#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 4.53 -0.15 1.39 1.01 -1.26 -2.50 120.40 123.42 1ljz s VAL 2 Ca 0.00 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 60.92 1ljz s VAL 2 Cb 0.00 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.83 1ljz s VAL 2 CO 0.00 -0.25 0.38 0.00 0.00 0.00 0.00 175.10 175.24 1ljz s HIS 4 N 0.52 2.80 0.06 0.00 3.76 -1.26 0.11 115.29 121.29 1ljz s HIS 4 Ca -0.03 0.57 -0.28 0.00 -0.15 0.00 0.00 55.06 55.17 1ljz s HIS 4 Cb -0.04 -3.41 0.09 0.00 1.11 0.00 0.00 32.58 30.33 1ljz s HIS 4 CO -0.03 -1.69 1.11 -0.08 -0.85 0.00 0.00 174.74 173.20 1ljz s THR 5 N -3.45 0.00 -0.31 1.30 -1.32 0.24 -3.87 115.64 108.23 1ljz s THR 5 Ca 0.62 -0.42 -0.01 0.00 -1.21 0.00 0.00 61.69 60.68 1ljz s THR 5 Cb -0.10 -1.91 0.10 0.00 -1.51 0.00 0.00 72.50 69.08 1ljz s THR 5 CO 0.47 0.00 0.11 0.42 -2.21 0.00 0.00 174.62 173.41 1ljz s THR 6 N -2.87 0.79 0.00 5.08 -4.23 -1.22 0.78 115.64 113.97 1ljz s THR 6 Ca 0.13 -1.38 0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1ljz s THR 6 Cb 0.01 -1.60 0.00 0.00 1.34 0.00 0.00 72.50 72.25 1ljz s THR 6 CO -0.01 -0.70 0.00 0.00 -0.54 0.00 0.00 174.62 173.37 1ljz n ALA 7 N 4.83 0.00 -1.00 3.99 0.00 -1.26 -4.71 120.51 122.36 1ljz n ALA 7 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 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 0.25 0.00 0.00 0.00 177.50 177.75 1ljz n THR 8 N -1.19 0.00 0.24 0.00 -2.24 -1.26 -4.96 114.28 104.87 1ljz n THR 8 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1ljz n THR 8 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 1ljz n THR 8 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1ljz h SER 9 N 0.00 -0.56 -2.90 3.42 0.02 -2.02 -3.46 113.55 108.05 1ljz h SER 9 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 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 -0.20 0.00 -0.81 -1.14 0.00 0.00 176.83 174.68 1ljz n PRO 10 N -4.90 2.10 -1.79 3.45 -0.04 -1.26 -5.04 135.00 127.52 1ljz n PRO 10 Ca -0.08 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.98 1ljz n PRO 10 Cb 0.26 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.73 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 1.37 2.04 0.38 0.52 1.09 -1.26 -4.36 121.20 120.99 1ljz s ILE 11 Ca 0.00 0.04 0.06 0.00 -1.10 0.00 0.00 60.65 59.65 1ljz s ILE 11 Cb 0.00 -3.02 -0.00 0.00 -1.06 0.00 0.00 42.46 38.37 1ljz s ILE 11 CO 0.00 0.01 0.53 -0.94 -0.10 0.00 0.00 174.94 174.44 1ljz s SER 12 N -0.39 5.85 -0.25 3.58 1.04 0.23 -4.90 113.70 118.86 1ljz s SER 12 Ca 0.59 -0.18 -0.03 0.00 0.48 0.00 0.00 55.95 56.81 1ljz s SER 12 Cb -0.45 -1.12 0.11 0.00 0.10 0.00 0.00 66.02 64.66 1ljz s SER 12 CO 0.59 -0.58 0.21 0.00 0.98 0.00 0.00 173.24 174.44 1ljz s ALA 13 N -2.29 -0.07 0.10 5.32 0.00 -1.26 -0.59 121.76 122.97 1ljz s ALA 13 Ca 0.48 -0.28 0.09 0.00 0.00 0.00 0.00 51.96 52.25 1ljz s ALA 13 Cb -0.10 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 1ljz s ALA 13 CO 0.33 -1.47 -0.23 0.14 0.00 0.00 0.00 175.76 174.53 1ljz s VAL 14 N 2.27 1.87 0.37 0.00 -7.23 0.12 -4.92 120.40 112.88 1ljz s VAL 14 Ca 0.08 -1.53 -0.16 0.00 -1.81 0.00 0.00 61.98 58.56 1ljz s VAL 14 Cb -0.15 -1.67 -0.09 0.00 0.56 0.00 0.00 36.38 35.03 1ljz s VAL 14 CO -0.24 0.05 0.81 0.28 -0.31 0.00 0.00 175.10 175.68 1ljz s THR 15 N -1.06 4.62 0.20 5.32 -1.32 -1.26 -0.52 115.64 121.62 1ljz s THR 15 Ca 0.09 1.04 -0.12 0.00 -1.21 0.00 0.00 61.69 61.49 1ljz s THR 15 Cb -0.10 -3.63 -0.07 0.00 -1.51 0.00 0.00 72.50 67.19 1ljz s THR 15 CO 0.04 -0.31 0.56 0.00 -2.21 0.00 0.00 174.62 172.70 1ljz s PRO 17 N -2.42 0.56 -0.53 0.00 0.04 -1.26 -4.60 135.00 126.79 1ljz s PRO 17 Ca 0.43 -0.53 -0.10 0.00 0.04 0.00 0.00 61.00 60.84 1ljz s PRO 17 Cb -0.13 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 1ljz s PRO 17 CO 0.20 -2.44 1.70 -2.30 0.04 0.00 0.00 177.00 174.20 1ljz n PRO 18 N -3.75 1.15 0.00 0.56 -0.02 -1.26 -3.95 135.00 127.72 1ljz n PRO 18 Ca 0.16 -1.22 0.00 0.00 -2.02 0.00 0.00 63.50 60.42 1ljz n PRO 18 Cb 0.59 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1ljz n PRO 18 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ljz n GLY 19 N 4.13 -1.85 3.55 -1.23 0.00 -1.26 -5.05 105.19 103.48 1ljz n GLY 19 Ca 0.33 0.68 -0.32 0.00 0.00 0.00 0.00 46.02 46.71 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 0.00 2.55 -0.39 1.61 1.03 -1.25 -4.81 118.70 117.44 1ljz s GLU 20 Ca 0.00 0.20 -0.01 0.00 0.03 0.00 0.00 54.97 55.20 1ljz s GLU 20 Cb 0.00 -4.72 0.31 0.00 -0.80 0.00 0.00 34.13 28.92 1ljz s GLU 20 CO 0.00 -3.10 1.94 0.09 -1.33 0.00 0.00 175.26 172.86 1ljz n ASN 21 N 13.56 6.17 -0.62 0.83 5.03 -1.19 -4.43 115.26 134.62 1ljz n ASN 21 Ca 0.31 -3.22 0.00 0.00 0.87 0.00 0.00 54.58 52.53 1ljz n ASN 21 Cb 0.49 -0.97 0.00 0.00 -1.02 0.00 0.00 39.78 38.28 1ljz n ASN 21 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ljz n LEU 22 N -0.12 0.00 -3.66 3.41 -0.00 -0.63 -4.06 117.00 111.94 1ljz n LEU 22 Ca 0.39 0.00 -0.21 0.00 -0.00 0.00 0.00 56.01 56.20 1ljz n LEU 22 Cb 0.73 0.00 -0.18 0.00 -0.00 0.00 0.00 43.42 43.97 1ljz n LEU 22 CO 0.48 0.00 -0.34 0.00 -0.00 0.00 0.00 177.39 177.53 1ljz s TYR 24 N 2.17 3.53 -0.44 0.00 1.13 0.30 -1.49 117.35 122.54 1ljz s TYR 24 Ca 0.05 1.05 0.03 0.00 -1.41 0.00 0.00 57.07 56.78 1ljz s TYR 24 Cb -0.12 -2.38 0.12 0.00 -1.10 0.00 0.00 41.96 38.48 1ljz s TYR 24 CO -0.04 0.33 0.20 1.03 -2.51 0.00 0.00 175.55 174.57 1ljz s ARG 25 N -2.35 1.56 -0.13 -3.49 0.52 0.33 -2.56 118.95 112.83 1ljz s ARG 25 Ca 0.43 -2.16 -0.02 0.00 -0.52 0.00 0.00 55.73 53.46 1ljz s ARG 25 Cb -0.13 -2.87 -0.03 0.00 0.52 0.00 0.00 34.95 32.44 1ljz s ARG 25 CO 0.20 -1.08 -0.05 -1.59 0.02 0.00 0.00 175.30 172.79 1ljz s LYS 26 N 0.30 3.44 -0.10 3.54 0.00 -1.11 -2.19 119.74 123.62 1ljz s LYS 26 Ca 0.15 -0.54 -0.09 0.00 0.00 0.00 0.00 55.97 55.50 1ljz s LYS 26 Cb -0.23 -2.82 0.03 0.00 0.00 0.00 0.00 37.83 34.81 1ljz s LYS 26 CO -0.04 0.34 0.26 0.00 0.00 0.00 0.00 175.35 175.91 1ljz s MET 27 N 0.08 0.29 0.00 1.78 0.23 -0.64 -1.35 119.30 119.70 1ljz s MET 27 Ca -0.01 0.38 0.00 0.00 -1.03 0.00 0.00 55.69 55.03 1ljz s MET 27 Cb -0.14 0.12 0.00 0.00 -1.53 0.00 0.00 34.83 33.28 1ljz s MET 27 CO 0.03 -0.05 0.00 -2.67 -2.03 0.00 0.00 175.02 170.30 1ljz n TRP 28 N 3.08 0.00 -3.67 3.16 2.14 -0.29 -1.95 117.44 119.92 1ljz n TRP 28 Ca -0.14 0.00 -0.38 0.00 2.07 0.00 0.00 57.50 59.05 1ljz n TRP 28 Cb 0.58 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 30.96 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 1.64 2.60 0.00 0.00 -1.08 -0.96 -4.79 116.67 114.09 1ljz s ASP 30 Ca 0.05 -2.21 0.00 0.00 -0.52 0.00 0.00 52.55 49.87 1ljz s ASP 30 Cb -0.16 -0.29 0.00 0.00 -1.46 0.00 0.00 42.92 41.01 1ljz s ASP 30 CO 0.06 -0.29 0.00 0.00 0.52 0.00 0.00 175.17 175.46 1ljz n ALA 31 N 3.94 0.00 0.13 3.66 0.00 -1.18 -2.76 120.51 124.29 1ljz n ALA 31 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.59 1ljz n ALA 31 Cb 0.39 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.16 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 0.20 0.09 0.00 3.57 -1.53 12.56 116.94 131.83 1ljz h PHE 32 Ca 0.00 -0.04 -0.26 0.00 3.53 0.00 0.00 57.97 61.20 1ljz h PHE 32 Cb 0.00 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 38.70 1ljz h PHE 32 CO 0.00 0.46 -1.14 0.00 -2.23 0.00 0.00 178.31 175.40 1ljz n SER 34 N -3.65 0.00 0.01 0.00 7.64 -0.11 -5.05 113.62 112.47 1ljz n SER 34 Ca -0.09 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1ljz n SER 34 Cb 0.95 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.92 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 -1.65 -0.04 0.00 6.43 3.41 3.90 -4.97 113.62 120.70 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 0.54 -0.16 0.00 0.00 175.04 175.42 1ljz n ARG 36 N -2.58 0.00 -3.64 4.33 1.74 0.93 -4.60 116.66 112.83 1ljz n ARG 36 Ca 0.00 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.03 1ljz n ARG 36 Cb 0.00 -0.05 0.02 0.00 -1.02 0.00 0.00 32.46 31.41 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 2.71 0.83 3.77 -0.13 0.00 -1.11 -3.92 105.19 107.34 1ljz n GLY 37 Ca 0.00 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.06 2.98 0.04 1.61 1.02 -1.26 -2.05 119.74 120.01 1ljz s LYS 38 Ca 0.18 1.45 -0.11 0.00 0.02 0.00 0.00 55.97 57.51 1ljz s LYS 38 Cb -0.04 -1.97 -0.06 0.00 -0.52 0.00 0.00 37.83 35.25 1ljz s LYS 38 CO 0.08 -1.12 0.38 0.08 -0.92 0.00 0.00 175.35 173.85 1ljz s VAL 39 N -2.17 5.11 -0.04 3.17 1.01 0.15 -4.68 120.40 122.95 1ljz s VAL 39 Ca 0.69 0.56 0.02 0.00 0.00 0.00 0.00 61.98 63.24 1ljz s VAL 39 Cb -0.21 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.53 1ljz s VAL 39 CO 0.37 0.41 -0.07 -0.69 0.00 0.00 0.00 175.10 175.12 1ljz s VAL 40 N -1.26 0.70 -0.06 2.92 1.01 -1.26 -1.13 120.40 121.30 1ljz s VAL 40 Ca 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1ljz s VAL 40 Cb -0.15 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1ljz s VAL 40 CO 0.16 0.24 -0.04 -1.83 0.00 0.00 0.00 175.10 173.63 1ljz s GLU 41 N 0.51 0.87 -0.10 2.72 1.03 -0.46 -5.01 118.70 118.26 1ljz s GLU 41 Ca -0.08 -0.06 -0.04 0.00 0.03 0.00 0.00 54.97 54.82 1ljz s GLU 41 Cb -0.11 -0.99 -0.04 0.00 -0.80 0.00 0.00 34.13 32.19 1ljz s GLU 41 CO 0.01 -0.18 0.07 -0.51 -1.33 0.00 0.00 175.26 173.33 1ljz s LEU 42 N 1.36 4.00 0.07 1.83 1.43 -1.26 -2.76 118.68 123.34 1ljz s LEU 42 Ca -0.04 0.31 -0.28 0.00 -1.03 0.00 0.00 54.13 53.10 1ljz s LEU 42 Cb -0.13 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.22 1ljz s LEU 42 CO -0.03 0.39 1.08 -0.83 0.23 0.00 0.00 176.35 177.20 1ljz s GLY 43 N -0.97 -0.32 0.43 -3.19 0.00 -1.06 -3.44 107.32 98.78 1ljz s GLY 43 Ca 0.14 0.46 -0.14 0.00 0.00 0.00 0.00 44.72 45.18 1ljz s GLY 43 CO 0.03 0.09 0.84 0.00 0.00 0.00 0.00 173.10 174.07 1ljz s ALA 45 N -2.37 -1.40 -0.16 0.00 0.00 -0.93 -4.60 121.76 112.30 1ljz s ALA 45 Ca 0.55 0.29 0.03 0.00 0.00 0.00 0.00 51.96 52.83 1ljz s ALA 45 Cb -0.10 0.85 -0.12 0.00 0.00 0.00 0.00 23.12 23.75 1ljz s ALA 45 CO 0.27 -0.76 -0.12 0.00 0.00 0.00 0.00 175.76 175.16 1ljz n ALA 46 N -0.35 1.65 -2.67 0.00 0.00 -1.26 -1.60 120.51 116.27 1ljz n ALA 46 Ca -0.16 -0.74 -0.04 0.00 0.00 0.00 0.00 53.44 52.50 1ljz n ALA 46 Cb 0.64 0.09 0.11 0.00 0.00 0.00 0.00 19.45 20.29 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 -2.91 0.00 -1.48 0.00 5.66 -1.26 -4.77 114.28 109.53 1ljz n THR 47 Ca -0.28 -1.15 -0.33 0.00 -3.05 0.00 0.00 64.05 59.24 1ljz n THR 47 Cb 0.83 0.95 -0.18 0.00 -1.55 0.00 0.00 70.33 70.38 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 7.13 2.13 -1.04 0.00 -0.04 -1.26 -4.61 135.00 137.31 1ljz n PRO 49 Ca 0.66 -2.39 -0.20 0.00 -0.04 0.00 0.00 63.50 61.52 1ljz n PRO 49 Cb 0.07 -1.94 0.03 0.00 -0.04 0.00 0.00 33.50 31.63 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 -0.51 6.63 -1.46 3.54 7.64 -1.26 -4.52 113.62 123.68 1ljz n SER 50 Ca 0.47 -3.18 -0.05 0.00 1.01 0.00 0.00 58.87 57.12 1ljz n SER 50 Cb 0.96 -1.07 0.15 0.00 -1.01 0.00 0.00 64.21 63.24 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 0.27 2.31 -1.49 1.43 0.00 -1.26 -4.46 118.16 114.95 1ljz n LYS 51 Ca 0.37 -1.62 -0.39 0.00 -0.00 0.00 0.00 58.31 56.66 1ljz n LYS 51 Cb 0.58 -1.75 0.03 0.00 -0.00 0.00 0.00 35.03 33.89 1ljz n LYS 51 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1ljz n LYS 52 N -0.04 0.65 -0.43 -1.58 2.85 -1.26 -4.66 118.16 113.69 1ljz n LYS 52 Ca 0.24 0.25 -0.34 0.00 -1.05 0.00 0.00 58.31 57.40 1ljz n LYS 52 Cb 0.95 -1.72 -0.09 0.00 -0.65 0.00 0.00 35.03 33.53 1ljz n LYS 52 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1ljz n PRO 53 N 0.09 0.13 0.19 -1.58 -0.02 -1.26 -3.13 135.00 129.42 1ljz n PRO 53 Ca 0.11 -0.95 0.00 0.00 -2.02 0.00 0.00 63.50 60.65 1ljz n PRO 53 Cb 0.44 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 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 7.89 -4.25 -3.98 6.00 4.19 -1.26 -5.15 117.16 120.60 1ljz n TYR 54 Ca 0.36 1.29 -0.22 0.00 3.31 0.00 0.00 57.90 62.64 1ljz n TYR 54 Cb 0.32 3.30 -0.04 0.00 0.49 0.00 0.00 39.34 43.40 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 -1.81 2.74 -0.31 2.98 2.02 -1.18 -4.89 118.70 118.25 1ljz s GLU 55 Ca 0.00 -1.23 -0.07 0.00 0.02 0.00 0.00 54.97 53.69 1ljz s GLU 55 Cb 0.00 -2.46 0.02 0.00 0.10 0.00 0.00 34.13 31.78 1ljz s GLU 55 CO 0.00 0.23 0.09 -2.00 0.02 0.00 0.00 175.26 173.60 1ljz s GLU 56 N -3.90 2.96 -0.04 1.61 -6.30 -0.82 -4.53 118.70 107.67 1ljz s GLU 56 Ca 0.37 -0.95 0.05 0.00 -2.50 0.00 0.00 54.97 51.94 1ljz s GLU 56 Cb -0.06 -3.40 -0.01 0.00 0.00 0.00 0.00 34.13 30.66 1ljz s GLU 56 CO 0.25 -0.51 -0.18 0.54 0.02 0.00 0.00 175.26 175.38 1ljz s VAL 57 N 1.47 1.51 -0.02 3.70 0.11 -1.25 -1.62 120.40 124.30 1ljz s VAL 57 Ca 0.01 -0.78 -0.00 0.00 -2.93 0.00 0.00 61.98 58.28 1ljz s VAL 57 Cb -0.18 -1.28 0.03 0.00 -1.53 0.00 0.00 36.38 33.42 1ljz s VAL 57 CO 0.03 0.43 0.03 -0.89 -3.33 0.00 0.00 175.10 171.36 1ljz s THR 58 N -0.13 -0.03 0.05 5.04 2.01 -0.93 -4.80 115.64 116.86 1ljz s THR 58 Ca -0.00 0.22 -0.11 0.00 0.31 0.00 0.00 61.69 62.10 1ljz s THR 58 Cb -0.10 -0.11 -0.06 0.00 0.01 0.00 0.00 72.50 72.24 1ljz s THR 58 CO 0.01 0.10 0.39 0.00 -0.69 0.00 0.00 174.62 174.44 1ljz n SER 61 N 4.74 6.87 -3.81 0.00 3.41 -1.26 0.14 113.62 123.71 1ljz n SER 61 Ca -0.16 -3.24 -0.12 0.00 -0.26 0.00 0.00 58.87 55.08 1ljz n SER 61 Cb 0.51 -1.36 -0.10 0.00 -0.26 0.00 0.00 64.21 63.00 1ljz n SER 61 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ljz s THR 62 N -1.35 0.04 -0.48 6.66 -1.32 -1.26 -4.91 115.64 113.01 1ljz s THR 62 Ca 0.45 -0.32 -0.46 0.00 -1.21 0.00 0.00 61.69 60.16 1ljz s THR 62 Cb 0.14 -0.43 -0.19 0.00 -1.51 0.00 0.00 72.50 70.51 1ljz s THR 62 CO -0.04 -0.17 1.76 0.47 -2.21 0.00 0.00 174.62 174.43 1ljz n ASP 63 N 2.13 1.17 -4.15 8.08 8.00 -1.25 -0.10 116.55 130.44 1ljz n ASP 63 Ca -0.18 1.03 -0.30 0.00 0.71 0.00 0.00 54.79 56.06 1ljz n ASP 63 Cb 0.57 -0.91 -0.09 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 5.09 -0.91 0.00 -1.24 -0.00 0.95 -4.77 118.16 117.28 1ljz n LYS 64 Ca 0.37 0.09 0.08 0.00 -0.00 0.00 0.00 58.31 58.85 1ljz n LYS 64 Cb -0.04 -3.38 0.45 0.00 -0.00 0.00 0.00 35.03 32.06 1ljz n LYS 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ljz s ASN 66 N -1.59 6.18 0.22 0.00 2.20 -1.26 -4.93 114.94 115.77 1ljz s ASN 66 Ca 0.23 -2.79 0.05 0.00 -0.94 0.00 0.00 52.86 49.42 1ljz s ASN 66 Cb 0.11 -2.07 -0.03 0.00 -2.00 0.00 0.00 41.25 37.25 1ljz s ASN 66 CO 0.18 -0.49 0.27 -2.16 -2.94 0.00 0.00 177.10 171.97 1ljz s PRO 67 N 0.03 3.22 0.05 3.55 0.04 -1.26 -4.72 135.00 135.91 1ljz s PRO 67 Ca 0.18 -0.84 -0.30 0.00 0.04 0.00 0.00 61.00 60.07 1ljz s PRO 67 Cb -0.14 -2.77 -0.05 0.00 0.04 0.00 0.00 34.50 31.58 1ljz s PRO 67 CO -0.07 0.44 1.07 -1.01 0.04 0.00 0.00 177.00 177.47 1ljz s HIS 68 N -1.97 3.58 0.08 0.56 3.76 -1.26 -4.98 115.29 115.06 1ljz s HIS 68 Ca 0.33 1.55 -0.30 0.00 -0.15 0.00 0.00 55.06 56.49 1ljz s HIS 68 Cb -0.09 -3.24 -0.16 0.00 1.11 0.00 0.00 32.58 30.20 1ljz s HIS 68 CO 0.27 -0.53 1.64 -1.00 -0.85 0.00 0.00 174.74 174.27 1ljz h PRO 69 N 6.52 -0.66 -0.17 8.40 0.13 -2.02 -3.18 132.00 141.01 1ljz h PRO 69 Ca -0.42 0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 64.70 1ljz h PRO 69 Cb 1.22 0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.49 1ljz h PRO 69 CO 0.77 -0.44 -0.11 0.87 -0.23 0.00 0.00 178.00 178.86 1ljz h LYS 70 N -0.69 0.38 0.00 0.86 6.56 -2.06 -3.44 116.57 118.18 1ljz h LYS 70 Ca -0.05 -0.18 0.00 0.00 -1.06 0.00 0.00 60.65 59.37 1ljz h LYS 70 Cb 0.57 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.22 1ljz h LYS 70 CO 0.04 0.71 0.00 1.04 -2.06 0.00 0.00 179.45 179.18 1ljz n GLN 71 N -4.57 3.72 0.00 3.15 6.02 -1.21 -4.84 117.38 119.66 1ljz n GLN 71 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 1ljz n GLN 71 Cb 0.33 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.59 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 0.00 0.00 -0.51 -1.09 1.74 -1.20 -4.72 116.66 110.88 1ljz n ARG 72 Ca 0.00 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.03 1ljz n ARG 72 Cb 0.00 0.00 0.13 0.00 -1.02 0.00 0.00 32.46 31.57 1ljz n ARG 72 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1ljz n PRO 73 N 0.00 2.16 0.00 5.56 -0.04 -1.26 -5.03 135.00 136.39 1ljz n PRO 73 Ca 0.00 -1.44 0.14 0.00 -0.04 0.00 0.00 63.50 62.16 1ljz n PRO 73 Cb 0.00 -1.69 0.53 0.00 -0.04 0.00 0.00 33.50 32.29 1ljz n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87