#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v80 s GLN 2 N 0.00 1.52 0.61 3.17 -0.21 -1.26 -3.84 119.66 119.65 1v80 s GLN 2 Ca 0.00 -1.98 -0.02 0.00 0.02 0.00 0.00 55.36 53.38 1v80 s GLN 2 Cb 0.00 -3.11 0.05 0.00 1.00 0.00 0.00 33.01 30.94 1v80 s GLN 2 CO 0.00 -0.99 0.87 0.96 -2.12 0.00 0.00 175.29 174.01 1v80 s ILE 3 N 0.68 2.51 0.40 1.08 -5.25 -0.69 0.44 121.20 120.36 1v80 s ILE 3 Ca 0.12 -0.51 0.03 0.00 -0.99 0.00 0.00 60.65 59.31 1v80 s ILE 3 Cb -0.21 -3.00 -0.03 0.00 2.95 0.00 0.00 42.46 42.17 1v80 s ILE 3 CO -0.07 0.00 0.09 -0.36 -1.79 0.00 0.00 174.94 172.81 1v80 s PHE 4 N -2.96 1.86 -0.06 1.37 0.08 0.51 0.18 117.98 118.97 1v80 s PHE 4 Ca 0.59 -1.14 -0.04 0.00 0.12 0.00 0.00 56.93 56.45 1v80 s PHE 4 Cb -0.10 -1.26 0.02 0.00 -0.57 0.00 0.00 43.02 41.11 1v80 s PHE 4 CO 0.41 -0.14 0.14 0.08 -0.10 0.00 0.00 175.22 175.61 1v80 s VAL 5 N -3.19 -0.01 -0.34 -0.44 1.01 0.40 0.38 120.40 118.21 1v80 s VAL 5 Ca 0.25 0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.23 1v80 s VAL 5 Cb 0.04 -0.21 0.05 0.00 0.00 0.00 0.00 36.38 36.26 1v80 s VAL 5 CO 0.13 0.02 0.09 -0.54 0.00 0.00 0.00 175.10 174.80 1v80 s LYS 6 N 0.37 2.51 0.13 2.72 1.02 -0.35 -1.43 119.74 124.72 1v80 s LYS 6 Ca -0.02 -1.27 -0.02 0.00 0.02 0.00 0.00 55.97 54.68 1v80 s LYS 6 Cb -0.04 -3.39 0.03 0.00 -0.52 0.00 0.00 37.83 33.91 1v80 s LYS 6 CO -0.02 -0.69 0.18 0.25 -0.92 0.00 0.00 175.35 174.15 1v80 n THR 7 N 4.74 0.00 0.04 2.17 -2.24 -1.05 0.20 114.28 118.14 1v80 n THR 7 Ca -0.12 -0.13 -0.02 0.00 -2.27 0.00 0.00 64.05 61.51 1v80 n THR 7 Cb 0.44 -1.92 0.24 0.00 -2.10 0.00 0.00 70.33 66.99 1v80 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1v80 h LEU 8 N 0.00 0.40 0.00 3.22 3.38 -1.88 -1.24 115.31 119.19 1v80 h LEU 8 Ca -0.06 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1v80 h LEU 8 Cb 0.16 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1v80 h LEU 8 CO 0.04 0.65 0.00 1.07 0.09 0.00 0.00 178.44 180.29 1v80 n THR 9 N -4.14 0.02 0.00 0.22 5.66 -1.26 -4.88 114.28 109.90 1v80 n THR 9 Ca -0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1v80 n THR 9 Cb 0.38 -0.51 0.00 0.00 -1.55 0.00 0.00 70.33 68.65 1v80 n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1v80 n GLY 10 N 1.26 3.14 2.95 1.09 0.00 -0.47 -4.99 105.19 108.17 1v80 n GLY 10 Ca 0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.71 1v80 n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1v80 n LYS 11 N -1.74 0.00 -3.64 1.61 4.81 -1.26 -4.30 118.16 113.64 1v80 n LYS 11 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 1v80 n LYS 11 Cb 0.00 -1.02 -0.12 0.00 0.02 0.00 0.00 35.03 33.92 1v80 n LYS 11 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1v80 s THR 12 N -0.54 4.67 -0.20 3.15 2.01 -1.25 -2.53 115.64 120.94 1v80 s THR 12 Ca 0.64 -0.42 -0.06 0.00 0.31 0.00 0.00 61.69 62.16 1v80 s THR 12 Cb -0.91 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 68.18 1v80 s THR 12 CO 0.48 0.05 0.02 -0.63 -0.69 0.00 0.00 174.62 173.86 1v80 s ILE 13 N 1.62 4.20 0.33 1.82 1.09 -0.51 -4.88 121.20 124.88 1v80 s ILE 13 Ca 0.05 -0.23 -0.25 0.00 -1.10 0.00 0.00 60.65 59.11 1v80 s ILE 13 Cb -0.17 -2.91 -0.10 0.00 -1.06 0.00 0.00 42.46 38.22 1v80 s ILE 13 CO 0.07 0.42 0.94 -0.89 -0.10 0.00 0.00 174.94 175.38 1v80 s THR 14 N 0.90 4.24 0.15 2.92 2.01 -1.26 -0.46 115.64 124.14 1v80 s THR 14 Ca 0.02 1.78 0.05 0.00 0.31 0.00 0.00 61.69 63.85 1v80 s THR 14 Cb -0.14 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1v80 s THR 14 CO 0.02 0.09 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.18 1v80 s LEU 15 N -2.17 2.53 -0.48 4.42 2.01 0.49 -4.94 118.68 120.53 1v80 s LEU 15 Ca 0.51 -1.00 0.08 0.00 0.01 0.00 0.00 54.13 53.74 1v80 s LEU 15 Cb -0.18 -0.39 0.33 0.00 0.01 0.00 0.00 46.19 45.96 1v80 s LEU 15 CO 0.23 -0.30 0.80 1.21 1.01 0.00 0.00 176.35 179.30 1v80 n GLU 16 N -0.16 2.02 -1.00 1.70 2.13 -1.26 -1.71 120.64 122.36 1v80 n GLU 16 Ca -0.10 -4.09 -0.05 0.00 0.66 0.00 0.00 57.16 53.58 1v80 n GLU 16 Cb 0.60 -1.93 0.03 0.00 0.27 0.00 0.00 31.44 30.41 1v80 n GLU 16 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1v80 n VAL 17 N 0.21 0.00 -4.33 6.31 0.24 -1.25 -4.97 118.33 114.54 1v80 n VAL 17 Ca 0.28 -0.32 -0.18 0.00 -2.04 0.00 0.00 64.34 62.08 1v80 n VAL 17 Cb 0.52 -1.30 -0.10 0.00 -1.47 0.00 0.00 33.84 31.49 1v80 n VAL 17 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1v80 s GLU 18 N -2.96 1.29 0.00 7.34 -1.05 -1.26 -4.22 118.70 117.84 1v80 s GLU 18 Ca 0.14 -1.58 0.23 0.00 -0.15 0.00 0.00 54.97 53.61 1v80 s GLU 18 Cb -0.01 -1.00 1.30 0.00 -0.44 0.00 0.00 34.13 33.99 1v80 s GLU 18 CO 0.09 0.14 1.77 -0.35 0.95 0.00 0.00 175.26 177.86 1v80 n PRO 19 N -0.36 0.55 0.00 -4.83 -0.04 -1.26 -2.00 135.00 127.06 1v80 n PRO 19 Ca -0.08 0.03 0.06 0.00 -0.04 0.00 0.00 63.50 63.47 1v80 n PRO 19 Cb 0.61 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.55 1v80 n PRO 19 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1v80 n SER 20 N -1.13 1.09 -2.30 3.54 7.64 -1.26 -1.60 113.62 119.60 1v80 n SER 20 Ca 0.15 -1.04 -0.03 0.00 1.01 0.00 0.00 58.87 58.95 1v80 n SER 20 Cb 0.13 0.64 0.02 0.00 -1.01 0.00 0.00 64.21 63.98 1v80 n SER 20 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1v80 n ASP 21 N -0.54 -0.29 -4.50 6.43 8.00 -0.85 -4.94 116.55 119.86 1v80 n ASP 21 Ca 0.04 -0.92 -0.24 0.00 0.71 0.00 0.00 54.79 54.39 1v80 n ASP 21 Cb 0.23 -0.10 -0.11 0.00 -0.02 0.00 0.00 41.12 41.12 1v80 n ASP 21 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1v80 s THR 22 N -1.26 1.62 0.03 -3.53 2.01 -1.26 -3.72 115.64 109.52 1v80 s THR 22 Ca 0.07 -2.05 -0.25 0.00 0.31 0.00 0.00 61.69 59.78 1v80 s THR 22 Cb -0.00 -2.76 -0.18 0.00 0.01 0.00 0.00 72.50 69.57 1v80 s THR 22 CO 0.05 -0.09 1.46 0.40 -0.69 0.00 0.00 174.62 175.76 1v80 h ILE 23 N 2.05 1.19 -0.24 1.82 1.08 -1.74 -2.12 117.51 119.54 1v80 h ILE 23 Ca -0.42 -0.64 0.07 0.00 -0.39 0.00 0.00 64.86 63.49 1v80 h ILE 23 Cb 1.24 1.62 -0.01 0.00 -3.07 0.00 0.00 36.82 36.60 1v80 h ILE 23 CO 0.72 0.16 0.35 1.05 -0.69 0.00 0.00 178.15 179.74 1v80 h GLU 24 N -0.30 0.00 0.03 2.37 4.11 -1.81 0.83 114.58 119.80 1v80 h GLU 24 Ca -0.00 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.21 1v80 h GLU 24 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1v80 h GLU 24 CO 0.00 0.00 -1.04 -0.91 0.07 0.00 0.00 179.01 177.14 1v80 h ASN 25 N 0.00 0.10 0.09 3.06 2.35 -1.78 -2.55 115.58 116.84 1v80 h ASN 25 Ca 0.11 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1v80 h ASN 25 Cb 0.81 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1v80 h ASN 25 CO -0.00 1.07 -0.04 0.58 -1.65 0.00 0.00 177.43 177.38 1v80 h VAL 26 N 0.02 1.14 -0.70 2.81 2.07 0.12 -3.12 116.25 118.58 1v80 h VAL 26 Ca -0.04 -1.29 0.09 0.00 0.82 0.00 0.00 66.70 66.29 1v80 h VAL 26 Cb 1.79 1.90 -0.07 0.00 -1.52 0.00 0.00 31.29 33.39 1v80 h VAL 26 CO 0.14 0.29 0.34 0.11 0.02 0.00 0.00 177.57 178.48 1v80 h LYS 27 N -0.76 0.56 -0.95 1.57 1.57 -1.12 0.33 116.57 117.75 1v80 h LYS 27 Ca -0.01 -0.03 0.26 0.00 -1.87 0.00 0.00 60.65 58.99 1v80 h LYS 27 Cb 0.57 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.71 1v80 h LYS 27 CO 0.02 0.37 0.66 0.00 -0.57 0.00 0.00 179.45 179.93 1v80 h ALA 28 N 1.43 2.66 0.02 3.86 0.00 -1.48 1.31 119.26 127.06 1v80 h ALA 28 Ca 0.35 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 55.05 1v80 h ALA 28 Cb 0.38 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1v80 h ALA 28 CO -0.28 -0.95 -0.92 0.87 0.00 0.00 0.00 179.25 177.96 1v80 h LYS 29 N 0.14 0.12 0.00 0.00 1.57 -0.31 -2.97 116.57 115.11 1v80 h LYS 29 Ca 0.48 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 59.09 1v80 h LYS 29 Cb 1.64 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.99 1v80 h LYS 29 CO -0.08 0.96 -0.08 0.82 -0.57 0.00 0.00 179.45 180.49 1v80 h ILE 30 N 0.06 0.20 0.08 1.86 1.08 0.23 0.41 117.51 121.43 1v80 h ILE 30 Ca -0.04 -0.80 -0.00 0.00 -0.39 0.00 0.00 64.86 63.62 1v80 h ILE 30 Cb 1.59 1.67 0.00 0.00 -3.07 0.00 0.00 36.82 37.01 1v80 h ILE 30 CO 0.13 0.08 -0.04 1.56 -0.69 0.00 0.00 178.15 179.20 1v80 h GLN 31 N 0.00 -0.10 0.00 2.37 7.50 -0.59 -2.57 115.11 121.71 1v80 h GLN 31 Ca -0.00 0.01 -0.05 0.00 0.50 0.00 0.00 58.65 59.11 1v80 h GLN 31 Cb 0.66 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 28.21 1v80 h GLN 31 CO 0.01 0.21 -0.27 0.22 -1.50 0.00 0.00 178.83 177.50 1v80 h ASP 32 N -0.42 0.00 -0.89 1.46 3.58 -1.58 1.72 116.42 120.29 1v80 h ASP 32 Ca -0.01 -0.90 0.20 0.00 0.42 0.00 0.00 57.03 56.75 1v80 h ASP 32 Cb 0.36 -0.00 -0.17 0.00 1.72 0.00 0.00 39.33 41.24 1v80 h ASP 32 CO 0.02 1.11 -0.13 0.29 -2.88 0.00 0.00 179.24 177.65 1v80 n LYS 33 N -4.57 -0.08 -0.07 0.28 4.76 0.14 -0.38 118.16 118.24 1v80 n LYS 33 Ca -0.15 1.37 -0.04 0.00 -2.87 0.00 0.00 58.31 56.62 1v80 n LYS 33 Cb 0.52 -2.09 -0.16 0.00 -1.84 0.00 0.00 35.03 31.46 1v80 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1v80 n GLU 34 N -5.39 0.71 -0.57 1.97 -0.58 -0.97 -4.99 120.64 110.81 1v80 n GLU 34 Ca 0.17 -0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 1v80 n GLU 34 Cb 0.54 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.90 1v80 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1v80 n GLY 35 N 1.63 0.66 3.90 0.62 0.00 0.52 -5.06 105.19 107.46 1v80 n GLY 35 Ca -0.25 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 1v80 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v80 s ILE 36 N -2.00 5.23 0.48 -0.61 1.01 0.21 -4.89 121.20 120.63 1v80 s ILE 36 Ca 0.00 -0.00 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 1v80 s ILE 36 Cb 0.00 -3.62 -0.09 0.00 0.01 0.00 0.00 42.46 38.77 1v80 s ILE 36 CO 0.00 0.13 1.04 -2.16 0.00 0.00 0.00 174.94 173.94 1v80 s PRO 37 N -2.43 3.82 0.00 2.79 0.04 -1.26 -4.11 135.00 133.84 1v80 s PRO 37 Ca 0.37 1.36 0.22 0.00 0.04 0.00 0.00 61.00 63.00 1v80 s PRO 37 Cb -0.13 -2.11 1.33 0.00 0.04 0.00 0.00 34.50 33.64 1v80 s PRO 37 CO 0.23 -0.42 1.72 -0.35 0.04 0.00 0.00 177.00 178.23 1v80 n PRO 38 N -0.93 0.75 0.15 0.56 -0.04 -1.26 -2.91 135.00 131.32 1v80 n PRO 38 Ca 0.09 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.56 1v80 n PRO 38 Cb 0.52 -1.47 0.32 0.00 -0.04 0.00 0.00 33.50 32.84 1v80 n PRO 38 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1v80 h ASP 39 N 0.00 0.10 -1.15 3.54 1.82 -2.02 -3.15 116.42 115.56 1v80 h ASP 39 Ca 0.00 -0.04 -0.48 0.00 -0.39 0.00 0.00 57.03 56.12 1v80 h ASP 39 Cb 0.00 -0.03 -0.41 0.00 0.68 0.00 0.00 39.33 39.57 1v80 h ASP 39 CO 0.00 0.45 -0.92 0.00 -1.61 0.00 0.00 179.24 177.16 1v80 n GLN 40 N -4.10 2.61 -4.58 0.28 6.02 -1.14 -4.86 117.38 111.61 1v80 n GLN 40 Ca -0.02 -3.99 -0.24 0.00 -0.01 0.00 0.00 57.00 52.74 1v80 n GLN 40 Cb 0.41 -1.89 -0.14 0.00 1.02 0.00 0.00 30.24 29.64 1v80 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1v80 s GLN 41 N -3.45 1.29 -0.29 -1.09 -0.21 -1.19 -4.56 119.66 110.16 1v80 s GLN 41 Ca 0.40 -0.90 0.04 0.00 0.02 0.00 0.00 55.36 54.93 1v80 s GLN 41 Cb 0.41 -1.38 0.20 0.00 1.00 0.00 0.00 33.01 33.23 1v80 s GLN 41 CO -0.07 0.35 0.60 0.50 -2.12 0.00 0.00 175.29 174.55 1v80 s ARG 42 N -1.16 0.56 -0.08 2.91 3.52 -1.19 -4.88 118.95 118.63 1v80 s ARG 42 Ca 0.06 0.62 -0.28 0.00 -0.13 0.00 0.00 55.73 56.01 1v80 s ARG 42 Cb -0.09 0.30 -0.02 0.00 -1.56 0.00 0.00 34.95 33.58 1v80 s ARG 42 CO 0.02 -0.96 0.92 -0.51 -0.81 0.00 0.00 175.30 173.96 1v80 s LEU 43 N 2.84 4.28 0.03 -0.88 1.43 -1.25 -2.58 118.68 122.55 1v80 s LEU 43 Ca 0.12 1.46 0.06 0.00 -1.03 0.00 0.00 54.13 54.75 1v80 s LEU 43 Cb -0.11 -3.44 -0.02 0.00 0.03 0.00 0.00 46.19 42.65 1v80 s LEU 43 CO -0.25 -0.33 -0.18 -0.63 0.23 0.00 0.00 176.35 175.19 1v80 s ILE 44 N 1.54 1.45 0.03 -0.59 1.01 0.24 -4.08 121.20 120.80 1v80 s ILE 44 Ca 0.46 -1.02 0.08 0.00 0.00 0.00 0.00 60.65 60.17 1v80 s ILE 44 Cb -0.19 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 1v80 s ILE 44 CO 0.20 0.21 -0.25 0.12 0.00 0.00 0.00 174.94 175.22 1v80 s PHE 45 N -0.70 2.17 -1.75 3.97 5.36 -0.97 0.21 117.98 126.25 1v80 s PHE 45 Ca 0.06 -0.40 -0.16 0.00 -0.96 0.00 0.00 56.93 55.47 1v80 s PHE 45 Cb -0.08 -1.32 0.15 0.00 -0.34 0.00 0.00 43.02 41.43 1v80 s PHE 45 CO 0.01 0.08 0.44 0.00 -1.46 0.00 0.00 175.22 174.29 1v80 n ALA 46 N 1.94 -1.48 -3.97 11.12 0.00 -1.26 0.18 120.51 127.04 1v80 n ALA 46 Ca -0.17 -0.25 -0.29 0.00 0.00 0.00 0.00 53.44 52.73 1v80 n ALA 46 Cb 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.89 1v80 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v80 n GLY 47 N -1.57 -0.38 3.05 0.00 0.00 -1.26 -4.96 105.19 100.06 1v80 n GLY 47 Ca -0.03 0.16 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 1v80 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v80 s LYS 48 N -6.59 0.63 0.26 1.61 -2.85 0.48 -5.12 119.74 108.16 1v80 s LYS 48 Ca 0.42 -0.53 -0.30 0.00 -1.00 0.00 0.00 55.97 54.57 1v80 s LYS 48 Cb -0.22 -0.55 -0.10 0.00 -2.06 0.00 0.00 37.83 34.89 1v80 s LYS 48 CO 0.87 0.14 1.47 -0.65 0.10 0.00 0.00 175.35 177.27 1v80 s GLN 49 N -0.84 4.24 0.16 1.78 -0.21 -1.26 -2.30 119.66 121.22 1v80 s GLN 49 Ca -0.02 2.36 0.06 0.00 0.02 0.00 0.00 55.36 57.78 1v80 s GLN 49 Cb -0.06 -3.09 -0.04 0.00 1.00 0.00 0.00 33.01 30.82 1v80 s GLN 49 CO 0.00 -0.46 0.09 -0.51 -2.12 0.00 0.00 175.29 172.29 1v80 s LEU 50 N -0.51 3.64 0.11 2.90 1.02 -1.26 -4.90 118.68 119.69 1v80 s LEU 50 Ca 0.59 -0.21 0.09 0.00 0.02 0.00 0.00 54.13 54.62 1v80 s LEU 50 Cb -0.43 -2.26 -0.04 0.00 0.02 0.00 0.00 46.19 43.48 1v80 s LEU 50 CO 0.45 0.08 -0.22 -1.61 0.02 0.00 0.00 176.35 175.07 1v80 s GLU 51 N -3.01 1.21 0.00 1.70 2.02 -1.26 -5.00 118.70 114.35 1v80 s GLU 51 Ca 0.30 -1.23 0.28 0.00 0.02 0.00 0.00 54.97 54.34 1v80 s GLU 51 Cb -0.10 -1.51 1.55 0.00 0.10 0.00 0.00 34.13 34.17 1v80 s GLU 51 CO 0.22 0.35 2.01 -0.25 0.02 0.00 0.00 175.26 177.60 1v80 n ASP 52 N 0.98 0.00 -0.02 -0.19 8.00 -1.26 -2.62 116.55 121.44 1v80 n ASP 52 Ca -0.19 -0.46 0.08 0.00 0.71 0.00 0.00 54.79 54.93 1v80 n ASP 52 Cb 0.54 -0.16 -0.16 0.00 -0.02 0.00 0.00 41.12 41.31 1v80 n ASP 52 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1v80 n GLY 53 N 0.96 -1.01 0.19 0.44 0.00 -1.26 -4.58 105.19 99.92 1v80 n GLY 53 Ca 0.17 -0.49 -0.01 0.00 0.00 0.00 0.00 46.02 45.69 1v80 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v80 n ARG 54 N -2.34 -0.12 -3.82 1.61 5.12 -1.08 -5.04 116.66 110.99 1v80 n ARG 54 Ca -0.08 -0.10 -0.09 0.00 -1.93 0.00 0.00 57.85 55.65 1v80 n ARG 54 Cb 0.65 -0.07 -0.07 0.00 -1.16 0.00 0.00 32.46 31.81 1v80 n ARG 54 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1v80 s THR 55 N -1.14 0.13 0.07 0.55 -4.23 -1.26 -4.21 115.64 105.55 1v80 s THR 55 Ca 0.04 -1.09 -0.27 0.00 -1.18 0.00 0.00 61.69 59.19 1v80 s THR 55 Cb -0.00 -1.31 -0.17 0.00 1.34 0.00 0.00 72.50 72.36 1v80 s THR 55 CO 0.03 -0.60 1.62 -0.07 -0.54 0.00 0.00 174.62 175.05 1v80 h LEU 56 N 2.71 -0.29 -2.87 4.79 3.38 -1.74 0.44 115.31 121.72 1v80 h LEU 56 Ca -0.34 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1v80 h LEU 56 Cb 1.21 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1v80 h LEU 56 CO 0.55 -0.15 0.02 0.77 0.09 0.00 0.00 178.44 179.71 1v80 h SER 57 N -0.41 0.00 0.96 -0.43 4.64 -1.50 0.52 113.55 117.32 1v80 h SER 57 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1v80 h SER 57 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1v80 h SER 57 CO 0.06 0.00 -1.03 0.47 -0.87 0.00 0.00 176.83 175.46 1v80 n ASP 58 N -3.19 0.82 -0.68 4.97 8.00 -0.51 -3.70 116.55 122.26 1v80 n ASP 58 Ca -0.03 0.31 0.12 0.00 0.71 0.00 0.00 54.79 55.90 1v80 n ASP 58 Cb 0.09 0.49 0.16 0.00 -0.02 0.00 0.00 41.12 41.84 1v80 n ASP 58 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1v80 n TYR 59 N -2.65 0.00 -0.99 1.24 4.01 0.15 -4.88 117.16 114.03 1v80 n TYR 59 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1v80 n TYR 59 Cb 0.55 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 1v80 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1v80 n ASN 60 N 0.57 -2.37 -4.76 7.72 3.02 0.56 -4.98 115.26 115.02 1v80 n ASN 60 Ca 0.13 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.27 1v80 n ASN 60 Cb 0.50 -0.56 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 1v80 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1v80 s ILE 61 N -2.42 2.42 0.00 2.41 1.01 0.26 -4.97 121.20 119.91 1v80 s ILE 61 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.04 1v80 s ILE 61 Cb 0.00 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.22 1v80 s ILE 61 CO 0.00 0.08 0.00 0.00 0.00 0.00 0.00 174.94 175.02 1v80 n GLN 62 N 1.52 1.95 -2.97 2.79 10.64 -1.26 -4.36 117.38 125.68 1v80 n GLN 62 Ca 0.04 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 54.88 1v80 n GLN 62 Cb 0.40 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.71 1v80 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 1v80 s LYS 63 N 1.12 4.16 -0.11 2.61 0.00 -1.26 -3.41 119.74 122.85 1v80 s LYS 63 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 55.97 56.90 1v80 s LYS 63 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 37.83 35.44 1v80 s LYS 63 CO 0.00 0.11 0.00 0.39 0.00 0.00 0.00 175.35 175.85 1v80 n GLU 64 N -0.32 -1.06 -2.54 1.78 1.02 0.17 -4.87 120.64 114.82 1v80 n GLU 64 Ca 0.04 0.33 -0.42 0.00 -0.02 0.00 0.00 57.16 57.09 1v80 n GLU 64 Cb 0.53 -4.16 -0.03 0.00 -0.02 0.00 0.00 31.44 27.76 1v80 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1v80 s SER 65 N -2.08 7.18 -0.18 1.62 0.01 -1.22 -4.68 113.70 114.35 1v80 s SER 65 Ca 0.00 1.82 -0.10 0.00 1.31 0.00 0.00 55.95 58.98 1v80 s SER 65 Cb 0.00 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.61 1v80 s SER 65 CO 0.00 -0.42 0.15 -0.89 0.41 0.00 0.00 173.24 172.49 1v80 s THR 66 N 1.35 5.41 0.06 1.44 2.01 -1.26 0.19 115.64 124.85 1v80 s THR 66 Ca 0.55 0.23 0.01 0.00 0.31 0.00 0.00 61.69 62.80 1v80 s THR 66 Cb -0.25 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 68.80 1v80 s THR 66 CO 0.26 0.47 0.08 0.18 -0.69 0.00 0.00 174.62 174.93 1v80 n LEU 67 N 3.21 0.00 -3.83 4.42 7.99 0.16 -4.62 117.00 124.33 1v80 n LEU 67 Ca -0.16 -0.26 -0.25 0.00 -0.01 0.00 0.00 56.01 55.33 1v80 n LEU 67 Cb 0.53 -0.04 -0.17 0.00 -0.11 0.00 0.00 43.42 43.62 1v80 n LEU 67 CO 0.36 -0.51 -0.41 -1.00 -1.51 0.00 0.00 177.39 174.32 1v80 s HIS 68 N 0.60 1.01 -0.37 -1.77 3.76 0.55 -1.20 115.29 117.87 1v80 s HIS 68 Ca 0.06 -0.42 -0.08 0.00 -0.15 0.00 0.00 55.06 54.47 1v80 s HIS 68 Cb -0.00 -0.99 0.05 0.00 1.11 0.00 0.00 32.58 32.75 1v80 s HIS 68 CO 0.04 -0.41 0.17 -1.17 -0.85 0.00 0.00 174.74 172.52 1v80 s LEU 69 N 1.86 4.65 0.00 0.89 2.96 0.53 0.81 118.68 130.39 1v80 s LEU 69 Ca 0.05 -1.20 0.00 0.00 -0.22 0.00 0.00 54.13 52.76 1v80 s LEU 69 Cb -0.12 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.62 1v80 s LEU 69 CO -0.07 -0.40 0.00 1.33 -1.32 0.00 0.00 176.35 175.90 1v80 n VAL 70 N 4.89 0.00 -2.75 1.68 0.24 -1.06 -2.81 118.33 118.52 1v80 n VAL 70 Ca -0.11 -1.31 -0.22 0.00 -2.04 0.00 0.00 64.34 60.65 1v80 n VAL 70 Cb 0.45 0.27 0.09 0.00 -1.47 0.00 0.00 33.84 33.17 1v80 n VAL 70 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1v80 s LEU 71 N 0.00 3.02 0.00 1.34 2.96 -1.26 -3.18 118.68 121.56 1v80 s LEU 71 Ca 0.00 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.37 1v80 s LEU 71 Cb 0.00 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.87 1v80 s LEU 71 CO 0.00 -1.70 0.06 0.54 -1.32 0.00 0.00 176.35 173.93 1v80 n ARG 72 N -2.63 0.48 -0.46 1.98 1.74 -1.26 -4.81 116.66 111.69 1v80 n ARG 72 Ca 0.16 -0.89 -0.28 0.00 -0.77 0.00 0.00 57.85 56.06 1v80 n ARG 72 Cb 0.61 0.61 0.26 0.00 -1.02 0.00 0.00 32.46 32.92 1v80 n ARG 72 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1v80 n LEU 73 N 0.00 -1.98 0.00 0.55 -0.00 -1.26 -4.99 117.00 109.32 1v80 n LEU 73 Ca 0.00 -0.23 -0.13 0.00 -0.00 0.00 0.00 56.01 55.66 1v80 n LEU 73 Cb 0.16 -1.22 0.12 0.00 -0.00 0.00 0.00 43.42 42.47 1v80 n LEU 73 CO 0.08 -3.40 0.19 -2.11 -0.00 0.00 0.00 177.39 172.15 1v80 n ARG 74 N -4.91 -2.72 -0.03 1.47 1.85 -1.26 -4.97 116.66 106.09 1v80 n ARG 74 Ca 0.02 -0.65 -0.04 0.00 -1.00 0.00 0.00 57.85 56.18 1v80 n ARG 74 Cb 0.55 -0.75 -0.01 0.00 -1.05 0.00 0.00 32.46 31.19 1v80 n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1v80 n GLY 75 N -1.70 -0.32 0.00 2.89 0.00 -1.26 -5.11 105.19 99.69 1v80 n GLY 75 Ca 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1v80 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93