#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 4.19 -0.17 7.28 1.01 -1.26 -2.20 120.40 129.24 1ljz s VAL 2 Ca 0.00 -0.97 -0.15 0.00 0.00 0.00 0.00 61.98 60.87 1ljz s VAL 2 Cb 0.00 -3.46 0.05 0.00 0.00 0.00 0.00 36.38 32.97 1ljz s VAL 2 CO 0.00 -0.18 0.45 0.00 0.00 0.00 0.00 175.10 175.37 1ljz s HIS 4 N 0.46 3.08 0.07 0.00 3.76 -1.26 -1.26 115.29 120.13 1ljz s HIS 4 Ca -0.02 1.05 -0.28 0.00 -0.15 0.00 0.00 55.06 55.66 1ljz s HIS 4 Cb -0.04 -3.15 0.09 0.00 1.11 0.00 0.00 32.58 30.60 1ljz s HIS 4 CO -0.02 -1.50 1.12 -0.08 -0.85 0.00 0.00 174.74 173.41 1ljz s THR 5 N -3.31 0.00 -0.26 1.30 -1.32 0.51 -3.38 115.64 109.19 1ljz s THR 5 Ca 0.60 -0.44 0.00 0.00 -1.21 0.00 0.00 61.69 60.64 1ljz s THR 5 Cb -0.12 -1.98 0.07 0.00 -1.51 0.00 0.00 72.50 68.96 1ljz s THR 5 CO 0.52 0.00 0.01 0.42 -2.21 0.00 0.00 174.62 173.36 1ljz s THR 6 N -2.86 1.30 0.00 5.08 -4.23 -1.23 0.11 115.64 113.81 1ljz s THR 6 Ca 0.13 -1.29 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1ljz s THR 6 Cb 0.02 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1ljz s THR 6 CO -0.01 -0.31 0.00 0.00 -0.54 0.00 0.00 174.62 173.76 1ljz n ALA 7 N 4.72 0.00 -1.00 3.99 0.00 -1.26 -4.87 120.51 122.10 1ljz n ALA 7 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 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 -2.19 0.00 0.26 0.00 5.66 -1.26 -4.96 114.28 111.78 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 -0.60 -3.14 1.09 0.02 -2.01 -3.47 113.55 105.44 1ljz h SER 9 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 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 -0.19 0.00 -0.81 -1.14 0.00 0.00 176.83 174.69 1ljz n PRO 10 N -5.25 1.86 -1.74 3.45 -0.04 -1.26 -5.04 135.00 126.97 1ljz n PRO 10 Ca -0.09 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.95 1ljz n PRO 10 Cb 0.29 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 -0.89 -0.04 0.00 0.00 175.50 174.57 1ljz n ILE 11 N -0.52 0.80 -3.81 0.52 5.41 -1.26 -4.36 119.36 116.14 1ljz n ILE 11 Ca 0.00 -0.20 -0.32 0.00 1.00 0.00 0.00 62.75 63.23 1ljz n ILE 11 Cb 0.00 -2.00 -0.04 0.00 -0.71 0.00 0.00 39.64 36.89 1ljz n ILE 11 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1ljz s SER 12 N 0.66 6.43 -0.28 4.38 1.04 0.31 -4.89 113.70 121.34 1ljz s SER 12 Ca 0.66 0.43 -0.03 0.00 0.48 0.00 0.00 55.95 57.50 1ljz s SER 12 Cb -0.49 -2.03 0.09 0.00 0.10 0.00 0.00 66.02 63.70 1ljz s SER 12 CO 0.45 0.15 0.10 0.00 0.98 0.00 0.00 173.24 174.92 1ljz s ALA 13 N -1.51 1.06 0.17 5.32 0.00 -1.26 0.19 121.76 125.73 1ljz s ALA 13 Ca 0.35 -1.25 0.11 0.00 0.00 0.00 0.00 51.96 51.17 1ljz s ALA 13 Cb -0.13 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.51 1ljz s ALA 13 CO 0.24 -1.57 -0.22 0.14 0.00 0.00 0.00 175.76 174.36 1ljz s VAL 14 N 1.86 2.51 0.58 0.00 -7.23 -0.39 -4.86 120.40 112.87 1ljz s VAL 14 Ca 0.08 -1.87 -0.14 0.00 -1.81 0.00 0.00 61.98 58.24 1ljz s VAL 14 Cb -0.17 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 34.53 1ljz s VAL 14 CO -0.27 -0.05 1.02 0.42 -0.31 0.00 0.00 175.10 175.91 1ljz s THR 15 N -1.50 4.42 -0.03 5.32 -4.23 -1.26 -1.37 115.64 116.99 1ljz s THR 15 Ca 0.20 1.00 -0.19 0.00 -1.18 0.00 0.00 61.69 61.51 1ljz s THR 15 Cb -0.09 -3.68 -0.05 0.00 1.34 0.00 0.00 72.50 70.02 1ljz s THR 15 CO 0.10 -0.83 0.55 0.00 -0.54 0.00 0.00 174.62 173.90 1ljz s PRO 17 N -0.12 -1.89 0.00 0.00 0.04 -1.26 -4.76 135.00 127.01 1ljz s PRO 17 Ca 0.29 0.16 -0.02 0.00 0.04 0.00 0.00 61.00 61.47 1ljz s PRO 17 Cb -0.17 -1.50 -0.09 0.00 0.04 0.00 0.00 34.50 32.78 1ljz s PRO 17 CO 0.15 -4.20 1.77 -0.35 0.04 0.00 0.00 177.00 174.41 1ljz n PRO 18 N -5.15 0.87 0.00 0.56 -0.04 -1.26 -2.73 135.00 127.25 1ljz n PRO 18 Ca 0.11 -0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.23 1ljz n PRO 18 Cb 0.59 -1.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1ljz n PRO 18 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ljz n GLY 19 N 2.39 0.19 3.60 0.55 0.00 -1.26 -5.13 105.19 105.53 1ljz n GLY 19 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 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 0.49 0.00 1.61 1.03 -1.11 -4.39 118.70 116.33 1ljz s GLU 20 Ca 0.00 0.18 0.00 0.00 0.03 0.00 0.00 54.97 55.18 1ljz s GLU 20 Cb 0.00 0.23 0.00 0.00 -0.80 0.00 0.00 34.13 33.56 1ljz s GLU 20 CO 0.00 -0.14 0.20 0.09 -1.33 0.00 0.00 175.26 174.08 1ljz n ASN 21 N 0.90 0.00 -4.63 0.83 3.02 -0.74 -4.31 115.26 110.33 1ljz n ASN 21 Ca -0.09 -1.00 -0.25 0.00 -0.03 0.00 0.00 54.58 53.21 1ljz n ASN 21 Cb 0.58 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.86 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 2.93 -0.35 3.41 1.02 0.13 -4.36 118.68 121.45 1ljz s LEU 22 Ca 0.00 -0.10 0.02 0.00 0.02 0.00 0.00 54.13 54.07 1ljz s LEU 22 Cb 0.00 -2.27 0.15 0.00 0.02 0.00 0.00 46.19 44.09 1ljz s LEU 22 CO 0.00 -1.94 0.34 0.00 0.02 0.00 0.00 176.35 174.77 1ljz s TYR 24 N 1.54 3.15 -0.65 0.00 1.13 0.14 -2.12 117.35 120.53 1ljz s TYR 24 Ca 0.16 1.61 -0.02 0.00 -1.41 0.00 0.00 57.07 57.42 1ljz s TYR 24 Cb -0.16 -3.09 0.17 0.00 -1.10 0.00 0.00 41.96 37.77 1ljz s TYR 24 CO -0.08 -0.71 0.47 0.50 -2.51 0.00 0.00 175.55 173.22 1ljz s ARG 25 N -2.83 2.59 -0.08 -3.49 6.06 0.88 -2.80 118.95 119.29 1ljz s ARG 25 Ca 0.62 -2.69 -0.14 0.00 -2.50 0.00 0.00 55.73 51.02 1ljz s ARG 25 Cb -0.19 -3.70 -0.05 0.00 0.06 0.00 0.00 34.95 31.07 1ljz s ARG 25 CO 0.24 -1.18 0.36 0.21 -2.50 0.00 0.00 175.30 172.42 1ljz s LYS 26 N -0.34 4.02 -0.29 5.12 2.20 -0.92 -2.26 119.74 127.27 1ljz s LYS 26 Ca 0.19 0.27 -0.24 0.00 -0.36 0.00 0.00 55.97 55.82 1ljz s LYS 26 Cb -0.19 -3.31 0.14 0.00 -1.51 0.00 0.00 37.83 32.97 1ljz s LYS 26 CO -0.05 0.49 1.12 0.00 -0.36 0.00 0.00 175.35 176.56 1ljz s MET 27 N -0.38 0.39 0.00 4.03 0.23 -0.97 -0.65 119.30 121.95 1ljz s MET 27 Ca 0.21 0.48 0.00 0.00 -1.03 0.00 0.00 55.69 55.35 1ljz s MET 27 Cb -0.15 0.18 0.00 0.00 -1.53 0.00 0.00 34.83 33.34 1ljz s MET 27 CO 0.09 -0.05 0.00 -2.67 -2.03 0.00 0.00 175.02 170.36 1ljz n TRP 28 N 2.18 0.00 -4.04 3.16 2.14 -0.78 -0.67 117.44 119.44 1ljz n TRP 28 Ca -0.12 0.00 -0.35 0.00 2.07 0.00 0.00 57.50 59.10 1ljz n TRP 28 Cb 0.56 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 30.94 1ljz n TRP 28 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1ljz n ASP 30 N 4.18 0.54 0.00 0.00 2.03 -0.76 -4.80 116.55 117.75 1ljz n ASP 30 Ca -0.17 -2.73 0.00 0.00 0.52 0.00 0.00 54.79 52.41 1ljz n ASP 30 Cb 0.52 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 40.29 1ljz n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ljz n ALA 31 N 1.62 0.00 0.11 -1.67 0.00 -1.11 -2.68 120.51 116.77 1ljz n ALA 31 Ca 0.24 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.67 1ljz n ALA 31 Cb 0.50 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.24 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 0.26 -0.08 0.00 3.57 -1.37 17.28 116.94 136.60 1ljz h PHE 32 Ca 0.00 -0.05 -0.18 0.00 3.53 0.00 0.00 57.97 61.26 1ljz h PHE 32 Cb 0.00 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.67 1ljz h PHE 32 CO 0.00 0.52 -0.72 0.00 -2.23 0.00 0.00 178.31 175.88 1ljz n SER 34 N -3.84 0.00 0.06 0.00 2.88 0.28 -5.06 113.62 107.93 1ljz n SER 34 Ca -0.04 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1ljz n SER 34 Cb 0.70 -0.15 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 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 -1.43 -0.21 0.00 -3.46 3.41 5.30 -5.00 113.62 112.23 1ljz n SER 35 Ca 0.00 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 1ljz n SER 35 Cb 0.00 0.30 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 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 -2.88 0.00 -3.13 4.33 0.63 0.34 -4.58 116.66 111.36 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 -0.17 0.02 0.00 0.45 0.00 0.00 32.46 32.77 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 1.66 1.22 3.90 5.14 0.00 -1.09 -4.14 105.19 111.88 1ljz n GLY 37 Ca 0.00 -1.20 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.07 2.54 -0.00 1.61 1.02 -1.26 -1.34 119.74 120.24 1ljz s LYS 38 Ca 0.12 0.14 0.02 0.00 0.02 0.00 0.00 55.97 56.27 1ljz s LYS 38 Cb -0.04 -2.09 -0.04 0.00 -0.52 0.00 0.00 37.83 35.15 1ljz s LYS 38 CO 0.09 -1.12 -0.02 0.08 -0.92 0.00 0.00 175.35 173.46 1ljz s VAL 39 N -3.30 4.01 -0.03 3.17 1.01 -0.35 -4.65 120.40 120.26 1ljz s VAL 39 Ca 0.58 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.91 1ljz s VAL 39 Cb -0.11 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.53 1ljz s VAL 39 CO 0.48 0.39 0.05 -0.69 0.00 0.00 0.00 175.10 175.33 1ljz s VAL 40 N -1.05 -0.08 -0.11 2.92 1.01 -1.26 -1.86 120.40 119.97 1ljz s VAL 40 Ca 0.19 0.31 -0.00 0.00 0.00 0.00 0.00 61.98 62.47 1ljz s VAL 40 Cb -0.11 -0.11 0.02 0.00 0.00 0.00 0.00 36.38 36.17 1ljz s VAL 40 CO 0.09 0.13 -0.08 -1.83 0.00 0.00 0.00 175.10 173.41 1ljz s GLU 41 N 1.56 1.53 -0.08 2.72 -1.05 0.17 -4.96 118.70 118.59 1ljz s GLU 41 Ca -0.03 -0.27 -0.01 0.00 -0.15 0.00 0.00 54.97 54.51 1ljz s GLU 41 Cb -0.13 -1.55 -0.03 0.00 -0.44 0.00 0.00 34.13 31.98 1ljz s GLU 41 CO -0.03 -0.23 -0.03 -0.51 0.95 0.00 0.00 175.26 175.41 1ljz s LEU 42 N 1.57 3.42 0.29 1.83 1.43 -1.26 -2.17 118.68 123.78 1ljz s LEU 42 Ca 0.02 0.08 -0.19 0.00 -1.03 0.00 0.00 54.13 53.02 1ljz s LEU 42 Cb -0.13 -1.77 0.07 0.00 0.03 0.00 0.00 46.19 44.39 1ljz s LEU 42 CO -0.07 0.37 0.91 -0.83 0.23 0.00 0.00 176.35 176.96 1ljz s GLY 43 N -0.86 0.25 0.22 -3.19 0.00 -1.12 -3.56 107.32 99.06 1ljz s GLY 43 Ca 0.13 -0.56 0.05 0.00 0.00 0.00 0.00 44.72 44.35 1ljz s GLY 43 CO 0.02 1.01 0.25 0.00 0.00 0.00 0.00 173.10 174.38 1ljz s ALA 45 N -1.98 -0.89 -0.08 0.00 0.00 -0.97 -4.80 121.76 113.03 1ljz s ALA 45 Ca 0.33 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.80 1ljz s ALA 45 Cb -0.09 0.86 -0.08 0.00 0.00 0.00 0.00 23.12 23.81 1ljz s ALA 45 CO 0.26 -0.99 -0.02 0.00 0.00 0.00 0.00 175.76 175.02 1ljz n ALA 46 N -0.47 1.81 -2.57 0.00 0.00 -1.26 0.21 120.51 118.23 1ljz n ALA 46 Ca -0.04 -0.45 -0.13 0.00 0.00 0.00 0.00 53.44 52.82 1ljz n ALA 46 Cb 0.60 0.17 0.03 0.00 0.00 0.00 0.00 19.45 20.25 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 -2.47 1.59 -1.49 0.00 5.66 -1.26 -4.81 114.28 111.49 1ljz n THR 47 Ca -0.14 -3.60 -0.40 0.00 -3.05 0.00 0.00 64.05 56.86 1ljz n THR 47 Cb 0.71 0.14 -0.15 0.00 -1.55 0.00 0.00 70.33 69.48 1ljz n THR 47 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ljz s PRO 49 N 8.93 4.50 -0.77 0.00 0.04 -1.26 -4.90 135.00 141.53 1ljz s PRO 49 Ca 1.35 1.30 -0.26 0.00 0.04 0.00 0.00 61.00 63.43 1ljz s PRO 49 Cb -1.25 -3.48 -0.14 0.00 0.04 0.00 0.00 34.50 29.67 1ljz s PRO 49 CO 0.49 -0.10 2.42 0.43 0.04 0.00 0.00 177.00 180.28 1ljz n SER 50 N 4.18 1.80 -3.84 6.66 7.64 -1.26 -4.83 113.62 123.97 1ljz n SER 50 Ca 0.05 -1.41 -0.42 0.00 1.01 0.00 0.00 58.87 58.09 1ljz n SER 50 Cb 0.50 -1.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.06 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 8.78 3.48 0.00 1.43 -0.00 -1.26 -4.67 118.16 125.91 1ljz n LYS 51 Ca 0.47 -3.35 0.13 0.00 -0.00 0.00 0.00 58.31 55.55 1ljz n LYS 51 Cb 0.43 -3.00 0.33 0.00 -0.00 0.00 0.00 35.03 32.80 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 4.30 0.88 -0.11 -1.58 0.00 -1.23 -3.76 118.16 116.67 1ljz n LYS 52 Ca 0.42 -0.55 0.24 0.00 0.00 0.00 0.00 58.31 58.42 1ljz n LYS 52 Cb 0.37 -1.49 0.46 0.00 0.00 0.00 0.00 35.03 34.37 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 1.34 0.00 0.00 1.64 0.11 -2.01 -3.34 132.00 129.74 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 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1ljz h PRO 53 CO 0.00 0.00 0.00 0.98 -0.21 0.00 0.00 178.00 178.77 1ljz n TYR 54 N -3.25 0.00 -3.99 0.65 4.19 -1.26 -5.14 117.16 108.36 1ljz n TYR 54 Ca 0.18 0.00 -0.28 0.00 3.31 0.00 0.00 57.90 61.12 1ljz n TYR 54 Cb 1.31 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 41.10 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 -0.99 3.21 0.30 2.98 8.01 -1.25 -4.91 118.70 126.05 1ljz s GLU 55 Ca 0.00 -0.66 -0.27 0.00 0.01 0.00 0.00 54.97 54.05 1ljz s GLU 55 Cb 0.00 -2.86 -0.10 0.00 -4.31 0.00 0.00 34.13 26.87 1ljz s GLU 55 CO 0.00 0.53 0.95 -2.00 0.01 0.00 0.00 175.26 174.75 1ljz s GLU 56 N -2.94 4.65 -0.12 1.61 2.56 0.15 -3.54 118.70 121.07 1ljz s GLU 56 Ca 0.33 1.39 -0.06 0.00 0.00 0.00 0.00 54.97 56.63 1ljz s GLU 56 Cb -0.11 -2.94 0.05 0.00 2.00 0.00 0.00 34.13 33.12 1ljz s GLU 56 CO 0.26 0.33 0.28 0.54 -0.56 0.00 0.00 175.26 176.12 1ljz s VAL 57 N -1.48 -0.03 -0.17 3.70 0.11 -1.25 -2.29 120.40 118.99 1ljz s VAL 57 Ca 0.48 0.13 -0.01 0.00 -2.93 0.00 0.00 61.98 59.64 1ljz s VAL 57 Cb -0.21 -0.43 0.05 0.00 -1.53 0.00 0.00 36.38 34.25 1ljz s VAL 57 CO 0.27 0.05 -0.02 -0.89 -3.33 0.00 0.00 175.10 171.18 1ljz s THR 58 N 1.22 0.90 -0.16 5.04 2.01 -0.96 -4.85 115.64 118.84 1ljz s THR 58 Ca -0.09 -0.56 -0.17 0.00 0.31 0.00 0.00 61.69 61.18 1ljz s THR 58 Cb -0.09 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 1ljz s THR 58 CO -0.09 0.04 0.43 0.00 -0.69 0.00 0.00 174.62 174.31 1ljz n SER 61 N 3.49 5.85 -3.83 0.00 2.88 -1.26 0.17 113.62 120.92 1ljz n SER 61 Ca -0.18 -3.57 -0.12 0.00 -1.33 0.00 0.00 58.87 53.67 1ljz n SER 61 Cb 0.56 -0.98 -0.11 0.00 -0.75 0.00 0.00 64.21 62.94 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 -3.60 0.04 -0.58 2.46 -4.23 -1.26 -4.97 115.64 103.50 1ljz s THR 62 Ca 0.39 -0.35 -0.40 0.00 -1.18 0.00 0.00 61.69 60.15 1ljz s THR 62 Cb 0.16 -0.38 -0.19 0.00 1.34 0.00 0.00 72.50 73.43 1ljz s THR 62 CO -0.04 -0.19 2.18 0.47 -0.54 0.00 0.00 174.62 176.50 1ljz n ASP 63 N 2.16 0.64 -3.95 3.99 9.92 -1.24 0.05 116.55 128.11 1ljz n ASP 63 Ca -0.18 0.56 -0.26 0.00 -0.53 0.00 0.00 54.79 54.39 1ljz n ASP 63 Cb 0.57 -0.88 -0.02 0.00 -0.64 0.00 0.00 41.12 40.15 1ljz n ASP 63 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ljz n LYS 64 N 7.47 -3.18 -0.18 -1.24 4.01 0.06 -4.84 118.16 120.27 1ljz n LYS 64 Ca 0.55 0.40 0.07 0.00 -0.51 0.00 0.00 58.31 58.82 1ljz n LYS 64 Cb -0.03 -4.49 0.20 0.00 -0.51 0.00 0.00 35.03 30.20 1ljz n LYS 64 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ljz n ASN 66 N 0.58 5.54 -4.86 0.00 6.94 -1.26 -4.89 115.26 117.31 1ljz n ASN 66 Ca 0.13 -3.45 -0.35 0.00 -0.02 0.00 0.00 54.58 50.89 1ljz n ASN 66 Cb 0.33 -1.04 -0.06 0.00 -2.36 0.00 0.00 39.78 36.65 1ljz n ASN 66 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1ljz s PRO 67 N -2.81 3.79 0.51 -0.53 0.04 -1.26 -4.72 135.00 130.03 1ljz s PRO 67 Ca 0.35 0.23 0.01 0.00 0.04 0.00 0.00 61.00 61.62 1ljz s PRO 67 Cb 0.10 -3.04 0.02 0.00 0.04 0.00 0.00 34.50 31.62 1ljz s PRO 67 CO 0.05 0.58 0.74 -3.38 0.04 0.00 0.00 177.00 175.03 1ljz s HIS 68 N -1.34 3.02 0.24 0.56 -3.43 -1.24 -5.03 115.29 108.07 1ljz s HIS 68 Ca 0.31 0.11 0.03 0.00 -0.80 0.00 0.00 55.06 54.71 1ljz s HIS 68 Cb -0.14 -2.58 0.26 0.00 -1.43 0.00 0.00 32.58 28.69 1ljz s HIS 68 CO 0.17 -0.67 1.58 -1.35 -2.00 0.00 0.00 174.74 172.47 1ljz h PRO 69 N 0.19 0.32 -0.02 -0.38 0.11 -2.02 -3.32 132.00 126.88 1ljz h PRO 69 Ca -0.44 -0.20 -0.01 0.00 0.11 0.00 0.00 66.00 65.47 1ljz h PRO 69 Cb 1.28 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 1ljz h PRO 69 CO 0.55 0.78 -0.01 -0.22 -0.21 0.00 0.00 178.00 178.89 1ljz h LYS 70 N 0.25 0.04 -4.24 1.05 3.11 -2.02 -3.45 116.57 111.31 1ljz h LYS 70 Ca 0.00 -0.02 -0.34 0.00 -2.81 0.00 0.00 60.65 57.49 1ljz h LYS 70 Cb 1.04 -0.00 -0.30 0.00 -1.00 0.00 0.00 32.23 31.97 1ljz h LYS 70 CO 0.09 0.45 -0.76 -0.65 -2.81 0.00 0.00 179.45 175.77 1ljz s GLN 71 N -4.53 0.48 0.27 1.90 -0.21 -1.25 -5.03 119.66 111.29 1ljz s GLN 71 Ca -0.15 -0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.07 1ljz s GLN 71 Cb 0.03 -0.49 0.00 0.00 1.00 0.00 0.00 33.01 33.55 1ljz s GLN 71 CO 0.68 0.07 0.00 0.54 -2.12 0.00 0.00 175.29 174.46 1ljz n ARG 72 N 3.20 0.00 -0.23 2.91 1.74 -1.26 -3.62 116.66 119.40 1ljz n ARG 72 Ca -0.16 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 56.90 1ljz n ARG 72 Cb 0.56 0.00 0.06 0.00 -1.02 0.00 0.00 32.46 32.07 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 -3.15 1.55 0.00 5.56 -0.04 -1.26 -5.04 135.00 132.62 1ljz n PRO 73 Ca 0.00 -0.66 0.00 0.00 -0.04 0.00 0.00 63.50 62.80 1ljz n PRO 73 Cb 0.00 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 1ljz n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87