -7.29 -1.23 0.00 -2.00 -3.39 103.07 88.35 1ljz h GLY 19 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1ljz h GLY 19 CO 0.00 0.00 1.05 -1.83 0.00 0.00 0.00 176.54 175.76 1ljz s GLU 20 N -3.87 3.29 0.00 4.80 -1.05 -1.26 -4.74 118.70 115.88 1ljz s GLU 20 Ca -0.02 -0.65 0.02 0.00 -0.15 0.00 0.00 54.97 54.17 1ljz s GLU 20 Cb 0.13 -4.51 0.03 0.00 -0.44 0.00 0.00 34.13 29.35 1ljz s GLU 20 CO 0.71 -2.08 0.77 0.09 0.95 0.00 0.00 175.26 175.70 1ljz n ASN 21 N 8.77 1.59 -4.68 0.83 3.02 -1.19 -4.58 115.26 119.01 1ljz n ASN 21 Ca 0.10 -1.47 -0.42 0.00 -0.03 0.00 0.00 54.58 52.76 1ljz n ASN 21 Cb 0.49 -0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.61 1ljz n ASN 21 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ljz s LEU 22 N -0.52 4.30 -0.22 3.41 0.20 0.32 -4.61 118.68 121.57 1ljz s LEU 22 Ca 0.03 2.04 -0.14 0.00 0.69 0.00 0.00 54.13 56.76 1ljz s LEU 22 Cb 0.02 -3.56 -0.04 0.00 -0.43 0.00 0.00 46.19 42.18 1ljz s LEU 22 CO 0.03 -0.72 0.31 0.00 -0.29 0.00 0.00 176.35 175.68 1ljz s TYR 24 N 1.31 2.77 -0.55 0.00 1.13 -0.65 0.12 117.35 121.48 1ljz s TYR 24 Ca 0.15 -0.17 0.04 0.00 -1.41 0.00 0.00 57.07 55.67 1ljz s TYR 24 Cb -0.14 -1.31 0.15 0.00 -1.10 0.00 0.00 41.96 39.55 1ljz s TYR 24 CO 0.07 0.54 0.34 0.50 -2.51 0.00 0.00 175.55 174.49 1ljz s ARG 25 N -3.12 1.85 -0.38 -3.49 3.00 -0.58 -2.56 118.95 113.66 1ljz s ARG 25 Ca 0.28 -2.64 -0.29 0.00 -1.00 0.00 0.00 55.73 52.08 1ljz s ARG 25 Cb -0.08 -2.90 0.01 0.00 0.00 0.00 0.00 34.95 31.97 1ljz s ARG 25 CO 0.18 -1.21 1.29 0.15 0.00 0.00 0.00 175.30 175.72 1ljz s LYS 26 N -0.46 3.76 -0.04 5.12 -0.14 -1.01 -1.79 119.74 125.18 1ljz s LYS 26 Ca 0.21 0.98 0.00 0.00 -1.36 0.00 0.00 55.97 55.80 1ljz s LYS 26 Cb -0.16 -3.93 0.03 0.00 -1.68 0.00 0.00 37.83 32.09 1ljz s LYS 26 CO -0.07 -1.32 -0.01 -1.64 -0.76 0.00 0.00 175.35 171.55 1ljz s MET 27 N 4.47 0.50 0.00 1.68 -1.94 -0.90 -1.18 119.30 121.92 1ljz s MET 27 Ca 0.55 0.04 0.00 0.00 -1.71 0.00 0.00 55.69 54.58 1ljz s MET 27 Cb -0.13 -0.68 0.00 0.00 2.01 0.00 0.00 34.83 36.03 1ljz s MET 27 CO 0.28 -0.16 0.00 -2.67 -0.01 0.00 0.00 175.02 172.46 1ljz n TRP 28 N 4.37 0.00 -4.39 -0.03 2.14 -0.99 0.41 117.44 118.94 1ljz n TRP 28 Ca -0.21 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.06 1ljz n TRP 28 Cb 0.50 0.00 -0.17 0.00 -0.81 0.00 0.00 31.31 30.84 1ljz n TRP 28 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1ljz s ASP 30 N 1.07 3.40 0.00 0.00 2.15 -0.87 -4.76 116.67 117.65 1ljz s ASP 30 Ca -0.03 -1.62 0.00 0.00 0.43 0.00 0.00 52.55 51.33 1ljz s ASP 30 Cb -0.14 -0.41 0.00 0.00 -0.30 0.00 0.00 42.92 42.06 1ljz s ASP 30 CO -0.04 -0.39 0.00 0.00 -0.17 0.00 0.00 175.17 174.56 1ljz n ALA 31 N 4.82 0.00 0.12 3.66 0.00 -1.20 -2.76 120.51 125.15 1ljz n ALA 31 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ljz n ALA 31 Cb 0.40 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.15 1ljz n ALA 31 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1ljz h PHE 32 N 0.00 0.19 -0.42 0.00 3.57 -1.46 21.09 116.94 139.92 1ljz h PHE 32 Ca 0.00 -0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.32 1ljz h PHE 32 Cb 0.00 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1ljz h PHE 32 CO 0.00 0.49 -0.29 0.00 -2.23 0.00 0.00 178.31 176.28 1ljz n SER 34 N -4.12 0.00 0.00 0.00 7.64 0.31 -5.05 113.62 112.39 1ljz n SER 34 Ca -0.01 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1ljz n SER 34 Cb 0.49 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 1ljz n SER 34 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ljz n SER 35 N -1.50 0.00 0.00 6.43 3.41 6.39 -4.98 113.62 123.37 1ljz n SER 35 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ljz n SER 35 Cb 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1ljz n SER 35 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ljz n ARG 36 N -2.49 0.00 -3.83 4.33 0.63 0.96 -4.52 116.66 111.74 1ljz n ARG 36 Ca 0.00 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.86 1ljz n ARG 36 Cb 0.00 -0.23 0.02 0.00 0.45 0.00 0.00 32.46 32.70 1ljz n ARG 36 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1ljz s GLY 37 N 0.00 0.27 1.02 5.14 0.00 -1.11 -4.08 107.32 108.56 1ljz s GLY 37 Ca 0.00 -0.61 -0.14 0.00 0.00 0.00 0.00 44.72 43.97 1ljz s GLY 37 CO 0.00 0.40 1.13 0.54 0.00 0.00 0.00 173.10 175.17 1ljz s LYS 38 N -2.36 0.29 -0.00 2.90 3.01 -1.26 -1.65 119.74 120.67 1ljz s LYS 38 Ca 0.17 0.21 0.01 0.00 -1.01 0.00 0.00 55.97 55.36 1ljz s LYS 38 Cb -0.04 -1.75 -0.04 0.00 -1.01 0.00 0.00 37.83 34.99 1ljz s LYS 38 CO 0.09 -2.76 0.00 0.08 0.51 0.00 0.00 175.35 173.28 1ljz s VAL 39 N -3.16 4.17 -0.05 3.17 1.01 0.64 -4.55 120.40 121.62 1ljz s VAL 39 Ca 0.67 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 1ljz s VAL 39 Cb -0.14 -2.86 0.03 0.00 0.00 0.00 0.00 36.38 33.41 1ljz s VAL 39 CO 0.55 0.38 0.07 -0.69 0.00 0.00 0.00 175.10 175.41 1ljz s VAL 40 N -1.09 -0.12 -0.30 2.92 1.01 -1.26 -2.35 120.40 119.21 1ljz s VAL 40 Ca 0.20 0.39 -0.03 0.00 0.00 0.00 0.00 61.98 62.53 1ljz s VAL 40 Cb -0.12 -0.19 0.11 0.00 0.00 0.00 0.00 36.38 36.18 1ljz s VAL 40 CO 0.10 0.15 0.14 -1.83 0.00 0.00 0.00 175.10 173.66 1ljz s GLU 41 N 2.18 0.33 0.23 2.72 -1.05 -0.33 -4.93 118.70 117.85 1ljz s GLU 41 Ca 0.05 -0.74 -0.16 0.00 -0.15 0.00 0.00 54.97 53.96 1ljz s GLU 41 Cb -0.12 -1.32 -0.08 0.00 -0.44 0.00 0.00 34.13 32.17 1ljz s GLU 41 CO -0.04 -1.04 0.67 -0.51 0.95 0.00 0.00 175.26 175.29 1ljz s LEU 42 N 1.86 4.26 0.00 1.83 1.43 -1.26 -2.40 118.68 124.40 1ljz s LEU 42 Ca 0.11 1.26 -0.06 0.00 -1.03 0.00 0.00 54.13 54.41 1ljz s LEU 42 Cb -0.17 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.43 1ljz s LEU 42 CO -0.29 -0.02 0.28 0.61 0.23 0.00 0.00 176.35 177.16 1ljz n GLY 43 N 0.41 1.01 3.26 -3.19 0.00 -1.06 -2.43 105.19 103.19 1ljz n GLY 43 Ca -0.01 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.76 1ljz n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ljz n ALA 45 N 2.35 -1.12 -0.02 0.00 0.00 0.16 -4.95 120.51 116.93 1ljz n ALA 45 Ca -0.16 -1.29 -0.00 0.00 0.00 0.00 0.00 53.44 51.99 1ljz n ALA 45 Cb 0.52 1.04 -0.05 0.00 0.00 0.00 0.00 19.45 20.96 1ljz n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ljz n ALA 46 N -0.81 2.03 -3.04 0.00 0.00 -1.26 -0.52 120.51 116.91 1ljz n ALA 46 Ca -0.14 -0.28 -0.17 0.00 0.00 0.00 0.00 53.44 52.85 1ljz n ALA 46 Cb 0.54 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 1ljz n ALA 46 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1ljz n THR 47 N -1.99 -0.49 -1.27 0.00 5.66 -1.26 -4.86 114.28 110.07 1ljz n THR 47 Ca -0.06 -2.84 -0.41 0.00 -3.05 0.00 0.00 64.05 57.69 1ljz n THR 47 Cb 0.45 -0.55 -0.01 0.00 -1.55 0.00 0.00 70.33 68.68 1ljz n THR 47 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ljz n PRO 49 N 1.25 0.69 -0.80 0.00 -0.02 -1.26 -4.97 135.00 129.90 1ljz n PRO 49 Ca 0.12 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.31 1ljz n PRO 49 Cb 0.37 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 34.08 1ljz n PRO 49 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1ljz s SER 50 N -2.09 1.11 0.00 2.55 0.01 -1.26 -5.05 113.70 108.97 1ljz s SER 50 Ca 0.00 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.42 1ljz s SER 50 Cb 0.00 -1.77 0.00 0.00 0.21 0.00 0.00 66.02 64.46 1ljz s SER 50 CO 0.00 -4.07 0.00 2.29 0.41 0.00 0.00 173.24 171.87 1ljz n LYS 51 N -4.79 0.00 -0.39 12.44 -0.00 -1.26 -4.61 118.16 119.54 1ljz n LYS 51 Ca 0.06 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.42 1ljz n LYS 51 Cb 0.57 0.00 0.20 0.00 -0.00 0.00 0.00 35.03 35.80 1ljz n LYS 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1ljz n LYS 52 N 0.00 2.73 0.22 -1.58 0.00 -1.22 -3.86 118.16 114.45 1ljz n LYS 52 Ca 0.00 -1.58 0.13 0.00 0.00 0.00 0.00 58.31 56.86 1ljz n LYS 52 Cb 0.00 -1.73 0.70 0.00 0.00 0.00 0.00 35.03 33.99 1ljz n LYS 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 1ljz h PRO 53 N 2.15 0.00 0.00 1.64 0.11 -2.02 -3.39 132.00 130.49 1ljz h PRO 53 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ljz h PRO 53 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ljz h PRO 53 CO 0.19 0.00 0.00 0.98 -0.21 0.00 0.00 178.00 178.96 1ljz n TYR 54 N -2.46 0.00 -4.69 0.65 4.19 -1.26 -5.16 117.16 108.43 1ljz n TYR 54 Ca -0.02 0.00 -0.33 0.00 3.31 0.00 0.00 57.90 60.86 1ljz n TYR 54 Cb 0.15 0.00 -0.06 0.00 0.49 0.00 0.00 39.34 39.92 1ljz n TYR 54 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 1ljz s GLU 55 N -0.58 2.23 -0.50 2.98 2.02 -1.25 -4.79 118.70 118.80 1ljz s GLU 55 Ca 0.00 -2.40 0.03 0.00 0.02 0.00 0.00 54.97 52.62 1ljz s GLU 55 Cb 0.00 -1.58 0.13 0.00 0.10 0.00 0.00 34.13 32.79 1ljz s GLU 55 CO 0.00 -0.43 0.27 -2.00 0.02 0.00 0.00 175.26 173.12 1ljz s GLU 56 N -3.94 1.75 -0.31 1.61 2.56 0.17 -3.43 118.70 117.10 1ljz s GLU 56 Ca 0.05 -2.45 -0.17 0.00 0.00 0.00 0.00 54.97 52.40 1ljz s GLU 56 Cb 0.00 -2.96 -0.02 0.00 2.00 0.00 0.00 34.13 33.15 1ljz s GLU 56 CO 0.03 -1.14 0.47 0.54 -0.56 0.00 0.00 175.26 174.60 1ljz s VAL 57 N -0.13 5.07 -0.62 3.70 0.11 -1.25 -2.13 120.40 125.15 1ljz s VAL 57 Ca 0.18 0.48 -0.21 0.00 -2.93 0.00 0.00 61.98 59.50 1ljz s VAL 57 Cb -0.24 -3.87 0.09 0.00 -1.53 0.00 0.00 36.38 30.83 1ljz s VAL 57 CO -0.01 -0.06 0.83 -0.89 -3.33 0.00 0.00 175.10 171.63 1ljz s THR 58 N 2.28 4.58 -0.50 5.04 2.01 -0.74 -4.81 115.64 123.50 1ljz s THR 58 Ca 0.18 -0.69 -0.26 0.00 0.31 0.00 0.00 61.69 61.23 1ljz s THR 58 Cb -0.16 -4.58 0.03 0.00 0.01 0.00 0.00 72.50 67.80 1ljz s THR 58 CO 0.12 -1.28 1.01 0.00 -0.69 0.00 0.00 174.62 173.77 1ljz n SER 61 N 3.67 6.75 -4.16 0.00 7.64 -1.26 0.14 113.62 126.39 1ljz n SER 61 Ca -0.20 -3.70 -0.19 0.00 1.01 0.00 0.00 58.87 55.78 1ljz n SER 61 Cb 0.55 -1.02 -0.12 0.00 -1.01 0.00 0.00 64.21 62.60 1ljz n SER 61 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ljz s THR 62 N -4.46 1.11 -0.50 0.44 -4.23 -1.26 -4.88 115.64 101.86 1ljz s THR 62 Ca 0.42 -1.21 -0.45 0.00 -1.18 0.00 0.00 61.69 59.27 1ljz s THR 62 Cb 0.23 -1.05 -0.19 0.00 1.34 0.00 0.00 72.50 72.83 1ljz s THR 62 CO -0.16 -0.16 1.89 0.47 -0.54 0.00 0.00 174.62 176.13 1ljz n ASP 63 N 1.47 0.95 -4.07 3.99 8.00 -1.24 -0.72 116.55 124.93 1ljz n ASP 63 Ca -0.20 0.90 -0.35 0.00 0.71 0.00 0.00 54.79 55.85 1ljz n ASP 63 Cb 0.54 -0.89 -0.02 0.00 -0.02 0.00 0.00 41.12 40.73 1ljz n ASP 63 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ljz n LYS 64 N 5.91 -1.27 0.00 -1.24 4.76 0.15 -4.85 118.16 121.62 1ljz n LYS 64 Ca 0.44 0.21 0.14 0.00 -2.87 0.00 0.00 58.31 56.23 1ljz n LYS 64 Cb -0.05 -3.53 0.60 0.00 -1.84 0.00 0.00 35.03 30.21 1ljz n LYS 64 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ljz n ASN 66 N -0.82 4.21 -1.31 0.00 6.94 -1.26 -4.95 115.26 118.06 1ljz n ASN 66 Ca 0.15 -3.30 0.00 0.00 -0.02 0.00 0.00 54.58 51.41 1ljz n ASN 66 Cb 0.28 -0.91 0.00 0.00 -2.36 0.00 0.00 39.78 36.79 1ljz n ASN 66 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1ljz n PRO 67 N 1.60 3.52 -4.57 -0.53 -0.04 -1.26 -4.49 135.00 129.24 1ljz n PRO 67 Ca 0.25 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.37 1ljz n PRO 67 Cb 0.37 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.73 1ljz n PRO 67 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1ljz s HIS 68 N 1.66 2.97 -0.07 0.54 3.76 -1.26 -4.92 115.29 117.97 1ljz s HIS 68 Ca 0.00 0.04 -0.22 0.00 -0.15 0.00 0.00 55.06 54.73 1ljz s HIS 68 Cb 0.00 -1.71 -0.18 0.00 1.11 0.00 0.00 32.58 31.81 1ljz s HIS 68 CO 0.00 0.36 0.86 -1.00 -0.85 0.00 0.00 174.74 174.11 1ljz h PRO 69 N 5.13 -0.12 -0.12 8.40 0.13 -1.98 -3.35 132.00 140.09 1ljz h PRO 69 Ca -0.49 0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1ljz h PRO 69 Cb 1.17 0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ljz h PRO 69 CO 0.53 0.41 -0.10 -0.22 -0.23 0.00 0.00 178.00 178.39 1ljz h LYS 70 N -0.84 0.27 -7.15 0.86 1.63 -2.05 -3.45 116.57 105.85 1ljz h LYS 70 Ca -0.01 -0.14 -0.46 0.00 -0.85 0.00 0.00 60.65 59.19 1ljz h LYS 70 Cb 0.58 0.00 0.06 0.00 -0.60 0.00 0.00 32.23 32.28 1ljz h LYS 70 CO 0.02 0.66 0.16 -0.65 -3.45 0.00 0.00 179.45 176.20 1ljz s GLN 71 N -4.36 2.55 -0.06 1.90 -0.21 -1.26 -4.47 119.66 113.76 1ljz s GLN 71 Ca -0.14 -0.23 -0.00 0.00 0.02 0.00 0.00 55.36 55.00 1ljz s GLN 71 Cb 0.04 -2.26 0.00 0.00 1.00 0.00 0.00 33.01 31.79 1ljz s GLN 71 CO 0.73 -0.93 0.01 0.54 -2.12 0.00 0.00 175.29 173.52 1ljz n ARG 72 N -2.69 -0.10 -0.18 2.91 5.12 -1.26 -4.34 116.66 116.13 1ljz n ARG 72 Ca 0.06 0.03 0.03 0.00 -1.93 0.00 0.00 57.85 56.05 1ljz n ARG 72 Cb 0.59 -3.39 0.10 0.00 -1.16 0.00 0.00 32.46 28.61 1ljz n ARG 72 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1ljz n PRO 73 N -0.99 1.77 0.00 5.56 -0.04 -1.26 -5.03 135.00 135.01 1ljz n PRO 73 Ca -0.01 -0.84 0.00 0.00 -0.04 0.00 0.00 63.50 62.62 1ljz n PRO 73 Cb 0.51 -1.41 0.02 0.00 -0.04 0.00 0.00 33.50 32.57 1ljz n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87