#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 -1.99 -1.89 1.61 1.13 -1.26 -4.46 117.38 110.53 2opv n GLN 6 Ca 0.00 1.88 -0.34 0.00 -1.94 0.00 0.00 57.00 56.60 2opv n GLN 6 Cb 0.00 -5.45 -0.05 0.00 0.11 0.00 0.00 30.24 24.85 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 -0.67 2.74 -4.62 1.08 1.16 -1.26 -4.84 117.46 111.05 2opv n PHE 7 Ca 0.08 -1.72 0.00 0.00 -1.87 0.00 0.00 57.45 53.94 2opv n PHE 7 Cb 0.45 -2.40 0.00 0.00 -1.61 0.00 0.00 39.48 35.92 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 11.93 -1.19 0.20 2.97 -0.00 -1.26 -3.97 115.22 123.89 2opv n HIS 8 Ca 0.47 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 58.04 2opv n HIS 8 Cb 0.45 0.16 -0.07 0.00 -0.00 0.00 0.00 29.99 30.53 2opv n HIS 8 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.34 176.56 2opv h ASP 9 N 0.00 -0.54 0.00 0.26 1.82 -1.98 -3.45 116.42 112.53 2opv h ASP 9 Ca 0.00 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.68 2opv h ASP 9 Cb 0.00 0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.18 2opv h ASP 9 CO 0.00 -0.33 0.00 -3.20 -1.61 0.00 0.00 179.24 174.10 2opv n ASN 10 N -5.34 -0.06 -4.19 2.28 5.15 -1.26 -5.10 115.26 106.74 2opv n ASN 10 Ca -0.09 0.04 -0.30 0.00 -0.60 0.00 0.00 54.58 53.62 2opv n ASN 10 Cb 0.25 0.15 -0.17 0.00 -0.53 0.00 0.00 39.78 39.48 2opv n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2opv s ALA 11 N -2.00 1.97 -0.05 5.20 0.00 -1.26 -4.91 121.76 120.72 2opv s ALA 11 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 51.96 51.18 2opv s ALA 11 Cb 0.00 -0.73 -0.12 0.00 0.00 0.00 0.00 23.12 22.26 2opv s ALA 11 CO 0.00 0.27 0.12 0.27 0.00 0.00 0.00 175.76 176.42 2opv n ASN 12 N 3.49 2.90 0.00 0.00 6.94 -1.26 -4.83 115.26 122.50 2opv n ASN 12 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.37 2opv n ASN 12 Cb 0.53 1.07 0.00 0.00 -2.36 0.00 0.00 39.78 39.02 2opv n ASN 12 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2opv n GLY 13 N 2.22 1.73 1.52 4.83 0.00 -1.26 -3.14 105.19 111.10 2opv n GLY 13 Ca -0.08 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2opv n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2opv n GLY 14 N 0.00 -0.09 3.46 -0.02 0.00 -1.26 -4.75 105.19 102.53 2opv n GLY 14 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2opv n GLY 14 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2opv s GLN 15 N -1.76 3.07 -0.17 1.61 0.74 -1.19 -3.89 119.66 118.08 2opv s GLN 15 Ca 0.00 -0.90 -0.14 0.00 0.05 0.00 0.00 55.36 54.37 2opv s GLN 15 Cb 0.00 -4.02 -0.10 0.00 1.10 0.00 0.00 33.01 30.00 2opv s GLN 15 CO 0.00 -0.94 -0.00 -0.97 -0.55 0.00 0.00 175.29 172.83 2opv h ASN 16 N 8.77 0.00 0.00 6.67 -1.24 -1.75 -3.45 115.58 124.57 2opv h ASN 16 Ca -0.27 -0.22 0.00 0.00 0.71 0.00 0.00 56.30 56.52 2opv h ASN 16 Cb 1.11 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.16 2opv h ASN 16 CO 0.83 1.05 0.00 0.61 -1.29 0.00 0.00 177.43 178.63 2opv n GLY 17 N 1.55 1.13 3.71 1.57 0.00 -0.42 -4.83 105.19 107.89 2opv n GLY 17 Ca -0.17 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 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 3.02 -0.01 2.61 2.01 -0.38 -4.79 115.64 118.09 2opv s THR 18 Ca 0.00 0.65 0.03 0.00 0.31 0.00 0.00 61.69 62.68 2opv s THR 18 Cb 0.00 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 69.09 2opv s THR 18 CO 0.00 0.03 -0.10 0.54 -0.69 0.00 0.00 174.62 174.40 2opv s VAL 19 N 1.62 0.84 -0.04 3.82 0.11 -1.26 0.05 120.40 125.54 2opv s VAL 19 Ca 0.69 -0.44 0.05 0.00 -2.93 0.00 0.00 61.98 59.35 2opv s VAL 19 Cb -0.40 -0.72 -0.01 0.00 -1.53 0.00 0.00 36.38 33.73 2opv s VAL 19 CO 0.31 0.24 -0.20 -1.58 -3.33 0.00 0.00 175.10 170.55 2opv s GLN 20 N -0.12 1.98 -0.21 1.54 0.74 -0.69 -4.93 119.66 117.96 2opv s GLN 20 Ca 0.02 -0.70 -0.08 0.00 0.05 0.00 0.00 55.36 54.66 2opv s GLN 20 Cb -0.05 -1.72 -0.04 0.00 1.10 0.00 0.00 33.01 32.30 2opv s GLN 20 CO -0.00 0.30 0.07 -1.21 -0.55 0.00 0.00 175.29 173.90 2opv s GLU 21 N -0.06 3.86 0.04 1.67 2.02 -1.25 -0.82 118.70 124.16 2opv s GLU 21 Ca -0.03 -0.39 0.04 0.00 0.02 0.00 0.00 54.97 54.61 2opv s GLU 21 Cb -0.12 -3.29 -0.04 0.00 0.10 0.00 0.00 34.13 30.79 2opv s GLU 21 CO 0.02 0.08 -0.06 0.42 0.02 0.00 0.00 175.26 175.75 2opv s ILE 22 N 0.91 3.70 -0.72 -1.63 -1.09 0.57 -4.92 121.20 118.03 2opv s ILE 22 Ca 0.04 -0.89 -0.14 0.00 -2.23 0.00 0.00 60.65 57.43 2opv s ILE 22 Cb -0.14 -2.66 0.18 0.00 -1.58 0.00 0.00 42.46 38.26 2opv s ILE 22 CO 0.03 0.29 0.66 -0.04 -1.23 0.00 0.00 174.94 174.65 2opv s MET 23 N -1.73 3.34 -0.08 2.79 -1.94 -1.26 -0.81 119.30 119.61 2opv s MET 23 Ca 0.20 -2.19 -0.30 0.00 -1.71 0.00 0.00 55.69 51.69 2opv s MET 23 Cb -0.11 -4.36 -0.02 0.00 2.01 0.00 0.00 34.83 32.35 2opv s MET 23 CO 0.11 -1.30 1.03 0.42 -0.01 0.00 0.00 175.02 175.27 2opv s ILE 24 N 0.68 4.72 0.21 2.53 -1.09 -0.29 -4.70 121.20 123.26 2opv s ILE 24 Ca 0.12 1.98 -0.32 0.00 -2.23 0.00 0.00 60.65 60.21 2opv s ILE 24 Cb -0.18 -4.27 -0.14 0.00 -1.58 0.00 0.00 42.46 36.29 2opv s ILE 24 CO -0.04 0.03 1.33 -2.65 -1.23 0.00 0.00 174.94 172.37 2opv n PRO 25 N 4.87 1.71 0.26 2.79 -0.02 -1.26 -0.16 135.00 143.19 2opv n PRO 25 Ca 0.09 0.61 0.16 0.00 -2.02 0.00 0.00 63.50 62.34 2opv n PRO 25 Cb 0.49 -2.21 0.89 0.00 -0.02 0.00 0.00 33.50 32.64 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 3.99 1.63 -0.01 3.55 0.00 -1.94 0.24 119.26 126.72 2opv h ALA 26 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2opv h ALA 26 Cb 1.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2opv h ALA 26 CO 0.74 -0.13 -0.30 0.41 0.00 0.00 0.00 179.25 179.97 2opv n GLY 27 N -1.35 -0.83 0.31 0.00 0.00 -1.26 -3.86 105.19 98.20 2opv n GLY 27 Ca -0.01 -0.37 0.03 0.00 0.00 0.00 0.00 46.02 45.67 2opv n GLY 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2opv n LYS 28 N -0.92 2.87 0.18 1.61 5.02 0.77 -4.58 118.16 123.11 2opv n LYS 28 Ca 0.11 -1.83 0.02 0.00 -2.02 0.00 0.00 58.31 54.58 2opv n LYS 28 Cb 0.34 -1.17 0.32 0.00 -0.02 0.00 0.00 35.03 34.50 2opv n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2opv h ALA 29 N 0.92 1.29 0.00 7.82 0.00 -1.48 -1.73 119.26 126.07 2opv h ALA 29 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2opv h ALA 29 Cb 0.66 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2opv h ALA 29 CO 0.01 0.53 0.00 0.78 0.00 0.00 0.00 179.25 180.57 2opv h GLY 30 N 1.29 0.00 0.69 0.00 0.00 -1.85 -2.16 103.07 101.04 2opv h GLY 30 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.07 2opv h GLY 30 CO 0.05 0.00 -1.21 1.41 0.00 0.00 0.00 176.54 176.80 2opv h LEU 31 N 0.00 0.47 -0.89 3.11 3.38 -1.62 0.01 115.31 119.77 2opv h LEU 31 Ca 0.00 -0.90 -0.11 0.00 0.09 0.00 0.00 57.88 56.96 2opv h LEU 31 Cb 0.44 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2opv h LEU 31 CO 0.00 1.55 -0.39 -0.37 0.09 0.00 0.00 178.44 179.32 2opv h VAL 32 N -0.27 1.30 0.11 1.22 -1.51 -1.45 -2.92 116.25 112.74 2opv h VAL 32 Ca -0.24 -1.50 -0.28 0.00 -1.23 0.00 0.00 66.70 63.45 2opv h VAL 32 Cb 1.77 1.62 0.03 0.00 -2.13 0.00 0.00 31.29 32.58 2opv h VAL 32 CO 0.12 0.46 -1.17 0.40 -1.23 0.00 0.00 177.57 176.15 2opv h ILE 33 N 0.28 1.31 0.00 7.19 2.04 -1.50 -3.12 117.51 123.70 2opv h ILE 33 Ca 0.03 -2.43 0.00 0.00 1.00 0.00 0.00 64.86 63.45 2opv h ILE 33 Cb 0.82 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 39.62 2opv h ILE 33 CO 0.06 0.73 0.00 0.61 0.00 0.00 0.00 178.15 179.56 2opv n GLY 34 N 1.38 2.00 2.16 5.37 0.00 -0.01 -0.83 105.19 115.26 2opv n GLY 34 Ca -0.14 -1.96 -0.23 0.00 0.00 0.00 0.00 46.02 43.69 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 1.54 2.63 0.00 1.61 4.01 -1.26 -3.00 118.16 123.70 2opv n LYS 35 Ca 0.00 -1.47 0.00 0.00 -0.51 0.00 0.00 58.31 56.33 2opv n LYS 35 Cb 0.00 -2.33 0.00 0.00 -0.51 0.00 0.00 35.03 32.19 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 3.00 0.00 3.44 0.72 0.00 -1.26 -4.80 105.19 106.28 2opv n GLY 36 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 0.00 0.67 0.30 -0.02 0.00 -1.16 -4.85 105.19 100.13 2opv n GLY 37 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 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 1.73 0.90 0.29 1.61 4.11 -1.82 -2.67 114.58 118.73 2opv h GLU 38 Ca 0.00 -0.22 -0.01 0.00 0.07 0.00 0.00 59.36 59.20 2opv h GLU 38 Cb 0.00 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2opv h GLU 38 CO 0.00 0.84 -0.14 1.15 0.07 0.00 0.00 179.01 180.93 2opv h THR 39 N 0.85 0.61 0.00 -1.06 2.02 -1.71 -2.02 112.91 111.60 2opv h THR 39 Ca 0.17 -0.79 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 2opv h THR 39 Cb 0.39 0.95 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2opv h THR 39 CO 0.01 0.13 -0.05 -0.29 0.37 0.00 0.00 175.52 175.69 2opv h ILE 40 N -0.89 0.54 -0.07 3.11 2.10 -0.92 0.16 117.51 121.56 2opv h ILE 40 Ca -0.04 -0.21 -0.05 0.00 1.08 0.00 0.00 64.86 65.64 2opv h ILE 40 Cb 0.51 1.14 0.00 0.00 -1.09 0.00 0.00 36.82 37.38 2opv h ILE 40 CO 0.07 0.05 -0.15 0.50 -1.08 0.00 0.00 178.15 177.53 2opv h LYS 41 N 0.00 0.22 -0.20 2.19 3.64 -1.40 -3.24 116.57 117.78 2opv h LYS 41 Ca -0.00 -0.15 -0.18 0.00 -1.27 0.00 0.00 60.65 59.05 2opv h LYS 41 Cb 0.13 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2opv h LYS 41 CO 0.01 0.75 -0.59 -0.56 -2.27 0.00 0.00 179.45 176.78 2opv h GLN 42 N -0.28 0.76 -0.53 1.90 3.07 -0.58 -3.29 115.11 116.17 2opv h GLN 42 Ca -0.00 -0.54 0.10 0.00 0.09 0.00 0.00 58.65 58.30 2opv h GLN 42 Cb 0.75 0.09 -0.09 0.00 0.08 0.00 0.00 27.48 28.31 2opv h GLN 42 CO 0.03 1.17 0.00 -0.07 0.09 0.00 0.00 178.83 180.05 2opv h LEU 43 N 0.49 -0.22 -0.81 0.06 3.38 -1.09 0.17 115.31 117.29 2opv h LEU 43 Ca -0.02 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2opv h LEU 43 Cb 1.21 0.22 -0.05 0.00 0.09 0.00 0.00 40.66 42.13 2opv h LEU 43 CO 0.13 -0.08 0.51 1.56 0.09 0.00 0.00 178.44 180.65 2opv h GLN 44 N 0.12 0.95 0.12 1.13 4.20 -1.62 -1.41 115.11 118.61 2opv h GLN 44 Ca 0.27 -0.06 -0.28 0.00 0.06 0.00 0.00 58.65 58.64 2opv h GLN 44 Cb 0.41 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2opv h GLN 44 CO -0.44 0.63 -1.33 0.93 -0.67 0.00 0.00 178.83 177.95 2opv h GLU 45 N 0.98 0.26 0.00 1.46 4.39 -1.33 -2.53 114.58 117.81 2opv h GLU 45 Ca 0.33 -0.45 -0.07 0.00 0.34 0.00 0.00 59.36 59.52 2opv h GLU 45 Cb 0.06 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2opv h GLU 45 CO -0.13 1.18 -0.33 0.07 -1.16 0.00 0.00 179.01 178.65 2opv h ARG 46 N 0.07 0.00 0.00 2.33 0.11 -0.54 -3.22 114.38 113.13 2opv h ARG 46 Ca -0.17 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.77 2opv h ARG 46 Cb 1.99 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 33.04 2opv h ARG 46 CO 0.19 0.33 -1.71 0.00 0.10 0.00 0.00 179.97 178.88 2opv n ALA 47 N -2.19 2.13 -1.24 0.08 0.00 -0.54 -4.98 120.51 113.76 2opv n ALA 47 Ca 0.02 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2opv n ALA 47 Cb 0.64 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.32 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 1.41 0.46 3.52 0.00 0.00 -0.97 -4.88 105.19 104.73 2opv n GLY 48 Ca -0.12 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.00 0.53 -0.19 1.61 -7.23 -1.08 -4.15 120.40 107.89 2opv s VAL 49 Ca 0.00 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.13 2opv s VAL 49 Cb 0.00 -2.31 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 2opv s VAL 49 CO 0.00 0.00 -0.02 -0.75 -0.31 0.00 0.00 175.10 174.02 2opv s LYS 50 N -3.67 3.55 -0.25 4.82 2.20 -0.26 -4.55 119.74 121.58 2opv s LYS 50 Ca 0.23 -0.56 -0.03 0.00 -0.36 0.00 0.00 55.97 55.25 2opv s LYS 50 Cb 0.02 -3.01 0.02 0.00 -1.51 0.00 0.00 37.83 33.35 2opv s LYS 50 CO 0.15 0.01 -0.03 -1.64 -0.36 0.00 0.00 175.35 173.48 2opv s MET 51 N 0.98 2.98 -0.37 4.03 -1.94 -1.26 0.07 119.30 123.79 2opv s MET 51 Ca 0.01 -0.89 -0.05 0.00 -1.71 0.00 0.00 55.69 53.04 2opv s MET 51 Cb -0.14 -3.06 0.07 0.00 2.01 0.00 0.00 34.83 33.71 2opv s MET 51 CO 0.01 -0.37 0.16 -1.50 -0.01 0.00 0.00 175.02 173.31 2opv s ILE 52 N 1.38 3.63 -0.62 2.53 2.07 -0.96 -5.00 121.20 124.25 2opv s ILE 52 Ca 0.02 -1.50 -0.24 0.00 -1.41 0.00 0.00 60.65 57.51 2opv s ILE 52 Cb -0.16 -3.22 0.05 0.00 0.13 0.00 0.00 42.46 39.26 2opv s ILE 52 CO -0.03 -0.40 1.00 -0.76 -1.91 0.00 0.00 174.94 172.84 2opv s LEU 53 N 1.31 4.09 -1.11 8.50 2.01 -1.26 -2.45 118.68 129.77 2opv s LEU 53 Ca 0.02 -0.61 -0.21 0.00 0.01 0.00 0.00 54.13 53.34 2opv s LEU 53 Cb -0.21 -2.64 0.06 0.00 0.01 0.00 0.00 46.19 43.41 2opv s LEU 53 CO -0.00 -1.39 1.53 -0.63 1.01 0.00 0.00 176.35 176.87 2opv s ILE 54 N 4.23 4.04 0.00 -0.59 1.01 -0.69 -4.26 121.20 124.95 2opv s ILE 54 Ca 0.28 -1.21 0.00 0.00 0.00 0.00 0.00 60.65 59.72 2opv s ILE 54 Cb -0.14 -5.09 0.00 0.00 0.01 0.00 0.00 42.46 37.24 2opv s ILE 54 CO 0.15 -1.95 0.00 0.00 0.00 0.00 0.00 174.94 173.15 2opv n GLN 55 N 8.57 2.89 -0.07 2.79 -0.00 -1.26 -4.02 117.38 126.29 2opv n GLN 55 Ca 0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 57.00 57.36 2opv n GLN 55 Cb 0.49 -0.32 -0.16 0.00 -0.00 0.00 0.00 30.24 30.26 2opv n GLN 55 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2opv n ASP 56 N -0.42 0.15 -0.54 2.61 2.03 -1.26 -4.22 116.55 114.90 2opv n ASP 56 Ca 0.00 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.32 2opv n ASP 56 Cb 0.00 1.34 0.06 0.00 -0.72 0.00 0.00 41.12 41.80 2opv n ASP 56 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2opv n GLY 57 N 1.61 0.97 7.00 0.27 0.00 -1.26 -4.99 105.19 108.78 2opv n GLY 57 Ca -0.22 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2opv n GLY 57 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2opv n SER 58 N 0.00 0.00 0.00 1.61 7.64 -1.26 -4.84 113.62 116.77 2opv n SER 58 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2opv n SER 58 Cb 0.29 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 14.00 0.00 -1.54 1.43 6.02 -1.26 -3.67 117.38 132.35 2opv n GLN 59 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.65 2opv n GLN 59 Cb 0.00 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.32 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 2.34 7.28 0.18 1.08 4.13 -1.26 -4.57 115.26 124.45 2opv n ASN 60 Ca 0.00 -3.79 0.04 0.00 1.68 0.00 0.00 54.58 52.51 2opv n ASN 60 Cb 0.00 -0.91 0.32 0.00 -1.54 0.00 0.00 39.78 37.65 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 1.35 1.03 0.00 3.41 1.35 -1.88 -3.13 112.91 115.03 2opv h THR 61 Ca 0.57 -1.59 -0.22 0.00 -0.55 0.00 0.00 66.41 64.61 2opv h THR 61 Cb 0.76 1.93 -0.04 0.00 -1.73 0.00 0.00 68.15 69.07 2opv h THR 61 CO 1.45 0.41 -1.77 -3.20 -0.25 0.00 0.00 175.52 172.16 2opv n ASN 62 N -3.64 0.56 -0.06 5.36 5.15 -1.26 -5.01 115.26 116.35 2opv n ASN 62 Ca -0.01 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.22 2opv n ASN 62 Cb 0.51 0.53 0.00 0.00 -0.53 0.00 0.00 39.78 40.29 2opv n ASN 62 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2opv n VAL 63 N -2.81 0.00 -1.23 3.44 0.24 -1.18 -4.98 118.33 111.80 2opv n VAL 63 Ca -0.16 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.80 2opv n VAL 63 Cb 0.93 -0.41 0.11 0.00 -1.47 0.00 0.00 33.84 33.00 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 -0.06 1.01 -4.61 -1.34 8.00 -1.26 -4.49 116.55 113.80 2opv n ASP 64 Ca 0.00 0.63 -0.38 0.00 0.71 0.00 0.00 54.79 55.75 2opv n ASP 64 Cb 0.00 -1.49 -0.10 0.00 -0.02 0.00 0.00 41.12 39.51 2opv n ASP 64 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2opv s LYS 65 N -3.86 4.00 -0.41 -1.24 -0.14 0.77 -4.76 119.74 114.10 2opv s LYS 65 Ca 0.74 -0.21 -0.27 0.00 -1.36 0.00 0.00 55.97 54.87 2opv s LYS 65 Cb -0.31 -3.63 -0.04 0.00 -1.68 0.00 0.00 37.83 32.17 2opv s LYS 65 CO 0.50 -0.15 2.06 -2.14 -0.76 0.00 0.00 175.35 174.86 2opv s PRO 66 N 1.67 2.82 -0.41 -1.68 0.02 -1.26 -1.13 135.00 135.03 2opv s PRO 66 Ca 0.09 1.38 -0.10 0.00 0.02 0.00 0.00 61.00 62.38 2opv s PRO 66 Cb -0.15 -4.37 0.06 0.00 0.02 0.00 0.00 34.50 30.05 2opv s PRO 66 CO 0.09 -2.46 0.26 -1.17 -0.33 0.00 0.00 177.00 173.39 2opv s LEU 67 N 9.01 5.09 -0.45 -5.54 2.96 0.01 -1.70 118.68 128.07 2opv s LEU 67 Ca 0.86 -1.34 -0.14 0.00 -0.22 0.00 0.00 54.13 53.29 2opv s LEU 67 Cb -0.21 -2.02 0.07 0.00 0.50 0.00 0.00 46.19 44.52 2opv s LEU 67 CO 0.29 -0.51 0.35 -0.13 -1.32 0.00 0.00 176.35 175.03 2opv s ARG 68 N 1.49 2.89 -0.59 1.98 0.52 -1.02 -0.32 118.95 123.90 2opv s ARG 68 Ca 0.03 -1.33 -0.24 0.00 -0.52 0.00 0.00 55.73 53.67 2opv s ARG 68 Cb -0.22 -4.02 0.05 0.00 0.52 0.00 0.00 34.95 31.28 2opv s ARG 68 CO 0.04 -0.97 0.97 0.42 0.02 0.00 0.00 175.30 175.79 2opv s ILE 69 N 1.59 4.32 -0.35 1.52 1.09 0.00 -2.25 121.20 127.12 2opv s ILE 69 Ca 0.04 0.14 -0.11 0.00 -1.10 0.00 0.00 60.65 59.62 2opv s ILE 69 Cb -0.23 -4.60 0.01 0.00 -1.06 0.00 0.00 42.46 36.57 2opv s ILE 69 CO 0.06 -1.25 0.20 -0.63 -0.10 0.00 0.00 174.94 173.22 2opv s ILE 70 N 4.11 4.74 0.00 2.92 1.01 0.11 -1.70 121.20 132.39 2opv s ILE 70 Ca 0.29 -0.60 0.00 0.00 0.00 0.00 0.00 60.65 60.34 2opv s ILE 70 Cb -0.13 -3.53 0.00 0.00 0.01 0.00 0.00 42.46 38.81 2opv s ILE 70 CO 0.17 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.62 2opv n GLY 71 N 5.02 0.75 3.63 6.18 0.00 0.11 -1.10 105.19 119.78 2opv n GLY 71 Ca -0.13 0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 2.00 4.82 0.35 1.61 -1.08 -1.26 -1.25 116.67 121.86 2opv s ASP 72 Ca 0.00 -0.06 0.16 0.00 -0.52 0.00 0.00 52.55 52.13 2opv s ASP 72 Cb 0.00 -1.20 1.13 0.00 -1.46 0.00 0.00 42.92 41.39 2opv s ASP 72 CO 0.00 0.30 1.65 -0.65 0.52 0.00 0.00 175.17 177.00 2opv h PRO 73 N 4.65 0.27 0.10 4.34 0.11 -1.87 0.70 132.00 140.30 2opv h PRO 73 Ca -0.49 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2opv h PRO 73 Cb 1.17 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2opv h PRO 73 CO 0.55 0.18 -0.05 -0.92 -0.21 0.00 0.00 178.00 177.55 2opv h TYR 74 N 0.28 -0.13 0.00 0.65 3.20 -1.95 -2.40 116.97 116.62 2opv h TYR 74 Ca 0.75 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.62 2opv h TYR 74 Cb 1.76 0.04 0.00 0.00 1.54 0.00 0.00 36.73 40.07 2opv h TYR 74 CO -0.01 0.38 0.00 1.57 -1.64 0.00 0.00 178.16 178.46 2opv h LYS 75 N -0.87 0.00 -0.37 1.82 2.10 -1.70 -1.04 116.57 116.52 2opv h LYS 75 Ca -0.01 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.47 2opv h LYS 75 Cb 0.56 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.89 2opv h LYS 75 CO 0.02 0.00 -0.40 0.28 -2.00 0.00 0.00 179.45 177.35 2opv h VAL 76 N 0.00 1.27 -0.15 0.07 2.07 0.35 -0.27 116.25 119.59 2opv h VAL 76 Ca 0.00 -1.58 -0.06 0.00 0.82 0.00 0.00 66.70 65.89 2opv h VAL 76 Cb 0.67 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2opv h VAL 76 CO 0.00 0.53 -0.13 -0.61 0.02 0.00 0.00 177.57 177.38 2opv h GLN 77 N 0.74 0.36 -0.97 1.57 5.75 -0.93 0.12 115.11 121.74 2opv h GLN 77 Ca 0.05 -0.18 0.03 0.00 -0.15 0.00 0.00 58.65 58.41 2opv h GLN 77 Cb 1.00 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.50 2opv h GLN 77 CO 0.10 0.72 0.64 1.96 -2.65 0.00 0.00 178.83 179.60 2opv h GLN 78 N -0.00 1.20 -0.31 1.69 4.20 -1.23 -0.37 115.11 120.29 2opv h GLN 78 Ca 0.03 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.54 2opv h GLN 78 Cb 0.65 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2opv h GLN 78 CO 0.03 0.79 -0.34 0.00 -0.67 0.00 0.00 178.83 178.65 2opv h ALA 79 N 1.43 0.84 0.06 3.87 0.00 -0.87 -0.45 119.26 124.14 2opv h ALA 79 Ca 0.38 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2opv h ALA 79 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2opv h ALA 79 CO -0.11 0.64 -0.03 0.00 0.00 0.00 0.00 179.25 179.75 2opv h GLU 81 N -0.34 0.00 0.17 0.00 4.11 -1.09 0.10 114.58 117.52 2opv h GLU 81 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.41 2opv h GLU 81 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2opv h GLU 81 CO 0.01 0.00 -0.08 1.98 0.07 0.00 0.00 179.01 180.99 2opv h MET 82 N 0.00 -0.21 -0.20 1.06 4.05 -0.62 -1.66 114.93 117.36 2opv h MET 82 Ca 0.00 0.01 -0.15 0.00 -0.28 0.00 0.00 59.70 59.29 2opv h MET 82 Cb 0.46 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.30 2opv h MET 82 CO 0.00 0.20 -0.49 -0.39 0.23 0.00 0.00 176.91 176.46 2opv h VAL 83 N -0.75 1.32 0.00 -5.77 -1.51 -0.57 -2.58 116.25 106.38 2opv h VAL 83 Ca -0.02 -1.72 -0.07 0.00 -1.23 0.00 0.00 66.70 63.66 2opv h VAL 83 Cb 0.52 1.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.37 2opv h VAL 83 CO 0.04 0.53 -0.34 0.24 -1.23 0.00 0.00 177.57 176.81 2opv h MET 84 N 0.42 0.00 -0.16 5.19 2.86 -0.91 -2.69 114.93 119.63 2opv h MET 84 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2opv h MET 84 Cb 1.01 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 2opv h MET 84 CO 0.09 0.34 0.11 0.22 1.06 0.00 0.00 176.91 178.72 2opv h ASP 85 N 0.00 0.19 -0.46 1.22 1.82 -0.90 -0.41 116.42 117.87 2opv h ASP 85 Ca -0.00 -0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.62 2opv h ASP 85 Cb 0.74 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.68 2opv h ASP 85 CO 0.04 0.14 0.29 0.40 -1.61 0.00 0.00 179.24 178.50 2opv h ILE 86 N 0.21 1.14 0.00 2.25 2.04 -1.30 0.20 117.51 122.05 2opv h ILE 86 Ca 0.06 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2opv h ILE 86 Cb -0.02 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2opv h ILE 86 CO -0.01 0.14 -0.10 -0.07 0.00 0.00 0.00 178.15 178.11 2opv h LEU 87 N 0.65 0.00 0.01 1.44 3.38 -1.15 -3.29 115.31 116.35 2opv h LEU 87 Ca 0.17 -0.02 -0.36 0.00 0.09 0.00 0.00 57.88 57.76 2opv h LEU 87 Cb -0.03 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 2opv h LEU 87 CO -0.03 0.01 -2.25 -1.14 0.09 0.00 0.00 178.44 175.12 2opv n ARG 88 N -2.45 0.68 0.00 1.13 0.63 -0.20 -5.09 116.66 111.36 2opv n ARG 88 Ca 0.05 0.12 0.15 0.00 -0.92 0.00 0.00 57.85 57.24 2opv n ARG 88 Cb 0.46 -1.59 0.88 0.00 0.45 0.00 0.00 32.46 32.66 2opv n ARG 88 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21