#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 0.57 0.04 0.03 0.74 -1.26 -3.92 119.66 115.87 1v81 s GLN 2 Ca 0.00 -0.37 0.01 0.00 0.05 0.00 0.00 55.36 55.05 1v81 s GLN 2 Cb 0.00 -0.52 -0.00 0.00 1.10 0.00 0.00 33.01 33.59 1v81 s GLN 2 CO 0.00 0.14 0.03 0.44 -0.55 0.00 0.00 175.29 175.34 1v81 n ILE 3 N 2.58 0.00 -3.93 -2.34 -5.35 -0.35 -0.13 119.36 109.84 1v81 n ILE 3 Ca -0.15 -0.27 -0.09 0.00 -0.27 0.00 0.00 62.75 61.97 1v81 n ILE 3 Cb 0.57 0.13 -0.07 0.00 -1.74 0.00 0.00 39.64 38.52 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 -2.03 0.33 0.00 4.28 0.08 0.55 -2.33 117.98 118.86 1v81 s PHE 4 Ca 0.04 -0.73 0.01 0.00 0.12 0.00 0.00 56.93 56.37 1v81 s PHE 4 Cb 0.00 -0.10 -0.01 0.00 -0.57 0.00 0.00 43.02 42.35 1v81 s PHE 4 CO 0.03 -0.62 -0.03 0.08 -0.10 0.00 0.00 175.22 174.58 1v81 s VAL 5 N -3.93 0.25 0.00 -0.44 1.01 -1.20 -2.31 120.40 113.79 1v81 s VAL 5 Ca 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1v81 s VAL 5 Cb 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.18 1v81 s VAL 5 CO -0.05 -0.02 0.00 0.29 0.00 0.00 0.00 175.10 175.32 1v81 n LYS 6 N 2.74 1.94 0.00 2.72 5.02 -1.08 -3.06 118.16 126.44 1v81 n LYS 6 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 1v81 n LYS 6 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 1v81 n LYS 6 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1v81 n THR 7 N -0.52 0.00 0.30 -0.18 5.66 -1.26 -3.70 114.28 114.58 1v81 n THR 7 Ca 0.00 0.00 0.15 0.00 -3.05 0.00 0.00 64.05 61.15 1v81 n THR 7 Cb 0.00 0.00 0.81 0.00 -1.55 0.00 0.00 70.33 69.59 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 0.00 1.09 3.38 -1.83 0.92 115.31 118.87 1v81 h LEU 8 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1v81 h LEU 8 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1v81 h LEU 8 CO 0.00 0.00 -1.04 0.71 0.09 0.00 0.00 178.44 178.20 1v81 h THR 9 N 0.00 1.15 -3.75 0.22 1.35 -1.96 -3.49 112.91 106.43 1v81 h THR 9 Ca 0.00 -2.75 -0.06 0.00 -0.55 0.00 0.00 66.41 63.04 1v81 h THR 9 Cb 0.51 2.54 0.05 0.00 -1.73 0.00 0.00 68.15 69.51 1v81 h THR 9 CO 0.00 0.66 -0.22 0.61 -0.25 0.00 0.00 175.52 176.32 1v81 n GLY 10 N 1.36 0.12 3.62 5.82 0.00 0.32 -5.08 105.19 111.35 1v81 n GLY 10 Ca -0.04 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 1v81 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v81 s LYS 11 N -3.35 2.06 -0.21 1.61 1.02 -1.26 -4.95 119.74 114.66 1v81 s LYS 11 Ca 0.12 -2.29 -0.02 0.00 0.02 0.00 0.00 55.97 53.80 1v81 s LYS 11 Cb -0.02 -0.98 0.06 0.00 -0.52 0.00 0.00 37.83 36.38 1v81 s LYS 11 CO 0.23 -0.45 0.01 0.99 -0.92 0.00 0.00 175.35 175.21 1v81 s THR 12 N -3.06 0.82 -0.26 2.17 2.01 -1.26 -3.99 115.64 112.06 1v81 s THR 12 Ca 0.15 -0.77 -0.11 0.00 0.31 0.00 0.00 61.69 61.27 1v81 s THR 12 Cb 0.02 -1.27 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 1v81 s THR 12 CO 0.10 -0.19 0.21 0.27 -0.69 0.00 0.00 174.62 174.31 1v81 s ILE 13 N 1.72 5.30 -0.27 1.82 -0.00 -1.17 -4.90 121.20 123.71 1v81 s ILE 13 Ca -0.02 0.24 -0.29 0.00 -0.00 0.00 0.00 60.65 60.58 1v81 s ILE 13 Cb -0.18 -3.55 0.01 0.00 -0.00 0.00 0.00 42.46 38.75 1v81 s ILE 13 CO -0.08 0.27 1.10 -0.89 -0.00 0.00 0.00 174.94 175.34 1v81 s THR 14 N 1.58 4.52 0.24 8.37 2.01 -1.26 -3.21 115.64 127.88 1v81 s THR 14 Ca 0.08 1.79 0.06 0.00 0.31 0.00 0.00 61.69 63.94 1v81 s THR 14 Cb -0.15 -4.32 -0.05 0.00 0.01 0.00 0.00 72.50 67.99 1v81 s THR 14 CO 0.09 -0.33 -0.09 -0.76 -0.69 0.00 0.00 174.62 172.84 1v81 s LEU 15 N 3.53 2.48 -0.47 4.42 1.02 -0.98 -4.99 118.68 123.68 1v81 s LEU 15 Ca 0.47 -1.12 0.03 0.00 0.02 0.00 0.00 54.13 53.53 1v81 s LEU 15 Cb -0.14 -0.59 0.15 0.00 0.02 0.00 0.00 46.19 45.63 1v81 s LEU 15 CO 0.12 -0.30 0.29 -1.83 0.02 0.00 0.00 176.35 174.66 1v81 s GLU 16 N -3.71 1.36 0.50 1.70 -1.05 -1.26 -1.21 118.70 115.03 1v81 s GLU 16 Ca 0.26 -2.20 0.05 0.00 -0.15 0.00 0.00 54.97 52.94 1v81 s GLU 16 Cb 0.02 -2.29 0.01 0.00 -0.44 0.00 0.00 34.13 31.43 1v81 s GLU 16 CO 0.09 -1.22 0.29 0.14 0.95 0.00 0.00 175.26 175.51 1v81 s VAL 17 N 0.06 1.81 -0.05 1.83 -7.23 -1.25 -4.96 120.40 110.61 1v81 s VAL 17 Ca 0.21 -1.60 -0.04 0.00 -1.81 0.00 0.00 61.98 58.75 1v81 s VAL 17 Cb -0.16 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 1v81 s VAL 17 CO -0.06 0.00 0.14 -1.61 -0.31 0.00 0.00 175.10 173.26 1v81 s GLU 18 N -4.12 3.34 0.00 4.82 2.02 -1.26 -4.51 118.70 118.99 1v81 s GLU 18 Ca 0.33 -0.29 0.24 0.00 0.02 0.00 0.00 54.97 55.26 1v81 s GLU 18 Cb -0.00 -3.06 1.39 0.00 0.10 0.00 0.00 34.13 32.55 1v81 s GLU 18 CO 0.19 0.71 1.79 -0.35 0.02 0.00 0.00 175.26 177.62 1v81 n PRO 19 N 1.44 0.70 -0.07 0.39 -0.04 -1.26 -1.96 135.00 134.19 1v81 n PRO 19 Ca -0.15 0.01 0.02 0.00 -0.04 0.00 0.00 63.50 63.34 1v81 n PRO 19 Cb 0.54 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.56 1v81 n PRO 19 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1v81 n SER 20 N -1.03 2.30 -4.91 3.54 7.64 -1.26 0.18 113.62 120.08 1v81 n SER 20 Ca 0.17 -1.91 -0.28 0.00 1.01 0.00 0.00 58.87 57.86 1v81 n SER 20 Cb 0.09 -0.09 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1v81 n SER 20 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1v81 s ASP 21 N -0.94 6.40 0.33 6.43 -4.77 -0.83 -4.83 116.67 118.46 1v81 s ASP 21 Ca 0.10 0.76 -0.24 0.00 -3.30 0.00 0.00 52.55 49.86 1v81 s ASP 21 Cb 0.05 -2.17 -0.10 0.00 -1.09 0.00 0.00 42.92 39.62 1v81 s ASP 21 CO 0.07 -0.30 0.92 0.28 0.70 0.00 0.00 175.17 176.83 1v81 s THR 22 N -2.27 4.29 0.46 2.11 -1.32 -1.26 -2.15 115.64 115.49 1v81 s THR 22 Ca 0.45 1.70 0.32 0.00 -1.21 0.00 0.00 61.69 62.94 1v81 s THR 22 Cb -0.10 -3.92 0.52 0.00 -1.51 0.00 0.00 72.50 67.48 1v81 s THR 22 CO 0.34 0.07 1.66 0.40 -2.21 0.00 0.00 174.62 174.88 1v81 h ILE 23 N 2.51 0.19 -0.76 5.08 1.08 -1.69 1.65 117.51 125.56 1v81 h ILE 23 Ca -0.47 -0.04 0.02 0.00 -0.39 0.00 0.00 64.86 63.98 1v81 h ILE 23 Cb 1.19 0.08 -0.04 0.00 -3.07 0.00 0.00 36.82 34.97 1v81 h ILE 23 CO 0.64 0.02 0.50 -0.33 -0.69 0.00 0.00 178.15 178.29 1v81 h GLU 24 N 0.11 0.96 -0.26 2.37 4.39 -1.86 0.98 114.58 121.27 1v81 h GLU 24 Ca 0.78 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 60.42 1v81 h GLU 24 Cb 2.55 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 30.97 1v81 h GLU 24 CO -0.30 0.64 0.16 -0.97 -1.16 0.00 0.00 179.01 177.38 1v81 h ASN 25 N 0.99 0.31 -0.37 1.42 -0.00 0.21 1.56 115.58 119.71 1v81 h ASN 25 Ca 0.29 -0.04 -0.06 0.00 -0.00 0.00 0.00 56.30 56.49 1v81 h ASN 25 Cb -0.06 -0.08 -0.01 0.00 -0.00 0.00 0.00 38.32 38.17 1v81 h ASN 25 CO -0.08 0.26 -0.01 0.58 -0.00 0.00 0.00 177.43 178.18 1v81 h VAL 26 N 0.34 1.26 0.00 2.57 2.07 -0.98 -0.83 116.25 120.69 1v81 h VAL 26 Ca 0.10 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.61 1v81 h VAL 26 Cb -0.00 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1v81 h VAL 26 CO -0.02 0.33 0.00 1.17 0.02 0.00 0.00 177.57 179.08 1v81 n LYS 27 N -4.48 0.95 -0.06 1.57 4.81 0.33 -2.85 118.16 118.43 1v81 n LYS 27 Ca -0.01 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.27 1v81 n LYS 27 Cb 0.28 -1.49 -0.14 0.00 0.02 0.00 0.00 35.03 33.70 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 -0.99 1.29 0.13 3.14 0.00 0.53 -3.62 120.51 120.98 1v81 n ALA 28 Ca 0.22 -0.93 -0.05 0.00 0.00 0.00 0.00 53.44 52.68 1v81 n ALA 28 Cb 0.10 -0.42 -0.02 0.00 0.00 0.00 0.00 19.45 19.10 1v81 n ALA 28 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1v81 h LYS 29 N 0.02 -0.32 -0.55 0.00 1.57 -1.04 -1.01 116.57 115.23 1v81 h LYS 29 Ca -0.48 0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.41 1v81 h LYS 29 Cb 2.03 0.07 -0.10 0.00 0.08 0.00 0.00 32.23 34.31 1v81 h LYS 29 CO 0.02 -0.21 -0.44 -0.84 -0.57 0.00 0.00 179.45 177.40 1v81 h ILE 30 N -0.41 0.08 -0.25 1.86 3.07 -1.79 2.31 117.51 122.39 1v81 h ILE 30 Ca -0.03 0.00 0.07 0.00 1.55 0.00 0.00 64.86 66.45 1v81 h ILE 30 Cb 0.26 0.08 -0.01 0.00 -0.27 0.00 0.00 36.82 36.88 1v81 h ILE 30 CO 0.06 0.00 0.41 1.56 -1.05 0.00 0.00 178.15 179.13 1v81 h GLN 31 N -0.25 0.00 0.11 0.16 1.08 -1.62 0.20 115.11 114.79 1v81 h GLN 31 Ca 0.17 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 57.01 1v81 h GLN 31 Cb 0.57 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.98 1v81 h GLN 31 CO -0.67 0.00 -1.97 -0.25 -0.95 0.00 0.00 178.83 174.99 1v81 n ASP 32 N -3.37 2.10 -0.08 1.46 8.00 0.58 -0.78 116.55 124.47 1v81 n ASP 32 Ca 0.04 0.21 -0.14 0.00 0.71 0.00 0.00 54.79 55.61 1v81 n ASP 32 Cb 0.54 -0.85 -0.10 0.00 -0.02 0.00 0.00 41.12 40.69 1v81 n ASP 32 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1v81 h LYS 33 N -0.02 -0.44 0.01 -1.24 1.79 0.62 -3.13 116.57 114.16 1v81 h LYS 33 Ca -0.43 0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.07 1v81 h LYS 33 Cb 1.97 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 32.72 1v81 h LYS 33 CO 0.06 -0.29 -0.00 1.05 -1.08 0.00 0.00 179.45 179.18 1v81 h GLU 34 N -0.46 -0.01 0.00 3.15 9.09 -1.57 -3.49 114.58 121.30 1v81 h GLU 34 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.46 1v81 h GLU 34 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.70 1v81 h GLU 34 CO -0.51 0.67 0.00 0.41 0.05 0.00 0.00 179.01 179.64 1v81 n GLY 35 N 1.61 1.63 3.38 1.06 0.00 -0.65 -5.11 105.19 107.10 1v81 n GLY 35 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.00 2.41 0.33 -0.61 2.07 0.04 -4.98 121.20 118.46 1v81 s ILE 36 Ca 0.00 -1.08 -0.27 0.00 -1.41 0.00 0.00 60.65 57.89 1v81 s ILE 36 Cb 0.00 -1.90 -0.09 0.00 0.13 0.00 0.00 42.46 40.59 1v81 s ILE 36 CO 0.00 0.51 1.07 -2.16 -1.91 0.00 0.00 174.94 172.45 1v81 s PRO 37 N -0.86 4.44 0.44 3.50 0.04 -1.26 -4.27 135.00 137.04 1v81 s PRO 37 Ca 0.11 1.67 0.25 0.00 0.04 0.00 0.00 61.00 63.07 1v81 s PRO 37 Cb -0.10 -2.92 0.73 0.00 0.04 0.00 0.00 34.50 32.25 1v81 s PRO 37 CO 0.01 0.07 1.74 -1.00 0.04 0.00 0.00 177.00 177.86 1v81 h PRO 38 N 3.27 0.00 -1.68 0.56 0.13 -1.89 -3.20 132.00 129.19 1v81 h PRO 38 Ca -0.47 0.00 0.49 0.00 -0.87 0.00 0.00 66.00 65.14 1v81 h PRO 38 Cb 1.21 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.28 1v81 h PRO 38 CO 0.65 0.15 1.32 -0.44 -0.23 0.00 0.00 178.00 179.45 1v81 h ASP 39 N 0.00 0.00 0.01 1.44 3.32 -1.97 0.60 116.42 119.82 1v81 h ASP 39 Ca -0.00 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.76 1v81 h ASP 39 Cb 0.86 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 1v81 h ASP 39 CO 0.02 0.00 -1.57 0.00 -1.72 0.00 0.00 179.24 175.97 1v81 n GLN 40 N -3.79 0.59 0.00 3.56 3.00 -1.21 -4.97 117.38 114.55 1v81 n GLN 40 Ca 0.38 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.86 1v81 n GLN 40 Cb 1.83 -1.70 0.00 0.00 0.00 0.00 0.00 30.24 30.37 1v81 n GLN 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1v81 n GLN 41 N -4.31 0.18 0.00 -1.09 1.13 0.21 -4.95 117.38 108.55 1v81 n GLN 41 Ca -0.36 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.70 1v81 n GLN 41 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.10 1v81 n GLN 41 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1v81 n ARG 42 N -0.79 0.00 -2.61 -1.09 1.74 -1.26 -4.86 116.66 107.79 1v81 n ARG 42 Ca 0.00 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.76 1v81 n ARG 42 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.40 1v81 n ARG 42 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1v81 s LEU 43 N 0.00 3.76 0.01 0.55 2.01 -1.26 -3.39 118.68 120.36 1v81 s LEU 43 Ca 0.00 1.50 -0.02 0.00 0.01 0.00 0.00 54.13 55.62 1v81 s LEU 43 Cb 0.00 -4.40 -0.01 0.00 0.01 0.00 0.00 46.19 41.78 1v81 s LEU 43 CO 0.00 -0.48 0.03 -0.63 1.01 0.00 0.00 176.35 176.28 1v81 s ILE 44 N -2.44 0.09 -0.30 -0.59 -1.09 -0.90 -3.72 121.20 112.25 1v81 s ILE 44 Ca 0.58 -0.76 -0.14 0.00 -2.23 0.00 0.00 60.65 58.09 1v81 s ILE 44 Cb -0.10 -0.30 0.15 0.00 -1.58 0.00 0.00 42.46 40.63 1v81 s ILE 44 CO 0.26 -0.42 0.89 0.12 -1.23 0.00 0.00 174.94 174.56 1v81 s PHE 45 N -1.31 -0.84 0.00 3.97 5.36 -1.21 -0.75 117.98 123.20 1v81 s PHE 45 Ca -0.14 1.50 0.00 0.00 -0.96 0.00 0.00 56.93 57.32 1v81 s PHE 45 Cb -0.08 0.50 0.00 0.00 -0.34 0.00 0.00 43.02 43.10 1v81 s PHE 45 CO -0.00 -0.41 0.00 0.00 -1.46 0.00 0.00 175.22 173.34 1v81 n ALA 46 N 4.80 0.00 -0.53 11.12 0.00 -1.26 -1.38 120.51 133.26 1v81 n ALA 46 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1v81 n ALA 46 Cb 0.53 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.95 0.92 3.97 0.00 0.00 -1.26 -5.08 105.19 102.79 1v81 n GLY 47 Ca 0.00 -0.43 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 1v81 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v81 s LYS 48 N -1.23 3.39 0.00 1.61 3.01 -0.48 -4.99 119.74 121.05 1v81 s LYS 48 Ca 0.00 -0.75 0.30 0.00 -1.01 0.00 0.00 55.97 54.51 1v81 s LYS 48 Cb 0.00 -2.85 1.51 0.00 -1.01 0.00 0.00 37.83 35.48 1v81 s LYS 48 CO 0.00 0.34 2.04 0.94 0.51 0.00 0.00 175.35 179.18 1v81 n GLN 49 N -1.49 0.45 -2.97 1.68 7.27 -1.26 -3.34 117.38 117.72 1v81 n GLN 49 Ca -0.07 0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.01 1v81 n GLN 49 Cb 0.57 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.72 1v81 n GLN 49 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1v81 n LEU 50 N -1.27 -3.41 -4.46 1.69 4.77 -1.24 -4.51 117.00 108.56 1v81 n LEU 50 Ca 0.15 0.43 -0.28 0.00 -0.03 0.00 0.00 56.01 56.27 1v81 n LEU 50 Cb 0.23 -1.45 -0.11 0.00 -2.33 0.00 0.00 43.42 39.75 1v81 n LEU 50 CO 0.22 -1.45 -0.51 -0.70 -1.33 0.00 0.00 177.39 173.62 1v81 s GLU 51 N -0.82 1.68 0.65 3.23 2.56 -1.26 -4.42 118.70 120.31 1v81 s GLU 51 Ca 0.00 -1.33 0.25 0.00 0.00 0.00 0.00 54.97 53.89 1v81 s GLU 51 Cb 0.00 -2.00 1.33 0.00 2.00 0.00 0.00 34.13 35.46 1v81 s GLU 51 CO 0.00 0.44 1.75 0.22 -0.56 0.00 0.00 175.26 177.11 1v81 h ASP 52 N 3.46 0.00 -0.49 -1.70 3.58 -1.93 -2.76 116.42 116.58 1v81 h ASP 52 Ca -0.49 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.01 1v81 h ASP 52 Cb 1.19 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.18 1v81 h ASP 52 CO 0.47 0.00 -0.29 0.61 -2.88 0.00 0.00 179.24 177.14 1v81 n GLY 53 N -1.34 -1.81 2.90 -0.78 0.00 -1.26 -4.31 105.19 98.59 1v81 n GLY 53 Ca 0.01 0.69 -0.22 0.00 0.00 0.00 0.00 46.02 46.50 1v81 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v81 n ARG 54 N -4.28 0.92 -0.40 1.61 1.74 -1.04 -5.01 116.66 110.20 1v81 n ARG 54 Ca 0.01 -2.71 0.00 0.00 -0.77 0.00 0.00 57.85 54.38 1v81 n ARG 54 Cb 0.13 0.42 0.00 0.00 -1.02 0.00 0.00 32.46 31.98 1v81 n ARG 54 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1v81 n THR 55 N -1.35 0.00 0.08 0.55 -2.24 -1.26 -2.63 114.28 107.42 1v81 n THR 55 Ca -0.06 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.51 1v81 n THR 55 Cb 0.49 -0.86 -0.15 0.00 -2.10 0.00 0.00 70.33 67.70 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 0.57 -2.39 3.22 3.38 -1.48 -3.13 115.31 115.48 1v81 h LEU 56 Ca 0.00 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.03 1v81 h LEU 56 Cb 0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1v81 h LEU 56 CO 0.00 1.48 0.01 0.77 0.09 0.00 0.00 178.44 180.79 1v81 h SER 57 N -0.24 0.00 0.88 -0.43 4.64 0.18 1.52 113.55 120.10 1v81 h SER 57 Ca -0.17 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.01 1v81 h SER 57 Cb 1.78 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.85 1v81 h SER 57 CO 0.18 0.00 -0.67 0.44 -0.87 0.00 0.00 176.83 175.91 1v81 h ASP 58 N 0.00 0.00 -0.22 4.97 3.32 -1.79 -3.04 116.42 119.65 1v81 h ASP 58 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1v81 h ASP 58 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1v81 h ASP 58 CO -0.00 0.67 0.00 -1.22 -1.72 0.00 0.00 179.24 176.97 1v81 n TYR 59 N -3.55 0.28 -1.10 4.55 4.01 0.70 -4.93 117.16 117.13 1v81 n TYR 59 Ca -0.00 -0.17 -0.03 0.00 -0.16 0.00 0.00 57.90 57.53 1v81 n TYR 59 Cb 0.71 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.72 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 1.12 -3.91 -4.55 7.72 2.85 0.29 -4.93 115.26 113.85 1v81 n ASN 60 Ca 0.14 0.08 -0.40 0.00 -0.11 0.00 0.00 54.58 54.29 1v81 n ASN 60 Cb 0.50 -1.70 -0.03 0.00 1.24 0.00 0.00 39.78 39.79 1v81 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1v81 s ILE 61 N -1.95 3.77 -0.19 -1.44 1.01 0.44 -4.90 121.20 117.95 1v81 s ILE 61 Ca 0.00 -0.15 -0.27 0.00 0.00 0.00 0.00 60.65 60.22 1v81 s ILE 61 Cb 0.00 -4.88 0.08 0.00 0.01 0.00 0.00 42.46 37.67 1v81 s ILE 61 CO 0.00 -1.80 0.75 0.00 0.00 0.00 0.00 174.94 173.90 1v81 s GLN 62 N 5.54 0.87 0.10 2.79 -2.07 -1.26 -4.04 119.66 121.59 1v81 s GLN 62 Ca 0.43 0.64 0.00 0.00 -1.82 0.00 0.00 55.36 54.61 1v81 s GLN 62 Cb -0.05 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.29 1v81 s GLN 62 CO 0.04 -0.18 0.00 1.17 -1.32 0.00 0.00 175.29 174.99 1v81 n LYS 63 N 1.88 -1.92 -2.19 9.60 0.00 -1.26 -4.53 118.16 119.74 1v81 n LYS 63 Ca -0.15 1.54 0.00 0.00 0.00 0.00 0.00 58.31 59.70 1v81 n LYS 63 Cb 0.56 -1.49 0.00 0.00 0.00 0.00 0.00 35.03 34.10 1v81 n LYS 63 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1v81 n GLU 64 N 0.30 -0.35 -3.19 1.64 1.02 0.82 -4.77 120.64 116.11 1v81 n GLU 64 Ca 0.00 -0.17 -0.33 0.00 -0.02 0.00 0.00 57.16 56.64 1v81 n GLU 64 Cb 0.00 0.31 -0.06 0.00 -0.02 0.00 0.00 31.44 31.67 1v81 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1v81 s SER 65 N -2.40 6.77 -0.17 1.62 0.01 -1.25 -4.80 113.70 113.47 1v81 s SER 65 Ca 0.00 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.49 1v81 s SER 65 Cb 0.00 -2.35 0.04 0.00 0.21 0.00 0.00 66.02 63.92 1v81 s SER 65 CO 0.00 -0.16 -0.08 -0.89 0.41 0.00 0.00 173.24 172.52 1v81 s THR 66 N -1.91 1.38 0.55 1.44 2.01 -1.25 0.21 115.64 118.05 1v81 s THR 66 Ca 0.52 -0.77 0.02 0.00 0.31 0.00 0.00 61.69 61.77 1v81 s THR 66 Cb -0.11 -1.47 0.11 0.00 0.01 0.00 0.00 72.50 71.03 1v81 s THR 66 CO 0.18 0.20 0.75 0.18 -0.69 0.00 0.00 174.62 175.24 1v81 n LEU 67 N 4.79 0.00 -3.71 4.42 7.99 -0.98 -4.86 117.00 124.65 1v81 n LEU 67 Ca -0.14 -1.72 -0.24 0.00 -0.01 0.00 0.00 56.01 53.90 1v81 n LEU 67 Cb 0.48 -0.47 -0.17 0.00 -0.11 0.00 0.00 43.42 43.14 1v81 n LEU 67 CO 0.19 -0.84 -0.36 -1.00 -1.51 0.00 0.00 177.39 173.87 1v81 s HIS 68 N -2.25 0.58 0.29 -1.77 3.76 0.07 -2.65 115.29 113.32 1v81 s HIS 68 Ca 0.51 -0.33 -0.28 0.00 -0.15 0.00 0.00 55.06 54.81 1v81 s HIS 68 Cb -0.03 -0.80 -0.09 0.00 1.11 0.00 0.00 32.58 32.77 1v81 s HIS 68 CO 0.34 -0.43 0.96 -0.51 -0.85 0.00 0.00 174.74 174.25 1v81 s LEU 69 N 2.00 4.46 0.00 0.89 1.43 -1.24 -2.13 118.68 124.09 1v81 s LEU 69 Ca 0.03 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.04 1v81 s LEU 69 Cb -0.14 -3.85 0.07 0.00 0.03 0.00 0.00 46.19 42.29 1v81 s LEU 69 CO -0.06 -0.01 0.51 1.33 0.23 0.00 0.00 176.35 178.34 1v81 n VAL 70 N 0.90 0.00 -0.99 -1.59 0.24 -1.22 -4.38 118.33 111.30 1v81 n VAL 70 Ca 0.00 -0.82 -0.36 0.00 -2.04 0.00 0.00 64.34 61.13 1v81 n VAL 70 Cb 0.49 -1.10 0.05 0.00 -1.47 0.00 0.00 33.84 31.80 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 -5.45 0.00 1.34 -0.00 -1.26 -4.66 117.00 106.97 1v81 n LEU 71 Ca 0.08 0.17 0.00 0.00 -0.00 0.00 0.00 56.01 56.27 1v81 n LEU 71 Cb 0.30 -0.77 0.00 0.00 -0.00 0.00 0.00 43.42 42.95 1v81 n LEU 71 CO 0.20 -5.63 0.00 -1.14 -0.00 0.00 0.00 177.39 170.82 1v81 n ARG 72 N 2.21 3.20 -3.22 1.47 0.63 -1.26 -4.77 116.66 114.92 1v81 n ARG 72 Ca -0.01 0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.71 1v81 n ARG 72 Cb 0.57 0.00 0.04 0.00 0.45 0.00 0.00 32.46 33.52 1v81 n ARG 72 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1v81 s LEU 73 N 0.00 3.07 0.73 6.15 1.43 -1.26 -5.06 118.68 123.74 1v81 s LEU 73 Ca 0.00 -0.90 -0.17 0.00 -1.03 0.00 0.00 54.13 52.03 1v81 s LEU 73 Cb 0.00 -1.62 -0.14 0.00 0.03 0.00 0.00 46.19 44.45 1v81 s LEU 73 CO 0.00 -1.23 -0.40 -2.11 0.23 0.00 0.00 176.35 172.84 1v81 n ARG 74 N -2.10 0.01 0.00 1.70 0.00 -1.26 -4.72 116.66 110.30 1v81 n ARG 74 Ca 0.11 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.97 1v81 n ARG 74 Cb 0.62 -1.04 0.00 0.00 -0.00 0.00 0.00 32.46 32.04 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 2.90 0.07 0.00 2.89 0.00 -1.26 -5.32 105.19 104.47 1v81 n GLY 75 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1v81 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93