#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 0.11 0.42 2.12 -0.21 -1.26 -3.94 119.66 116.90 1v80 s GLN 2 Ca 0.00 -0.22 0.08 0.00 0.02 0.00 0.00 55.36 55.24 1v80 s GLN 2 Cb 0.00 -1.58 -0.00 0.00 1.00 0.00 0.00 33.01 32.43 1v80 s GLN 2 CO 0.00 -0.79 0.50 0.96 -2.12 0.00 0.00 175.29 173.85 1v80 s ILE 3 N 2.14 2.88 0.12 1.08 -4.36 0.37 0.41 121.20 123.83 1v80 s ILE 3 Ca 0.04 -1.12 0.02 0.00 -0.26 0.00 0.00 60.65 59.33 1v80 s ILE 3 Cb -0.16 -3.00 -0.01 0.00 1.25 0.00 0.00 42.46 40.55 1v80 s ILE 3 CO -0.18 0.00 0.06 0.49 0.24 0.00 0.00 174.94 175.55 1v80 n PHE 4 N -1.75 -0.06 -3.55 1.37 3.72 0.53 0.23 117.46 117.95 1v80 n PHE 4 Ca 0.06 -0.83 -0.16 0.00 -0.05 0.00 0.00 57.45 56.47 1v80 n PHE 4 Cb 0.60 0.03 -0.06 0.00 -0.94 0.00 0.00 39.48 39.11 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 -2.16 0.00 -0.18 -4.37 0.11 -0.80 0.13 120.40 113.13 1v80 s VAL 5 Ca 0.08 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.15 1v80 s VAL 5 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 1v80 s VAL 5 CO 0.06 0.00 -0.17 -0.54 -3.33 0.00 0.00 175.10 171.12 1v80 s LYS 6 N -0.86 2.65 0.00 1.54 1.02 0.23 -2.26 119.74 122.07 1v80 s LYS 6 Ca -0.08 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.09 1v80 s LYS 6 Cb -0.01 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 34.82 1v80 s LYS 6 CO 0.07 -0.28 0.00 0.25 -0.92 0.00 0.00 175.35 174.48 1v80 n THR 7 N 4.64 0.00 0.10 2.17 -2.24 -1.23 0.14 114.28 117.86 1v80 n THR 7 Ca -0.19 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.57 1v80 n THR 7 Cb 0.49 -1.59 -0.04 0.00 -2.10 0.00 0.00 70.33 67.08 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 0.00 -0.04 3.22 3.38 -1.94 -3.08 115.31 116.86 1v80 h LEU 8 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1v80 h LEU 8 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1v80 h LEU 8 CO 0.00 0.73 0.00 1.07 0.09 0.00 0.00 178.44 180.33 1v80 n THR 9 N -3.28 0.48 -1.78 0.22 5.66 -1.26 -4.93 114.28 109.39 1v80 n THR 9 Ca 0.01 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 1v80 n THR 9 Cb 0.83 -0.60 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 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 0.62 3.20 1.09 0.00 -1.16 -5.07 105.19 105.13 1v80 n GLY 10 Ca 0.06 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 1v80 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v80 s LYS 11 N -3.56 3.11 -0.54 1.61 1.02 -1.26 -4.92 119.74 115.20 1v80 s LYS 11 Ca 0.00 -0.79 -0.23 0.00 0.02 0.00 0.00 55.97 54.97 1v80 s LYS 11 Cb 0.00 -2.60 0.04 0.00 -0.52 0.00 0.00 37.83 34.75 1v80 s LYS 11 CO 0.00 -0.09 0.88 0.99 -0.92 0.00 0.00 175.35 176.21 1v80 s THR 12 N 1.05 4.48 -0.25 2.17 2.01 -1.25 -3.47 115.64 120.39 1v80 s THR 12 Ca -0.01 0.13 -0.10 0.00 0.31 0.00 0.00 61.69 62.03 1v80 s THR 12 Cb -0.14 -4.49 -0.04 0.00 0.01 0.00 0.00 72.50 67.83 1v80 s THR 12 CO -0.05 -1.05 0.14 -0.63 -0.69 0.00 0.00 174.62 172.34 1v80 s ILE 13 N 3.69 5.07 0.41 1.82 1.09 -0.96 -4.90 121.20 127.43 1v80 s ILE 13 Ca 0.27 0.08 -0.22 0.00 -1.10 0.00 0.00 60.65 59.68 1v80 s ILE 13 Cb -0.14 -3.37 -0.10 0.00 -1.06 0.00 0.00 42.46 37.79 1v80 s ILE 13 CO 0.18 0.33 0.97 -0.89 -0.10 0.00 0.00 174.94 175.43 1v80 s THR 14 N 1.28 4.20 -0.00 2.92 2.01 -1.26 -1.90 115.64 122.88 1v80 s THR 14 Ca 0.06 1.51 -0.03 0.00 0.31 0.00 0.00 61.69 63.55 1v80 s THR 14 Cb -0.14 -3.69 -0.00 0.00 0.01 0.00 0.00 72.50 68.67 1v80 s THR 14 CO 0.06 -0.16 0.05 -0.76 -0.69 0.00 0.00 174.62 173.12 1v80 s LEU 15 N -2.88 1.85 -0.84 4.42 1.43 0.63 -4.92 118.68 118.37 1v80 s LEU 15 Ca 0.59 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.56 1v80 s LEU 15 Cb -0.14 0.30 0.22 0.00 0.03 0.00 0.00 46.19 46.60 1v80 s LEU 15 CO 0.18 -0.19 0.79 -0.62 0.23 0.00 0.00 176.35 176.74 1v80 n GLU 16 N 2.22 2.64 -5.20 1.70 1.02 -1.26 0.14 120.64 121.89 1v80 n GLU 16 Ca -0.18 -4.53 -0.32 0.00 -0.02 0.00 0.00 57.16 52.11 1v80 n GLU 16 Cb 0.57 -2.37 -0.16 0.00 -0.02 0.00 0.00 31.44 29.46 1v80 n GLU 16 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1v80 s VAL 17 N -1.74 2.20 1.03 2.62 -7.23 -1.25 -4.99 120.40 111.04 1v80 s VAL 17 Ca 0.30 -1.01 -0.15 0.00 -1.81 0.00 0.00 61.98 59.30 1v80 s VAL 17 Cb -0.01 -1.81 0.21 0.00 0.56 0.00 0.00 36.38 35.32 1v80 s VAL 17 CO -0.09 0.57 1.15 -1.61 -0.31 0.00 0.00 175.10 174.80 1v80 s GLU 18 N -0.15 0.12 0.35 4.82 8.01 -1.26 -4.60 118.70 125.99 1v80 s GLU 18 Ca -0.04 0.11 0.27 0.00 0.01 0.00 0.00 54.97 55.32 1v80 s GLU 18 Cb -0.14 -1.74 0.89 0.00 -4.31 0.00 0.00 34.13 28.83 1v80 s GLU 18 CO 0.04 -2.85 1.77 -1.00 0.01 0.00 0.00 175.26 173.23 1v80 h PRO 19 N -1.96 0.00 0.00 0.39 0.13 -1.96 -2.76 132.00 125.84 1v80 h PRO 19 Ca -0.49 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 1v80 h PRO 19 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 1v80 h PRO 19 CO 0.49 0.00 -0.95 0.77 -0.23 0.00 0.00 178.00 178.08 1v80 h SER 20 N 0.00 0.00 -2.44 1.44 0.02 -1.96 0.62 113.55 111.23 1v80 h SER 20 Ca 0.00 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.62 1v80 h SER 20 Cb 0.64 0.00 0.19 0.00 0.14 0.00 0.00 62.40 63.36 1v80 h SER 20 CO 0.00 0.03 -0.38 0.47 -1.14 0.00 0.00 176.83 175.81 1v80 n ASP 21 N -2.72 -3.10 -4.54 3.07 9.92 -1.04 -4.77 116.55 113.36 1v80 n ASP 21 Ca -0.00 -0.46 -0.25 0.00 -0.53 0.00 0.00 54.79 53.54 1v80 n ASP 21 Cb 0.56 -0.93 -0.11 0.00 -0.64 0.00 0.00 41.12 40.01 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 -2.15 1.91 0.01 -3.53 2.01 -1.26 -3.42 115.64 109.21 1v80 s THR 22 Ca 0.53 -2.09 -0.25 0.00 0.31 0.00 0.00 61.69 60.19 1v80 s THR 22 Cb -0.11 -2.76 -0.18 0.00 0.01 0.00 0.00 72.50 69.46 1v80 s THR 22 CO 0.50 -0.12 1.33 0.40 -0.69 0.00 0.00 174.62 176.04 1v80 h ILE 23 N 1.99 1.01 -0.21 1.82 1.08 -1.77 -2.11 117.51 119.32 1v80 h ILE 23 Ca -0.42 -0.72 0.06 0.00 -0.39 0.00 0.00 64.86 63.39 1v80 h ILE 23 Cb 1.24 1.45 -0.01 0.00 -3.07 0.00 0.00 36.82 36.43 1v80 h ILE 23 CO 0.74 0.17 0.45 1.05 -0.69 0.00 0.00 178.15 179.86 1v80 h GLU 24 N -0.53 0.00 0.25 2.37 4.11 -1.80 0.67 114.58 119.64 1v80 h GLU 24 Ca -0.02 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.07 1v80 h GLU 24 Cb 0.42 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.70 1v80 h GLU 24 CO 0.03 0.00 -1.52 -0.91 0.07 0.00 0.00 179.01 176.68 1v80 h ASN 25 N 0.00 0.82 0.53 3.06 2.35 -1.82 -2.72 115.58 117.80 1v80 h ASN 25 Ca 0.10 -0.92 -0.03 0.00 -0.55 0.00 0.00 56.30 54.90 1v80 h ASN 25 Cb 0.99 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 39.10 1v80 h ASN 25 CO -0.00 1.72 -0.26 0.58 -1.65 0.00 0.00 177.43 177.83 1v80 h VAL 26 N 0.13 0.38 -0.64 2.81 2.07 0.89 -2.87 116.25 119.02 1v80 h VAL 26 Ca -0.27 -0.33 0.13 0.00 0.82 0.00 0.00 66.70 67.05 1v80 h VAL 26 Cb 2.16 0.50 -0.10 0.00 -1.52 0.00 0.00 31.29 32.33 1v80 h VAL 26 CO 0.26 0.05 0.11 0.11 0.02 0.00 0.00 177.57 178.12 1v80 h LYS 27 N -0.95 0.22 -1.16 1.57 1.57 -1.13 0.69 116.57 117.39 1v80 h LYS 27 Ca -0.07 -0.01 0.33 0.00 -1.87 0.00 0.00 60.65 59.02 1v80 h LYS 27 Cb 0.62 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.81 1v80 h LYS 27 CO 0.12 0.14 0.80 0.00 -0.57 0.00 0.00 179.45 179.94 1v80 h ALA 28 N 1.54 2.76 0.07 3.86 0.00 -1.36 1.65 119.26 127.78 1v80 h ALA 28 Ca 0.34 0.01 -0.24 0.00 0.00 0.00 0.00 54.91 55.03 1v80 h ALA 28 Cb 0.55 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1v80 h ALA 28 CO -0.46 -1.16 -1.09 0.87 0.00 0.00 0.00 179.25 177.41 1v80 h LYS 29 N 0.16 0.22 0.00 0.00 1.57 0.56 -3.08 116.57 116.01 1v80 h LYS 29 Ca 0.61 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 59.03 1v80 h LYS 29 Cb 2.04 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 34.46 1v80 h LYS 29 CO -0.16 1.11 -0.14 0.82 -0.57 0.00 0.00 179.45 180.52 1v80 h ILE 30 N 0.08 0.44 -0.03 1.86 1.08 0.34 1.08 117.51 122.37 1v80 h ILE 30 Ca -0.09 -0.75 -0.00 0.00 -0.39 0.00 0.00 64.86 63.62 1v80 h ILE 30 Cb 1.80 1.53 -0.00 0.00 -3.07 0.00 0.00 36.82 37.08 1v80 h ILE 30 CO 0.17 0.14 -0.00 1.56 -0.69 0.00 0.00 178.15 179.33 1v80 h GLN 31 N 0.00 0.05 0.02 2.37 7.50 -0.44 -2.67 115.11 121.94 1v80 h GLN 31 Ca -0.00 -0.02 -0.12 0.00 0.50 0.00 0.00 58.65 59.01 1v80 h GLN 31 Cb 0.52 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.04 1v80 h GLN 31 CO 0.02 0.36 -0.63 0.22 -1.50 0.00 0.00 178.83 177.30 1v80 h ASP 32 N -0.27 0.06 -0.56 1.46 1.82 -1.54 0.12 116.42 117.50 1v80 h ASP 32 Ca 0.01 -0.80 0.05 0.00 -0.39 0.00 0.00 57.03 55.89 1v80 h ASP 32 Cb 0.34 -0.02 -0.07 0.00 0.68 0.00 0.00 39.33 40.27 1v80 h ASP 32 CO 0.00 1.25 -0.33 0.29 -1.61 0.00 0.00 179.24 178.84 1v80 n LYS 33 N -4.46 -0.25 -0.07 0.28 4.76 0.37 -2.82 118.16 115.97 1v80 n LYS 33 Ca -0.20 1.17 -0.08 0.00 -2.87 0.00 0.00 58.31 56.33 1v80 n LYS 33 Cb 0.61 -1.74 -0.06 0.00 -1.84 0.00 0.00 35.03 32.00 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 -1.65 -3.49 114.58 115.80 1v80 h GLU 34 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1v80 h GLU 34 Cb 0.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1v80 h GLU 34 CO -0.53 0.46 0.00 0.41 -1.16 0.00 0.00 179.01 178.19 1v80 n GLY 35 N 1.65 1.87 3.46 -3.84 0.00 0.34 -5.07 105.19 103.60 1v80 n GLY 35 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 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 2.70 0.52 -0.61 1.09 -0.68 -4.97 121.20 117.24 1v80 s ILE 36 Ca 0.00 -1.46 -0.19 0.00 -1.10 0.00 0.00 60.65 57.90 1v80 s ILE 36 Cb 0.00 -2.20 -0.07 0.00 -1.06 0.00 0.00 42.46 39.13 1v80 s ILE 36 CO 0.00 0.17 1.04 -2.16 -0.10 0.00 0.00 174.94 173.89 1v80 s PRO 37 N -1.91 3.68 0.00 2.79 0.04 -1.26 -4.10 135.00 134.24 1v80 s PRO 37 Ca 0.16 1.30 0.20 0.00 0.04 0.00 0.00 61.00 62.70 1v80 s PRO 37 Cb -0.10 -2.08 1.22 0.00 0.04 0.00 0.00 34.50 33.58 1v80 s PRO 37 CO 0.08 -0.52 1.64 -0.35 0.04 0.00 0.00 177.00 177.89 1v80 n PRO 38 N -1.28 0.75 0.23 0.56 -0.04 -1.26 -2.57 135.00 131.39 1v80 n PRO 38 Ca 0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 1v80 n PRO 38 Cb 0.53 -1.43 0.53 0.00 -0.04 0.00 0.00 33.50 33.09 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 -2.02 -3.24 116.42 119.88 1v80 h ASP 39 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 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 0.21 -1.06 0.00 -3.12 0.00 0.00 179.24 175.27 1v80 n GLN 40 N -3.48 2.19 -1.61 3.56 6.02 -1.13 -4.81 117.38 118.12 1v80 n GLN 40 Ca -0.01 -0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.60 1v80 n GLN 40 Cb 0.38 -1.03 0.05 0.00 1.02 0.00 0.00 30.24 30.66 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 -1.82 0.89 -3.15 -1.09 1.13 -1.06 -2.86 117.38 109.42 1v80 n GLN 41 Ca -0.01 0.35 0.04 0.00 -1.94 0.00 0.00 57.00 55.44 1v80 n GLN 41 Cb 0.31 -2.13 -0.00 0.00 0.11 0.00 0.00 30.24 28.53 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 -2.69 0.55 0.04 -1.09 6.06 -1.02 -4.84 118.95 115.96 1v80 s ARG 42 Ca 0.75 0.54 -0.30 0.00 -2.50 0.00 0.00 55.73 54.22 1v80 s ARG 42 Cb -0.42 0.25 -0.04 0.00 0.06 0.00 0.00 34.95 34.79 1v80 s ARG 42 CO 0.48 -1.02 0.99 -1.17 -2.50 0.00 0.00 175.30 172.08 1v80 s LEU 43 N 2.83 4.41 -0.04 -0.88 2.96 -1.26 -1.80 118.68 124.90 1v80 s LEU 43 Ca 0.11 1.73 -0.02 0.00 -0.22 0.00 0.00 54.13 55.73 1v80 s LEU 43 Cb -0.10 -3.58 0.03 0.00 0.50 0.00 0.00 46.19 43.04 1v80 s LEU 43 CO -0.26 -0.22 0.06 -0.63 -1.32 0.00 0.00 176.35 173.98 1v80 s ILE 44 N 0.69 -0.09 -0.12 6.68 1.01 0.25 -3.80 121.20 125.81 1v80 s ILE 44 Ca 0.51 0.42 -0.07 0.00 0.00 0.00 0.00 60.65 61.51 1v80 s ILE 44 Cb -0.22 -0.17 -0.04 0.00 0.01 0.00 0.00 42.46 42.04 1v80 s ILE 44 CO 0.29 0.18 0.13 0.12 0.00 0.00 0.00 174.94 175.66 1v80 s PHE 45 N 2.16 3.57 -1.60 3.97 5.36 -0.76 0.74 117.98 131.43 1v80 s PHE 45 Ca 0.05 0.50 -0.07 0.00 -0.96 0.00 0.00 56.93 56.45 1v80 s PHE 45 Cb -0.12 -1.94 0.07 0.00 -0.34 0.00 0.00 43.02 40.68 1v80 s PHE 45 CO -0.03 0.70 0.34 0.00 -1.46 0.00 0.00 175.22 174.77 1v80 n ALA 46 N 2.07 -1.75 -3.79 11.12 0.00 -1.26 0.17 120.51 127.07 1v80 n ALA 46 Ca -0.20 -0.28 -0.29 0.00 0.00 0.00 0.00 53.44 52.67 1v80 n ALA 46 Cb 0.55 -1.71 -0.00 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.97 -0.48 3.11 0.00 0.00 -1.26 -4.94 105.19 99.64 1v80 n GLY 47 Ca -0.18 0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 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 -6.47 1.13 0.43 1.61 2.20 0.46 -5.12 119.74 113.98 1v80 s LYS 48 Ca 0.59 -0.52 -0.26 0.00 -0.36 0.00 0.00 55.97 55.42 1v80 s LYS 48 Cb -0.31 -1.10 -0.09 0.00 -1.51 0.00 0.00 37.83 34.82 1v80 s LYS 48 CO 0.72 0.30 1.42 -1.14 -0.36 0.00 0.00 175.35 176.29 1v80 s GLN 49 N -0.37 3.81 0.39 4.03 2.00 -1.26 -1.82 119.66 126.44 1v80 s GLN 49 Ca 0.05 2.40 0.05 0.00 -2.00 0.00 0.00 55.36 55.86 1v80 s GLN 49 Cb -0.06 -2.73 0.05 0.00 0.80 0.00 0.00 33.01 31.07 1v80 s GLN 49 CO -0.00 -0.71 0.38 1.28 -0.50 0.00 0.00 175.29 175.73 1v80 n LEU 50 N -0.02 0.00 -3.59 3.68 4.32 -1.25 -4.84 117.00 115.29 1v80 n LEU 50 Ca 0.04 -1.93 -0.16 0.00 -0.02 0.00 0.00 56.01 53.94 1v80 n LEU 50 Cb 0.42 -0.12 -0.07 0.00 -1.62 0.00 0.00 43.42 42.03 1v80 n LEU 50 CO 0.59 -0.54 0.36 -1.61 -1.22 0.00 0.00 177.39 174.97 1v80 s GLU 51 N -3.68 0.92 0.39 3.23 2.02 -1.26 -5.02 118.70 115.30 1v80 s GLU 51 Ca 0.29 0.41 0.21 0.00 0.02 0.00 0.00 54.97 55.90 1v80 s GLU 51 Cb -0.02 0.43 0.59 0.00 0.10 0.00 0.00 34.13 35.23 1v80 s GLU 51 CO 0.18 -0.24 1.68 0.38 0.02 0.00 0.00 175.26 177.29 1v80 h ASP 52 N 3.77 0.00 1.14 -0.19 2.03 -1.99 -2.74 116.42 118.44 1v80 h ASP 52 Ca -0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 1v80 h ASP 52 Cb 1.15 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 1v80 h ASP 52 CO 0.30 0.29 -0.26 0.61 -1.03 0.00 0.00 179.24 179.15 1v80 n GLY 53 N 0.59 -1.55 0.00 7.15 0.00 -1.26 -4.52 105.19 105.59 1v80 n GLY 53 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.08 0.76 -3.81 1.61 5.12 -1.03 -5.08 116.66 112.15 1v80 n ARG 54 Ca 0.05 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.87 1v80 n ARG 54 Cb 0.42 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.67 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 -0.04 0.03 -0.01 0.55 -4.23 -1.26 -4.40 115.64 106.28 1v80 s THR 55 Ca 0.00 -0.95 -0.24 0.00 -1.18 0.00 0.00 61.69 59.32 1v80 s THR 55 Cb 0.00 -1.70 -0.17 0.00 1.34 0.00 0.00 72.50 71.96 1v80 s THR 55 CO 0.00 -0.13 1.16 -0.07 -0.54 0.00 0.00 174.62 175.04 1v80 h LEU 56 N 2.25 -0.19 -2.47 4.79 3.38 -1.57 0.34 115.31 121.83 1v80 h LEU 56 Ca -0.28 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.39 1v80 h LEU 56 Cb 1.25 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 1v80 h LEU 56 CO 0.38 0.25 0.15 -1.28 0.09 0.00 0.00 178.44 178.03 1v80 h SER 57 N -0.69 0.00 0.40 -0.43 0.87 0.04 0.30 113.55 114.05 1v80 h SER 57 Ca -0.02 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.23 1v80 h SER 57 Cb 0.49 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.42 1v80 h SER 57 CO 0.04 0.00 -1.75 0.44 -0.53 0.00 0.00 176.83 175.03 1v80 h ASP 58 N 0.00 0.16 -0.13 6.23 3.32 -1.74 -3.30 116.42 120.96 1v80 h ASP 58 Ca 0.02 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1v80 h ASP 58 Cb 0.33 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1v80 h ASP 58 CO -0.00 1.29 0.00 -1.22 -1.72 0.00 0.00 179.24 177.59 1v80 n TYR 59 N -3.22 0.17 -1.19 4.55 4.01 0.12 -4.83 117.16 116.77 1v80 n TYR 59 Ca -0.20 -0.08 -0.06 0.00 -0.16 0.00 0.00 57.90 57.39 1v80 n TYR 59 Cb 1.05 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 40.05 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 -0.14 -5.04 -4.73 7.72 5.15 -0.21 -4.91 115.26 113.09 1v80 n ASN 60 Ca 0.06 0.16 -0.42 0.00 -0.60 0.00 0.00 54.58 53.78 1v80 n ASN 60 Cb 0.12 -3.11 -0.03 0.00 -0.53 0.00 0.00 39.78 36.24 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 -1.81 2.34 0.10 -1.44 1.01 0.57 -4.99 121.20 116.98 1v80 s ILE 61 Ca 0.00 0.26 0.08 0.00 0.00 0.00 0.00 60.65 60.99 1v80 s ILE 61 Cb 0.00 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 1v80 s ILE 61 CO 0.00 0.03 -0.21 -1.10 0.00 0.00 0.00 174.94 173.66 1v80 s GLN 62 N 0.63 1.12 0.37 2.79 -0.21 -1.26 -4.46 119.66 118.64 1v80 s GLN 62 Ca 0.69 -1.15 -0.21 0.00 0.02 0.00 0.00 55.36 54.71 1v80 s GLN 62 Cb -0.46 -1.38 -0.15 0.00 1.00 0.00 0.00 33.01 32.02 1v80 s GLN 62 CO 0.36 0.32 0.12 0.36 -2.12 0.00 0.00 175.29 174.33 1v80 n LYS 63 N 1.11 0.00 -1.49 2.91 0.00 -1.26 -1.16 118.16 118.28 1v80 n LYS 63 Ca -0.19 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.03 1v80 n LYS 63 Cb 0.54 -0.96 -0.03 0.00 -0.00 0.00 0.00 35.03 34.58 1v80 n LYS 63 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1v80 n GLU 64 N 1.25 -0.60 -2.92 -1.58 1.02 0.16 -4.93 120.64 113.05 1v80 n GLU 64 Ca 0.11 0.69 -0.41 0.00 -0.02 0.00 0.00 57.16 57.53 1v80 n GLU 64 Cb 0.37 -4.57 -0.04 0.00 -0.02 0.00 0.00 31.44 27.18 1v80 n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1v80 s SER 65 N -2.84 7.01 -0.25 1.62 1.04 -0.31 -4.76 113.70 115.21 1v80 s SER 65 Ca 0.00 1.23 -0.11 0.00 0.48 0.00 0.00 55.95 57.55 1v80 s SER 65 Cb 0.00 -2.45 -0.05 0.00 0.10 0.00 0.00 66.02 63.62 1v80 s SER 65 CO 0.00 -0.29 0.19 -0.89 0.98 0.00 0.00 173.24 173.22 1v80 s THR 66 N 1.59 5.33 0.66 2.02 2.01 -1.26 0.20 115.64 126.19 1v80 s THR 66 Ca 0.40 0.21 -0.05 0.00 0.31 0.00 0.00 61.69 62.56 1v80 s THR 66 Cb -0.17 -3.53 0.14 0.00 0.01 0.00 0.00 72.50 68.95 1v80 s THR 66 CO 0.16 0.30 0.90 0.18 -0.69 0.00 0.00 174.62 175.48 1v80 n LEU 67 N 4.58 0.00 -3.80 4.42 7.99 0.35 -4.51 117.00 126.03 1v80 n LEU 67 Ca -0.14 -1.51 -0.28 0.00 -0.01 0.00 0.00 56.01 54.07 1v80 n LEU 67 Cb 0.52 -0.63 -0.16 0.00 -0.11 0.00 0.00 43.42 43.04 1v80 n LEU 67 CO 0.35 -1.03 -0.38 -1.00 -1.51 0.00 0.00 177.39 173.81 1v80 s HIS 68 N -2.77 1.33 -0.30 -1.77 3.76 0.23 0.77 115.29 116.54 1v80 s HIS 68 Ca 0.56 -0.99 -0.18 0.00 -0.15 0.00 0.00 55.06 54.30 1v80 s HIS 68 Cb -0.02 -1.15 -0.02 0.00 1.11 0.00 0.00 32.58 32.50 1v80 s HIS 68 CO 0.38 -0.62 0.52 -1.17 -0.85 0.00 0.00 174.74 173.00 1v80 s LEU 69 N 1.75 4.15 0.39 0.89 2.96 0.36 -0.59 118.68 128.60 1v80 s LEU 69 Ca -0.01 0.31 0.04 0.00 -0.22 0.00 0.00 54.13 54.25 1v80 s LEU 69 Cb -0.17 -2.64 -0.05 0.00 0.50 0.00 0.00 46.19 43.84 1v80 s LEU 69 CO -0.07 -0.37 0.06 0.68 -1.32 0.00 0.00 176.35 175.33 1v80 s VAL 70 N 2.36 1.19 0.19 1.68 -7.23 -0.74 -3.30 120.40 114.55 1v80 s VAL 70 Ca 0.20 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.43 1v80 s VAL 70 Cb -0.15 -2.64 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 1v80 s VAL 70 CO 0.11 0.00 0.13 -0.22 -0.31 0.00 0.00 175.10 174.81 1v80 s LEU 71 N -3.61 3.71 -0.06 1.32 2.96 -1.26 -2.44 118.68 119.30 1v80 s LEU 71 Ca 0.29 -0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.87 1v80 s LEU 71 Cb 0.07 -2.30 -0.05 0.00 0.50 0.00 0.00 46.19 44.40 1v80 s LEU 71 CO 0.14 0.04 0.27 -0.13 -1.32 0.00 0.00 176.35 175.35 1v80 s ARG 72 N -3.31 3.66 1.43 1.98 0.52 -1.14 -4.99 118.95 117.11 1v80 s ARG 72 Ca 0.31 0.12 -0.23 0.00 -0.52 0.00 0.00 55.73 55.41 1v80 s ARG 72 Cb -0.09 -3.20 0.36 0.00 0.52 0.00 0.00 34.95 32.54 1v80 s ARG 72 CO 0.23 0.73 0.85 1.47 0.02 0.00 0.00 175.30 178.60 1v80 n LEU 73 N 1.86 -0.51 -3.99 2.53 -0.00 -1.26 -4.79 117.00 110.84 1v80 n LEU 73 Ca -0.17 -0.78 -0.46 0.00 -0.00 0.00 0.00 56.01 54.61 1v80 n LEU 73 Cb 0.54 -1.01 -0.04 0.00 -0.00 0.00 0.00 43.42 42.91 1v80 n LEU 73 CO 0.34 -4.43 0.11 -2.11 -0.00 0.00 0.00 177.39 171.30 1v80 n ARG 74 N -5.47 0.00 -1.18 1.47 1.85 -1.26 -4.74 116.66 107.34 1v80 n ARG 74 Ca 0.12 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.79 1v80 n ARG 74 Cb 0.58 -1.00 -0.13 0.00 -1.05 0.00 0.00 32.46 30.86 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 3.49 2.04 2.89 0.00 -1.26 -5.26 105.19 108.79 1v80 n GLY 75 Ca 0.17 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1v80 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93