#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 2.32 0.72 1.61 0.15 -1.26 -5.14 113.70 112.10 2elj s SER 2 Ca 0.00 -0.64 -0.15 0.00 0.70 0.00 0.00 55.95 55.86 2elj s SER 2 Cb 0.00 -0.12 0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2elj s SER 2 CO 0.00 -0.36 1.20 -0.94 1.20 0.00 0.00 173.24 174.34 2elj s SER 3 N 2.18 4.29 0.00 5.45 1.04 -1.26 -4.97 113.70 120.43 2elj s SER 3 Ca 0.04 2.33 0.00 0.00 0.48 0.00 0.00 55.95 58.81 2elj s SER 3 Cb -0.16 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.37 2elj s SER 3 CO -0.14 -2.20 0.00 0.61 0.98 0.00 0.00 173.24 172.49 2elj n GLY 4 N 0.34 4.22 2.63 7.32 0.00 -1.26 -5.12 105.19 113.31 2elj n GLY 4 Ca 0.13 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.97 2elj n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2elj s SER 5 N 0.00 2.92 -1.06 1.61 1.04 -1.26 -5.07 113.70 111.88 2elj s SER 5 Ca 0.00 -0.92 -0.12 0.00 0.48 0.00 0.00 55.95 55.39 2elj s SER 5 Cb 0.00 -0.41 0.23 0.00 0.10 0.00 0.00 66.02 65.94 2elj s SER 5 CO 0.00 -0.37 1.12 -0.44 0.98 0.00 0.00 173.24 174.53 2elj s SER 6 N 2.02 7.10 0.00 7.02 0.01 -1.26 -4.71 113.70 123.88 2elj s SER 6 Ca 0.04 -3.16 0.00 0.00 1.31 0.00 0.00 55.95 54.14 2elj s SER 6 Cb -0.16 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.80 2elj s SER 6 CO -0.17 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.58 2elj n GLY 7 N 3.50 -1.37 3.17 3.44 0.00 -1.26 -5.09 105.19 107.58 2elj n GLY 7 Ca 0.25 0.66 -0.39 0.00 0.00 0.00 0.00 46.02 46.54 2elj n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2elj s ASN 8 N 2.00 5.49 0.18 1.61 3.84 -1.26 -5.08 114.94 121.71 2elj s ASN 8 Ca 0.00 -1.92 0.07 0.00 0.21 0.00 0.00 52.86 51.22 2elj s ASN 8 Cb 0.00 -1.92 -0.04 0.00 -0.55 0.00 0.00 41.25 38.74 2elj s ASN 8 CO 0.00 -0.61 0.02 -0.04 -2.79 0.00 0.00 177.10 173.68 2elj s MET 9 N 1.27 2.47 0.27 0.43 -1.94 -1.26 -5.12 119.30 115.41 2elj s MET 9 Ca 0.06 -1.09 0.04 0.00 -1.71 0.00 0.00 55.69 52.99 2elj s MET 9 Cb -0.24 -2.39 -0.06 0.00 2.01 0.00 0.00 34.83 34.15 2elj s MET 9 CO -0.02 0.45 0.01 0.99 -0.01 0.00 0.00 175.02 176.44 2elj s THR 10 N -1.77 1.17 0.03 2.05 2.01 -1.26 -4.99 115.64 112.88 2elj s THR 10 Ca 0.28 -2.04 -0.26 0.00 0.31 0.00 0.00 61.69 59.98 2elj s THR 10 Cb -0.09 -2.50 -0.17 0.00 0.01 0.00 0.00 72.50 69.75 2elj s THR 10 CO 0.19 -0.22 1.44 0.40 -0.69 0.00 0.00 174.62 175.75 2elj h ILE 11 N 2.34 0.89 -0.97 1.82 5.03 -1.95 -2.84 117.51 121.83 2elj h ILE 11 Ca -0.39 -0.46 0.25 0.00 -0.12 0.00 0.00 64.86 64.13 2elj h ILE 11 Cb 1.23 1.16 -0.07 0.00 -3.03 0.00 0.00 36.82 36.12 2elj h ILE 11 CO 0.66 0.10 0.65 -1.28 -0.68 0.00 0.00 178.15 177.61 2elj h SER 12 N -0.49 0.30 -0.52 1.72 0.87 -1.97 0.18 113.55 113.64 2elj h SER 12 Ca -0.03 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 2elj h SER 12 Cb 0.37 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 2elj h SER 12 CO 0.04 0.09 0.21 0.44 -0.53 0.00 0.00 176.83 177.09 2elj h ASP 13 N 0.28 0.71 0.25 6.23 3.32 -1.87 -1.83 116.42 123.52 2elj h ASP 13 Ca 0.51 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 2elj h ASP 13 Cb 1.48 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2elj h ASP 13 CO -0.16 0.68 -0.12 0.40 -1.72 0.00 0.00 179.24 178.32 2elj h ILE 14 N 0.70 0.03 -0.01 0.35 2.04 -0.65 -3.23 117.51 116.74 2elj h ILE 14 Ca 0.17 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.27 2elj h ILE 14 Cb 0.19 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.31 2elj h ILE 14 CO -0.02 0.01 0.54 1.56 0.00 0.00 0.00 178.15 180.25 2elj h GLN 15 N -1.09 0.00 -1.94 2.37 4.20 -1.05 -0.17 115.11 117.43 2elj h GLN 15 Ca -0.03 0.00 -0.75 0.00 0.06 0.00 0.00 58.65 57.93 2elj h GLN 15 Cb 0.27 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 27.76 2elj h GLN 15 CO 0.06 0.00 0.83 1.58 -0.67 0.00 0.00 178.83 180.63 2elj n HIS 16 N -2.78 3.04 -4.35 2.96 -0.00 -0.69 -4.93 115.22 108.47 2elj n HIS 16 Ca -0.01 -2.43 -0.19 0.00 0.46 0.00 0.00 57.72 55.55 2elj n HIS 16 Cb 0.58 -1.04 -0.14 0.00 -0.12 0.00 0.00 29.99 29.26 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 -4.01 0.86 -0.44 1.57 0.00 -0.08 -4.94 121.76 114.71 2elj s ALA 17 Ca 0.51 -0.54 0.24 0.00 0.00 0.00 0.00 51.96 52.18 2elj s ALA 17 Cb 0.43 -0.17 1.01 0.00 0.00 0.00 0.00 23.12 24.39 2elj s ALA 17 CO -0.38 0.18 1.73 -0.35 0.00 0.00 0.00 175.76 176.93 2elj n PRO 18 N 2.50 0.21 -0.37 0.00 -0.04 -1.26 -2.15 135.00 133.89 2elj n PRO 18 Ca -0.15 0.44 0.07 0.00 -0.04 0.00 0.00 63.50 63.82 2elj n PRO 18 Cb 0.56 -1.90 0.23 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.29 3.63 -0.09 3.54 8.00 -1.26 -4.45 116.55 123.63 2elj n ASP 19 Ca 0.02 -2.57 -0.11 0.00 0.71 0.00 0.00 54.79 52.84 2elj n ASP 19 Cb 0.23 -0.43 -0.15 0.00 -0.02 0.00 0.00 41.12 40.75 2elj n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2elj n TYR 20 N 0.05 0.12 0.26 1.24 9.36 -0.92 -4.28 117.16 122.99 2elj n TYR 20 Ca 0.18 0.04 0.09 0.00 3.32 0.00 0.00 57.90 61.53 2elj n TYR 20 Cb 0.72 -1.02 0.67 0.00 -0.63 0.00 0.00 39.34 39.08 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 0.89 1.78 0.14 2.98 0.00 -1.78 -2.83 119.26 120.43 2elj h ALA 21 Ca -0.52 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.35 2elj h ALA 21 Cb 2.19 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.94 2elj h ALA 21 CO 0.02 0.07 -0.24 -0.07 0.00 0.00 0.00 179.25 179.04 2elj h LEU 22 N 0.00 -0.66 -9.06 0.00 3.38 -1.85 -3.43 115.31 103.69 2elj h LEU 22 Ca -0.00 0.07 -0.57 0.00 0.09 0.00 0.00 57.88 57.48 2elj h LEU 22 Cb 0.11 0.25 0.22 0.00 0.09 0.00 0.00 40.66 41.32 2elj h LEU 22 CO 0.01 -0.33 -1.51 0.18 0.09 0.00 0.00 178.44 176.88 2elj n LEU 23 N -5.36 -4.72 -4.99 1.67 4.77 -1.07 -4.97 117.00 102.33 2elj n LEU 23 Ca -0.07 0.36 -0.25 0.00 -0.03 0.00 0.00 56.01 56.03 2elj n LEU 23 Cb 0.27 -0.83 0.14 0.00 -2.33 0.00 0.00 43.42 40.67 2elj n LEU 23 CO 0.26 -5.41 0.63 -0.44 -1.33 0.00 0.00 177.39 171.10 2elj s SER 24 N -1.06 3.96 0.08 -1.43 0.01 -1.26 -4.82 113.70 109.17 2elj s SER 24 Ca 0.47 -0.40 -0.30 0.00 1.31 0.00 0.00 55.95 57.03 2elj s SER 24 Cb -0.29 0.19 -0.14 0.00 0.21 0.00 0.00 66.02 65.98 2elj s SER 24 CO 0.76 -2.14 1.48 -1.13 0.41 0.00 0.00 173.24 172.61 2elj h ASN 25 N -0.79 -1.29 0.63 2.44 -0.73 -1.96 -0.46 115.58 113.41 2elj h ASN 25 Ca -0.36 0.12 -0.02 0.00 1.87 0.00 0.00 56.30 57.91 2elj h ASN 25 Cb 1.25 0.45 -0.01 0.00 0.27 0.00 0.00 38.32 40.29 2elj h ASN 25 CO 0.36 -0.53 -0.46 0.44 -0.37 0.00 0.00 177.43 176.87 2elj h ASP 26 N -0.76 -1.19 -0.96 1.15 5.19 -2.01 -2.85 116.42 114.98 2elj h ASP 26 Ca -0.03 0.08 0.17 0.00 -0.62 0.00 0.00 57.03 56.63 2elj h ASP 26 Cb 0.71 0.37 -0.17 0.00 0.18 0.00 0.00 39.33 40.41 2elj h ASP 26 CO -0.15 -0.67 -0.31 -0.33 -3.12 0.00 0.00 179.24 174.66 2elj h GLU 27 N -1.05 -0.01 -0.60 3.56 5.08 -1.93 0.35 114.58 119.99 2elj h GLU 27 Ca -0.08 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.40 2elj h GLU 27 Cb 0.87 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.01 2elj h GLU 27 CO 0.04 -0.01 -0.16 1.96 -1.00 0.00 0.00 179.01 179.84 2elj h GLN 28 N -0.01 -0.01 -0.59 2.33 4.20 -0.85 -1.17 115.11 119.02 2elj h GLN 28 Ca 0.41 0.00 0.10 0.00 0.06 0.00 0.00 58.65 59.22 2elj h GLN 28 Cb 0.66 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.32 2elj h GLN 28 CO -0.98 -0.01 -0.34 1.96 -0.67 0.00 0.00 178.83 178.80 2elj h GLN 29 N -0.01 -0.16 0.10 1.46 1.08 -0.16 -1.62 115.11 115.81 2elj h GLN 29 Ca 0.29 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.50 2elj h GLN 29 Cb 0.44 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 2elj h GLN 29 CO -0.62 -0.11 -0.20 1.25 -0.95 0.00 0.00 178.83 178.21 2elj h LEU 30 N -0.16 -0.57 -0.88 1.46 5.85 -1.10 -0.01 115.31 119.90 2elj h LEU 30 Ca 0.23 0.05 0.18 0.00 0.84 0.00 0.00 57.88 59.19 2elj h LEU 30 Cb 0.55 0.20 -0.17 0.00 0.37 0.00 0.00 40.66 41.62 2elj h LEU 30 CO -0.68 -0.22 -0.18 0.00 -0.34 0.00 0.00 178.44 177.01 2elj h ILE 32 N 0.00 1.15 0.73 0.00 2.04 -0.83 1.80 117.51 122.39 2elj h ILE 32 Ca 0.44 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.87 2elj h ILE 32 Cb 0.71 0.73 0.01 0.00 -0.74 0.00 0.00 36.82 37.52 2elj h ILE 32 CO -0.89 0.15 -0.35 1.56 0.00 0.00 0.00 178.15 178.62 2elj h GLN 33 N 0.47 -0.94 0.00 2.37 4.20 0.28 -2.91 115.11 118.58 2elj h GLN 33 Ca 0.13 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2elj h GLN 33 Cb 0.07 0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.06 2elj h GLN 33 CO -0.02 -0.60 0.00 1.28 -0.67 0.00 0.00 178.83 178.82 2elj n LEU 34 N -5.45 0.55 -3.15 1.46 4.77 0.12 -4.90 117.00 110.40 2elj n LEU 34 Ca -0.13 0.61 -0.18 0.00 -0.03 0.00 0.00 56.01 56.28 2elj n LEU 34 Cb 0.40 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 41.06 2elj n LEU 34 CO 0.34 -0.39 0.16 0.29 -1.33 0.00 0.00 177.39 176.46 2elj n LYS 35 N -2.08 -6.41 -4.31 3.23 5.02 0.59 -5.01 118.16 109.18 2elj n LYS 35 Ca 0.03 0.73 -0.31 0.00 -2.02 0.00 0.00 58.31 56.74 2elj n LYS 35 Cb 0.27 -5.43 -0.10 0.00 -0.02 0.00 0.00 35.03 29.75 2elj n LYS 35 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2elj s ILE 36 N -3.29 3.65 0.61 -0.18 1.01 0.16 -4.78 121.20 118.39 2elj s ILE 36 Ca 0.28 -0.97 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 2elj s ILE 36 Cb -0.12 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.65 2elj s ILE 36 CO 0.63 0.25 1.03 -0.76 0.00 0.00 0.00 174.94 176.09 2elj s LEU 37 N -1.86 3.31 0.28 2.97 1.43 -1.26 -4.65 118.68 118.89 2elj s LEU 37 Ca 0.20 1.53 0.06 0.00 -1.03 0.00 0.00 54.13 54.89 2elj s LEU 37 Cb -0.11 -4.49 0.39 0.00 0.03 0.00 0.00 46.19 42.01 2elj s LEU 37 CO 0.12 -0.97 1.66 1.55 0.23 0.00 0.00 176.35 178.94 2elj h PRO 38 N -0.11 0.24 0.98 1.29 0.13 -1.94 -1.02 132.00 131.58 2elj h PRO 38 Ca -0.45 -0.13 -0.05 0.00 -0.87 0.00 0.00 66.00 64.51 2elj h PRO 38 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2elj h PRO 38 CO 0.60 0.66 -0.49 -0.22 -0.23 0.00 0.00 178.00 178.33 2elj h LYS 39 N 0.20 -1.29 -0.15 0.86 1.63 -1.94 0.16 116.57 116.05 2elj h LYS 39 Ca 0.01 0.09 -0.12 0.00 -0.85 0.00 0.00 60.65 59.78 2elj h LYS 39 Cb 0.90 0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 32.81 2elj h LYS 39 CO 0.07 -0.86 -0.45 -1.00 -3.45 0.00 0.00 179.45 173.77 2elj h PRO 40 N -1.33 0.36 -0.07 1.90 0.13 -1.97 -1.70 132.00 129.31 2elj h PRO 40 Ca -0.13 -0.19 -0.08 0.00 -0.87 0.00 0.00 66.00 64.72 2elj h PRO 40 Cb 1.03 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 2elj h PRO 40 CO 0.21 0.75 -0.34 -0.92 -0.23 0.00 0.00 178.00 177.47 2elj h TYR 41 N 0.30 0.15 0.00 1.56 5.03 -1.15 -2.78 116.97 120.08 2elj h TYR 41 Ca 0.02 -0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 2elj h TYR 41 Cb 0.91 -0.04 -0.00 0.00 1.55 0.00 0.00 36.73 39.15 2elj h TYR 41 CO 0.02 0.46 -0.12 -0.07 -1.32 0.00 0.00 178.16 177.13 2elj h LEU 42 N 0.12 0.00 -0.91 2.82 3.38 -0.81 -3.07 115.31 116.84 2elj h LEU 42 Ca 0.01 -0.27 0.23 0.00 0.09 0.00 0.00 57.88 57.95 2elj h LEU 42 Cb 0.66 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.25 2elj h LEU 42 CO 0.05 0.70 0.03 1.62 0.09 0.00 0.00 178.44 180.93 2elj h VAL 43 N -1.00 0.14 -0.10 1.22 3.04 -1.37 1.13 116.25 119.31 2elj h VAL 43 Ca -0.02 -0.02 -0.09 0.00 -1.01 0.00 0.00 66.70 65.56 2elj h VAL 43 Cb 0.37 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 29.72 2elj h VAL 43 CO -0.01 0.01 -0.36 0.17 -1.01 0.00 0.00 177.57 176.37 2elj h LEU 44 N 0.06 0.20 -1.03 3.16 8.10 -1.64 -2.79 115.31 121.36 2elj h LEU 44 Ca 0.53 -0.07 -0.07 0.00 0.11 0.00 0.00 57.88 58.38 2elj h LEU 44 Cb 1.04 -0.05 -0.02 0.00 -0.44 0.00 0.00 40.66 41.19 2elj h LEU 44 CO -0.83 0.55 -0.04 0.50 -4.11 0.00 0.00 178.44 174.50 2elj h LYS 45 N 0.17 0.64 -0.64 0.17 3.64 0.14 -2.80 116.57 117.88 2elj h LYS 45 Ca 0.02 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.20 2elj h LYS 45 Cb 0.71 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.43 2elj h LYS 45 CO 0.05 0.69 0.27 0.93 -2.27 0.00 0.00 179.45 179.12 2elj h GLU 46 N 0.60 0.95 0.00 1.90 3.07 -0.91 -2.78 114.58 117.41 2elj h GLU 46 Ca 0.12 -0.17 0.01 0.00 -0.50 0.00 0.00 59.36 58.82 2elj h GLU 46 Cb 0.44 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 2elj h GLU 46 CO 0.02 0.79 -0.03 0.28 -1.40 0.00 0.00 179.01 178.68 2elj h VAL 47 N 0.90 0.93 0.07 3.13 2.07 -1.47 -0.60 116.25 121.28 2elj h VAL 47 Ca 0.22 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.74 2elj h VAL 47 Cb 0.19 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2elj h VAL 47 CO -0.02 0.00 -0.26 0.24 0.02 0.00 0.00 177.57 177.55 2elj h MET 48 N -0.05 -0.37 -0.95 1.57 2.86 -1.39 0.86 114.93 117.46 2elj h MET 48 Ca 0.01 0.03 0.20 0.00 -2.06 0.00 0.00 59.70 57.88 2elj h MET 48 Cb 0.07 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 31.73 2elj h MET 48 CO -0.03 -0.25 0.61 0.74 1.06 0.00 0.00 176.91 179.05 2elj h PHE 49 N -0.38 0.72 0.00 -0.22 0.04 -1.49 0.56 116.94 116.16 2elj h PHE 49 Ca -0.01 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.73 2elj h PHE 49 Cb 0.38 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 2elj h PHE 49 CO -0.36 0.18 -0.25 0.00 -0.60 0.00 0.00 178.31 177.28 2elj h ARG 50 N 0.53 0.00 0.05 1.51 3.08 -0.15 -2.51 114.38 116.90 2elj h ARG 50 Ca 0.51 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.25 2elj h ARG 50 Cb 1.10 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.12 2elj h ARG 50 CO -0.25 0.25 -1.75 1.49 -1.07 0.00 0.00 179.97 178.64 2elj h GLU 51 N 0.00 0.11 0.00 0.04 4.57 0.23 -3.19 114.58 116.35 2elj h GLU 51 Ca -0.00 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 57.98 2elj h GLU 51 Cb 0.54 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 2elj h GLU 51 CO 0.03 0.81 0.00 -0.07 -1.18 0.00 0.00 179.01 178.60 2elj h LEU 52 N 0.03 0.00 0.09 1.64 3.38 -0.38 -1.26 115.31 118.81 2elj h LEU 52 Ca -0.31 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.29 2elj h LEU 52 Cb 2.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.73 2elj h LEU 52 CO 0.09 0.00 -2.06 0.00 0.09 0.00 0.00 178.44 176.56 2elj n LEU 53 N -2.36 2.64 0.18 1.67 -0.00 -0.96 -1.72 117.00 116.45 2elj n LEU 53 Ca 0.02 0.15 0.04 0.00 -0.00 0.00 0.00 56.01 56.22 2elj n LEU 53 Cb 0.22 -1.06 0.30 0.00 -0.00 0.00 0.00 43.42 42.88 2elj n LEU 53 CO 0.20 0.83 0.64 0.07 -0.00 0.00 0.00 177.39 179.13 2elj h LYS 54 N -0.05 0.00 0.00 1.47 2.10 -1.51 -3.12 116.57 115.46 2elj h LYS 54 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2elj h LYS 54 Cb 1.94 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.27 2elj h LYS 54 CO 0.02 0.42 -1.39 0.25 -2.00 0.00 0.00 179.45 176.75 2elj n THR 55 N -3.57 0.00 0.00 0.07 -2.24 -0.49 -4.99 114.28 103.05 2elj n THR 55 Ca -0.00 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2elj n THR 55 Cb 0.53 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 2elj n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2elj n GLY 56 N 1.43 2.00 0.00 3.38 0.00 -0.70 -4.05 105.19 107.25 2elj n GLY 56 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 0.00 2.70 -0.02 0.00 -1.18 -4.77 105.19 101.93 2elj n GLY 57 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2elj n GLY 57 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2elj n ASN 58 N 0.00 6.09 -4.38 1.61 3.02 -1.26 -4.97 115.26 115.37 2elj n ASN 58 Ca 0.00 -3.78 -0.41 0.00 -0.03 0.00 0.00 54.58 50.37 2elj n ASN 58 Cb 0.00 -0.76 -0.11 0.00 -0.61 0.00 0.00 39.78 38.30 2elj n ASN 58 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2elj s LEU 59 N -3.81 4.81 0.46 3.41 2.96 -1.26 -5.07 118.68 120.18 2elj s LEU 59 Ca 0.50 -1.01 0.01 0.00 -0.22 0.00 0.00 54.13 53.41 2elj s LEU 59 Cb 0.41 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 45.07 2elj s LEU 59 CO -0.30 -0.41 0.68 -0.44 -1.32 0.00 0.00 176.35 174.56 2elj s SER 60 N 1.59 5.70 0.16 3.68 0.01 -1.26 -4.93 113.70 118.66 2elj s SER 60 Ca 0.02 0.14 -0.15 0.00 1.31 0.00 0.00 55.95 57.27 2elj s SER 60 Cb -0.19 -1.31 0.10 0.00 0.21 0.00 0.00 66.02 64.83 2elj s SER 60 CO 0.07 -0.79 1.74 0.50 0.41 0.00 0.00 173.24 175.17 2elj h LYS 61 N 0.37 0.25 0.55 12.44 3.64 -1.99 0.36 116.57 132.18 2elj h LYS 61 Ca -0.45 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.89 2elj h LYS 61 Cb 1.26 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 33.03 2elj h LYS 61 CO 0.55 0.16 -0.26 0.77 -2.27 0.00 0.00 179.45 178.40 2elj h SER 62 N 0.25 -0.62 -0.89 4.20 0.02 -2.00 -0.92 113.55 113.60 2elj h SER 62 Ca 0.19 0.02 0.14 0.00 -0.84 0.00 0.00 61.79 61.29 2elj h SER 62 Cb 0.20 0.16 -0.07 0.00 0.14 0.00 0.00 62.40 62.83 2elj h SER 62 CO -0.22 -0.44 0.57 0.00 -1.14 0.00 0.00 176.83 175.60 2elj h ALA 63 N -0.27 1.81 0.63 3.77 0.00 -1.90 -2.39 119.26 120.91 2elj h ALA 63 Ca -0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2elj h ALA 63 Cb 0.56 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2elj h ALA 63 CO 0.12 -0.04 -0.31 0.00 0.00 0.00 0.00 179.25 179.03 2elj h ARG 65 N -1.12 0.27 -0.00 0.00 3.08 -0.79 0.16 114.38 115.96 2elj h ARG 65 Ca -0.09 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 59.90 2elj h ARG 65 Cb 0.69 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2elj h ARG 65 CO 0.14 0.18 -0.18 0.93 -1.07 0.00 0.00 179.97 179.97 2elj h GLU 66 N 0.27 0.12 -0.50 0.04 4.39 -1.37 0.14 114.58 117.68 2elj h GLU 66 Ca 0.67 -0.13 0.15 0.00 0.34 0.00 0.00 59.36 60.39 2elj h GLU 66 Cb 1.49 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 30.16 2elj h GLU 66 CO -0.63 0.89 0.43 1.25 -1.16 0.00 0.00 179.01 179.78 2elj h LEU 67 N -0.59 0.00 0.00 1.33 5.85 0.15 -0.11 115.31 121.94 2elj h LEU 67 Ca -0.02 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.37 2elj h LEU 67 Cb 0.95 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.92 2elj h LEU 67 CO 0.04 0.00 -2.04 0.18 -0.34 0.00 0.00 178.44 176.27 2elj n LEU 68 N -4.04 0.45 -2.26 2.25 4.77 0.35 -4.98 117.00 113.54 2elj n LEU 68 Ca 0.09 0.21 -0.21 0.00 -0.03 0.00 0.00 56.01 56.08 2elj n LEU 68 Cb 0.64 0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 42.04 2elj n LEU 68 CO 0.32 0.44 -0.26 0.59 -1.33 0.00 0.00 177.39 177.16 2elj n ASN 69 N -2.90 -5.85 -3.85 -1.43 4.13 0.03 -4.98 115.26 100.42 2elj n ASN 69 Ca -0.25 0.08 -0.16 0.00 1.68 0.00 0.00 54.58 55.93 2elj n ASN 69 Cb 1.11 -4.92 0.01 0.00 -1.54 0.00 0.00 39.78 34.44 2elj n ASN 69 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 2elj n ILE 70 N -3.73 0.00 -1.61 2.41 -5.35 -1.23 -5.06 119.36 104.79 2elj n ILE 70 Ca -0.24 -1.36 -0.40 0.00 -0.27 0.00 0.00 62.75 60.47 2elj n ILE 70 Cb 0.69 -0.34 0.02 0.00 -1.74 0.00 0.00 39.64 38.27 2elj n ILE 70 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2elj n ASP 71 N -2.09 1.09 0.21 7.28 9.92 -1.26 -4.87 116.55 126.83 2elj n ASP 71 Ca 0.02 0.97 0.08 0.00 -0.53 0.00 0.00 54.79 55.33 2elj n ASP 71 Cb 0.40 -1.36 0.45 0.00 -0.64 0.00 0.00 41.12 39.97 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 1.28 0.00 0.12 -0.24 0.13 -1.98 -2.19 132.00 129.12 2elj h PRO 72 Ca -0.46 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.36 2elj h PRO 72 Cb 1.34 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 2elj h PRO 72 CO 0.55 0.29 -1.62 0.82 -0.23 0.00 0.00 178.00 177.81 2elj h ILE 73 N 0.00 1.05 -0.11 -3.56 2.04 -2.01 -3.24 117.51 111.68 2elj h ILE 73 Ca -0.00 -2.70 -0.12 0.00 1.00 0.00 0.00 64.86 63.03 2elj h ILE 73 Cb 0.71 2.71 -0.01 0.00 -0.74 0.00 0.00 36.82 39.50 2elj h ILE 73 CO 0.04 0.81 -0.47 0.11 0.00 0.00 0.00 178.15 178.64 2elj h LYS 74 N 0.07 0.28 0.22 2.37 6.56 -1.91 -3.04 116.57 121.11 2elj h LYS 74 Ca -0.28 -0.15 -0.01 0.00 -1.06 0.00 0.00 60.65 59.15 2elj h LYS 74 Cb 2.03 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 33.70 2elj h LYS 74 CO 0.15 0.70 -0.11 0.00 -2.06 0.00 0.00 179.45 178.13 2elj h ALA 75 N 1.28 -0.30 -0.71 3.86 0.00 -1.52 -0.67 119.26 121.21 2elj h ALA 75 Ca 0.01 -0.17 0.19 0.00 0.00 0.00 0.00 54.91 54.94 2elj h ALA 75 Cb 0.92 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2elj h ALA 75 CO 0.07 -0.51 0.50 -2.95 0.00 0.00 0.00 179.25 176.36 2elj h ASN 76 N -0.60 0.11 0.13 0.00 7.08 -1.58 0.21 115.58 120.93 2elj h ASN 76 Ca -0.03 0.01 -0.01 0.00 -3.08 0.00 0.00 56.30 53.19 2elj h ASN 76 Cb 0.44 -0.01 0.00 0.00 -2.08 0.00 0.00 38.32 36.67 2elj h ASN 76 CO 0.05 0.05 -0.06 -0.09 -2.08 0.00 0.00 177.43 175.30 2elj h ARG 77 N 0.11 -0.17 -0.69 4.14 9.65 -1.40 -3.18 114.38 122.84 2elj h ARG 77 Ca 0.34 0.01 0.11 0.00 -1.10 0.00 0.00 59.98 59.34 2elj h ARG 77 Cb 1.19 0.04 -0.08 0.00 -1.39 0.00 0.00 29.97 29.73 2elj h ARG 77 CO -0.04 -0.05 0.30 0.82 2.80 0.00 0.00 179.97 183.80 2elj h ILE 78 N -1.04 0.77 -0.73 1.20 2.04 -0.72 -1.21 117.51 117.82 2elj h ILE 78 Ca -0.02 -0.17 0.13 0.00 1.00 0.00 0.00 64.86 65.80 2elj h ILE 78 Cb 0.20 0.23 -0.09 0.00 -0.74 0.00 0.00 36.82 36.42 2elj h ILE 78 CO 0.03 0.09 0.30 0.22 0.00 0.00 0.00 178.15 178.79 2elj h TYR 79 N 0.50 0.52 -0.55 1.37 5.03 -0.73 0.08 116.97 123.18 2elj h TYR 79 Ca 0.36 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.65 2elj h TYR 79 Cb 0.45 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.59 2elj h TYR 79 CO -0.14 0.09 0.13 0.22 -1.32 0.00 0.00 178.16 177.14 2elj h ASP 80 N 0.47 0.80 -0.03 -2.11 3.58 -1.22 -2.22 116.42 115.68 2elj h ASP 80 Ca 0.39 -0.15 0.01 0.00 0.42 0.00 0.00 57.03 57.70 2elj h ASP 80 Cb 0.56 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 2elj h ASP 80 CO -0.37 0.78 0.02 0.15 -2.88 0.00 0.00 179.24 176.94 2elj h PHE 81 N 0.82 0.01 -0.00 0.28 3.57 -0.47 0.13 116.94 121.28 2elj h PHE 81 Ca 0.18 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.46 2elj h PHE 81 Cb 0.31 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2elj h PHE 81 CO 0.02 0.00 -0.92 0.74 -2.23 0.00 0.00 178.31 175.93 2elj h PHE 82 N 0.01 0.54 0.00 0.41 -1.00 -0.98 -3.22 116.94 112.69 2elj h PHE 82 Ca 0.01 -0.29 -0.17 0.00 2.81 0.00 0.00 57.97 60.33 2elj h PHE 82 Cb 0.04 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.52 2elj h PHE 82 CO -0.00 1.10 -0.83 1.96 -1.61 0.00 0.00 178.31 178.93 2elj h GLN 83 N 0.21 0.00 -0.47 1.51 4.20 -1.09 -1.52 115.11 117.94 2elj h GLN 83 Ca -0.07 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.65 2elj h GLN 83 Cb 1.55 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.30 2elj h GLN 83 CO 0.15 0.83 0.30 0.77 -0.67 0.00 0.00 178.83 180.21 2elj h SER 84 N 0.00 0.51 -0.30 1.46 0.02 -0.80 -1.41 113.55 113.02 2elj h SER 84 Ca -0.01 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 2elj h SER 84 Cb 1.57 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.98 2elj h SER 84 CO 0.11 0.36 0.03 0.00 -1.14 0.00 0.00 176.83 176.19 2elj n GLN 85 N -4.78 2.84 -2.63 3.45 1.13 -1.22 -4.87 117.38 111.30 2elj n GLN 85 Ca 0.02 -1.56 -0.06 0.00 -1.94 0.00 0.00 57.00 53.46 2elj n GLN 85 Cb 0.04 -1.86 -0.01 0.00 0.11 0.00 0.00 30.24 28.52 2elj n GLN 85 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2elj n ASN 86 N 0.26 -1.86 0.11 1.08 5.15 -0.53 -4.76 115.26 114.71 2elj n ASN 86 Ca 0.15 0.30 -0.03 0.00 -0.60 0.00 0.00 54.58 54.40 2elj n ASN 86 Cb 0.75 -1.68 0.15 0.00 -0.53 0.00 0.00 39.78 38.47 2elj n ASN 86 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 2elj h TRP 87 N -0.09 0.15 -0.02 1.20 6.55 -1.52 -3.49 115.95 118.74 2elj h TRP 87 Ca -0.12 -0.06 0.00 0.00 0.95 0.00 0.00 58.89 59.66 2elj h TRP 87 Cb 1.08 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 29.36 2elj h TRP 87 CO 0.83 0.69 0.00 0.00 -1.05 0.00 0.00 178.44 178.91