#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uyz h GLU 20 N 0.00 0.38 -6.24 2.12 4.81 -2.01 -3.42 114.58 110.22 2uyz h GLU 20 Ca 0.00 -0.21 -0.58 0.00 -0.13 0.00 0.00 59.36 58.44 2uyz h GLU 20 Cb 0.00 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.28 2uyz h GLU 20 CO 0.00 0.78 -0.68 0.71 -0.73 0.00 0.00 179.01 179.10 2uyz s TYR 21 N -4.21 2.61 -0.01 0.92 1.51 -1.26 -1.02 117.35 115.90 2uyz s TYR 21 Ca -0.14 -0.24 0.01 0.00 -1.01 0.00 0.00 57.07 55.68 2uyz s TYR 21 Cb 0.05 -1.17 0.01 0.00 -0.11 0.00 0.00 41.96 40.74 2uyz s TYR 21 CO 0.76 0.62 -0.01 -1.50 -1.11 0.00 0.00 175.55 174.31 2uyz s ILE 22 N -2.26 0.14 -0.01 2.71 2.07 0.41 -4.81 121.20 119.45 2uyz s ILE 22 Ca 0.30 -0.03 -0.21 0.00 -1.41 0.00 0.00 60.65 59.31 2uyz s ILE 22 Cb -0.07 -0.16 -0.05 0.00 0.13 0.00 0.00 42.46 42.32 2uyz s ILE 22 CO 0.18 0.07 0.60 -0.54 -1.91 0.00 0.00 174.94 173.33 2uyz s LYS 23 N 0.24 4.32 0.05 3.50 1.02 -1.26 -1.38 119.74 126.23 2uyz s LYS 23 Ca -0.02 0.73 0.00 0.00 0.02 0.00 0.00 55.97 56.70 2uyz s LYS 23 Cb -0.04 -3.35 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 2uyz s LYS 23 CO -0.01 0.36 -0.04 -0.51 -0.92 0.00 0.00 175.35 174.23 2uyz s LEU 24 N -0.16 2.41 0.02 3.17 1.43 -0.32 -0.27 118.68 124.96 2uyz s LEU 24 Ca 0.31 -0.84 0.04 0.00 -1.03 0.00 0.00 54.13 52.61 2uyz s LEU 24 Cb -0.18 0.08 -0.02 0.00 0.03 0.00 0.00 46.19 46.10 2uyz s LEU 24 CO 0.17 -0.46 -0.13 -1.59 0.23 0.00 0.00 176.35 174.57 2uyz s LYS 25 N -3.11 0.96 -0.21 1.70 -2.85 -0.51 -1.09 119.74 114.62 2uyz s LYS 25 Ca 0.01 -0.62 -0.05 0.00 -1.00 0.00 0.00 55.97 54.31 2uyz s LYS 25 Cb 0.02 -0.94 -0.02 0.00 -2.06 0.00 0.00 37.83 34.82 2uyz s LYS 25 CO -0.06 0.24 0.01 0.08 0.10 0.00 0.00 175.35 175.73 2uyz s VAL 26 N -0.61 3.95 0.09 1.79 1.01 0.56 -0.42 120.40 126.77 2uyz s VAL 26 Ca 0.03 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 61.76 2uyz s VAL 26 Cb -0.07 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2uyz s VAL 26 CO 0.00 0.41 -0.07 0.27 0.00 0.00 0.00 175.10 175.71 2uyz s ILE 27 N 1.21 3.54 0.31 2.22 -4.36 0.39 -0.87 121.20 123.64 2uyz s ILE 27 Ca 0.03 -1.13 0.07 0.00 -0.26 0.00 0.00 60.65 59.36 2uyz s ILE 27 Cb -0.15 -2.65 -0.06 0.00 1.25 0.00 0.00 42.46 40.86 2uyz s ILE 27 CO 0.01 0.16 -0.04 -0.83 0.24 0.00 0.00 174.94 174.49 2uyz s GLY 28 N -2.10 2.00 0.17 6.27 0.00 -0.93 -1.13 107.32 111.59 2uyz s GLY 28 Ca 0.22 -2.00 -0.18 0.00 0.00 0.00 0.00 44.72 42.75 2uyz s GLY 28 CO 0.14 -1.89 1.64 1.46 0.00 0.00 0.00 173.10 174.45 2uyz h GLN 29 N 2.16 -0.09 0.00 2.90 4.20 -1.91 -1.32 115.11 121.05 2uyz h GLN 29 Ca -0.41 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.31 2uyz h GLN 29 Cb 1.24 0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.04 2uyz h GLN 29 CO 0.70 -0.06 0.00 -0.40 -0.67 0.00 0.00 178.83 178.40 2uyz n ASP 30 N -5.36 0.00 0.00 1.46 5.75 -1.26 -4.71 116.55 112.42 2uyz n ASP 30 Ca 0.02 -0.23 0.00 0.00 -0.01 0.00 0.00 54.79 54.58 2uyz n ASP 30 Cb 0.27 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 2uyz n ASP 30 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2uyz n SER 31 N -0.58 -1.36 -4.76 -1.12 3.41 -0.50 -5.01 113.62 103.70 2uyz n SER 31 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.26 2uyz n SER 31 Cb 0.00 -0.23 0.02 0.00 -0.26 0.00 0.00 64.21 63.75 2uyz n SER 31 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2uyz s SER 32 N -2.51 5.38 -0.16 4.04 1.04 -1.25 -4.83 113.70 115.41 2uyz s SER 32 Ca 0.00 2.32 -0.04 0.00 0.48 0.00 0.00 55.95 58.70 2uyz s SER 32 Cb 0.00 -2.59 0.06 0.00 0.10 0.00 0.00 66.02 63.59 2uyz s SER 32 CO 0.00 -1.46 0.12 -0.70 0.98 0.00 0.00 173.24 172.18 2uyz s GLU 33 N -3.30 0.08 -0.16 4.02 2.12 -1.26 -2.20 118.70 117.99 2uyz s GLU 33 Ca 0.76 0.05 -0.02 0.00 0.36 0.00 0.00 54.97 56.12 2uyz s GLU 33 Cb -0.28 -1.52 -0.01 0.00 0.26 0.00 0.00 34.13 32.58 2uyz s GLU 33 CO 0.31 -0.63 -0.10 0.42 -0.54 0.00 0.00 175.26 174.72 2uyz s ILE 34 N 2.19 3.15 0.02 -3.70 -1.09 -0.05 -4.92 121.20 116.79 2uyz s ILE 34 Ca 0.03 -0.60 -0.09 0.00 -2.23 0.00 0.00 60.65 57.77 2uyz s ILE 34 Cb -0.15 -2.37 -0.05 0.00 -1.58 0.00 0.00 42.46 38.31 2uyz s ILE 34 CO -0.09 0.49 0.31 -1.00 -1.23 0.00 0.00 174.94 173.42 2uyz s HIS 35 N 0.77 3.60 0.06 3.97 3.76 -1.26 -0.32 115.29 125.86 2uyz s HIS 35 Ca -0.04 0.68 0.01 0.00 -0.15 0.00 0.00 55.06 55.57 2uyz s HIS 35 Cb -0.15 -2.07 -0.03 0.00 1.11 0.00 0.00 32.58 31.44 2uyz s HIS 35 CO 0.01 0.60 -0.06 -0.06 -0.85 0.00 0.00 174.74 174.38 2uyz s PHE 36 N -1.28 0.68 -0.20 1.40 0.40 -0.25 -5.00 117.98 113.72 2uyz s PHE 36 Ca 0.28 -0.72 -0.03 0.00 -0.60 0.00 0.00 56.93 55.86 2uyz s PHE 36 Cb -0.14 -0.41 0.06 0.00 0.51 0.00 0.00 43.02 43.04 2uyz s PHE 36 CO 0.15 -0.16 0.06 0.21 0.70 0.00 0.00 175.22 176.18 2uyz s LYS 37 N -2.62 0.49 0.19 0.44 2.20 -1.26 -1.17 119.74 118.00 2uyz s LYS 37 Ca -0.01 -0.37 0.04 0.00 -0.36 0.00 0.00 55.97 55.27 2uyz s LYS 37 Cb -0.03 -2.00 -0.05 0.00 -1.51 0.00 0.00 37.83 34.25 2uyz s LYS 37 CO -0.03 -0.68 -0.06 0.14 -0.36 0.00 0.00 175.35 174.36 2uyz s VAL 38 N 1.93 1.16 0.32 4.02 -7.23 -0.48 -4.92 120.40 115.20 2uyz s VAL 38 Ca 0.01 -2.06 -0.28 0.00 -1.81 0.00 0.00 61.98 57.83 2uyz s VAL 38 Cb -0.17 -2.09 -0.10 0.00 0.56 0.00 0.00 36.38 34.58 2uyz s VAL 38 CO -0.10 -0.54 1.16 -0.54 -0.31 0.00 0.00 175.10 174.77 2uyz s LYS 39 N -3.79 4.46 0.55 4.82 1.02 -1.26 -0.44 119.74 125.10 2uyz s LYS 39 Ca 0.23 1.91 0.34 0.00 0.02 0.00 0.00 55.97 58.46 2uyz s LYS 39 Cb 0.04 -3.06 1.39 0.00 -0.52 0.00 0.00 37.83 35.68 2uyz s LYS 39 CO 0.05 0.02 1.99 0.52 -0.92 0.00 0.00 175.35 177.01 2uyz h MET 40 N 3.48 0.00 -0.37 1.68 2.86 -1.32 -2.83 114.93 118.42 2uyz h MET 40 Ca -0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2uyz h MET 40 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 2uyz h MET 40 CO 0.66 0.00 0.00 0.25 1.06 0.00 0.00 176.91 178.88 2uyz n THR 41 N -3.09 0.75 -3.26 2.22 -2.24 -1.26 -1.71 114.28 105.68 2uyz n THR 41 Ca 0.01 -0.87 -0.38 0.00 -2.27 0.00 0.00 64.05 60.53 2uyz n THR 41 Cb 0.30 0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 69.18 2uyz n THR 41 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2uyz s THR 42 N -1.08 4.72 0.24 4.28 2.01 -1.07 -4.94 115.64 119.81 2uyz s THR 42 Ca 0.29 1.23 -0.31 0.00 0.31 0.00 0.00 61.69 63.21 2uyz s THR 42 Cb 0.16 -3.90 -0.14 0.00 0.01 0.00 0.00 72.50 68.63 2uyz s THR 42 CO 0.21 0.54 1.30 1.41 -0.69 0.00 0.00 174.62 177.39 2uyz n HIS 43 N 1.67 1.89 0.47 4.92 8.25 -1.26 -4.43 115.22 126.73 2uyz n HIS 43 Ca -0.10 0.53 0.10 0.00 -0.26 0.00 0.00 57.72 57.98 2uyz n HIS 43 Cb 0.51 -2.39 0.41 0.00 1.12 0.00 0.00 29.99 29.63 2uyz n HIS 43 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2uyz n LEU 44 N 1.89 0.33 -0.29 2.41 4.77 0.51 -2.37 117.00 124.25 2uyz n LEU 44 Ca 0.11 0.58 0.10 0.00 -0.03 0.00 0.00 56.01 56.78 2uyz n LEU 44 Cb 0.30 -0.53 0.26 0.00 -2.33 0.00 0.00 43.42 41.13 2uyz n LEU 44 CO 0.62 -0.39 1.00 0.50 -1.33 0.00 0.00 177.39 177.80 2uyz h LYS 45 N 0.00 0.34 -0.16 3.23 3.64 -1.50 -0.91 116.57 121.21 2uyz h LYS 45 Ca 0.00 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2uyz h LYS 45 Cb 0.32 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 2uyz h LYS 45 CO 0.00 0.23 -0.01 0.87 -2.27 0.00 0.00 179.45 178.27 2uyz h LYS 46 N 0.35 0.04 -0.69 1.90 1.57 -1.76 -0.19 116.57 117.78 2uyz h LYS 46 Ca 0.51 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 59.32 2uyz h LYS 46 Cb 0.93 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.19 2uyz h LYS 46 CO -0.53 0.02 0.43 1.25 -0.57 0.00 0.00 179.45 180.06 2uyz h LEU 47 N 0.04 0.70 -0.60 2.94 6.46 -1.44 0.53 115.31 123.95 2uyz h LEU 47 Ca 0.08 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.86 2uyz h LEU 47 Cb 0.10 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 39.84 2uyz h LEU 47 CO -0.14 0.48 0.37 0.11 -0.62 0.00 0.00 178.44 178.64 2uyz h LYS 48 N 0.84 0.71 -0.70 1.25 1.57 -0.82 0.25 116.57 119.67 2uyz h LYS 48 Ca 0.28 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 2uyz h LYS 48 Cb 0.03 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 2uyz h LYS 48 CO -0.11 0.47 0.16 0.93 -0.57 0.00 0.00 179.45 180.33 2uyz h GLU 49 N 0.73 1.13 -0.29 3.15 5.08 -0.22 -0.92 114.58 123.24 2uyz h GLU 49 Ca 0.24 -0.27 -0.11 0.00 -1.00 0.00 0.00 59.36 58.22 2uyz h GLU 49 Cb 0.01 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2uyz h GLU 49 CO -0.10 1.00 -0.27 0.77 -1.00 0.00 0.00 179.01 179.42 2uyz h SER 50 N 1.07 0.58 -0.10 1.42 0.02 -0.35 -1.48 113.55 114.71 2uyz h SER 50 Ca 0.22 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2uyz h SER 50 Cb 0.38 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 2uyz h SER 50 CO 0.00 0.83 0.01 0.22 -1.14 0.00 0.00 176.83 176.75 2uyz h TYR 51 N 0.50 0.18 -0.83 3.45 5.03 -0.70 -1.93 116.97 122.67 2uyz h TYR 51 Ca 0.07 -0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.36 2uyz h TYR 51 Cb 0.72 -0.05 -0.04 0.00 1.55 0.00 0.00 36.73 38.91 2uyz h TYR 51 CO 0.03 0.39 0.55 0.00 -1.32 0.00 0.00 178.16 177.81 2uyz h GLN 53 N 1.12 0.88 -0.16 0.00 -0.00 -1.24 0.51 115.11 116.22 2uyz h GLN 53 Ca 0.31 -0.38 -0.12 0.00 -0.00 0.00 0.00 58.65 58.46 2uyz h GLN 53 Cb -0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.32 2uyz h GLN 53 CO -0.07 1.03 -0.44 0.00 0.00 0.00 0.00 178.83 179.35 2uyz h ARG 54 N 0.71 0.39 -0.01 1.69 3.08 -0.98 -3.10 114.38 116.15 2uyz h ARG 54 Ca 0.10 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2uyz h ARG 54 Cb 0.75 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.80 2uyz h ARG 54 CO 0.06 0.75 -0.51 1.04 -1.07 0.00 0.00 179.97 180.25 2uyz n GLN 55 N -4.01 0.99 -3.06 0.04 1.13 -0.62 -5.00 117.38 106.86 2uyz n GLN 55 Ca -0.02 -0.79 -0.12 0.00 -1.94 0.00 0.00 57.00 54.13 2uyz n GLN 55 Cb 0.51 -1.48 0.04 0.00 0.11 0.00 0.00 30.24 29.42 2uyz n GLN 55 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2uyz n GLY 56 N 1.42 0.16 3.17 1.08 0.00 0.07 -5.04 105.19 106.05 2uyz n GLY 56 Ca 0.09 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2uyz n GLY 56 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2uyz s VAL 57 N -3.17 0.86 0.45 1.61 -7.23 -0.58 -5.05 120.40 107.30 2uyz s VAL 57 Ca 0.29 -1.73 -0.20 0.00 -1.81 0.00 0.00 61.98 58.52 2uyz s VAL 57 Cb -0.13 -1.45 -0.10 0.00 0.56 0.00 0.00 36.38 35.26 2uyz s VAL 57 CO 0.38 -0.66 0.97 -2.16 -0.31 0.00 0.00 175.10 173.33 2uyz s PRO 58 N -3.12 4.09 0.35 4.82 0.04 -1.26 -4.48 135.00 135.45 2uyz s PRO 58 Ca 0.07 1.15 0.04 0.00 0.04 0.00 0.00 61.00 62.31 2uyz s PRO 58 Cb -0.00 -2.15 0.69 0.00 0.04 0.00 0.00 34.50 33.07 2uyz s PRO 58 CO -0.01 -0.15 1.97 0.52 0.04 0.00 0.00 177.00 179.36 2uyz h MET 59 N 1.69 0.79 0.00 4.56 2.86 -1.95 -2.12 114.93 120.77 2uyz h MET 59 Ca -0.49 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.10 2uyz h MET 59 Cb 1.19 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.67 2uyz h MET 59 CO 0.61 0.52 0.00 0.27 1.06 0.00 0.00 176.91 179.37 2uyz n ASN 60 N -4.47 0.00 -0.25 1.22 0.23 -1.26 -2.76 115.26 107.97 2uyz n ASN 60 Ca 0.10 0.26 0.12 0.00 -0.53 0.00 0.00 54.58 54.54 2uyz n ASN 60 Cb 0.17 -0.39 0.29 0.00 -2.08 0.00 0.00 39.78 37.77 2uyz n ASN 60 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2uyz n SER 61 N -1.39 1.13 -4.15 0.53 3.41 -0.80 -4.77 113.62 107.58 2uyz n SER 61 Ca 0.06 -0.93 -0.16 0.00 -0.26 0.00 0.00 58.87 57.59 2uyz n SER 61 Cb 0.17 0.23 -0.11 0.00 -0.26 0.00 0.00 64.21 64.24 2uyz n SER 61 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2uyz s LEU 62 N -2.56 2.33 0.03 1.04 1.43 -1.11 -0.85 118.68 118.99 2uyz s LEU 62 Ca 0.22 -0.69 0.08 0.00 -1.03 0.00 0.00 54.13 52.71 2uyz s LEU 62 Cb 0.19 -0.36 -0.03 0.00 0.03 0.00 0.00 46.19 46.02 2uyz s LEU 62 CO 0.56 -0.18 -0.24 -0.60 0.23 0.00 0.00 176.35 176.12 2uyz s ARG 63 N -2.15 1.68 -0.06 1.70 3.52 -0.33 -4.77 118.95 118.54 2uyz s ARG 63 Ca -0.00 -1.01 0.05 0.00 -0.13 0.00 0.00 55.73 54.64 2uyz s ARG 63 Cb -0.07 -1.79 -0.01 0.00 -1.56 0.00 0.00 34.95 31.52 2uyz s ARG 63 CO 0.01 0.47 -0.23 -0.06 -0.81 0.00 0.00 175.30 174.67 2uyz s PHE 64 N -0.76 2.34 0.06 5.12 0.40 -1.26 -0.53 117.98 123.36 2uyz s PHE 64 Ca 0.10 -0.76 0.08 0.00 -0.60 0.00 0.00 56.93 55.76 2uyz s PHE 64 Cb -0.09 -1.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.86 2uyz s PHE 64 CO 0.01 -0.25 -0.23 -0.51 0.70 0.00 0.00 175.22 174.94 2uyz s LEU 65 N -0.01 2.20 -0.08 -0.37 1.02 0.35 -0.75 118.68 121.03 2uyz s LEU 65 Ca -0.07 -0.58 0.01 0.00 0.02 0.00 0.00 54.13 53.51 2uyz s LEU 65 Cb -0.14 -1.08 0.02 0.00 0.02 0.00 0.00 46.19 45.01 2uyz s LEU 65 CO 0.05 0.18 -0.10 0.12 0.02 0.00 0.00 176.35 176.61 2uyz s PHE 66 N -0.87 1.41 -1.45 0.29 5.36 0.01 -1.03 117.98 121.70 2uyz s PHE 66 Ca 0.09 -0.56 -0.11 0.00 -0.96 0.00 0.00 56.93 55.39 2uyz s PHE 66 Cb -0.09 -1.08 0.07 0.00 -0.34 0.00 0.00 43.02 41.58 2uyz s PHE 66 CO 0.03 -0.33 0.73 0.39 -1.46 0.00 0.00 175.22 174.57 2uyz n GLU 67 N 4.13 -4.55 -0.93 10.12 -0.58 -1.26 -1.58 120.64 125.99 2uyz n GLU 67 Ca -0.20 0.60 0.00 0.00 -0.42 0.00 0.00 57.16 57.13 2uyz n GLU 67 Cb 0.51 -5.41 0.00 0.00 -0.57 0.00 0.00 31.44 25.97 2uyz n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2uyz n GLY 68 N -1.46 0.87 3.30 0.62 0.00 -1.26 -5.03 105.19 102.23 2uyz n GLY 68 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2uyz n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uyz s GLN 69 N -0.07 2.16 0.26 1.61 -1.52 -0.61 -5.07 119.66 116.41 2uyz s GLN 69 Ca 0.00 -0.92 -0.30 0.00 -1.95 0.00 0.00 55.36 52.19 2uyz s GLN 69 Cb 0.00 -2.04 -0.10 0.00 -0.22 0.00 0.00 33.01 30.65 2uyz s GLN 69 CO 0.00 0.53 1.37 0.50 -0.25 0.00 0.00 175.29 177.44 2uyz s ARG 70 N -0.54 4.33 -0.30 2.91 3.52 -1.26 -0.81 118.95 126.80 2uyz s ARG 70 Ca 0.08 2.21 -0.23 0.00 -0.13 0.00 0.00 55.73 57.66 2uyz s ARG 70 Cb -0.10 -3.12 -0.00 0.00 -1.56 0.00 0.00 34.95 30.16 2uyz s ARG 70 CO -0.00 -0.31 0.76 0.42 -0.81 0.00 0.00 175.30 175.36 2uyz s ILE 71 N -0.29 4.83 0.55 4.11 1.01 0.07 -4.88 121.20 126.59 2uyz s ILE 71 Ca 0.56 1.18 -0.18 0.00 0.00 0.00 0.00 60.65 62.20 2uyz s ILE 71 Cb -0.40 -4.11 -0.05 0.00 0.01 0.00 0.00 42.46 37.91 2uyz s ILE 71 CO 0.45 -0.20 1.06 0.00 0.00 0.00 0.00 174.94 176.25 2uyz s ALA 72 N 2.87 2.77 0.41 9.38 0.00 -1.26 -4.78 121.76 131.14 2uyz s ALA 72 Ca 0.31 0.53 0.14 0.00 0.00 0.00 0.00 51.96 52.94 2uyz s ALA 72 Cb -0.14 -3.26 1.00 0.00 0.00 0.00 0.00 23.12 20.72 2uyz s ALA 72 CO 0.12 -0.64 1.90 -0.44 0.00 0.00 0.00 175.76 176.70 2uyz h ASP 73 N 0.92 0.45 -0.15 0.00 3.32 -1.96 -1.81 116.42 117.19 2uyz h ASP 73 Ca -0.48 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2uyz h ASP 73 Cb 1.23 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.71 2uyz h ASP 73 CO 0.58 0.23 0.00 -0.46 -1.72 0.00 0.00 179.24 177.87 2uyz n ASN 74 N -4.50 2.12 -4.80 6.45 0.23 -1.26 -1.48 115.26 112.02 2uyz n ASN 74 Ca 0.15 -1.75 -0.34 0.00 -0.53 0.00 0.00 54.58 52.12 2uyz n ASN 74 Cb 0.53 -0.09 -0.04 0.00 -2.08 0.00 0.00 39.78 38.09 2uyz n ASN 74 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2uyz s HIS 75 N -1.81 3.10 0.25 -2.53 3.76 -0.68 -4.79 115.29 112.58 2uyz s HIS 75 Ca 0.34 1.60 0.11 0.00 -0.15 0.00 0.00 55.06 56.96 2uyz s HIS 75 Cb 0.20 -3.04 -0.05 0.00 1.11 0.00 0.00 32.58 30.80 2uyz s HIS 75 CO 0.29 -0.67 -0.18 0.95 -0.85 0.00 0.00 174.74 174.29 2uyz s THR 76 N -1.96 2.63 0.32 1.30 -4.23 -1.26 -0.37 115.64 112.08 2uyz s THR 76 Ca 0.65 -2.19 0.05 0.00 -1.18 0.00 0.00 61.69 59.02 2uyz s THR 76 Cb -0.16 -2.35 0.30 0.00 1.34 0.00 0.00 72.50 71.63 2uyz s THR 76 CO 0.20 -0.30 1.86 -0.65 -0.54 0.00 0.00 174.62 175.19 2uyz h PRO 77 N 2.52 0.84 -0.33 3.99 0.11 -1.76 -1.89 132.00 135.48 2uyz h PRO 77 Ca -0.43 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 2uyz h PRO 77 Cb 1.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2uyz h PRO 77 CO 0.56 0.56 -0.08 -0.22 -0.21 0.00 0.00 178.00 178.61 2uyz h LYS 78 N 0.87 0.64 -0.80 1.05 1.63 -1.67 -0.87 116.57 117.43 2uyz h LYS 78 Ca 0.46 -0.25 0.03 0.00 -0.85 0.00 0.00 60.65 60.04 2uyz h LYS 78 Cb 0.54 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.09 2uyz h LYS 78 CO -0.22 0.81 0.52 0.93 -3.45 0.00 0.00 179.45 178.05 2uyz h GLU 79 N 0.42 0.98 -0.00 1.90 5.08 -1.71 -2.54 114.58 118.70 2uyz h GLU 79 Ca 0.08 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2uyz h GLU 79 Cb 0.58 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2uyz h GLU 79 CO 0.03 0.65 -0.11 1.28 -1.00 0.00 0.00 179.01 179.86 2uyz n LEU 80 N -4.44 0.40 -0.98 1.33 4.77 -0.76 -4.93 117.00 112.39 2uyz n LEU 80 Ca 0.10 0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 56.06 2uyz n LEU 80 Cb 0.09 -0.21 -0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2uyz n LEU 80 CO 0.35 0.08 -0.08 0.61 -1.33 0.00 0.00 177.39 177.01 2uyz n GLY 81 N 1.30 0.07 3.77 -0.72 0.00 -0.57 -5.00 105.19 104.05 2uyz n GLY 81 Ca 0.14 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 2uyz n GLY 81 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2uyz s MET 82 N -4.50 3.21 0.15 1.61 -1.94 -0.44 -5.05 119.30 112.34 2uyz s MET 82 Ca 0.02 1.65 0.08 0.00 -1.71 0.00 0.00 55.69 55.73 2uyz s MET 82 Cb -0.01 -1.98 -0.04 0.00 2.01 0.00 0.00 34.83 34.81 2uyz s MET 82 CO 0.03 -0.98 -0.19 -1.21 -0.01 0.00 0.00 175.02 172.67 2uyz s GLU 83 N -3.37 1.22 0.13 2.03 2.02 -1.26 -4.87 118.70 114.60 2uyz s GLU 83 Ca 0.73 -1.33 -0.35 0.00 0.02 0.00 0.00 54.97 54.04 2uyz s GLU 83 Cb -0.25 -1.31 -0.16 0.00 0.10 0.00 0.00 34.13 32.51 2uyz s GLU 83 CO 0.30 0.27 1.35 -1.91 0.02 0.00 0.00 175.26 175.29 2uyz n GLU 84 N 0.51 1.37 -1.00 1.61 4.07 -1.26 -1.40 120.64 124.53 2uyz n GLU 84 Ca -0.15 0.49 -0.00 0.00 -0.06 0.00 0.00 57.16 57.44 2uyz n GLU 84 Cb 0.56 -2.13 -0.00 0.00 -0.06 0.00 0.00 31.44 29.81 2uyz n GLU 84 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2uyz n GLU 85 N 2.49 -0.22 -1.72 5.31 1.02 0.62 -5.00 120.64 123.15 2uyz n GLU 85 Ca 0.17 0.09 -0.39 0.00 -0.02 0.00 0.00 57.16 57.01 2uyz n GLU 85 Cb 0.23 -3.29 0.03 0.00 -0.02 0.00 0.00 31.44 28.39 2uyz n GLU 85 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2uyz n ASP 86 N 0.01 2.61 -4.79 1.62 8.00 -0.49 -4.56 116.55 118.95 2uyz n ASP 86 Ca -0.00 1.03 -0.37 0.00 0.71 0.00 0.00 54.79 56.16 2uyz n ASP 86 Cb 0.06 -1.55 -0.07 0.00 -0.02 0.00 0.00 41.12 39.54 2uyz n ASP 86 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2uyz s VAL 87 N -1.26 5.35 -0.08 2.53 0.11 -1.26 -1.43 120.40 124.36 2uyz s VAL 87 Ca 0.67 0.41 -0.01 0.00 -2.93 0.00 0.00 61.98 60.13 2uyz s VAL 87 Cb -0.45 -3.54 -0.03 0.00 -1.53 0.00 0.00 36.38 30.83 2uyz s VAL 87 CO 0.53 0.50 -0.03 -0.63 -3.33 0.00 0.00 175.10 172.14 2uyz s ILE 88 N -0.26 4.00 -0.13 7.04 1.01 0.44 -4.71 121.20 128.60 2uyz s ILE 88 Ca 0.15 -0.36 -0.06 0.00 0.00 0.00 0.00 60.65 60.38 2uyz s ILE 88 Cb -0.13 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 2uyz s ILE 88 CO 0.04 0.60 0.08 -1.61 0.00 0.00 0.00 174.94 174.05 2uyz s GLU 89 N -0.83 3.51 -0.10 2.79 2.02 -0.20 -0.46 118.70 125.42 2uyz s GLU 89 Ca 0.13 -0.27 0.01 0.00 0.02 0.00 0.00 54.97 54.86 2uyz s GLU 89 Cb -0.11 -3.10 -0.02 0.00 0.10 0.00 0.00 34.13 31.00 2uyz s GLU 89 CO 0.02 0.59 -0.14 0.54 0.02 0.00 0.00 175.26 176.29 2uyz s VAL 90 N -0.51 3.01 0.17 2.63 0.11 -0.29 -0.50 120.40 125.02 2uyz s VAL 90 Ca 0.11 -0.70 0.11 0.00 -2.93 0.00 0.00 61.98 58.56 2uyz s VAL 90 Cb -0.12 -2.23 -0.04 0.00 -1.53 0.00 0.00 36.38 32.46 2uyz s VAL 90 CO 0.02 0.55 -0.23 -0.31 -3.33 0.00 0.00 175.10 171.80 2uyz s TYR 91 N -0.03 2.18 0.06 1.54 1.51 0.31 -4.39 117.35 118.54 2uyz s TYR 91 Ca -0.04 -0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 55.34 2uyz s TYR 91 Cb -0.14 -1.10 -0.05 0.00 -0.11 0.00 0.00 41.96 40.56 2uyz s TYR 91 CO 0.04 0.43 1.11 -0.65 -1.11 0.00 0.00 175.55 175.37 2uyz s GLN 92 N -2.56 4.50 0.48 -0.62 -1.52 -1.26 -1.19 119.66 117.49 2uyz s GLN 92 Ca 0.18 1.65 -0.09 0.00 -1.95 0.00 0.00 55.36 55.15 2uyz s GLN 92 Cb -0.08 -3.37 -0.05 0.00 -0.22 0.00 0.00 33.01 29.29 2uyz s GLN 92 CO 0.08 -0.14 0.84 -1.21 -0.25 0.00 0.00 175.29 174.62 2uyz s GLU 93 N 0.83 3.67 0.21 2.91 0.41 -0.03 -4.83 118.70 121.87 2uyz s GLU 93 Ca 0.55 0.45 -0.30 0.00 -0.41 0.00 0.00 54.97 55.26 2uyz s GLU 93 Cb -0.27 -2.31 -0.10 0.00 -1.78 0.00 0.00 34.13 29.68 2uyz s GLU 93 CO 0.30 -0.22 1.42 -0.65 -0.49 0.00 0.00 175.26 175.62 2uyz s GLN 94 N -4.46 4.30 0.00 1.61 -1.52 -1.26 -4.86 119.66 113.47 2uyz s GLN 94 Ca 0.51 2.23 0.00 0.00 -1.95 0.00 0.00 55.36 56.15 2uyz s GLN 94 Cb -0.10 -3.15 0.00 0.00 -0.22 0.00 0.00 33.01 29.54 2uyz s GLN 94 CO 0.41 -0.40 0.55 0.25 -0.25 0.00 0.00 175.29 175.84 2uyz n THR 95 N 2.76 0.28 -0.21 -0.19 -2.24 -1.26 -4.97 114.28 108.45 2uyz n THR 95 Ca 0.08 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 2uyz n THR 95 Cb 0.41 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 2uyz n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11