#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 3.08 -0.46 1.61 0.01 -1.26 -5.08 113.70 111.60 2elj s SER 2 Ca 0.00 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.54 2elj s SER 2 Cb 0.00 -1.29 0.12 0.00 0.21 0.00 0.00 66.02 65.06 2elj s SER 2 CO 0.00 -0.07 0.27 -0.55 0.41 0.00 0.00 173.24 173.29 2elj s SER 3 N 1.39 5.28 0.00 2.44 0.15 -1.26 -4.68 113.70 117.02 2elj s SER 3 Ca 0.03 -2.20 0.00 0.00 0.70 0.00 0.00 55.95 54.47 2elj s SER 3 Cb -0.14 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 2elj s SER 3 CO -0.10 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.43 2elj n GLY 4 N 4.37 3.27 4.43 9.45 0.00 -1.26 -4.84 105.19 120.62 2elj n GLY 4 Ca -0.00 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.71 2elj n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2elj n SER 5 N 0.74 -1.33 -3.74 1.61 3.41 -1.26 -4.89 113.62 108.16 2elj n SER 5 Ca 0.00 -1.22 -0.14 0.00 -0.26 0.00 0.00 58.87 57.25 2elj n SER 5 Cb 0.00 -1.55 -0.14 0.00 -0.26 0.00 0.00 64.21 62.25 2elj n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2elj s SER 6 N -3.38 -0.10 0.00 4.04 0.01 -1.26 -5.11 113.70 107.89 2elj s SER 6 Ca 0.68 0.33 0.00 0.00 1.31 0.00 0.00 55.95 58.27 2elj s SER 6 Cb -0.40 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.05 2elj s SER 6 CO 1.00 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 175.10 2elj n GLY 7 N 4.26 2.23 3.63 3.44 0.00 -1.26 -4.99 105.19 112.50 2elj n GLY 7 Ca -0.26 -1.70 -0.46 0.00 0.00 0.00 0.00 46.02 43.60 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 2.07 -4.42 1.61 3.02 -1.26 -4.98 115.26 111.31 2elj n ASN 8 Ca 0.00 1.15 -0.33 0.00 -0.03 0.00 0.00 54.58 55.37 2elj n ASN 8 Cb 0.00 -1.34 -0.14 0.00 -0.61 0.00 0.00 39.78 37.70 2elj n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2elj s MET 9 N -0.56 2.75 1.01 3.52 0.23 -1.26 -5.13 119.30 119.86 2elj s MET 9 Ca 0.69 -0.72 -0.17 0.00 -1.03 0.00 0.00 55.69 54.45 2elj s MET 9 Cb -0.73 -2.42 0.23 0.00 -1.53 0.00 0.00 34.83 30.39 2elj s MET 9 CO 0.52 0.48 1.35 0.95 -2.03 0.00 0.00 175.02 176.29 2elj s THR 10 N -0.36 1.98 0.14 3.16 -4.23 -1.26 -4.99 115.64 110.08 2elj s THR 10 Ca 0.03 0.00 -0.00 0.00 -1.18 0.00 0.00 61.69 60.54 2elj s THR 10 Cb -0.12 -2.98 -0.17 0.00 1.34 0.00 0.00 72.50 70.56 2elj s THR 10 CO 0.02 0.00 1.33 0.40 -0.54 0.00 0.00 174.62 175.83 2elj h ILE 11 N -1.83 1.47 -0.27 2.99 5.03 -1.98 -3.18 117.51 119.75 2elj h ILE 11 Ca -0.44 -2.63 0.08 0.00 -0.12 0.00 0.00 64.86 61.75 2elj h ILE 11 Cb 1.21 2.51 -0.01 0.00 -3.03 0.00 0.00 36.82 37.50 2elj h ILE 11 CO 0.31 0.77 0.22 0.28 -0.68 0.00 0.00 178.15 179.05 2elj h SER 12 N 0.14 0.00 0.74 1.72 0.02 -2.00 0.20 113.55 114.38 2elj h SER 12 Ca -0.06 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 2elj h SER 12 Cb 1.58 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.12 2elj h SER 12 CO 0.15 0.00 -0.11 -0.78 -1.14 0.00 0.00 176.83 174.95 2elj h ASP 13 N 0.00 0.00 0.07 3.07 1.82 -1.94 -0.96 116.42 118.49 2elj h ASP 13 Ca 0.13 0.00 -0.20 0.00 -0.39 0.00 0.00 57.03 56.57 2elj h ASP 13 Cb 0.56 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.57 2elj h ASP 13 CO -0.00 0.11 -0.99 0.40 -1.61 0.00 0.00 179.24 177.15 2elj h ILE 14 N 0.00 1.25 -0.14 2.25 2.04 -0.76 -3.25 117.51 118.91 2elj h ILE 14 Ca -0.00 -2.37 -0.09 0.00 1.00 0.00 0.00 64.86 63.40 2elj h ILE 14 Cb 0.51 2.85 -0.01 0.00 -0.74 0.00 0.00 36.82 39.43 2elj h ILE 14 CO 0.01 0.61 -0.31 1.56 0.00 0.00 0.00 178.15 180.03 2elj h GLN 15 N -0.59 0.26 0.00 2.37 4.20 -1.42 -2.36 115.11 117.57 2elj h GLN 15 Ca -0.22 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.37 2elj h GLN 15 Cb 1.50 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.26 2elj h GLN 15 CO 0.01 0.55 -0.09 0.45 -0.67 0.00 0.00 178.83 179.09 2elj h HIS 16 N 0.23 0.00 -1.80 2.96 3.86 -1.31 -3.44 115.15 115.65 2elj h HIS 16 Ca 0.03 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.61 2elj h HIS 16 Cb 0.66 0.00 0.13 0.00 1.06 0.00 0.00 27.41 29.26 2elj h HIS 16 CO 0.01 0.09 -0.41 0.00 0.86 0.00 0.00 177.93 178.47 2elj n ALA 17 N -2.15 -1.93 0.60 2.45 0.00 -0.89 -4.81 120.51 113.78 2elj n ALA 17 Ca 0.00 0.30 0.07 0.00 0.00 0.00 0.00 53.44 53.81 2elj n ALA 17 Cb 0.33 -1.72 0.34 0.00 0.00 0.00 0.00 19.45 18.40 2elj n ALA 17 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2elj n PRO 18 N 0.87 0.12 -2.53 0.00 -0.04 -1.26 -2.87 135.00 129.28 2elj n PRO 18 Ca 0.13 0.20 -0.12 0.00 -0.04 0.00 0.00 63.50 63.67 2elj n PRO 18 Cb 0.33 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.32 2elj n PRO 18 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2elj n ASP 19 N -1.38 2.88 -1.63 3.54 5.75 -1.26 -4.80 116.55 119.64 2elj n ASP 19 Ca 0.05 -2.84 0.09 0.00 -0.01 0.00 0.00 54.79 52.08 2elj n ASP 19 Cb 0.14 -0.45 0.37 0.00 -1.03 0.00 0.00 41.12 40.15 2elj n ASP 19 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2elj n TYR 20 N -0.52 1.64 -0.03 2.11 9.36 -1.14 -4.18 117.16 124.40 2elj n TYR 20 Ca 0.22 -0.66 0.00 0.00 3.32 0.00 0.00 57.90 60.78 2elj n TYR 20 Cb 0.83 -0.33 -0.10 0.00 -0.63 0.00 0.00 39.34 39.11 2elj n TYR 20 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2elj n ALA 21 N 0.86 2.10 0.33 2.98 0.00 -1.26 -4.44 120.51 121.09 2elj n ALA 21 Ca 0.26 -0.58 -0.03 0.00 0.00 0.00 0.00 53.44 53.09 2elj n ALA 21 Cb 0.99 -0.25 0.09 0.00 0.00 0.00 0.00 19.45 20.28 2elj n ALA 21 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2elj n LEU 22 N -2.22 3.43 -4.31 0.00 -0.00 -1.26 -4.78 117.00 107.86 2elj n LEU 22 Ca -0.11 -1.76 -0.38 0.00 -0.00 0.00 0.00 56.01 53.76 2elj n LEU 22 Cb 0.63 -0.59 -0.12 0.00 -0.00 0.00 0.00 43.42 43.34 2elj n LEU 22 CO 0.28 0.53 -0.26 -0.76 -0.00 0.00 0.00 177.39 177.18 2elj s LEU 23 N -0.98 4.09 0.44 1.47 1.43 -1.26 -5.08 118.68 118.79 2elj s LEU 23 Ca 0.18 -0.91 -0.23 0.00 -1.03 0.00 0.00 54.13 52.14 2elj s LEU 23 Cb 0.14 -1.88 -0.11 0.00 0.03 0.00 0.00 46.19 44.38 2elj s LEU 23 CO 0.04 -0.26 0.81 -1.20 0.23 0.00 0.00 176.35 175.98 2elj n SER 24 N 4.85 0.33 -0.25 2.29 7.64 -1.26 -4.22 113.62 122.99 2elj n SER 24 Ca -0.14 0.96 0.24 0.00 1.01 0.00 0.00 58.87 60.94 2elj n SER 24 Cb 0.46 -1.26 0.44 0.00 -1.01 0.00 0.00 64.21 62.84 2elj n SER 24 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2elj n ASN 25 N 0.68 0.24 -0.04 6.43 5.15 -1.26 0.23 115.26 126.70 2elj n ASN 25 Ca 0.11 1.27 -0.15 0.00 -0.60 0.00 0.00 54.58 55.21 2elj n ASN 25 Cb 0.40 -0.61 -0.08 0.00 -0.53 0.00 0.00 39.78 38.96 2elj n ASN 25 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 2elj h ASP 26 N 0.00 0.56 0.05 1.20 3.58 -2.02 -3.22 116.42 116.58 2elj h ASP 26 Ca 0.64 -0.59 0.02 0.00 0.42 0.00 0.00 57.03 57.52 2elj h ASP 26 Cb 1.67 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 42.52 2elj h ASP 26 CO -0.60 1.06 -0.23 -0.33 -2.88 0.00 0.00 179.24 176.26 2elj h GLU 27 N 0.10 -0.37 -0.65 0.28 5.08 0.26 -2.67 114.58 116.62 2elj h GLU 27 Ca -0.01 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.49 2elj h GLU 27 Cb 1.00 0.08 -0.12 0.00 0.50 0.00 0.00 28.75 30.21 2elj h GLU 27 CO 0.08 -0.25 -0.31 1.96 -1.00 0.00 0.00 179.01 179.49 2elj h GLN 28 N -0.39 -0.12 -0.37 2.33 4.20 -1.28 -1.62 115.11 117.87 2elj h GLN 28 Ca 0.05 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.81 2elj h GLN 28 Cb 0.44 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.18 2elj h GLN 28 CO -0.17 -0.08 -0.46 1.96 -0.67 0.00 0.00 178.83 179.41 2elj h GLN 29 N -0.12 -0.30 -0.10 1.46 1.08 -1.48 -1.94 115.11 113.70 2elj h GLN 29 Ca 0.26 0.02 0.02 0.00 -1.45 0.00 0.00 58.65 57.50 2elj h GLN 29 Cb 0.55 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.00 2elj h GLN 29 CO -0.72 -0.20 -0.40 1.25 -0.95 0.00 0.00 178.83 177.82 2elj h LEU 30 N -0.31 -1.27 -0.88 1.46 5.85 -1.19 0.01 115.31 118.99 2elj h LEU 30 Ca 0.06 0.15 0.37 0.00 0.84 0.00 0.00 57.88 59.30 2elj h LEU 30 Cb 0.48 0.49 -0.16 0.00 0.37 0.00 0.00 40.66 41.85 2elj h LEU 30 CO -0.51 -0.35 0.47 0.00 -0.34 0.00 0.00 178.44 177.70 2elj h ILE 32 N 0.00 1.30 0.56 0.00 2.04 -0.28 0.25 117.51 121.38 2elj h ILE 32 Ca 0.74 -1.74 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 2elj h ILE 32 Cb 1.96 1.84 0.01 0.00 -0.74 0.00 0.00 36.82 39.88 2elj h ILE 32 CO -0.68 0.55 -0.27 1.56 0.00 0.00 0.00 178.15 179.31 2elj h GLN 33 N 0.45 -0.72 0.00 2.37 4.20 0.35 -2.89 115.11 118.87 2elj h GLN 33 Ca -0.01 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2elj h GLN 33 Cb 1.14 0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.08 2elj h GLN 33 CO 0.11 -0.42 0.00 1.28 -0.67 0.00 0.00 178.83 179.14 2elj n LEU 34 N -5.32 0.00 -3.96 1.46 4.77 0.40 -4.90 117.00 109.45 2elj n LEU 34 Ca -0.11 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.57 2elj n LEU 34 Cb 0.33 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2elj n LEU 34 CO 0.31 0.00 -0.23 0.29 -1.33 0.00 0.00 177.39 176.43 2elj n LYS 35 N -0.90 -2.28 -5.02 3.23 5.02 0.21 -4.96 118.16 113.46 2elj n LYS 35 Ca 0.17 0.34 -0.32 0.00 -2.02 0.00 0.00 58.31 56.49 2elj n LYS 35 Cb 0.08 -4.13 -0.14 0.00 -0.02 0.00 0.00 35.03 30.82 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 -3.88 2.54 0.56 -0.18 1.01 0.64 -5.01 121.20 116.89 2elj s ILE 36 Ca 0.14 -1.00 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 2elj s ILE 36 Cb -0.06 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.39 2elj s ILE 36 CO 0.91 0.53 1.03 -0.76 0.00 0.00 0.00 174.94 176.64 2elj s LEU 37 N -0.84 3.55 0.32 2.97 1.43 -1.26 -4.66 118.68 120.18 2elj s LEU 37 Ca 0.11 1.72 0.11 0.00 -1.03 0.00 0.00 54.13 55.04 2elj s LEU 37 Cb -0.10 -4.52 0.52 0.00 0.03 0.00 0.00 46.19 42.12 2elj s LEU 37 CO 0.01 -0.94 1.72 1.55 0.23 0.00 0.00 176.35 178.91 2elj h PRO 38 N 0.62 0.05 0.93 1.29 0.13 -1.84 -1.43 132.00 131.75 2elj h PRO 38 Ca -0.47 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 2elj h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2elj h PRO 38 CO 0.59 0.52 -0.49 -0.22 -0.23 0.00 0.00 178.00 178.17 2elj h LYS 39 N 0.04 -1.26 -0.37 0.86 1.63 -1.93 -1.67 116.57 113.87 2elj h LYS 39 Ca -0.00 0.09 -0.15 0.00 -0.85 0.00 0.00 60.65 59.73 2elj h LYS 39 Cb 0.87 0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 32.78 2elj h LYS 39 CO 0.06 -0.84 -0.36 -1.00 -3.45 0.00 0.00 179.45 173.87 2elj h PRO 40 N -1.31 0.89 -0.64 1.90 0.13 -1.98 -3.08 132.00 127.92 2elj h PRO 40 Ca -0.13 -0.47 0.10 0.00 -0.87 0.00 0.00 66.00 64.64 2elj h PRO 40 Cb 1.02 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.12 2elj h PRO 40 CO 0.18 1.11 0.43 -0.92 -0.23 0.00 0.00 178.00 178.58 2elj h TYR 41 N 0.70 0.50 -0.24 1.56 5.03 -1.28 -1.71 116.97 121.52 2elj h TYR 41 Ca 0.06 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.34 2elj h TYR 41 Cb 0.95 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 39.06 2elj h TYR 41 CO 0.07 0.23 -0.02 -0.07 -1.32 0.00 0.00 178.16 177.05 2elj h LEU 42 N 0.46 0.44 0.04 2.82 3.38 -1.21 -1.62 115.31 119.62 2elj h LEU 42 Ca 0.30 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.96 2elj h LEU 42 Cb 0.55 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2elj h LEU 42 CO -0.09 0.67 -0.41 0.58 0.09 0.00 0.00 178.44 179.28 2elj h VAL 43 N 0.20 0.17 -0.57 1.22 2.07 -1.31 0.03 116.25 118.06 2elj h VAL 43 Ca 0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 2elj h VAL 43 Cb 0.46 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2elj h VAL 43 CO 0.02 0.00 0.33 0.17 0.02 0.00 0.00 177.57 178.11 2elj h LEU 44 N -0.59 0.69 -0.32 2.57 8.10 -1.53 -2.49 115.31 121.74 2elj h LEU 44 Ca 0.04 -0.04 0.01 0.00 0.11 0.00 0.00 57.88 58.00 2elj h LEU 44 Cb 0.65 -0.17 -0.02 0.00 -0.44 0.00 0.00 40.66 40.68 2elj h LEU 44 CO -0.29 0.54 0.20 0.50 -4.11 0.00 0.00 178.44 175.28 2elj h LYS 45 N 0.79 0.39 -0.59 0.17 3.64 -0.26 -1.80 116.57 118.92 2elj h LYS 45 Ca 0.21 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 2elj h LYS 45 Cb -0.01 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 2elj h LYS 45 CO -0.04 0.26 0.29 0.93 -2.27 0.00 0.00 179.45 178.62 2elj h GLU 46 N 0.41 0.82 -0.07 1.90 4.39 -0.60 -2.81 114.58 118.61 2elj h GLU 46 Ca 0.12 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2elj h GLU 46 Cb -0.03 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.46 2elj h GLU 46 CO -0.04 0.63 0.03 0.28 -1.16 0.00 0.00 179.01 178.75 2elj h VAL 47 N 0.82 1.14 -0.93 3.13 2.07 -1.04 -0.80 116.25 120.64 2elj h VAL 47 Ca 0.21 -0.42 0.26 0.00 0.82 0.00 0.00 66.70 67.56 2elj h VAL 47 Cb 0.07 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 2elj h VAL 47 CO -0.03 0.12 0.65 0.24 0.02 0.00 0.00 177.57 178.58 2elj h MET 48 N -0.04 0.10 0.00 1.57 2.86 -1.08 -0.89 114.93 117.45 2elj h MET 48 Ca 0.02 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 2elj h MET 48 Cb 0.17 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2elj h MET 48 CO -0.00 0.07 -0.19 0.74 1.06 0.00 0.00 176.91 178.59 2elj h PHE 49 N 0.11 0.00 -0.48 -0.22 0.04 -1.38 -1.96 116.94 113.05 2elj h PHE 49 Ca 0.46 0.00 0.14 0.00 2.80 0.00 0.00 57.97 61.37 2elj h PHE 49 Cb 1.64 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.77 2elj h PHE 49 CO -0.00 0.87 0.53 0.00 -0.60 0.00 0.00 178.31 179.11 2elj h ARG 50 N -1.00 0.00 0.05 1.51 3.08 -0.25 0.12 114.38 117.89 2elj h ARG 50 Ca -0.05 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.66 2elj h ARG 50 Cb 0.86 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.87 2elj h ARG 50 CO -0.03 0.00 -2.03 -1.91 -1.07 0.00 0.00 179.97 174.93 2elj n GLU 51 N -3.65 0.69 0.28 0.04 4.07 -0.43 -3.40 120.64 118.24 2elj n GLU 51 Ca 0.09 0.22 0.16 0.00 -0.06 0.00 0.00 57.16 57.57 2elj n GLU 51 Cb 0.72 -1.68 0.81 0.00 -0.06 0.00 0.00 31.44 31.23 2elj n GLU 51 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2elj h LEU 52 N 0.03 0.00 0.11 4.31 3.38 -0.01 -2.58 115.31 120.55 2elj h LEU 52 Ca -0.42 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.21 2elj h LEU 52 Cb 2.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.77 2elj h LEU 52 CO 0.05 0.07 -1.85 0.17 0.09 0.00 0.00 178.44 176.97 2elj h LEU 53 N 0.00 0.38 -0.69 1.67 8.10 -1.27 -1.46 115.31 122.04 2elj h LEU 53 Ca -0.00 -0.74 0.01 0.00 0.11 0.00 0.00 57.88 57.26 2elj h LEU 53 Cb 0.34 -0.12 -0.04 0.00 -0.44 0.00 0.00 40.66 40.40 2elj h LEU 53 CO 0.01 1.65 0.45 0.50 -4.11 0.00 0.00 178.44 176.94 2elj h LYS 54 N 0.07 0.88 0.00 0.17 3.64 -1.50 -2.87 116.57 116.95 2elj h LYS 54 Ca -0.36 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 58.80 2elj h LYS 54 Cb 2.04 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 33.63 2elj h LYS 54 CO 0.11 0.59 -1.40 0.25 -2.27 0.00 0.00 179.45 176.72 2elj n THR 55 N -4.62 1.15 0.00 1.00 -2.24 -1.00 -4.97 114.28 103.60 2elj n THR 55 Ca 0.06 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 2elj n THR 55 Cb 0.03 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 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 1.39 1.63 0.00 3.38 0.00 -0.61 -4.61 105.19 106.37 2elj n GLY 56 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.00 -0.14 2.58 -0.02 0.00 -0.85 -4.87 105.19 99.89 2elj n GLY 57 Ca 0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 46.02 45.62 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 2.72 -4.57 1.61 4.13 -1.26 -5.07 115.26 112.81 2elj n ASN 58 Ca 0.00 -3.03 -0.34 0.00 1.68 0.00 0.00 54.58 52.89 2elj n ASN 58 Cb 0.00 -0.49 -0.11 0.00 -1.54 0.00 0.00 39.78 37.64 2elj n ASN 58 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2elj s LEU 59 N -3.35 3.53 0.04 3.41 2.96 -1.26 -5.05 118.68 118.95 2elj s LEU 59 Ca 0.35 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 54.25 2elj s LEU 59 Cb 0.42 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 45.22 2elj s LEU 59 CO -0.04 0.19 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.70 2elj s SER 60 N 0.25 0.50 0.19 3.68 0.01 -1.26 -4.97 113.70 112.09 2elj s SER 60 Ca 0.00 -0.69 -0.08 0.00 1.31 0.00 0.00 55.95 56.49 2elj s SER 60 Cb -0.13 0.11 0.28 0.00 0.21 0.00 0.00 66.02 66.49 2elj s SER 60 CO 0.02 -0.38 1.12 0.29 0.41 0.00 0.00 173.24 174.70 2elj n LYS 61 N 1.02 -0.10 -0.32 12.44 4.01 -1.26 0.11 118.16 134.06 2elj n LYS 61 Ca -0.20 1.11 0.03 0.00 -0.51 0.00 0.00 58.31 58.75 2elj n LYS 61 Cb 0.57 -1.66 0.11 0.00 -0.51 0.00 0.00 35.03 33.54 2elj n LYS 61 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 2elj h SER 62 N 0.00 -0.90 0.00 4.39 0.02 -2.00 0.97 113.55 116.03 2elj h SER 62 Ca 0.31 0.27 -0.06 0.00 -0.84 0.00 0.00 61.79 61.48 2elj h SER 62 Cb 0.49 0.57 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 2elj h SER 62 CO -0.73 -0.30 -0.31 0.00 -1.14 0.00 0.00 176.83 174.35 2elj h ALA 63 N 1.82 0.06 -0.99 3.77 0.00 0.42 -3.37 119.26 120.98 2elj h ALA 63 Ca 0.42 -0.64 0.15 0.00 0.00 0.00 0.00 54.91 54.83 2elj h ALA 63 Cb 0.65 0.19 -0.15 0.00 0.00 0.00 0.00 17.79 18.47 2elj h ALA 63 CO -0.92 0.18 -0.41 0.00 0.00 0.00 0.00 179.25 178.10 2elj h ARG 65 N -0.00 0.29 0.00 0.00 3.08 -0.99 -0.60 114.38 116.15 2elj h ARG 65 Ca 0.32 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.31 2elj h ARG 65 Cb 0.57 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2elj h ARG 65 CO -0.98 0.19 -0.27 1.49 -1.07 0.00 0.00 179.97 179.33 2elj h GLU 66 N 0.30 0.00 -0.72 0.04 4.81 0.12 -3.37 114.58 115.76 2elj h GLU 66 Ca 0.66 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 60.01 2elj h GLU 66 Cb 1.81 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 31.06 2elj h GLU 66 CO -0.33 0.77 -0.34 1.25 -0.73 0.00 0.00 179.01 179.62 2elj h LEU 67 N -1.00 -1.22 -9.61 1.64 5.85 0.52 -3.38 115.31 108.10 2elj h LEU 67 Ca -0.07 0.25 -0.55 0.00 0.84 0.00 0.00 57.88 58.36 2elj h LEU 67 Cb 0.85 0.62 -0.04 0.00 0.37 0.00 0.00 40.66 42.47 2elj h LEU 67 CO -0.04 -0.30 0.10 -0.76 -0.34 0.00 0.00 178.44 177.10 2elj s LEU 68 N -10.80 4.50 -1.25 2.25 1.43 -0.33 -4.99 118.68 109.48 2elj s LEU 68 Ca -0.14 1.41 -0.11 0.00 -1.03 0.00 0.00 54.13 54.26 2elj s LEU 68 Cb 0.18 -3.13 0.17 0.00 0.03 0.00 0.00 46.19 43.44 2elj s LEU 68 CO 0.70 0.13 1.72 0.59 0.23 0.00 0.00 176.35 179.72 2elj n ASN 69 N 2.27 5.16 -2.39 2.29 3.02 -1.26 -4.78 115.26 119.56 2elj n ASN 69 Ca -0.06 -3.07 -0.09 0.00 -0.03 0.00 0.00 54.58 51.33 2elj n ASN 69 Cb 0.50 -1.51 -0.01 0.00 -0.61 0.00 0.00 39.78 38.15 2elj n ASN 69 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2elj n ILE 70 N 3.74 0.00 -1.32 2.41 -5.35 -1.26 -5.16 119.36 112.42 2elj n ILE 70 Ca 0.38 -1.14 -0.32 0.00 -0.27 0.00 0.00 62.75 61.41 2elj n ILE 70 Cb 0.38 0.77 0.10 0.00 -1.74 0.00 0.00 39.64 39.15 2elj n ILE 70 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2elj s ASP 71 N -2.54 4.26 0.09 7.28 1.11 -1.26 -4.91 116.67 120.70 2elj s ASP 71 Ca 0.18 2.08 -0.16 0.00 0.18 0.00 0.00 52.55 54.83 2elj s ASP 71 Cb -0.01 -2.56 -0.10 0.00 1.07 0.00 0.00 42.92 41.32 2elj s ASP 71 CO 0.13 -2.20 1.40 1.55 1.18 0.00 0.00 175.17 177.23 2elj h PRO 72 N -0.77 0.63 -0.42 8.23 0.13 -1.98 -2.25 132.00 135.57 2elj h PRO 72 Ca -0.45 -0.33 -0.14 0.00 -0.87 0.00 0.00 66.00 64.21 2elj h PRO 72 Cb 1.26 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 2elj h PRO 72 CO 0.50 0.93 -0.29 0.82 -0.23 0.00 0.00 178.00 179.73 2elj h ILE 73 N 0.35 1.27 -0.63 -3.56 5.03 -2.01 -2.92 117.51 115.04 2elj h ILE 73 Ca 0.04 -1.46 -0.06 0.00 -0.12 0.00 0.00 64.86 63.27 2elj h ILE 73 Cb 0.82 1.25 -0.03 0.00 -3.03 0.00 0.00 36.82 35.83 2elj h ILE 73 CO 0.06 0.49 0.17 0.11 -0.68 0.00 0.00 178.15 178.31 2elj h LYS 74 N 0.78 0.99 0.11 2.37 1.79 -1.95 -3.11 116.57 117.55 2elj h LYS 74 Ca 0.09 -0.23 0.01 0.00 -2.18 0.00 0.00 60.65 58.34 2elj h LYS 74 Cb 0.86 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.36 2elj h LYS 74 CO 0.08 0.89 -0.16 0.00 -1.08 0.00 0.00 179.45 179.17 2elj h ALA 75 N 1.06 -0.28 -0.83 3.86 0.00 -1.33 -2.85 119.26 118.89 2elj h ALA 75 Ca 0.20 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.21 2elj h ALA 75 Cb 0.33 0.25 -0.14 0.00 0.00 0.00 0.00 17.79 18.23 2elj h ALA 75 CO -0.00 -0.69 -0.31 0.09 0.00 0.00 0.00 179.25 178.34 2elj n ASN 76 N -5.29 -0.51 -0.04 0.00 3.02 -1.11 0.73 115.26 112.05 2elj n ASN 76 Ca -0.07 1.45 -0.08 0.00 -0.03 0.00 0.00 54.58 55.85 2elj n ASN 76 Cb 0.20 -0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 39.01 2elj n ASN 76 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2elj h ARG 77 N 0.00 -0.06 -0.48 3.52 2.47 -1.58 -1.72 114.38 116.53 2elj h ARG 77 Ca 0.30 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 59.06 2elj h ARG 77 Cb 0.51 0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.81 2elj h ARG 77 CO -0.83 -0.04 0.27 0.82 0.56 0.00 0.00 179.97 180.75 2elj h ILE 78 N -0.07 1.02 0.03 2.04 2.04 0.39 -1.84 117.51 121.11 2elj h ILE 78 Ca 0.12 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.82 2elj h ILE 78 Cb 0.24 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.71 2elj h ILE 78 CO -0.26 0.10 -0.33 0.22 0.00 0.00 0.00 178.15 177.87 2elj h TYR 79 N 0.54 -0.92 -0.19 1.37 5.03 -0.07 -2.54 116.97 120.19 2elj h TYR 79 Ca 0.20 0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.59 2elj h TYR 79 Cb 0.05 0.40 -0.05 0.00 1.55 0.00 0.00 36.73 38.69 2elj h TYR 79 CO -0.08 -0.43 -0.13 0.22 -1.32 0.00 0.00 178.16 176.43 2elj h ASP 80 N -0.50 -0.41 -0.98 -2.11 3.58 -1.13 -2.15 116.42 112.72 2elj h ASP 80 Ca 0.05 0.09 0.26 0.00 0.42 0.00 0.00 57.03 57.85 2elj h ASP 80 Cb 0.58 0.21 -0.18 0.00 1.72 0.00 0.00 39.33 41.66 2elj h ASP 80 CO -0.26 -0.16 -0.03 0.33 -2.88 0.00 0.00 179.24 176.24 2elj n PHE 81 N -5.28 0.57 -0.34 0.28 -0.00 -0.71 0.16 117.46 112.14 2elj n PHE 81 Ca -0.02 1.19 0.02 0.00 -0.00 0.00 0.00 57.45 58.64 2elj n PHE 81 Cb 0.20 -1.20 0.16 0.00 -0.00 0.00 0.00 39.48 38.64 2elj n PHE 81 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 2elj h PHE 82 N 0.00 1.10 -0.13 -5.13 -1.00 -1.16 -1.10 116.94 109.51 2elj h PHE 82 Ca 0.57 0.03 -0.10 0.00 2.81 0.00 0.00 57.97 61.28 2elj h PHE 82 Cb 1.13 -0.36 -0.01 0.00 3.61 0.00 0.00 35.95 40.32 2elj h PHE 82 CO -0.55 0.56 -0.35 1.96 -1.61 0.00 0.00 178.31 178.32 2elj h GLN 83 N 1.07 0.26 0.00 1.51 4.20 0.16 -2.50 115.11 119.82 2elj h GLN 83 Ca 0.41 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.97 2elj h GLN 83 Cb 0.18 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 2elj h GLN 83 CO -0.18 0.58 -0.19 0.77 -0.67 0.00 0.00 178.83 179.15 2elj h SER 84 N 0.23 0.00 -0.68 1.46 0.02 0.11 -2.26 113.55 112.42 2elj h SER 84 Ca 0.03 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.73 2elj h SER 84 Cb 0.73 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.12 2elj h SER 84 CO 0.06 0.19 0.32 0.00 -1.14 0.00 0.00 176.83 176.25 2elj n GLN 85 N -3.62 2.98 -2.60 3.45 1.13 -0.96 -4.89 117.38 112.88 2elj n GLN 85 Ca -0.01 -2.56 -0.04 0.00 -1.94 0.00 0.00 57.00 52.45 2elj n GLN 85 Cb 0.32 -2.05 -0.01 0.00 0.11 0.00 0.00 30.24 28.61 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 -0.28 -1.03 0.06 1.08 2.85 -0.85 -4.72 115.26 112.37 2elj n ASN 86 Ca 0.39 0.31 -0.10 0.00 -0.11 0.00 0.00 54.58 55.06 2elj n ASN 86 Cb 1.30 -1.01 -0.13 0.00 1.24 0.00 0.00 39.78 41.18 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 -0.08 0.15 -0.01 1.20 6.55 -1.71 -3.50 115.95 118.54 2elj h TRP 87 Ca -0.06 -0.11 0.00 0.00 0.95 0.00 0.00 58.89 59.67 2elj h TRP 87 Cb 0.99 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 29.28 2elj h TRP 87 CO 0.84 1.09 0.00 -1.33 -1.05 0.00 0.00 178.44 177.99