#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2elj n SER 2 N 0.00 0.62 -4.88 1.61 7.64 -1.26 -4.88 113.62 112.47 2elj n SER 2 Ca 0.00 0.54 -0.31 0.00 1.01 0.00 0.00 58.87 60.11 2elj n SER 2 Cb 0.00 -0.91 -0.05 0.00 -1.01 0.00 0.00 64.21 62.25 2elj n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2elj s SER 3 N 6.85 6.56 0.59 6.43 0.15 -1.26 -4.93 113.70 128.09 2elj s SER 3 Ca 1.24 0.85 0.00 0.00 0.70 0.00 0.00 55.95 58.75 2elj s SER 3 Cb -1.43 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 60.68 2elj s SER 3 CO 0.61 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.54 2elj n GLY 4 N -0.41 -4.13 3.04 9.45 0.00 -1.26 -4.82 105.19 107.06 2elj n GLY 4 Ca -0.00 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 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 -5.29 5.09 0.19 1.61 0.15 -1.26 -5.08 113.70 109.11 2elj s SER 5 Ca 0.00 -3.20 -0.32 0.00 0.70 0.00 0.00 55.95 53.13 2elj s SER 5 Cb 0.00 -1.78 -0.15 0.00 -1.71 0.00 0.00 66.02 62.38 2elj s SER 5 CO 0.00 -0.26 1.24 -0.24 1.20 0.00 0.00 173.24 175.18 2elj n SER 6 N 2.97 1.76 0.00 5.45 2.88 -1.26 -4.93 113.62 120.48 2elj n SER 6 Ca 0.11 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 2elj n SER 6 Cb 0.36 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.54 2elj n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2elj n GLY 7 N 2.07 0.99 3.89 0.46 0.00 -1.26 -4.99 105.19 106.34 2elj n GLY 7 Ca 0.14 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2elj n GLY 7 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2elj n ASN 8 N 0.00 -4.16 -4.32 1.61 4.13 -1.26 -4.94 115.26 106.32 2elj n ASN 8 Ca 0.00 -0.79 -0.39 0.00 1.68 0.00 0.00 54.58 55.08 2elj n ASN 8 Cb 0.00 -3.89 -0.12 0.00 -1.54 0.00 0.00 39.78 34.24 2elj n ASN 8 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 2elj s MET 9 N -6.53 2.72 0.29 3.52 1.75 -1.26 -4.94 119.30 114.85 2elj s MET 9 Ca 0.55 -1.12 -0.10 0.00 -1.25 0.00 0.00 55.69 53.77 2elj s MET 9 Cb -0.28 -3.56 0.00 0.00 2.84 0.00 0.00 34.83 33.84 2elj s MET 9 CO 0.83 -0.67 0.51 0.95 -0.65 0.00 0.00 175.02 175.99 2elj s THR 10 N 1.46 0.00 0.12 10.11 -4.23 -1.26 -5.06 115.64 116.79 2elj s THR 10 Ca -0.00 -1.42 -0.22 0.00 -1.18 0.00 0.00 61.69 58.87 2elj s THR 10 Cb -0.19 -2.40 -0.05 0.00 1.34 0.00 0.00 72.50 71.21 2elj s THR 10 CO 0.04 0.00 1.69 0.40 -0.54 0.00 0.00 174.62 176.21 2elj h ILE 11 N 2.19 0.71 -1.59 2.99 2.04 -1.93 -1.33 117.51 120.58 2elj h ILE 11 Ca -0.27 0.00 0.47 0.00 1.00 0.00 0.00 64.86 66.06 2elj h ILE 11 Cb 1.25 0.71 -0.08 0.00 -0.74 0.00 0.00 36.82 37.95 2elj h ILE 11 CO 0.37 0.00 1.12 -1.28 0.00 0.00 0.00 178.15 178.36 2elj h SER 12 N -0.13 0.07 0.31 1.72 0.87 -2.00 -0.05 113.55 114.34 2elj h SER 12 Ca 0.08 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 2elj h SER 12 Cb 0.24 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2elj h SER 12 CO -0.18 -0.04 -0.15 -0.78 -0.53 0.00 0.00 176.83 175.15 2elj h ASP 13 N 0.03 -0.35 -0.90 6.23 3.58 -1.61 -1.92 116.42 121.47 2elj h ASP 13 Ca 0.80 0.01 0.11 0.00 0.42 0.00 0.00 57.03 58.37 2elj h ASP 13 Cb 3.03 0.09 -0.13 0.00 1.72 0.00 0.00 39.33 44.04 2elj h ASP 13 CO -0.11 0.02 -0.49 0.40 -2.88 0.00 0.00 179.24 176.17 2elj h ILE 14 N -0.95 0.01 0.03 2.25 2.04 -0.90 0.11 117.51 120.09 2elj h ILE 14 Ca -0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.82 2elj h ILE 14 Cb 0.32 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 2elj h ILE 14 CO 0.07 0.00 -0.04 1.56 0.00 0.00 0.00 178.15 179.74 2elj h GLN 15 N -0.05 -0.08 -0.77 2.37 4.20 -1.55 -2.72 115.11 116.51 2elj h GLN 15 Ca 0.23 0.01 0.18 0.00 0.06 0.00 0.00 58.65 59.12 2elj h GLN 15 Cb 0.51 0.02 -0.13 0.00 0.30 0.00 0.00 27.48 28.18 2elj h GLN 15 CO -0.90 -0.05 0.11 1.25 -0.67 0.00 0.00 178.83 178.57 2elj h HIS 16 N -0.08 0.14 -1.49 2.96 2.76 -0.13 -3.43 115.15 115.88 2elj h HIS 16 Ca 0.01 0.05 -0.64 0.00 -2.20 0.00 0.00 60.37 57.58 2elj h HIS 16 Cb 0.08 0.06 0.13 0.00 1.55 0.00 0.00 27.41 29.23 2elj h HIS 16 CO -0.10 -0.18 -0.56 0.00 -1.30 0.00 0.00 177.93 175.79 2elj n ALA 17 N -2.80 -2.48 0.00 5.26 0.00 0.16 -4.90 120.51 115.75 2elj n ALA 17 Ca 0.15 0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.78 2elj n ALA 17 Cb 0.51 -1.63 -0.10 0.00 0.00 0.00 0.00 19.45 18.23 2elj n ALA 17 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2elj h PRO 18 N 0.89 -0.04 -0.49 0.00 0.13 -1.87 -3.20 132.00 127.42 2elj h PRO 18 Ca -0.33 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.82 2elj h PRO 18 Cb 1.43 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.54 2elj h PRO 18 CO 0.54 0.43 0.32 -0.44 -0.23 0.00 0.00 178.00 178.62 2elj h ASP 19 N -0.53 0.51 -0.98 1.44 3.32 -1.94 -2.88 116.42 115.36 2elj h ASP 19 Ca -0.00 -0.01 0.16 0.00 0.02 0.00 0.00 57.03 57.20 2elj h ASP 19 Cb 0.49 -0.12 -0.17 0.00 0.22 0.00 0.00 39.33 39.75 2elj h ASP 19 CO 0.01 0.36 -0.34 0.00 -1.72 0.00 0.00 179.24 177.54 2elj n TYR 20 N -4.47 0.12 -0.32 4.55 9.36 -1.21 0.56 117.16 125.75 2elj n TYR 20 Ca 0.05 1.21 0.12 0.00 3.32 0.00 0.00 57.90 62.60 2elj n TYR 20 Cb 0.11 -0.92 0.26 0.00 -0.63 0.00 0.00 39.34 38.16 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 1.53 1.11 -0.89 2.98 0.00 -1.66 0.32 119.26 122.66 2elj h ALA 21 Ca 0.38 0.30 0.23 0.00 0.00 0.00 0.00 54.91 55.82 2elj h ALA 21 Cb 0.62 0.52 -0.16 0.00 0.00 0.00 0.00 17.79 18.78 2elj h ALA 21 CO -0.98 -0.53 0.06 -0.07 0.00 0.00 0.00 179.25 177.73 2elj h LEU 22 N 0.06 -0.34 -9.06 0.00 3.38 -0.08 -3.42 115.31 105.86 2elj h LEU 22 Ca 0.56 0.23 -0.64 0.00 0.09 0.00 0.00 57.88 58.12 2elj h LEU 22 Cb 1.11 0.39 0.14 0.00 0.09 0.00 0.00 40.66 42.39 2elj h LEU 22 CO -0.83 -0.25 -0.68 0.18 0.09 0.00 0.00 178.44 176.94 2elj n LEU 23 N -5.38 -1.74 -4.87 1.67 4.77 0.11 -4.92 117.00 106.63 2elj n LEU 23 Ca 0.19 0.96 -0.31 0.00 -0.03 0.00 0.00 56.01 56.83 2elj n LEU 23 Cb 0.64 -0.95 0.01 0.00 -2.33 0.00 0.00 43.42 40.79 2elj n LEU 23 CO -0.00 -3.47 0.69 -0.44 -1.33 0.00 0.00 177.39 172.84 2elj s SER 24 N -0.98 6.24 0.26 -1.43 0.01 -1.26 -4.67 113.70 111.87 2elj s SER 24 Ca 0.62 1.37 0.09 0.00 1.31 0.00 0.00 55.95 59.34 2elj s SER 24 Cb -0.75 -2.45 0.81 0.00 0.21 0.00 0.00 66.02 63.85 2elj s SER 24 CO 0.59 -0.84 1.19 -0.46 0.41 0.00 0.00 173.24 174.14 2elj n ASN 25 N -2.68 0.10 0.08 2.44 0.23 -1.26 -0.79 115.26 113.38 2elj n ASN 25 Ca 0.05 1.27 -0.04 0.00 -0.53 0.00 0.00 54.58 55.34 2elj n ASN 25 Cb 0.54 -0.55 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 2elj n ASN 25 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2elj h ASP 26 N 0.00 -0.20 -0.87 0.53 3.32 -2.01 -3.21 116.42 113.98 2elj h ASP 26 Ca 0.56 0.01 0.28 0.00 0.02 0.00 0.00 57.03 57.90 2elj h ASP 26 Cb 1.35 0.05 -0.16 0.00 0.22 0.00 0.00 39.33 40.79 2elj h ASP 26 CO -0.64 0.01 0.18 -0.62 -1.72 0.00 0.00 179.24 176.45 2elj n GLU 27 N -3.54 -0.06 -0.11 3.56 1.02 -0.01 0.14 120.64 121.63 2elj n GLU 27 Ca -0.03 1.26 -0.06 0.00 -0.02 0.00 0.00 57.16 58.32 2elj n GLU 27 Cb 0.10 -2.09 0.02 0.00 -0.02 0.00 0.00 31.44 29.44 2elj n GLU 27 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2elj h GLN 28 N 0.00 0.16 0.24 3.49 4.20 -1.04 -2.02 115.11 120.14 2elj h GLN 28 Ca 0.60 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.30 2elj h GLN 28 Cb 1.39 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.12 2elj h GLN 28 CO -0.76 0.11 -0.27 1.96 -0.67 0.00 0.00 178.83 179.19 2elj h GLN 29 N 0.17 -0.50 -0.31 1.46 1.08 0.12 -2.43 115.11 114.70 2elj h GLN 29 Ca 0.17 0.03 0.03 0.00 -1.45 0.00 0.00 58.65 57.44 2elj h GLN 29 Cb 0.21 0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.71 2elj h GLN 29 CO -0.24 -0.33 -0.26 1.25 -0.95 0.00 0.00 178.83 178.29 2elj h LEU 30 N -0.52 -0.91 -0.88 1.46 5.85 -1.39 0.18 115.31 119.11 2elj h LEU 30 Ca -0.03 0.13 0.28 0.00 0.84 0.00 0.00 57.88 59.10 2elj h LEU 30 Cb 0.46 0.39 -0.16 0.00 0.37 0.00 0.00 40.66 41.71 2elj h LEU 30 CO -0.05 -0.15 0.16 0.00 -0.34 0.00 0.00 178.44 178.06 2elj h ILE 32 N 0.00 1.28 0.23 0.00 2.04 -0.23 0.49 117.51 121.31 2elj h ILE 32 Ca 0.60 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 2elj h ILE 32 Cb 1.36 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 2elj h ILE 32 CO -0.78 0.48 -0.11 1.56 0.00 0.00 0.00 178.15 179.30 2elj h GLN 33 N 0.70 -0.29 -0.49 2.37 1.08 0.48 -3.07 115.11 115.88 2elj h GLN 33 Ca 0.08 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2elj h GLN 33 Cb 0.83 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.33 2elj h GLN 33 CO 0.07 0.06 0.00 1.28 -0.95 0.00 0.00 178.83 179.29 2elj n LEU 34 N -5.05 2.06 -4.41 1.46 4.77 0.87 -4.90 117.00 111.80 2elj n LEU 34 Ca -0.09 -1.03 -0.36 0.00 -0.03 0.00 0.00 56.01 54.49 2elj n LEU 34 Cb 0.25 -0.33 -0.09 0.00 -2.33 0.00 0.00 43.42 40.92 2elj n LEU 34 CO 0.30 0.40 -0.33 0.29 -1.33 0.00 0.00 177.39 176.72 2elj n LYS 35 N 0.33 -0.83 -4.14 3.23 4.01 0.13 -4.91 118.16 115.98 2elj n LYS 35 Ca 0.10 0.11 -0.33 0.00 -0.51 0.00 0.00 58.31 57.69 2elj n LYS 35 Cb 0.39 -4.09 -0.07 0.00 -0.51 0.00 0.00 35.03 30.74 2elj n LYS 35 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2elj s ILE 36 N -3.84 4.59 0.45 -0.18 1.01 0.96 -4.96 121.20 119.24 2elj s ILE 36 Ca 0.40 -0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.44 2elj s ILE 36 Cb -0.23 -3.09 -0.08 0.00 0.01 0.00 0.00 42.46 39.07 2elj s ILE 36 CO 1.01 0.36 0.90 -0.76 0.00 0.00 0.00 174.94 176.44 2elj s LEU 37 N -1.69 3.78 0.21 2.97 1.43 -1.26 -4.59 118.68 119.52 2elj s LEU 37 Ca 0.22 1.45 -0.03 0.00 -1.03 0.00 0.00 54.13 54.75 2elj s LEU 37 Cb -0.12 -4.35 0.17 0.00 0.03 0.00 0.00 46.19 41.93 2elj s LEU 37 CO 0.13 -0.46 1.57 1.55 0.23 0.00 0.00 176.35 179.37 2elj h PRO 38 N 1.32 0.60 0.50 1.29 0.13 -1.96 -0.92 132.00 132.97 2elj h PRO 38 Ca -0.47 -0.32 -0.01 0.00 -0.87 0.00 0.00 66.00 64.32 2elj h PRO 38 Cb 1.18 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2elj h PRO 38 CO 0.62 0.91 -0.43 -0.22 -0.23 0.00 0.00 178.00 178.66 2elj h LYS 39 N 0.49 -0.89 -0.27 0.86 3.64 -1.96 -0.23 116.57 118.22 2elj h LYS 39 Ca 0.04 0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.37 2elj h LYS 39 Cb 0.94 0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2elj h LYS 39 CO 0.08 -0.59 -0.26 -1.00 -2.27 0.00 0.00 179.45 175.41 2elj h PRO 40 N -0.92 0.65 -0.61 1.90 0.13 -1.98 -3.16 132.00 128.01 2elj h PRO 40 Ca -0.05 -0.34 0.08 0.00 -0.87 0.00 0.00 66.00 64.81 2elj h PRO 40 Cb 0.79 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.87 2elj h PRO 40 CO -0.02 0.95 0.27 -0.92 -0.23 0.00 0.00 178.00 178.04 2elj h TYR 41 N 0.38 0.48 -0.95 1.56 3.20 -1.12 -1.34 116.97 119.17 2elj h TYR 41 Ca 0.04 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.00 2elj h TYR 41 Cb 0.83 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.91 2elj h TYR 41 CO 0.07 0.17 0.61 -0.07 -1.64 0.00 0.00 178.16 177.30 2elj h LEU 42 N 0.48 0.98 0.19 2.82 3.38 -1.04 -0.05 115.31 122.07 2elj h LEU 42 Ca 0.30 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.29 2elj h LEU 42 Cb 0.31 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2elj h LEU 42 CO -0.26 0.64 -0.34 0.58 0.09 0.00 0.00 178.44 179.15 2elj h VAL 43 N 1.12 0.29 0.00 1.22 2.07 -1.21 -0.82 116.25 118.92 2elj h VAL 43 Ca 0.40 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.90 2elj h VAL 43 Cb 0.12 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2elj h VAL 43 CO -0.16 0.00 -0.12 0.17 0.02 0.00 0.00 177.57 177.48 2elj h LEU 44 N -0.61 0.00 -0.12 2.57 8.10 -1.25 -2.83 115.31 121.18 2elj h LEU 44 Ca 0.01 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.98 2elj h LEU 44 Cb 0.61 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.83 2elj h LEU 44 CO -0.15 0.12 -0.03 0.50 -4.11 0.00 0.00 178.44 174.77 2elj h LYS 45 N 0.00 0.22 -0.33 0.17 3.64 0.10 -2.81 116.57 117.57 2elj h LYS 45 Ca -0.00 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2elj h LYS 45 Cb 0.45 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2elj h LYS 45 CO 0.02 0.52 0.11 1.49 -2.27 0.00 0.00 179.45 179.32 2elj h GLU 46 N -0.09 0.51 -0.46 1.90 4.57 -1.02 -2.98 114.58 117.02 2elj h GLU 46 Ca 0.03 -0.11 0.09 0.00 -1.18 0.00 0.00 59.36 58.20 2elj h GLU 46 Cb 0.44 -0.08 -0.09 0.00 -0.16 0.00 0.00 28.75 28.86 2elj h GLU 46 CO 0.01 0.54 -0.16 0.28 -1.18 0.00 0.00 179.01 178.50 2elj h VAL 47 N 0.38 0.47 -0.95 0.32 2.07 -1.51 0.22 116.25 117.24 2elj h VAL 47 Ca 0.11 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.74 2elj h VAL 47 Cb 0.23 0.47 -0.07 0.00 -1.52 0.00 0.00 31.29 30.39 2elj h VAL 47 CO -0.00 0.00 0.61 0.24 0.02 0.00 0.00 177.57 178.43 2elj h MET 48 N -0.05 0.91 -0.20 1.57 2.86 -1.40 -0.91 114.93 117.71 2elj h MET 48 Ca 0.22 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.70 2elj h MET 48 Cb 0.39 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 2elj h MET 48 CO -0.50 0.60 -0.28 0.74 1.06 0.00 0.00 176.91 178.54 2elj h PHE 49 N 0.94 0.66 -0.32 -0.22 0.04 -0.80 0.16 116.94 117.39 2elj h PHE 49 Ca 0.46 -0.22 0.02 0.00 2.80 0.00 0.00 57.97 61.03 2elj h PHE 49 Cb 0.47 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 2elj h PHE 49 CO -0.00 0.93 0.22 -0.09 -0.60 0.00 0.00 178.31 178.76 2elj h ARG 50 N 0.21 0.37 0.17 1.51 2.43 0.14 -2.06 114.38 117.15 2elj h ARG 50 Ca 0.02 -0.02 -0.32 0.00 -0.81 0.00 0.00 59.98 58.85 2elj h ARG 50 Cb 0.85 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.32 2elj h ARG 50 CO 0.06 0.24 -1.58 1.49 -1.51 0.00 0.00 179.97 178.68 2elj h GLU 51 N 0.38 0.35 -0.76 0.20 4.57 -1.11 -3.05 114.58 115.16 2elj h GLU 51 Ca 0.13 -0.60 0.15 0.00 -1.18 0.00 0.00 59.36 57.85 2elj h GLU 51 Cb 0.04 0.22 -0.05 0.00 -0.16 0.00 0.00 28.75 28.81 2elj h GLU 51 CO -0.03 1.29 0.51 -0.07 -1.18 0.00 0.00 179.01 179.53 2elj h LEU 52 N -0.05 0.40 0.22 1.64 3.38 -0.33 0.19 115.31 120.77 2elj h LEU 52 Ca -0.32 0.02 -0.29 0.00 0.09 0.00 0.00 57.88 57.39 2elj h LEU 52 Cb 1.97 -0.06 0.03 0.00 0.09 0.00 0.00 40.66 42.70 2elj h LEU 52 CO 0.14 0.21 -1.26 0.17 0.09 0.00 0.00 178.44 177.79 2elj h LEU 53 N 0.43 0.72 -0.76 1.67 8.10 -1.50 -0.87 115.31 123.10 2elj h LEU 53 Ca 0.38 -0.93 -0.03 0.00 0.11 0.00 0.00 57.88 57.41 2elj h LEU 53 Cb 0.85 -0.24 -0.03 0.00 -0.44 0.00 0.00 40.66 40.80 2elj h LEU 53 CO -0.12 1.61 0.37 0.50 -4.11 0.00 0.00 178.44 176.69 2elj h LYS 54 N -0.03 1.10 0.00 0.17 3.64 -1.17 -2.62 116.57 117.66 2elj h LYS 54 Ca -0.22 -0.16 -0.12 0.00 -1.27 0.00 0.00 60.65 58.88 2elj h LYS 54 Cb 1.99 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 33.60 2elj h LYS 54 CO 0.23 0.85 -0.62 1.79 -2.27 0.00 0.00 179.45 179.43 2elj h THR 55 N 1.07 0.89 0.00 1.00 1.35 -0.77 -3.48 112.91 112.98 2elj h THR 55 Ca 0.26 -2.28 0.00 0.00 -0.55 0.00 0.00 66.41 63.84 2elj h THR 55 Cb 0.11 2.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 2elj h THR 55 CO -0.03 0.51 0.00 0.61 -0.25 0.00 0.00 175.52 176.35 2elj n GLY 56 N 1.25 2.96 0.00 5.82 0.00 -0.54 -4.43 105.19 110.24 2elj n GLY 56 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.08 0.69 2.79 -0.02 0.00 -0.44 -4.86 105.19 102.27 2elj n GLY 57 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2elj n GLY 57 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2elj n ASN 58 N 0.00 5.26 -4.44 1.61 6.94 -1.26 -5.02 115.26 118.34 2elj n ASN 58 Ca 0.00 -3.64 -0.35 0.00 -0.02 0.00 0.00 54.58 50.58 2elj n ASN 58 Cb 0.00 -0.78 -0.13 0.00 -2.36 0.00 0.00 39.78 36.51 2elj n ASN 58 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2elj s LEU 59 N -3.51 3.21 0.52 -4.53 2.96 -1.26 -5.06 118.68 111.01 2elj s LEU 59 Ca 0.44 -0.21 0.04 0.00 -0.22 0.00 0.00 54.13 54.19 2elj s LEU 59 Cb 0.22 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 45.12 2elj s LEU 59 CO -0.10 0.08 0.26 -0.94 -1.32 0.00 0.00 176.35 174.33 2elj s SER 60 N 0.90 4.46 -0.02 3.68 1.04 -1.26 -5.01 113.70 117.50 2elj s SER 60 Ca 0.01 -1.35 -0.25 0.00 0.48 0.00 0.00 55.95 54.83 2elj s SER 60 Cb -0.14 0.35 -0.19 0.00 0.10 0.00 0.00 66.02 66.13 2elj s SER 60 CO 0.02 -0.97 1.22 0.11 0.98 0.00 0.00 173.24 174.60 2elj h LYS 61 N 1.00 -0.07 -0.22 4.02 1.57 -1.98 -1.71 116.57 119.18 2elj h LYS 61 Ca -0.40 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.42 2elj h LYS 61 Cb 1.30 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.58 2elj h LYS 61 CO 0.64 0.39 -0.35 1.03 -0.57 0.00 0.00 179.45 180.59 2elj h SER 62 N -0.56 -1.14 0.47 0.86 0.87 -2.00 -0.07 113.55 111.98 2elj h SER 62 Ca -0.01 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2elj h SER 62 Cb 0.49 0.46 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 2elj h SER 62 CO 0.01 -0.26 -0.37 0.00 -0.53 0.00 0.00 176.83 175.68 2elj h ALA 63 N -0.56 -0.87 -0.95 6.23 0.00 -1.99 -2.90 119.26 118.23 2elj h ALA 63 Ca 0.04 -0.15 0.15 0.00 0.00 0.00 0.00 54.91 54.95 2elj h ALA 63 Cb 0.38 0.50 -0.16 0.00 0.00 0.00 0.00 17.79 18.52 2elj h ALA 63 CO -0.35 -1.02 -0.35 0.00 0.00 0.00 0.00 179.25 177.53 2elj h ARG 65 N 0.00 0.06 -0.26 0.00 3.08 -0.79 0.33 114.38 116.79 2elj h ARG 65 Ca 0.34 -0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.32 2elj h ARG 65 Cb 0.58 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 2elj h ARG 65 CO -0.94 0.04 -0.12 1.49 -1.07 0.00 0.00 179.97 179.36 2elj h GLU 66 N 0.06 0.54 -0.56 0.04 4.81 0.20 -3.17 114.58 116.50 2elj h GLU 66 Ca 0.53 -0.24 0.08 0.00 -0.13 0.00 0.00 59.36 59.61 2elj h GLU 66 Cb 1.03 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.32 2elj h GLU 66 CO -0.82 0.80 0.20 1.25 -0.73 0.00 0.00 179.01 179.70 2elj h LEU 67 N 0.28 0.19 -9.66 1.64 5.85 0.55 -3.41 115.31 110.75 2elj h LEU 67 Ca 0.06 0.07 -0.56 0.00 0.84 0.00 0.00 57.88 58.29 2elj h LEU 67 Cb 0.63 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2elj h LEU 67 CO 0.04 0.12 0.01 -0.76 -0.34 0.00 0.00 178.44 177.51 2elj s LEU 68 N -10.40 4.51 -0.54 2.25 1.43 0.18 -4.97 118.68 111.15 2elj s LEU 68 Ca -0.13 1.31 -0.05 0.00 -1.03 0.00 0.00 54.13 54.23 2elj s LEU 68 Cb 0.16 -2.98 -0.02 0.00 0.03 0.00 0.00 46.19 43.38 2elj s LEU 68 CO 0.74 0.22 2.94 0.59 0.23 0.00 0.00 176.35 181.07 2elj n ASN 69 N 1.95 6.53 -4.10 2.29 3.02 -1.26 -4.81 115.26 118.88 2elj n ASN 69 Ca -0.09 -2.98 -0.25 0.00 -0.03 0.00 0.00 54.58 51.23 2elj n ASN 69 Cb 0.50 -1.32 -0.08 0.00 -0.61 0.00 0.00 39.78 38.28 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 -1.03 0.59 0.73 2.41 -4.36 -1.26 -5.15 121.20 113.13 2elj s ILE 70 Ca 0.61 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.89 2elj s ILE 70 Cb 0.33 -2.37 0.03 0.00 1.25 0.00 0.00 42.46 41.70 2elj s ILE 70 CO -0.14 0.00 1.07 -1.81 0.24 0.00 0.00 174.94 174.30 2elj s ASP 71 N -3.59 5.03 0.39 4.36 1.11 -1.26 -4.92 116.67 117.79 2elj s ASP 71 Ca 0.25 1.67 0.18 0.00 0.18 0.00 0.00 52.55 54.84 2elj s ASP 71 Cb 0.03 -2.48 0.81 0.00 1.07 0.00 0.00 42.92 42.34 2elj s ASP 71 CO 0.15 -1.68 1.81 1.55 1.18 0.00 0.00 175.17 178.18 2elj h PRO 72 N -0.88 0.00 -0.44 8.23 0.13 -1.98 -2.68 132.00 134.38 2elj h PRO 72 Ca -0.44 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.56 2elj h PRO 72 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2elj h PRO 72 CO 0.55 0.34 -0.22 0.82 -0.23 0.00 0.00 178.00 179.26 2elj h ILE 73 N 0.00 1.27 0.15 -3.56 1.08 -2.00 -2.26 117.51 112.19 2elj h ILE 73 Ca -0.00 -1.38 -0.01 0.00 -0.39 0.00 0.00 64.86 63.08 2elj h ILE 73 Cb 0.75 1.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.72 2elj h ILE 73 CO 0.04 0.47 -0.07 0.11 -0.69 0.00 0.00 178.15 178.01 2elj h LYS 74 N 0.76 -0.20 -0.89 2.37 1.57 -1.93 -3.19 116.57 115.07 2elj h LYS 74 Ca 0.10 0.01 0.19 0.00 -1.87 0.00 0.00 60.65 59.08 2elj h LYS 74 Cb 0.80 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 33.09 2elj h LYS 74 CO 0.07 0.24 0.58 0.00 -0.57 0.00 0.00 179.45 179.77 2elj h ALA 75 N -0.09 2.16 -0.60 3.86 0.00 -1.54 0.22 119.26 123.26 2elj h ALA 75 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2elj h ALA 75 Cb 0.53 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2elj h ALA 75 CO 0.03 -0.43 0.39 -0.91 0.00 0.00 0.00 179.25 178.33 2elj h ASN 76 N 0.43 0.70 0.00 0.00 2.35 -1.39 0.98 115.58 118.65 2elj h ASN 76 Ca 0.46 -0.02 -0.14 0.00 -0.55 0.00 0.00 56.30 56.05 2elj h ASN 76 Cb 1.10 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 39.27 2elj h ASN 76 CO -0.18 0.52 -0.78 -0.09 -1.65 0.00 0.00 177.43 175.26 2elj h ARG 77 N 0.82 0.00 -0.77 0.81 9.65 -0.73 -3.36 114.38 120.81 2elj h ARG 77 Ca 0.22 0.00 0.13 0.00 -1.10 0.00 0.00 59.98 59.23 2elj h ARG 77 Cb -0.07 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.45 2elj h ARG 77 CO -0.05 0.94 0.51 0.82 2.80 0.00 0.00 179.97 184.99 2elj h ILE 78 N -1.00 0.85 0.00 1.20 2.04 -0.69 0.18 117.51 120.09 2elj h ILE 78 Ca -0.21 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 2elj h ILE 78 Cb 1.14 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 2elj h ILE 78 CO -0.13 0.10 -0.01 0.22 0.00 0.00 0.00 178.15 178.33 2elj h TYR 79 N 0.53 0.00 0.00 1.37 5.03 -0.95 0.13 116.97 123.08 2elj h TYR 79 Ca 0.37 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.68 2elj h TYR 79 Cb 0.70 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.98 2elj h TYR 79 CO -0.00 0.01 -0.45 -3.47 -1.32 0.00 0.00 178.16 172.93 2elj n ASP 80 N -3.58 0.53 -0.02 -2.11 -0.08 0.61 -3.64 116.55 108.27 2elj n ASP 80 Ca -0.03 0.07 -0.16 0.00 -1.51 0.00 0.00 54.79 53.16 2elj n ASP 80 Cb 0.09 0.04 -0.09 0.00 2.34 0.00 0.00 41.12 43.49 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 0.65 0.26 -0.67 3.57 -0.65 -2.79 116.94 117.32 2elj h PHE 81 Ca 0.00 -0.29 -0.01 0.00 3.53 0.00 0.00 57.97 61.19 2elj h PHE 81 Cb 0.62 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2elj h PHE 81 CO 0.00 1.07 -0.13 0.74 -2.23 0.00 0.00 178.31 177.76 2elj h PHE 82 N 0.05 -0.33 -0.63 0.41 -1.00 -1.67 -3.03 116.94 110.73 2elj h PHE 82 Ca -0.04 -0.01 0.13 0.00 2.81 0.00 0.00 57.97 60.87 2elj h PHE 82 Cb 1.14 0.11 -0.11 0.00 3.61 0.00 0.00 35.95 40.70 2elj h PHE 82 CO 0.12 0.03 -0.02 -0.56 -1.61 0.00 0.00 178.31 176.27 2elj h GLN 83 N -0.80 0.09 -0.89 1.51 -0.00 -1.69 0.85 115.11 114.17 2elj h GLN 83 Ca -0.04 -0.01 0.14 0.00 -0.00 0.00 0.00 58.65 58.74 2elj h GLN 83 Cb 0.51 -0.02 -0.09 0.00 -0.00 0.00 0.00 27.48 27.88 2elj h GLN 83 CO 0.06 0.06 0.51 1.03 -0.00 0.00 0.00 178.83 180.49 2elj h SER 84 N 0.10 0.68 -0.10 0.06 0.87 -1.53 0.39 113.55 114.02 2elj h SER 84 Ca 0.33 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 2elj h SER 84 Cb 0.53 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2elj h SER 84 CO -0.56 0.32 0.00 0.00 -0.53 0.00 0.00 176.83 176.06 2elj n GLN 85 N -4.78 1.59 -2.47 2.24 1.13 0.25 -4.84 117.38 110.51 2elj n GLN 85 Ca 0.17 -0.50 -0.03 0.00 -1.94 0.00 0.00 57.00 54.71 2elj n GLN 85 Cb 0.40 -1.56 -0.00 0.00 0.11 0.00 0.00 30.24 29.18 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 0.07 -1.62 0.09 1.08 5.03 0.14 -4.76 115.26 115.30 2elj n ASN 86 Ca 0.04 0.43 -0.17 0.00 0.87 0.00 0.00 54.58 55.76 2elj n ASN 86 Cb 0.37 -1.50 -0.11 0.00 -1.02 0.00 0.00 39.78 37.53 2elj n ASN 86 CO 0.00 0.00 0.00 -0.50 -1.83 0.00 0.00 177.26 174.93 2elj h TRP 87 N 0.00 0.65 -0.03 3.10 6.55 -1.63 -3.49 115.95 121.10 2elj h TRP 87 Ca -0.06 -0.42 0.00 0.00 0.95 0.00 0.00 58.89 59.35 2elj h TRP 87 Cb 1.03 -0.05 0.00 0.00 -0.86 0.00 0.00 29.16 29.29 2elj h TRP 87 CO 0.85 1.29 0.00 0.00 -1.05 0.00 0.00 178.44 179.53