#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 4.08 0.05 1.39 1.01 -1.26 -1.71 120.40 123.96 1ljz s VAL 2 Ca 0.00 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 60.93 1ljz s VAL 2 Cb 0.00 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1ljz s VAL 2 CO 0.00 -0.18 0.24 0.00 0.00 0.00 0.00 175.10 175.16 1ljz n HIS 4 N 0.47 3.59 -2.38 0.00 8.25 -1.26 -1.36 115.22 122.52 1ljz n HIS 4 Ca -0.18 -4.09 -0.25 0.00 -0.26 0.00 0.00 57.72 52.94 1ljz n HIS 4 Cb 0.60 -0.81 0.11 0.00 1.12 0.00 0.00 29.99 31.02 1ljz n HIS 4 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1ljz s THR 5 N -1.84 2.17 -0.25 1.59 -1.32 0.49 -4.43 115.64 112.04 1ljz s THR 5 Ca 0.30 -0.41 -0.01 0.00 -1.21 0.00 0.00 61.69 60.36 1ljz s THR 5 Cb 0.01 -2.75 0.08 0.00 -1.51 0.00 0.00 72.50 68.33 1ljz s THR 5 CO -0.09 0.00 0.04 0.42 -2.21 0.00 0.00 174.62 172.78 1ljz s THR 6 N -3.30 0.93 0.03 5.08 -4.23 -0.44 0.92 115.64 114.63 1ljz s THR 6 Ca 0.66 -1.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.09 1ljz s THR 6 Cb -0.06 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.28 1ljz s THR 6 CO 0.46 -0.38 0.00 0.00 -0.54 0.00 0.00 174.62 174.16 1ljz n ALA 7 N 4.86 0.92 -1.00 3.99 0.00 -1.26 -4.72 120.51 123.30 1ljz n ALA 7 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1ljz n ALA 7 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 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 -2.56 0.00 0.18 0.00 5.66 -1.26 -4.94 114.28 111.36 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 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 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 -0.42 -3.81 1.09 0.02 -2.02 -3.46 113.55 104.94 1ljz h SER 9 Ca 0.00 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1ljz h SER 9 Cb 0.00 0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1ljz h SER 9 CO 0.00 -0.01 -0.00 -0.81 -1.14 0.00 0.00 176.83 174.87 1ljz n PRO 10 N -5.14 1.22 -1.84 3.45 -0.04 -1.26 -5.04 135.00 126.35 1ljz n PRO 10 Ca -0.09 -0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 62.89 1ljz n PRO 10 Cb 0.28 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.72 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 0.47 2.23 -0.26 0.52 1.01 -1.26 -4.34 121.20 119.57 1ljz s ILE 11 Ca 0.01 0.19 -0.13 0.00 0.00 0.00 0.00 60.65 60.72 1ljz s ILE 11 Cb -0.00 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 1ljz s ILE 11 CO 0.01 0.03 0.27 -0.94 0.00 0.00 0.00 174.94 174.30 1ljz s SER 12 N 0.56 6.17 -0.28 3.58 1.04 0.26 -4.94 113.70 120.09 1ljz s SER 12 Ca 0.64 0.18 -0.04 0.00 0.48 0.00 0.00 55.95 57.20 1ljz s SER 12 Cb -0.46 -2.16 0.02 0.00 0.10 0.00 0.00 66.02 63.52 1ljz s SER 12 CO 0.45 -0.07 0.02 0.00 0.98 0.00 0.00 173.24 174.62 1ljz s ALA 13 N 1.62 2.91 0.06 5.32 0.00 -1.26 0.18 121.76 130.60 1ljz s ALA 13 Ca 0.11 -1.51 0.01 0.00 0.00 0.00 0.00 51.96 50.57 1ljz s ALA 13 Cb -0.15 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.96 1ljz s ALA 13 CO 0.09 -0.95 -0.05 0.14 0.00 0.00 0.00 175.76 174.99 1ljz s VAL 14 N 1.41 0.43 -0.13 0.00 -7.23 -0.47 -4.87 120.40 109.53 1ljz s VAL 14 Ca 0.01 -1.67 -0.19 0.00 -1.81 0.00 0.00 61.98 58.32 1ljz s VAL 14 Cb -0.17 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 1ljz s VAL 14 CO -0.00 -0.82 0.51 -0.89 -0.31 0.00 0.00 175.10 173.58 1ljz s THR 15 N -3.23 5.15 0.43 5.32 2.01 -1.26 0.14 115.64 124.20 1ljz s THR 15 Ca 0.04 1.00 -0.22 0.00 0.31 0.00 0.00 61.69 62.83 1ljz s THR 15 Cb 0.03 -3.85 -0.10 0.00 0.01 0.00 0.00 72.50 68.59 1ljz s THR 15 CO -0.06 0.28 0.99 0.00 -0.69 0.00 0.00 174.62 175.15 1ljz n PRO 17 N -0.48 -2.66 0.22 0.00 -0.02 -1.22 -4.20 135.00 126.64 1ljz n PRO 17 Ca 0.07 -0.76 0.17 0.00 -2.02 0.00 0.00 63.50 60.95 1ljz n PRO 17 Cb 0.52 -1.99 0.84 0.00 -0.02 0.00 0.00 33.50 32.85 1ljz n PRO 17 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1ljz h PRO 18 N -2.70 0.00 0.00 0.52 0.13 -1.99 -3.22 132.00 124.73 1ljz h PRO 18 Ca -0.58 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 1ljz h PRO 18 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1ljz h PRO 18 CO 0.43 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.61 1ljz n GLY 19 N -1.40 -1.07 3.82 1.56 0.00 -1.26 -4.82 105.19 102.03 1ljz n GLY 19 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1ljz n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ljz s GLU 20 N -1.27 3.90 0.00 1.61 1.03 -1.22 -4.95 118.70 117.81 1ljz s GLU 20 Ca 0.00 0.29 0.00 0.00 0.03 0.00 0.00 54.97 55.29 1ljz s GLU 20 Cb 0.00 -3.25 0.00 0.00 -0.80 0.00 0.00 34.13 30.08 1ljz s GLU 20 CO 0.00 0.62 0.21 0.09 -1.33 0.00 0.00 175.26 174.85 1ljz n ASN 21 N 2.16 0.00 -4.77 0.83 3.02 -1.19 -3.38 115.26 111.93 1ljz n ASN 21 Ca -0.14 -1.00 -0.39 0.00 -0.03 0.00 0.00 54.58 53.02 1ljz n ASN 21 Cb 0.53 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.64 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 0.00 4.55 -0.30 3.41 1.02 -0.34 -4.66 118.68 122.37 1ljz s LEU 22 Ca 0.00 1.73 -0.04 0.00 0.02 0.00 0.00 54.13 55.84 1ljz s LEU 22 Cb 0.00 -3.51 0.04 0.00 0.02 0.00 0.00 46.19 42.74 1ljz s LEU 22 CO 0.00 0.14 0.02 0.00 0.02 0.00 0.00 176.35 176.53 1ljz s TYR 24 N 1.34 3.48 -0.61 0.00 1.13 -0.69 -0.12 117.35 121.88 1ljz s TYR 24 Ca -0.02 0.52 0.04 0.00 -1.41 0.00 0.00 57.07 56.20 1ljz s TYR 24 Cb -0.19 -2.00 0.16 0.00 -1.10 0.00 0.00 41.96 38.84 1ljz s TYR 24 CO -0.00 0.30 0.41 1.03 -2.51 0.00 0.00 175.55 174.77 1ljz s ARG 25 N -3.29 2.04 0.34 -3.49 0.52 -0.10 -2.59 118.95 112.38 1ljz s ARG 25 Ca 0.41 -2.91 -0.26 0.00 -0.52 0.00 0.00 55.73 52.45 1ljz s ARG 25 Cb -0.11 -3.01 -0.09 0.00 0.52 0.00 0.00 34.95 32.25 1ljz s ARG 25 CO 0.28 -1.26 1.05 0.21 0.02 0.00 0.00 175.30 175.61 1ljz s LYS 26 N -0.86 4.41 -0.25 3.54 2.20 -1.04 -1.68 119.74 126.05 1ljz s LYS 26 Ca 0.24 1.60 -0.12 0.00 -0.36 0.00 0.00 55.97 57.33 1ljz s LYS 26 Cb -0.09 -2.84 0.09 0.00 -1.51 0.00 0.00 37.83 33.48 1ljz s LYS 26 CO -0.12 0.06 0.60 -1.64 -0.36 0.00 0.00 175.35 173.88 1ljz s MET 27 N -2.01 0.58 0.00 4.03 -1.94 -0.48 -2.54 119.30 116.94 1ljz s MET 27 Ca 0.51 1.18 0.00 0.00 -1.71 0.00 0.00 55.69 55.67 1ljz s MET 27 Cb -0.26 0.30 0.00 0.00 2.01 0.00 0.00 34.83 36.89 1ljz s MET 27 CO 0.32 -0.17 0.00 -2.67 -0.01 0.00 0.00 175.02 172.49 1ljz n TRP 28 N 4.69 0.00 -3.67 -0.03 2.14 -1.05 -1.86 117.44 117.65 1ljz n TRP 28 Ca -0.18 0.00 -0.38 0.00 2.07 0.00 0.00 57.50 59.01 1ljz n TRP 28 Cb 0.55 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 30.93 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 1.59 3.24 0.00 0.00 2.15 -0.93 -4.84 116.67 117.88 1ljz s ASP 30 Ca 0.04 -1.45 0.00 0.00 0.43 0.00 0.00 52.55 51.57 1ljz s ASP 30 Cb -0.17 -0.28 0.00 0.00 -0.30 0.00 0.00 42.92 42.17 1ljz s ASP 30 CO 0.05 -0.41 0.00 0.00 -0.17 0.00 0.00 175.17 174.65 1ljz n ALA 31 N 4.98 0.00 0.14 3.66 0.00 -1.15 -2.72 120.51 125.43 1ljz n ALA 31 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.43 1ljz n ALA 31 Cb 0.41 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.18 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 0.13 0.10 0.00 3.57 0.61 13.63 116.94 134.98 1ljz h PHE 32 Ca 0.00 -0.03 -0.26 0.00 3.53 0.00 0.00 57.97 61.21 1ljz h PHE 32 Cb 0.00 -0.03 0.01 0.00 2.79 0.00 0.00 35.95 38.71 1ljz h PHE 32 CO 0.00 0.45 -1.17 0.00 -2.23 0.00 0.00 178.31 175.36 1ljz n SER 34 N -3.59 0.00 0.01 0.00 7.64 -0.05 -5.06 113.62 112.57 1ljz n SER 34 Ca -0.08 0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1ljz n SER 34 Cb 0.98 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 64.02 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 -1.45 -0.04 0.00 6.43 3.41 4.22 -4.96 113.62 121.22 1ljz n SER 35 Ca 0.00 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 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 0.54 -0.16 0.00 0.00 175.04 175.42 1ljz n ARG 36 N -2.58 0.00 0.00 4.33 1.74 0.73 -4.59 116.66 116.29 1ljz n ARG 36 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1ljz n ARG 36 Cb 0.00 -0.12 0.00 0.00 -1.02 0.00 0.00 32.46 31.32 1ljz n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ljz n GLY 37 N 2.29 3.22 3.88 -0.13 0.00 -1.10 -4.04 105.19 109.32 1ljz n GLY 37 Ca 0.00 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 1ljz n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ljz s LYS 38 N 1.69 3.68 0.19 1.61 2.20 -1.26 0.11 119.74 127.96 1ljz s LYS 38 Ca 0.00 0.03 -0.17 0.00 -0.36 0.00 0.00 55.97 55.47 1ljz s LYS 38 Cb 0.00 -2.88 -0.08 0.00 -1.51 0.00 0.00 37.83 33.36 1ljz s LYS 38 CO 0.00 0.49 0.65 0.08 -0.36 0.00 0.00 175.35 176.21 1ljz s VAL 39 N -1.58 4.69 -0.05 4.02 1.01 -0.39 -4.79 120.40 123.31 1ljz s VAL 39 Ca 0.39 1.10 -0.01 0.00 0.00 0.00 0.00 61.98 63.45 1ljz s VAL 39 Cb -0.13 -3.81 0.03 0.00 0.00 0.00 0.00 36.38 32.47 1ljz s VAL 39 CO 0.22 0.24 0.03 -0.69 0.00 0.00 0.00 175.10 174.89 1ljz s VAL 40 N -1.48 0.12 -0.21 2.92 1.01 -1.26 -2.54 120.40 118.95 1ljz s VAL 40 Ca 0.40 0.27 -0.02 0.00 0.00 0.00 0.00 61.98 62.63 1ljz s VAL 40 Cb -0.16 -0.32 0.06 0.00 0.00 0.00 0.00 36.38 35.96 1ljz s VAL 40 CO 0.20 0.21 0.03 -1.83 0.00 0.00 0.00 175.10 173.71 1ljz s GLU 41 N 1.97 0.78 -0.12 2.72 -1.05 -1.05 -5.01 118.70 116.93 1ljz s GLU 41 Ca 0.04 -0.57 -0.14 0.00 -0.15 0.00 0.00 54.97 54.14 1ljz s GLU 41 Cb -0.12 -2.15 -0.05 0.00 -0.44 0.00 0.00 34.13 31.37 1ljz s GLU 41 CO -0.04 -0.68 0.34 -0.51 0.95 0.00 0.00 175.26 175.32 1ljz s LEU 42 N 1.78 4.30 0.00 1.83 1.43 -1.26 -2.50 118.68 124.25 1ljz s LEU 42 Ca -0.00 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1ljz s LEU 42 Cb -0.17 -2.45 0.00 0.00 0.03 0.00 0.00 46.19 43.60 1ljz s LEU 42 CO -0.10 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.23 1ljz n GLY 43 N 3.01 3.26 2.80 -3.19 0.00 -1.07 -1.33 105.19 108.68 1ljz n GLY 43 Ca -0.12 -1.17 -0.22 0.00 0.00 0.00 0.00 46.02 44.51 1ljz n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ljz s ALA 45 N 1.68 4.36 -0.06 0.00 0.00 0.22 -4.91 121.76 123.04 1ljz s ALA 45 Ca 0.01 -0.66 0.06 0.00 0.00 0.00 0.00 51.96 51.37 1ljz s ALA 45 Cb -0.13 -0.36 -0.09 0.00 0.00 0.00 0.00 23.12 22.54 1ljz s ALA 45 CO -0.04 -0.24 0.03 0.00 0.00 0.00 0.00 175.76 175.51 1ljz n ALA 46 N -1.55 1.85 -3.13 0.00 0.00 -1.26 -1.19 120.51 115.23 1ljz n ALA 46 Ca -0.11 -0.44 -0.15 0.00 0.00 0.00 0.00 53.44 52.74 1ljz n ALA 46 Cb 0.66 0.09 -0.05 0.00 0.00 0.00 0.00 19.45 20.14 1ljz n ALA 46 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ljz s THR 47 N -2.18 -0.38 -1.00 0.00 -4.23 -1.26 -4.83 115.64 101.76 1ljz s THR 47 Ca -0.03 -1.57 -0.25 0.00 -1.18 0.00 0.00 61.69 58.66 1ljz s THR 47 Cb 0.02 -0.59 -0.25 0.00 1.34 0.00 0.00 72.50 73.02 1ljz s THR 47 CO 0.28 -0.57 2.54 0.00 -0.54 0.00 0.00 174.62 176.33 1ljz n PRO 49 N 7.66 0.40 -2.03 0.00 -0.02 -1.26 -4.87 135.00 134.89 1ljz n PRO 49 Ca 0.66 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.73 1ljz n PRO 49 Cb 0.06 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.51 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 -1.53 5.67 0.00 2.55 0.01 -1.26 -4.83 113.70 114.31 1ljz s SER 50 Ca 0.00 0.91 0.21 0.00 1.31 0.00 0.00 55.95 58.38 1ljz s SER 50 Cb 0.00 -2.53 0.75 0.00 0.21 0.00 0.00 66.02 64.45 1ljz s SER 50 CO 0.00 -1.96 1.55 2.29 0.41 0.00 0.00 173.24 175.53 1ljz n LYS 51 N 8.69 1.76 -0.72 12.44 0.00 -1.26 -4.25 118.16 134.81 1ljz n LYS 51 Ca 0.22 -1.14 -0.06 0.00 -0.00 0.00 0.00 58.31 57.33 1ljz n LYS 51 Cb 0.49 -1.41 0.19 0.00 -0.00 0.00 0.00 35.03 34.31 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 0.37 2.71 0.00 -1.58 0.00 -1.26 -3.83 118.16 114.57 1ljz n LYS 52 Ca 0.16 -2.07 0.11 0.00 0.00 0.00 0.00 58.31 56.52 1ljz n LYS 52 Cb 0.34 -1.90 0.49 0.00 0.00 0.00 0.00 35.03 33.96 1ljz n LYS 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1ljz n PRO 53 N -0.11 0.02 0.00 1.64 -0.04 -1.26 -4.68 135.00 130.57 1ljz n PRO 53 Ca 0.30 0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1ljz n PRO 53 Cb 1.10 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 33.06 1ljz n PRO 53 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1ljz n TYR 54 N -1.49 0.00 -4.67 0.54 4.19 -1.26 -5.16 117.16 109.31 1ljz n TYR 54 Ca 0.06 0.00 -0.30 0.00 3.31 0.00 0.00 57.90 60.97 1ljz n TYR 54 Cb 0.26 0.00 -0.09 0.00 0.49 0.00 0.00 39.34 40.00 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 0.00 2.04 -0.08 2.98 8.01 -1.25 -4.91 118.70 125.48 1ljz s GLU 55 Ca 0.00 -2.22 0.04 0.00 0.01 0.00 0.00 54.97 52.80 1ljz s GLU 55 Cb 0.00 -1.52 0.00 0.00 -4.31 0.00 0.00 34.13 28.31 1ljz s GLU 55 CO 0.00 -0.20 -0.21 -2.00 0.01 0.00 0.00 175.26 172.86 1ljz s GLU 56 N -3.79 2.65 0.15 1.61 2.12 -0.78 -4.14 118.70 116.52 1ljz s GLU 56 Ca 0.23 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 54.82 1ljz s GLU 56 Cb 0.06 -2.06 -0.04 0.00 0.26 0.00 0.00 34.13 32.35 1ljz s GLU 56 CO 0.12 0.18 -0.09 0.14 -0.54 0.00 0.00 175.26 175.06 1ljz s VAL 57 N 0.33 1.10 -0.33 3.70 -7.23 -1.26 -1.38 120.40 115.34 1ljz s VAL 57 Ca -0.16 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 57.99 1ljz s VAL 57 Cb -0.17 -1.88 0.10 0.00 0.56 0.00 0.00 36.38 34.99 1ljz s VAL 57 CO 0.07 -0.72 0.07 -0.89 -0.31 0.00 0.00 175.10 173.32 1ljz s THR 58 N -3.37 1.65 -0.23 5.32 2.01 -0.68 -4.88 115.64 115.47 1ljz s THR 58 Ca 0.17 -1.92 -0.19 0.00 0.31 0.00 0.00 61.69 60.06 1ljz s THR 58 Cb 0.03 -2.23 -0.03 0.00 0.01 0.00 0.00 72.50 70.28 1ljz s THR 58 CO 0.01 -0.63 0.56 0.00 -0.69 0.00 0.00 174.62 173.86 1ljz n SER 61 N -1.39 0.16 -4.73 0.00 3.41 -1.26 0.14 113.62 109.95 1ljz n SER 61 Ca -0.10 -1.84 -0.27 0.00 -0.26 0.00 0.00 58.87 56.41 1ljz n SER 61 Cb 0.41 -0.16 -0.07 0.00 -0.26 0.00 0.00 64.21 64.14 1ljz n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ljz s THR 62 N 0.00 4.12 -0.39 6.66 -4.23 -1.26 -4.89 115.64 115.64 1ljz s THR 62 Ca 0.08 -1.23 -0.45 0.00 -1.18 0.00 0.00 61.69 58.91 1ljz s THR 62 Cb 0.09 -3.08 -0.19 0.00 1.34 0.00 0.00 72.50 70.65 1ljz s THR 62 CO -0.04 -0.10 1.54 0.47 -0.54 0.00 0.00 174.62 175.96 1ljz n ASP 63 N -0.19 1.22 -4.05 3.99 8.00 -1.26 -1.22 116.55 123.04 1ljz n ASP 63 Ca -0.09 1.17 -0.34 0.00 0.71 0.00 0.00 54.79 56.24 1ljz n ASP 63 Cb 0.55 -0.93 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 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 3.82 -0.64 -0.08 -1.24 -0.00 0.41 -4.82 118.16 115.62 1ljz n LYS 64 Ca 0.29 0.02 0.11 0.00 -0.00 0.00 0.00 58.31 58.73 1ljz n LYS 64 Cb -0.01 -2.52 0.37 0.00 -0.00 0.00 0.00 35.03 32.87 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 0.41 4.31 -1.31 0.00 6.94 -1.26 -4.91 115.26 119.43 1ljz n ASN 66 Ca 0.17 -3.34 0.00 0.00 -0.02 0.00 0.00 54.58 51.39 1ljz n ASN 66 Cb 0.36 -0.89 0.00 0.00 -2.36 0.00 0.00 39.78 36.88 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 1.43 1.97 -2.81 -0.53 -0.04 -1.26 -4.28 135.00 129.47 1ljz n PRO 67 Ca 0.26 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.39 1ljz n PRO 67 Cb 0.38 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.77 1ljz n PRO 67 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1ljz s HIS 68 N 1.06 3.32 -0.07 0.54 2.46 -1.26 -4.97 115.29 116.36 1ljz s HIS 68 Ca 0.00 1.62 -0.01 0.00 0.47 0.00 0.00 55.06 57.14 1ljz s HIS 68 Cb 0.00 -2.86 -0.00 0.00 -0.13 0.00 0.00 32.58 29.58 1ljz s HIS 68 CO 0.00 -0.12 -0.02 -1.00 -2.47 0.00 0.00 174.74 171.13 1ljz h PRO 69 N 1.98 0.00 -0.31 2.88 0.13 -1.99 -3.40 132.00 131.28 1ljz h PRO 69 Ca -0.49 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.49 1ljz h PRO 69 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1ljz h PRO 69 CO 0.61 0.00 -0.42 -0.22 -0.23 0.00 0.00 178.00 177.74 1ljz h LYS 70 N -0.69 0.79 0.00 0.86 3.11 -2.03 -3.45 116.57 115.15 1ljz h LYS 70 Ca 0.00 -0.42 -0.41 0.00 -2.81 0.00 0.00 60.65 57.00 1ljz h LYS 70 Cb 0.06 0.02 0.06 0.00 -1.00 0.00 0.00 32.23 31.37 1ljz h LYS 70 CO 0.00 1.05 0.06 1.04 -2.81 0.00 0.00 179.45 178.80 1ljz n GLN 71 N -4.03 0.13 0.00 1.90 6.02 -1.26 -4.75 117.38 115.39 1ljz n GLN 71 Ca -0.02 -2.48 0.00 0.00 -0.01 0.00 0.00 57.00 54.49 1ljz n GLN 71 Cb 0.55 -0.50 0.00 0.00 1.02 0.00 0.00 30.24 31.31 1ljz n GLN 71 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1ljz n ARG 72 N -2.51 0.00 -2.64 -1.09 1.85 -1.26 -4.49 116.66 106.52 1ljz n ARG 72 Ca 0.15 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.56 1ljz n ARG 72 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 1ljz n ARG 72 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1ljz n PRO 73 N 0.00 3.26 0.00 2.89 -0.04 -1.26 -5.10 135.00 134.75 1ljz n PRO 73 Ca 0.00 -3.45 0.14 0.00 -0.04 0.00 0.00 63.50 60.15 1ljz n PRO 73 Cb 0.00 -3.28 0.62 0.00 -0.04 0.00 0.00 33.50 30.80 1ljz n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87