#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajy n SER 31 N 0.00 -6.11 -4.37 6.12 2.88 -1.26 -5.00 113.62 105.89 1ajy n SER 31 Ca 0.00 -0.75 -0.28 0.00 -1.33 0.00 0.00 58.87 56.51 1ajy n SER 31 Cb 0.00 -4.02 -0.13 0.00 -0.75 0.00 0.00 64.21 59.31 1ajy n SER 31 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1ajy s VAL 32 N -3.30 2.15 0.18 2.46 1.01 -1.26 -5.14 120.40 116.50 1ajy s VAL 32 Ca 0.33 -1.68 -0.23 0.00 0.00 0.00 0.00 61.98 60.40 1ajy s VAL 32 Cb -0.09 -1.90 0.06 0.00 0.00 0.00 0.00 36.38 34.45 1ajy s VAL 32 CO 0.81 0.09 0.64 0.00 0.00 0.00 0.00 175.10 176.65 1ajy s ALA 33 N -1.05 -1.52 1.23 5.51 0.00 -1.26 -4.64 121.76 120.04 1ajy s ALA 33 Ca 0.12 0.32 -0.19 0.00 0.00 0.00 0.00 51.96 52.21 1ajy s ALA 33 Cb -0.10 0.86 0.30 0.00 0.00 0.00 0.00 23.12 24.18 1ajy s ALA 33 CO 0.05 -0.83 1.06 0.00 0.00 0.00 0.00 175.76 176.04 1ajy h LEU 35 N -2.72 0.60 0.54 0.00 -0.00 -1.82 0.37 115.31 112.28 1ajy h LEU 35 Ca -0.47 -0.22 -0.03 0.00 -0.00 0.00 0.00 57.88 57.16 1ajy h LEU 35 Cb 1.31 -0.16 0.01 0.00 -0.00 0.00 0.00 40.66 41.82 1ajy h LEU 35 CO 0.36 0.67 -0.26 0.77 -0.00 0.00 0.00 178.44 179.98 1ajy h SER 36 N 0.50 -0.61 -0.24 -0.43 4.64 -1.92 0.35 113.55 115.85 1ajy h SER 36 Ca 0.13 -0.02 0.05 0.00 -0.47 0.00 0.00 61.79 61.48 1ajy h SER 36 Cb 0.29 0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1ajy h SER 36 CO -0.00 -0.37 0.17 0.00 -0.87 0.00 0.00 176.83 175.76 1ajy h ARG 38 N 0.08 0.73 -0.06 0.00 2.47 0.37 0.69 114.38 118.67 1ajy h ARG 38 Ca 0.11 -0.66 -0.10 0.00 -1.26 0.00 0.00 59.98 58.07 1ajy h ARG 38 Cb 0.34 0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 1ajy h ARG 38 CO -0.01 1.26 -0.40 -0.22 0.56 0.00 0.00 179.97 181.16 1ajy h LYS 39 N 0.47 0.13 -0.23 0.04 3.11 0.88 -2.88 116.57 118.09 1ajy h LYS 39 Ca -0.08 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.71 1ajy h LYS 39 Cb 1.50 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.73 1ajy h LYS 39 CO 0.17 0.52 0.00 0.54 -2.81 0.00 0.00 179.45 177.87 1ajy n ARG 40 N -4.04 1.99 -3.40 1.90 1.74 -0.41 -5.00 116.66 109.44 1ajy n ARG 40 Ca -0.02 -1.88 -0.17 0.00 -0.77 0.00 0.00 57.85 55.01 1ajy n ARG 40 Cb 0.45 -1.38 0.03 0.00 -1.02 0.00 0.00 32.46 30.55 1ajy n ARG 40 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1ajy n HIS 41 N 1.05 -2.38 -4.08 -1.55 8.25 0.19 -4.98 115.22 111.72 1ajy n HIS 41 Ca 0.14 0.80 -0.32 0.00 -0.26 0.00 0.00 57.72 58.07 1ajy n HIS 41 Cb 0.48 -3.75 -0.07 0.00 1.12 0.00 0.00 29.99 27.78 1ajy n HIS 41 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1ajy s ILE 42 N -3.26 4.73 -1.14 1.59 1.01 0.16 -5.00 121.20 119.29 1ajy s ILE 42 Ca 0.29 -0.46 -0.22 0.00 0.00 0.00 0.00 60.65 60.26 1ajy s ILE 42 Cb -0.07 -3.19 -0.01 0.00 0.01 0.00 0.00 42.46 39.20 1ajy s ILE 42 CO 0.80 0.31 1.80 -0.54 0.00 0.00 0.00 174.94 177.31 1ajy s LYS 43 N -1.86 3.11 0.35 2.79 3.01 -1.26 -4.82 119.74 121.06 1ajy s LYS 43 Ca 0.24 -1.24 -0.29 0.00 -1.01 0.00 0.00 55.97 53.68 1ajy s LYS 43 Cb -0.12 -5.31 -0.11 0.00 -1.01 0.00 0.00 37.83 31.28 1ajy s LYS 43 CO 0.16 -3.09 1.49 0.00 0.51 0.00 0.00 175.35 174.42 1ajy h PRO 45 N 3.50 0.52 0.00 0.00 0.14 -1.92 -3.48 132.00 130.75 1ajy h PRO 45 Ca -0.50 -0.09 0.00 0.00 0.14 0.00 0.00 66.00 65.55 1ajy h PRO 45 Cb 1.23 -0.09 0.00 0.00 0.14 0.00 0.00 31.00 32.29 1ajy h PRO 45 CO 0.68 0.51 0.00 0.41 0.14 0.00 0.00 178.00 179.74 1ajy n GLY 46 N -0.76 1.83 0.00 1.56 0.00 -1.26 -5.08 105.19 101.47 1ajy n GLY 46 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1ajy n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajy n GLY 47 N 0.00 -0.44 2.68 -0.02 0.00 -1.26 -4.97 105.19 101.18 1ajy n GLY 47 Ca 0.00 -0.96 -0.21 0.00 0.00 0.00 0.00 46.02 44.85 1ajy n GLY 47 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ajy s ASN 48 N 0.00 2.16 0.82 1.61 0.02 -1.26 -2.20 114.94 116.09 1ajy s ASN 48 Ca 0.00 -0.74 -0.11 0.00 -1.02 0.00 0.00 52.86 50.99 1ajy s ASN 48 Cb 0.00 0.18 0.08 0.00 0.02 0.00 0.00 41.25 41.53 1ajy s ASN 48 CO 0.00 -0.38 1.09 -2.16 0.02 0.00 0.00 177.10 175.67 1ajy s PRO 49 N 2.26 1.89 0.00 -0.60 0.05 -1.26 -5.16 135.00 132.18 1ajy s PRO 49 Ca 0.08 1.11 0.00 0.00 0.05 0.00 0.00 61.00 62.24 1ajy s PRO 49 Cb -0.15 -1.86 0.00 0.00 0.05 0.00 0.00 34.50 32.54 1ajy s PRO 49 CO -0.26 -1.88 0.00 0.00 0.05 0.00 0.00 177.00 174.91 1ajy n GLN 51 N 0.00 0.00 0.23 0.00 -0.06 -1.26 -4.57 117.38 111.72 1ajy n GLN 51 Ca 0.00 0.00 0.15 0.00 -2.00 0.00 0.00 57.00 55.15 1ajy n GLN 51 Cb 0.00 -0.52 0.81 0.00 -4.06 0.00 0.00 30.24 26.47 1ajy n GLN 51 CO 0.00 0.00 0.00 0.87 -0.20 0.00 0.00 177.06 177.73 1ajy h LYS 52 N 0.00 0.00 0.05 3.69 1.79 -1.96 0.26 116.57 120.39 1ajy h LYS 52 Ca 0.00 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 58.10 1ajy h LYS 52 Cb 0.04 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.64 1ajy h LYS 52 CO 0.00 0.00 -2.24 0.00 -1.08 0.00 0.00 179.45 176.13 1ajy h VAL 54 N 0.03 1.20 -0.13 0.00 2.07 -1.63 0.14 116.25 117.93 1ajy h VAL 54 Ca -0.50 -0.84 -0.21 0.00 0.82 0.00 0.00 66.70 65.97 1ajy h VAL 54 Cb 1.99 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 1ajy h VAL 54 CO -0.00 0.28 -0.75 0.00 0.02 0.00 0.00 177.57 177.11 1ajy h THR 55 N 0.39 1.31 0.00 2.57 1.03 -0.66 -3.40 112.91 114.15 1ajy h THR 55 Ca 0.08 -2.02 0.00 0.00 -0.01 0.00 0.00 66.41 64.46 1ajy h THR 55 Cb 0.39 2.01 0.00 0.00 -1.07 0.00 0.00 68.15 69.47 1ajy h THR 55 CO 0.02 0.63 0.00 -1.20 -0.01 0.00 0.00 175.52 174.96 1ajy n SER 56 N -3.91 0.00 0.00 0.00 7.64 -0.91 -5.02 113.62 111.42 1ajy n SER 56 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1ajy n SER 56 Cb 0.73 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.93 1ajy n SER 56 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1ajy n ASN 57 N -0.46 0.00 -4.51 6.43 0.23 -0.05 -5.06 115.26 111.84 1ajy n ASN 57 Ca 0.00 0.00 -0.28 0.00 -0.53 0.00 0.00 54.58 53.77 1ajy n ASN 57 Cb 0.00 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 37.59 1ajy n ASN 57 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ajy s ALA 58 N 0.00 2.76 0.23 -2.53 0.00 -0.69 -5.03 121.76 116.50 1ajy s ALA 58 Ca 0.00 -1.41 -0.30 0.00 0.00 0.00 0.00 51.96 50.26 1ajy s ALA 58 Cb 0.00 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 22.37 1ajy s ALA 58 CO 0.00 0.55 1.14 0.42 0.00 0.00 0.00 175.76 177.87 1ajy s ILE 59 N -1.36 3.56 -0.29 0.00 -1.09 -1.26 -4.22 121.20 116.54 1ajy s ILE 59 Ca 0.20 1.42 -0.05 0.00 -2.23 0.00 0.00 60.65 60.00 1ajy s ILE 59 Cb -0.10 -3.91 0.02 0.00 -1.58 0.00 0.00 42.46 36.89 1ajy s ILE 59 CO 0.12 0.28 0.04 0.00 -1.23 0.00 0.00 174.94 174.15 1ajy s GLU 61 N 1.44 0.82 -0.02 0.00 2.02 -1.26 -4.76 118.70 116.93 1ajy s GLU 61 Ca 0.01 0.03 0.05 0.00 0.02 0.00 0.00 54.97 55.09 1ajy s GLU 61 Cb -0.17 0.38 0.12 0.00 0.10 0.00 0.00 34.13 34.55 1ajy s GLU 61 CO 0.01 -0.24 1.09 0.66 0.02 0.00 0.00 175.26 176.80 1ajy n TYR 62 N 1.20 0.13 -4.49 1.61 4.01 -1.26 -3.38 117.16 114.98 1ajy n TYR 62 Ca -0.20 -0.57 -0.23 0.00 -0.16 0.00 0.00 57.90 56.73 1ajy n TYR 62 Cb 0.56 -0.07 -0.10 0.00 -0.31 0.00 0.00 39.34 39.43 1ajy n TYR 62 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1ajy s LEU 63 N -1.28 2.22 -0.27 7.72 1.43 -1.26 -5.06 118.68 122.18 1ajy s LEU 63 Ca 0.10 -1.44 -0.32 0.00 -1.03 0.00 0.00 54.13 51.44 1ajy s LEU 63 Cb 0.07 -0.40 -0.09 0.00 0.03 0.00 0.00 46.19 45.80 1ajy s LEU 63 CO 0.04 -0.66 2.19 -0.62 0.23 0.00 0.00 176.35 177.53 1ajy n GLU 64 N -0.78 1.54 -1.73 1.70 1.02 -1.26 -4.79 120.64 116.34 1ajy n GLU 64 Ca -0.04 0.43 -0.18 0.00 -0.02 0.00 0.00 57.16 57.35 1ajy n GLU 64 Cb 0.66 -2.81 -0.10 0.00 -0.02 0.00 0.00 31.44 29.17 1ajy n GLU 64 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1ajy s PRO 65 N 6.14 1.50 1.34 3.49 0.05 -1.26 -4.80 135.00 141.47 1ajy s PRO 65 Ca 1.05 -0.62 0.00 0.00 0.05 0.00 0.00 61.00 61.47 1ajy s PRO 65 Cb -0.62 -5.05 0.00 0.00 0.05 0.00 0.00 34.50 28.88 1ajy s PRO 65 CO 0.43 -5.14 0.00 0.45 0.05 0.00 0.00 177.00 172.79 1ajy n SER 66 N 18.38 -3.17 -4.54 6.66 2.88 -1.26 -4.07 113.62 128.49 1ajy n SER 66 Ca 0.42 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.60 1ajy n SER 66 Cb 0.47 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.87 1ajy n SER 66 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1ajy n LYS 67 N -0.92 0.79 -3.24 -1.46 5.02 -1.26 -4.84 118.16 112.27 1ajy n LYS 67 Ca 0.00 -0.04 -0.02 0.00 -2.02 0.00 0.00 58.31 56.23 1ajy n LYS 67 Cb 0.00 -3.03 -0.04 0.00 -0.02 0.00 0.00 35.03 31.94 1ajy n LYS 67 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1ajy s LYS 68 N 8.46 0.48 0.44 1.97 2.20 -1.26 -5.15 119.74 126.87 1ajy s LYS 68 Ca 1.06 0.62 -0.21 0.00 -0.36 0.00 0.00 55.97 57.09 1ajy s LYS 68 Cb -0.40 0.05 -0.11 0.00 -1.51 0.00 0.00 37.83 35.85 1ajy s LYS 68 CO 0.31 -0.79 0.95 -1.50 -0.36 0.00 0.00 175.35 173.96 1ajy s ILE 69 N 2.71 4.39 -0.28 5.43 1.10 -1.26 -4.85 121.20 128.44 1ajy s ILE 69 Ca 0.14 1.47 0.01 0.00 -0.51 0.00 0.00 60.65 61.76 1ajy s ILE 69 Cb -0.14 -3.61 0.16 0.00 0.15 0.00 0.00 42.46 39.02 1ajy s ILE 69 CO -0.22 -0.34 0.40 -0.69 -2.11 0.00 0.00 174.94 171.97 1ajy s VAL 70 N -2.21 -0.62 0.00 4.00 1.01 -1.26 -5.06 120.40 116.27 1ajy s VAL 70 Ca 0.62 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.31 1ajy s VAL 70 Cb -0.09 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.32 1ajy s VAL 70 CO 0.14 -0.28 0.00 0.52 0.00 0.00 0.00 175.10 175.48 1ajy n VAL 71 N 5.35 0.00 -3.67 2.92 0.31 -1.26 -5.15 118.33 116.83 1ajy n VAL 71 Ca -0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1ajy n VAL 71 Cb 0.49 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.33 1ajy n VAL 71 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ajy s SER 72 N 1.69 -0.70 0.34 4.52 0.15 -1.26 -5.03 113.70 113.41 1ajy s SER 72 Ca 0.00 1.19 0.06 0.00 0.70 0.00 0.00 55.95 57.90 1ajy s SER 72 Cb 0.00 1.18 0.60 0.00 -1.71 0.00 0.00 66.02 66.09 1ajy s SER 72 CO 0.00 -0.22 1.83 0.00 1.20 0.00 0.00 173.24 176.05 1ajy h THR 73 N 5.44 1.22 -0.11 6.45 1.03 -2.01 -2.81 112.91 122.13 1ajy h THR 73 Ca -0.31 -1.01 0.04 0.00 -0.01 0.00 0.00 66.41 65.12 1ajy h THR 73 Cb 1.19 1.26 -0.06 0.00 -1.07 0.00 0.00 68.15 69.47 1ajy h THR 73 CO 0.21 0.32 -0.24 0.50 -0.01 0.00 0.00 175.52 176.30 1ajy h LYS 74 N 0.33 -0.30 -0.21 0.00 3.11 -1.99 0.17 116.57 117.67 1ajy h LYS 74 Ca 0.06 0.02 0.04 0.00 -2.81 0.00 0.00 60.65 57.96 1ajy h LYS 74 Cb 0.50 0.07 -0.04 0.00 -1.00 0.00 0.00 32.23 31.76 1ajy h LYS 74 CO 0.03 -0.20 -0.02 -0.92 -2.81 0.00 0.00 179.45 175.52 1ajy h TYR 75 N -0.32 -0.06 -0.90 1.91 3.20 -1.95 -1.21 116.97 117.65 1ajy h TYR 75 Ca 0.10 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.15 1ajy h TYR 75 Cb 0.46 0.06 -0.10 0.00 1.54 0.00 0.00 36.73 38.68 1ajy h TYR 75 CO -0.33 -0.06 0.48 -0.07 -1.64 0.00 0.00 178.16 176.53 1ajy h LEU 76 N 0.03 0.57 -0.09 2.82 -0.00 -1.02 0.50 115.31 118.12 1ajy h LEU 76 Ca 0.10 0.10 -0.01 0.00 -0.00 0.00 0.00 57.88 58.07 1ajy h LEU 76 Cb 0.14 0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 40.81 1ajy h LEU 76 CO -0.19 0.20 0.01 1.56 -0.00 0.00 0.00 178.44 180.02 1ajy h GLN 77 N 0.63 0.15 0.00 1.13 7.50 0.40 -1.77 115.11 123.16 1ajy h GLN 77 Ca 0.51 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.61 1ajy h GLN 77 Cb 0.78 -0.02 -0.00 0.00 0.05 0.00 0.00 27.48 28.29 1ajy h GLN 77 CO -0.39 0.39 -0.03 0.37 -1.50 0.00 0.00 178.83 177.66 1ajy h GLN 78 N -0.10 0.00 0.15 1.46 -0.00 -0.21 -0.90 115.11 115.51 1ajy h GLN 78 Ca 0.03 0.00 -0.30 0.00 -0.00 0.00 0.00 58.65 58.38 1ajy h GLN 78 Cb 0.31 0.00 0.02 0.00 0.00 0.00 0.00 27.48 27.82 1ajy h GLN 78 CO 0.00 0.03 -1.29 1.25 0.00 0.00 0.00 178.83 178.83 1ajy h LEU 79 N 0.00 0.72 -0.18 -2.39 7.12 -0.44 -0.92 115.31 119.22 1ajy h LEU 79 Ca -0.00 -0.71 -0.22 0.00 0.13 0.00 0.00 57.88 57.08 1ajy h LEU 79 Cb 0.15 -0.23 -0.00 0.00 -0.53 0.00 0.00 40.66 40.05 1ajy h LEU 79 CO 0.00 1.54 -0.94 1.56 -0.13 0.00 0.00 178.44 180.47 1ajy h GLN 80 N 0.18 0.36 -0.00 1.25 7.50 -0.66 -2.77 115.11 120.97 1ajy h GLN 80 Ca -0.18 -0.39 -0.17 0.00 0.50 0.00 0.00 58.65 58.40 1ajy h GLN 80 Cb 1.97 0.11 0.01 0.00 0.05 0.00 0.00 27.48 29.63 1ajy h GLN 80 CO 0.23 1.08 -0.66 0.87 -1.50 0.00 0.00 178.83 178.85 1ajy h LYS 81 N 0.20 0.45 -0.78 1.46 1.57 -1.27 -2.78 116.57 115.43 1ajy h LYS 81 Ca -0.07 -0.49 0.12 0.00 -1.87 0.00 0.00 60.65 58.34 1ajy h LYS 81 Cb 1.58 0.14 -0.08 0.00 0.08 0.00 0.00 32.23 33.94 1ajy h LYS 81 CO 0.16 1.14 0.39 0.22 -0.57 0.00 0.00 179.45 180.78 1ajy h ASP 82 N -0.03 0.49 -0.75 0.86 3.58 -1.22 0.16 116.42 119.50 1ajy h ASP 82 Ca -0.08 0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.45 1ajy h ASP 82 Cb 1.37 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 42.37 1ajy h ASP 82 CO 0.13 0.25 0.50 0.25 -2.88 0.00 0.00 179.24 177.48 1ajy h LEU 83 N 0.62 0.85 -1.15 2.28 6.46 -1.48 -1.30 115.31 121.59 1ajy h LEU 83 Ca 0.40 -0.02 -0.06 0.00 -0.12 0.00 0.00 57.88 58.08 1ajy h LEU 83 Cb 0.49 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 1ajy h LEU 83 CO -0.31 0.61 -0.08 -1.13 -0.62 0.00 0.00 178.44 176.91 1ajy h ASN 84 N 1.01 0.48 0.47 1.25 -0.73 -0.54 -0.84 115.58 116.67 1ajy h ASN 84 Ca 0.28 -0.11 -0.00 0.00 1.87 0.00 0.00 56.30 58.34 1ajy h ASN 84 Cb -0.09 -0.13 -0.00 0.00 0.27 0.00 0.00 38.32 38.37 1ajy h ASN 84 CO -0.07 0.60 -0.00 -0.78 -0.37 0.00 0.00 177.43 176.81 1ajy h ASP 85 N 0.47 0.00 0.99 1.15 1.82 0.34 0.22 116.42 121.41 1ajy h ASP 85 Ca 0.09 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 56.52 1ajy h ASP 85 Cb 0.43 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.41 1ajy h ASP 85 CO 0.02 0.00 -1.00 0.11 -1.61 0.00 0.00 179.24 176.76 1ajy h LYS 86 N 0.00 0.00 0.00 0.28 1.79 -0.69 -1.27 116.57 116.68 1ajy h LYS 86 Ca -0.00 -0.01 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 1ajy h LYS 86 Cb 0.24 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.90 1ajy h LYS 86 CO 0.00 1.00 -0.61 1.15 -1.08 0.00 0.00 179.45 179.91 1ajy h THR 87 N 0.00 1.43 -0.33 -0.16 2.02 -0.70 0.17 112.91 115.35 1ajy h THR 87 Ca -0.01 -2.10 -0.04 0.00 0.77 0.00 0.00 66.41 65.03 1ajy h THR 87 Cb 1.77 2.62 -0.02 0.00 -1.74 0.00 0.00 68.15 70.78 1ajy h THR 87 CO 0.13 0.61 0.04 -0.33 0.37 0.00 0.00 175.52 176.34 1ajy h GLU 88 N -0.11 0.48 0.01 6.66 4.39 -0.71 -0.67 114.58 124.64 1ajy h GLU 88 Ca -0.08 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 1ajy h GLU 88 Cb 1.33 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1ajy h GLU 88 CO 0.12 0.48 -0.01 0.93 -1.16 0.00 0.00 179.01 179.38 1ajy h GLU 89 N 0.47 -0.01 -0.44 2.33 5.08 -1.16 -1.56 114.58 119.29 1ajy h GLU 89 Ca 0.11 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.60 1ajy h GLU 89 Cb 0.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1ajy h GLU 89 CO 0.00 0.48 0.41 -0.91 -1.00 0.00 0.00 179.01 177.99 1ajy h ASN 90 N -0.52 0.00 0.40 1.42 2.35 -0.51 0.61 115.58 119.33 1ajy h ASN 90 Ca -0.00 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.50 1ajy h ASN 90 Cb 0.50 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.88 1ajy h ASN 90 CO 0.00 0.00 -1.05 0.78 -1.65 0.00 0.00 177.43 175.51 1ajy h ASN 91 N 0.00 0.54 0.00 5.81 2.35 -0.73 -2.81 115.58 120.74 1ajy h ASN 91 Ca 0.21 -0.47 -0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1ajy h ASN 91 Cb 1.02 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 39.22 1ajy h ASN 91 CO -0.00 1.30 -0.05 -0.09 -1.65 0.00 0.00 177.43 176.93 1ajy h ARG 92 N 0.19 0.00 -1.19 0.81 2.43 0.75 -2.93 114.38 114.45 1ajy h ARG 92 Ca -0.11 0.00 0.34 0.00 -0.81 0.00 0.00 59.98 59.41 1ajy h ARG 92 Cb 1.72 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 31.18 1ajy h ARG 92 CO 0.18 0.01 0.80 1.25 -1.51 0.00 0.00 179.97 180.71 1ajy h LEU 93 N -1.00 0.24 -0.35 3.80 6.46 -0.19 1.11 115.31 125.38 1ajy h LEU 93 Ca -0.00 0.06 -0.18 0.00 -0.12 0.00 0.00 57.88 57.65 1ajy h LEU 93 Cb 0.06 0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.02 1ajy h LEU 93 CO -0.00 0.00 -0.50 0.50 -0.62 0.00 0.00 178.44 177.82 1ajy h LYS 94 N 0.19 0.87 -0.64 1.25 3.64 -1.59 -2.91 116.57 117.39 1ajy h LYS 94 Ca 0.65 -0.52 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1ajy h LYS 94 Cb 2.08 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.95 1ajy h LYS 94 CO -0.21 1.16 0.00 0.00 -2.27 0.00 0.00 179.45 178.13 1ajy n ALA 95 N -2.56 3.37 -0.03 5.00 0.00 0.31 -2.83 120.51 123.76 1ajy n ALA 95 Ca -0.04 -1.61 -0.01 0.00 0.00 0.00 0.00 53.44 51.79 1ajy n ALA 95 Cb 0.60 -1.07 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 1ajy n ALA 95 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ajy n LEU 96 N 0.87 0.00 0.00 0.00 0.00 0.29 -4.71 117.00 113.45 1ajy n LEU 96 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.26 1ajy n LEU 96 Cb 0.97 0.15 0.00 0.00 0.00 0.00 0.00 43.42 44.54 1ajy n LEU 96 CO 0.26 0.15 -0.22 0.00 0.00 0.00 0.00 177.39 177.59 1ajy n LEU 97 N -2.18 0.00 0.01 -1.96 -0.00 -1.11 -4.51 117.00 107.24 1ajy n LEU 97 Ca -0.11 -0.23 0.02 0.00 -0.00 0.00 0.00 56.01 55.69 1ajy n LEU 97 Cb 0.62 0.00 0.36 0.00 -0.00 0.00 0.00 43.42 44.40 1ajy n LEU 97 CO 0.21 0.00 1.03 0.25 -0.00 0.00 0.00 177.39 178.87 1ajy h LEU 98 N 0.00 0.46 0.04 1.47 6.46 -1.72 -2.56 115.31 119.46 1ajy h LEU 98 Ca 0.00 -0.06 -0.26 0.00 -0.12 0.00 0.00 57.88 57.45 1ajy h LEU 98 Cb 0.00 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 39.79 1ajy h LEU 98 CO 0.00 0.46 -1.31 -0.08 -0.62 0.00 0.00 178.44 176.89 1ajy h GLU 99 N 0.50 0.09 -0.02 1.25 4.81 -1.83 -3.52 114.58 115.87 1ajy h GLU 99 Ca 0.12 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1ajy h GLU 99 Cb 0.17 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1ajy h GLU 99 CO -0.01 0.94 0.00 -2.13 -0.73 0.00 0.00 179.01 177.09