#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2elj s SER 2 N 0.00 4.88 -0.04 1.61 1.04 -1.26 -4.76 113.70 115.17 2elj s SER 2 Ca 0.00 -0.47 -0.23 0.00 0.48 0.00 0.00 55.95 55.73 2elj s SER 2 Cb 0.00 -2.56 -0.23 0.00 0.10 0.00 0.00 66.02 63.33 2elj s SER 2 CO 0.00 -2.97 1.05 -1.28 0.98 0.00 0.00 173.24 171.02 2elj h SER 3 N 11.81 0.29 -5.00 7.02 0.87 -2.15 -3.50 113.55 122.89 2elj h SER 3 Ca 0.06 -0.76 0.00 0.00 -1.23 0.00 0.00 61.79 59.86 2elj h SER 3 Cb 1.01 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 2elj h SER 3 CO 1.17 1.01 0.00 0.61 -0.53 0.00 0.00 176.83 179.09 2elj n GLY 4 N 1.02 2.57 3.57 5.77 0.00 -1.26 -5.13 105.19 111.72 2elj n GLY 4 Ca -0.10 -1.82 -0.14 0.00 0.00 0.00 0.00 46.02 43.96 2elj n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2elj s SER 5 N 0.00 -0.57 -0.41 1.61 0.15 -1.26 -5.13 113.70 108.09 2elj s SER 5 Ca 0.00 0.78 -0.17 0.00 0.70 0.00 0.00 55.95 57.26 2elj s SER 5 Cb 0.00 0.68 0.02 0.00 -1.71 0.00 0.00 66.02 65.01 2elj s SER 5 CO 0.00 -0.41 0.41 -0.44 1.20 0.00 0.00 173.24 174.00 2elj s SER 6 N -0.70 6.18 0.00 5.45 0.01 -1.26 -5.02 113.70 118.36 2elj s SER 6 Ca -0.05 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 56.55 2elj s SER 6 Cb -0.02 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 64.00 2elj s SER 6 CO 0.04 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 173.76 2elj n GLY 7 N 5.10 -1.82 3.66 3.44 0.00 -1.26 -4.75 105.19 109.56 2elj n GLY 7 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 2elj n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2elj s ASN 8 N -1.87 6.53 -0.07 1.61 -0.87 -1.26 -5.05 114.94 113.95 2elj s ASN 8 Ca 0.00 0.63 -0.01 0.00 -1.57 0.00 0.00 52.86 51.91 2elj s ASN 8 Cb 0.00 -2.28 0.03 0.00 -0.02 0.00 0.00 41.25 38.97 2elj s ASN 8 CO 0.00 -0.18 -0.02 -0.32 -2.57 0.00 0.00 177.10 174.01 2elj s MET 9 N 1.69 0.80 0.36 -0.60 1.75 -1.26 -5.10 119.30 116.94 2elj s MET 9 Ca 0.23 0.01 0.06 0.00 -1.25 0.00 0.00 55.69 54.74 2elj s MET 9 Cb -0.15 -1.05 -0.07 0.00 2.84 0.00 0.00 34.83 36.40 2elj s MET 9 CO 0.09 -0.26 0.02 0.95 -0.65 0.00 0.00 175.02 175.18 2elj s THR 10 N 1.75 1.60 0.28 10.11 -4.23 -1.26 -5.02 115.64 118.87 2elj s THR 10 Ca 0.02 -2.02 -0.02 0.00 -1.18 0.00 0.00 61.69 58.49 2elj s THR 10 Cb -0.13 -2.84 0.35 0.00 1.34 0.00 0.00 72.50 71.23 2elj s THR 10 CO -0.05 -0.04 1.60 0.40 -0.54 0.00 0.00 174.62 176.00 2elj h ILE 11 N 1.99 0.18 -1.12 2.99 2.04 -1.96 0.48 117.51 122.10 2elj h ILE 11 Ca -0.42 -0.02 0.39 0.00 1.00 0.00 0.00 64.86 65.80 2elj h ILE 11 Cb 1.24 0.10 -0.15 0.00 -0.74 0.00 0.00 36.82 37.28 2elj h ILE 11 CO 0.74 0.01 0.67 0.28 0.00 0.00 0.00 178.15 179.85 2elj h SER 12 N 0.07 0.36 0.17 1.72 0.02 -1.98 0.36 113.55 114.27 2elj h SER 12 Ca 0.51 0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.64 2elj h SER 12 Cb 0.99 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2elj h SER 12 CO -0.80 -0.23 -0.08 0.44 -1.14 0.00 0.00 176.83 175.02 2elj h ASP 13 N 0.15 -0.19 0.15 3.07 3.32 -0.38 -0.03 116.42 122.51 2elj h ASP 13 Ca 0.79 -0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.75 2elj h ASP 13 Cb 2.16 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 41.74 2elj h ASP 13 CO -0.57 -0.02 -0.18 0.40 -1.72 0.00 0.00 179.24 177.15 2elj h ILE 14 N -0.36 0.60 0.00 0.35 2.04 -0.37 -1.30 117.51 118.46 2elj h ILE 14 Ca -0.02 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2elj h ILE 14 Cb 0.28 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2elj h ILE 14 CO 0.04 0.00 -0.02 1.56 0.00 0.00 0.00 178.15 179.73 2elj h GLN 15 N -0.37 0.00 -0.98 2.37 4.20 -1.22 -1.98 115.11 117.12 2elj h GLN 15 Ca 0.01 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 58.08 2elj h GLN 15 Cb 0.37 0.00 -0.30 0.00 0.30 0.00 0.00 27.48 27.85 2elj h GLN 15 CO -0.07 0.02 0.75 1.58 -0.67 0.00 0.00 178.83 180.44 2elj n HIS 16 N -3.31 3.16 -4.48 2.96 -0.00 -0.03 -4.87 115.22 108.65 2elj n HIS 16 Ca -0.02 -2.79 -0.32 0.00 0.46 0.00 0.00 57.72 55.04 2elj n HIS 16 Cb 0.13 -1.31 -0.11 0.00 -0.12 0.00 0.00 29.99 28.59 2elj n HIS 16 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2elj s ALA 17 N -3.73 3.01 -1.91 1.57 0.00 -0.75 -4.93 121.76 115.02 2elj s ALA 17 Ca 0.63 -1.01 0.15 0.00 0.00 0.00 0.00 51.96 51.73 2elj s ALA 17 Cb 0.50 -1.14 0.90 0.00 0.00 0.00 0.00 23.12 23.39 2elj s ALA 17 CO 0.01 0.61 1.35 -0.35 0.00 0.00 0.00 175.76 177.38 2elj n PRO 18 N 1.63 0.44 -1.23 0.00 -0.04 -1.26 -2.36 135.00 132.19 2elj n PRO 18 Ca -0.16 0.02 0.04 0.00 -0.04 0.00 0.00 63.50 63.37 2elj n PRO 18 Cb 0.53 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.57 2elj n PRO 18 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2elj n ASP 19 N -1.04 1.34 -0.12 3.54 9.92 -1.26 -4.82 116.55 124.11 2elj n ASP 19 Ca 0.11 -2.71 -0.23 0.00 -0.53 0.00 0.00 54.79 51.43 2elj n ASP 19 Cb 0.06 -0.39 -0.09 0.00 -0.64 0.00 0.00 41.12 40.06 2elj n ASP 19 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2elj n TYR 20 N -0.13 0.00 -0.27 1.24 9.36 -1.00 -4.49 117.16 121.87 2elj n TYR 20 Ca 0.11 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.49 2elj n TYR 20 Cb 0.97 -0.86 0.43 0.00 -0.63 0.00 0.00 39.34 39.25 2elj n TYR 20 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2elj h ALA 21 N -0.61 1.98 -0.60 2.98 0.00 -1.88 0.15 119.26 121.28 2elj h ALA 21 Ca -0.58 0.03 0.17 0.00 0.00 0.00 0.00 54.91 54.53 2elj h ALA 21 Cb 1.60 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 2elj h ALA 21 CO -0.28 -0.26 0.44 1.37 0.00 0.00 0.00 179.25 180.52 2elj h LEU 22 N 0.57 0.00-10.26 0.00 8.10 -1.90 -3.42 115.31 108.39 2elj h LEU 22 Ca 0.48 0.00 -0.51 0.00 0.11 0.00 0.00 57.88 57.96 2elj h LEU 22 Cb 0.95 0.00 0.20 0.00 -0.44 0.00 0.00 40.66 41.37 2elj h LEU 22 CO -0.22 0.00 0.21 -0.76 -4.11 0.00 0.00 178.44 173.56 2elj s LEU 23 N -8.58 2.70 0.20 0.17 1.43 0.52 -5.01 118.68 110.12 2elj s LEU 23 Ca -0.05 2.13 -0.07 0.00 -1.03 0.00 0.00 54.13 55.12 2elj s LEU 23 Cb 0.20 -4.48 -0.06 0.00 0.03 0.00 0.00 46.19 41.87 2elj s LEU 23 CO 0.72 -3.16 0.47 -0.44 0.23 0.00 0.00 176.35 174.18 2elj s SER 24 N -2.68 6.53 0.32 2.29 0.01 -1.26 -4.84 113.70 114.07 2elj s SER 24 Ca 0.67 0.73 0.19 0.00 1.31 0.00 0.00 55.95 58.85 2elj s SER 24 Cb -0.23 -2.15 1.14 0.00 0.21 0.00 0.00 66.02 65.00 2elj s SER 24 CO 0.58 -0.04 1.31 -3.20 0.41 0.00 0.00 173.24 172.31 2elj n ASN 25 N -0.18 0.27 0.14 2.44 2.85 -1.26 0.20 115.26 119.72 2elj n ASN 25 Ca -0.01 1.34 -0.10 0.00 -0.11 0.00 0.00 54.58 55.70 2elj n ASN 25 Cb 0.52 -0.65 -0.06 0.00 1.24 0.00 0.00 39.78 40.83 2elj n ASN 25 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 2elj h ASP 26 N 0.00 -0.36 -0.75 1.20 3.04 -2.02 -3.25 116.42 114.30 2elj h ASP 26 Ca 0.71 -0.14 0.17 0.00 -3.24 0.00 0.00 57.03 54.53 2elj h ASP 26 Cb 1.96 0.09 -0.12 0.00 -1.04 0.00 0.00 39.33 40.22 2elj h ASP 26 CO -0.60 0.12 0.12 -0.33 -2.04 0.00 0.00 179.24 176.51 2elj h GLU 27 N -1.01 0.19 -0.54 4.15 5.08 -0.61 -1.11 114.58 120.73 2elj h GLU 27 Ca -0.04 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.40 2elj h GLU 27 Cb 0.47 -0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.57 2elj h GLU 27 CO 0.07 0.13 -0.35 1.96 -1.00 0.00 0.00 179.01 179.82 2elj h GLN 28 N 0.20 -0.19 -0.49 2.33 4.20 -1.01 -0.63 115.11 119.52 2elj h GLN 28 Ca 0.42 0.01 0.10 0.00 0.06 0.00 0.00 58.65 59.24 2elj h GLN 28 Cb 0.74 0.04 -0.10 0.00 0.30 0.00 0.00 27.48 28.47 2elj h GLN 28 CO -0.57 -0.13 -0.24 1.96 -0.67 0.00 0.00 178.83 179.18 2elj h GLN 29 N -0.20 -0.12 0.11 1.46 1.08 -1.23 -1.56 115.11 114.64 2elj h GLN 29 Ca 0.21 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.41 2elj h GLN 29 Cb 0.55 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 2elj h GLN 29 CO -0.64 -0.08 -0.13 1.25 -0.95 0.00 0.00 178.83 178.27 2elj h LEU 30 N -0.13 -0.37 -0.88 1.46 5.85 -1.05 0.54 115.31 120.74 2elj h LEU 30 Ca 0.22 0.03 0.16 0.00 0.84 0.00 0.00 57.88 59.14 2elj h LEU 30 Cb 0.48 0.12 -0.16 0.00 0.37 0.00 0.00 40.66 41.47 2elj h LEU 30 CO -0.57 -0.17 -0.25 0.00 -0.34 0.00 0.00 178.44 177.12 2elj h ILE 32 N 0.00 0.49 0.41 0.00 2.04 -1.00 2.01 117.51 121.46 2elj h ILE 32 Ca 0.39 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.24 2elj h ILE 32 Cb 0.61 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 2elj h ILE 32 CO -0.89 0.00 -0.49 1.56 0.00 0.00 0.00 178.15 178.33 2elj h GLN 33 N -0.70 -0.89 0.00 2.37 1.08 0.18 -1.14 115.11 116.01 2elj h GLN 33 Ca -0.07 0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2elj h GLN 33 Cb 0.54 0.20 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 2elj h GLN 33 CO 0.11 -0.59 0.00 1.28 -0.95 0.00 0.00 178.83 178.68 2elj n LEU 34 N -5.54 0.00 -3.57 1.46 4.77 0.11 -4.88 117.00 109.35 2elj n LEU 34 Ca -0.11 0.27 -0.26 0.00 -0.03 0.00 0.00 56.01 55.88 2elj n LEU 34 Cb 0.44 -0.27 0.05 0.00 -2.33 0.00 0.00 43.42 41.32 2elj n LEU 34 CO 0.25 -0.06 0.15 0.29 -1.33 0.00 0.00 177.39 176.68 2elj n LYS 35 N -1.27 -6.46 -4.01 3.23 4.76 0.62 -4.98 118.16 110.05 2elj n LYS 35 Ca 0.11 0.76 -0.29 0.00 -2.87 0.00 0.00 58.31 56.02 2elj n LYS 35 Cb 0.18 -5.71 -0.05 0.00 -1.84 0.00 0.00 35.03 27.60 2elj n LYS 35 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2elj s ILE 36 N -3.27 4.88 0.34 -0.18 1.01 0.25 -4.96 121.20 119.27 2elj s ILE 36 Ca 0.55 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 60.40 2elj s ILE 36 Cb -0.26 -3.43 -0.05 0.00 0.01 0.00 0.00 42.46 38.73 2elj s ILE 36 CO 0.68 0.03 0.64 -0.76 0.00 0.00 0.00 174.94 175.53 2elj s LEU 37 N -2.75 3.96 0.44 2.97 1.43 -1.26 -4.51 118.68 118.95 2elj s LEU 37 Ca 0.32 0.86 0.22 0.00 -1.03 0.00 0.00 54.13 54.50 2elj s LEU 37 Cb -0.12 -3.70 0.96 0.00 0.03 0.00 0.00 46.19 43.36 2elj s LEU 37 CO 0.25 -0.28 1.86 1.55 0.23 0.00 0.00 176.35 179.95 2elj h PRO 38 N 1.45 0.00 0.75 1.29 0.13 -1.93 -1.64 132.00 132.05 2elj h PRO 38 Ca -0.48 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.62 2elj h PRO 38 Cb 1.19 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2elj h PRO 38 CO 0.65 0.25 -0.36 -0.22 -0.23 0.00 0.00 178.00 178.09 2elj h LYS 39 N 0.00 -0.98 -0.32 0.86 1.63 -1.94 -1.91 116.57 113.91 2elj h LYS 39 Ca -0.00 0.07 -0.15 0.00 -0.85 0.00 0.00 60.65 59.71 2elj h LYS 39 Cb 0.69 0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 32.53 2elj h LYS 39 CO 0.03 -0.64 -0.40 -1.00 -3.45 0.00 0.00 179.45 173.99 2elj h PRO 40 N -1.24 0.78 -0.92 1.90 0.13 -1.98 -2.97 132.00 127.70 2elj h PRO 40 Ca -0.10 -0.41 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2elj h PRO 40 Cb 0.79 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.89 2elj h PRO 40 CO 0.17 1.04 0.61 -0.92 -0.23 0.00 0.00 178.00 178.67 2elj h TYR 41 N 0.64 1.16 -0.32 1.56 3.20 -1.37 -2.32 116.97 119.51 2elj h TYR 41 Ca 0.05 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 2elj h TYR 41 Cb 0.96 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 2elj h TYR 41 CO 0.05 0.73 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.22 2elj h LEU 42 N 1.25 0.57 0.19 2.82 3.38 -1.28 0.81 115.31 123.05 2elj h LEU 42 Ca 0.34 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2elj h LEU 42 Cb -0.15 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 2elj h LEU 42 CO -0.07 0.76 -0.33 0.58 0.09 0.00 0.00 178.44 179.47 2elj h VAL 43 N 0.38 0.31 0.00 1.22 2.07 -1.31 0.77 116.25 119.70 2elj h VAL 43 Ca 0.09 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.55 2elj h VAL 43 Cb 0.47 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2elj h VAL 43 CO 0.02 0.00 -0.30 0.17 0.02 0.00 0.00 177.57 177.48 2elj h LEU 44 N -0.59 0.00 0.38 2.57 8.10 -1.45 -3.09 115.31 121.23 2elj h LEU 44 Ca 0.01 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.99 2elj h LEU 44 Cb 0.59 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.82 2elj h LEU 44 CO -0.15 0.30 -0.18 0.50 -4.11 0.00 0.00 178.44 174.80 2elj h LYS 45 N 0.00 -0.49 -0.99 0.17 3.64 -0.02 -2.79 116.57 116.10 2elj h LYS 45 Ca -0.00 0.03 0.19 0.00 -1.27 0.00 0.00 60.65 59.60 2elj h LYS 45 Cb 0.66 0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 32.49 2elj h LYS 45 CO 0.04 -0.19 0.61 1.49 -2.27 0.00 0.00 179.45 179.14 2elj h GLU 46 N -0.81 0.67 0.61 1.90 4.22 -0.85 -2.50 114.58 117.82 2elj h GLU 46 Ca -0.05 -0.04 -0.03 0.00 0.08 0.00 0.00 59.36 59.32 2elj h GLU 46 Cb 0.53 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2elj h GLU 46 CO 0.09 0.44 -0.34 0.28 -2.18 0.00 0.00 179.01 177.30 2elj h VAL 47 N 0.69 0.00 -0.81 0.32 2.07 -1.46 -1.72 116.25 115.34 2elj h VAL 47 Ca 0.55 0.00 0.13 0.00 0.82 0.00 0.00 66.70 68.20 2elj h VAL 47 Cb 0.96 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.59 2elj h VAL 47 CO -0.33 0.00 -0.31 0.23 0.02 0.00 0.00 177.57 177.19 2elj n MET 48 N -4.53 -0.18 0.42 1.57 2.81 -0.95 -0.43 117.12 115.82 2elj n MET 48 Ca -0.11 1.25 -0.19 0.00 -1.81 0.00 0.00 57.70 56.84 2elj n MET 48 Cb 0.36 -1.85 -0.10 0.00 -0.71 0.00 0.00 33.22 30.92 2elj n MET 48 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 2elj h PHE 49 N 0.00 -1.25 -0.75 2.03 0.04 -1.42 0.32 116.94 115.91 2elj h PHE 49 Ca 0.29 -0.01 0.17 0.00 2.80 0.00 0.00 57.97 61.22 2elj h PHE 49 Cb 0.49 0.45 -0.13 0.00 2.20 0.00 0.00 35.95 38.95 2elj h PHE 49 CO -0.70 -0.70 -0.04 -0.09 -0.60 0.00 0.00 178.31 176.17 2elj h ARG 50 N -1.15 0.07 -0.17 1.51 2.43 0.20 0.45 114.38 117.71 2elj h ARG 50 Ca -0.10 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 58.96 2elj h ARG 50 Cb 0.93 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 2elj h ARG 50 CO 0.10 0.05 -0.37 1.49 -1.51 0.00 0.00 179.97 179.73 2elj h GLU 51 N 0.07 0.37 -0.38 0.20 4.57 -0.52 -0.55 114.58 118.35 2elj h GLU 51 Ca 0.40 -0.17 -0.02 0.00 -1.18 0.00 0.00 59.36 58.40 2elj h GLU 51 Cb 0.69 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 2elj h GLU 51 CO -0.69 0.69 0.16 -0.07 -1.18 0.00 0.00 179.01 177.91 2elj h LEU 52 N 0.31 0.52 -0.13 1.64 3.38 0.38 -1.61 115.31 119.80 2elj h LEU 52 Ca 0.03 -0.16 -0.23 0.00 0.09 0.00 0.00 57.88 57.61 2elj h LEU 52 Cb 0.79 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.42 2elj h LEU 52 CO 0.06 0.53 -0.85 0.17 0.09 0.00 0.00 178.44 178.44 2elj h LEU 53 N 0.46 0.91 0.19 1.67 8.10 -0.85 0.22 115.31 126.01 2elj h LEU 53 Ca 0.13 -0.63 0.01 0.00 0.11 0.00 0.00 57.88 57.49 2elj h LEU 53 Cb 0.18 -0.27 -0.03 0.00 -0.44 0.00 0.00 40.66 40.10 2elj h LEU 53 CO -0.01 1.43 -0.28 0.50 -4.11 0.00 0.00 178.44 175.97 2elj h LYS 54 N 0.48 -0.51 0.00 0.17 3.64 -0.99 -2.74 116.57 116.61 2elj h LYS 54 Ca -0.07 0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 2elj h LYS 54 Cb 1.49 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 33.40 2elj h LYS 54 CO 0.17 -0.34 -0.74 1.79 -2.27 0.00 0.00 179.45 178.06 2elj h THR 55 N -0.53 1.38 -0.95 1.00 1.35 -1.38 -3.48 112.91 110.30 2elj h THR 55 Ca 0.01 -2.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.20 2elj h THR 55 Cb 0.53 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 2elj h THR 55 CO -0.11 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 2elj n GLY 56 N 0.96 0.74 1.28 5.82 0.00 0.48 -4.62 105.19 109.85 2elj n GLY 56 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2elj n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2elj n GLY 57 N -0.47 0.91 2.55 -0.02 0.00 0.46 -5.01 105.19 103.62 2elj n GLY 57 Ca 0.00 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 2elj n GLY 57 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2elj n ASN 58 N -1.28 2.76 -4.84 1.61 5.15 -1.26 -5.08 115.26 112.32 2elj n ASN 58 Ca 0.00 -2.77 -0.29 0.00 -0.60 0.00 0.00 54.58 50.92 2elj n ASN 58 Cb 0.43 -0.45 -0.05 0.00 -0.53 0.00 0.00 39.78 39.18 2elj n ASN 58 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2elj s LEU 59 N -3.61 4.01 -0.14 1.20 2.96 -1.26 -5.00 118.68 116.83 2elj s LEU 59 Ca 0.36 0.07 -0.29 0.00 -0.22 0.00 0.00 54.13 54.04 2elj s LEU 59 Cb 0.38 -2.64 0.09 0.00 0.50 0.00 0.00 46.19 44.51 2elj s LEU 59 CO -0.02 0.14 0.79 -0.55 -1.32 0.00 0.00 176.35 175.40 2elj s SER 60 N -2.62 -0.59 0.26 3.68 0.15 -1.26 -4.97 113.70 108.35 2elj s SER 60 Ca 0.32 0.80 0.11 0.00 0.70 0.00 0.00 55.95 57.87 2elj s SER 60 Cb -0.12 0.69 0.86 0.00 -1.71 0.00 0.00 66.02 65.74 2elj s SER 60 CO 0.24 -0.44 1.20 0.29 1.20 0.00 0.00 173.24 175.73 2elj n LYS 61 N 1.32 -0.05 0.35 5.44 4.76 -1.26 0.78 118.16 129.50 2elj n LYS 61 Ca -0.15 1.08 -0.18 0.00 -2.87 0.00 0.00 58.31 56.19 2elj n LYS 61 Cb 0.57 -1.86 -0.09 0.00 -1.84 0.00 0.00 35.03 31.81 2elj n LYS 61 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 2elj h SER 62 N 0.00 -0.80 0.38 4.39 0.02 -2.00 -1.81 113.55 113.72 2elj h SER 62 Ca 0.58 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.54 2elj h SER 62 Cb 1.42 0.22 0.00 0.00 0.14 0.00 0.00 62.40 64.19 2elj h SER 62 CO -0.63 -0.54 -0.18 0.00 -1.14 0.00 0.00 176.83 174.33 2elj h ALA 63 N -0.52 -0.51 -0.76 3.77 0.00 -0.03 -3.24 119.26 117.97 2elj h ALA 63 Ca -0.08 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.72 2elj h ALA 63 Cb 0.69 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.59 2elj h ALA 63 CO 0.12 -0.53 -0.45 0.00 0.00 0.00 0.00 179.25 178.39 2elj h ARG 65 N 0.00 0.04 -0.02 0.00 3.08 -1.44 0.31 114.38 116.35 2elj h ARG 65 Ca 0.12 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 2elj h ARG 65 Cb 0.31 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2elj h ARG 65 CO -0.71 0.03 0.01 1.49 -1.07 0.00 0.00 179.97 179.71 2elj h GLU 66 N 0.05 0.03 0.23 0.04 4.57 -0.16 0.19 114.58 119.52 2elj h GLU 66 Ca 0.59 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.77 2elj h GLU 66 Cb 1.23 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.78 2elj h GLU 66 CO -0.85 0.23 -0.53 1.25 -1.18 0.00 0.00 179.01 177.93 2elj h LEU 67 N -0.17 -1.55 -1.65 1.64 5.85 0.13 -1.63 115.31 117.93 2elj h LEU 67 Ca 0.01 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 2elj h LEU 67 Cb 0.21 0.55 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 2elj h LEU 67 CO -0.00 -0.59 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.32 2elj h LEU 68 N -0.83 0.07 -1.12 2.25 3.38 -1.14 -3.46 115.31 114.46 2elj h LEU 68 Ca -0.02 -0.01 -0.45 0.00 0.09 0.00 0.00 57.88 57.48 2elj h LEU 68 Cb 0.80 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.54 2elj h LEU 68 CO -0.23 0.20 -0.76 0.59 0.09 0.00 0.00 178.44 178.33 2elj n ASN 69 N -4.36 -4.33 -4.46 -0.43 3.02 0.65 -4.98 115.26 100.37 2elj n ASN 69 Ca -0.02 -0.75 -0.22 0.00 -0.03 0.00 0.00 54.58 53.56 2elj n ASN 69 Cb 0.21 -4.09 -0.11 0.00 -0.61 0.00 0.00 39.78 35.19 2elj n ASN 69 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2elj s ILE 70 N -3.37 1.50 0.43 2.41 -4.36 -1.24 -5.07 121.20 111.50 2elj s ILE 70 Ca 0.53 -2.06 -0.20 0.00 -0.26 0.00 0.00 60.65 58.65 2elj s ILE 70 Cb -0.26 -2.64 -0.15 0.00 1.25 0.00 0.00 42.46 40.65 2elj s ILE 70 CO 0.81 -0.15 0.06 0.47 0.24 0.00 0.00 174.94 176.37 2elj n ASP 71 N -0.66 -2.97 0.15 4.36 9.92 -1.26 -4.77 116.55 121.31 2elj n ASP 71 Ca -0.04 0.77 -0.00 0.00 -0.53 0.00 0.00 54.79 54.99 2elj n ASP 71 Cb 0.65 -0.89 0.25 0.00 -0.64 0.00 0.00 41.12 40.49 2elj n ASP 71 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2elj h PRO 72 N 0.25 0.06 -0.40 -0.24 0.13 -1.99 -2.93 132.00 126.88 2elj h PRO 72 Ca -0.38 -0.03 -0.14 0.00 -0.87 0.00 0.00 66.00 64.57 2elj h PRO 72 Cb 1.44 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.57 2elj h PRO 72 CO 0.46 0.53 -0.31 0.82 -0.23 0.00 0.00 178.00 179.26 2elj h ILE 73 N 0.05 1.27 0.74 -3.56 2.04 -1.99 -0.70 117.51 115.37 2elj h ILE 73 Ca -0.00 -1.48 -0.04 0.00 1.00 0.00 0.00 64.86 64.34 2elj h ILE 73 Cb 0.87 1.33 0.01 0.00 -0.74 0.00 0.00 36.82 38.29 2elj h ILE 73 CO 0.07 0.50 -0.36 0.11 0.00 0.00 0.00 178.15 178.47 2elj h LYS 74 N 0.74 -0.96 -0.24 2.37 1.57 -1.89 -3.12 116.57 115.03 2elj h LYS 74 Ca 0.07 0.07 0.04 0.00 -1.87 0.00 0.00 60.65 58.96 2elj h LYS 74 Cb 0.90 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 33.39 2elj h LYS 74 CO 0.08 -0.64 0.01 0.00 -0.57 0.00 0.00 179.45 178.33 2elj h ALA 75 N -1.37 0.22 -1.42 3.86 0.00 -1.61 0.06 119.26 119.00 2elj h ALA 75 Ca -0.10 0.06 0.47 0.00 0.00 0.00 0.00 54.91 55.34 2elj h ALA 75 Cb 0.76 0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.53 2elj h ALA 75 CO 0.17 -0.41 0.93 -0.91 0.00 0.00 0.00 179.25 179.03 2elj h ASN 76 N 0.09 0.19 0.04 0.00 4.21 -1.16 0.22 115.58 119.16 2elj h ASN 76 Ca 0.11 0.13 -0.29 0.00 1.21 0.00 0.00 56.30 57.47 2elj h ASN 76 Cb 0.14 0.13 -0.03 0.00 -1.12 0.00 0.00 38.32 37.44 2elj h ASN 76 CO -0.18 -0.20 -1.56 -1.14 -1.29 0.00 0.00 177.43 173.05 2elj n ARG 77 N -4.63 0.62 -0.31 0.81 3.00 -0.67 -4.19 116.66 111.29 2elj n ARG 77 Ca 0.40 0.46 0.21 0.00 -0.00 0.00 0.00 57.85 58.92 2elj n ARG 77 Cb 1.57 -1.72 0.49 0.00 0.00 0.00 0.00 32.46 32.80 2elj n ARG 77 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2elj h ILE 78 N -0.67 0.56 0.35 5.15 2.04 0.11 -2.26 117.51 122.79 2elj h ILE 78 Ca -0.39 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 2elj h ILE 78 Cb 1.54 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2elj h ILE 78 CO -0.13 0.08 -0.27 0.22 0.00 0.00 0.00 178.15 178.04 2elj h TYR 79 N 0.43 -0.74 -0.94 1.37 5.03 -0.88 -2.87 116.97 118.37 2elj h TYR 79 Ca 0.58 -0.00 0.18 0.00 2.58 0.00 0.00 58.73 62.06 2elj h TYR 79 Cb 1.41 0.27 -0.17 0.00 1.55 0.00 0.00 36.73 39.79 2elj h TYR 79 CO -0.00 -0.38 -0.27 -3.47 -1.32 0.00 0.00 178.16 172.72 2elj n ASP 80 N -4.00 -0.41 -0.23 -2.11 -0.08 -0.86 0.00 116.55 108.87 2elj n ASP 80 Ca -0.07 1.62 -0.06 0.00 -1.51 0.00 0.00 54.79 54.77 2elj n ASP 80 Cb 0.26 -0.46 -0.00 0.00 2.34 0.00 0.00 41.12 43.25 2elj n ASP 80 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2elj h PHE 81 N 0.00 -1.08 -0.06 -0.67 3.57 -1.40 0.20 116.94 117.49 2elj h PHE 81 Ca 0.42 0.08 0.04 0.00 3.53 0.00 0.00 57.97 62.04 2elj h PHE 81 Cb 0.65 0.57 -0.06 0.00 2.79 0.00 0.00 35.95 39.90 2elj h PHE 81 CO -0.75 -0.40 -0.39 0.74 -2.23 0.00 0.00 178.31 175.28 2elj h PHE 82 N -0.16 -1.10 -0.13 0.41 -1.00 -0.30 -2.39 116.94 112.27 2elj h PHE 82 Ca 0.23 0.04 0.04 0.00 2.81 0.00 0.00 57.97 61.09 2elj h PHE 82 Cb 0.56 0.49 -0.05 0.00 3.61 0.00 0.00 35.95 40.56 2elj h PHE 82 CO -0.70 -0.46 -0.20 1.96 -1.61 0.00 0.00 178.31 177.30 2elj h GLN 83 N -0.50 -0.25 -1.39 1.51 4.20 -0.95 -0.65 115.11 117.07 2elj h GLN 83 Ca 0.07 0.02 0.42 0.00 0.06 0.00 0.00 58.65 59.21 2elj h GLN 83 Cb 0.62 0.06 -0.09 0.00 0.30 0.00 0.00 27.48 28.36 2elj h GLN 83 CO -0.34 -0.17 0.95 0.66 -0.67 0.00 0.00 178.83 179.26 2elj h SER 84 N -0.26 0.16 -0.30 1.46 4.64 -0.17 1.63 113.55 120.71 2elj h SER 84 Ca 0.10 0.06 -0.11 0.00 -0.47 0.00 0.00 61.79 61.36 2elj h SER 84 Cb 0.40 0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 62.47 2elj h SER 84 CO -0.28 -0.05 0.15 0.00 -0.87 0.00 0.00 176.83 175.78 2elj n GLN 85 N -4.38 1.79 -3.47 4.77 1.13 -0.26 -4.85 117.38 112.12 2elj n GLN 85 Ca 0.34 -1.08 -0.26 0.00 -1.94 0.00 0.00 57.00 54.06 2elj n GLN 85 Cb 1.43 -1.55 -0.05 0.00 0.11 0.00 0.00 30.24 30.18 2elj n GLN 85 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2elj n ASN 86 N 0.03 -1.29 0.00 1.08 4.13 0.56 -4.73 115.26 115.04 2elj n ASN 86 Ca 0.17 -0.66 -0.15 0.00 1.68 0.00 0.00 54.58 55.62 2elj n ASN 86 Cb 0.79 -1.15 -0.14 0.00 -1.54 0.00 0.00 39.78 37.74 2elj n ASN 86 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 2elj h TRP 87 N -0.52 0.26 0.00 3.10 6.55 -1.65 -3.50 115.95 120.19 2elj h TRP 87 Ca -0.36 -0.19 0.00 0.00 0.95 0.00 0.00 58.89 59.29 2elj h TRP 87 Cb 1.02 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 29.31 2elj h TRP 87 CO 0.59 1.38 0.00 0.00 -1.05 0.00 0.00 178.44 179.36