#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 0.82 0.28 2.12 -0.21 -1.26 -3.75 119.66 117.66 1v80 s GLN 2 Ca 0.00 -1.33 -0.09 0.00 0.02 0.00 0.00 55.36 53.96 1v80 s GLN 2 Cb 0.00 -0.15 -0.00 0.00 1.00 0.00 0.00 33.01 33.86 1v80 s GLN 2 CO 0.00 -0.04 0.48 0.96 -2.12 0.00 0.00 175.29 174.57 1v80 s ILE 3 N -3.67 0.00 0.10 1.08 -4.36 0.20 0.19 121.20 114.74 1v80 s ILE 3 Ca 0.12 -1.47 0.02 0.00 -0.26 0.00 0.00 60.65 59.06 1v80 s ILE 3 Cb 0.06 -2.40 -0.01 0.00 1.25 0.00 0.00 42.46 41.36 1v80 s ILE 3 CO -0.05 0.00 0.06 0.49 0.24 0.00 0.00 174.94 175.68 1v80 n PHE 4 N -0.44 -0.13 -3.48 1.37 3.72 -0.51 0.22 117.46 118.21 1v80 n PHE 4 Ca -0.01 -0.74 -0.15 0.00 -0.05 0.00 0.00 57.45 56.50 1v80 n PHE 4 Cb 0.62 0.05 -0.04 0.00 -0.94 0.00 0.00 39.48 39.17 1v80 n PHE 4 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1v80 s VAL 5 N -2.23 0.00 -0.23 -4.37 0.11 -0.82 0.73 120.40 113.59 1v80 s VAL 5 Ca 0.09 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.16 1v80 s VAL 5 Cb 0.00 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.90 1v80 s VAL 5 CO 0.06 0.00 -0.11 -0.54 -3.33 0.00 0.00 175.10 171.18 1v80 s LYS 6 N -2.27 2.23 0.00 1.54 1.02 0.35 -2.67 119.74 119.94 1v80 s LYS 6 Ca -0.06 -1.11 0.00 0.00 0.02 0.00 0.00 55.97 54.82 1v80 s LYS 6 Cb -0.00 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.61 1v80 s LYS 6 CO 0.00 -0.49 0.00 0.25 -0.92 0.00 0.00 175.35 174.20 1v80 n THR 7 N 4.55 0.00 -0.22 2.17 -2.24 -1.21 0.19 114.28 117.52 1v80 n THR 7 Ca -0.15 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.58 1v80 n THR 7 Cb 0.45 -1.72 0.11 0.00 -2.10 0.00 0.00 70.33 67.06 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 0.97 -0.00 3.22 -0.00 -1.93 -1.01 115.31 116.55 1v80 h LEU 8 Ca 0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 57.88 57.70 1v80 h LEU 8 Cb 0.00 -0.25 0.00 0.00 -0.00 0.00 0.00 40.66 40.41 1v80 h LEU 8 CO 0.00 0.91 0.00 1.07 -0.00 0.00 0.00 178.44 180.42 1v80 n THR 9 N -4.26 0.09 0.00 0.22 5.66 -1.26 -4.89 114.28 109.85 1v80 n THR 9 Ca 0.05 -0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1v80 n THR 9 Cb 0.23 -0.53 0.00 0.00 -1.55 0.00 0.00 70.33 68.47 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 1.41 2.85 3.05 1.09 0.00 -0.39 -4.97 105.19 108.22 1v80 n GLY 10 Ca 0.07 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.54 1v80 n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1v80 n LYS 11 N -2.00 0.00 -3.01 1.61 5.02 -1.26 -4.25 118.16 114.28 1v80 n LYS 11 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 1v80 n LYS 11 Cb 0.00 -1.22 -0.05 0.00 -0.02 0.00 0.00 35.03 33.73 1v80 n LYS 11 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1v80 s THR 12 N 2.26 4.66 -0.23 -0.18 2.01 -1.26 -3.34 115.64 119.56 1v80 s THR 12 Ca 0.85 -0.03 -0.11 0.00 0.31 0.00 0.00 61.69 62.71 1v80 s THR 12 Cb -1.21 -4.38 -0.05 0.00 0.01 0.00 0.00 72.50 66.87 1v80 s THR 12 CO 0.65 -0.89 0.18 -0.63 -0.69 0.00 0.00 174.62 173.24 1v80 s ILE 13 N 3.24 5.35 0.47 1.82 1.09 -1.09 -4.89 121.20 127.18 1v80 s ILE 13 Ca 0.23 0.23 -0.18 0.00 -1.10 0.00 0.00 60.65 59.83 1v80 s ILE 13 Cb -0.15 -3.52 -0.09 0.00 -1.06 0.00 0.00 42.46 37.64 1v80 s ILE 13 CO 0.17 0.35 0.95 -0.89 -0.10 0.00 0.00 174.94 175.41 1v80 s THR 14 N 1.02 4.51 0.02 2.92 2.01 -1.26 -1.95 115.64 122.91 1v80 s THR 14 Ca 0.09 1.25 -0.04 0.00 0.31 0.00 0.00 61.69 63.30 1v80 s THR 14 Cb -0.13 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 1v80 s THR 14 CO 0.04 -0.53 0.06 -0.76 -0.69 0.00 0.00 174.62 172.74 1v80 s LEU 15 N -3.71 1.92 -0.64 4.42 1.43 0.60 -4.91 118.68 117.80 1v80 s LEU 15 Ca 0.59 -0.46 0.06 0.00 -1.03 0.00 0.00 54.13 53.29 1v80 s LEU 15 Cb -0.10 0.43 0.22 0.00 0.03 0.00 0.00 46.19 46.77 1v80 s LEU 15 CO 0.25 -0.41 0.64 1.21 0.23 0.00 0.00 176.35 178.27 1v80 n GLU 16 N 1.19 2.12 -4.02 1.70 2.13 -1.26 0.63 120.64 123.12 1v80 n GLU 16 Ca -0.21 -4.48 -0.22 0.00 0.66 0.00 0.00 57.16 52.90 1v80 n GLU 16 Cb 0.57 -2.19 -0.05 0.00 0.27 0.00 0.00 31.44 30.03 1v80 n GLU 16 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1v80 s VAL 17 N -1.99 3.25 0.36 6.31 -7.23 -1.25 -4.97 120.40 114.88 1v80 s VAL 17 Ca 0.34 -1.60 0.06 0.00 -1.81 0.00 0.00 61.98 58.98 1v80 s VAL 17 Cb 0.08 -3.05 -0.01 0.00 0.56 0.00 0.00 36.38 33.97 1v80 s VAL 17 CO -0.08 -0.20 0.50 -1.61 -0.31 0.00 0.00 175.10 173.41 1v80 s GLU 18 N -3.88 3.07 0.16 4.82 8.01 -1.26 -4.32 118.70 125.29 1v80 s GLU 18 Ca 0.38 -0.99 0.24 0.00 0.01 0.00 0.00 54.97 54.61 1v80 s GLU 18 Cb -0.04 -2.79 0.91 0.00 -4.31 0.00 0.00 34.13 27.90 1v80 s GLU 18 CO 0.24 -0.02 1.73 -0.35 0.01 0.00 0.00 175.26 176.87 1v80 n PRO 19 N -1.71 0.16 0.01 0.39 -0.04 -1.26 -2.36 135.00 130.18 1v80 n PRO 19 Ca 0.01 0.26 0.11 0.00 -0.04 0.00 0.00 63.50 63.84 1v80 n PRO 19 Cb 0.58 -1.73 -0.07 0.00 -0.04 0.00 0.00 33.50 32.24 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 -2.01 0.54 -3.07 3.54 7.64 -1.26 0.91 113.62 119.91 1v80 n SER 20 Ca 0.04 -0.33 -0.09 0.00 1.01 0.00 0.00 58.87 59.50 1v80 n SER 20 Cb 0.31 1.19 0.09 0.00 -1.01 0.00 0.00 64.21 64.79 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 -1.95 -2.64 -4.44 6.43 9.92 -1.00 -4.82 116.55 118.04 1v80 n ASP 21 Ca 0.01 -0.26 -0.21 0.00 -0.53 0.00 0.00 54.79 53.79 1v80 n ASP 21 Cb 0.45 -0.30 -0.10 0.00 -0.64 0.00 0.00 41.12 40.53 1v80 n ASP 21 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1v80 s THR 22 N -1.32 1.44 0.05 -3.53 2.01 -1.26 -3.61 115.64 109.43 1v80 s THR 22 Ca 0.20 -2.06 -0.21 0.00 0.31 0.00 0.00 61.69 59.93 1v80 s THR 22 Cb -0.03 -2.62 -0.13 0.00 0.01 0.00 0.00 72.50 69.73 1v80 s THR 22 CO 0.17 -0.16 1.47 0.40 -0.69 0.00 0.00 174.62 175.81 1v80 h ILE 23 N 2.19 1.26 -0.08 1.82 1.08 -1.75 -2.11 117.51 119.92 1v80 h ILE 23 Ca -0.40 -0.86 0.02 0.00 -0.39 0.00 0.00 64.86 63.23 1v80 h ILE 23 Cb 1.24 1.55 -0.00 0.00 -3.07 0.00 0.00 36.82 36.54 1v80 h ILE 23 CO 0.69 0.25 0.22 1.05 -0.69 0.00 0.00 178.15 179.68 1v80 h GLU 24 N -0.02 0.00 0.10 2.37 4.11 -1.85 0.47 114.58 119.76 1v80 h GLU 24 Ca 0.04 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.20 1v80 h GLU 24 Cb 0.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1v80 h GLU 24 CO 0.01 0.00 -1.30 -0.91 0.07 0.00 0.00 179.01 176.88 1v80 h ASN 25 N 0.00 0.34 0.32 3.06 2.35 -1.81 -2.68 115.58 117.15 1v80 h ASN 25 Ca 0.04 -0.39 -0.02 0.00 -0.55 0.00 0.00 56.30 55.38 1v80 h ASN 25 Cb 0.48 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1v80 h ASN 25 CO -0.00 1.31 -0.15 0.58 -1.65 0.00 0.00 177.43 177.52 1v80 h VAL 26 N 0.06 0.44 -0.73 2.81 2.07 0.38 -3.08 116.25 118.20 1v80 h VAL 26 Ca -0.15 -0.77 0.14 0.00 0.82 0.00 0.00 66.70 66.74 1v80 h VAL 26 Cb 1.96 0.71 -0.10 0.00 -1.52 0.00 0.00 31.29 32.34 1v80 h VAL 26 CO 0.18 0.10 0.27 0.11 0.02 0.00 0.00 177.57 178.25 1v80 h LYS 27 N -0.98 0.39 -0.99 1.57 1.57 -1.12 0.70 116.57 117.71 1v80 h LYS 27 Ca -0.04 -0.02 0.27 0.00 -1.87 0.00 0.00 60.65 58.99 1v80 h LYS 27 Cb 0.50 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 1v80 h LYS 27 CO 0.07 0.26 0.69 0.00 -0.57 0.00 0.00 179.45 179.91 1v80 h ALA 28 N 1.55 2.73 0.00 3.86 0.00 -1.49 1.59 119.26 127.50 1v80 h ALA 28 Ca 0.40 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 55.11 1v80 h ALA 28 Cb 0.62 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1v80 h ALA 28 CO -0.41 -1.04 -0.91 0.87 0.00 0.00 0.00 179.25 177.76 1v80 h LYS 29 N 0.12 0.00 0.00 0.00 1.57 0.46 -3.04 116.57 115.68 1v80 h LYS 29 Ca 0.49 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1v80 h LYS 29 Cb 1.74 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.05 1v80 h LYS 29 CO -0.08 0.91 -0.02 0.82 -0.57 0.00 0.00 179.45 180.51 1v80 h ILE 30 N 0.00 0.04 -0.16 1.86 1.08 0.31 0.46 117.51 121.10 1v80 h ILE 30 Ca -0.01 -0.72 -0.03 0.00 -0.39 0.00 0.00 64.86 63.71 1v80 h ILE 30 Cb 1.66 1.69 -0.01 0.00 -3.07 0.00 0.00 36.82 37.10 1v80 h ILE 30 CO 0.12 0.02 -0.02 1.56 -0.69 0.00 0.00 178.15 179.14 1v80 h GLN 31 N 0.00 0.30 0.00 2.37 7.50 -0.64 -2.73 115.11 121.92 1v80 h GLN 31 Ca -0.00 -0.10 -0.17 0.00 0.50 0.00 0.00 58.65 58.87 1v80 h GLN 31 Cb 0.69 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 28.17 1v80 h GLN 31 CO 0.00 0.54 -0.94 0.22 -1.50 0.00 0.00 178.83 177.15 1v80 h ASP 32 N 0.02 0.00 -0.84 1.46 3.58 -1.61 0.94 116.42 119.98 1v80 h ASP 32 Ca 0.04 -0.62 0.09 0.00 0.42 0.00 0.00 57.03 56.97 1v80 h ASP 32 Cb 0.42 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 41.36 1v80 h ASP 32 CO 0.01 1.36 -0.43 0.29 -2.88 0.00 0.00 179.24 177.59 1v80 n LYS 33 N -4.48 -0.31 -0.08 0.28 4.76 0.16 -2.64 118.16 115.85 1v80 n LYS 33 Ca -0.26 1.27 -0.12 0.00 -2.87 0.00 0.00 58.31 56.33 1v80 n LYS 33 Cb 0.63 -1.88 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 1v80 n LYS 33 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1v80 h GLU 34 N 0.00 0.00 0.00 1.97 4.39 -1.66 -3.50 114.58 115.78 1v80 h GLU 34 Ca 0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1v80 h GLU 34 Cb 0.40 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1v80 h GLU 34 CO -0.80 0.46 0.00 0.41 -1.16 0.00 0.00 179.01 177.92 1v80 n GLY 35 N 1.55 1.76 3.40 -3.84 0.00 0.24 -5.07 105.19 103.23 1v80 n GLY 35 Ca -0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 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 2.37 0.57 -0.61 1.09 -0.67 -4.98 121.20 116.97 1v80 s ILE 36 Ca 0.00 -1.60 -0.16 0.00 -1.10 0.00 0.00 60.65 57.78 1v80 s ILE 36 Cb 0.00 -2.03 -0.05 0.00 -1.06 0.00 0.00 42.46 39.32 1v80 s ILE 36 CO 0.00 0.16 1.05 -2.16 -0.10 0.00 0.00 174.94 173.89 1v80 s PRO 37 N -1.87 3.46 0.00 2.79 0.04 -1.26 -4.12 135.00 134.05 1v80 s PRO 37 Ca 0.14 1.20 0.20 0.00 0.04 0.00 0.00 61.00 62.58 1v80 s PRO 37 Cb -0.10 -2.05 1.20 0.00 0.04 0.00 0.00 34.50 33.58 1v80 s PRO 37 CO 0.06 -0.69 1.62 -0.35 0.04 0.00 0.00 177.00 177.68 1v80 n PRO 38 N -1.83 0.75 0.22 0.56 -0.04 -1.26 -2.50 135.00 130.90 1v80 n PRO 38 Ca 0.09 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 1v80 n PRO 38 Cb 0.53 -1.42 0.46 0.00 -0.04 0.00 0.00 33.50 33.04 1v80 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1v80 h ASP 39 N 0.00 0.00 0.00 3.54 5.19 -2.03 -3.26 116.42 119.86 1v80 h ASP 39 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1v80 h ASP 39 Cb 0.00 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 1v80 h ASP 39 CO 0.00 0.27 -1.11 0.00 -3.12 0.00 0.00 179.24 175.28 1v80 n GLN 40 N -3.55 2.19 -1.58 3.56 6.02 -1.12 -4.86 117.38 118.03 1v80 n GLN 40 Ca -0.01 -0.01 -0.39 0.00 -0.01 0.00 0.00 57.00 56.59 1v80 n GLN 40 Cb 0.41 -1.05 0.04 0.00 1.02 0.00 0.00 30.24 30.67 1v80 n GLN 40 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1v80 n GLN 41 N -1.86 0.93 -3.15 -1.09 1.13 -1.04 -3.38 117.38 108.92 1v80 n GLN 41 Ca -0.02 0.35 0.04 0.00 -1.94 0.00 0.00 57.00 55.43 1v80 n GLN 41 Cb 0.35 -2.03 -0.00 0.00 0.11 0.00 0.00 30.24 28.67 1v80 n GLN 41 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1v80 s ARG 42 N -2.41 0.54 -0.06 -1.09 3.52 -0.97 -4.89 118.95 113.59 1v80 s ARG 42 Ca 0.71 0.59 -0.30 0.00 -0.13 0.00 0.00 55.73 56.60 1v80 s ARG 42 Cb -0.46 0.28 -0.02 0.00 -1.56 0.00 0.00 34.95 33.19 1v80 s ARG 42 CO 0.51 -0.97 1.02 -1.17 -0.81 0.00 0.00 175.30 173.88 1v80 s LEU 43 N 2.84 4.29 -0.09 -0.88 2.96 -1.26 -1.74 118.68 124.79 1v80 s LEU 43 Ca 0.12 1.62 0.01 0.00 -0.22 0.00 0.00 54.13 55.65 1v80 s LEU 43 Cb -0.10 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.04 1v80 s LEU 43 CO -0.25 -0.40 -0.10 -0.63 -1.32 0.00 0.00 176.35 173.65 1v80 s ILE 44 N 1.67 1.11 -0.07 6.68 -1.09 0.16 -3.68 121.20 125.98 1v80 s ILE 44 Ca 0.51 -0.40 0.03 0.00 -2.23 0.00 0.00 60.65 58.56 1v80 s ILE 44 Cb -0.20 -1.07 -0.02 0.00 -1.58 0.00 0.00 42.46 39.58 1v80 s ILE 44 CO 0.22 0.37 -0.15 0.12 -1.23 0.00 0.00 174.94 174.27 1v80 s PHE 45 N 1.23 2.71 -1.59 3.97 5.36 -0.97 0.86 117.98 129.55 1v80 s PHE 45 Ca -0.04 -0.32 -0.03 0.00 -0.96 0.00 0.00 56.93 55.58 1v80 s PHE 45 Cb -0.14 -1.68 0.03 0.00 -0.34 0.00 0.00 43.02 40.89 1v80 s PHE 45 CO -0.03 0.06 0.11 0.00 -1.46 0.00 0.00 175.22 173.90 1v80 n ALA 46 N 2.66 -1.90 -4.03 11.12 0.00 -1.26 0.11 120.51 127.21 1v80 n ALA 46 Ca -0.17 -0.38 -0.27 0.00 0.00 0.00 0.00 53.44 52.62 1v80 n ALA 46 Cb 0.52 -1.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.86 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 -2.35 -0.23 2.87 0.00 0.00 -1.26 -4.96 105.19 99.27 1v80 n GLY 47 Ca -0.27 0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1v80 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1v80 s LYS 48 N -6.70 0.01 0.36 1.61 2.20 0.30 -5.13 119.74 112.39 1v80 s LYS 48 Ca 0.07 0.05 -0.28 0.00 -0.36 0.00 0.00 55.97 55.44 1v80 s LYS 48 Cb -0.04 -0.03 -0.11 0.00 -1.51 0.00 0.00 37.83 36.15 1v80 s LYS 48 CO 0.91 -0.03 1.47 -1.14 -0.36 0.00 0.00 175.35 176.20 1v80 s GLN 49 N 0.16 4.15 0.23 4.03 0.74 -1.26 -2.30 119.66 125.41 1v80 s GLN 49 Ca -0.01 2.51 0.08 0.00 0.05 0.00 0.00 55.36 57.99 1v80 s GLN 49 Cb -0.02 -2.99 -0.04 0.00 1.10 0.00 0.00 33.01 31.06 1v80 s GLN 49 CO -0.00 -0.49 0.03 -0.51 -0.55 0.00 0.00 175.29 173.76 1v80 s LEU 50 N -1.82 3.34 0.11 3.68 1.02 -1.24 -4.89 118.68 118.88 1v80 s LEU 50 Ca 0.54 -0.48 -0.09 0.00 0.02 0.00 0.00 54.13 54.12 1v80 s LEU 50 Cb -0.45 -1.92 -0.00 0.00 0.02 0.00 0.00 46.19 43.84 1v80 s LEU 50 CO 0.59 0.03 0.22 -1.83 0.02 0.00 0.00 176.35 175.38 1v80 s GLU 51 N -3.40 0.94 0.20 1.70 -1.05 -1.26 -4.97 118.70 110.86 1v80 s GLU 51 Ca 0.30 -1.03 0.26 0.00 -0.15 0.00 0.00 54.97 54.35 1v80 s GLU 51 Cb -0.08 0.35 0.86 0.00 -0.44 0.00 0.00 34.13 34.82 1v80 s GLU 51 CO 0.20 -0.32 1.78 -0.40 0.95 0.00 0.00 175.26 177.48 1v80 n ASP 52 N -0.11 0.74 0.02 0.83 5.68 -1.26 -2.69 116.55 119.75 1v80 n ASP 52 Ca -0.12 0.58 0.14 0.00 -0.50 0.00 0.00 54.79 54.88 1v80 n ASP 52 Cb 0.63 -0.77 0.56 0.00 -1.14 0.00 0.00 41.12 40.39 1v80 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1v80 n GLY 53 N 1.18 -1.52 0.00 6.12 0.00 -1.26 -4.68 105.19 105.04 1v80 n GLY 53 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.63 1.46 -3.85 1.61 5.12 -1.10 -5.12 116.66 113.16 1v80 n ARG 54 Ca 0.07 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.89 1v80 n ARG 54 Cb 0.36 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.60 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 0.95 0.06 0.04 0.55 -4.23 -1.26 -4.31 115.64 107.43 1v80 s THR 55 Ca 0.00 -1.09 -0.25 0.00 -1.18 0.00 0.00 61.69 59.17 1v80 s THR 55 Cb 0.00 -1.65 -0.17 0.00 1.34 0.00 0.00 72.50 72.01 1v80 s THR 55 CO 0.00 -0.26 1.47 -0.07 -0.54 0.00 0.00 174.62 175.21 1v80 h LEU 56 N 2.42 -0.16 -2.62 4.79 3.38 -1.65 0.85 115.31 122.31 1v80 h LEU 56 Ca -0.31 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1v80 h LEU 56 Cb 1.24 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1v80 h LEU 56 CO 0.45 0.09 0.00 -1.28 0.09 0.00 0.00 178.44 177.79 1v80 h SER 57 N -0.42 0.00 0.36 -0.43 0.87 0.39 0.88 113.55 115.19 1v80 h SER 57 Ca -0.02 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.22 1v80 h SER 57 Cb 0.33 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.25 1v80 h SER 57 CO 0.03 0.00 -1.81 0.47 -0.53 0.00 0.00 176.83 174.99 1v80 n ASP 58 N -3.00 1.31 -0.55 6.23 8.00 -0.79 -3.81 116.55 123.94 1v80 n ASP 58 Ca -0.02 0.34 0.03 0.00 0.71 0.00 0.00 54.79 55.85 1v80 n ASP 58 Cb 0.10 -0.34 0.11 0.00 -0.02 0.00 0.00 41.12 40.97 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 -3.20 0.39 -1.03 1.24 4.01 0.29 -4.83 117.16 114.03 1v80 n TYR 59 Ca -0.22 -0.17 -0.01 0.00 -0.16 0.00 0.00 57.90 57.34 1v80 n TYR 59 Cb 1.05 -0.05 -0.00 0.00 -0.31 0.00 0.00 39.34 40.02 1v80 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1v80 n ASN 60 N 0.18 -4.77 -4.73 7.72 5.15 -0.44 -4.94 115.26 113.43 1v80 n ASN 60 Ca 0.08 0.03 -0.42 0.00 -0.60 0.00 0.00 54.58 53.67 1v80 n ASN 60 Cb 0.28 -2.37 -0.03 0.00 -0.53 0.00 0.00 39.78 37.13 1v80 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1v80 s ILE 61 N -1.49 3.11 0.00 -1.44 1.01 0.29 -4.97 121.20 117.71 1v80 s ILE 61 Ca 0.00 0.88 0.00 0.00 0.00 0.00 0.00 60.65 61.53 1v80 s ILE 61 Cb 0.00 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.91 1v80 s ILE 61 CO 0.00 0.11 0.00 0.00 0.00 0.00 0.00 174.94 175.05 1v80 n GLN 62 N 2.98 1.69 -2.90 2.79 10.64 -1.26 -4.06 117.38 127.27 1v80 n GLN 62 Ca 0.08 0.00 -0.36 0.00 -1.83 0.00 0.00 57.00 54.89 1v80 n GLN 62 Cb 0.42 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.74 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 1.79 4.42 -1.36 2.61 0.00 -1.26 -3.34 119.74 122.60 1v80 s LYS 63 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 55.97 57.11 1v80 s LYS 63 Cb 0.00 -2.74 0.00 0.00 0.00 0.00 0.00 37.83 35.09 1v80 s LYS 63 CO 0.00 0.28 0.00 0.39 0.00 0.00 0.00 175.35 176.02 1v80 n GLU 64 N 0.44 -1.14 -2.38 1.78 1.02 0.50 -4.91 120.64 115.95 1v80 n GLU 64 Ca 0.01 0.93 -0.41 0.00 -0.02 0.00 0.00 57.16 57.67 1v80 n GLU 64 Cb 0.51 -5.08 -0.03 0.00 -0.02 0.00 0.00 31.44 26.83 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 -2.70 6.05 -0.08 1.62 0.01 -1.21 -4.69 113.70 112.69 1v80 s SER 65 Ca 0.00 0.20 -0.30 0.00 1.31 0.00 0.00 55.95 57.16 1v80 s SER 65 Cb 0.00 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.67 1v80 s SER 65 CO 0.00 -1.79 1.03 -0.89 0.41 0.00 0.00 173.24 172.00 1v80 s THR 66 N 6.31 4.72 0.12 1.44 2.01 -1.26 -1.43 115.64 127.55 1v80 s THR 66 Ca 0.52 1.98 0.00 0.00 0.31 0.00 0.00 61.69 64.50 1v80 s THR 66 Cb -0.11 -4.28 0.02 0.00 0.01 0.00 0.00 72.50 68.15 1v80 s THR 66 CO 0.23 0.02 0.16 0.18 -0.69 0.00 0.00 174.62 174.53 1v80 n LEU 67 N 4.88 0.00 -3.67 4.42 7.99 0.22 -4.71 117.00 126.13 1v80 n LEU 67 Ca 0.09 -0.37 -0.26 0.00 -0.01 0.00 0.00 56.01 55.45 1v80 n LEU 67 Cb 0.49 -0.10 -0.17 0.00 -0.11 0.00 0.00 43.42 43.53 1v80 n LEU 67 CO 0.52 -0.57 -0.35 -1.00 -1.51 0.00 0.00 177.39 174.48 1v80 s HIS 68 N -0.19 0.55 -0.29 -1.77 3.76 0.25 -0.50 115.29 117.10 1v80 s HIS 68 Ca 0.11 -0.50 -0.17 0.00 -0.15 0.00 0.00 55.06 54.36 1v80 s HIS 68 Cb -0.01 -0.82 -0.02 0.00 1.11 0.00 0.00 32.58 32.84 1v80 s HIS 68 CO 0.07 -0.52 0.45 -1.17 -0.85 0.00 0.00 174.74 172.72 1v80 s LEU 69 N 2.02 4.15 0.20 0.89 2.96 0.52 0.37 118.68 129.79 1v80 s LEU 69 Ca 0.01 0.23 0.04 0.00 -0.22 0.00 0.00 54.13 54.19 1v80 s LEU 69 Cb -0.16 -2.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.95 1v80 s LEU 69 CO -0.08 -0.30 -0.05 0.68 -1.32 0.00 0.00 176.35 175.27 1v80 s VAL 70 N 2.22 1.13 0.43 1.68 -7.23 -0.71 -3.39 120.40 114.52 1v80 s VAL 70 Ca 0.17 -2.05 -0.05 0.00 -1.81 0.00 0.00 61.98 58.24 1v80 s VAL 70 Cb -0.16 -2.13 0.09 0.00 0.56 0.00 0.00 36.38 34.75 1v80 s VAL 70 CO 0.11 -0.51 0.58 -0.11 -0.31 0.00 0.00 175.10 174.86 1v80 n LEU 71 N -0.33 0.00 -4.15 1.32 7.94 -1.26 -2.30 117.00 118.22 1v80 n LEU 71 Ca -0.07 -0.81 -0.11 0.00 -1.11 0.00 0.00 56.01 53.91 1v80 n LEU 71 Cb 0.62 -0.42 -0.09 0.00 0.53 0.00 0.00 43.42 44.05 1v80 n LEU 71 CO 0.35 -0.88 -0.21 -0.13 -1.11 0.00 0.00 177.39 175.41 1v80 s ARG 72 N -4.14 1.14 0.98 1.96 0.52 -1.22 -4.84 118.95 113.36 1v80 s ARG 72 Ca 0.35 -1.51 -0.16 0.00 -0.52 0.00 0.00 55.73 53.88 1v80 s ARG 72 Cb -0.01 0.28 0.07 0.00 0.52 0.00 0.00 34.95 35.81 1v80 s ARG 72 CO 0.24 -0.37 -0.14 1.47 0.02 0.00 0.00 175.30 176.52 1v80 n LEU 73 N -0.22 -1.98 -2.97 2.53 -0.00 -1.26 -4.06 117.00 109.04 1v80 n LEU 73 Ca -0.01 -0.21 -0.23 0.00 -0.00 0.00 0.00 56.01 55.56 1v80 n LEU 73 Cb 0.65 -0.74 0.02 0.00 -0.00 0.00 0.00 43.42 43.35 1v80 n LEU 73 CO 0.31 -2.93 -0.29 -2.11 -0.00 0.00 0.00 177.39 172.37 1v80 n ARG 74 N -0.69 -1.16 -1.28 1.47 1.85 -1.26 -4.75 116.66 110.85 1v80 n ARG 74 Ca 0.02 1.00 -0.22 0.00 -1.00 0.00 0.00 57.85 57.66 1v80 n ARG 74 Cb 0.46 -1.38 -0.07 0.00 -1.05 0.00 0.00 32.46 30.42 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 0.26 3.98 0.00 2.89 0.00 -1.26 -5.00 105.19 106.06 1v80 n GLY 75 Ca -0.05 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1v80 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93