#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2opv n GLN 6 N 0.00 2.33 0.00 1.61 1.13 -1.26 -4.68 117.38 116.51 2opv n GLN 6 Ca 0.00 -2.55 0.00 0.00 -1.94 0.00 0.00 57.00 52.51 2opv n GLN 6 Cb 0.00 -2.02 0.00 0.00 0.11 0.00 0.00 30.24 28.33 2opv n GLN 6 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 2opv n PHE 7 N -0.18 0.00 -2.23 1.08 1.16 -1.26 -2.16 117.46 113.88 2opv n PHE 7 Ca 0.48 -0.21 -0.02 0.00 -1.87 0.00 0.00 57.45 55.84 2opv n PHE 7 Cb 0.57 -0.15 0.02 0.00 -1.61 0.00 0.00 39.48 38.31 2opv n PHE 7 CO 0.00 0.00 0.00 1.58 -1.87 0.00 0.00 176.76 176.47 2opv n HIS 8 N 0.43 -0.51 -2.24 2.97 -0.00 -1.26 -3.79 115.22 110.82 2opv n HIS 8 Ca 0.00 -0.50 -0.33 0.00 -0.00 0.00 0.00 57.72 56.88 2opv n HIS 8 Cb 0.28 0.72 -0.04 0.00 -0.00 0.00 0.00 29.99 30.95 2opv n HIS 8 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2opv s ASP 9 N -0.44 5.64 0.00 0.26 2.15 -0.92 -4.35 116.67 119.01 2opv s ASP 9 Ca 0.02 -0.80 0.00 0.00 0.43 0.00 0.00 52.55 52.21 2opv s ASP 9 Cb 0.11 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 2opv s ASP 9 CO -0.03 -2.27 0.00 -3.20 -0.17 0.00 0.00 175.17 169.50 2opv n ASN 10 N 12.00 0.00 -0.28 -0.34 5.15 -1.26 -4.73 115.26 125.80 2opv n ASN 10 Ca 0.34 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.32 2opv n ASN 10 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 2opv n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2opv n ALA 11 N 0.00 0.00 -0.56 5.20 0.00 -1.26 -5.05 120.51 118.85 2opv n ALA 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2opv n ALA 11 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2opv n ALA 11 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2opv n ASN 12 N 0.00 -3.07 0.00 0.00 2.85 -1.11 -4.21 115.26 109.72 2opv n ASN 12 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2opv n ASN 12 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2opv n ASN 12 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2opv n GLY 13 N 0.00 2.20 0.09 8.20 0.00 -1.25 -3.90 105.19 110.53 2opv n GLY 13 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 46.02 46.07 2opv n GLY 13 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2opv h GLY 14 N 0.00 -0.15 -7.24 -0.02 0.00 -1.95 -3.42 103.07 90.29 2opv h GLY 14 Ca 0.00 0.06 -0.68 0.00 0.00 0.00 0.00 47.33 46.71 2opv h GLY 14 CO 0.00 -0.06 0.03 1.62 0.00 0.00 0.00 176.54 178.13 2opv s GLN 15 N -1.97 3.14 -0.78 4.80 2.00 -1.25 -5.00 119.66 120.60 2opv s GLN 15 Ca -0.02 -0.79 -0.18 0.00 -2.00 0.00 0.00 55.36 52.37 2opv s GLN 15 Cb 0.00 -4.06 0.15 0.00 0.80 0.00 0.00 33.01 29.90 2opv s GLN 15 CO 0.06 -1.14 0.88 -0.80 -0.50 0.00 0.00 175.29 173.79 2opv s ASN 16 N 2.47 6.50 -0.41 6.67 0.01 -1.26 -2.74 114.94 126.18 2opv s ASN 16 Ca 0.16 -2.00 -0.03 0.00 -0.71 0.00 0.00 52.86 50.28 2opv s ASN 16 Cb -0.18 -2.31 0.08 0.00 0.41 0.00 0.00 41.25 39.25 2opv s ASN 16 CO 0.13 -0.95 2.66 0.61 -1.51 0.00 0.00 177.10 178.04 2opv n GLY 17 N 4.98 4.26 2.99 0.66 0.00 -1.21 -4.09 105.19 112.78 2opv n GLY 17 Ca 0.09 -1.71 -0.13 0.00 0.00 0.00 0.00 46.02 44.26 2opv n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2opv s THR 18 N -2.14 -0.16 -0.04 2.61 2.01 -0.93 -4.98 115.64 112.02 2opv s THR 18 Ca 0.54 0.21 -0.01 0.00 0.31 0.00 0.00 61.69 62.75 2opv s THR 18 Cb 0.36 -0.36 0.03 0.00 0.01 0.00 0.00 72.50 72.53 2opv s THR 18 CO -0.17 0.09 0.02 -0.69 -0.69 0.00 0.00 174.62 173.18 2opv s VAL 19 N 1.65 0.08 -0.25 3.82 1.01 -1.26 -0.14 120.40 125.32 2opv s VAL 19 Ca -0.05 0.21 -0.03 0.00 0.00 0.00 0.00 61.98 62.11 2opv s VAL 19 Cb -0.11 -0.24 0.02 0.00 0.00 0.00 0.00 36.38 36.05 2opv s VAL 19 CO -0.08 0.16 -0.03 -1.10 0.00 0.00 0.00 175.10 174.05 2opv s GLN 20 N 1.48 2.98 -0.37 2.72 -0.21 -1.05 -4.93 119.66 120.28 2opv s GLN 20 Ca -0.04 -0.89 -0.24 0.00 0.02 0.00 0.00 55.36 54.22 2opv s GLN 20 Cb -0.13 -3.05 0.01 0.00 1.00 0.00 0.00 33.01 30.84 2opv s GLN 20 CO -0.03 -0.37 0.81 -1.21 -2.12 0.00 0.00 175.29 172.38 2opv s GLU 21 N 1.38 3.74 0.13 2.91 2.02 -1.24 -2.26 118.70 125.38 2opv s GLU 21 Ca 0.02 0.32 -0.02 0.00 0.02 0.00 0.00 54.97 55.31 2opv s GLU 21 Cb -0.16 -3.82 -0.05 0.00 0.10 0.00 0.00 34.13 30.20 2opv s GLU 21 CO -0.03 -0.90 0.32 0.42 0.02 0.00 0.00 175.26 175.09 2opv s ILE 22 N 3.21 5.26 -0.51 -1.63 -1.09 0.49 -4.86 121.20 122.06 2opv s ILE 22 Ca 0.33 -0.24 -0.11 0.00 -2.23 0.00 0.00 60.65 58.39 2opv s ILE 22 Cb -0.13 -3.66 0.13 0.00 -1.58 0.00 0.00 42.46 37.22 2opv s ILE 22 CO 0.18 0.01 0.41 -0.04 -1.23 0.00 0.00 174.94 174.27 2opv s MET 23 N -2.81 2.67 -0.16 2.79 -1.94 -1.25 -0.87 119.30 117.73 2opv s MET 23 Ca 0.38 -1.81 -0.26 0.00 -1.71 0.00 0.00 55.69 52.29 2opv s MET 23 Cb -0.12 -4.05 -0.01 0.00 2.01 0.00 0.00 34.83 32.66 2opv s MET 23 CO 0.27 -1.24 0.88 0.42 -0.01 0.00 0.00 175.02 175.34 2opv s ILE 24 N 1.32 4.85 0.14 2.53 -1.09 0.45 -4.61 121.20 124.79 2opv s ILE 24 Ca 0.06 1.73 -0.35 0.00 -2.23 0.00 0.00 60.65 59.87 2opv s ILE 24 Cb -0.26 -4.18 -0.15 0.00 -1.58 0.00 0.00 42.46 36.29 2opv s ILE 24 CO -0.00 0.01 1.48 -2.65 -1.23 0.00 0.00 174.94 172.55 2opv n PRO 25 N 5.25 1.79 -0.23 2.79 -0.02 -1.26 0.63 135.00 143.95 2opv n PRO 25 Ca 0.06 0.65 0.06 0.00 -2.02 0.00 0.00 63.50 62.24 2opv n PRO 25 Cb 0.49 -2.36 0.31 0.00 -0.02 0.00 0.00 33.50 31.92 2opv n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2opv h ALA 26 N 5.32 1.64 0.07 3.55 0.00 -1.93 0.26 119.26 128.18 2opv h ALA 26 Ca -0.46 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.18 2opv h ALA 26 Cb 1.28 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2opv h ALA 26 CO 0.84 0.23 -1.18 0.78 0.00 0.00 0.00 179.25 179.93 2opv h GLY 27 N 0.85 0.17 1.32 0.00 0.00 -1.92 -3.25 103.07 100.25 2opv h GLY 27 Ca 0.35 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2opv h GLY 27 CO -0.12 0.39 -0.13 1.17 0.00 0.00 0.00 176.54 177.84 2opv n LYS 28 N -3.44 0.34 0.30 4.80 3.00 -0.63 -3.71 118.16 118.82 2opv n LYS 28 Ca -0.06 -0.09 0.20 0.00 -0.00 0.00 0.00 58.31 58.36 2opv n LYS 28 Cb 0.99 -1.50 1.04 0.00 0.00 0.00 0.00 35.03 35.56 2opv n LYS 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2opv h ALA 29 N 3.31 1.00 -0.75 3.14 0.00 -0.55 -1.62 119.26 123.78 2opv h ALA 29 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2opv h ALA 29 Cb 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2opv h ALA 29 CO 0.00 0.00 0.50 0.78 0.00 0.00 0.00 179.25 180.53 2opv h GLY 30 N 0.44 1.04 1.70 0.00 0.00 -1.80 -1.62 103.07 102.82 2opv h GLY 30 Ca 0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 47.33 46.77 2opv h GLY 30 CO 0.00 0.29 -1.11 1.41 0.00 0.00 0.00 176.54 177.13 2opv h LEU 31 N 0.89 0.00 -1.15 3.11 3.38 -1.55 0.37 115.31 120.36 2opv h LEU 31 Ca 0.31 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.19 2opv h LEU 31 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2opv h LEU 31 CO -0.09 0.89 -0.39 1.62 0.09 0.00 0.00 178.44 180.55 2opv h VAL 32 N 0.00 1.12 0.03 1.22 3.04 -1.44 -3.11 116.25 117.12 2opv h VAL 32 Ca -0.08 -1.43 -0.18 0.00 -1.01 0.00 0.00 66.70 64.00 2opv h VAL 32 Cb 1.75 1.80 -0.02 0.00 -2.01 0.00 0.00 31.29 32.82 2opv h VAL 32 CO 0.10 0.39 -0.97 0.40 -1.01 0.00 0.00 177.57 176.48 2opv h ILE 33 N 0.00 1.18 0.00 3.17 2.04 -1.32 -3.37 117.51 119.21 2opv h ILE 33 Ca -0.00 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 63.57 2opv h ILE 33 Cb 0.77 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.52 2opv h ILE 33 CO 0.05 0.50 0.00 0.61 0.00 0.00 0.00 178.15 179.31 2opv n GLY 34 N 1.57 2.96 0.21 5.37 0.00 0.12 -1.21 105.19 114.20 2opv n GLY 34 Ca -0.24 -1.83 0.07 0.00 0.00 0.00 0.00 46.02 44.01 2opv n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2opv h LYS 35 N 0.00 0.00 0.00 1.61 6.56 -1.86 -3.21 116.57 119.67 2opv h LYS 35 Ca 0.00 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.49 2opv h LYS 35 Cb 0.00 0.00 -0.21 0.00 -0.57 0.00 0.00 32.23 31.45 2opv h LYS 35 CO 0.00 0.30 -0.75 0.41 -2.06 0.00 0.00 179.45 177.35 2opv n GLY 36 N -0.31 0.78 2.85 3.86 0.00 -1.26 -4.95 105.19 106.17 2opv n GLY 36 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2opv n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2opv n GLY 37 N 0.26 0.74 0.08 -0.02 0.00 -1.21 -4.87 105.19 100.17 2opv n GLY 37 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 2opv n GLY 37 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2opv h GLU 38 N 2.10 0.00 -0.32 1.61 -0.00 -1.86 -3.38 114.58 112.73 2opv h GLU 38 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 59.36 59.38 2opv h GLU 38 Cb 0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.76 2opv h GLU 38 CO 0.00 0.62 0.17 1.15 -0.00 0.00 0.00 179.01 180.95 2opv h THR 39 N 0.00 1.00 -0.41 -1.06 2.02 -1.89 -0.73 112.91 111.85 2opv h THR 39 Ca -0.14 -0.12 0.04 0.00 0.77 0.00 0.00 66.41 66.96 2opv h THR 39 Cb 1.79 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.81 2opv h THR 39 CO 0.09 0.06 0.27 -0.29 0.37 0.00 0.00 175.52 176.02 2opv h ILE 40 N 0.34 1.00 -0.19 3.11 2.10 -1.33 0.16 117.51 122.71 2opv h ILE 40 Ca 0.13 -0.13 -0.18 0.00 1.08 0.00 0.00 64.86 65.76 2opv h ILE 40 Cb 0.03 0.58 -0.00 0.00 -1.09 0.00 0.00 36.82 36.34 2opv h ILE 40 CO -0.08 0.07 -0.60 0.50 -1.08 0.00 0.00 178.15 176.96 2opv h LYS 41 N 0.38 0.64 -0.42 2.19 3.64 -1.48 -3.10 116.57 118.41 2opv h LYS 41 Ca 0.17 -0.43 -0.10 0.00 -1.27 0.00 0.00 60.65 59.03 2opv h LYS 41 Cb 0.20 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2opv h LYS 41 CO -0.04 1.05 -0.12 1.96 -2.27 0.00 0.00 179.45 180.03 2opv h GLN 42 N 0.48 0.82 -0.93 1.90 4.20 0.38 -2.94 115.11 119.01 2opv h GLN 42 Ca -0.00 -0.32 0.12 0.00 0.06 0.00 0.00 58.65 58.50 2opv h GLN 42 Cb 1.17 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.83 2opv h GLN 42 CO 0.12 0.95 0.56 -0.07 -0.67 0.00 0.00 178.83 179.72 2opv h LEU 43 N 0.65 0.81 -0.66 1.46 3.38 -0.74 0.15 115.31 120.35 2opv h LEU 43 Ca 0.10 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2opv h LEU 43 Cb 0.66 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2opv h LEU 43 CO 0.05 0.43 -0.00 1.56 0.09 0.00 0.00 178.44 180.56 2opv h GLN 44 N 0.89 1.04 -0.46 1.13 4.20 -1.46 -2.81 115.11 117.64 2opv h GLN 44 Ca 0.46 -0.33 -0.12 0.00 0.06 0.00 0.00 58.65 58.73 2opv h GLN 44 Cb 0.47 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2opv h GLN 44 CO -0.27 1.02 -0.21 0.93 -0.67 0.00 0.00 178.83 179.63 2opv h GLU 45 N 0.95 0.92 -0.42 1.46 4.39 -0.97 -1.06 114.58 119.84 2opv h GLU 45 Ca 0.17 -0.38 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 2opv h GLU 45 Cb 0.55 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2opv h GLU 45 CO 0.03 1.04 0.18 0.00 -1.16 0.00 0.00 179.01 179.10 2opv h ARG 46 N 0.80 0.63 -0.02 2.33 2.47 -0.55 -3.22 114.38 116.82 2opv h ARG 46 Ca 0.11 -0.11 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2opv h ARG 46 Cb 0.76 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 2opv h ARG 46 CO 0.06 0.57 -0.04 0.00 0.56 0.00 0.00 179.97 181.13 2opv n ALA 47 N -2.30 2.55 -3.31 0.04 0.00 -1.08 -4.97 120.51 111.44 2opv n ALA 47 Ca 0.00 -0.62 -0.18 0.00 0.00 0.00 0.00 53.44 52.65 2opv n ALA 47 Cb 0.14 -0.56 0.06 0.00 0.00 0.00 0.00 19.45 19.09 2opv n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2opv n GLY 48 N 0.96 -0.17 3.62 0.00 0.00 -0.51 -4.79 105.19 104.30 2opv n GLY 48 Ca 0.09 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2opv n GLY 48 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2opv s VAL 49 N -3.24 0.72 -0.10 1.61 -7.23 -0.55 -4.94 120.40 106.68 2opv s VAL 49 Ca 0.42 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.60 2opv s VAL 49 Cb -0.18 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.57 2opv s VAL 49 CO 0.55 0.00 -0.15 -0.75 -0.31 0.00 0.00 175.10 174.44 2opv s LYS 50 N -3.75 2.12 -0.26 4.82 2.20 -0.58 -4.49 119.74 119.80 2opv s LYS 50 Ca 0.14 -0.53 -0.03 0.00 -0.36 0.00 0.00 55.97 55.19 2opv s LYS 50 Cb 0.01 -1.77 0.02 0.00 -1.51 0.00 0.00 37.83 34.58 2opv s LYS 50 CO 0.10 -0.02 -0.03 -1.64 -0.36 0.00 0.00 175.35 173.39 2opv s MET 51 N 0.86 2.91 -0.42 4.03 -1.94 -1.26 -0.01 119.30 123.47 2opv s MET 51 Ca -0.10 -0.94 -0.15 0.00 -1.71 0.00 0.00 55.69 52.79 2opv s MET 51 Cb -0.15 -3.06 0.03 0.00 2.01 0.00 0.00 34.83 33.66 2opv s MET 51 CO 0.01 -0.40 0.33 -1.50 -0.01 0.00 0.00 175.02 173.45 2opv s ILE 52 N 1.36 5.23 -0.62 2.53 2.07 -0.87 -4.98 121.20 125.93 2opv s ILE 52 Ca 0.01 -0.67 -0.24 0.00 -1.41 0.00 0.00 60.65 58.34 2opv s ILE 52 Cb -0.17 -3.97 0.05 0.00 0.13 0.00 0.00 42.46 38.51 2opv s ILE 52 CO -0.03 -0.36 1.00 -0.76 -1.91 0.00 0.00 174.94 172.88 2opv s LEU 53 N 1.73 4.08 -1.09 8.50 2.01 -1.26 -2.77 118.68 129.88 2opv s LEU 53 Ca 0.06 -0.61 -0.22 0.00 0.01 0.00 0.00 54.13 53.37 2opv s LEU 53 Cb -0.19 -2.64 -0.00 0.00 0.01 0.00 0.00 46.19 43.36 2opv s LEU 53 CO 0.10 -1.40 1.75 -0.63 1.01 0.00 0.00 176.35 177.18 2opv s ILE 54 N 4.25 3.76 -0.01 -0.59 1.01 -0.91 -4.42 121.20 124.30 2opv s ILE 54 Ca 0.28 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 60.03 2opv s ILE 54 Cb -0.14 -4.71 -0.08 0.00 0.01 0.00 0.00 42.46 37.54 2opv s ILE 54 CO 0.15 -1.50 0.12 0.00 0.00 0.00 0.00 174.94 173.71 2opv n GLN 55 N 8.64 0.24 -0.03 2.79 10.64 -1.26 -4.14 117.38 134.25 2opv n GLN 55 Ca 0.41 -0.05 -0.04 0.00 -1.83 0.00 0.00 57.00 55.49 2opv n GLN 55 Cb 0.48 -1.12 -0.13 0.00 -0.86 0.00 0.00 30.24 28.61 2opv n GLN 55 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 2opv n ASP 56 N -1.67 0.43 -4.58 2.61 5.75 -1.26 -4.82 116.55 113.01 2opv n ASP 56 Ca -0.01 0.19 -0.40 0.00 -0.01 0.00 0.00 54.79 54.56 2opv n ASP 56 Cb 0.13 0.67 -0.03 0.00 -1.03 0.00 0.00 41.12 40.86 2opv n ASP 56 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2opv s GLY 57 N -5.09 0.25 -1.55 6.12 0.00 -1.26 -4.85 107.32 100.95 2opv s GLY 57 Ca -0.07 0.16 -0.12 0.00 0.00 0.00 0.00 44.72 44.70 2opv s GLY 57 CO 0.83 3.69 2.63 1.44 0.00 0.00 0.00 173.10 181.69 2opv n SER 58 N 12.74 6.69 0.00 1.64 7.64 -1.26 -3.66 113.62 137.40 2opv n SER 58 Ca 0.28 -2.71 0.00 0.00 1.01 0.00 0.00 58.87 57.46 2opv n SER 58 Cb 0.50 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.10 2opv n SER 58 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2opv n GLN 59 N 4.57 0.00 -0.67 1.43 1.13 -1.26 -4.79 117.38 117.78 2opv n GLN 59 Ca 0.67 0.00 0.03 0.00 -1.94 0.00 0.00 57.00 55.75 2opv n GLN 59 Cb 0.30 -0.56 0.21 0.00 0.11 0.00 0.00 30.24 30.29 2opv n GLN 59 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2opv n ASN 60 N -2.90 1.97 -0.12 1.08 4.13 -1.24 -4.79 115.26 113.39 2opv n ASN 60 Ca 0.00 -3.86 -0.01 0.00 1.68 0.00 0.00 54.58 52.38 2opv n ASN 60 Cb 0.48 -0.57 0.23 0.00 -1.54 0.00 0.00 39.78 38.39 2opv n ASN 60 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 2opv h THR 61 N 0.99 1.21 -0.65 3.41 1.35 -1.87 -2.54 112.91 114.80 2opv h THR 61 Ca 0.08 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 2opv h THR 61 Cb 1.22 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 2opv h THR 61 CO 0.13 0.26 0.00 -0.46 -0.25 0.00 0.00 175.52 175.20 2opv n ASN 62 N -4.32 3.98 0.00 5.36 6.94 -1.26 -4.96 115.26 121.00 2opv n ASN 62 Ca 0.04 -2.11 0.00 0.00 -0.02 0.00 0.00 54.58 52.49 2opv n ASN 62 Cb 0.17 -0.47 0.00 0.00 -2.36 0.00 0.00 39.78 37.12 2opv n ASN 62 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2opv n VAL 63 N 1.34 0.00 -1.72 3.53 0.24 -0.96 -4.94 118.33 115.82 2opv n VAL 63 Ca 0.23 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.10 2opv n VAL 63 Cb 0.66 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 33.01 2opv n VAL 63 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2opv n ASP 64 N 0.00 3.45 -4.75 -1.34 9.92 -1.26 -3.99 116.55 118.58 2opv n ASP 64 Ca 0.00 1.14 -0.38 0.00 -0.53 0.00 0.00 54.79 55.02 2opv n ASP 64 Cb 0.00 -1.53 -0.06 0.00 -0.64 0.00 0.00 41.12 38.89 2opv n ASP 64 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2opv s LYS 65 N -0.41 4.29 -0.49 -1.24 -0.14 0.20 -4.64 119.74 117.31 2opv s LYS 65 Ca 0.66 0.56 -0.28 0.00 -1.36 0.00 0.00 55.97 55.55 2opv s LYS 65 Cb -0.55 -3.38 -0.00 0.00 -1.68 0.00 0.00 37.83 32.21 2opv s LYS 65 CO 0.48 0.28 1.64 -2.14 -0.76 0.00 0.00 175.35 174.85 2opv s PRO 66 N 0.17 3.17 -0.28 -1.68 0.02 -1.26 -0.41 135.00 134.74 2opv s PRO 66 Ca 0.28 0.83 -0.06 0.00 0.02 0.00 0.00 61.00 62.07 2opv s PRO 66 Cb -0.16 -4.20 0.01 0.00 0.02 0.00 0.00 34.50 30.16 2opv s PRO 66 CO 0.13 -2.07 0.05 -1.17 -0.33 0.00 0.00 177.00 173.62 2opv s LEU 67 N 6.98 3.66 -0.43 -5.54 2.96 -0.05 -2.14 118.68 124.12 2opv s LEU 67 Ca 0.65 -0.66 -0.15 0.00 -0.22 0.00 0.00 54.13 53.75 2opv s LEU 67 Cb -0.15 -1.85 0.04 0.00 0.50 0.00 0.00 46.19 44.73 2opv s LEU 67 CO 0.27 -0.16 0.34 -0.13 -1.32 0.00 0.00 176.35 175.36 2opv s ARG 68 N 1.49 2.98 -0.56 1.98 0.52 -1.11 -0.38 118.95 123.86 2opv s ARG 68 Ca 0.03 -1.13 -0.24 0.00 -0.52 0.00 0.00 55.73 53.87 2opv s ARG 68 Cb -0.17 -4.04 0.05 0.00 0.52 0.00 0.00 34.95 31.31 2opv s ARG 68 CO 0.01 -0.86 0.93 0.42 0.02 0.00 0.00 175.30 175.82 2opv s ILE 69 N 1.69 4.40 -0.21 1.52 1.09 -0.96 -2.06 121.20 126.68 2opv s ILE 69 Ca 0.05 0.15 -0.13 0.00 -1.10 0.00 0.00 60.65 59.62 2opv s ILE 69 Cb -0.21 -4.55 -0.04 0.00 -1.06 0.00 0.00 42.46 36.60 2opv s ILE 69 CO 0.09 -1.15 0.28 -0.63 -0.10 0.00 0.00 174.94 173.43 2opv s ILE 70 N 3.90 5.29 0.00 2.92 1.01 0.99 -2.52 121.20 132.79 2opv s ILE 70 Ca 0.28 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.39 2opv s ILE 70 Cb -0.13 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.72 2opv s ILE 70 CO 0.17 0.32 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2opv n GLY 71 N 3.95 -0.40 3.12 6.18 0.00 0.81 -1.52 105.19 117.33 2opv n GLY 71 Ca -0.12 0.48 -0.18 0.00 0.00 0.00 0.00 46.02 46.20 2opv n GLY 71 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2opv s ASP 72 N -4.00 1.47 0.36 1.61 2.15 -1.26 -2.18 116.67 114.82 2opv s ASP 72 Ca 0.00 -0.47 0.18 0.00 0.43 0.00 0.00 52.55 52.69 2opv s ASP 72 Cb 0.00 -0.07 1.25 0.00 -0.30 0.00 0.00 42.92 43.79 2opv s ASP 72 CO 0.00 -0.02 1.60 -0.65 -0.17 0.00 0.00 175.17 175.93 2opv h PRO 73 N 4.83 0.06 0.56 4.34 0.11 -1.93 0.55 132.00 140.52 2opv h PRO 73 Ca -0.38 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.70 2opv h PRO 73 Cb 1.19 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.29 2opv h PRO 73 CO 0.43 0.04 -0.27 -0.92 -0.21 0.00 0.00 178.00 177.07 2opv h TYR 74 N 0.06 -0.69 -0.04 0.65 3.20 -1.96 -1.96 116.97 116.22 2opv h TYR 74 Ca 0.81 -0.02 -0.12 0.00 3.14 0.00 0.00 58.73 62.54 2opv h TYR 74 Cb 2.05 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 40.54 2opv h TYR 74 CO -0.05 -0.43 -0.51 1.57 -1.64 0.00 0.00 178.16 177.09 2opv h LYS 75 N -0.94 0.11 -0.58 1.82 2.10 -1.54 -1.03 116.57 116.52 2opv h LYS 75 Ca -0.08 -0.06 -0.09 0.00 -2.00 0.00 0.00 60.65 58.42 2opv h LYS 75 Cb 0.57 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.89 2opv h LYS 75 CO 0.13 0.60 0.01 0.28 -2.00 0.00 0.00 179.45 178.46 2opv h VAL 76 N 0.09 1.26 -0.15 0.07 2.07 -0.02 0.40 116.25 119.98 2opv h VAL 76 Ca 0.00 -1.12 -0.21 0.00 0.82 0.00 0.00 66.70 66.19 2opv h VAL 76 Cb 0.94 0.85 0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2opv h VAL 76 CO 0.07 0.41 -0.71 -0.61 0.02 0.00 0.00 177.57 176.75 2opv h GLN 77 N 0.90 0.74 -0.12 1.57 -0.00 -1.13 0.16 115.11 117.22 2opv h GLN 77 Ca 0.16 -0.60 -0.09 0.00 -0.00 0.00 0.00 58.65 58.12 2opv h GLN 77 Cb 0.54 0.12 -0.01 0.00 0.00 0.00 0.00 27.48 28.13 2opv h GLN 77 CO 0.03 1.21 -0.33 1.96 0.00 0.00 0.00 178.83 181.70 2opv h GLN 78 N 0.45 0.24 -0.08 1.69 4.20 -1.06 0.22 115.11 120.77 2opv h GLN 78 Ca -0.05 -0.10 -0.16 0.00 0.06 0.00 0.00 58.65 58.40 2opv h GLN 78 Cb 1.34 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.10 2opv h GLN 78 CO 0.15 0.55 -0.65 0.00 -0.67 0.00 0.00 178.83 178.20 2opv h ALA 79 N 1.45 0.73 -0.12 3.87 0.00 -0.05 -1.51 119.26 123.63 2opv h ALA 79 Ca 0.03 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 2opv h ALA 79 Cb 0.69 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2opv h ALA 79 CO 0.05 0.75 0.06 0.00 0.00 0.00 0.00 179.25 180.11 2opv h GLU 81 N 0.07 0.00 0.03 0.00 5.08 -0.45 0.25 114.58 119.56 2opv h GLU 81 Ca 0.04 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2opv h GLU 81 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2opv h GLU 81 CO -0.01 0.00 -0.02 1.98 -1.00 0.00 0.00 179.01 179.97 2opv h MET 82 N 0.00 -0.04 -0.05 2.33 4.05 -0.64 -2.55 114.93 118.02 2opv h MET 82 Ca 0.15 0.00 -0.23 0.00 -0.28 0.00 0.00 59.70 59.34 2opv h MET 82 Cb 0.64 0.01 0.01 0.00 -0.80 0.00 0.00 31.60 31.46 2opv h MET 82 CO -0.00 0.61 -0.91 -0.39 0.23 0.00 0.00 176.91 176.45 2opv h VAL 83 N -0.76 1.32 -0.34 -5.77 -1.51 -0.69 -2.92 116.25 105.58 2opv h VAL 83 Ca -0.00 -2.21 -0.05 0.00 -1.23 0.00 0.00 66.70 63.21 2opv h VAL 83 Cb 0.67 2.25 -0.02 0.00 -2.13 0.00 0.00 31.29 32.06 2opv h VAL 83 CO 0.01 0.68 -0.00 -0.03 -1.23 0.00 0.00 177.57 176.99 2opv h MET 84 N 0.38 0.52 -0.28 5.19 -1.53 -0.65 -1.21 114.93 117.35 2opv h MET 84 Ca -0.08 -0.11 -0.02 0.00 -3.44 0.00 0.00 59.70 56.05 2opv h MET 84 Cb 1.54 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 32.50 2opv h MET 84 CO 0.17 0.55 0.10 0.22 0.14 0.00 0.00 176.91 178.09 2opv h ASP 85 N 0.50 0.39 -0.18 1.39 1.82 -1.35 -1.31 116.42 117.68 2opv h ASP 85 Ca 0.11 -0.18 -0.06 0.00 -0.39 0.00 0.00 57.03 56.51 2opv h ASP 85 Cb 0.33 -0.10 -0.02 0.00 0.68 0.00 0.00 39.33 40.22 2opv h ASP 85 CO 0.01 0.46 -0.07 0.40 -1.61 0.00 0.00 179.24 178.44 2opv h ILE 86 N 0.29 1.21 0.00 2.25 2.04 -1.27 0.09 117.51 122.12 2opv h ILE 86 Ca 0.09 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 65.05 2opv h ILE 86 Cb 0.20 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2opv h ILE 86 CO -0.01 0.30 0.00 0.18 0.00 0.00 0.00 178.15 178.62 2opv n LEU 87 N -4.24 0.72 -0.69 1.44 4.77 -0.49 -1.96 117.00 116.55 2opv n LEU 87 Ca 0.01 0.60 0.06 0.00 -0.03 0.00 0.00 56.01 56.65 2opv n LEU 87 Cb 0.28 -0.41 0.16 0.00 -2.33 0.00 0.00 43.42 41.12 2opv n LEU 87 CO 0.40 -0.29 0.62 0.54 -1.33 0.00 0.00 177.39 177.32 2opv n ARG 88 N -2.21 2.55 0.00 3.23 5.12 -0.53 -5.05 116.66 119.77 2opv n ARG 88 Ca 0.05 -2.00 0.10 0.00 -1.93 0.00 0.00 57.85 54.07 2opv n ARG 88 Cb 0.36 -1.30 0.09 0.00 -1.16 0.00 0.00 32.46 30.45 2opv n ARG 88 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79