#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 3.18 -0.23 7.28 1.01 -1.26 -2.65 120.40 127.73 1ljz s VAL 2 Ca 0.00 -0.93 -0.18 0.00 0.00 0.00 0.00 61.98 60.86 1ljz s VAL 2 Cb 0.00 -3.09 0.06 0.00 0.00 0.00 0.00 36.38 33.35 1ljz s VAL 2 CO 0.00 -0.04 0.60 0.00 0.00 0.00 0.00 175.10 175.66 1ljz s HIS 4 N 0.79 2.43 -0.00 0.00 3.76 -1.26 -0.13 115.29 120.88 1ljz s HIS 4 Ca -0.04 0.95 -0.29 0.00 -0.15 0.00 0.00 55.06 55.53 1ljz s HIS 4 Cb -0.05 -3.30 0.10 0.00 1.11 0.00 0.00 32.58 30.44 1ljz s HIS 4 CO -0.06 -2.43 1.07 -0.08 -0.85 0.00 0.00 174.74 172.38 1ljz s THR 5 N -3.16 0.00 -0.02 1.30 -1.32 -0.74 -3.90 115.64 107.81 1ljz s THR 5 Ca 0.64 -0.24 -0.23 0.00 -1.21 0.00 0.00 61.69 60.65 1ljz s THR 5 Cb -0.16 -1.50 -0.16 0.00 -1.51 0.00 0.00 72.50 69.17 1ljz s THR 5 CO 0.55 0.00 1.06 0.71 -2.21 0.00 0.00 174.62 174.73 1ljz h THR 6 N 2.00 0.74 -1.61 5.08 1.35 -1.85 1.43 112.91 120.05 1ljz h THR 6 Ca -0.22 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 1ljz h THR 6 Cb 1.21 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 1ljz h THR 6 CO 0.27 0.16 -0.22 0.00 -0.25 0.00 0.00 175.52 175.47 1ljz n ALA 7 N -2.52 -2.78 -0.29 6.62 0.00 -1.25 -0.79 120.51 119.50 1ljz n ALA 7 Ca -0.09 0.11 0.30 0.00 0.00 0.00 0.00 53.44 53.77 1ljz n ALA 7 Cb 0.26 -0.72 0.47 0.00 0.00 0.00 0.00 19.45 19.46 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 0.30 0.00 0.00 0.00 5.66 -1.26 -3.41 114.28 115.57 1ljz n THR 8 Ca 0.00 1.20 0.00 0.00 -3.05 0.00 0.00 64.05 62.20 1ljz n THR 8 Cb 0.00 -2.11 0.00 0.00 -1.55 0.00 0.00 70.33 66.67 1ljz n THR 8 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1ljz n SER 9 N -3.21 0.00 -4.96 1.09 7.64 -1.26 -5.09 113.62 107.82 1ljz n SER 9 Ca 0.25 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.91 1ljz n SER 9 Cb 1.50 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 64.72 1ljz n SER 9 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ljz s PRO 10 N 1.19 2.37 -0.10 1.43 0.04 -1.22 -5.02 135.00 133.68 1ljz s PRO 10 Ca 0.00 -1.73 -0.38 0.00 0.04 0.00 0.00 61.00 58.93 1ljz s PRO 10 Cb 0.00 -2.41 -0.15 0.00 0.04 0.00 0.00 34.50 31.98 1ljz s PRO 10 CO 0.00 -0.61 1.64 -0.89 0.04 0.00 0.00 177.00 177.18 1ljz n ILE 11 N -1.91 0.24 -2.73 0.56 5.41 0.03 -3.83 119.36 117.13 1ljz n ILE 11 Ca 0.07 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1ljz n ILE 11 Cb 0.62 -1.25 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 1ljz n ILE 11 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1ljz n SER 12 N 4.61 0.00 -3.19 4.38 3.41 0.49 -4.88 113.62 118.44 1ljz n SER 12 Ca 0.23 -0.86 0.01 0.00 -0.26 0.00 0.00 58.87 57.98 1ljz n SER 12 Cb 0.19 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.13 1ljz n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ljz s ALA 13 N -2.13 -2.12 0.00 7.33 0.00 -1.26 -1.79 121.76 121.78 1ljz s ALA 13 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 51.96 52.75 1ljz s ALA 13 Cb 0.00 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.66 1ljz s ALA 13 CO 0.00 -1.85 0.00 1.33 0.00 0.00 0.00 175.76 175.24 1ljz n VAL 14 N 5.31 0.00 -4.41 0.00 0.24 0.81 -4.83 118.33 115.45 1ljz n VAL 14 Ca 0.05 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.08 1ljz n VAL 14 Cb 0.53 -0.60 -0.11 0.00 -1.47 0.00 0.00 33.84 32.19 1ljz n VAL 14 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1ljz s THR 15 N 0.66 2.46 -0.59 3.34 -1.32 -1.26 0.12 115.64 119.05 1ljz s THR 15 Ca 0.00 -2.02 -0.21 0.00 -1.21 0.00 0.00 61.69 58.25 1ljz s THR 15 Cb 0.00 -2.19 0.07 0.00 -1.51 0.00 0.00 72.50 68.87 1ljz s THR 15 CO 0.00 -0.14 0.82 0.00 -2.21 0.00 0.00 174.62 173.09 1ljz h PRO 17 N 9.31 -0.29 0.00 0.00 0.11 -1.91 -3.44 132.00 135.78 1ljz h PRO 17 Ca -0.28 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1ljz h PRO 17 Cb 1.08 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1ljz h PRO 17 CO 1.10 -0.15 0.00 -2.30 -0.21 0.00 0.00 178.00 176.45 1ljz n PRO 18 N -4.98 0.51 0.12 1.05 -0.02 -1.26 -4.85 135.00 125.58 1ljz n PRO 18 Ca -0.04 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.55 1ljz n PRO 18 Cb 0.14 0.00 0.48 0.00 -0.02 0.00 0.00 33.50 34.11 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 1.30 -1.24 3.52 -1.23 0.00 -1.26 -4.47 105.19 101.80 1ljz n GLY 19 Ca 0.00 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1ljz n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ljz s GLU 20 N -3.30 3.26 0.00 1.61 2.02 -1.26 -4.76 118.70 116.26 1ljz s GLU 20 Ca 0.04 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.71 1ljz s GLU 20 Cb 0.09 -4.13 0.00 0.00 0.10 0.00 0.00 34.13 30.19 1ljz s GLU 20 CO 0.38 -1.79 0.45 0.09 0.02 0.00 0.00 175.26 174.40 1ljz n ASN 21 N 8.23 0.90 -4.54 -0.19 3.02 -1.11 -4.56 115.26 117.01 1ljz n ASN 21 Ca 0.02 -0.95 -0.43 0.00 -0.03 0.00 0.00 54.58 53.19 1ljz n ASN 21 Cb 0.48 0.13 -0.05 0.00 -0.61 0.00 0.00 39.78 39.73 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 -0.29 4.17 0.09 3.41 1.02 -0.59 -4.68 118.68 121.82 1ljz s LEU 22 Ca 0.00 -0.12 -0.31 0.00 0.02 0.00 0.00 54.13 53.73 1ljz s LEU 22 Cb 0.00 -2.99 -0.07 0.00 0.02 0.00 0.00 46.19 43.15 1ljz s LEU 22 CO 0.01 -1.02 1.37 0.00 0.02 0.00 0.00 176.35 176.73 1ljz s TYR 24 N 1.30 2.65 -0.77 0.00 1.13 -0.52 0.73 117.35 121.86 1ljz s TYR 24 Ca 0.64 -0.21 0.03 0.00 -1.41 0.00 0.00 57.07 56.11 1ljz s TYR 24 Cb -0.35 -1.30 0.21 0.00 -1.10 0.00 0.00 41.96 39.42 1ljz s TYR 24 CO 0.30 0.51 0.68 0.54 -2.51 0.00 0.00 175.55 175.07 1ljz n ARG 25 N 0.07 2.35 -2.21 -3.49 5.12 0.30 -2.59 116.66 116.20 1ljz n ARG 25 Ca -0.11 -4.54 -0.40 0.00 -1.93 0.00 0.00 57.85 50.87 1ljz n ARG 25 Cb 0.55 -2.33 -0.03 0.00 -1.16 0.00 0.00 32.46 29.50 1ljz n ARG 25 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1ljz s LYS 26 N -1.74 4.40 -0.15 5.56 1.02 -0.76 -2.27 119.74 125.81 1ljz s LYS 26 Ca 0.29 2.09 -0.29 0.00 0.02 0.00 0.00 55.97 58.08 1ljz s LYS 26 Cb -0.00 -3.07 0.10 0.00 -0.52 0.00 0.00 37.83 34.33 1ljz s LYS 26 CO -0.11 -0.10 0.85 1.41 -0.92 0.00 0.00 175.35 176.48 1ljz s MET 27 N -1.74 0.79 0.00 1.68 1.75 0.29 -1.92 119.30 120.14 1ljz s MET 27 Ca 0.48 0.37 0.00 0.00 -1.25 0.00 0.00 55.69 55.29 1ljz s MET 27 Cb -0.37 0.37 0.00 0.00 2.84 0.00 0.00 34.83 37.67 1ljz s MET 27 CO 0.49 -0.21 0.00 -2.67 -0.65 0.00 0.00 175.02 171.98 1ljz n TRP 28 N 1.28 0.00 -4.30 4.11 2.14 -1.05 0.04 117.44 119.67 1ljz n TRP 28 Ca -0.14 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.10 1ljz n TRP 28 Cb 0.57 0.00 -0.16 0.00 -0.81 0.00 0.00 31.31 30.91 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 4.41 0.89 0.00 0.00 8.00 -0.65 -4.60 116.55 124.60 1ljz n ASP 30 Ca -0.20 -2.74 0.00 0.00 0.71 0.00 0.00 54.79 52.56 1ljz n ASP 30 Cb 0.51 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 40.98 1ljz n ASP 30 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ljz n ALA 31 N 2.15 0.00 -0.07 2.24 0.00 -1.01 -2.49 120.51 121.34 1ljz n ALA 31 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.63 1ljz n ALA 31 Cb 0.45 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.00 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 0.83 -0.09 0.00 3.57 0.24 18.05 116.94 139.53 1ljz h PHE 32 Ca 0.00 -0.19 -0.13 0.00 3.53 0.00 0.00 57.97 61.18 1ljz h PHE 32 Cb 0.00 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1ljz h PHE 32 CO 0.00 0.90 -0.51 0.00 -2.23 0.00 0.00 178.31 176.47 1ljz n SER 34 N -3.94 0.00 0.00 0.00 7.64 -0.10 -5.06 113.62 112.16 1ljz n SER 34 Ca -0.02 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1ljz n SER 34 Cb 0.55 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 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 -1.22 0.00 0.00 6.43 3.41 5.50 -5.00 113.62 122.74 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 0.54 -0.16 0.00 0.00 175.04 175.42 1ljz n ARG 36 N -2.49 0.00 -0.75 4.33 1.74 0.15 -4.62 116.66 115.02 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 -0.09 0.00 0.00 -1.02 0.00 0.00 32.46 31.35 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 2.45 3.75 3.88 -0.13 0.00 -1.04 -4.17 105.19 109.94 1ljz n GLY 37 Ca 0.00 -1.26 -0.33 0.00 0.00 0.00 0.00 46.02 44.43 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 -0.43 3.69 0.30 1.61 3.01 -1.26 0.21 119.74 126.87 1ljz s LYS 38 Ca 0.00 0.05 -0.29 0.00 -1.01 0.00 0.00 55.97 54.72 1ljz s LYS 38 Cb 0.00 -2.87 -0.10 0.00 -1.01 0.00 0.00 37.83 33.85 1ljz s LYS 38 CO 0.00 0.48 1.28 0.08 0.51 0.00 0.00 175.35 177.70 1ljz s VAL 39 N -1.59 2.92 -0.04 3.17 1.01 -0.76 -4.59 120.40 120.52 1ljz s VAL 39 Ca 0.39 0.89 -0.02 0.00 0.00 0.00 0.00 61.98 63.24 1ljz s VAL 39 Cb -0.13 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 32.72 1ljz s VAL 39 CO 0.22 0.20 0.07 -0.69 0.00 0.00 0.00 175.10 174.89 1ljz s VAL 40 N -0.88 -0.11 -0.03 2.92 1.01 -1.26 -2.52 120.40 119.54 1ljz s VAL 40 Ca 0.50 0.33 -0.01 0.00 0.00 0.00 0.00 61.98 62.81 1ljz s VAL 40 Cb -0.38 -0.15 0.03 0.00 0.00 0.00 0.00 36.38 35.88 1ljz s VAL 40 CO 0.48 0.14 0.03 -1.83 0.00 0.00 0.00 175.10 173.92 1ljz s GLU 41 N 1.75 0.05 -0.17 2.72 1.03 -0.81 -5.01 118.70 118.26 1ljz s GLU 41 Ca -0.01 0.22 -0.07 0.00 0.03 0.00 0.00 54.97 55.14 1ljz s GLU 41 Cb -0.12 -0.41 -0.04 0.00 -0.80 0.00 0.00 34.13 32.75 1ljz s GLU 41 CO -0.04 -0.22 0.05 -0.51 -1.33 0.00 0.00 175.26 173.22 1ljz s LEU 42 N 1.44 3.77 0.00 1.83 1.43 -1.26 -1.83 118.68 124.05 1ljz s LEU 42 Ca -0.04 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1ljz s LEU 42 Cb -0.13 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.15 1ljz s LEU 42 CO -0.03 0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.36 1ljz n GLY 43 N 3.37 3.81 2.67 -3.19 0.00 -1.07 -4.11 105.19 106.67 1ljz n GLY 43 Ca -0.17 -0.88 -0.22 0.00 0.00 0.00 0.00 46.02 44.75 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 5.30 0.60 -0.02 0.00 0.00 0.18 -4.81 120.51 121.75 1ljz n ALA 45 Ca -0.05 -1.71 -0.02 0.00 0.00 0.00 0.00 53.44 51.65 1ljz n ALA 45 Cb 0.49 0.75 -0.04 0.00 0.00 0.00 0.00 19.45 20.65 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 -2.06 1.93 -3.21 0.00 0.00 -1.26 -1.53 120.51 114.37 1ljz n ALA 46 Ca -0.14 -0.30 -0.16 0.00 0.00 0.00 0.00 53.44 52.84 1ljz n ALA 46 Cb 0.49 0.09 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 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 -2.16 -0.30 0.08 0.00 -4.23 -1.26 -4.92 115.64 102.85 1ljz s THR 47 Ca -0.02 -1.53 -0.34 0.00 -1.18 0.00 0.00 61.69 58.61 1ljz s THR 47 Cb 0.02 -0.67 -0.18 0.00 1.34 0.00 0.00 72.50 73.00 1ljz s THR 47 CO 0.21 -0.64 0.83 0.00 -0.54 0.00 0.00 174.62 174.47 1ljz s PRO 49 N -0.38 3.80 0.17 0.00 0.04 -1.26 -5.03 135.00 132.33 1ljz s PRO 49 Ca 0.78 0.29 -0.32 0.00 0.04 0.00 0.00 61.00 61.79 1ljz s PRO 49 Cb -1.10 -2.62 -0.11 0.00 0.04 0.00 0.00 34.50 30.71 1ljz s PRO 49 CO 0.55 0.29 1.66 -1.12 0.04 0.00 0.00 177.00 178.42 1ljz s SER 50 N -2.43 6.49 0.27 6.66 0.01 -1.26 -4.95 113.70 118.49 1ljz s SER 50 Ca 0.48 2.71 -0.09 0.00 1.31 0.00 0.00 55.95 60.36 1ljz s SER 50 Cb -0.11 -2.59 -0.07 0.00 0.21 0.00 0.00 66.02 63.46 1ljz s SER 50 CO 0.22 -0.91 0.59 -1.59 0.41 0.00 0.00 173.24 171.96 1ljz s LYS 51 N 1.47 3.78 1.12 12.44 0.00 -1.26 -5.09 119.74 132.20 1ljz s LYS 51 Ca 0.73 0.27 -0.17 0.00 0.00 0.00 0.00 55.97 56.81 1ljz s LYS 51 Cb -0.46 -2.60 0.25 0.00 0.00 0.00 0.00 37.83 35.02 1ljz s LYS 51 CO 0.32 0.24 1.14 0.15 0.00 0.00 0.00 175.35 177.20 1ljz s LYS 52 N -3.11 -0.54 0.37 1.78 1.02 -1.26 -4.84 119.74 113.16 1ljz s LYS 52 Ca 0.48 0.01 0.25 0.00 0.02 0.00 0.00 55.97 56.73 1ljz s LYS 52 Cb -0.11 -1.67 1.36 0.00 -0.52 0.00 0.00 37.83 36.89 1ljz s LYS 52 CO 0.24 -3.27 1.77 -1.35 -0.92 0.00 0.00 175.35 171.82 1ljz h PRO 53 N -2.27 0.00 0.00 -1.68 0.11 -2.02 -2.14 132.00 124.00 1ljz h PRO 53 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1ljz h PRO 53 Cb 1.30 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.36 1ljz h PRO 53 CO 0.41 0.00 -0.34 2.48 -0.21 0.00 0.00 178.00 180.34 1ljz n TYR 54 N -2.39 0.00 -5.18 0.65 0.18 -1.26 -5.04 117.16 104.13 1ljz n TYR 54 Ca -0.01 -0.76 -0.30 0.00 1.88 0.00 0.00 57.90 58.70 1ljz n TYR 54 Cb 0.05 -0.14 -0.16 0.00 -0.38 0.00 0.00 39.34 38.71 1ljz n TYR 54 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 1ljz s GLU 55 N -1.84 2.23 -0.26 -3.48 2.02 -0.81 -4.48 118.70 112.09 1ljz s GLU 55 Ca 0.25 -0.84 -0.04 0.00 0.02 0.00 0.00 54.97 54.35 1ljz s GLU 55 Cb 0.23 -1.97 0.01 0.00 0.10 0.00 0.00 34.13 32.50 1ljz s GLU 55 CO -0.02 0.41 -0.00 -2.00 0.02 0.00 0.00 175.26 173.67 1ljz s GLU 56 N -0.27 3.11 -0.55 1.61 2.12 0.11 -4.33 118.70 120.50 1ljz s GLU 56 Ca 0.01 -0.81 0.04 0.00 0.36 0.00 0.00 54.97 54.56 1ljz s GLU 56 Cb -0.12 -3.14 0.17 0.00 0.26 0.00 0.00 34.13 31.30 1ljz s GLU 56 CO 0.02 -0.35 0.40 0.54 -0.54 0.00 0.00 175.26 175.33 1ljz s VAL 57 N 1.44 1.67 -0.30 3.70 0.11 -1.21 0.10 120.40 125.90 1ljz s VAL 57 Ca 0.03 -3.41 -0.23 0.00 -2.93 0.00 0.00 61.98 55.43 1ljz s VAL 57 Cb -0.16 -2.12 -0.00 0.00 -1.53 0.00 0.00 36.38 32.57 1ljz s VAL 57 CO -0.01 -1.09 0.79 -0.89 -3.33 0.00 0.00 175.10 170.56 1ljz s THR 58 N -0.62 4.80 -0.10 5.04 2.01 -0.96 -4.75 115.64 121.05 1ljz s THR 58 Ca 0.27 1.20 -0.03 0.00 0.31 0.00 0.00 61.69 63.44 1ljz s THR 58 Cb -0.03 -4.14 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 1ljz s THR 58 CO -0.16 -0.24 0.03 0.00 -0.69 0.00 0.00 174.62 173.56 1ljz n SER 61 N -0.22 3.08 -4.20 0.00 2.88 -1.26 0.82 113.62 114.73 1ljz n SER 61 Ca -0.01 -2.95 -0.19 0.00 -1.33 0.00 0.00 58.87 54.39 1ljz n SER 61 Cb 0.65 -0.41 -0.12 0.00 -0.75 0.00 0.00 64.21 63.58 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 -3.89 1.24 0.11 2.46 -4.23 -1.26 -4.98 115.64 105.10 1ljz s THR 62 Ca 0.39 -1.39 -0.34 0.00 -1.18 0.00 0.00 61.69 59.17 1ljz s THR 62 Cb 0.37 -1.21 -0.18 0.00 1.34 0.00 0.00 72.50 72.82 1ljz s THR 62 CO -0.01 -0.21 0.93 0.47 -0.54 0.00 0.00 174.62 175.25 1ljz n ASP 63 N 1.17 -0.01 -4.44 3.99 9.92 -1.25 -1.13 116.55 124.79 1ljz n ASP 63 Ca -0.20 1.15 -0.39 0.00 -0.53 0.00 0.00 54.79 54.81 1ljz n ASP 63 Cb 0.54 -1.01 -0.08 0.00 -0.64 0.00 0.00 41.12 39.93 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 1.42 -0.78 -0.08 -1.24 4.01 -0.97 -4.82 118.16 115.70 1ljz n LYS 64 Ca 0.18 0.12 0.11 0.00 -0.51 0.00 0.00 58.31 58.21 1ljz n LYS 64 Cb 0.18 -4.32 0.36 0.00 -0.51 0.00 0.00 35.03 30.74 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 0.50 6.03 -4.89 0.00 6.94 -1.26 -4.84 115.26 117.74 1ljz n ASN 66 Ca 0.17 -3.74 -0.30 0.00 -0.02 0.00 0.00 54.58 50.69 1ljz n ASN 66 Cb 0.38 -0.81 -0.04 0.00 -2.36 0.00 0.00 39.78 36.95 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 -3.86 3.72 -0.12 -0.53 0.04 -1.26 -4.70 135.00 128.30 1ljz s PRO 67 Ca 0.47 0.20 -0.04 0.00 0.04 0.00 0.00 61.00 61.67 1ljz s PRO 67 Cb 0.33 -2.57 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 1ljz s PRO 67 CO -0.23 0.16 0.05 -3.38 0.04 0.00 0.00 177.00 173.65 1ljz s HIS 68 N -2.11 3.30 0.21 0.56 -3.43 -1.26 -4.91 115.29 107.65 1ljz s HIS 68 Ca 0.47 0.25 -0.05 0.00 -0.80 0.00 0.00 55.06 54.93 1ljz s HIS 68 Cb -0.11 -1.89 0.35 0.00 -1.43 0.00 0.00 32.58 29.50 1ljz s HIS 68 CO 0.28 0.47 1.14 -2.30 -2.00 0.00 0.00 174.74 172.33 1ljz n PRO 69 N 2.41 -0.07 -0.09 -0.38 -0.01 -1.26 0.26 135.00 135.86 1ljz n PRO 69 Ca -0.19 1.14 -0.12 0.00 -0.01 0.00 0.00 63.50 64.32 1ljz n PRO 69 Cb 0.54 -1.70 -0.04 0.00 -0.01 0.00 0.00 33.50 32.28 1ljz n PRO 69 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 175.50 175.27 1ljz h LYS 70 N 0.00 0.56 -0.23 -0.52 1.63 -2.02 -3.23 116.57 112.77 1ljz h LYS 70 Ca 0.36 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1ljz h LYS 70 Cb 0.56 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.17 1ljz h LYS 70 CO -0.75 0.79 0.00 1.04 -3.45 0.00 0.00 179.45 177.08 1ljz n GLN 71 N -4.47 2.10 0.20 1.90 1.13 -0.73 -4.51 117.38 113.00 1ljz n GLN 71 Ca -0.04 -1.95 -0.14 0.00 -1.94 0.00 0.00 57.00 52.93 1ljz n GLN 71 Cb 0.34 -1.41 -0.08 0.00 0.11 0.00 0.00 30.24 29.20 1ljz n GLN 71 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1ljz h ARG 72 N 3.79 -0.49 -0.94 -1.09 2.43 0.35 -3.12 114.38 115.31 1ljz h ARG 72 Ca 0.00 0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 1ljz h ARG 72 Cb 0.85 0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 30.44 1ljz h ARG 72 CO 0.00 -0.19 0.15 -0.35 -1.51 0.00 0.00 179.97 178.08 1ljz n PRO 73 N -5.19 1.88 0.00 0.20 -0.04 -1.26 -4.98 135.00 125.61 1ljz n PRO 73 Ca -0.10 -1.17 0.00 0.00 -0.04 0.00 0.00 63.50 62.19 1ljz n PRO 73 Cb 0.28 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 1ljz n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87