#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cz8 s VAL 15 N 0.00 4.63 0.36 2.52 1.01 -1.26 -5.00 120.40 122.66 1cz8 s VAL 15 Ca 0.00 1.91 -0.28 0.00 0.00 0.00 0.00 61.98 63.62 1cz8 s VAL 15 Cb 0.00 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 1cz8 s VAL 15 CO 0.00 0.01 1.31 -0.54 0.00 0.00 0.00 175.10 175.88 1cz8 s LYS 16 N 2.04 4.21 0.23 2.72 -0.14 -1.26 -4.80 119.74 122.73 1cz8 s LYS 16 Ca 0.51 2.20 -0.11 0.00 -1.36 0.00 0.00 55.97 57.21 1cz8 s LYS 16 Cb -0.20 -2.95 0.32 0.00 -1.68 0.00 0.00 37.83 33.32 1cz8 s LYS 16 CO 0.19 -0.31 1.61 0.35 -0.76 0.00 0.00 175.35 176.44 1cz8 h PHE 17 N 3.10 -0.32 -0.68 3.18 3.57 -1.99 -0.39 116.94 123.42 1cz8 h PHE 17 Ca -0.49 0.06 0.10 0.00 3.53 0.00 0.00 57.97 61.17 1cz8 h PHE 17 Cb 1.23 0.25 -0.07 0.00 2.79 0.00 0.00 35.95 40.15 1cz8 h PHE 17 CO 0.55 -0.30 0.31 1.98 -2.23 0.00 0.00 178.31 178.62 1cz8 h MET 18 N 0.02 0.51 0.69 1.11 4.05 -1.99 0.10 114.93 119.42 1cz8 h MET 18 Ca 0.36 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.72 1cz8 h MET 18 Cb 0.57 -0.11 0.01 0.00 -0.80 0.00 0.00 31.60 31.26 1cz8 h MET 18 CO -0.73 0.33 -0.33 -0.44 0.23 0.00 0.00 176.91 175.98 1cz8 h ASP 19 N 0.52 -0.78 -0.93 1.39 3.32 -1.50 0.61 116.42 119.06 1cz8 h ASP 19 Ca 0.34 0.03 0.24 0.00 0.02 0.00 0.00 57.03 57.66 1cz8 h ASP 19 Cb 0.40 0.20 -0.17 0.00 0.22 0.00 0.00 39.33 39.98 1cz8 h ASP 19 CO -0.29 -0.48 0.04 0.58 -1.72 0.00 0.00 179.24 177.36 1cz8 h VAL 20 N -1.08 0.12 -0.08 -1.35 2.07 -0.99 0.13 116.25 115.07 1cz8 h VAL 20 Ca -0.09 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1cz8 h VAL 20 Cb 0.71 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1cz8 h VAL 20 CO 0.16 0.01 0.03 0.22 0.02 0.00 0.00 177.57 178.00 1cz8 h TYR 21 N 0.05 0.12 -0.37 1.57 3.20 -0.82 -1.55 116.97 119.17 1cz8 h TYR 21 Ca 0.55 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.34 1cz8 h TYR 21 Cb 1.09 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 1cz8 h TYR 21 CO -0.46 0.26 -0.02 0.37 -1.64 0.00 0.00 178.16 176.67 1cz8 h GLN 22 N -0.05 0.67 0.00 1.82 5.75 0.73 -2.70 115.11 121.32 1cz8 h GLN 22 Ca 0.03 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.25 1cz8 h GLN 22 Cb 0.19 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1cz8 h GLN 22 CO -0.00 0.78 -0.24 0.00 -2.65 0.00 0.00 178.83 176.73 1cz8 h ARG 23 N 0.48 0.00 -0.02 1.69 3.08 -0.81 -3.12 114.38 115.68 1cz8 h ARG 23 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1cz8 h ARG 23 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1cz8 h ARG 23 CO 0.02 0.24 -0.03 -1.13 -1.07 0.00 0.00 179.97 178.00 1cz8 n SER 24 N -3.73 2.65 -4.72 7.04 3.41 -0.59 -4.97 113.62 112.71 1cz8 n SER 24 Ca -0.01 -1.83 -0.41 0.00 -0.26 0.00 0.00 58.87 56.36 1cz8 n SER 24 Cb 0.34 0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.29 1cz8 n SER 24 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1cz8 s TYR 25 N -1.74 3.72 0.00 7.33 6.14 -1.02 -1.35 117.35 130.43 1cz8 s TYR 25 Ca 0.23 1.71 0.00 0.00 0.64 0.00 0.00 57.07 59.66 1cz8 s TYR 25 Cb 0.17 -3.13 0.00 0.00 0.42 0.00 0.00 41.96 39.42 1cz8 s TYR 25 CO 0.27 -0.06 0.00 0.00 0.64 0.00 0.00 175.55 176.40 1cz8 s HIS 27 N 0.00 -0.04 -0.15 0.00 -3.43 -0.36 -4.84 115.29 106.47 1cz8 s HIS 27 Ca 0.00 0.02 -0.29 0.00 -0.80 0.00 0.00 55.06 53.98 1cz8 s HIS 27 Cb 0.00 0.51 -0.04 0.00 -1.43 0.00 0.00 32.58 31.62 1cz8 s HIS 27 CO 0.00 -0.09 1.57 -2.14 -2.00 0.00 0.00 174.74 172.08 1cz8 s PRO 28 N -2.18 4.01 -0.04 -0.38 0.02 -1.26 -0.28 135.00 134.89 1cz8 s PRO 28 Ca 0.12 1.86 0.03 0.00 0.02 0.00 0.00 61.00 63.04 1cz8 s PRO 28 Cb 0.01 -3.97 0.00 0.00 0.02 0.00 0.00 34.50 30.56 1cz8 s PRO 28 CO -0.04 -1.03 -0.14 -1.50 -0.33 0.00 0.00 177.00 173.97 1cz8 s ILE 29 N 4.48 1.18 -0.25 2.83 1.10 0.10 -4.72 121.20 125.93 1cz8 s ILE 29 Ca 0.69 -0.57 -0.41 0.00 -0.51 0.00 0.00 60.65 59.86 1cz8 s ILE 29 Cb -0.28 -1.04 -0.17 0.00 0.15 0.00 0.00 42.46 41.13 1cz8 s ILE 29 CO 0.27 0.35 1.61 1.21 -2.11 0.00 0.00 174.94 176.27 1cz8 n GLU 30 N 3.31 0.84 -4.65 3.50 2.13 -1.26 -2.23 120.64 122.28 1cz8 n GLU 30 Ca -0.19 0.31 -0.25 0.00 0.66 0.00 0.00 57.16 57.68 1cz8 n GLU 30 Cb 0.53 -1.94 -0.17 0.00 0.27 0.00 0.00 31.44 30.14 1cz8 n GLU 30 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1cz8 s THR 31 N 2.71 1.23 -0.67 6.31 2.01 0.07 -4.90 115.64 122.39 1cz8 s THR 31 Ca 0.97 -0.54 -0.24 0.00 0.31 0.00 0.00 61.69 62.19 1cz8 s THR 31 Cb -1.15 -1.11 0.06 0.00 0.01 0.00 0.00 72.50 70.30 1cz8 s THR 31 CO 0.65 0.38 1.06 -0.76 -0.69 0.00 0.00 174.62 175.25 1cz8 s LEU 32 N 0.62 4.01 -0.08 4.42 1.43 -1.26 -0.66 118.68 127.15 1cz8 s LEU 32 Ca -0.15 -0.78 -0.16 0.00 -1.03 0.00 0.00 54.13 52.01 1cz8 s LEU 32 Cb -0.16 -2.50 -0.05 0.00 0.03 0.00 0.00 46.19 43.52 1cz8 s LEU 32 CO 0.04 -1.54 0.41 -0.69 0.23 0.00 0.00 176.35 174.80 1cz8 s VAL 33 N 4.54 5.15 -0.39 -1.59 1.01 0.10 -4.80 120.40 124.43 1cz8 s VAL 33 Ca 0.27 0.82 -0.29 0.00 0.00 0.00 0.00 61.98 62.78 1cz8 s VAL 33 Cb -0.14 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1cz8 s VAL 33 CO 0.12 0.43 1.53 -0.62 0.00 0.00 0.00 175.10 176.57 1cz8 s ASP 34 N -0.04 6.19 0.25 3.32 2.15 -1.26 -0.43 116.67 126.85 1cz8 s ASP 34 Ca 0.23 0.95 -0.04 0.00 0.43 0.00 0.00 52.55 54.12 1cz8 s ASP 34 Cb -0.15 -2.54 0.51 0.00 -0.30 0.00 0.00 42.92 40.44 1cz8 s ASP 34 CO 0.10 -1.53 1.67 0.40 -0.17 0.00 0.00 175.17 175.64 1cz8 h ILE 35 N 6.57 0.45 0.00 4.11 2.04 -1.27 0.26 117.51 129.67 1cz8 h ILE 35 Ca -0.29 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1cz8 h ILE 35 Cb 1.12 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1cz8 h ILE 35 CO 1.07 0.04 -0.08 0.15 0.00 0.00 0.00 178.15 179.33 1cz8 h PHE 36 N 0.24 0.00 0.53 1.37 3.57 -1.83 -1.71 116.94 119.11 1cz8 h PHE 36 Ca 0.44 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.92 1cz8 h PHE 36 Cb 0.79 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.53 1cz8 h PHE 36 CO -0.28 0.08 -0.26 0.37 -2.23 0.00 0.00 178.31 175.99 1cz8 h GLN 37 N 0.00 -0.69 -0.15 1.11 4.15 -0.86 -2.90 115.11 115.77 1cz8 h GLN 37 Ca -0.00 0.05 0.04 0.00 0.77 0.00 0.00 58.65 59.51 1cz8 h GLN 37 Cb 0.16 0.16 -0.07 0.00 0.21 0.00 0.00 27.48 27.94 1cz8 h GLN 37 CO 0.01 -0.39 -0.46 0.93 -1.93 0.00 0.00 178.83 176.99 1cz8 h GLU 38 N -0.92 -0.49 -3.72 1.69 4.39 -1.05 -3.14 114.58 111.33 1cz8 h GLU 38 Ca -0.07 0.03 -0.79 0.00 0.34 0.00 0.00 59.36 58.87 1cz8 h GLU 38 Cb 0.62 0.11 -0.27 0.00 -0.10 0.00 0.00 28.75 29.11 1cz8 h GLU 38 CO 0.12 -0.33 0.35 0.71 -1.16 0.00 0.00 179.01 178.70 1cz8 s TYR 39 N -5.83 4.04 -1.10 4.33 1.51 -0.70 -4.85 117.35 114.75 1cz8 s TYR 39 Ca -0.15 -2.39 0.09 0.00 -1.01 0.00 0.00 57.07 53.60 1cz8 s TYR 39 Cb 0.09 -3.85 0.40 0.00 -0.11 0.00 0.00 41.96 38.49 1cz8 s TYR 39 CO 0.63 -0.99 1.26 -0.35 -1.11 0.00 0.00 175.55 174.99 1cz8 n PRO 40 N 3.32 0.03 0.12 -1.71 -0.04 -1.10 -2.11 135.00 133.51 1cz8 n PRO 40 Ca 0.20 0.31 0.02 0.00 -0.04 0.00 0.00 63.50 64.00 1cz8 n PRO 40 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1cz8 n PRO 40 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1cz8 h ASP 41 N 0.00 0.00 0.00 3.54 3.32 -1.89 -3.36 116.42 118.04 1cz8 h ASP 41 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1cz8 h ASP 41 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1cz8 h ASP 41 CO 0.00 0.49 0.00 -0.62 -1.72 0.00 0.00 179.24 177.39 1cz8 n GLU 42 N -3.13 0.29 -0.36 3.56 -0.58 -0.90 -4.55 120.64 114.99 1cz8 n GLU 42 Ca -0.01 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.64 1cz8 n GLU 42 Cb 0.75 -1.35 -0.08 0.00 -0.57 0.00 0.00 31.44 30.18 1cz8 n GLU 42 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1cz8 n ILE 43 N 1.16 -0.57 1.54 -3.67 -5.35 -1.26 -1.52 119.36 109.68 1cz8 n ILE 43 Ca 0.00 2.11 0.00 0.00 -0.27 0.00 0.00 62.75 64.59 1cz8 n ILE 43 Cb 0.15 -2.61 0.00 0.00 -1.74 0.00 0.00 39.64 35.44 1cz8 n ILE 43 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1cz8 n GLU 44 N -5.01 0.95 -4.23 6.28 4.71 -1.26 -4.86 120.64 117.22 1cz8 n GLU 44 Ca 0.02 0.00 -0.23 0.00 -0.01 0.00 0.00 57.16 56.94 1cz8 n GLU 44 Cb 0.22 -1.18 -0.06 0.00 -1.01 0.00 0.00 31.44 29.41 1cz8 n GLU 44 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1cz8 s TYR 45 N -1.62 2.85 0.04 -0.32 1.51 -0.58 -4.58 117.35 114.66 1cz8 s TYR 45 Ca 0.00 -0.18 0.09 0.00 -1.01 0.00 0.00 57.07 55.97 1cz8 s TYR 45 Cb 0.00 -1.28 -0.03 0.00 -0.11 0.00 0.00 41.96 40.54 1cz8 s TYR 45 CO 0.00 0.58 -0.26 0.42 -1.11 0.00 0.00 175.55 175.18 1cz8 s ILE 46 N -2.20 2.08 0.10 2.71 1.01 0.08 -4.95 121.20 120.04 1cz8 s ILE 46 Ca 0.31 -1.36 0.09 0.00 0.00 0.00 0.00 60.65 59.69 1cz8 s ILE 46 Cb -0.07 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 1cz8 s ILE 46 CO 0.21 0.35 -0.22 -0.36 0.00 0.00 0.00 174.94 174.93 1cz8 s PHE 47 N -0.80 1.92 -0.22 3.97 0.40 -1.26 -1.55 117.98 120.44 1cz8 s PHE 47 Ca 0.11 -0.41 -0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1cz8 s PHE 47 Cb -0.10 -1.06 0.07 0.00 0.51 0.00 0.00 43.02 42.44 1cz8 s PHE 47 CO 0.02 0.22 0.04 0.15 0.70 0.00 0.00 175.22 176.35 1cz8 s LYS 48 N -1.87 0.74 0.90 0.44 -0.14 -0.76 -3.13 119.74 115.92 1cz8 s LYS 48 Ca 0.08 -0.58 -0.12 0.00 -1.36 0.00 0.00 55.97 54.00 1cz8 s LYS 48 Cb -0.10 -2.11 0.13 0.00 -1.68 0.00 0.00 37.83 34.07 1cz8 s LYS 48 CO 0.04 -0.70 1.11 -2.14 -0.76 0.00 0.00 175.35 172.90 1cz8 s PRO 49 N 1.79 1.23 0.08 -1.68 0.02 -1.26 -1.82 135.00 133.36 1cz8 s PRO 49 Ca 0.00 0.55 0.25 0.00 0.02 0.00 0.00 61.00 61.82 1cz8 s PRO 49 Cb -0.17 -1.83 0.46 0.00 0.02 0.00 0.00 34.50 32.98 1cz8 s PRO 49 CO -0.11 -2.19 1.39 -1.13 -0.33 0.00 0.00 177.00 174.63 1cz8 n SER 50 N -3.81 0.60 -4.11 2.53 3.41 -1.18 -4.89 113.62 106.17 1cz8 n SER 50 Ca 0.06 0.05 -0.10 0.00 -0.26 0.00 0.00 58.87 58.62 1cz8 n SER 50 Cb 0.57 0.13 -0.10 0.00 -0.26 0.00 0.00 64.21 64.54 1cz8 n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cz8 s VAL 52 N -2.90 1.11 -0.67 0.00 -7.23 0.43 -4.89 120.40 106.24 1cz8 s VAL 52 Ca 0.03 -1.43 -0.27 0.00 -1.81 0.00 0.00 61.98 58.50 1cz8 s VAL 52 Cb 0.00 -1.19 0.03 0.00 0.56 0.00 0.00 36.38 35.79 1cz8 s VAL 52 CO -0.04 -0.32 1.21 -2.16 -0.31 0.00 0.00 175.10 173.48 1cz8 s PRO 53 N -2.07 3.29 -0.08 4.82 0.04 -1.26 0.02 135.00 139.77 1cz8 s PRO 53 Ca 0.01 -0.13 0.04 0.00 0.04 0.00 0.00 61.00 60.95 1cz8 s PRO 53 Cb -0.08 -4.12 -0.01 0.00 0.04 0.00 0.00 34.50 30.32 1cz8 s PRO 53 CO 0.02 -1.94 -0.20 -0.51 0.04 0.00 0.00 177.00 174.41 1cz8 s LEU 54 N 5.26 2.33 -0.01 -3.56 1.43 0.16 -4.88 118.68 119.41 1cz8 s LEU 54 Ca 0.36 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 1cz8 s LEU 54 Cb -0.09 -1.47 -0.07 0.00 0.03 0.00 0.00 46.19 44.60 1cz8 s LEU 54 CO 0.18 0.22 1.73 -0.04 0.23 0.00 0.00 176.35 178.67 1cz8 s MET 55 N -0.02 4.18 -0.05 1.70 -1.94 -1.26 -0.75 119.30 121.15 1cz8 s MET 55 Ca -0.06 2.31 -0.08 0.00 -1.71 0.00 0.00 55.69 56.15 1cz8 s MET 55 Cb -0.15 -3.95 0.02 0.00 2.01 0.00 0.00 34.83 32.76 1cz8 s MET 55 CO 0.05 -0.85 0.20 0.50 -0.01 0.00 0.00 175.02 174.91 1cz8 s ARG 56 N 3.85 0.34 -0.15 2.03 6.06 -0.94 -0.78 118.95 129.36 1cz8 s ARG 56 Ca 0.77 0.07 -0.35 0.00 -2.50 0.00 0.00 55.73 53.72 1cz8 s ARG 56 Cb -0.37 0.16 -0.12 0.00 0.06 0.00 0.00 34.95 34.67 1cz8 s ARG 56 CO 0.33 -0.06 1.87 0.00 -2.50 0.00 0.00 175.30 174.94 1cz8 s GLY 58 N 4.19 -0.32 0.00 0.00 0.00 0.61 -4.87 107.32 106.94 1cz8 s GLY 58 Ca 0.95 0.73 0.00 0.00 0.00 0.00 0.00 44.72 46.40 1cz8 s GLY 58 CO 0.55 0.47 0.00 0.61 0.00 0.00 0.00 173.10 174.72 1cz8 n GLY 59 N 1.19 0.73 3.40 0.20 0.00 -1.26 -1.23 105.19 108.23 1cz8 n GLY 59 Ca -0.20 -2.05 -0.20 0.00 0.00 0.00 0.00 46.02 43.56 1cz8 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cz8 n ASN 62 N -0.81 -5.11 -3.41 0.00 3.02 -1.26 -4.93 115.26 102.76 1cz8 n ASN 62 Ca 0.02 -0.42 -0.08 0.00 -0.03 0.00 0.00 54.58 54.07 1cz8 n ASN 62 Cb 0.14 -4.13 -0.08 0.00 -0.61 0.00 0.00 39.78 35.10 1cz8 n ASN 62 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1cz8 s ASP 63 N -2.85 0.01 0.43 6.41 -1.08 -1.26 -5.02 116.67 113.31 1cz8 s ASP 63 Ca 0.42 0.46 0.17 0.00 -0.52 0.00 0.00 52.55 53.08 1cz8 s ASP 63 Cb -0.20 1.25 1.09 0.00 -1.46 0.00 0.00 42.92 43.59 1cz8 s ASP 63 CO 0.51 -0.28 1.91 -0.33 0.52 0.00 0.00 175.17 177.51 1cz8 h GLU 64 N 8.17 0.37 0.00 4.34 4.39 -2.05 -1.52 114.58 128.28 1cz8 h GLU 64 Ca -0.19 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.49 1cz8 h GLU 64 Cb 1.14 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1cz8 h GLU 64 CO 0.23 0.25 0.00 0.41 -1.16 0.00 0.00 179.01 178.74 1cz8 n GLY 65 N -1.53 -1.61 3.00 -3.84 0.00 -1.26 -4.90 105.19 95.05 1cz8 n GLY 65 Ca 0.15 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 1cz8 n GLY 65 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1cz8 n LEU 66 N -1.97 0.00 -3.59 0.99 4.77 -0.57 -2.37 117.00 114.25 1cz8 n LEU 66 Ca 0.06 -2.16 -0.13 0.00 -0.03 0.00 0.00 56.01 53.75 1cz8 n LEU 66 Cb 0.39 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.29 1cz8 n LEU 66 CO 0.29 -0.56 0.59 -1.83 -1.33 0.00 0.00 177.39 174.55 1cz8 s GLU 67 N -3.85 0.75 -0.17 3.23 -1.05 -0.70 -4.72 118.70 112.18 1cz8 s GLU 67 Ca 0.31 0.53 -0.28 0.00 -0.15 0.00 0.00 54.97 55.38 1cz8 s GLU 67 Cb -0.02 0.36 -0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1cz8 s GLU 67 CO 0.20 -0.16 0.96 0.00 0.95 0.00 0.00 175.26 177.20 1cz8 s VAL 69 N 2.48 0.22 0.23 0.00 -7.23 -0.82 -4.95 120.40 110.32 1cz8 s VAL 69 Ca 0.43 -1.71 -0.25 0.00 -1.81 0.00 0.00 61.98 58.64 1cz8 s VAL 69 Cb -0.17 -1.38 -0.09 0.00 0.56 0.00 0.00 36.38 35.31 1cz8 s VAL 69 CO 0.12 -0.94 0.83 -2.16 -0.31 0.00 0.00 175.10 172.64 1cz8 s PRO 70 N -3.64 4.54 -0.00 4.82 0.04 -1.26 -0.90 135.00 138.61 1cz8 s PRO 70 Ca 0.04 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1cz8 s PRO 70 Cb 0.06 -3.06 -0.00 0.00 0.04 0.00 0.00 34.50 31.54 1cz8 s PRO 70 CO -0.09 0.45 0.01 0.25 0.04 0.00 0.00 177.00 177.66 1cz8 n THR 71 N 1.11 0.00 -3.62 1.26 -2.24 0.26 -4.91 114.28 106.15 1cz8 n THR 71 Ca -0.02 -0.37 -0.20 0.00 -2.27 0.00 0.00 64.05 61.18 1cz8 n THR 71 Cb 0.49 0.87 -0.16 0.00 -2.10 0.00 0.00 70.33 69.44 1cz8 n THR 71 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1cz8 s GLU 72 N -1.28 0.05 0.43 -0.78 2.12 -1.12 -4.89 118.70 113.23 1cz8 s GLU 72 Ca 0.00 0.27 0.07 0.00 0.36 0.00 0.00 54.97 55.67 1cz8 s GLU 72 Cb 0.00 -0.96 -0.02 0.00 0.26 0.00 0.00 34.13 33.41 1cz8 s GLU 72 CO 0.01 -0.49 0.32 -1.21 -0.54 0.00 0.00 175.26 173.35 1cz8 s GLU 73 N 2.23 2.39 0.20 4.30 2.02 -1.26 0.15 118.70 128.72 1cz8 s GLU 73 Ca 0.04 -1.71 -0.23 0.00 0.02 0.00 0.00 54.97 53.10 1cz8 s GLU 73 Cb -0.14 -2.20 0.07 0.00 0.10 0.00 0.00 34.13 31.95 1cz8 s GLU 73 CO -0.07 -0.23 0.96 0.45 0.02 0.00 0.00 175.26 176.39 1cz8 s SER 74 N -4.08 -0.08 0.01 -0.19 0.15 -0.59 -4.75 113.70 104.17 1cz8 s SER 74 Ca 0.44 -0.62 0.08 0.00 0.70 0.00 0.00 55.95 56.55 1cz8 s SER 74 Cb -0.01 0.55 -0.02 0.00 -1.71 0.00 0.00 66.02 64.83 1cz8 s SER 74 CO 0.25 -1.05 -0.25 0.20 1.20 0.00 0.00 173.24 173.59 1cz8 s ASN 75 N -3.15 2.95 -0.02 5.45 0.02 -1.26 0.58 114.94 119.50 1cz8 s ASN 75 Ca 0.17 -0.51 0.06 0.00 -1.02 0.00 0.00 52.86 51.56 1cz8 s ASN 75 Cb -0.02 -0.30 -0.01 0.00 0.02 0.00 0.00 41.25 40.94 1cz8 s ASN 75 CO 0.05 0.27 -0.20 -0.51 0.02 0.00 0.00 177.10 176.73 1cz8 s ILE 76 N -0.69 1.58 -0.19 0.60 1.10 0.11 -4.90 121.20 118.81 1cz8 s ILE 76 Ca 0.10 -0.85 -0.03 0.00 -0.51 0.00 0.00 60.65 59.36 1cz8 s ILE 76 Cb -0.10 -1.32 -0.02 0.00 0.15 0.00 0.00 42.46 41.18 1cz8 s ILE 76 CO 0.01 0.45 -0.05 -0.89 -2.11 0.00 0.00 174.94 172.34 1cz8 s THR 77 N -0.40 3.52 0.06 4.00 2.01 -1.26 0.69 115.64 124.27 1cz8 s THR 77 Ca 0.06 -0.46 0.07 0.00 0.31 0.00 0.00 61.69 61.67 1cz8 s THR 77 Cb -0.08 -2.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1cz8 s THR 77 CO -0.00 0.45 -0.19 -0.04 -0.69 0.00 0.00 174.62 174.15 1cz8 s MET 78 N 0.99 1.20 -0.56 4.92 -1.94 0.15 -4.93 119.30 119.13 1cz8 s MET 78 Ca 0.00 -0.99 -0.27 0.00 -1.71 0.00 0.00 55.69 52.72 1cz8 s MET 78 Cb -0.15 -1.35 0.03 0.00 2.01 0.00 0.00 34.83 35.38 1cz8 s MET 78 CO 0.01 0.33 1.11 -0.65 -0.01 0.00 0.00 175.02 175.80 1cz8 s GLN 79 N -1.45 3.47 -0.12 2.03 -0.21 -1.26 -0.65 119.66 121.47 1cz8 s GLN 79 Ca 0.06 0.11 -0.00 0.00 0.02 0.00 0.00 55.36 55.55 1cz8 s GLN 79 Cb -0.09 -4.02 -0.02 0.00 1.00 0.00 0.00 33.01 29.88 1cz8 s GLN 79 CO 0.03 -1.60 -0.11 0.42 -2.12 0.00 0.00 175.29 171.90 1cz8 s ILE 80 N 4.61 3.25 -0.08 1.08 -1.09 -0.20 -4.86 121.20 123.91 1cz8 s ILE 80 Ca 0.39 -0.61 -0.26 0.00 -2.23 0.00 0.00 60.65 57.94 1cz8 s ILE 80 Cb -0.09 -2.36 -0.03 0.00 -1.58 0.00 0.00 42.46 38.41 1cz8 s ILE 80 CO 0.24 0.54 0.84 -0.32 -1.23 0.00 0.00 174.94 175.00 1cz8 s MET 81 N 0.09 4.44 -0.03 2.79 -2.45 -0.75 -2.21 119.30 121.16 1cz8 s MET 81 Ca -0.04 1.11 -0.02 0.00 -1.25 0.00 0.00 55.69 55.49 1cz8 s MET 81 Cb -0.14 -3.49 -0.04 0.00 1.25 0.00 0.00 34.83 32.41 1cz8 s MET 81 CO 0.04 -0.10 0.09 1.03 1.05 0.00 0.00 175.02 177.14 1cz8 s ARG 82 N 1.29 3.16 -0.10 4.11 0.52 0.75 -1.82 118.95 126.86 1cz8 s ARG 82 Ca 0.43 -0.40 -0.03 0.00 -0.52 0.00 0.00 55.73 55.20 1cz8 s ARG 82 Cb -0.18 -2.93 0.05 0.00 0.52 0.00 0.00 34.95 32.41 1cz8 s ARG 82 CO 0.20 0.68 0.14 0.42 0.02 0.00 0.00 175.30 176.75 1cz8 s ILE 83 N -1.15 -0.22 -0.39 1.52 1.01 -0.59 -1.88 121.20 119.51 1cz8 s ILE 83 Ca 0.21 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 61.09 1cz8 s ILE 83 Cb -0.12 -0.35 0.11 0.00 0.01 0.00 0.00 42.46 42.10 1cz8 s ILE 83 CO 0.12 0.05 0.15 -0.75 0.00 0.00 0.00 174.94 174.51 1cz8 s LYS 84 N 2.25 1.83 0.04 2.79 2.47 -0.48 -0.74 119.74 127.90 1cz8 s LYS 84 Ca 0.04 -1.84 -0.38 0.00 -1.56 0.00 0.00 55.97 52.22 1cz8 s LYS 84 Cb -0.13 -3.46 -0.19 0.00 -1.46 0.00 0.00 37.83 32.59 1cz8 s LYS 84 CO -0.06 -1.03 1.02 -2.30 0.16 0.00 0.00 175.35 173.14 1cz8 n PRO 85 N 4.47 0.12 0.00 4.03 -0.01 -1.26 -1.09 135.00 141.26 1cz8 n PRO 85 Ca -0.00 0.04 0.00 0.00 -0.01 0.00 0.00 63.50 63.53 1cz8 n PRO 85 Cb 0.42 -1.49 0.00 0.00 -0.01 0.00 0.00 33.50 32.41 1cz8 n PRO 85 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 175.50 176.21 1cz8 n HIS 86 N 1.39 0.00 -0.09 6.00 8.25 -1.26 -4.73 115.22 124.78 1cz8 n HIS 86 Ca 0.19 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.52 1cz8 n HIS 86 Cb 0.11 -0.04 -0.04 0.00 1.12 0.00 0.00 29.99 31.14 1cz8 n HIS 86 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1cz8 n GLN 87 N -1.93 0.50 -3.87 -0.41 6.02 -0.35 -5.13 117.38 112.22 1cz8 n GLN 87 Ca 0.00 0.20 -0.01 0.00 -0.01 0.00 0.00 57.00 57.19 1cz8 n GLN 87 Cb 0.00 -1.37 0.01 0.00 1.02 0.00 0.00 30.24 29.90 1cz8 n GLN 87 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1cz8 s GLY 88 N -4.99 -0.07 -0.28 1.08 0.00 -0.25 -5.01 107.32 97.80 1cz8 s GLY 88 Ca -0.29 -0.03 -0.18 0.00 0.00 0.00 0.00 44.72 44.22 1cz8 s GLY 88 CO 0.41 2.96 0.79 1.62 0.00 0.00 0.00 173.10 178.88 1cz8 s GLN 89 N -2.25 0.63 -0.12 2.90 -0.44 -1.26 -1.38 119.66 117.74 1cz8 s GLN 89 Ca 0.22 1.01 -0.33 0.00 -2.50 0.00 0.00 55.36 53.77 1cz8 s GLN 89 Cb -0.01 0.17 0.13 0.00 -1.64 0.00 0.00 33.01 31.66 1cz8 s GLN 89 CO 0.02 -0.12 1.14 -3.38 0.50 0.00 0.00 175.29 173.45 1cz8 s HIS 90 N 1.30 -0.16 0.49 1.67 -3.43 -0.79 -5.01 115.29 109.35 1cz8 s HIS 90 Ca -0.07 0.08 0.01 0.00 -0.80 0.00 0.00 55.06 54.28 1cz8 s HIS 90 Cb -0.05 0.53 0.01 0.00 -1.43 0.00 0.00 32.58 31.64 1cz8 s HIS 90 CO -0.15 -0.30 0.71 0.96 -2.00 0.00 0.00 174.74 173.95 1cz8 s ILE 91 N -2.59 3.37 -0.29 -5.38 -4.36 -1.26 -0.18 121.20 110.51 1cz8 s ILE 91 Ca 0.09 -0.61 0.00 0.00 -0.26 0.00 0.00 60.65 59.87 1cz8 s ILE 91 Cb -0.00 -3.25 0.00 0.00 1.25 0.00 0.00 42.46 40.46 1cz8 s ILE 91 CO -0.05 -0.17 0.00 0.61 0.24 0.00 0.00 174.94 175.57 1cz8 n GLY 92 N -2.17 -1.23 3.79 6.27 0.00 -0.94 -4.90 105.19 106.01 1cz8 n GLY 92 Ca 0.04 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 1cz8 n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cz8 s GLU 93 N -0.76 3.95 -0.01 1.61 2.02 -1.26 -1.03 118.70 123.21 1cz8 s GLU 93 Ca 0.00 0.02 0.03 0.00 0.02 0.00 0.00 54.97 55.04 1cz8 s GLU 93 Cb 0.00 -3.32 -0.01 0.00 0.10 0.00 0.00 34.13 30.90 1cz8 s GLU 93 CO 0.00 0.49 -0.09 -1.64 0.02 0.00 0.00 175.26 174.04 1cz8 s MET 94 N -0.26 0.72 -0.01 1.61 -1.94 0.17 -4.92 119.30 114.68 1cz8 s MET 94 Ca 0.16 -0.31 0.02 0.00 -1.71 0.00 0.00 55.69 53.85 1cz8 s MET 94 Cb -0.13 -0.70 -0.03 0.00 2.01 0.00 0.00 34.83 35.98 1cz8 s MET 94 CO 0.04 0.18 -0.04 -1.54 -0.01 0.00 0.00 175.02 173.65 1cz8 s SER 95 N -0.16 4.83 0.05 3.03 1.04 -1.26 0.31 113.70 121.54 1cz8 s SER 95 Ca 0.03 -0.07 0.03 0.00 0.48 0.00 0.00 55.95 56.42 1cz8 s SER 95 Cb -0.04 -1.20 -0.03 0.00 0.10 0.00 0.00 66.02 64.86 1cz8 s SER 95 CO -0.00 0.29 -0.11 -0.36 0.98 0.00 0.00 173.24 174.04 1cz8 s PHE 96 N -1.01 0.90 -0.21 5.02 0.08 0.22 -4.94 117.98 118.05 1cz8 s PHE 96 Ca 0.17 -0.48 -0.29 0.00 0.12 0.00 0.00 56.93 56.46 1cz8 s PHE 96 Cb -0.11 -0.52 0.00 0.00 -0.57 0.00 0.00 43.02 41.82 1cz8 s PHE 96 CO 0.08 -0.02 1.12 -1.17 -0.10 0.00 0.00 175.22 175.13 1cz8 s LEU 97 N -1.62 4.13 0.27 -0.37 2.96 -1.26 0.04 118.68 122.83 1cz8 s LEU 97 Ca -0.06 1.49 0.06 0.00 -0.22 0.00 0.00 54.13 55.39 1cz8 s LEU 97 Cb -0.10 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 1cz8 s LEU 97 CO 0.01 -0.71 0.37 -1.10 -1.32 0.00 0.00 176.35 173.61 1cz8 s GLN 98 N 3.32 3.29 -0.19 1.98 -1.52 0.19 -4.81 119.66 121.93 1cz8 s GLN 98 Ca 0.48 -0.87 0.00 0.00 -1.95 0.00 0.00 55.36 53.02 1cz8 s GLN 98 Cb -0.17 -2.83 0.01 0.00 -0.22 0.00 0.00 33.01 29.80 1cz8 s GLN 98 CO 0.09 0.32 -0.17 -1.01 -0.25 0.00 0.00 175.29 174.28 1cz8 s HIS 99 N -2.05 2.81 -0.10 0.91 3.76 0.04 -1.54 115.29 119.12 1cz8 s HIS 99 Ca 0.37 -1.46 0.20 0.00 -0.15 0.00 0.00 55.06 54.02 1cz8 s HIS 99 Cb -0.09 -1.95 -0.30 0.00 1.11 0.00 0.00 32.58 31.34 1cz8 s HIS 99 CO 0.29 -0.73 0.32 0.09 -0.85 0.00 0.00 174.74 173.86 1cz8 n ASN 100 N 4.61 0.02 -3.87 1.40 3.02 0.39 -4.47 115.26 116.36 1cz8 n ASN 100 Ca -0.20 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.21 1cz8 n ASN 100 Cb 0.50 1.61 -0.15 0.00 -0.61 0.00 0.00 39.78 41.13 1cz8 n ASN 100 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1cz8 s LYS 101 N -3.11 0.12 0.13 3.52 3.01 -0.64 -4.89 119.74 117.87 1cz8 s LYS 101 Ca -0.09 -0.01 0.05 0.00 -1.01 0.00 0.00 55.97 54.92 1cz8 s LYS 101 Cb 0.11 -0.17 -0.04 0.00 -1.01 0.00 0.00 37.83 36.72 1cz8 s LYS 101 CO 0.88 -0.01 -0.12 0.00 0.51 0.00 0.00 175.35 176.60 1cz8 s GLU 103 N -2.98 1.03 -0.40 0.00 2.02 -0.08 -4.84 118.70 113.45 1cz8 s GLU 103 Ca 0.11 0.08 -0.22 0.00 0.02 0.00 0.00 54.97 54.95 1cz8 s GLU 103 Cb -0.03 0.48 0.02 0.00 0.10 0.00 0.00 34.13 34.70 1cz8 s GLU 103 CO 0.02 -0.34 0.71 0.00 0.02 0.00 0.00 175.26 175.67 1cz8 s ARG 105 N 2.99 1.11 0.55 0.00 1.81 -0.49 -4.81 118.95 120.11 1cz8 s ARG 105 Ca 0.27 -1.24 -0.18 0.00 -1.72 0.00 0.00 55.73 52.86 1cz8 s ARG 105 Cb -0.13 -1.17 -0.10 0.00 -0.45 0.00 0.00 34.95 33.10 1cz8 s ARG 105 CO 0.19 0.25 0.40 -2.30 -0.68 0.00 0.00 175.30 173.15 1cz8 n PRO 106 N 0.69 0.41 0.00 3.54 -0.02 -1.26 -1.73 135.00 136.64 1cz8 n PRO 106 Ca -0.16 0.16 0.15 0.00 -2.02 0.00 0.00 63.50 61.63 1cz8 n PRO 106 Cb 0.56 -1.56 0.83 0.00 -0.02 0.00 0.00 33.50 33.31 1cz8 n PRO 106 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11