#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 -1.59 -4.64 1.61 3.41 -1.26 -4.85 113.62 106.30 2elj n SER 2 Ca 0.00 -1.20 -0.42 0.00 -0.26 0.00 0.00 58.87 56.99 2elj n SER 2 Cb 0.00 -1.89 -0.03 0.00 -0.26 0.00 0.00 64.21 62.03 2elj n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2elj s SER 3 N -3.50 6.86 0.00 4.04 0.15 -1.26 -4.85 113.70 115.14 2elj s SER 3 Ca 0.64 0.99 0.00 0.00 0.70 0.00 0.00 55.95 58.29 2elj s SER 3 Cb -0.37 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.47 2elj s SER 3 CO 1.00 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 175.38 2elj n GLY 4 N 3.83 3.29 3.56 9.45 0.00 -1.26 -5.01 105.19 119.06 2elj n GLY 4 Ca 0.08 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 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 6.83 -0.29 1.61 1.04 -1.26 -4.85 113.70 116.79 2elj s SER 5 Ca 0.00 -2.42 -0.23 0.00 0.48 0.00 0.00 55.95 53.78 2elj s SER 5 Cb 0.00 -2.56 0.16 0.00 0.10 0.00 0.00 66.02 63.72 2elj s SER 5 CO 0.00 -1.15 1.19 -0.94 0.98 0.00 0.00 173.24 173.32 2elj s SER 6 N 4.13 -0.29 -0.46 7.02 1.04 -1.26 -5.12 113.70 118.76 2elj s SER 6 Ca 0.52 0.53 0.03 0.00 0.48 0.00 0.00 55.95 57.50 2elj s SER 6 Cb 0.03 0.67 0.15 0.00 0.10 0.00 0.00 66.02 66.97 2elj s SER 6 CO 0.05 -0.09 0.30 -0.83 0.98 0.00 0.00 173.24 173.66 2elj s GLY 7 N 0.39 1.63 -0.56 7.32 0.00 -1.26 -4.97 107.32 109.88 2elj s GLY 7 Ca 0.02 -2.65 -0.02 0.00 0.00 0.00 0.00 44.72 42.07 2elj s GLY 7 CO -0.11 1.71 2.09 0.70 0.00 0.00 0.00 173.10 177.48 2elj n ASN 8 N 3.16 7.21 -4.70 1.64 3.02 -1.26 -4.97 115.26 119.36 2elj n ASN 8 Ca 0.17 -3.52 -0.42 0.00 -0.03 0.00 0.00 54.58 50.78 2elj n ASN 8 Cb 0.39 -1.03 -0.03 0.00 -0.61 0.00 0.00 39.78 38.49 2elj n ASN 8 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2elj s MET 9 N -3.05 4.32 0.02 3.52 -2.45 -1.26 -5.02 119.30 115.39 2elj s MET 9 Ca 0.52 1.98 0.03 0.00 -1.25 0.00 0.00 55.69 56.97 2elj s MET 9 Cb 0.41 -3.41 -0.02 0.00 1.25 0.00 0.00 34.83 33.06 2elj s MET 9 CO -0.06 -0.47 -0.09 0.95 1.05 0.00 0.00 175.02 176.39 2elj s THR 10 N 1.68 0.69 0.33 10.11 -4.23 -1.26 -5.03 115.64 117.93 2elj s THR 10 Ca 0.63 -0.72 0.10 0.00 -1.18 0.00 0.00 61.69 60.52 2elj s THR 10 Cb -0.33 -0.65 0.37 0.00 1.34 0.00 0.00 72.50 73.23 2elj s THR 10 CO 0.28 -0.05 1.60 0.40 -0.54 0.00 0.00 174.62 176.31 2elj h ILE 11 N 4.70 0.09 -0.95 2.99 2.04 -1.96 0.46 117.51 124.89 2elj h ILE 11 Ca -0.33 -0.03 0.30 0.00 1.00 0.00 0.00 64.86 65.80 2elj h ILE 11 Cb 1.19 0.01 -0.16 0.00 -0.74 0.00 0.00 36.82 37.12 2elj h ILE 11 CO 0.45 0.01 0.32 -1.28 0.00 0.00 0.00 178.15 177.66 2elj h SER 12 N 0.07 0.06 -0.41 1.72 0.87 -1.99 0.44 113.55 114.31 2elj h SER 12 Ca 0.69 0.23 0.06 0.00 -1.23 0.00 0.00 61.79 61.54 2elj h SER 12 Cb 1.60 0.29 -0.05 0.00 -0.44 0.00 0.00 62.40 63.79 2elj h SER 12 CO -0.79 -0.26 0.09 0.44 -0.53 0.00 0.00 176.83 175.78 2elj h ASP 13 N 0.14 0.04 0.47 6.23 3.32 -0.49 0.24 116.42 126.37 2elj h ASP 13 Ca 0.66 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.76 2elj h ASP 13 Cb 1.50 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 41.12 2elj h ASP 13 CO -0.73 0.05 -0.35 0.40 -1.72 0.00 0.00 179.24 176.90 2elj h ILE 14 N 0.23 0.00 -0.35 0.35 2.04 -0.21 -2.96 117.51 116.60 2elj h ILE 14 Ca 0.20 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.13 2elj h ILE 14 Cb 0.23 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.25 2elj h ILE 14 CO -0.25 0.00 -0.08 1.56 0.00 0.00 0.00 178.15 179.38 2elj h GLN 15 N -0.78 0.01 -0.81 2.37 4.20 -1.34 -2.56 115.11 116.20 2elj h GLN 15 Ca -0.06 -0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.75 2elj h GLN 15 Cb 0.65 -0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.31 2elj h GLN 15 CO 0.02 0.01 -0.39 1.58 -0.67 0.00 0.00 178.83 179.38 2elj n HIS 16 N -5.27 -0.15 -1.40 2.96 -0.00 0.84 -4.49 115.22 107.72 2elj n HIS 16 Ca 0.01 1.00 -0.43 0.00 0.46 0.00 0.00 57.72 58.76 2elj n HIS 16 Cb 0.20 -0.69 -0.01 0.00 -0.12 0.00 0.00 29.99 29.37 2elj n HIS 16 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2elj n ALA 17 N -3.49 -2.21 -0.02 1.57 0.00 -0.96 -4.90 120.51 110.49 2elj n ALA 17 Ca 0.05 0.22 -0.13 0.00 0.00 0.00 0.00 53.44 53.58 2elj n ALA 17 Cb 0.27 -1.65 -0.10 0.00 0.00 0.00 0.00 19.45 17.97 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 0.75 0.05 -1.01 0.00 0.13 -1.88 -3.19 132.00 126.86 2elj h PRO 18 Ca -0.37 -0.03 0.24 0.00 -0.87 0.00 0.00 66.00 64.98 2elj h PRO 18 Cb 1.42 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.45 2elj h PRO 18 CO 0.52 0.52 0.63 -0.44 -0.23 0.00 0.00 178.00 178.99 2elj h ASP 19 N -0.42 0.59 -0.74 1.44 5.19 -1.92 -1.82 116.42 118.74 2elj h ASP 19 Ca 0.00 0.10 0.16 0.00 -0.62 0.00 0.00 57.03 56.67 2elj h ASP 19 Cb 0.51 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 39.88 2elj h ASP 19 CO 0.00 0.14 -0.13 0.00 -3.12 0.00 0.00 179.24 176.14 2elj n TYR 20 N -4.73 0.32 -0.20 4.55 9.36 -1.20 0.97 117.16 126.22 2elj n TYR 20 Ca 0.25 0.90 -0.04 0.00 3.32 0.00 0.00 57.90 62.32 2elj n TYR 20 Cb 0.75 -0.96 0.02 0.00 -0.63 0.00 0.00 39.34 38.52 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 1.47 0.05 -0.92 2.98 0.00 -1.53 0.13 119.26 121.45 2elj h ALA 21 Ca 0.38 0.18 0.38 0.00 0.00 0.00 0.00 54.91 55.85 2elj h ALA 21 Cb 0.64 0.72 -0.17 0.00 0.00 0.00 0.00 17.79 18.99 2elj h ALA 21 CO -0.74 -0.63 0.49 1.28 0.00 0.00 0.00 179.25 179.65 2elj n LEU 22 N -5.44 0.32 -4.71 0.00 4.77 0.27 -4.31 117.00 107.90 2elj n LEU 22 Ca 0.05 1.52 -0.42 0.00 -0.03 0.00 0.00 56.01 57.13 2elj n LEU 22 Cb 0.35 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 40.67 2elj n LEU 22 CO 0.02 -1.71 1.35 -0.76 -1.33 0.00 0.00 177.39 174.96 2elj s LEU 23 N -10.15 4.38 1.10 2.23 1.43 0.47 -4.99 118.68 113.14 2elj s LEU 23 Ca -0.08 2.70 -0.17 0.00 -1.03 0.00 0.00 54.13 55.55 2elj s LEU 23 Cb 0.31 -3.58 0.24 0.00 0.03 0.00 0.00 46.19 43.19 2elj s LEU 23 CO 0.72 -0.92 1.15 -0.55 0.23 0.00 0.00 176.35 176.97 2elj s SER 24 N 1.74 1.82 0.12 2.29 0.15 -1.26 -4.60 113.70 113.96 2elj s SER 24 Ca 0.75 0.68 -0.33 0.00 0.70 0.00 0.00 55.95 57.74 2elj s SER 24 Cb -0.45 -0.99 -0.12 0.00 -1.71 0.00 0.00 66.02 62.75 2elj s SER 24 CO 0.33 -3.57 1.55 0.78 1.20 0.00 0.00 173.24 173.53 2elj h ASN 25 N -2.20 -1.77 0.50 5.45 4.21 -1.94 0.14 115.58 119.98 2elj h ASN 25 Ca -0.47 0.22 -0.01 0.00 1.21 0.00 0.00 56.30 57.25 2elj h ASN 25 Cb 1.29 0.70 -0.02 0.00 -1.12 0.00 0.00 38.32 39.18 2elj h ASN 25 CO 0.41 -0.46 -0.43 0.44 -1.29 0.00 0.00 177.43 176.10 2elj h ASP 26 N -0.52 -1.16 -0.90 5.81 3.32 -2.00 -2.01 116.42 118.95 2elj h ASP 26 Ca 0.05 0.09 0.25 0.00 0.02 0.00 0.00 57.03 57.44 2elj h ASP 26 Cb 0.65 0.37 -0.15 0.00 0.22 0.00 0.00 39.33 40.43 2elj h ASP 26 CO -0.49 -0.61 0.20 -0.33 -1.72 0.00 0.00 179.24 176.29 2elj h GLU 27 N -0.93 0.15 0.94 3.56 5.08 -1.82 -1.07 114.58 120.49 2elj h GLU 27 Ca -0.05 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2elj h GLU 27 Cb 0.80 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.02 2elj h GLU 27 CO -0.02 0.10 -0.48 1.96 -1.00 0.00 0.00 179.01 179.56 2elj h GLN 28 N 0.15 -1.25 -0.84 2.33 4.20 -0.26 -2.52 115.11 116.93 2elj h GLN 28 Ca 0.57 0.09 0.19 0.00 0.06 0.00 0.00 58.65 59.56 2elj h GLN 28 Cb 1.18 0.28 -0.16 0.00 0.30 0.00 0.00 27.48 29.09 2elj h GLN 28 CO -0.71 -0.83 -0.13 1.04 -0.67 0.00 0.00 178.83 177.53 2elj n GLN 29 N -5.58 -0.07 0.45 1.46 1.13 -0.43 -0.50 117.38 113.84 2elj n GLN 29 Ca -0.16 1.30 -0.18 0.00 -1.94 0.00 0.00 57.00 56.02 2elj n GLN 29 Cb 0.52 -1.98 -0.08 0.00 0.11 0.00 0.00 30.24 28.80 2elj n GLN 29 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2elj h LEU 30 N 0.00 -1.00 -0.88 1.08 5.85 -1.30 -2.57 115.31 116.50 2elj h LEU 30 Ca 0.44 0.04 0.22 0.00 0.84 0.00 0.00 57.88 59.42 2elj h LEU 30 Cb 0.78 0.26 -0.16 0.00 0.37 0.00 0.00 40.66 41.90 2elj h LEU 30 CO -0.84 -0.70 -0.05 0.00 -0.34 0.00 0.00 178.44 176.51 2elj h ILE 32 N 0.00 0.02 -0.24 0.00 2.04 -1.19 0.85 117.51 118.98 2elj h ILE 32 Ca 0.50 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.42 2elj h ILE 32 Cb 0.97 0.02 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 2elj h ILE 32 CO -0.85 0.00 -0.27 1.56 0.00 0.00 0.00 178.15 178.60 2elj h GLN 33 N -1.25 -0.26 0.00 2.37 4.20 -0.27 0.28 115.11 120.17 2elj h GLN 33 Ca -0.12 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.61 2elj h GLN 33 Cb 0.99 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2elj h GLN 33 CO 0.15 -0.18 0.00 1.28 -0.67 0.00 0.00 178.83 179.41 2elj n LEU 34 N -5.39 0.09 -3.93 1.46 4.77 0.23 -4.88 117.00 109.36 2elj n LEU 34 Ca -0.01 0.52 -0.29 0.00 -0.03 0.00 0.00 56.01 56.20 2elj n LEU 34 Cb 0.30 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.90 2elj n LEU 34 CO 0.14 -0.25 0.02 0.29 -1.33 0.00 0.00 177.39 176.26 2elj n LYS 35 N -1.60 -4.79 -4.03 3.23 5.02 0.28 -4.96 118.16 111.31 2elj n LYS 35 Ca 0.04 0.54 -0.30 0.00 -2.02 0.00 0.00 58.31 56.57 2elj n LYS 35 Cb 0.21 -5.26 -0.06 0.00 -0.02 0.00 0.00 35.03 29.89 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 -3.44 4.65 0.43 -0.18 1.01 -0.42 -5.02 121.20 118.24 2elj s ILE 36 Ca 0.48 -0.74 -0.21 0.00 0.00 0.00 0.00 60.65 60.18 2elj s ILE 36 Cb -0.25 -3.25 -0.10 0.00 0.01 0.00 0.00 42.46 38.87 2elj s ILE 36 CO 0.85 0.11 0.98 -0.76 0.00 0.00 0.00 174.94 176.12 2elj s LEU 37 N -2.46 3.97 0.12 2.97 1.43 -1.26 -4.75 118.68 118.70 2elj s LEU 37 Ca 0.30 1.79 -0.13 0.00 -1.03 0.00 0.00 54.13 55.06 2elj s LEU 37 Cb -0.12 -4.47 -0.06 0.00 0.03 0.00 0.00 46.19 41.56 2elj s LEU 37 CO 0.23 -0.45 1.45 1.55 0.23 0.00 0.00 176.35 179.36 2elj h PRO 38 N 1.98 0.83 -0.02 1.29 0.13 -1.94 -1.10 132.00 133.17 2elj h PRO 38 Ca -0.49 -0.44 0.03 0.00 -0.87 0.00 0.00 66.00 64.23 2elj h PRO 38 Cb 1.19 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 2elj h PRO 38 CO 0.61 1.08 -0.46 -0.22 -0.23 0.00 0.00 178.00 178.77 2elj h LYS 39 N 0.62 -0.58 -0.18 0.86 3.64 -1.94 0.47 116.57 119.47 2elj h LYS 39 Ca 0.06 0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 2elj h LYS 39 Cb 0.92 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2elj h LYS 39 CO 0.08 -0.39 -0.18 -1.00 -2.27 0.00 0.00 179.45 175.70 2elj h PRO 40 N -0.60 0.44 -0.76 1.90 0.13 -1.98 -2.46 132.00 128.67 2elj h PRO 40 Ca 0.04 -0.23 0.18 0.00 -0.87 0.00 0.00 66.00 65.11 2elj h PRO 40 Cb 0.68 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.77 2elj h PRO 40 CO -0.35 0.80 0.52 -0.92 -0.23 0.00 0.00 178.00 177.82 2elj h TYR 41 N 0.10 0.33 0.00 1.56 5.03 -1.02 0.18 116.97 123.15 2elj h TYR 41 Ca 0.03 0.01 -0.21 0.00 2.58 0.00 0.00 58.73 61.14 2elj h TYR 41 Cb 0.72 -0.10 -0.03 0.00 1.55 0.00 0.00 36.73 38.86 2elj h TYR 41 CO 0.08 0.11 -1.09 -0.07 -1.32 0.00 0.00 178.16 175.87 2elj h LEU 42 N 0.27 0.00 -0.40 2.82 3.38 -0.83 -2.67 115.31 117.88 2elj h LEU 42 Ca 0.37 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.18 2elj h LEU 42 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 2elj h LEU 42 CO -0.09 0.92 -0.45 0.58 0.09 0.00 0.00 178.44 179.49 2elj h VAL 43 N 0.00 1.28 0.00 1.22 2.07 -0.24 -3.06 116.25 117.52 2elj h VAL 43 Ca -0.07 -1.63 -0.06 0.00 0.82 0.00 0.00 66.70 65.76 2elj h VAL 43 Cb 1.76 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 2elj h VAL 43 CO 0.11 0.54 -0.35 0.17 0.02 0.00 0.00 177.57 178.05 2elj h LEU 44 N 0.69 0.00 -0.54 2.57 8.10 -1.18 -3.29 115.31 121.66 2elj h LEU 44 Ca 0.04 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 58.00 2elj h LEU 44 Cb 1.04 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.23 2elj h LEU 44 CO 0.10 0.29 0.23 0.50 -4.11 0.00 0.00 178.44 175.45 2elj h LYS 45 N 0.00 0.80 -0.73 0.17 3.64 -1.38 -2.59 116.57 116.50 2elj h LYS 45 Ca -0.01 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 2elj h LYS 45 Cb 1.23 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.88 2elj h LYS 45 CO 0.04 0.69 0.29 1.49 -2.27 0.00 0.00 179.45 179.69 2elj h GLU 46 N 0.73 1.08 0.21 1.90 4.57 -1.61 -3.02 114.58 118.43 2elj h GLU 46 Ca 0.18 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2elj h GLU 46 Cb 0.18 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2elj h GLU 46 CO -0.02 0.87 -0.16 0.28 -1.18 0.00 0.00 179.01 178.81 2elj h VAL 47 N 1.05 0.66 -0.95 0.32 2.07 -1.58 0.15 116.25 117.97 2elj h VAL 47 Ca 0.24 0.00 0.25 0.00 0.82 0.00 0.00 66.70 68.02 2elj h VAL 47 Cb 0.20 0.66 -0.13 0.00 -1.52 0.00 0.00 31.29 30.50 2elj h VAL 47 CO -0.02 0.00 0.47 0.24 0.02 0.00 0.00 177.57 178.28 2elj h MET 48 N -0.37 0.39 -0.02 1.57 2.86 -1.35 0.42 114.93 118.44 2elj h MET 48 Ca -0.01 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.46 2elj h MET 48 Cb 0.33 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.91 2elj h MET 48 CO -0.00 0.26 -0.55 0.74 1.06 0.00 0.00 176.91 178.41 2elj h PHE 49 N 0.40 0.59 -0.49 -0.22 0.04 -1.39 -1.59 116.94 114.29 2elj h PHE 49 Ca 0.63 -0.31 0.14 0.00 2.80 0.00 0.00 57.97 61.23 2elj h PHE 49 Cb 1.27 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 39.32 2elj h PHE 49 CO -0.09 1.12 0.37 -0.09 -0.60 0.00 0.00 178.31 179.02 2elj h ARG 50 N -0.11 0.00 0.00 1.51 2.43 0.13 -1.13 114.38 117.21 2elj h ARG 50 Ca -0.06 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 58.96 2elj h ARG 50 Cb 1.26 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 2elj h ARG 50 CO 0.11 0.00 -0.83 1.49 -1.51 0.00 0.00 179.97 179.23 2elj h GLU 51 N 0.00 0.00 -1.04 0.20 4.81 -1.03 -3.08 114.58 114.44 2elj h GLU 51 Ca 0.23 0.00 0.27 0.00 -0.13 0.00 0.00 59.36 59.73 2elj h GLU 51 Cb 0.96 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.26 2elj h GLU 51 CO -0.00 0.86 0.68 -0.07 -0.73 0.00 0.00 179.01 179.75 2elj h LEU 52 N -1.00 0.38 0.02 1.64 3.38 -0.87 0.07 115.31 118.92 2elj h LEU 52 Ca -0.22 0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.71 2elj h LEU 52 Cb 1.10 0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.86 2elj h LEU 52 CO -0.13 0.08 -0.47 0.17 0.09 0.00 0.00 178.44 178.18 2elj h LEU 53 N 0.34 0.37 -0.10 1.67 8.10 -1.37 0.28 115.31 124.60 2elj h LEU 53 Ca 0.57 -0.81 0.04 0.00 0.11 0.00 0.00 57.88 57.80 2elj h LEU 53 Cb 1.57 -0.12 -0.06 0.00 -0.44 0.00 0.00 40.66 41.62 2elj h LEU 53 CO -0.24 1.14 -0.32 0.50 -4.11 0.00 0.00 178.44 175.41 2elj h LYS 54 N -0.35 -0.39 0.00 0.17 3.64 -0.93 -2.37 116.57 116.34 2elj h LYS 54 Ca -0.06 0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.18 2elj h LYS 54 Cb 1.23 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 2elj h LYS 54 CO 0.09 -0.26 -0.78 1.79 -2.27 0.00 0.00 179.45 178.02 2elj h THR 55 N -0.41 1.34 0.00 1.00 1.35 -1.36 -3.48 112.91 111.34 2elj h THR 55 Ca 0.09 -2.89 0.00 0.00 -0.55 0.00 0.00 66.41 63.06 2elj h THR 55 Cb 0.54 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2elj h THR 55 CO -0.33 0.76 0.00 0.61 -0.25 0.00 0.00 175.52 176.31 2elj n GLY 56 N 1.30 2.59 0.00 5.82 0.00 0.94 -4.71 105.19 111.12 2elj n GLY 56 Ca 0.01 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.68 1.85 -0.02 0.00 -0.90 -4.72 105.19 99.72 2elj n GLY 57 Ca 0.00 0.55 -0.07 0.00 0.00 0.00 0.00 46.02 46.50 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 2.70 -4.38 1.61 3.02 -1.26 -5.01 115.26 111.94 2elj n ASN 58 Ca 0.00 -3.03 -0.45 0.00 -0.03 0.00 0.00 54.58 51.07 2elj n ASN 58 Cb 0.00 -0.41 -0.04 0.00 -0.61 0.00 0.00 39.78 38.72 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 -2.99 5.39 -0.04 3.41 2.96 -1.26 -5.00 118.68 121.15 2elj s LEU 59 Ca 0.39 -1.49 -0.05 0.00 -0.22 0.00 0.00 54.13 52.76 2elj s LEU 59 Cb 0.37 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 2elj s LEU 59 CO -0.04 -1.11 0.19 -0.55 -1.32 0.00 0.00 176.35 173.52 2elj s SER 60 N 3.59 6.40 0.20 3.68 0.15 -1.26 -4.87 113.70 121.59 2elj s SER 60 Ca 0.13 0.42 -0.05 0.00 0.70 0.00 0.00 55.95 57.15 2elj s SER 60 Cb -0.23 -2.04 0.34 0.00 -1.71 0.00 0.00 66.02 62.38 2elj s SER 60 CO 0.05 0.30 1.12 1.17 1.20 0.00 0.00 173.24 177.09 2elj n LYS 61 N 1.28 -0.06 -0.01 5.44 3.00 -1.26 0.14 118.16 126.68 2elj n LYS 61 Ca -0.14 1.12 -0.09 0.00 -0.00 0.00 0.00 58.31 59.21 2elj n LYS 61 Cb 0.53 -1.68 -0.03 0.00 0.00 0.00 0.00 35.03 33.86 2elj n LYS 61 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.40 178.17 2elj h SER 62 N 0.00 -0.39 0.06 3.14 0.02 -2.00 -2.60 113.55 111.78 2elj h SER 62 Ca 0.35 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.38 2elj h SER 62 Cb 0.54 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2elj h SER 62 CO -0.74 -0.16 -0.03 0.00 -1.14 0.00 0.00 176.83 174.76 2elj h ALA 63 N 0.97 -0.08 -0.99 3.77 0.00 0.78 -2.92 119.26 120.79 2elj h ALA 63 Ca 0.10 -0.10 0.37 0.00 0.00 0.00 0.00 54.91 55.28 2elj h ALA 63 Cb 0.28 0.03 -0.17 0.00 0.00 0.00 0.00 17.79 17.93 2elj h ALA 63 CO -0.24 -0.46 0.44 0.00 0.00 0.00 0.00 179.25 179.00 2elj h ARG 65 N 0.07 0.04 -0.43 0.00 3.08 -1.26 -1.51 114.38 114.37 2elj h ARG 65 Ca 0.77 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.81 2elj h ARG 65 Cb 1.92 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.94 2elj h ARG 65 CO -0.76 0.03 0.21 1.49 -1.07 0.00 0.00 179.97 179.87 2elj h GLU 66 N 0.04 0.61 0.01 0.04 4.81 0.01 -3.11 114.58 116.99 2elj h GLU 66 Ca 0.11 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 2elj h GLU 66 Cb 0.15 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 2elj h GLU 66 CO -0.21 0.51 -0.35 1.25 -0.73 0.00 0.00 179.01 179.48 2elj h LEU 67 N 0.55 -1.07 -8.88 1.64 5.85 -0.87 -3.38 115.31 109.15 2elj h LEU 67 Ca 0.15 0.13 -0.63 0.00 0.84 0.00 0.00 57.88 58.37 2elj h LEU 67 Cb 0.10 0.42 -0.15 0.00 0.37 0.00 0.00 40.66 41.40 2elj h LEU 67 CO -0.02 -0.41 -0.21 -0.76 -0.34 0.00 0.00 178.44 176.70 2elj s LEU 68 N -10.35 4.14 -1.32 2.25 1.43 -0.61 -4.99 118.68 109.24 2elj s LEU 68 Ca -0.16 0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 52.95 2elj s LEU 68 Cb 0.09 -2.45 0.02 0.00 0.03 0.00 0.00 46.19 43.88 2elj s LEU 68 CO 0.65 -0.25 2.03 0.59 0.23 0.00 0.00 176.35 179.59 2elj n ASN 69 N 5.41 3.99 -3.94 2.29 4.13 -1.26 -4.71 115.26 121.17 2elj n ASN 69 Ca -0.08 -2.84 -0.08 0.00 1.68 0.00 0.00 54.58 53.26 2elj n ASN 69 Cb 0.50 -1.63 -0.08 0.00 -1.54 0.00 0.00 39.78 37.03 2elj n ASN 69 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2elj s ILE 70 N 4.18 0.16 0.38 2.41 -4.36 -1.26 -5.13 121.20 117.58 2elj s ILE 70 Ca 0.52 -1.36 -0.17 0.00 -0.26 0.00 0.00 60.65 59.38 2elj s ILE 70 Cb 0.10 -1.34 -0.13 0.00 1.25 0.00 0.00 42.46 42.34 2elj s ILE 70 CO -0.00 -0.75 -0.01 0.47 0.24 0.00 0.00 174.94 174.89 2elj n ASP 71 N 0.09 -2.71 0.17 4.36 9.92 -1.26 -4.74 116.55 122.38 2elj n ASP 71 Ca -0.15 0.63 0.01 0.00 -0.53 0.00 0.00 54.79 54.75 2elj n ASP 71 Cb 0.61 -0.73 0.29 0.00 -0.64 0.00 0.00 41.12 40.65 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 0.15 0.00 -0.02 -0.24 0.13 -1.97 -2.95 132.00 127.10 2elj h PRO 72 Ca -0.33 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.65 2elj h PRO 72 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2elj h PRO 72 CO 0.38 0.47 -0.72 0.82 -0.23 0.00 0.00 178.00 178.71 2elj h ILE 73 N 0.00 1.48 0.41 -3.56 2.04 -1.99 -3.00 117.51 112.88 2elj h ILE 73 Ca -0.00 -2.36 -0.02 0.00 1.00 0.00 0.00 64.86 63.47 2elj h ILE 73 Cb 0.85 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.20 2elj h ILE 73 CO 0.06 0.68 -0.20 0.11 0.00 0.00 0.00 178.15 178.81 2elj h LYS 74 N 0.07 -0.53 0.00 2.37 1.79 -1.86 -3.02 116.57 115.38 2elj h LYS 74 Ca -0.02 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2elj h LYS 74 Cb 1.27 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 32.04 2elj h LYS 74 CO 0.10 -0.35 0.16 0.00 -1.08 0.00 0.00 179.45 178.28 2elj n ALA 75 N -2.51 0.79 0.09 3.86 0.00 -1.14 -0.32 120.51 121.28 2elj n ALA 75 Ca -0.07 0.13 -0.06 0.00 0.00 0.00 0.00 53.44 53.44 2elj n ALA 75 Cb 0.22 -0.96 0.07 0.00 0.00 0.00 0.00 19.45 18.78 2elj n ALA 75 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2elj h ASN 76 N 0.00 0.19 0.00 0.00 -0.73 -1.39 -2.79 115.58 110.86 2elj h ASN 76 Ca 0.00 -0.13 -0.08 0.00 1.87 0.00 0.00 56.30 57.96 2elj h ASN 76 Cb 0.33 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 38.85 2elj h ASN 76 CO 0.00 0.85 -0.58 -0.09 -0.37 0.00 0.00 177.43 177.24 2elj h ARG 77 N 0.11 0.00 -0.62 6.67 9.65 -0.68 -3.37 114.38 126.13 2elj h ARG 77 Ca -0.02 0.00 0.13 0.00 -1.10 0.00 0.00 59.98 58.99 2elj h ARG 77 Cb 1.28 0.00 -0.11 0.00 -1.39 0.00 0.00 29.97 29.74 2elj h ARG 77 CO 0.11 0.49 -0.10 0.82 2.80 0.00 0.00 179.97 184.09 2elj h ILE 78 N -1.00 0.41 -0.85 1.20 2.04 -1.63 -0.50 117.51 117.18 2elj h ILE 78 Ca -0.12 -0.01 0.18 0.00 1.00 0.00 0.00 64.86 65.92 2elj h ILE 78 Cb 0.76 0.37 -0.16 0.00 -0.74 0.00 0.00 36.82 37.05 2elj h ILE 78 CO -0.07 0.01 -0.14 0.22 0.00 0.00 0.00 178.15 178.17 2elj h TYR 79 N 0.04 -0.32 -0.14 1.37 3.20 -1.68 0.13 116.97 119.57 2elj h TYR 79 Ca 0.31 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.24 2elj h TYR 79 Cb 0.49 0.28 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 2elj h TYR 79 CO -0.46 -0.35 0.04 0.22 -1.64 0.00 0.00 178.16 175.97 2elj h ASP 80 N 0.02 0.20 -0.96 -2.11 3.58 -1.27 -2.93 116.42 112.96 2elj h ASP 80 Ca 0.44 -0.22 0.30 0.00 0.42 0.00 0.00 57.03 57.97 2elj h ASP 80 Cb 0.72 -0.05 -0.15 0.00 1.72 0.00 0.00 39.33 41.57 2elj h ASP 80 CO -0.85 0.36 0.40 0.15 -2.88 0.00 0.00 179.24 176.43 2elj h PHE 81 N 0.03 0.63 -0.32 0.28 3.57 -0.16 0.37 116.94 121.33 2elj h PHE 81 Ca 0.04 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2elj h PHE 81 Cb 0.24 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2elj h PHE 81 CO 0.00 -0.24 0.16 0.74 -2.23 0.00 0.00 178.31 176.74 2elj h PHE 82 N 0.22 0.31 -0.17 0.41 -1.00 -1.20 -1.91 116.94 113.60 2elj h PHE 82 Ca 0.67 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 61.43 2elj h PHE 82 Cb 1.50 -0.09 -0.01 0.00 3.61 0.00 0.00 35.95 40.95 2elj h PHE 82 CO -0.14 0.17 -0.03 1.96 -1.61 0.00 0.00 178.31 178.65 2elj h GLN 83 N 0.34 0.24 -0.77 1.51 1.08 -0.34 -2.25 115.11 114.92 2elj h GLN 83 Ca 0.13 -0.04 0.05 0.00 -1.45 0.00 0.00 58.65 57.34 2elj h GLN 83 Cb 0.04 -0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 27.38 2elj h GLN 83 CO -0.08 0.30 0.51 1.03 -0.95 0.00 0.00 178.83 179.63 2elj h SER 84 N 0.24 0.77 -0.47 1.46 0.87 -0.43 0.01 113.55 116.00 2elj h SER 84 Ca 0.06 -0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.51 2elj h SER 84 Cb 0.22 -0.17 -0.06 0.00 -0.44 0.00 0.00 62.40 61.95 2elj h SER 84 CO 0.01 0.51 0.13 0.00 -0.53 0.00 0.00 176.83 176.95 2elj n GLN 85 N -4.47 3.16 -2.35 2.24 1.13 -0.87 -4.88 117.38 111.35 2elj n GLN 85 Ca 0.11 -2.12 0.00 0.00 -1.94 0.00 0.00 57.00 53.05 2elj n GLN 85 Cb 0.17 -1.96 0.00 0.00 0.11 0.00 0.00 30.24 28.56 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 0.13 -0.90 -0.10 1.08 2.85 -0.01 -4.73 115.26 113.58 2elj n ASN 86 Ca 0.25 0.45 -0.12 0.00 -0.11 0.00 0.00 54.58 55.05 2elj n ASN 86 Cb 1.01 -0.95 0.00 0.00 1.24 0.00 0.00 39.78 41.09 2elj n ASN 86 CO 0.00 0.00 0.00 -0.50 -2.11 0.00 0.00 177.26 174.65 2elj h TRP 87 N 0.00 1.05 -0.01 1.20 6.55 -1.73 -3.50 115.95 119.51 2elj h TRP 87 Ca 0.00 -0.31 0.00 0.00 0.95 0.00 0.00 58.89 59.53 2elj h TRP 87 Cb 0.90 -0.22 0.00 0.00 -0.86 0.00 0.00 29.16 28.98 2elj h TRP 87 CO 0.81 1.12 0.00 -1.33 -1.05 0.00 0.00 178.44 177.99