#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v81 s GLN 2 N 0.00 0.27 0.32 0.03 0.74 -1.26 -3.30 119.66 116.46 1v81 s GLN 2 Ca 0.00 -0.03 0.04 0.00 0.05 0.00 0.00 55.36 55.42 1v81 s GLN 2 Cb 0.00 -0.34 -0.02 0.00 1.10 0.00 0.00 33.01 33.75 1v81 s GLN 2 CO 0.00 -0.02 0.15 0.44 -0.55 0.00 0.00 175.29 175.32 1v81 n ILE 3 N 3.48 0.00 -4.24 -2.34 -5.35 -0.90 0.88 119.36 110.89 1v81 n ILE 3 Ca -0.19 -1.97 -0.13 0.00 -0.27 0.00 0.00 62.75 60.19 1v81 n ILE 3 Cb 0.55 0.79 -0.10 0.00 -1.74 0.00 0.00 39.64 39.14 1v81 n ILE 3 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1v81 s PHE 4 N -2.90 1.21 -0.01 4.28 0.08 -1.26 -2.19 117.98 117.18 1v81 s PHE 4 Ca 0.22 -0.97 0.02 0.00 0.12 0.00 0.00 56.93 56.32 1v81 s PHE 4 Cb 0.01 -0.68 -0.00 0.00 -0.57 0.00 0.00 43.02 41.78 1v81 s PHE 4 CO 0.15 -0.16 -0.08 0.08 -0.10 0.00 0.00 175.22 175.11 1v81 s VAL 5 N -3.60 0.67 0.00 -0.44 1.01 -1.14 -0.63 120.40 116.26 1v81 s VAL 5 Ca 0.22 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.87 1v81 s VAL 5 Cb 0.06 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.85 1v81 s VAL 5 CO 0.03 0.20 0.00 1.17 0.00 0.00 0.00 175.10 176.50 1v81 n LYS 6 N 3.10 2.84 0.00 2.72 4.81 0.54 -2.93 118.16 129.24 1v81 n LYS 6 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 1v81 n LYS 6 Cb 0.56 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.61 1v81 n LYS 6 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1v81 n THR 7 N -0.04 0.00 0.25 3.15 5.66 -1.26 -3.53 114.28 118.51 1v81 n THR 7 Ca 0.00 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.14 1v81 n THR 7 Cb 0.00 0.00 0.74 0.00 -1.55 0.00 0.00 70.33 69.52 1v81 n THR 7 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1v81 h LEU 8 N 0.00 0.00 -1.42 1.09 3.38 -1.83 1.52 115.31 118.05 1v81 h LEU 8 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1v81 h LEU 8 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1v81 h LEU 8 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.88 1v81 n THR 9 N -2.56 0.09 -3.71 0.22 -2.24 -1.26 -4.98 114.28 99.84 1v81 n THR 9 Ca -0.02 -0.39 -0.26 0.00 -2.27 0.00 0.00 64.05 61.11 1v81 n THR 9 Cb 0.20 0.83 0.01 0.00 -2.10 0.00 0.00 70.33 69.27 1v81 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v81 n GLY 10 N 1.26 -1.15 0.00 3.38 0.00 0.52 -4.99 105.19 104.21 1v81 n GLY 10 Ca 0.17 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.70 1v81 n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1v81 n LYS 11 N -3.26 2.09 -3.66 1.61 5.02 -1.26 -4.92 118.16 113.77 1v81 n LYS 11 Ca -0.19 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.00 1v81 n LYS 11 Cb 0.62 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.52 1v81 n LYS 11 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1v81 s THR 12 N -0.91 -0.52 -0.13 -0.18 2.01 -1.23 -3.98 115.64 110.70 1v81 s THR 12 Ca 0.00 0.19 0.02 0.00 0.31 0.00 0.00 61.69 62.22 1v81 s THR 12 Cb 0.00 -0.59 0.00 0.00 0.01 0.00 0.00 72.50 71.92 1v81 s THR 12 CO 0.00 0.08 -0.20 0.27 -0.69 0.00 0.00 174.62 174.08 1v81 s ILE 13 N 2.44 2.31 0.24 1.82 -0.00 -1.15 -4.88 121.20 121.98 1v81 s ILE 13 Ca -0.02 -0.91 -0.30 0.00 -0.00 0.00 0.00 60.65 59.43 1v81 s ILE 13 Cb -0.12 -1.93 -0.09 0.00 -0.00 0.00 0.00 42.46 40.33 1v81 s ILE 13 CO -0.11 0.54 0.98 -0.89 -0.00 0.00 0.00 174.94 175.46 1v81 s THR 14 N 0.60 3.96 0.24 8.37 2.01 -1.26 -2.90 115.64 126.66 1v81 s THR 14 Ca -0.11 1.95 -0.12 0.00 0.31 0.00 0.00 61.69 63.73 1v81 s THR 14 Cb -0.16 -4.24 -0.01 0.00 0.01 0.00 0.00 72.50 68.09 1v81 s THR 14 CO 0.03 0.46 0.44 -0.76 -0.69 0.00 0.00 174.62 174.10 1v81 s LEU 15 N -1.16 0.41 -0.07 4.42 1.02 -0.93 -5.00 118.68 117.37 1v81 s LEU 15 Ca 0.42 -0.97 0.02 0.00 0.02 0.00 0.00 54.13 53.62 1v81 s LEU 15 Cb -0.27 1.63 0.01 0.00 0.02 0.00 0.00 46.19 47.58 1v81 s LEU 15 CO 0.34 -1.11 -0.12 -1.83 0.02 0.00 0.00 176.35 173.65 1v81 s GLU 16 N -4.03 1.70 0.24 1.70 1.03 -1.26 -2.12 118.70 115.96 1v81 s GLU 16 Ca 0.24 -0.40 -0.14 0.00 0.03 0.00 0.00 54.97 54.70 1v81 s GLU 16 Cb 0.00 -1.45 0.00 0.00 -0.80 0.00 0.00 34.13 31.88 1v81 s GLU 16 CO 0.09 -0.02 0.50 0.14 -1.33 0.00 0.00 175.26 174.64 1v81 s VAL 17 N 0.82 0.01 0.20 1.83 -7.23 -1.21 -5.02 120.40 109.80 1v81 s VAL 17 Ca -0.12 -1.32 0.05 0.00 -1.81 0.00 0.00 61.98 58.79 1v81 s VAL 17 Cb -0.15 -2.12 -0.04 0.00 0.56 0.00 0.00 36.38 34.63 1v81 s VAL 17 CO 0.02 -0.02 0.22 -1.61 -0.31 0.00 0.00 175.10 173.39 1v81 s GLU 18 N -3.99 3.09 0.12 4.82 2.02 -1.26 -3.87 118.70 119.62 1v81 s GLU 18 Ca 0.20 -0.87 0.23 0.00 0.02 0.00 0.00 54.97 54.56 1v81 s GLU 18 Cb -0.01 -2.71 0.92 0.00 0.10 0.00 0.00 34.13 32.42 1v81 s GLU 18 CO 0.07 0.45 1.72 -0.35 0.02 0.00 0.00 175.26 177.18 1v81 n PRO 19 N -0.82 0.12 -0.29 0.39 -0.04 -1.26 -2.17 135.00 130.92 1v81 n PRO 19 Ca -0.08 0.22 0.10 0.00 -0.04 0.00 0.00 63.50 63.70 1v81 n PRO 19 Cb 0.56 -1.67 0.26 0.00 -0.04 0.00 0.00 33.50 32.61 1v81 n PRO 19 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1v81 n SER 20 N -1.88 3.59 -4.84 3.54 3.41 -1.26 -0.27 113.62 115.91 1v81 n SER 20 Ca 0.05 -1.99 -0.36 0.00 -0.26 0.00 0.00 58.87 56.31 1v81 n SER 20 Cb 0.29 -0.38 -0.06 0.00 -0.26 0.00 0.00 64.21 63.80 1v81 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1v81 s ASP 21 N -1.06 6.86 0.77 4.04 1.01 -0.92 -4.90 116.67 122.46 1v81 s ASP 21 Ca 0.40 1.09 -0.12 0.00 0.71 0.00 0.00 52.55 54.64 1v81 s ASP 21 Cb 0.21 -2.29 0.05 0.00 1.01 0.00 0.00 42.92 41.90 1v81 s ASP 21 CO 0.28 0.16 1.11 0.28 0.21 0.00 0.00 175.17 177.21 1v81 s THR 22 N -1.36 3.02 0.01 -1.27 -1.32 -1.26 -1.87 115.64 111.59 1v81 s THR 22 Ca 0.35 0.33 -0.08 0.00 -1.21 0.00 0.00 61.69 61.07 1v81 s THR 22 Cb -0.16 -3.21 -0.05 0.00 -1.51 0.00 0.00 72.50 67.57 1v81 s THR 22 CO 0.19 -0.43 1.07 0.40 -2.21 0.00 0.00 174.62 173.63 1v81 h ILE 23 N -0.94 0.00 -0.87 5.08 1.08 -1.68 -0.30 117.51 119.89 1v81 h ILE 23 Ca -0.46 -0.01 0.31 0.00 -0.39 0.00 0.00 64.86 64.31 1v81 h ILE 23 Cb 1.27 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.92 1v81 h ILE 23 CO 0.62 0.00 0.54 1.21 -0.69 0.00 0.00 178.15 179.83 1v81 n GLU 24 N -2.86 -0.03 0.14 2.37 2.13 -1.26 0.31 120.64 121.43 1v81 n GLU 24 Ca -0.04 0.87 -0.09 0.00 0.66 0.00 0.00 57.16 58.57 1v81 n GLU 24 Cb 0.12 -1.68 -0.05 0.00 0.27 0.00 0.00 31.44 30.10 1v81 n GLU 24 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 1v81 h ASN 25 N 0.00 -0.36 -0.58 4.31 -1.24 -1.86 0.22 115.58 116.07 1v81 h ASN 25 Ca 0.59 -0.09 -0.01 0.00 0.71 0.00 0.00 56.30 57.50 1v81 h ASN 25 Cb 1.82 0.09 -0.03 0.00 0.73 0.00 0.00 38.32 40.93 1v81 h ASN 25 CO -0.37 0.11 0.35 0.58 -1.29 0.00 0.00 177.43 176.81 1v81 h VAL 26 N -1.05 1.17 -0.00 2.57 2.07 0.38 0.35 116.25 121.74 1v81 h VAL 26 Ca -0.04 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1v81 h VAL 26 Cb 0.43 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1v81 h VAL 26 CO 0.07 0.18 -0.02 1.17 0.02 0.00 0.00 177.57 178.99 1v81 n LYS 27 N -4.41 0.34 -0.08 1.57 4.81 0.91 -3.43 118.16 117.87 1v81 n LYS 27 Ca 0.06 -0.02 -0.22 0.00 -0.87 0.00 0.00 58.31 57.25 1v81 n LYS 27 Cb 0.08 -1.50 -0.12 0.00 0.02 0.00 0.00 35.03 33.51 1v81 n LYS 27 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1v81 n ALA 28 N -1.31 0.88 -0.41 3.14 0.00 0.97 -3.95 120.51 119.83 1v81 n ALA 28 Ca 0.12 -0.60 -0.08 0.00 0.00 0.00 0.00 53.44 52.88 1v81 n ALA 28 Cb 0.27 -0.51 -0.06 0.00 0.00 0.00 0.00 19.45 19.15 1v81 n ALA 28 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1v81 n LYS 29 N -4.10 -0.38 -0.15 0.00 5.02 0.33 0.68 118.16 119.55 1v81 n LYS 29 Ca -0.35 1.52 -0.05 0.00 -2.02 0.00 0.00 58.31 57.41 1v81 n LYS 29 Cb 0.82 -2.24 0.02 0.00 -0.02 0.00 0.00 35.03 33.61 1v81 n LYS 29 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1v81 h ILE 30 N 0.00 0.31 -0.31 -0.18 3.07 -1.76 1.34 117.51 119.99 1v81 h ILE 30 Ca 0.21 0.00 0.09 0.00 1.55 0.00 0.00 64.86 66.71 1v81 h ILE 30 Cb 0.46 0.31 -0.01 0.00 -0.27 0.00 0.00 36.82 37.31 1v81 h ILE 30 CO -0.95 0.00 0.42 1.56 -1.05 0.00 0.00 178.15 178.12 1v81 h GLN 31 N -0.14 0.00 0.00 0.16 1.08 0.12 0.78 115.11 117.11 1v81 h GLN 31 Ca 0.22 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 57.16 1v81 h GLN 31 Cb 0.49 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.87 1v81 h GLN 31 CO -0.57 0.00 -1.72 -0.25 -0.95 0.00 0.00 178.83 175.34 1v81 n ASP 32 N -3.51 0.75 0.07 1.46 9.92 0.39 -1.92 116.55 123.70 1v81 n ASP 32 Ca 0.05 0.35 -0.13 0.00 -0.53 0.00 0.00 54.79 54.53 1v81 n ASP 32 Cb 0.56 0.16 -0.08 0.00 -0.64 0.00 0.00 41.12 41.12 1v81 n ASP 32 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1v81 h LYS 33 N 0.00 -0.14 0.00 -1.24 1.79 0.71 -3.39 116.57 114.30 1v81 h LYS 33 Ca -0.28 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 1v81 h LYS 33 Cb 1.91 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.60 1v81 h LYS 33 CO 0.06 0.13 0.00 -0.85 -1.08 0.00 0.00 179.45 177.71 1v81 n GLU 34 N -5.03 0.00 0.00 3.15 0.00 0.04 -5.05 120.64 113.75 1v81 n GLU 34 Ca -0.08 0.25 0.00 0.00 0.00 0.00 0.00 57.16 57.32 1v81 n GLU 34 Cb 0.18 -0.72 0.00 0.00 0.00 0.00 0.00 31.44 30.91 1v81 n GLU 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1v81 n GLY 35 N 1.89 0.16 3.15 -1.84 0.00 -0.81 -5.07 105.19 102.67 1v81 n GLY 35 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1v81 n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1v81 s ILE 36 N -0.25 1.22 0.28 -0.61 2.07 -1.06 -5.04 121.20 117.81 1v81 s ILE 36 Ca 0.00 -0.94 -0.29 0.00 -1.41 0.00 0.00 60.65 58.01 1v81 s ILE 36 Cb 0.00 -1.07 -0.09 0.00 0.13 0.00 0.00 42.46 41.42 1v81 s ILE 36 CO 0.00 0.12 1.08 -2.16 -1.91 0.00 0.00 174.94 172.07 1v81 s PRO 37 N -0.94 4.64 0.17 3.50 0.04 -1.26 -4.31 135.00 136.83 1v81 s PRO 37 Ca 0.04 1.75 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1v81 s PRO 37 Cb -0.07 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.33 1v81 s PRO 37 CO 0.01 0.23 1.40 -1.00 0.04 0.00 0.00 177.00 177.67 1v81 h PRO 38 N 3.77 0.27 -1.56 0.56 0.13 -1.87 -3.15 132.00 130.15 1v81 h PRO 38 Ca -0.47 -0.27 0.45 0.00 -0.87 0.00 0.00 66.00 64.85 1v81 h PRO 38 Cb 1.21 0.07 -0.06 0.00 0.13 0.00 0.00 31.00 32.35 1v81 h PRO 38 CO 0.67 0.96 1.30 -0.44 -0.23 0.00 0.00 178.00 180.25 1v81 h ASP 39 N 0.17 0.00 0.00 1.44 3.32 -1.97 0.27 116.42 119.64 1v81 h ASP 39 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1v81 h ASP 39 Cb 1.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1v81 h ASP 39 CO 0.13 0.00 -0.01 1.56 -1.72 0.00 0.00 179.24 179.20 1v81 h GLN 40 N 0.00 0.00 -6.24 3.56 7.50 -1.89 -3.47 115.11 114.57 1v81 h GLN 40 Ca 0.74 0.00 -0.68 0.00 0.50 0.00 0.00 58.65 59.21 1v81 h GLN 40 Cb 3.33 0.00 -0.19 0.00 0.05 0.00 0.00 27.48 30.67 1v81 h GLN 40 CO -0.01 0.00 -0.71 1.14 -1.50 0.00 0.00 178.83 177.75 1v81 s GLN 41 N -1.46 2.61 0.32 1.46 -2.07 0.94 -4.64 119.66 116.83 1v81 s GLN 41 Ca -0.00 -0.65 0.09 0.00 -1.82 0.00 0.00 55.36 52.98 1v81 s GLN 41 Cb 0.00 -2.51 -0.05 0.00 -1.09 0.00 0.00 33.01 29.36 1v81 s GLN 41 CO 0.00 0.63 0.05 1.03 -1.32 0.00 0.00 175.29 175.69 1v81 s ARG 42 N -1.04 2.22 0.28 9.60 0.52 -1.25 -4.43 118.95 124.84 1v81 s ARG 42 Ca 0.14 -1.61 -0.03 0.00 -0.52 0.00 0.00 55.73 53.71 1v81 s ARG 42 Cb -0.11 -2.06 -0.05 0.00 0.52 0.00 0.00 34.95 33.25 1v81 s ARG 42 CO 0.04 0.17 0.52 -0.51 0.02 0.00 0.00 175.30 175.54 1v81 s LEU 43 N -3.75 4.08 0.13 2.53 2.01 -1.26 -3.42 118.68 118.99 1v81 s LEU 43 Ca 0.35 0.62 0.04 0.00 0.01 0.00 0.00 54.13 55.15 1v81 s LEU 43 Cb -0.02 -3.43 -0.04 0.00 0.01 0.00 0.00 46.19 42.70 1v81 s LEU 43 CO 0.21 -0.19 -0.10 -0.63 1.01 0.00 0.00 176.35 176.65 1v81 s ILE 44 N -2.09 1.06 -0.30 -0.59 -1.09 -0.11 -2.86 121.20 115.23 1v81 s ILE 44 Ca 0.42 -1.97 -0.14 0.00 -2.23 0.00 0.00 60.65 56.74 1v81 s ILE 44 Cb -0.11 -1.74 0.14 0.00 -1.58 0.00 0.00 42.46 39.18 1v81 s ILE 44 CO 0.31 -0.73 0.86 0.12 -1.23 0.00 0.00 174.94 174.27 1v81 s PHE 45 N -3.20 -0.88 -0.23 3.97 5.36 -1.18 -0.69 117.98 121.13 1v81 s PHE 45 Ca 0.14 1.60 0.00 0.00 -0.96 0.00 0.00 56.93 57.70 1v81 s PHE 45 Cb 0.02 0.53 0.00 0.00 -0.34 0.00 0.00 43.02 43.23 1v81 s PHE 45 CO -0.00 -0.44 0.00 0.00 -1.46 0.00 0.00 175.22 173.32 1v81 n ALA 46 N 4.73 -0.03 -2.21 11.12 0.00 -1.26 -1.95 120.51 130.91 1v81 n ALA 46 Ca -0.13 0.03 -0.02 0.00 0.00 0.00 0.00 53.44 53.33 1v81 n ALA 46 Cb 0.54 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1v81 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v81 n GLY 47 N -0.96 0.48 3.37 0.00 0.00 -1.26 -5.06 105.19 101.76 1v81 n GLY 47 Ca -0.02 -0.75 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 1v81 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v81 s LYS 48 N -4.41 1.40 -0.62 1.61 -2.85 -0.82 -5.09 119.74 108.96 1v81 s LYS 48 Ca 0.01 -1.60 -0.28 0.00 -1.00 0.00 0.00 55.97 53.11 1v81 s LYS 48 Cb -0.01 -1.29 0.02 0.00 -2.06 0.00 0.00 37.83 34.50 1v81 s LYS 48 CO 0.02 0.23 1.31 -1.14 0.10 0.00 0.00 175.35 175.87 1v81 s GLN 49 N -3.49 3.32 -0.35 1.78 0.74 -1.26 -3.08 119.66 117.32 1v81 s GLN 49 Ca 0.23 0.19 -0.29 0.00 0.05 0.00 0.00 55.36 55.54 1v81 s GLN 49 Cb -0.02 -4.11 -0.01 0.00 1.10 0.00 0.00 33.01 29.97 1v81 s GLN 49 CO 0.08 -1.94 1.63 -0.51 -0.55 0.00 0.00 175.29 174.00 1v81 s LEU 50 N 5.68 3.58 0.21 3.68 1.02 -1.14 -4.98 118.68 126.74 1v81 s LEU 50 Ca 0.44 1.16 0.11 0.00 0.02 0.00 0.00 54.13 55.86 1v81 s LEU 50 Cb -0.09 -3.53 -0.05 0.00 0.02 0.00 0.00 46.19 42.54 1v81 s LEU 50 CO 0.22 -1.55 -0.22 -0.70 0.02 0.00 0.00 176.35 174.13 1v81 s GLU 51 N 5.25 1.52 0.56 1.70 2.12 -1.26 -4.58 118.70 124.02 1v81 s GLU 51 Ca 0.72 -1.57 0.32 0.00 0.36 0.00 0.00 54.97 54.80 1v81 s GLU 51 Cb -0.19 -1.73 1.65 0.00 0.26 0.00 0.00 34.13 34.11 1v81 s GLU 51 CO 0.33 0.36 2.13 0.22 -0.54 0.00 0.00 175.26 177.75 1v81 h ASP 52 N 2.97 0.00 -1.60 -1.70 1.82 -1.93 -2.73 116.42 113.25 1v81 h ASP 52 Ca -0.44 0.00 0.48 0.00 -0.39 0.00 0.00 57.03 56.68 1v81 h ASP 52 Cb 1.22 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 41.14 1v81 h ASP 52 CO 0.52 0.07 1.11 1.23 -1.61 0.00 0.00 179.24 180.56 1v81 h GLY 53 N 0.84 0.51 -1.41 -0.78 0.00 -1.98 -3.39 103.07 96.86 1v81 h GLY 53 Ca -0.00 -0.04 -0.55 0.00 0.00 0.00 0.00 47.33 46.74 1v81 h GLY 53 CO 0.01 -0.15 -0.55 0.50 0.00 0.00 0.00 176.54 176.35 1v81 s ARG 54 N -5.05 1.87 0.00 4.80 0.52 -1.03 -5.07 118.95 114.99 1v81 s ARG 54 Ca -0.06 -2.12 0.00 0.00 -0.52 0.00 0.00 55.73 53.03 1v81 s ARG 54 Cb 0.27 -0.84 0.00 0.00 0.52 0.00 0.00 34.95 34.90 1v81 s ARG 54 CO 0.85 -0.35 0.00 0.25 0.02 0.00 0.00 175.30 176.07 1v81 n THR 55 N -0.88 0.00 -0.03 0.02 -2.24 -1.26 -2.65 114.28 107.24 1v81 n THR 55 Ca -0.06 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.57 1v81 n THR 55 Cb 0.66 -0.48 -0.04 0.00 -2.10 0.00 0.00 70.33 68.37 1v81 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1v81 h LEU 56 N 0.00 0.88 -1.24 3.22 3.38 -1.43 -2.60 115.31 117.53 1v81 h LEU 56 Ca 0.00 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.42 1v81 h LEU 56 Cb 0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1v81 h LEU 56 CO 0.00 1.32 0.32 0.77 0.09 0.00 0.00 178.44 180.95 1v81 h SER 57 N 0.54 0.76 0.32 -0.43 4.64 -0.90 1.62 113.55 120.09 1v81 h SER 57 Ca -0.03 -0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 61.13 1v81 h SER 57 Cb 1.30 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1v81 h SER 57 CO 0.14 0.62 -0.42 0.44 -0.87 0.00 0.00 176.83 176.74 1v81 h ASP 58 N 0.85 0.14 -0.57 4.97 3.32 -1.78 -2.34 116.42 121.01 1v81 h ASP 58 Ca 0.22 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1v81 h ASP 58 Cb 0.04 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1v81 h ASP 58 CO -0.03 0.55 0.00 -1.22 -1.72 0.00 0.00 179.24 176.82 1v81 n TYR 59 N -4.03 0.76 -2.32 4.55 4.01 -0.35 -4.92 117.16 114.87 1v81 n TYR 59 Ca -0.02 -0.38 -0.17 0.00 -0.16 0.00 0.00 57.90 57.18 1v81 n TYR 59 Cb 0.47 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.48 1v81 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1v81 n ASN 60 N 1.57 -4.95 -4.47 7.72 2.85 0.29 -4.83 115.26 113.42 1v81 n ASN 60 Ca 0.22 0.12 -0.42 0.00 -0.11 0.00 0.00 54.58 54.39 1v81 n ASN 60 Cb 0.61 -4.18 -0.00 0.00 1.24 0.00 0.00 39.78 37.44 1v81 n ASN 60 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1v81 n ILE 61 N -3.55 3.74 -0.74 -1.44 5.41 0.48 -4.92 119.36 118.34 1v81 n ILE 61 Ca -0.20 -3.83 0.00 0.00 1.00 0.00 0.00 62.75 59.72 1v81 n ILE 61 Cb 0.64 -2.37 0.00 0.00 -0.71 0.00 0.00 39.64 37.21 1v81 n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1v81 n GLN 62 N 8.12 1.97 -1.33 0.38 10.64 -1.26 -4.65 117.38 131.25 1v81 n GLN 62 Ca 0.49 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 55.31 1v81 n GLN 62 Cb 0.45 0.00 0.10 0.00 -0.86 0.00 0.00 30.24 29.93 1v81 n GLN 62 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1v81 n LYS 63 N 0.00 0.50 -3.79 2.61 5.02 -1.26 -3.47 118.16 117.77 1v81 n LYS 63 Ca 0.00 0.23 -0.24 0.00 -2.02 0.00 0.00 58.31 56.28 1v81 n LYS 63 Cb 0.00 -2.37 0.00 0.00 -0.02 0.00 0.00 35.03 32.64 1v81 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1v81 n GLU 64 N -2.41 -1.54 -0.02 1.97 1.02 0.25 -4.93 120.64 114.99 1v81 n GLU 64 Ca 0.14 0.76 -0.01 0.00 -0.02 0.00 0.00 57.16 58.02 1v81 n GLU 64 Cb 0.50 -2.31 -0.00 0.00 -0.02 0.00 0.00 31.44 29.60 1v81 n GLU 64 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1v81 h SER 65 N -0.29 0.00 -1.86 1.62 0.02 -1.79 -3.47 113.55 107.78 1v81 h SER 65 Ca -0.63 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.32 1v81 h SER 65 Cb 1.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.94 1v81 h SER 65 CO 0.37 0.25 0.00 0.41 -1.14 0.00 0.00 176.83 176.72 1v81 n THR 66 N -3.06 -1.24 -2.10 -2.27 -1.04 -0.91 -4.87 114.28 98.79 1v81 n THR 66 Ca -0.02 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.70 1v81 n THR 66 Cb 0.09 -2.48 0.04 0.00 -1.82 0.00 0.00 70.33 66.16 1v81 n THR 66 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1v81 s LEU 67 N -0.07 3.01 -0.20 -4.42 2.01 0.19 -4.79 118.68 114.42 1v81 s LEU 67 Ca 0.00 0.92 0.00 0.00 0.01 0.00 0.00 54.13 55.06 1v81 s LEU 67 Cb 0.00 -3.70 0.02 0.00 0.01 0.00 0.00 46.19 42.52 1v81 s LEU 67 CO 0.00 -1.27 -0.15 -1.00 1.01 0.00 0.00 176.35 174.94 1v81 s HIS 68 N -3.22 2.89 0.33 0.29 3.76 0.14 0.20 115.29 119.67 1v81 s HIS 68 Ca 0.57 -1.58 -0.22 0.00 -0.15 0.00 0.00 55.06 53.68 1v81 s HIS 68 Cb -0.11 -1.97 -0.10 0.00 1.11 0.00 0.00 32.58 31.52 1v81 s HIS 68 CO 0.49 -0.76 0.87 -1.17 -0.85 0.00 0.00 174.74 173.31 1v81 s LEU 69 N 1.31 4.20 0.00 0.89 0.20 -1.23 -0.93 118.68 123.12 1v81 s LEU 69 Ca 0.03 1.63 0.00 0.00 0.69 0.00 0.00 54.13 56.48 1v81 s LEU 69 Cb -0.14 -4.05 0.00 0.00 -0.43 0.00 0.00 46.19 41.56 1v81 s LEU 69 CO -0.10 -0.14 0.00 1.33 -0.29 0.00 0.00 176.35 177.16 1v81 n VAL 70 N 0.18 0.00 -2.82 1.68 0.24 -1.22 -4.17 118.33 112.22 1v81 n VAL 70 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 1v81 n VAL 70 Cb 0.52 -1.03 0.00 0.00 -1.47 0.00 0.00 33.84 31.86 1v81 n VAL 70 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1v81 n LEU 71 N 0.00 0.00 -0.62 1.34 -0.00 -1.26 -4.67 117.00 111.78 1v81 n LEU 71 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1v81 n LEU 71 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1v81 n LEU 71 CO 0.00 -0.17 -0.16 0.54 -0.00 0.00 0.00 177.39 177.60 1v81 n ARG 72 N -0.33 -1.75 0.00 1.47 5.12 -1.26 -4.69 116.66 115.22 1v81 n ARG 72 Ca 0.00 1.27 0.00 0.00 -1.93 0.00 0.00 57.85 57.19 1v81 n ARG 72 Cb 0.00 -1.40 0.00 0.00 -1.16 0.00 0.00 32.46 29.90 1v81 n ARG 72 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1v81 n LEU 73 N -0.29 0.00 -4.46 0.55 -0.00 -1.26 -4.15 117.00 107.39 1v81 n LEU 73 Ca 0.00 0.00 -0.54 0.00 -0.00 0.00 0.00 56.01 55.47 1v81 n LEU 73 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 1v81 n LEU 73 CO 0.00 0.00 0.32 0.54 -0.00 0.00 0.00 177.39 178.25 1v81 n ARG 74 N 0.00 0.01 0.00 1.96 3.00 -1.26 -4.78 116.66 115.59 1v81 n ARG 74 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1v81 n ARG 74 Cb 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.18 1v81 n ARG 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1v81 n GLY 75 N 1.72 2.61 0.00 -0.13 0.00 -1.26 -5.22 105.19 102.92 1v81 n GLY 75 Ca 0.19 -0.55 0.14 0.00 0.00 0.00 0.00 46.02 45.80 1v81 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93