#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 5.24 -0.14 1.39 1.01 -1.26 -1.85 120.40 124.79 1ljz s VAL 2 Ca 0.00 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.96 1ljz s VAL 2 Cb 0.00 -3.85 0.04 0.00 0.00 0.00 0.00 36.38 32.56 1ljz s VAL 2 CO 0.00 -0.35 0.36 0.00 0.00 0.00 0.00 175.10 175.11 1ljz s HIS 4 N 0.32 2.57 0.02 0.00 3.76 -1.26 0.10 115.29 120.80 1ljz s HIS 4 Ca -0.01 0.18 -0.29 0.00 -0.15 0.00 0.00 55.06 54.78 1ljz s HIS 4 Cb -0.03 -3.10 0.10 0.00 1.11 0.00 0.00 32.58 30.66 1ljz s HIS 4 CO -0.01 -1.40 1.13 -0.08 -0.85 0.00 0.00 174.74 173.54 1ljz s THR 5 N -3.14 0.00 -0.33 1.30 -1.32 0.31 -3.91 115.64 108.56 1ljz s THR 5 Ca 0.61 -0.32 0.02 0.00 -1.21 0.00 0.00 61.69 60.80 1ljz s THR 5 Cb -0.09 -1.77 0.10 0.00 -1.51 0.00 0.00 72.50 69.22 1ljz s THR 5 CO 0.43 0.00 0.06 0.42 -2.21 0.00 0.00 174.62 173.33 1ljz s THR 6 N -2.77 1.78 0.00 5.08 -4.23 -1.24 0.84 115.64 115.09 1ljz s THR 6 Ca 0.12 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 1ljz s THR 6 Cb 0.02 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.54 1ljz s THR 6 CO -0.02 -0.61 0.00 0.00 -0.54 0.00 0.00 174.62 173.45 1ljz n ALA 7 N 4.47 0.00 -1.00 3.99 0.00 -1.26 -4.86 120.51 121.84 1ljz n ALA 7 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1ljz n ALA 7 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 -1.08 0.00 0.23 0.00 5.66 -1.26 -4.97 114.28 112.86 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 -0.55 -2.75 1.09 0.02 -2.01 -3.46 113.55 105.89 1ljz h SER 9 Ca 0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1ljz h SER 9 Cb 0.00 0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1ljz h SER 9 CO 0.00 -0.14 0.00 -0.81 -1.14 0.00 0.00 176.83 174.74 1ljz n PRO 10 N -5.22 2.25 -1.99 3.45 -0.04 -1.26 -5.05 135.00 127.14 1ljz n PRO 10 Ca -0.09 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.96 1ljz n PRO 10 Cb 0.29 0.00 -0.01 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 1.46 2.45 0.17 0.52 1.01 -1.26 -4.45 121.20 121.10 1ljz s ILE 11 Ca 0.00 0.44 -0.00 0.00 0.00 0.00 0.00 60.65 61.09 1ljz s ILE 11 Cb 0.00 -3.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 1ljz s ILE 11 CO 0.00 0.10 0.34 -0.94 0.00 0.00 0.00 174.94 174.44 1ljz s SER 12 N -0.43 6.38 -0.21 3.58 1.04 0.25 -4.91 113.70 119.39 1ljz s SER 12 Ca 0.52 0.34 -0.04 0.00 0.48 0.00 0.00 55.95 57.26 1ljz s SER 12 Cb -0.42 -1.99 0.11 0.00 0.10 0.00 0.00 66.02 63.82 1ljz s SER 12 CO 0.56 0.01 0.29 0.00 0.98 0.00 0.00 173.24 175.07 1ljz s ALA 13 N -1.79 -0.64 0.16 5.32 0.00 -1.26 0.11 121.76 123.67 1ljz s ALA 13 Ca 0.37 0.58 0.07 0.00 0.00 0.00 0.00 51.96 52.99 1ljz s ALA 13 Cb -0.11 -1.45 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 1ljz s ALA 13 CO 0.28 -1.19 -0.16 0.54 0.00 0.00 0.00 175.76 175.24 1ljz s VAL 14 N 2.43 1.61 -0.19 0.00 0.11 0.29 -4.88 120.40 119.77 1ljz s VAL 14 Ca 0.09 -1.92 -0.16 0.00 -2.93 0.00 0.00 61.98 57.05 1ljz s VAL 14 Cb -0.15 -1.79 -0.04 0.00 -1.53 0.00 0.00 36.38 32.87 1ljz s VAL 14 CO -0.13 -0.43 0.41 -0.89 -3.33 0.00 0.00 175.10 170.72 1ljz s THR 15 N -2.34 5.20 -0.50 5.04 2.01 -1.26 0.13 115.64 123.92 1ljz s THR 15 Ca 0.15 0.74 -0.22 0.00 0.31 0.00 0.00 61.69 62.68 1ljz s THR 15 Cb -0.04 -3.74 0.04 0.00 0.01 0.00 0.00 72.50 68.77 1ljz s THR 15 CO 0.05 0.27 0.75 0.00 -0.69 0.00 0.00 174.62 175.00 1ljz h PRO 17 N 9.08 -0.35 0.00 0.00 0.11 -1.85 -3.36 132.00 135.63 1ljz h PRO 17 Ca -0.26 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1ljz h PRO 17 Cb 1.09 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ljz h PRO 17 CO 0.99 -0.00 0.00 -2.30 -0.21 0.00 0.00 178.00 176.48 1ljz n PRO 18 N -5.05 -0.38 0.28 1.05 -0.02 -1.26 -4.85 135.00 124.77 1ljz n PRO 18 Ca -0.08 0.00 0.17 0.00 -2.02 0.00 0.00 63.50 61.57 1ljz n PRO 18 Cb 0.26 0.00 0.71 0.00 -0.02 0.00 0.00 33.50 34.45 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 -0.46 0.00 -7.54 -1.23 0.00 -1.99 -3.37 103.07 88.49 1ljz h GLY 19 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.69 1ljz h GLY 19 CO 0.00 0.00 2.21 -2.21 0.00 0.00 0.00 176.54 176.54 1ljz n GLU 20 N -3.06 2.93 0.00 4.80 2.13 -1.26 -4.48 120.64 121.70 1ljz n GLU 20 Ca 0.00 -3.07 0.00 0.00 0.66 0.00 0.00 57.16 54.76 1ljz n GLU 20 Cb 0.29 -3.49 0.00 0.00 0.27 0.00 0.00 31.44 28.52 1ljz n GLU 20 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1ljz n ASN 21 N 8.76 1.53 -4.64 4.31 3.02 -1.23 -4.58 115.26 122.43 1ljz n ASN 21 Ca 0.49 -1.56 -0.43 0.00 -0.03 0.00 0.00 54.58 53.05 1ljz n ASN 21 Cb 0.45 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.60 1ljz n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ljz s LEU 22 N -0.56 4.01 -0.79 3.41 1.02 -0.66 -4.61 118.68 120.50 1ljz s LEU 22 Ca 0.00 1.37 -0.20 0.00 0.02 0.00 0.00 54.13 55.32 1ljz s LEU 22 Cb 0.00 -3.54 0.11 0.00 0.02 0.00 0.00 46.19 42.78 1ljz s LEU 22 CO 0.00 -0.92 1.00 0.00 0.02 0.00 0.00 176.35 176.45 1ljz s TYR 24 N 3.08 3.34 -0.78 0.00 1.13 -0.51 -2.49 117.35 121.12 1ljz s TYR 24 Ca 0.26 1.46 0.00 0.00 -1.41 0.00 0.00 57.07 57.38 1ljz s TYR 24 Cb -0.12 -2.73 0.19 0.00 -1.10 0.00 0.00 41.96 38.20 1ljz s TYR 24 CO -0.01 -0.04 0.62 0.50 -2.51 0.00 0.00 175.55 174.11 1ljz s ARG 25 N -3.13 2.86 -0.33 -3.49 3.52 -0.18 -2.47 118.95 115.72 1ljz s ARG 25 Ca 0.59 -3.15 -0.29 0.00 -0.13 0.00 0.00 55.73 52.76 1ljz s ARG 25 Cb -0.09 -3.73 -0.01 0.00 -1.56 0.00 0.00 34.95 29.55 1ljz s ARG 25 CO 0.15 -1.25 1.72 0.21 -0.81 0.00 0.00 175.30 175.32 1ljz s LYS 26 N -1.12 3.42 -0.16 5.12 2.47 -0.95 -2.31 119.74 126.20 1ljz s LYS 26 Ca 0.24 1.38 0.00 0.00 -1.56 0.00 0.00 55.97 56.03 1ljz s LYS 26 Cb -0.10 -4.15 0.03 0.00 -1.46 0.00 0.00 37.83 32.15 1ljz s LYS 26 CO -0.11 -1.75 -0.09 1.41 0.16 0.00 0.00 175.35 174.96 1ljz s MET 27 N 5.44 1.79 0.00 4.03 1.75 -0.68 -0.55 119.30 131.08 1ljz s MET 27 Ca 0.76 -0.57 0.00 0.00 -1.25 0.00 0.00 55.69 54.63 1ljz s MET 27 Cb -0.21 -2.07 0.00 0.00 2.84 0.00 0.00 34.83 35.39 1ljz s MET 27 CO 0.33 -0.36 0.00 -2.67 -0.65 0.00 0.00 175.02 171.67 1ljz n TRP 28 N 4.81 0.00 -3.71 4.11 2.14 -1.07 0.05 117.44 123.77 1ljz n TRP 28 Ca -0.14 0.00 -0.37 0.00 2.07 0.00 0.00 57.50 59.06 1ljz n TRP 28 Cb 0.48 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 30.86 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 1.65 2.05 0.00 0.00 2.15 -0.75 -4.77 116.67 117.00 1ljz s ASP 30 Ca 0.06 -2.58 0.00 0.00 0.43 0.00 0.00 52.55 50.47 1ljz s ASP 30 Cb -0.15 -0.33 0.00 0.00 -0.30 0.00 0.00 42.92 42.14 1ljz s ASP 30 CO 0.06 -0.24 0.00 0.00 -0.17 0.00 0.00 175.17 174.82 1ljz n ALA 31 N 3.46 0.00 -0.10 3.66 0.00 -0.95 -2.72 120.51 123.85 1ljz n ALA 31 Ca 0.21 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.56 1ljz n ALA 31 Cb 0.43 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.95 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 0.93 -0.08 0.00 3.57 0.20 15.21 116.94 136.77 1ljz h PHE 32 Ca 0.00 -0.22 -0.15 0.00 3.53 0.00 0.00 57.97 61.13 1ljz h PHE 32 Cb 0.00 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 1ljz h PHE 32 CO 0.00 0.97 -0.60 0.00 -2.23 0.00 0.00 178.31 176.45 1ljz n SER 34 N -3.88 0.00 0.01 0.00 2.88 -0.41 -5.06 113.62 107.17 1ljz n SER 34 Ca -0.03 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1ljz n SER 34 Cb 0.62 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1ljz n SER 34 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1ljz n SER 35 N -1.48 -0.04 0.00 -3.46 3.41 4.66 -4.98 113.62 111.72 1ljz n SER 35 Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1ljz n SER 35 Cb 0.00 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 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 -2.58 0.00 -0.51 4.33 0.63 0.22 -4.62 116.66 114.13 1ljz n ARG 36 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1ljz n ARG 36 Cb 0.00 -0.03 0.00 0.00 0.45 0.00 0.00 32.46 32.88 1ljz n ARG 36 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ljz n GLY 37 N 2.85 3.49 3.98 5.14 0.00 -1.10 -4.02 105.19 115.52 1ljz n GLY 37 Ca 0.00 -1.11 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 1ljz n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ljz s LYS 38 N -0.09 1.70 -0.04 1.61 3.01 -1.26 0.19 119.74 124.87 1ljz s LYS 38 Ca 0.00 -0.94 -0.06 0.00 -1.01 0.00 0.00 55.97 53.96 1ljz s LYS 38 Cb 0.00 -2.28 -0.04 0.00 -1.01 0.00 0.00 37.83 34.49 1ljz s LYS 38 CO 0.00 -1.46 0.21 0.08 0.51 0.00 0.00 175.35 174.69 1ljz s VAL 39 N -3.19 5.40 -0.27 3.17 1.01 0.14 -4.49 120.40 122.17 1ljz s VAL 39 Ca 0.66 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.76 1ljz s VAL 39 Cb -0.06 -3.51 0.08 0.00 0.00 0.00 0.00 36.38 32.89 1ljz s VAL 39 CO 0.45 0.46 0.05 -0.69 0.00 0.00 0.00 175.10 175.36 1ljz s VAL 40 N -1.20 1.05 -0.47 2.92 1.01 -1.26 -2.61 120.40 119.85 1ljz s VAL 40 Ca 0.23 -1.27 0.03 0.00 0.00 0.00 0.00 61.98 60.97 1ljz s VAL 40 Cb -0.13 -1.65 0.13 0.00 0.00 0.00 0.00 36.38 34.73 1ljz s VAL 40 CO 0.12 -0.46 0.23 -0.70 0.00 0.00 0.00 175.10 174.29 1ljz s GLU 41 N 1.56 1.68 0.30 2.72 2.56 0.28 -4.93 118.70 122.88 1ljz s GLU 41 Ca 0.05 -2.31 -0.28 0.00 0.00 0.00 0.00 54.97 52.42 1ljz s GLU 41 Cb -0.18 -2.97 -0.09 0.00 2.00 0.00 0.00 34.13 32.89 1ljz s GLU 41 CO -0.16 -1.10 1.03 -0.51 -0.56 0.00 0.00 175.26 173.95 1ljz s LEU 42 N 0.09 4.46 0.32 2.70 1.43 -1.26 -2.25 118.68 124.16 1ljz s LEU 42 Ca 0.16 2.09 -0.19 0.00 -1.03 0.00 0.00 54.13 55.16 1ljz s LEU 42 Cb -0.25 -3.80 0.05 0.00 0.03 0.00 0.00 46.19 42.22 1ljz s LEU 42 CO -0.02 -0.14 0.80 -0.83 0.23 0.00 0.00 176.35 176.39 1ljz s GLY 43 N -1.20 0.15 -0.22 -3.19 0.00 -1.03 -3.73 107.32 98.10 1ljz s GLY 43 Ca 0.47 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.70 1ljz s GLY 43 CO 0.34 0.03 -0.06 0.00 0.00 0.00 0.00 173.10 173.41 1ljz s ALA 45 N 1.43 2.71 0.00 0.00 0.00 0.67 -4.88 121.76 121.69 1ljz s ALA 45 Ca -0.05 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 50.14 1ljz s ALA 45 Cb -0.18 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.51 1ljz s ALA 45 CO -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 175.76 175.42 1ljz n ALA 46 N -0.81 1.99 -2.85 0.00 0.00 -1.26 -1.65 120.51 115.92 1ljz n ALA 46 Ca -0.05 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.15 1ljz n ALA 46 Cb 0.66 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.09 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 -1.42 2.19 -1.62 0.00 5.66 -1.26 -4.93 114.28 112.89 1ljz n THR 47 Ca 0.00 -5.06 -0.64 0.00 -3.05 0.00 0.00 64.05 55.30 1ljz n THR 47 Cb 0.00 -1.01 -0.09 0.00 -1.55 0.00 0.00 70.33 67.68 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 3.92 0.52 -1.63 0.00 -0.04 -1.26 -4.97 135.00 131.54 1ljz n PRO 49 Ca 0.30 0.00 -0.49 0.00 -0.04 0.00 0.00 63.50 63.27 1ljz n PRO 49 Cb -0.06 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.35 1ljz n PRO 49 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ljz n SER 50 N -1.93 2.42 0.00 3.54 7.64 -1.26 -4.98 113.62 119.06 1ljz n SER 50 Ca 0.00 1.10 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1ljz n SER 50 Cb 0.00 -1.32 0.00 0.00 -1.01 0.00 0.00 64.21 61.88 1ljz n SER 50 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1ljz n LYS 51 N 3.04 0.00 -0.33 1.43 2.85 -1.26 -4.78 118.16 119.12 1ljz n LYS 51 Ca 0.18 0.00 0.28 0.00 -1.05 0.00 0.00 58.31 57.72 1ljz n LYS 51 Cb 0.24 0.00 0.52 0.00 -0.65 0.00 0.00 35.03 35.14 1ljz n LYS 51 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1ljz n LYS 52 N 0.00 -0.06 0.00 -1.58 3.00 -0.61 -2.92 118.16 115.98 1ljz n LYS 52 Ca 0.00 1.41 0.00 0.00 -0.00 0.00 0.00 58.31 59.72 1ljz n LYS 52 Cb 0.00 -2.45 0.00 0.00 0.00 0.00 0.00 35.03 32.58 1ljz n LYS 52 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1ljz n PRO 53 N -5.32 0.00 0.00 1.64 -0.02 -1.26 -2.77 135.00 127.27 1ljz n PRO 53 Ca 0.35 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1ljz n PRO 53 Cb 1.16 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.64 1ljz n PRO 53 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1ljz n TYR 54 N -3.06 -0.03 -4.53 6.00 4.19 -1.16 -5.13 117.16 113.43 1ljz n TYR 54 Ca 0.00 0.00 -0.25 0.00 3.31 0.00 0.00 57.90 60.96 1ljz n TYR 54 Cb 0.00 0.20 -0.11 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 -1.40 1.80 -0.55 2.98 0.41 -1.12 -4.92 118.70 115.91 1ljz s GLU 55 Ca 0.00 -2.00 -0.15 0.00 -0.41 0.00 0.00 54.97 52.41 1ljz s GLU 55 Cb 0.00 -1.29 0.13 0.00 -1.78 0.00 0.00 34.13 31.19 1ljz s GLU 55 CO 0.00 -0.09 0.49 -2.00 -0.49 0.00 0.00 175.26 173.17 1ljz s GLU 56 N -3.78 2.93 -0.26 1.61 2.56 0.11 -1.58 118.70 120.29 1ljz s GLU 56 Ca 0.35 -1.77 -0.07 0.00 0.00 0.00 0.00 54.97 53.48 1ljz s GLU 56 Cb 0.09 -4.24 -0.02 0.00 2.00 0.00 0.00 34.13 31.96 1ljz s GLU 56 CO 0.16 -1.30 0.06 0.54 -0.56 0.00 0.00 175.26 174.17 1ljz s VAL 57 N 1.46 4.13 -0.77 3.70 0.11 -1.24 -1.69 120.40 126.10 1ljz s VAL 57 Ca 0.04 -0.35 -0.17 0.00 -2.93 0.00 0.00 61.98 58.58 1ljz s VAL 57 Cb -0.28 -2.98 0.16 0.00 -1.53 0.00 0.00 36.38 31.75 1ljz s VAL 57 CO 0.02 0.27 0.82 0.42 -3.33 0.00 0.00 175.10 173.29 1ljz s THR 58 N 1.57 5.16 -0.57 5.04 -4.23 -0.98 -4.73 115.64 116.90 1ljz s THR 58 Ca 0.05 -1.79 -0.23 0.00 -1.18 0.00 0.00 61.69 58.54 1ljz s THR 58 Cb -0.16 -4.54 0.05 0.00 1.34 0.00 0.00 72.50 69.20 1ljz s THR 58 CO 0.03 -1.16 0.90 0.00 -0.54 0.00 0.00 174.62 173.85 1ljz n SER 61 N -1.07 3.38 -4.39 0.00 2.88 -1.26 0.11 113.62 113.27 1ljz n SER 61 Ca -0.07 -2.96 -0.27 0.00 -1.33 0.00 0.00 58.87 54.25 1ljz n SER 61 Cb 0.67 -0.40 -0.12 0.00 -0.75 0.00 0.00 64.21 63.60 1ljz n SER 61 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1ljz s THR 62 N -4.23 2.21 -0.50 2.46 -4.23 -1.26 -4.94 115.64 105.15 1ljz s THR 62 Ca 0.40 -1.89 -0.46 0.00 -1.18 0.00 0.00 61.69 58.56 1ljz s THR 62 Cb 0.37 -2.00 -0.20 0.00 1.34 0.00 0.00 72.50 72.01 1ljz s THR 62 CO 0.00 -0.06 1.70 0.47 -0.54 0.00 0.00 174.62 176.19 1ljz n ASP 63 N 0.56 1.11 -4.00 3.99 8.00 -1.25 -0.96 116.55 124.00 1ljz n ASP 63 Ca -0.15 1.08 -0.31 0.00 0.71 0.00 0.00 54.79 56.12 1ljz n ASP 63 Cb 0.55 -0.88 -0.04 0.00 -0.02 0.00 0.00 41.12 40.73 1ljz n ASP 63 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1ljz n LYS 64 N 4.69 -0.70 -0.43 -1.24 -0.00 0.30 -4.81 118.16 115.96 1ljz n LYS 64 Ca 0.36 0.02 0.05 0.00 -0.00 0.00 0.00 58.31 58.73 1ljz n LYS 64 Cb -0.06 -2.44 0.22 0.00 -0.00 0.00 0.00 35.03 32.75 1ljz n LYS 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ljz n ASN 66 N 0.45 2.95 -4.01 0.00 0.23 -1.26 -4.84 115.26 108.78 1ljz n ASN 66 Ca 0.15 -1.89 -0.36 0.00 -0.53 0.00 0.00 54.58 51.95 1ljz n ASN 66 Cb 0.68 -0.22 0.04 0.00 -2.08 0.00 0.00 39.78 38.20 1ljz n ASN 66 CO 0.00 0.00 0.00 -2.65 -0.93 0.00 0.00 177.26 173.68 1ljz n PRO 67 N 0.86 0.00 -4.78 -0.53 -0.02 -1.26 -4.75 135.00 124.52 1ljz n PRO 67 Ca 0.14 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.29 1ljz n PRO 67 Cb 0.45 -1.00 -0.15 0.00 -0.02 0.00 0.00 33.50 32.78 1ljz n PRO 67 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1ljz s HIS 68 N -1.99 2.73 0.03 6.00 -3.43 -1.26 -4.99 115.29 112.38 1ljz s HIS 68 Ca 0.42 -0.94 -0.06 0.00 -0.80 0.00 0.00 55.06 53.68 1ljz s HIS 68 Cb -0.22 -1.83 -0.01 0.00 -1.43 0.00 0.00 32.58 29.09 1ljz s HIS 68 CO 0.81 -0.39 0.70 -2.30 -2.00 0.00 0.00 174.74 171.56 1ljz n PRO 69 N 3.76 -0.09 0.19 -0.38 -0.01 -1.26 0.36 135.00 137.58 1ljz n PRO 69 Ca -0.19 0.69 0.14 0.00 -0.01 0.00 0.00 63.50 64.14 1ljz n PRO 69 Cb 0.52 -1.03 0.59 0.00 -0.01 0.00 0.00 33.50 33.57 1ljz n PRO 69 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 175.50 176.36 1ljz h LYS 70 N 0.00 0.00 0.00 -0.52 1.79 -1.97 -3.29 116.57 112.58 1ljz h LYS 70 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1ljz h LYS 70 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1ljz h LYS 70 CO -0.19 0.00 0.00 1.04 -1.08 0.00 0.00 179.45 179.22 1ljz n GLN 71 N -2.54 0.21 0.00 3.15 6.02 -0.92 -4.90 117.38 118.41 1ljz n GLN 71 Ca 0.01 -0.47 0.00 0.00 -0.01 0.00 0.00 57.00 56.54 1ljz n GLN 71 Cb 0.23 -0.70 0.00 0.00 1.02 0.00 0.00 30.24 30.80 1ljz n GLN 71 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ljz n ARG 72 N -0.08 0.00 -1.16 -1.09 5.12 0.16 -4.81 116.66 114.81 1ljz n ARG 72 Ca 0.00 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.60 1ljz n ARG 72 Cb 0.25 -0.14 -0.05 0.00 -1.16 0.00 0.00 32.46 31.36 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 -2.46 3.14 0.00 5.56 -0.04 -1.24 -5.00 135.00 134.97 1ljz n PRO 73 Ca 0.00 -1.86 0.13 0.00 -0.04 0.00 0.00 63.50 61.73 1ljz n PRO 73 Cb 0.00 -2.60 0.78 0.00 -0.04 0.00 0.00 33.50 31.64 1ljz n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87