#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2opv h GLN 6 N 0.00 0.00 -5.77 1.61 4.20 -1.96 -3.45 115.11 109.75 2opv h GLN 6 Ca 0.00 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.22 2opv h GLN 6 Cb 0.00 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 27.60 2opv h GLN 6 CO 0.00 0.22 -0.77 -0.59 -0.67 0.00 0.00 178.83 177.01 2opv s PHE 7 N -3.23 1.70 -1.40 2.96 -0.71 -1.26 -2.90 117.98 113.15 2opv s PHE 7 Ca 0.04 -0.50 -0.12 0.00 -1.04 0.00 0.00 56.93 55.31 2opv s PHE 7 Cb 0.07 -0.85 0.08 0.00 -1.21 0.00 0.00 43.02 41.11 2opv s PHE 7 CO 0.68 0.28 2.13 1.58 -1.34 0.00 0.00 175.22 178.55 2opv n HIS 8 N 0.31 3.25 0.00 3.49 -0.00 -0.36 -4.85 115.22 117.06 2opv n HIS 8 Ca -0.13 -2.91 0.00 0.00 0.46 0.00 0.00 57.72 55.14 2opv n HIS 8 Cb 0.57 -2.32 0.00 0.00 -0.12 0.00 0.00 29.99 28.13 2opv n HIS 8 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 2opv n ASP 9 N 5.10 0.00 -0.01 0.26 5.68 -1.26 -1.31 116.55 125.01 2opv n ASP 9 Ca 0.49 0.00 0.01 0.00 -0.50 0.00 0.00 54.79 54.78 2opv n ASP 9 Cb 0.37 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.31 2opv n ASP 9 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2opv n ASN 10 N 2.72 3.62 -3.53 -1.12 5.03 -1.26 -4.78 115.26 115.95 2opv n ASN 10 Ca 0.00 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.05 2opv n ASN 10 Cb 0.00 1.00 -0.01 0.00 -1.02 0.00 0.00 39.78 39.74 2opv n ASN 10 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2opv n ALA 11 N -1.93 6.59 -2.74 5.41 0.00 -0.43 -4.85 120.51 122.56 2opv n ALA 11 Ca -0.05 -3.84 -0.09 0.00 0.00 0.00 0.00 53.44 49.46 2opv n ALA 11 Cb 0.39 -3.24 -0.10 0.00 0.00 0.00 0.00 19.45 16.50 2opv n ALA 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2opv s ASN 12 N 1.89 0.20 -0.33 0.00 2.20 -1.23 -4.81 114.94 112.87 2opv s ASN 12 Ca 0.57 -0.54 0.04 0.00 -0.94 0.00 0.00 52.86 51.99 2opv s ASN 12 Cb 0.16 0.20 0.17 0.00 -2.00 0.00 0.00 41.25 39.78 2opv s ASN 12 CO -0.07 -0.47 0.49 -0.83 -2.94 0.00 0.00 177.10 173.29 2opv s GLY 13 N -2.01 -0.79 0.00 0.45 0.00 -1.26 -4.95 107.32 98.75 2opv s GLY 13 Ca -0.07 0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.87 2opv s GLY 13 CO -0.04 3.28 0.00 0.61 0.00 0.00 0.00 173.10 176.95 2opv n GLY 14 N 4.99 1.64 3.64 0.20 0.00 -1.26 -4.84 105.19 109.55 2opv n GLY 14 Ca 0.06 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 2opv n GLY 14 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2opv s GLN 15 N 0.00 4.02 -0.09 1.61 -2.07 -1.26 -4.01 119.66 117.85 2opv s GLN 15 Ca 0.00 1.28 -0.10 0.00 -1.82 0.00 0.00 55.36 54.73 2opv s GLN 15 Cb 0.00 -3.82 -0.03 0.00 -1.09 0.00 0.00 33.01 28.07 2opv s GLN 15 CO 0.00 -0.98 -0.19 0.09 -1.32 0.00 0.00 175.29 172.89 2opv n ASN 16 N 7.23 1.08 0.00 12.60 4.13 -1.01 -4.68 115.26 134.62 2opv n ASN 16 Ca 0.14 0.18 0.00 0.00 1.68 0.00 0.00 54.58 56.58 2opv n ASN 16 Cb 0.46 -0.61 0.00 0.00 -1.54 0.00 0.00 39.78 38.09 2opv n ASN 16 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2opv n GLY 17 N 1.59 0.00 3.34 7.41 0.00 0.68 -1.23 105.19 116.99 2opv n GLY 17 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 -0.02 -0.04 2.61 2.01 0.14 -4.73 115.64 115.60 2opv s THR 18 Ca 0.00 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.09 2opv s THR 18 Cb 0.00 -0.69 0.01 0.00 0.01 0.00 0.00 72.50 71.84 2opv s THR 18 CO 0.00 0.03 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.18 2opv s VAL 19 N 1.43 0.82 -0.22 3.82 1.01 -1.26 -0.53 120.40 125.48 2opv s VAL 19 Ca -0.10 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.58 2opv s VAL 19 Cb -0.08 -0.77 0.04 0.00 0.00 0.00 0.00 36.38 35.57 2opv s VAL 19 CO -0.14 0.28 -0.14 -1.10 0.00 0.00 0.00 175.10 173.99 2opv s GLN 20 N 0.58 2.49 -0.25 2.72 -0.21 -1.06 -4.95 119.66 118.98 2opv s GLN 20 Ca -0.10 -1.05 -0.23 0.00 0.02 0.00 0.00 55.36 54.00 2opv s GLN 20 Cb -0.13 -2.67 -0.01 0.00 1.00 0.00 0.00 33.01 31.20 2opv s GLN 20 CO 0.02 -0.40 0.76 -1.21 -2.12 0.00 0.00 175.29 172.34 2opv s GLU 21 N 1.23 4.13 0.31 2.91 2.02 -1.24 -2.29 118.70 125.77 2opv s GLU 21 Ca -0.02 0.78 0.07 0.00 0.02 0.00 0.00 54.97 55.82 2opv s GLU 21 Cb -0.17 -3.66 -0.03 0.00 0.10 0.00 0.00 34.13 30.38 2opv s GLU 21 CO -0.09 -0.51 0.27 0.42 0.02 0.00 0.00 175.26 175.38 2opv s ILE 22 N 2.75 3.87 -0.56 -1.63 -1.09 0.84 -4.85 121.20 120.53 2opv s ILE 22 Ca 0.32 -1.36 -0.06 0.00 -2.23 0.00 0.00 60.65 57.33 2opv s ILE 22 Cb -0.15 -3.27 0.15 0.00 -1.58 0.00 0.00 42.46 37.60 2opv s ILE 22 CO 0.08 -0.23 0.40 -0.04 -1.23 0.00 0.00 174.94 173.93 2opv s MET 23 N -3.96 2.54 -0.10 2.79 -1.94 -1.25 -1.16 119.30 116.23 2opv s MET 23 Ca 0.39 -2.18 -0.27 0.00 -1.71 0.00 0.00 55.69 51.92 2opv s MET 23 Cb -0.07 -3.83 -0.02 0.00 2.01 0.00 0.00 34.83 32.92 2opv s MET 23 CO 0.26 -1.17 0.88 0.42 -0.01 0.00 0.00 175.02 175.40 2opv s ILE 24 N 0.58 4.88 -0.12 2.53 -1.09 0.75 -4.64 121.20 124.10 2opv s ILE 24 Ca 0.12 1.79 -0.39 0.00 -2.23 0.00 0.00 60.65 59.94 2opv s ILE 24 Cb -0.21 -4.20 -0.16 0.00 -1.58 0.00 0.00 42.46 36.30 2opv s ILE 24 CO -0.04 0.09 1.53 -2.65 -1.23 0.00 0.00 174.94 172.64 2opv n PRO 25 N 4.66 1.05 0.00 2.79 -0.02 -1.26 0.58 135.00 142.80 2opv n PRO 25 Ca 0.05 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2opv n PRO 25 Cb 0.50 -2.03 0.31 0.00 -0.02 0.00 0.00 33.50 32.25 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 5.78 1.40 -0.01 3.55 0.00 -1.93 -1.82 119.26 126.22 2opv h ALA 26 Ca -0.47 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2opv h ALA 26 Cb 1.33 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2opv h ALA 26 CO 0.87 0.42 -0.20 0.41 0.00 0.00 0.00 179.25 180.75 2opv n GLY 27 N -0.92 -0.40 0.07 0.00 0.00 -1.26 -3.92 105.19 98.76 2opv n GLY 27 Ca 0.02 -0.43 0.07 0.00 0.00 0.00 0.00 46.02 45.67 2opv n GLY 27 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2opv n LYS 28 N -0.39 1.64 0.26 1.61 4.81 -0.76 -4.68 118.16 120.66 2opv n LYS 28 Ca 0.14 -2.17 0.15 0.00 -0.87 0.00 0.00 58.31 55.56 2opv n LYS 28 Cb 0.36 -1.30 0.62 0.00 0.02 0.00 0.00 35.03 34.73 2opv n LYS 28 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2opv h ALA 29 N 0.00 1.01 0.00 3.14 0.00 -1.49 -2.57 119.26 119.36 2opv h ALA 29 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2opv h ALA 29 Cb 0.89 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2opv h ALA 29 CO 0.00 0.08 0.00 0.78 0.00 0.00 0.00 179.25 180.11 2opv h GLY 30 N 2.05 0.00 0.61 0.00 0.00 -1.88 -1.07 103.07 102.78 2opv h GLY 30 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 2opv h GLY 30 CO 0.01 0.00 -1.78 1.41 0.00 0.00 0.00 176.54 176.17 2opv h LEU 31 N 0.00 0.42 -0.80 3.11 3.38 -1.77 -1.19 115.31 118.45 2opv h LEU 31 Ca 0.00 -0.89 -0.12 0.00 0.09 0.00 0.00 57.88 56.95 2opv h LEU 31 Cb 0.24 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2opv h LEU 31 CO 0.00 1.77 -0.44 1.62 0.09 0.00 0.00 178.44 181.48 2opv h VAL 32 N -0.08 1.32 0.12 1.22 3.04 -1.56 -3.22 116.25 117.10 2opv h VAL 32 Ca -0.38 -1.62 -0.36 0.00 -1.01 0.00 0.00 66.70 63.32 2opv h VAL 32 Cb 1.94 1.70 -0.02 0.00 -2.01 0.00 0.00 31.29 32.90 2opv h VAL 32 CO 0.07 0.49 -2.00 -0.38 -1.01 0.00 0.00 177.57 174.75 2opv n ILE 33 N -4.00 1.78 0.00 3.17 5.41 -0.43 -3.85 119.36 121.45 2opv n ILE 33 Ca -0.02 -0.66 0.00 0.00 1.00 0.00 0.00 62.75 63.07 2opv n ILE 33 Cb 0.52 -1.72 0.00 0.00 -0.71 0.00 0.00 39.64 37.72 2opv n ILE 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2opv n GLY 34 N 1.99 2.64 0.04 7.39 0.00 -0.45 -1.19 105.19 115.61 2opv n GLY 34 Ca -0.32 -1.77 0.08 0.00 0.00 0.00 0.00 46.02 44.01 2opv n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2opv n LYS 35 N 0.85 0.05 -0.35 1.61 4.01 -1.21 -2.36 118.16 120.77 2opv n LYS 35 Ca 0.00 0.33 0.01 0.00 -0.51 0.00 0.00 58.31 58.14 2opv n LYS 35 Cb 0.00 -1.61 0.01 0.00 -0.51 0.00 0.00 35.03 32.92 2opv n LYS 35 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2opv n GLY 36 N -0.17 0.37 3.36 0.72 0.00 -1.26 -4.97 105.19 103.23 2opv n GLY 36 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.16 0.45 0.22 -0.02 0.00 -0.99 -4.84 105.19 99.85 2opv n GLY 37 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 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 1.32 0.57 0.69 1.61 4.11 -1.84 -3.05 114.58 117.99 2opv h GLU 38 Ca 0.00 -0.30 -0.03 0.00 0.07 0.00 0.00 59.36 59.10 2opv h GLU 38 Cb 0.08 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2opv h GLU 38 CO 0.00 0.89 -0.44 1.15 0.07 0.00 0.00 179.01 180.68 2opv h THR 39 N 0.46 0.00 0.00 -1.06 2.02 -1.86 -0.97 112.91 111.50 2opv h THR 39 Ca 0.03 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 2opv h THR 39 Cb 0.95 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 2opv h THR 39 CO 0.08 0.00 -0.02 -0.29 0.37 0.00 0.00 175.52 175.67 2opv h ILE 40 N -1.07 0.99 -0.06 3.11 2.10 -1.22 -1.37 117.51 120.00 2opv h ILE 40 Ca -0.09 -0.06 -0.19 0.00 1.08 0.00 0.00 64.86 65.60 2opv h ILE 40 Cb 0.86 1.03 0.01 0.00 -1.09 0.00 0.00 36.82 37.63 2opv h ILE 40 CO 0.08 0.02 -0.69 0.50 -1.08 0.00 0.00 178.15 176.98 2opv h LYS 41 N 0.00 0.58 -0.11 2.19 3.11 -1.41 -3.17 116.57 117.77 2opv h LYS 41 Ca -0.00 -0.54 -0.07 0.00 -2.81 0.00 0.00 60.65 57.23 2opv h LYS 41 Cb 0.03 0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.38 2opv h LYS 41 CO 0.00 1.16 -0.25 1.96 -2.81 0.00 0.00 179.45 179.52 2opv h GLN 42 N 0.20 0.19 -0.29 1.90 4.20 -0.25 -2.21 115.11 118.85 2opv h GLN 42 Ca -0.07 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 2opv h GLN 42 Cb 1.36 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.10 2opv h GLN 42 CO 0.14 0.43 0.09 -0.07 -0.67 0.00 0.00 178.83 178.75 2opv h LEU 43 N 0.17 0.37 -1.13 1.46 3.38 -1.26 0.14 115.31 118.45 2opv h LEU 43 Ca 0.03 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2opv h LEU 43 Cb 0.54 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2opv h LEU 43 CO 0.04 0.36 -0.18 1.56 0.09 0.00 0.00 178.44 180.32 2opv h GLN 44 N 0.41 0.00 0.00 1.13 4.20 -1.38 -2.31 115.11 117.16 2opv h GLN 44 Ca 0.10 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 2opv h GLN 44 Cb 0.13 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2opv h GLN 44 CO -0.01 0.18 -0.69 0.93 -0.67 0.00 0.00 178.83 178.57 2opv h GLU 45 N 0.00 0.00 -0.03 1.46 4.39 -1.09 -3.26 114.58 116.05 2opv h GLU 45 Ca -0.00 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 2opv h GLU 45 Cb 0.72 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 2opv h GLU 45 CO 0.02 0.49 -0.48 0.07 -1.16 0.00 0.00 179.01 177.95 2opv h ARG 46 N -1.00 0.08 0.00 2.33 0.11 -0.85 -3.08 114.38 111.97 2opv h ARG 46 Ca -0.14 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.90 2opv h ARG 46 Cb 0.81 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.89 2opv h ARG 46 CO -0.08 0.55 -1.44 0.00 0.10 0.00 0.00 179.97 179.10 2opv n ALA 47 N -2.46 2.90 -1.10 0.08 0.00 -0.87 -4.96 120.51 114.11 2opv n ALA 47 Ca -0.02 -0.40 -0.03 0.00 0.00 0.00 0.00 53.44 52.99 2opv n ALA 47 Cb 0.51 -0.92 -0.01 0.00 0.00 0.00 0.00 19.45 19.03 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 1.26 0.64 3.65 0.00 0.00 -1.17 -4.82 105.19 104.76 2opv n GLY 48 Ca -0.01 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.07 2.49 -0.23 1.61 -7.23 -1.24 -4.38 120.40 109.35 2opv s VAL 49 Ca 0.00 -1.92 -0.06 0.00 -1.81 0.00 0.00 61.98 58.19 2opv s VAL 49 Cb 0.00 -2.86 -0.02 0.00 0.56 0.00 0.00 36.38 34.06 2opv s VAL 49 CO 0.00 -0.14 0.01 -0.75 -0.31 0.00 0.00 175.10 173.92 2opv s LYS 50 N -3.75 3.56 -0.25 4.82 2.20 -0.34 -4.18 119.74 121.79 2opv s LYS 50 Ca 0.36 -0.54 -0.02 0.00 -0.36 0.00 0.00 55.97 55.41 2opv s LYS 50 Cb 0.02 -3.16 0.02 0.00 -1.51 0.00 0.00 37.83 33.21 2opv s LYS 50 CO 0.20 -0.14 -0.04 -1.64 -0.36 0.00 0.00 175.35 173.37 2opv s MET 51 N 1.40 2.89 -0.45 4.03 -1.94 -1.26 0.55 119.30 124.52 2opv s MET 51 Ca 0.05 -0.95 -0.15 0.00 -1.71 0.00 0.00 55.69 52.93 2opv s MET 51 Cb -0.15 -3.04 0.05 0.00 2.01 0.00 0.00 34.83 33.71 2opv s MET 51 CO 0.01 -0.40 0.35 -1.50 -0.01 0.00 0.00 175.02 173.47 2opv s ILE 52 N 1.36 5.19 -0.61 2.53 2.07 -0.47 -4.95 121.20 126.32 2opv s ILE 52 Ca 0.01 -0.93 -0.27 0.00 -1.41 0.00 0.00 60.65 58.04 2opv s ILE 52 Cb -0.17 -4.03 -0.01 0.00 0.13 0.00 0.00 42.46 38.39 2opv s ILE 52 CO -0.03 -0.48 1.67 -0.76 -1.91 0.00 0.00 174.94 173.43 2opv s LEU 53 N 1.65 3.30 -1.05 8.50 2.01 -1.26 -2.43 118.68 129.39 2opv s LEU 53 Ca 0.04 0.24 -0.23 0.00 0.01 0.00 0.00 54.13 54.19 2opv s LEU 53 Cb -0.22 -2.69 -0.02 0.00 0.01 0.00 0.00 46.19 43.27 2opv s LEU 53 CO 0.08 -2.12 1.80 -0.63 1.01 0.00 0.00 176.35 176.49 2opv s ILE 54 N 7.77 3.67 -0.12 -0.59 1.01 -0.41 -4.34 121.20 128.19 2opv s ILE 54 Ca 0.59 -0.81 0.13 0.00 0.00 0.00 0.00 60.65 60.56 2opv s ILE 54 Cb -0.12 -4.55 -0.18 0.00 0.01 0.00 0.00 42.46 37.62 2opv s ILE 54 CO 0.21 -1.34 0.08 0.00 0.00 0.00 0.00 174.94 173.90 2opv n GLN 55 N 8.66 1.58 -0.25 2.79 6.02 -1.26 -4.41 117.38 130.51 2opv n GLN 55 Ca 0.41 -0.02 0.07 0.00 -0.01 0.00 0.00 57.00 57.44 2opv n GLN 55 Cb 0.48 -1.35 0.31 0.00 1.02 0.00 0.00 30.24 30.70 2opv n GLN 55 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 2opv h ASP 56 N 0.00 0.76 -3.01 1.08 3.58 -2.01 -3.27 116.42 113.55 2opv h ASP 56 Ca -0.33 0.01 -0.72 0.00 0.42 0.00 0.00 57.03 56.41 2opv h ASP 56 Cb 1.71 -0.15 -0.21 0.00 1.72 0.00 0.00 39.33 42.41 2opv h ASP 56 CO 0.02 0.46 0.31 -0.83 -2.88 0.00 0.00 179.24 176.32 2opv s GLY 57 N -3.53 2.05 -0.68 -0.78 0.00 -1.26 -4.94 107.32 98.17 2opv s GLY 57 Ca -0.10 -2.67 -0.06 0.00 0.00 0.00 0.00 44.72 41.89 2opv s GLY 57 CO 0.79 1.61 2.71 1.44 0.00 0.00 0.00 173.10 179.65 2opv n SER 58 N 5.77 5.56 -0.12 1.64 7.64 -1.23 -4.09 113.62 128.79 2opv n SER 58 Ca 0.06 -2.36 -0.24 0.00 1.01 0.00 0.00 58.87 57.33 2opv n SER 58 Cb 0.45 -1.22 -0.11 0.00 -1.01 0.00 0.00 64.21 62.32 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 3.31 0.62 -1.75 1.43 6.02 -1.26 -4.57 117.38 121.18 2opv n GLN 59 Ca 0.49 0.27 -0.18 0.00 -0.01 0.00 0.00 57.00 57.57 2opv n GLN 59 Cb 0.42 -1.56 0.06 0.00 1.02 0.00 0.00 30.24 30.19 2opv n GLN 59 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2opv n ASN 60 N -3.90 4.23 0.17 1.08 4.13 -1.26 -4.71 115.26 115.00 2opv n ASN 60 Ca -0.47 -3.75 0.05 0.00 1.68 0.00 0.00 54.58 52.09 2opv n ASN 60 Cb 0.91 -0.38 0.17 0.00 -1.54 0.00 0.00 39.78 38.94 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 2.02 0.76 0.00 3.41 1.35 -1.81 -3.08 112.91 115.56 2opv h THR 61 Ca 0.29 -1.83 -0.05 0.00 -0.55 0.00 0.00 66.41 64.27 2opv h THR 61 Cb 1.43 2.19 -0.01 0.00 -1.73 0.00 0.00 68.15 70.04 2opv h THR 61 CO 0.60 0.39 -0.38 -1.13 -0.25 0.00 0.00 175.52 174.75 2opv h ASN 62 N 0.00 0.00 -0.51 5.36 -1.24 -1.92 -3.47 115.58 113.79 2opv h ASN 62 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2opv h ASN 62 Cb 1.16 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.21 2opv h ASN 62 CO 0.05 0.22 0.00 1.33 -1.29 0.00 0.00 177.43 177.74 2opv n VAL 63 N -3.08 0.00 -1.69 2.57 0.24 -1.16 -4.98 118.33 110.22 2opv n VAL 63 Ca 0.02 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.90 2opv n VAL 63 Cb 0.63 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.99 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 2.56 -4.75 -1.34 9.92 -1.26 -4.29 116.55 117.40 2opv n ASP 64 Ca 0.00 1.18 -0.38 0.00 -0.53 0.00 0.00 54.79 55.06 2opv n ASP 64 Cb 0.00 -1.47 -0.06 0.00 -0.64 0.00 0.00 41.12 38.95 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 -1.93 4.30 -0.31 -1.24 -0.14 0.20 -4.64 119.74 115.97 2opv s LYS 65 Ca 0.57 0.58 -0.28 0.00 -1.36 0.00 0.00 55.97 55.47 2opv s LYS 65 Cb -0.56 -3.38 -0.02 0.00 -1.68 0.00 0.00 37.83 32.18 2opv s LYS 65 CO 0.61 0.27 1.78 -2.14 -0.76 0.00 0.00 175.35 175.11 2opv s PRO 66 N 0.20 3.40 -0.30 -1.68 0.02 -1.25 -0.18 135.00 135.20 2opv s PRO 66 Ca 0.28 1.46 -0.07 0.00 0.02 0.00 0.00 61.00 62.70 2opv s PRO 66 Cb -0.16 -4.18 0.01 0.00 0.02 0.00 0.00 34.50 30.19 2opv s PRO 66 CO 0.14 -1.78 0.08 -1.17 -0.33 0.00 0.00 177.00 173.93 2opv s LEU 67 N 6.66 3.91 -0.46 -5.54 2.96 -0.31 -1.28 118.68 124.63 2opv s LEU 67 Ca 0.79 -0.78 -0.16 0.00 -0.22 0.00 0.00 54.13 53.76 2opv s LEU 67 Cb -0.23 -1.88 0.06 0.00 0.50 0.00 0.00 46.19 44.65 2opv s LEU 67 CO 0.33 -0.21 0.40 -0.13 -1.32 0.00 0.00 176.35 175.42 2opv s ARG 68 N 1.48 2.99 -0.59 1.98 0.52 -1.02 -0.11 118.95 124.20 2opv s ARG 68 Ca 0.02 -1.24 -0.24 0.00 -0.52 0.00 0.00 55.73 53.75 2opv s ARG 68 Cb -0.18 -4.10 0.05 0.00 0.52 0.00 0.00 34.95 31.24 2opv s ARG 68 CO 0.02 -0.99 0.97 0.42 0.02 0.00 0.00 175.30 175.74 2opv s ILE 69 N 1.74 4.33 -0.32 1.52 1.09 -0.97 -1.37 121.20 127.22 2opv s ILE 69 Ca 0.05 0.12 -0.11 0.00 -1.10 0.00 0.00 60.65 59.61 2opv s ILE 69 Cb -0.23 -4.60 -0.02 0.00 -1.06 0.00 0.00 42.46 36.55 2opv s ILE 69 CO 0.08 -1.25 0.20 -0.63 -0.10 0.00 0.00 174.94 173.24 2opv s ILE 70 N 4.09 5.04 0.00 2.92 1.01 0.19 -2.56 121.20 131.88 2opv s ILE 70 Ca 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.70 2opv s ILE 70 Cb -0.13 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.78 2opv s ILE 70 CO 0.17 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.77 2opv n GLY 71 N 5.06 -0.29 3.34 6.18 0.00 0.31 -1.20 105.19 118.59 2opv n GLY 71 Ca -0.13 0.43 -0.31 0.00 0.00 0.00 0.00 46.02 46.01 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 3.19 0.39 1.61 2.15 -1.26 -0.23 116.67 118.52 2opv s ASP 72 Ca 0.00 -0.50 0.22 0.00 0.43 0.00 0.00 52.55 52.70 2opv s ASP 72 Cb 0.00 -0.36 1.25 0.00 -0.30 0.00 0.00 42.92 43.51 2opv s ASP 72 CO 0.00 0.30 1.65 -0.65 -0.17 0.00 0.00 175.17 176.30 2opv h PRO 73 N 5.18 0.20 0.56 4.34 0.11 -1.88 0.31 132.00 140.82 2opv h PRO 73 Ca -0.45 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 2opv h PRO 73 Cb 1.13 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.20 2opv h PRO 73 CO 0.46 0.13 -0.27 -0.92 -0.21 0.00 0.00 178.00 177.19 2opv h TYR 74 N 0.20 -0.70 -0.21 0.65 3.20 -1.97 -1.99 116.97 116.15 2opv h TYR 74 Ca 0.76 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.52 2opv h TYR 74 Cb 2.07 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 40.56 2opv h TYR 74 CO -0.01 -0.44 -0.28 1.57 -1.64 0.00 0.00 178.16 177.37 2opv h LYS 75 N -1.01 0.40 -0.97 1.82 2.10 -1.65 -1.57 116.57 115.69 2opv h LYS 75 Ca -0.08 -0.15 0.05 0.00 -2.00 0.00 0.00 60.65 58.48 2opv h LYS 75 Cb 0.58 -0.02 -0.06 0.00 -0.90 0.00 0.00 32.23 31.83 2opv h LYS 75 CO 0.13 0.64 0.63 0.28 -2.00 0.00 0.00 179.45 179.13 2opv h VAL 76 N 0.35 1.11 -0.05 0.07 2.07 -0.46 0.23 116.25 119.57 2opv h VAL 76 Ca 0.05 -0.40 -0.13 0.00 0.82 0.00 0.00 66.70 67.04 2opv h VAL 76 Cb 0.67 -0.16 0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2opv h VAL 76 CO 0.05 0.21 -0.46 1.56 0.02 0.00 0.00 177.57 178.96 2opv h GLN 77 N 1.17 0.40 -0.65 1.57 1.08 -1.00 -1.42 115.11 116.25 2opv h GLN 77 Ca 0.41 -0.36 0.04 0.00 -1.45 0.00 0.00 58.65 57.29 2opv h GLN 77 Cb 0.11 0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.58 2opv h GLN 77 CO -0.15 1.01 0.38 1.96 -0.95 0.00 0.00 178.83 181.09 2opv h GLN 78 N -0.08 0.71 -0.57 1.46 4.20 -0.89 0.38 115.11 120.32 2opv h GLN 78 Ca -0.04 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.52 2opv h GLN 78 Cb 1.13 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.73 2opv h GLN 78 CO 0.09 0.47 -0.04 0.00 -0.67 0.00 0.00 178.83 178.68 2opv h ALA 79 N 1.31 0.77 0.62 3.87 0.00 -0.60 -2.06 119.26 123.18 2opv h ALA 79 Ca 0.28 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2opv h ALA 79 Cb 0.11 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.70 2opv h ALA 79 CO -0.15 0.64 -0.30 0.00 0.00 0.00 0.00 179.25 179.45 2opv h GLU 81 N -0.99 0.00 0.05 0.00 4.11 -0.98 0.41 114.58 117.18 2opv h GLU 81 Ca -0.08 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.34 2opv h GLU 81 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2opv h GLU 81 CO 0.14 0.00 -0.02 1.98 0.07 0.00 0.00 179.01 181.18 2opv h MET 82 N 0.00 -0.06 0.00 1.06 4.05 -1.13 -3.03 114.93 115.82 2opv h MET 82 Ca -0.00 0.00 -0.20 0.00 -0.28 0.00 0.00 59.70 59.22 2opv h MET 82 Cb 0.17 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.96 2opv h MET 82 CO 0.00 0.57 -0.96 -0.39 0.23 0.00 0.00 176.91 176.36 2opv h VAL 83 N -0.84 1.67 -0.10 -5.77 -1.51 -0.47 -2.99 116.25 106.24 2opv h VAL 83 Ca -0.01 -3.31 -0.08 0.00 -1.23 0.00 0.00 66.70 62.08 2opv h VAL 83 Cb 0.66 2.80 -0.01 0.00 -2.13 0.00 0.00 31.29 32.61 2opv h VAL 83 CO 0.01 0.94 -0.28 -0.03 -1.23 0.00 0.00 177.57 176.98 2opv h MET 84 N 0.00 0.19 -0.78 5.19 -1.53 -0.35 -2.37 114.93 115.28 2opv h MET 84 Ca -0.01 -0.06 -0.03 0.00 -3.44 0.00 0.00 59.70 56.15 2opv h MET 84 Cb 1.72 -0.01 -0.04 0.00 -0.55 0.00 0.00 31.60 32.72 2opv h MET 84 CO 0.12 0.46 0.35 0.22 0.14 0.00 0.00 176.91 178.21 2opv h ASP 85 N 0.17 1.03 0.27 1.39 3.58 -1.39 0.22 116.42 121.69 2opv h ASP 85 Ca 0.03 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.34 2opv h ASP 85 Cb 0.59 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.38 2opv h ASP 85 CO 0.04 0.88 0.00 0.40 -2.88 0.00 0.00 179.24 177.68 2opv h ILE 86 N 1.11 0.00 0.00 2.25 2.04 -1.42 -2.38 117.51 119.11 2opv h ILE 86 Ca 0.27 -0.13 -0.35 0.00 1.00 0.00 0.00 64.86 65.65 2opv h ILE 86 Cb 0.14 1.06 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 2opv h ILE 86 CO -0.03 0.00 -2.31 0.18 0.00 0.00 0.00 178.15 175.99 2opv n LEU 87 N -2.96 2.93 0.00 1.44 4.77 -0.45 -4.37 117.00 118.36 2opv n LEU 87 Ca -0.02 -0.10 0.14 0.00 -0.03 0.00 0.00 56.01 56.00 2opv n LEU 87 Cb 0.13 -0.80 0.73 0.00 -2.33 0.00 0.00 43.42 41.15 2opv n LEU 87 CO 0.21 0.87 0.98 -2.11 -1.33 0.00 0.00 177.39 176.01 2opv n ARG 88 N -3.21 0.53 0.00 3.23 -4.01 0.66 -5.04 116.66 108.81 2opv n ARG 88 Ca -0.41 0.02 0.08 0.00 -1.04 0.00 0.00 57.85 56.50 2opv n ARG 88 Cb 0.93 -1.50 0.07 0.00 -3.04 0.00 0.00 32.46 28.92 2opv n ARG 88 CO 0.00 0.00 0.00 -1.91 -3.04 0.00 0.00 177.63 172.68