#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 5.26 -0.00 -0.72 -1.09 0.11 -4.90 121.20 119.86 2asq s ILE 22 Ca 0.00 0.64 -0.01 0.00 -2.23 0.00 0.00 60.65 59.04 2asq s ILE 22 Cb 0.00 -3.66 -0.04 0.00 -1.58 0.00 0.00 42.46 37.18 2asq s ILE 22 CO 0.00 0.41 0.13 -0.54 -1.23 0.00 0.00 174.94 173.70 2asq s LYS 23 N 0.27 3.22 -0.06 2.79 3.01 -1.24 -0.63 119.74 127.09 2asq s LYS 23 Ca 0.19 -0.42 0.02 0.00 -1.01 0.00 0.00 55.97 54.74 2asq s LYS 23 Cb -0.14 -2.96 0.02 0.00 -1.01 0.00 0.00 37.83 33.74 2asq s LYS 23 CO 0.06 0.66 -0.09 -0.51 0.51 0.00 0.00 175.35 175.98 2asq s LEU 24 N -1.84 1.47 -0.43 3.17 1.43 -0.89 -0.54 118.68 121.05 2asq s LEU 24 Ca 0.25 -0.23 -0.19 0.00 -1.03 0.00 0.00 54.13 52.92 2asq s LEU 24 Cb -0.12 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.44 2asq s LEU 24 CO 0.16 -0.02 0.56 -0.54 0.23 0.00 0.00 176.35 176.75 2asq s LYS 25 N 0.86 3.20 -0.18 1.70 1.02 0.17 -1.18 119.74 125.34 2asq s LYS 25 Ca -0.11 -0.53 -0.24 0.00 0.02 0.00 0.00 55.97 55.10 2asq s LYS 25 Cb -0.15 -3.96 -0.02 0.00 -0.52 0.00 0.00 37.83 33.18 2asq s LYS 25 CO 0.01 -0.95 0.78 0.08 -0.92 0.00 0.00 175.35 174.35 2asq s VAL 26 N 2.55 4.91 -0.27 3.17 1.01 0.20 -0.48 120.40 131.49 2asq s VAL 26 Ca 0.18 1.52 -0.05 0.00 0.00 0.00 0.00 61.98 63.63 2asq s VAL 26 Cb -0.15 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2asq s VAL 26 CO 0.17 0.03 0.03 -0.63 0.00 0.00 0.00 175.10 174.70 2asq s ILE 27 N 2.17 3.71 0.78 2.22 -1.09 0.12 -1.92 121.20 127.19 2asq s ILE 27 Ca 0.36 -0.63 -0.03 0.00 -2.23 0.00 0.00 60.65 58.12 2asq s ILE 27 Cb -0.16 -2.84 0.16 0.00 -1.58 0.00 0.00 42.46 38.04 2asq s ILE 27 CO 0.11 0.21 1.07 0.61 -1.23 0.00 0.00 174.94 175.71 2asq n GLY 28 N 4.83 0.33 0.22 6.18 0.00 -1.24 -1.45 105.19 114.05 2asq n GLY 28 Ca -0.16 -1.99 0.06 0.00 0.00 0.00 0.00 46.02 43.94 2asq n GLY 28 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2asq h GLN 29 N 0.00 0.00 -0.46 1.61 5.75 -1.96 -1.29 115.11 118.76 2asq h GLN 29 Ca -0.35 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.15 2asq h GLN 29 Cb 1.24 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.79 2asq h GLN 29 CO 0.36 0.25 0.00 -0.40 -2.65 0.00 0.00 178.83 176.38 2asq n ASP 30 N -4.02 1.69 -3.46 -0.69 5.75 -1.26 -4.87 116.55 109.68 2asq n ASP 30 Ca -0.02 -2.10 -0.18 0.00 -0.01 0.00 0.00 54.79 52.48 2asq n ASP 30 Cb 0.32 -0.30 0.09 0.00 -1.03 0.00 0.00 41.12 40.20 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 0.19 -2.61 -4.92 -1.12 7.64 -0.49 -5.00 113.62 107.31 2asq n SER 31 Ca 0.08 -0.62 -0.27 0.00 1.01 0.00 0.00 58.87 59.08 2asq n SER 31 Cb 0.32 -5.08 0.04 0.00 -1.01 0.00 0.00 64.21 58.49 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 -4.22 5.34 -0.32 6.43 1.04 -1.25 -4.86 113.70 115.85 2asq s SER 32 Ca 0.08 0.66 -0.02 0.00 0.48 0.00 0.00 55.95 57.15 2asq s SER 32 Cb -0.04 -1.53 0.11 0.00 0.10 0.00 0.00 66.02 64.67 2asq s SER 32 CO 0.73 -1.25 0.15 -0.70 0.98 0.00 0.00 173.24 173.15 2asq s GLU 33 N -5.10 0.46 -0.14 4.02 2.12 -1.25 -3.65 118.70 115.16 2asq s GLU 33 Ca 0.56 -0.93 0.01 0.00 0.36 0.00 0.00 54.97 54.97 2asq s GLU 33 Cb -0.11 -1.45 -0.01 0.00 0.26 0.00 0.00 34.13 32.83 2asq s GLU 33 CO 0.45 -1.07 -0.16 0.42 -0.54 0.00 0.00 175.26 174.37 2asq s ILE 34 N 1.65 2.69 0.58 -3.70 -1.09 -0.81 -4.94 121.20 115.57 2asq s ILE 34 Ca 0.12 -0.78 -0.03 0.00 -2.23 0.00 0.00 60.65 57.73 2asq s ILE 34 Cb -0.18 -2.12 0.02 0.00 -1.58 0.00 0.00 42.46 38.60 2asq s ILE 34 CO -0.23 0.53 0.85 -2.28 -1.23 0.00 0.00 174.94 172.57 2asq s HIS 35 N 0.59 3.11 -0.06 3.97 2.46 -1.26 0.59 115.29 124.68 2asq s HIS 35 Ca -0.09 0.40 -0.03 0.00 0.47 0.00 0.00 55.06 55.81 2asq s HIS 35 Cb -0.16 -2.74 0.04 0.00 -0.13 0.00 0.00 32.58 29.58 2asq s HIS 35 CO 0.03 -0.85 0.14 -0.06 -2.47 0.00 0.00 174.74 171.53 2asq s PHE 36 N -2.91 -0.15 -0.69 3.88 0.08 -0.32 -4.88 117.98 112.99 2asq s PHE 36 Ca 0.55 0.45 -0.15 0.00 0.12 0.00 0.00 56.93 57.89 2asq s PHE 36 Cb -0.10 -0.08 0.17 0.00 -0.57 0.00 0.00 43.02 42.44 2asq s PHE 36 CO 0.42 -0.15 0.66 0.15 -0.10 0.00 0.00 175.22 176.20 2asq s LYS 37 N 1.05 3.29 0.43 0.44 1.02 -1.26 -2.08 119.74 122.63 2asq s LYS 37 Ca -0.08 -2.01 0.06 0.00 0.02 0.00 0.00 55.97 53.96 2asq s LYS 37 Cb -0.10 -4.38 -0.06 0.00 -0.52 0.00 0.00 37.83 32.77 2asq s LYS 37 CO -0.05 -1.35 0.09 0.14 -0.92 0.00 0.00 175.35 173.26 2asq s VAL 38 N 1.11 1.97 0.07 3.17 -7.23 0.20 -4.93 120.40 114.76 2asq s VAL 38 Ca 0.12 -1.87 0.07 0.00 -1.81 0.00 0.00 61.98 58.48 2asq s VAL 38 Cb -0.20 -2.84 -0.03 0.00 0.56 0.00 0.00 36.38 33.87 2asq s VAL 38 CO -0.02 0.00 -0.18 -1.59 -0.31 0.00 0.00 175.10 173.00 2asq s LYS 39 N -3.83 1.04 -1.11 4.82 -2.85 -1.26 0.06 119.74 116.61 2asq s LYS 39 Ca 0.33 -0.99 -0.19 0.00 -1.00 0.00 0.00 55.97 54.12 2asq s LYS 39 Cb 0.06 -1.15 0.10 0.00 -2.06 0.00 0.00 37.83 34.77 2asq s LYS 39 CO 0.18 0.27 1.46 -1.64 0.10 0.00 0.00 175.35 175.72 2asq s MET 40 N -1.59 3.80 0.00 1.78 -1.94 -1.26 -3.69 119.30 116.40 2asq s MET 40 Ca 0.03 -1.79 0.00 0.00 -1.71 0.00 0.00 55.69 52.22 2asq s MET 40 Cb -0.09 -5.26 0.00 0.00 2.01 0.00 0.00 34.83 31.49 2asq s MET 40 CO 0.03 -2.04 0.00 2.41 -0.01 0.00 0.00 175.02 175.41 2asq n THR 41 N 6.01 0.00 -2.62 2.05 -1.04 -1.26 -5.03 114.28 112.38 2asq n THR 41 Ca 0.36 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 62.02 2asq n THR 41 Cb 0.48 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.94 2asq n THR 41 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2asq s THR 42 N -1.69 3.92 0.70 12.58 2.01 -1.24 -5.03 115.64 126.90 2asq s THR 42 Ca 0.00 1.33 -0.14 0.00 0.31 0.00 0.00 61.69 63.18 2asq s THR 42 Cb 0.00 -3.61 0.03 0.00 0.01 0.00 0.00 72.50 68.92 2asq s THR 42 CO 0.00 -0.13 1.14 -1.00 -0.69 0.00 0.00 174.62 173.94 2asq s HIS 43 N -1.87 2.36 -1.00 4.92 3.76 -1.26 -4.59 115.29 117.60 2asq s HIS 43 Ca 0.61 1.58 0.14 0.00 -0.15 0.00 0.00 55.06 57.24 2asq s HIS 43 Cb -0.17 -3.28 0.59 0.00 1.11 0.00 0.00 32.58 30.83 2asq s HIS 43 CO 0.22 -2.08 1.44 1.28 -0.85 0.00 0.00 174.74 174.75 2asq n LEU 44 N -2.69 0.00 -0.33 0.89 4.77 -0.04 -2.14 117.00 117.46 2asq n LEU 44 Ca 0.11 0.50 -0.04 0.00 -0.03 0.00 0.00 56.01 56.55 2asq n LEU 44 Cb 0.51 -0.50 0.09 0.00 -2.33 0.00 0.00 43.42 41.19 2asq n LEU 44 CO 0.48 -0.26 1.18 0.50 -1.33 0.00 0.00 177.39 177.95 2asq h LYS 45 N 0.00 1.24 -0.83 3.23 3.64 -1.75 -2.09 116.57 120.01 2asq h LYS 45 Ca 0.00 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.20 2asq h LYS 45 Cb 0.24 -0.25 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 2asq h LYS 45 CO 0.00 0.90 0.38 -0.22 -2.27 0.00 0.00 179.45 178.25 2asq h LYS 46 N 1.25 1.21 -0.61 1.90 1.63 -1.78 -0.93 116.57 119.25 2asq h LYS 46 Ca 0.31 -0.19 0.04 0.00 -0.85 0.00 0.00 60.65 59.96 2asq h LYS 46 Cb 0.02 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.39 2asq h LYS 46 CO -0.05 0.94 0.36 1.25 -3.45 0.00 0.00 179.45 178.50 2asq h LEU 47 N 1.20 0.57 0.26 5.20 7.12 -1.52 0.18 115.31 128.32 2asq h LEU 47 Ca 0.28 0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.29 2asq h LEU 47 Cb 0.15 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 40.17 2asq h LEU 47 CO -0.03 0.39 -0.13 0.11 -0.13 0.00 0.00 178.44 178.65 2asq h LYS 48 N 0.70 -0.34 -0.62 1.25 1.57 -0.96 -2.74 116.57 115.43 2asq h LYS 48 Ca 0.25 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 59.03 2asq h LYS 48 Cb 0.07 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2asq h LYS 48 CO -0.12 0.02 0.28 1.05 -0.57 0.00 0.00 179.45 180.11 2asq h GLU 49 N -0.79 0.91 -0.30 3.15 4.11 -1.12 -1.49 114.58 119.05 2asq h GLU 49 Ca -0.04 -0.14 -0.07 0.00 0.07 0.00 0.00 59.36 59.18 2asq h GLU 49 Cb 0.51 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2asq h GLU 49 CO 0.06 0.74 -0.13 0.77 0.07 0.00 0.00 179.01 180.52 2asq h SER 50 N 0.86 0.49 -0.30 3.06 0.02 -1.05 -1.11 113.55 115.52 2asq h SER 50 Ca 0.21 -0.13 -0.17 0.00 -0.84 0.00 0.00 61.79 60.87 2asq h SER 50 Cb 0.15 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 2asq h SER 50 CO -0.02 0.65 -0.47 0.22 -1.14 0.00 0.00 176.83 176.07 2asq h TYR 51 N 0.46 1.05 -0.48 3.45 3.20 -1.19 -2.67 116.97 120.79 2asq h TYR 51 Ca 0.09 -0.36 -0.02 0.00 3.14 0.00 0.00 58.73 61.58 2asq h TYR 51 Cb 0.50 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 2asq h TYR 51 CO 0.02 1.17 0.23 0.00 -1.64 0.00 0.00 178.16 177.94 2asq h GLN 53 N 0.67 0.97 0.01 0.00 4.20 -1.00 0.15 115.11 120.10 2asq h GLN 53 Ca 0.17 -0.19 -0.25 0.00 0.06 0.00 0.00 58.65 58.44 2asq h GLN 53 Cb 0.07 -0.15 0.02 0.00 0.30 0.00 0.00 27.48 27.71 2asq h GLN 53 CO -0.02 0.83 -1.02 -0.09 -0.67 0.00 0.00 178.83 177.85 2asq h ARG 54 N 0.94 0.59 0.00 1.46 2.43 -0.95 -3.11 114.38 115.75 2asq h ARG 54 Ca 0.21 -0.65 -0.03 0.00 -0.81 0.00 0.00 59.98 58.70 2asq h ARG 54 Cb 0.25 0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 2asq h ARG 54 CO -0.01 1.25 -0.13 1.96 -1.51 0.00 0.00 179.97 181.53 2asq h GLN 55 N 0.33 0.00 0.00 0.20 1.08 -0.59 -3.46 115.11 112.67 2asq h GLN 55 Ca -0.12 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 2asq h GLN 55 Cb 1.67 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.10 2asq h GLN 55 CO 0.19 0.13 0.00 0.41 -0.95 0.00 0.00 178.83 178.62 2asq n GLY 56 N -0.07 0.59 3.48 3.46 0.00 0.40 -5.07 105.19 107.99 2asq n GLY 56 Ca -0.00 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.00 2.70 1.09 1.61 -7.23 -0.41 -5.03 120.40 111.12 2asq s VAL 57 Ca 0.00 -1.79 -0.16 0.00 -1.81 0.00 0.00 61.98 58.22 2asq s VAL 57 Cb 0.00 -2.29 0.23 0.00 0.56 0.00 0.00 36.38 34.88 2asq s VAL 57 CO 0.00 -0.06 1.12 -2.16 -0.31 0.00 0.00 175.10 173.69 2asq s PRO 58 N -2.57 -0.30 0.47 4.82 0.04 -1.26 -4.34 135.00 131.85 2asq s PRO 58 Ca 0.21 0.17 -0.21 0.00 0.04 0.00 0.00 61.00 61.20 2asq s PRO 58 Cb -0.09 -1.68 -0.08 0.00 0.04 0.00 0.00 34.50 32.68 2asq s PRO 58 CO 0.11 -3.15 1.05 1.41 0.04 0.00 0.00 177.00 176.47 2asq s MET 59 N -5.24 3.86 -0.74 4.56 1.75 -1.26 -3.36 119.30 118.86 2asq s MET 59 Ca 0.68 1.42 0.00 0.00 -1.25 0.00 0.00 55.69 56.55 2asq s MET 59 Cb -0.13 -2.20 0.00 0.00 2.84 0.00 0.00 34.83 35.33 2asq s MET 59 CO 0.56 -0.39 0.00 0.09 -0.65 0.00 0.00 175.02 174.63 2asq n ASN 60 N -0.76 -4.33 0.00 1.11 4.13 -1.26 -4.79 115.26 109.36 2asq n ASN 60 Ca 0.08 0.17 -0.02 0.00 1.68 0.00 0.00 54.58 56.50 2asq n ASN 60 Cb 0.52 -2.45 -0.11 0.00 -1.54 0.00 0.00 39.78 36.19 2asq n ASN 60 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2asq n SER 61 N 0.05 0.67 -4.33 6.41 3.41 -1.21 -3.94 113.62 114.67 2asq n SER 61 Ca -0.07 0.30 -0.29 0.00 -0.26 0.00 0.00 58.87 58.55 2asq n SER 61 Cb 0.31 0.39 -0.14 0.00 -0.26 0.00 0.00 64.21 64.52 2asq n SER 61 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2asq s LEU 62 N -5.68 2.22 -0.09 1.04 1.43 -1.26 -0.26 118.68 116.07 2asq s LEU 62 Ca -0.05 -0.63 0.04 0.00 -1.03 0.00 0.00 54.13 52.47 2asq s LEU 62 Cb 0.09 -1.18 -0.00 0.00 0.03 0.00 0.00 46.19 45.12 2asq s LEU 62 CO 0.82 0.21 -0.23 0.00 0.23 0.00 0.00 176.35 177.38 2asq s ARG 63 N -1.48 2.97 -0.17 1.70 1.70 0.16 -4.85 118.95 118.98 2asq s ARG 63 Ca 0.11 -0.86 -0.09 0.00 -0.47 0.00 0.00 55.73 54.42 2asq s ARG 63 Cb -0.10 -2.31 -0.05 0.00 -0.57 0.00 0.00 34.95 31.93 2asq s ARG 63 CO 0.03 0.23 0.14 -0.06 -1.08 0.00 0.00 175.30 174.56 2asq s PHE 64 N 0.22 3.48 -0.11 5.89 0.40 -1.26 -0.94 117.98 125.67 2asq s PHE 64 Ca -0.15 0.42 0.02 0.00 -0.60 0.00 0.00 56.93 56.62 2asq s PHE 64 Cb -0.17 -2.08 -0.01 0.00 0.51 0.00 0.00 43.02 41.27 2asq s PHE 64 CO 0.07 0.46 -0.17 -0.51 0.70 0.00 0.00 175.22 175.78 2asq s LEU 65 N -0.17 2.53 -0.14 -0.37 1.43 0.77 -0.46 118.68 122.27 2asq s LEU 65 Ca 0.11 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2asq s LEU 65 Cb -0.11 -1.54 0.05 0.00 0.03 0.00 0.00 46.19 44.61 2asq s LEU 65 CO 0.00 0.19 0.02 0.12 0.23 0.00 0.00 176.35 176.92 2asq s PHE 66 N 0.16 0.87 -1.78 0.29 5.36 0.16 -0.55 117.98 122.49 2asq s PHE 66 Ca -0.09 -0.55 0.00 0.00 -0.96 0.00 0.00 56.93 55.33 2asq s PHE 66 Cb -0.15 -0.93 0.00 0.00 -0.34 0.00 0.00 43.02 41.59 2asq s PHE 66 CO 0.06 -0.49 0.00 0.39 -1.46 0.00 0.00 175.22 173.72 2asq n GLU 67 N 5.09 -1.30 0.00 10.12 -0.58 -1.26 -1.17 120.64 131.54 2asq n GLU 67 Ca -0.08 1.05 0.00 0.00 -0.42 0.00 0.00 57.16 57.70 2asq n GLU 67 Cb 0.48 -5.38 0.00 0.00 -0.57 0.00 0.00 31.44 25.98 2asq n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2asq n GLY 68 N -0.86 1.48 3.76 0.62 0.00 -1.26 -5.04 105.19 103.89 2asq n GLY 68 Ca -0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.72 3.33 0.31 1.61 -1.52 -0.31 -5.05 119.66 117.31 2asq s GLN 69 Ca 0.00 -0.28 -0.27 0.00 -1.95 0.00 0.00 55.36 52.86 2asq s GLN 69 Cb 0.00 -3.02 -0.09 0.00 -0.22 0.00 0.00 33.01 29.67 2asq s GLN 69 CO 0.00 0.67 1.04 -0.98 -0.25 0.00 0.00 175.29 175.77 2asq s ARG 70 N -0.76 4.53 -0.23 2.91 1.70 -1.26 0.38 118.95 126.22 2asq s ARG 70 Ca 0.12 1.60 -0.29 0.00 -0.47 0.00 0.00 55.73 56.70 2asq s ARG 70 Cb -0.12 -2.96 -0.01 0.00 -0.57 0.00 0.00 34.95 31.30 2asq s ARG 70 CO 0.03 0.17 1.27 0.42 -1.08 0.00 0.00 175.30 176.10 2asq s ILE 71 N -1.37 4.24 0.39 4.99 -1.09 0.39 -4.89 121.20 123.86 2asq s ILE 71 Ca 0.49 1.46 -0.06 0.00 -2.23 0.00 0.00 60.65 60.31 2asq s ILE 71 Cb -0.26 -4.08 -0.05 0.00 -1.58 0.00 0.00 42.46 36.49 2asq s ILE 71 CO 0.33 -0.29 0.69 0.00 -1.23 0.00 0.00 174.94 174.44 2asq s ALA 72 N 3.88 3.49 0.35 9.38 0.00 -1.26 -4.77 121.76 132.82 2asq s ALA 72 Ca 0.55 -0.51 0.15 0.00 0.00 0.00 0.00 51.96 52.15 2asq s ALA 72 Cb -0.19 -2.47 0.77 0.00 0.00 0.00 0.00 23.12 21.23 2asq s ALA 72 CO 0.18 -0.07 1.83 -0.44 0.00 0.00 0.00 175.76 177.26 2asq h ASP 73 N 0.92 0.00 0.38 0.00 3.32 -1.95 -1.90 116.42 117.19 2asq h ASP 73 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2asq h ASP 73 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2asq h ASP 73 CO 0.63 0.36 -0.06 -0.46 -1.72 0.00 0.00 179.24 177.99 2asq n ASN 74 N -3.98 0.29 -4.80 6.45 6.94 -1.26 -3.79 115.26 115.11 2asq n ASN 74 Ca -0.02 -0.50 -0.36 0.00 -0.02 0.00 0.00 54.58 53.68 2asq n ASN 74 Cb 0.41 -0.13 -0.06 0.00 -2.36 0.00 0.00 39.78 37.63 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 -2.44 3.61 0.21 -2.53 3.76 -0.71 -4.95 115.29 112.24 2asq s HIS 75 Ca 0.31 1.63 0.07 0.00 -0.15 0.00 0.00 55.06 56.92 2asq s HIS 75 Cb 0.20 -2.82 -0.05 0.00 1.11 0.00 0.00 32.58 31.03 2asq s HIS 75 CO 0.46 0.19 -0.12 0.95 -0.85 0.00 0.00 174.74 175.37 2asq s THR 76 N -1.69 1.60 -0.79 1.30 -4.23 -1.26 -0.86 115.64 109.70 2asq s THR 76 Ca 0.50 -2.17 0.12 0.00 -1.18 0.00 0.00 61.69 58.97 2asq s THR 76 Cb -0.16 -2.09 0.12 0.00 1.34 0.00 0.00 72.50 71.70 2asq s THR 76 CO 0.21 -0.56 1.39 -2.65 -0.54 0.00 0.00 174.62 172.47 2asq n PRO 77 N -0.39 0.05 0.01 3.99 -0.02 -1.26 -2.14 135.00 135.25 2asq n PRO 77 Ca -0.08 0.42 -0.10 0.00 -2.02 0.00 0.00 63.50 61.72 2asq n PRO 77 Cb 0.61 -1.63 0.05 0.00 -0.02 0.00 0.00 33.50 32.51 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 0.55 0.00 -0.52 1.63 -1.95 -3.34 116.57 112.94 2asq h LYS 78 Ca 0.00 -0.35 -0.43 0.00 -0.85 0.00 0.00 60.65 59.02 2asq h LYS 78 Cb 0.15 0.04 0.04 0.00 -0.60 0.00 0.00 32.23 31.87 2asq h LYS 78 CO 0.00 0.96 -0.02 -0.85 -3.45 0.00 0.00 179.45 176.10 2asq n GLU 79 N -3.95 0.46 0.00 1.90 0.28 -0.91 -4.55 120.64 113.87 2asq n GLU 79 Ca -0.03 -2.70 0.00 0.00 -0.16 0.00 0.00 57.16 54.27 2asq n GLU 79 Cb 0.61 -0.32 0.00 0.00 1.43 0.00 0.00 31.44 33.16 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 0.00 -1.84 4.77 -1.26 -3.88 117.00 114.79 2asq n LEU 80 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2asq n LEU 80 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 2asq n LEU 80 CO 0.35 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 2asq n GLY 81 N 0.00 0.76 3.74 -0.72 0.00 -1.26 -5.10 105.19 102.61 2asq n GLY 81 Ca 0.00 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2asq n GLY 81 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2asq s MET 82 N 0.35 4.69 0.43 1.61 -1.94 -1.25 -5.05 119.30 118.13 2asq s MET 82 Ca 0.00 1.62 0.04 0.00 -1.71 0.00 0.00 55.69 55.64 2asq s MET 82 Cb 0.00 -3.29 -0.05 0.00 2.01 0.00 0.00 34.83 33.51 2asq s MET 82 CO 0.00 0.23 0.03 -1.21 -0.01 0.00 0.00 175.02 174.07 2asq s GLU 83 N -0.66 1.99 0.15 2.03 2.02 -1.26 -5.00 118.70 117.97 2asq s GLU 83 Ca 0.46 -2.19 -0.31 0.00 0.02 0.00 0.00 54.97 52.94 2asq s GLU 83 Cb -0.28 -1.32 -0.10 0.00 0.10 0.00 0.00 34.13 32.53 2asq s GLU 83 CO 0.34 -0.24 1.60 -2.00 0.02 0.00 0.00 175.26 174.98 2asq s GLU 84 N -3.80 4.20 -1.24 1.61 2.56 -1.26 -2.76 118.70 118.01 2asq s GLU 84 Ca 0.23 2.38 -0.01 0.00 0.00 0.00 0.00 54.97 57.58 2asq s GLU 84 Cb 0.06 -3.24 0.00 0.00 2.00 0.00 0.00 34.13 32.95 2asq s GLU 84 CO 0.12 -0.65 0.93 0.39 -0.56 0.00 0.00 175.26 175.49 2asq n GLU 85 N 4.30 -6.21 -1.88 4.30 1.02 0.29 -4.94 120.64 117.53 2asq n GLU 85 Ca 0.14 0.78 -0.30 0.00 -0.02 0.00 0.00 57.16 57.77 2asq n GLU 85 Cb 0.39 -5.68 0.20 0.00 -0.02 0.00 0.00 31.44 26.32 2asq n GLU 85 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2asq s ASP 86 N -4.30 2.86 -0.10 1.62 -1.08 -1.04 -4.71 116.67 109.94 2asq s ASP 86 Ca 0.04 0.25 0.03 0.00 -0.52 0.00 0.00 52.55 52.35 2asq s ASP 86 Cb -0.02 -0.28 -0.01 0.00 -1.46 0.00 0.00 42.92 41.16 2asq s ASP 86 CO 0.75 -2.89 -0.20 -0.69 0.52 0.00 0.00 175.17 172.66 2asq s VAL 87 N -3.85 2.44 -0.03 1.11 1.01 -1.26 0.43 120.40 120.24 2asq s VAL 87 Ca 0.75 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.84 2asq s VAL 87 Cb -0.04 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.40 2asq s VAL 87 CO 0.53 0.55 -0.05 -0.51 0.00 0.00 0.00 175.10 175.63 2asq s ILE 88 N 0.16 0.50 0.12 2.22 2.07 0.37 -4.69 121.20 121.95 2asq s ILE 88 Ca -0.11 -0.15 -0.01 0.00 -1.41 0.00 0.00 60.65 58.97 2asq s ILE 88 Cb -0.16 -0.50 -0.04 0.00 0.13 0.00 0.00 42.46 41.88 2asq s ILE 88 CO 0.06 0.20 0.29 -1.61 -1.91 0.00 0.00 174.94 171.97 2asq s GLU 89 N 0.63 3.49 -0.07 3.50 2.02 0.29 0.14 118.70 128.69 2asq s GLU 89 Ca -0.08 -0.37 0.01 0.00 0.02 0.00 0.00 54.97 54.55 2asq s GLU 89 Cb -0.11 -2.95 0.02 0.00 0.10 0.00 0.00 34.13 31.19 2asq s GLU 89 CO 0.00 0.52 -0.08 0.54 0.02 0.00 0.00 175.26 176.27 2asq s VAL 90 N -1.65 0.85 0.15 2.63 0.11 -0.53 -0.16 120.40 121.80 2asq s VAL 90 Ca 0.37 -0.27 0.04 0.00 -2.93 0.00 0.00 61.98 59.19 2asq s VAL 90 Cb -0.12 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 2asq s VAL 90 CO 0.28 0.31 -0.09 -0.31 -3.33 0.00 0.00 175.10 171.95 2asq s TYR 91 N 1.07 1.25 0.24 1.54 2.02 -0.11 -3.90 117.35 119.45 2asq s TYR 91 Ca -0.08 -0.79 -0.19 0.00 -0.37 0.00 0.00 57.07 55.64 2asq s TYR 91 Cb -0.14 -0.65 -0.08 0.00 -0.40 0.00 0.00 41.96 40.68 2asq s TYR 91 CO -0.01 0.04 0.73 -0.65 -1.57 0.00 0.00 175.55 174.10 2asq s GLN 92 N -3.77 4.21 0.02 -0.62 -0.21 -1.26 0.37 119.66 118.39 2asq s GLN 92 Ca 0.17 0.84 -0.25 0.00 0.02 0.00 0.00 55.36 56.14 2asq s GLN 92 Cb 0.03 -2.79 -0.05 0.00 1.00 0.00 0.00 33.01 31.20 2asq s GLN 92 CO 0.01 0.35 0.77 -1.21 -2.12 0.00 0.00 175.29 173.09 2asq s GLU 93 N -2.17 4.49 0.46 2.91 0.41 0.65 -4.78 118.70 120.67 2asq s GLU 93 Ca 0.45 1.07 0.18 0.00 -0.41 0.00 0.00 54.97 56.26 2asq s GLU 93 Cb -0.15 -3.39 1.09 0.00 -1.78 0.00 0.00 34.13 29.90 2asq s GLU 93 CO 0.20 0.21 1.99 0.37 -0.49 0.00 0.00 175.26 177.54 2asq h GLN 94 N 5.97 0.00 0.00 1.61 4.15 -1.95 -1.60 115.11 123.30 2asq h GLN 94 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.99 2asq h GLN 94 Cb 1.20 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.89 2asq h GLN 94 CO 0.72 0.19 0.00 1.15 -1.93 0.00 0.00 178.83 178.97 2asq h THR 95 N 0.00 0.00 0.00 2.39 2.02 -1.93 -3.46 112.91 111.93 2asq h THR 95 Ca -0.00 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2asq h THR 95 Cb 0.38 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2asq h THR 95 CO 0.03 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.53 2asq n GLY 96 N -0.23 2.22 0.00 2.16 0.00 -0.60 -5.13 105.19 103.61 2asq n GLY 96 Ca 0.01 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2asq n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93