#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2asq s ILE 22 N 0.00 4.77 -0.29 -0.72 -1.09 0.16 -4.86 121.20 119.17 2asq s ILE 22 Ca 0.00 1.49 -0.17 0.00 -2.23 0.00 0.00 60.65 59.74 2asq s ILE 22 Cb 0.00 -4.18 -0.02 0.00 -1.58 0.00 0.00 42.46 36.68 2asq s ILE 22 CO 0.00 -0.19 0.48 -0.75 -1.23 0.00 0.00 174.94 173.25 2asq s LYS 23 N 3.01 3.94 0.09 2.79 2.20 -1.26 0.04 119.74 130.55 2asq s LYS 23 Ca 0.36 0.13 0.03 0.00 -0.36 0.00 0.00 55.97 56.13 2asq s LYS 23 Cb -0.14 -3.69 -0.04 0.00 -1.51 0.00 0.00 37.83 32.44 2asq s LYS 23 CO 0.10 -0.41 0.11 -0.51 -0.36 0.00 0.00 175.35 174.28 2asq s LEU 24 N 2.28 3.90 -0.28 5.43 1.43 0.40 0.28 118.68 132.12 2asq s LEU 24 Ca 0.19 0.03 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 2asq s LEU 24 Cb -0.16 -2.56 0.03 0.00 0.03 0.00 0.00 46.19 43.53 2asq s LEU 24 CO 0.10 0.16 -0.01 -0.54 0.23 0.00 0.00 176.35 176.29 2asq s LYS 25 N -2.50 2.74 -0.28 1.70 1.02 0.51 -0.33 119.74 122.60 2asq s LYS 25 Ca 0.30 -1.06 -0.14 0.00 0.02 0.00 0.00 55.97 55.09 2asq s LYS 25 Cb -0.12 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 34.02 2asq s LYS 25 CO 0.23 -0.49 0.35 0.08 -0.92 0.00 0.00 175.35 174.60 2asq s VAL 26 N 1.33 5.19 -0.27 3.17 1.01 0.37 -1.27 120.40 129.92 2asq s VAL 26 Ca -0.01 0.45 -0.11 0.00 0.00 0.00 0.00 61.98 62.31 2asq s VAL 26 Cb -0.18 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 2asq s VAL 26 CO -0.02 0.14 0.18 -0.63 0.00 0.00 0.00 175.10 174.76 2asq s ILE 27 N 2.03 5.21 0.70 2.22 -1.09 -1.07 -1.06 121.20 128.14 2asq s ILE 27 Ca 0.14 0.14 -0.06 0.00 -2.23 0.00 0.00 60.65 58.63 2asq s ILE 27 Cb -0.16 -3.48 0.07 0.00 -1.58 0.00 0.00 42.46 37.32 2asq s ILE 27 CO 0.10 0.27 1.00 -0.83 -1.23 0.00 0.00 174.94 174.25 2asq s GLY 28 N 1.69 1.72 0.49 6.18 0.00 0.20 -4.46 107.32 113.14 2asq s GLY 28 Ca 0.07 -1.05 0.28 0.00 0.00 0.00 0.00 44.72 44.02 2asq s GLY 28 CO 0.10 -0.63 1.93 -1.61 0.00 0.00 0.00 173.10 172.89 2asq h GLN 29 N -0.56 0.00 -0.57 2.90 5.75 -1.90 -2.33 115.11 118.40 2asq h GLN 29 Ca -0.43 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 2asq h GLN 29 Cb 1.31 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.86 2asq h GLN 29 CO 0.57 0.14 0.00 -0.40 -2.65 0.00 0.00 178.83 176.48 2asq n ASP 30 N -3.34 1.82 -2.76 -0.69 5.75 -1.26 -4.87 116.55 111.21 2asq n ASP 30 Ca -0.00 -2.14 -0.14 0.00 -0.01 0.00 0.00 54.79 52.50 2asq n ASP 30 Cb 0.35 -0.36 0.06 0.00 -1.03 0.00 0.00 41.12 40.14 2asq n ASP 30 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2asq n SER 31 N 0.16 -2.88 -4.50 -1.12 7.64 -0.88 -5.03 113.62 107.02 2asq n SER 31 Ca 0.08 -0.43 -0.33 0.00 1.01 0.00 0.00 58.87 59.19 2asq n SER 31 Cb 0.37 -3.84 -0.12 0.00 -1.01 0.00 0.00 64.21 59.61 2asq n SER 31 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2asq s SER 32 N -3.78 4.43 -0.49 6.43 1.04 -1.25 -4.91 113.70 115.17 2asq s SER 32 Ca 0.11 -0.14 -0.00 0.00 0.48 0.00 0.00 55.95 56.41 2asq s SER 32 Cb -0.05 -1.31 0.13 0.00 0.10 0.00 0.00 66.02 64.88 2asq s SER 32 CO 0.53 0.28 0.26 -1.83 0.98 0.00 0.00 173.24 173.46 2asq s GLU 33 N -0.34 2.08 0.02 4.02 -1.05 -1.26 -0.63 118.70 121.54 2asq s GLU 33 Ca 0.04 -2.22 -0.18 0.00 -0.15 0.00 0.00 54.97 52.47 2asq s GLU 33 Cb -0.13 -3.51 -0.06 0.00 -0.44 0.00 0.00 34.13 30.00 2asq s GLU 33 CO 0.02 -1.09 0.50 0.42 0.95 0.00 0.00 175.26 176.06 2asq s ILE 34 N 0.42 4.91 0.00 1.83 1.01 -0.22 -4.85 121.20 124.31 2asq s ILE 34 Ca 0.13 1.05 -0.16 0.00 0.00 0.00 0.00 60.65 61.67 2asq s ILE 34 Cb -0.22 -3.82 -0.06 0.00 0.01 0.00 0.00 42.46 38.37 2asq s ILE 34 CO -0.04 0.53 0.46 -1.00 0.00 0.00 0.00 174.94 174.89 2asq s HIS 35 N -0.85 3.72 -0.26 3.97 3.76 -1.26 -0.48 115.29 123.89 2asq s HIS 35 Ca 0.27 1.05 0.01 0.00 -0.15 0.00 0.00 55.06 56.24 2asq s HIS 35 Cb -0.18 -2.37 0.07 0.00 1.11 0.00 0.00 32.58 31.21 2asq s HIS 35 CO 0.16 0.57 -0.01 -0.06 -0.85 0.00 0.00 174.74 174.55 2asq s PHE 36 N -0.88 2.45 -0.78 1.40 0.40 0.55 -4.93 117.98 116.20 2asq s PHE 36 Ca 0.25 -1.92 -0.23 0.00 -0.60 0.00 0.00 56.93 54.43 2asq s PHE 36 Cb -0.17 -1.80 0.07 0.00 0.51 0.00 0.00 43.02 41.63 2asq s PHE 36 CO 0.14 -0.81 1.14 0.15 0.70 0.00 0.00 175.22 176.54 2asq s LYS 37 N 1.37 3.28 0.44 0.44 1.02 -1.26 -0.46 119.74 124.57 2asq s LYS 37 Ca -0.00 -0.90 0.08 0.00 0.02 0.00 0.00 55.97 55.17 2asq s LYS 37 Cb -0.19 -4.50 -0.01 0.00 -0.52 0.00 0.00 37.83 32.62 2asq s LYS 37 CO -0.10 -1.94 0.41 0.14 -0.92 0.00 0.00 175.35 172.94 2asq s VAL 38 N 4.35 2.55 -0.00 3.17 -7.23 0.11 -4.83 120.40 118.51 2asq s VAL 38 Ca 0.30 -1.33 0.05 0.00 -1.81 0.00 0.00 61.98 59.19 2asq s VAL 38 Cb -0.10 -2.88 -0.01 0.00 0.56 0.00 0.00 36.38 33.94 2asq s VAL 38 CO 0.05 0.00 -0.16 -0.75 -0.31 0.00 0.00 175.10 173.93 2asq s LYS 39 N -4.18 1.22 -1.14 4.82 2.20 -1.26 0.36 119.74 121.77 2asq s LYS 39 Ca 0.48 -0.61 -0.21 0.00 -0.36 0.00 0.00 55.97 55.26 2asq s LYS 39 Cb -0.03 -1.20 0.03 0.00 -1.51 0.00 0.00 37.83 35.11 2asq s LYS 39 CO 0.28 0.32 1.68 1.41 -0.36 0.00 0.00 175.35 178.68 2asq s MET 40 N -0.53 3.50 0.06 4.03 -2.45 -1.26 -3.45 119.30 119.20 2asq s MET 40 Ca 0.05 -1.38 0.00 0.00 -1.25 0.00 0.00 55.69 53.12 2asq s MET 40 Cb -0.06 -5.38 0.00 0.00 1.25 0.00 0.00 34.83 30.63 2asq s MET 40 CO -0.00 -2.57 0.00 2.41 1.05 0.00 0.00 175.02 175.91 2asq n THR 41 N 6.92 0.00 -2.77 10.11 -1.04 -1.26 -5.03 114.28 121.20 2asq n THR 41 Ca 0.41 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 62.08 2asq n THR 41 Cb 0.48 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.93 2asq n THR 41 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2asq s THR 42 N -2.00 4.27 0.79 12.58 -4.23 -1.22 -5.04 115.64 120.79 2asq s THR 42 Ca 0.00 1.52 -0.11 0.00 -1.18 0.00 0.00 61.69 61.92 2asq s THR 42 Cb 0.00 -3.68 0.07 0.00 1.34 0.00 0.00 72.50 70.23 2asq s THR 42 CO 0.00 -0.20 1.11 -1.00 -0.54 0.00 0.00 174.62 173.99 2asq s HIS 43 N -2.02 2.35 -0.78 3.99 3.76 -1.26 -4.53 115.29 116.80 2asq s HIS 43 Ca 0.60 1.61 0.17 0.00 -0.15 0.00 0.00 55.06 57.29 2asq s HIS 43 Cb -0.12 -3.15 0.74 0.00 1.11 0.00 0.00 32.58 31.17 2asq s HIS 43 CO 0.17 -2.04 1.54 1.28 -0.85 0.00 0.00 174.74 174.83 2asq n LEU 44 N -3.52 0.27 -0.11 0.89 4.77 0.52 -1.97 117.00 117.85 2asq n LEU 44 Ca 0.10 0.57 0.05 0.00 -0.03 0.00 0.00 56.01 56.70 2asq n LEU 44 Cb 0.53 -0.54 0.37 0.00 -2.33 0.00 0.00 43.42 41.45 2asq n LEU 44 CO 0.52 -0.40 1.20 0.50 -1.33 0.00 0.00 177.39 177.88 2asq h LYS 45 N 0.00 0.68 -0.65 3.23 1.63 -1.75 -1.97 116.57 117.74 2asq h LYS 45 Ca 0.00 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2asq h LYS 45 Cb 0.28 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 2asq h LYS 45 CO 0.00 0.45 0.42 -0.22 -3.45 0.00 0.00 179.45 176.65 2asq h LYS 46 N 0.70 0.87 -0.25 1.90 1.63 -1.74 -1.43 116.57 118.26 2asq h LYS 46 Ca 0.24 -0.06 -0.06 0.00 -0.85 0.00 0.00 60.65 59.92 2asq h LYS 46 Cb 0.09 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.52 2asq h LYS 46 CO -0.07 0.59 -0.10 1.25 -3.45 0.00 0.00 179.45 177.67 2asq h LEU 47 N 0.88 0.38 -0.25 5.20 6.46 -1.53 -0.68 115.31 125.77 2asq h LEU 47 Ca 0.24 -0.08 -0.21 0.00 -0.12 0.00 0.00 57.88 57.70 2asq h LEU 47 Cb -0.08 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 39.76 2asq h LEU 47 CO -0.05 0.52 -0.84 0.11 -0.62 0.00 0.00 178.44 177.57 2asq h LYS 48 N 0.37 0.51 0.10 1.25 1.57 -1.11 -3.09 116.57 116.17 2asq h LYS 48 Ca 0.07 -0.47 -0.18 0.00 -1.87 0.00 0.00 60.65 58.21 2asq h LYS 48 Cb 0.42 0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.85 2asq h LYS 48 CO 0.02 1.10 -0.84 1.05 -0.57 0.00 0.00 179.45 180.22 2asq h GLU 49 N 0.33 0.20 -0.48 3.15 4.11 -1.08 -3.25 114.58 117.56 2asq h GLU 49 Ca -0.06 -0.35 0.02 0.00 0.07 0.00 0.00 59.36 59.04 2asq h GLU 49 Cb 1.45 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.80 2asq h GLU 49 CO 0.15 1.17 0.29 0.66 0.07 0.00 0.00 179.01 181.35 2asq h SER 50 N -0.53 0.46 -0.37 3.06 4.64 -1.26 -2.28 113.55 117.28 2asq h SER 50 Ca -0.17 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.10 2asq h SER 50 Cb 1.52 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 63.50 2asq h SER 50 CO 0.07 0.33 0.04 0.22 -0.87 0.00 0.00 176.83 176.62 2asq h TYR 51 N 0.57 0.75 -0.88 4.77 3.20 -1.70 -2.07 116.97 121.61 2asq h TYR 51 Ca 0.19 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2asq h TYR 51 Cb 0.02 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.03 2asq h TYR 51 CO -0.07 0.68 0.50 0.00 -1.64 0.00 0.00 178.16 177.64 2asq h GLN 53 N 1.22 0.67 -0.50 0.00 4.20 -0.93 0.38 115.11 120.14 2asq h GLN 53 Ca 0.31 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.81 2asq h GLN 53 Cb -0.01 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 2asq h GLN 53 CO -0.05 0.65 0.04 -0.09 -0.67 0.00 0.00 178.83 178.71 2asq h ARG 54 N 0.57 0.86 0.00 1.46 2.43 -0.84 -2.75 114.38 116.11 2asq h ARG 54 Ca 0.14 -0.25 -0.07 0.00 -0.81 0.00 0.00 59.98 58.99 2asq h ARG 54 Cb 0.25 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2asq h ARG 54 CO -0.01 0.88 -0.32 1.96 -1.51 0.00 0.00 179.97 180.97 2asq h GLN 55 N 0.73 0.00 -0.18 0.20 1.08 -0.62 -3.47 115.11 112.85 2asq h GLN 55 Ca 0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2asq h GLN 55 Cb 0.46 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2asq h GLN 55 CO 0.02 0.32 0.00 0.41 -0.95 0.00 0.00 178.83 178.62 2asq n GLY 56 N -0.17 1.04 3.17 3.46 0.00 -0.03 -5.08 105.19 107.57 2asq n GLY 56 Ca -0.01 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.39 2asq n GLY 56 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2asq s VAL 57 N -2.18 0.93 0.55 1.61 -7.23 -0.29 -5.04 120.40 108.74 2asq s VAL 57 Ca 0.00 -1.56 -0.19 0.00 -1.81 0.00 0.00 61.98 58.42 2asq s VAL 57 Cb 0.00 -1.27 -0.05 0.00 0.56 0.00 0.00 36.38 35.62 2asq s VAL 57 CO 0.00 -0.51 1.15 -2.16 -0.31 0.00 0.00 175.10 173.27 2asq s PRO 58 N -2.58 3.29 0.83 4.82 0.04 -1.26 -4.17 135.00 135.97 2asq s PRO 58 Ca 0.03 1.67 -0.11 0.00 0.04 0.00 0.00 61.00 62.63 2asq s PRO 58 Cb -0.04 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.59 2asq s PRO 58 CO 0.00 -0.92 1.10 1.41 0.04 0.00 0.00 177.00 178.63 2asq s MET 59 N -3.27 1.77 0.00 4.56 1.75 -1.26 -3.32 119.30 119.53 2asq s MET 59 Ca 0.74 1.10 0.00 0.00 -1.25 0.00 0.00 55.69 56.28 2asq s MET 59 Cb -0.26 -1.85 0.00 0.00 2.84 0.00 0.00 34.83 35.57 2asq s MET 59 CO 0.29 -1.96 0.00 0.09 -0.65 0.00 0.00 175.02 172.78 2asq n ASN 60 N -3.73 0.00 0.08 1.11 4.13 -1.26 -4.78 115.26 110.81 2asq n ASN 60 Ca 0.09 0.00 -0.08 0.00 1.68 0.00 0.00 54.58 56.27 2asq n ASN 60 Cb 0.54 -0.10 -0.07 0.00 -1.54 0.00 0.00 39.78 38.61 2asq n ASN 60 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2asq h SER 61 N 0.00 0.11 -3.34 6.41 4.64 -1.69 -3.38 113.55 116.29 2asq h SER 61 Ca 0.00 -0.10 -0.64 0.00 -0.47 0.00 0.00 61.79 60.57 2asq h SER 61 Cb 0.00 -0.03 -0.21 0.00 -0.31 0.00 0.00 62.40 61.85 2asq h SER 61 CO 0.00 1.01 -0.66 -0.76 -0.87 0.00 0.00 176.83 175.54 2asq s LEU 62 N -7.02 3.29 -0.22 5.97 1.43 -1.26 0.23 118.68 121.10 2asq s LEU 62 Ca -0.01 -0.09 -0.06 0.00 -1.03 0.00 0.00 54.13 52.95 2asq s LEU 62 Cb 0.10 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 2asq s LEU 62 CO 0.82 0.20 0.02 0.00 0.23 0.00 0.00 176.35 177.63 2asq s ARG 63 N 0.15 3.62 -0.17 1.70 1.70 0.19 -4.92 118.95 121.22 2asq s ARG 63 Ca -0.01 -0.51 -0.22 0.00 -0.47 0.00 0.00 55.73 54.52 2asq s ARG 63 Cb -0.14 -3.15 -0.03 0.00 -0.57 0.00 0.00 34.95 31.07 2asq s ARG 63 CO 0.03 -0.06 0.66 -0.06 -1.08 0.00 0.00 175.30 174.78 2asq s PHE 64 N 1.22 3.43 -0.14 5.89 0.08 -1.26 -1.56 117.98 125.64 2asq s PHE 64 Ca 0.04 1.02 -0.02 0.00 0.12 0.00 0.00 56.93 58.08 2asq s PHE 64 Cb -0.15 -2.81 -0.03 0.00 -0.57 0.00 0.00 43.02 39.47 2asq s PHE 64 CO 0.02 -0.11 -0.06 -0.51 -0.10 0.00 0.00 175.22 174.46 2asq s LEU 65 N 1.65 3.16 -0.27 -0.37 1.43 0.10 -0.34 118.68 124.04 2asq s LEU 65 Ca 0.31 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 2asq s LEU 65 Cb -0.16 -1.74 0.07 0.00 0.03 0.00 0.00 46.19 44.39 2asq s LEU 65 CO 0.12 0.20 -0.01 0.12 0.23 0.00 0.00 176.35 177.01 2asq s PHE 66 N 0.16 2.68 -1.30 0.29 5.36 0.17 -0.84 117.98 124.50 2asq s PHE 66 Ca -0.03 -2.08 -0.02 0.00 -0.96 0.00 0.00 56.93 53.84 2asq s PHE 66 Cb -0.14 -1.93 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 2asq s PHE 66 CO 0.03 -0.84 0.30 0.39 -1.46 0.00 0.00 175.22 173.64 2asq n GLU 67 N 4.58 -2.90 0.00 10.12 1.02 -1.26 -2.35 120.64 129.85 2asq n GLU 67 Ca -0.07 0.75 0.00 0.00 -0.02 0.00 0.00 57.16 57.82 2asq n GLU 67 Cb 0.43 -5.19 0.00 0.00 -0.02 0.00 0.00 31.44 26.66 2asq n GLU 67 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2asq n GLY 68 N -1.23 3.32 3.77 0.62 0.00 -1.26 -5.03 105.19 105.37 2asq n GLY 68 Ca -0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 2asq n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2asq s GLN 69 N -0.66 3.33 0.50 1.61 -0.21 -0.99 -5.03 119.66 118.20 2asq s GLN 69 Ca 0.00 -0.27 -0.21 0.00 0.02 0.00 0.00 55.36 54.90 2asq s GLN 69 Cb 0.00 -3.04 -0.07 0.00 1.00 0.00 0.00 33.01 30.91 2asq s GLN 69 CO 0.00 0.68 1.13 -0.98 -2.12 0.00 0.00 175.29 174.01 2asq s ARG 70 N -0.79 3.59 -0.23 2.91 1.70 -1.26 0.42 118.95 125.29 2asq s ARG 70 Ca 0.13 1.65 -0.24 0.00 -0.47 0.00 0.00 55.73 56.79 2asq s ARG 70 Cb -0.12 -2.19 -0.01 0.00 -0.57 0.00 0.00 34.95 32.06 2asq s ARG 70 CO 0.03 -0.66 0.81 0.42 -1.08 0.00 0.00 175.30 174.82 2asq s ILE 71 N -1.70 4.86 0.52 4.99 -1.09 0.54 -4.82 121.20 124.50 2asq s ILE 71 Ca 0.68 1.55 -0.13 0.00 -2.23 0.00 0.00 60.65 60.52 2asq s ILE 71 Cb -0.25 -4.11 -0.06 0.00 -1.58 0.00 0.00 42.46 36.46 2asq s ILE 71 CO 0.29 -0.04 0.94 0.00 -1.23 0.00 0.00 174.94 174.90 2asq s ALA 72 N 2.65 3.16 0.26 9.38 0.00 -1.26 -4.82 121.76 131.13 2asq s ALA 72 Ca 0.35 -0.03 0.18 0.00 0.00 0.00 0.00 51.96 52.46 2asq s ALA 72 Cb -0.16 -2.98 0.78 0.00 0.00 0.00 0.00 23.12 20.77 2asq s ALA 72 CO 0.08 -0.32 1.79 -0.44 0.00 0.00 0.00 175.76 176.87 2asq h ASP 73 N 0.59 0.00 -0.05 0.00 3.32 -1.96 -2.45 116.42 115.87 2asq h ASP 73 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2asq h ASP 73 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2asq h ASP 73 CO 0.62 0.35 0.00 -0.46 -1.72 0.00 0.00 179.24 178.04 2asq n ASN 74 N -3.69 1.19 -4.81 6.45 6.94 -1.26 -3.79 115.26 116.29 2asq n ASN 74 Ca -0.01 -1.46 -0.36 0.00 -0.02 0.00 0.00 54.58 52.73 2asq n ASN 74 Cb 0.45 -0.02 -0.06 0.00 -2.36 0.00 0.00 39.78 37.79 2asq n ASN 74 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 2asq s HIS 75 N -1.95 3.63 0.29 -2.53 3.76 -0.92 -4.94 115.29 112.62 2asq s HIS 75 Ca 0.38 1.41 0.11 0.00 -0.15 0.00 0.00 55.06 56.81 2asq s HIS 75 Cb 0.20 -2.64 -0.05 0.00 1.11 0.00 0.00 32.58 31.19 2asq s HIS 75 CO 0.32 0.31 -0.16 0.95 -0.85 0.00 0.00 174.74 175.30 2asq s THR 76 N -1.57 2.29 -1.69 1.30 -4.23 -1.26 -0.35 115.64 110.13 2asq s THR 76 Ca 0.44 -2.32 0.09 0.00 -1.18 0.00 0.00 61.69 58.73 2asq s THR 76 Cb -0.16 -2.38 0.20 0.00 1.34 0.00 0.00 72.50 71.50 2asq s THR 76 CO 0.21 -0.36 1.08 -2.65 -0.54 0.00 0.00 174.62 172.36 2asq n PRO 77 N -0.64 0.20 0.11 3.99 -0.02 -1.26 -2.14 135.00 135.23 2asq n PRO 77 Ca -0.05 0.11 -0.17 0.00 -2.02 0.00 0.00 63.50 61.37 2asq n PRO 77 Cb 0.61 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.46 2asq n PRO 77 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2asq h LYS 78 N 0.00 0.31 0.00 -0.52 1.63 -1.95 -3.37 116.57 112.68 2asq h LYS 78 Ca 0.00 -0.51 -0.46 0.00 -0.85 0.00 0.00 60.65 58.83 2asq h LYS 78 Cb 0.04 0.19 0.07 0.00 -0.60 0.00 0.00 32.23 31.93 2asq h LYS 78 CO 0.00 1.23 0.06 -0.85 -3.45 0.00 0.00 179.45 176.45 2asq n GLU 79 N -3.57 0.09 0.00 1.90 0.28 -0.91 -4.42 120.64 114.02 2asq n GLU 79 Ca -0.09 -2.80 0.00 0.00 -0.16 0.00 0.00 57.16 54.11 2asq n GLU 79 Cb 1.02 -0.54 0.00 0.00 1.43 0.00 0.00 31.44 33.35 2asq n GLU 79 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2asq n LEU 80 N 0.00 0.00 -0.07 -1.84 4.77 -1.26 -3.31 117.00 115.29 2asq n LEU 80 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2asq n LEU 80 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2asq n LEU 80 CO 0.39 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2asq n GLY 81 N -0.08 1.27 3.71 -0.72 0.00 -1.26 -5.04 105.19 103.08 2asq n GLY 81 Ca 0.00 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 2asq n GLY 81 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2asq s MET 82 N -1.70 4.24 0.39 1.61 0.00 -1.21 -5.01 119.30 117.62 2asq s MET 82 Ca 0.00 2.28 0.00 0.00 0.00 0.00 0.00 55.69 57.97 2asq s MET 82 Cb 0.00 -3.29 -0.00 0.00 0.00 0.00 0.00 34.83 31.54 2asq s MET 82 CO 0.00 -0.60 0.02 0.39 0.00 0.00 0.00 175.02 174.83 2asq n GLU 83 N 4.37 0.97 -2.56 4.11 1.02 -1.26 -4.94 120.64 122.35 2asq n GLU 83 Ca 0.14 -2.93 -0.37 0.00 -0.02 0.00 0.00 57.16 53.98 2asq n GLU 83 Cb 0.40 0.89 -0.04 0.00 -0.02 0.00 0.00 31.44 32.66 2asq n GLU 83 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2asq s GLU 84 N -3.43 4.31 -1.72 3.49 2.56 -1.26 -3.27 118.70 119.37 2asq s GLU 84 Ca 0.02 1.55 0.00 0.00 0.00 0.00 0.00 54.97 56.55 2asq s GLU 84 Cb 0.00 -2.71 0.00 0.00 2.00 0.00 0.00 34.13 33.42 2asq s GLU 84 CO 0.02 -0.02 0.00 0.39 -0.56 0.00 0.00 175.26 175.09 2asq n GLU 85 N 0.27 -1.45 -2.59 4.30 -0.58 0.14 -4.95 120.64 115.79 2asq n GLU 85 Ca 0.03 0.99 -0.40 0.00 -0.42 0.00 0.00 57.16 57.36 2asq n GLU 85 Cb 0.49 -5.46 -0.05 0.00 -0.57 0.00 0.00 31.44 25.85 2asq n GLU 85 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2asq s ASP 86 N -2.34 7.37 -0.15 1.62 1.01 -1.20 -4.61 116.67 118.37 2asq s ASP 86 Ca 0.00 2.12 -0.20 0.00 0.71 0.00 0.00 52.55 55.18 2asq s ASP 86 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 2asq s ASP 86 CO 0.00 -0.06 0.56 -0.69 0.21 0.00 0.00 175.17 175.19 2asq s VAL 87 N -1.23 5.11 -0.01 -1.27 1.01 -1.26 -0.36 120.40 122.39 2asq s VAL 87 Ca 0.44 1.08 0.06 0.00 0.00 0.00 0.00 61.98 63.56 2asq s VAL 87 Cb -0.28 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 2asq s VAL 87 CO 0.36 0.23 -0.19 -0.51 0.00 0.00 0.00 175.10 175.00 2asq s ILE 88 N 1.16 1.47 0.22 2.22 2.07 -0.40 -4.67 121.20 123.27 2asq s ILE 88 Ca 0.28 -0.79 0.06 0.00 -1.41 0.00 0.00 60.65 58.78 2asq s ILE 88 Cb -0.16 -1.22 -0.04 0.00 0.13 0.00 0.00 42.46 41.18 2asq s ILE 88 CO 0.11 0.42 0.20 -1.61 -1.91 0.00 0.00 174.94 172.15 2asq s GLU 89 N -0.43 3.00 -0.05 3.50 2.02 -0.02 -2.61 118.70 124.10 2asq s GLU 89 Ca 0.07 -0.94 -0.02 0.00 0.02 0.00 0.00 54.97 54.10 2asq s GLU 89 Cb -0.07 -2.65 0.04 0.00 0.10 0.00 0.00 34.13 31.55 2asq s GLU 89 CO -0.01 0.44 0.09 0.54 0.02 0.00 0.00 175.26 176.34 2asq s VAL 90 N -1.97 -0.14 0.21 2.63 0.11 -1.26 0.03 120.40 120.00 2asq s VAL 90 Ca 0.32 0.37 0.06 0.00 -2.93 0.00 0.00 61.98 59.80 2asq s VAL 90 Cb -0.09 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.52 2asq s VAL 90 CO 0.25 0.15 -0.10 -0.31 -3.33 0.00 0.00 175.10 171.77 2asq s TYR 91 N 2.00 1.60 -0.01 1.54 2.02 -0.60 -4.90 117.35 119.01 2asq s TYR 91 Ca 0.02 -0.70 -0.16 0.00 -0.37 0.00 0.00 57.07 55.86 2asq s TYR 91 Cb -0.12 -0.82 -0.06 0.00 -0.40 0.00 0.00 41.96 40.56 2asq s TYR 91 CO -0.04 0.20 0.44 -1.14 -1.57 0.00 0.00 175.55 173.45 2asq s GLN 92 N -3.72 4.03 0.35 -0.62 0.74 -1.26 0.54 119.66 119.72 2asq s GLN 92 Ca 0.23 0.47 -0.27 0.00 0.05 0.00 0.00 55.36 55.84 2asq s GLN 92 Cb 0.02 -3.26 -0.09 0.00 1.10 0.00 0.00 33.01 30.78 2asq s GLN 92 CO 0.06 0.60 1.14 -1.21 -0.55 0.00 0.00 175.29 175.33 2asq s GLU 93 N -0.82 4.30 0.29 1.67 0.41 0.14 -4.88 118.70 119.81 2asq s GLU 93 Ca 0.25 1.80 0.03 0.00 -0.41 0.00 0.00 54.97 56.64 2asq s GLU 93 Cb -0.17 -2.86 0.44 0.00 -1.78 0.00 0.00 34.13 29.76 2asq s GLU 93 CO 0.14 -0.09 1.74 0.37 -0.49 0.00 0.00 175.26 176.93 2asq h GLN 94 N 3.08 0.47 -0.33 1.61 4.15 -1.97 -2.85 115.11 119.27 2asq h GLN 94 Ca -0.48 -0.17 -0.09 0.00 0.77 0.00 0.00 58.65 58.68 2asq h GLN 94 Cb 1.22 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.86 2asq h GLN 94 CO 0.64 0.67 -0.17 1.79 -1.93 0.00 0.00 178.83 179.83 2asq h THR 95 N 0.42 1.25 0.00 2.39 1.35 -1.96 -3.47 112.91 112.89 2asq h THR 95 Ca 0.06 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 64.76 2asq h THR 95 Cb 0.63 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 2asq h THR 95 CO 0.05 0.38 0.00 0.61 -0.25 0.00 0.00 175.52 176.31 2asq n GLY 96 N -0.47 2.29 1.15 5.82 0.00 -1.08 -5.17 105.19 107.75 2asq n GLY 96 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2asq n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93