#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 0.32 0.31 1.61 0.15 -1.26 -5.15 113.70 109.68 2elj s SER 2 Ca 0.00 -0.71 -0.24 0.00 0.70 0.00 0.00 55.95 55.69 2elj s SER 2 Cb 0.00 0.18 -0.10 0.00 -1.71 0.00 0.00 66.02 64.40 2elj s SER 2 CO 0.00 -0.49 0.91 -0.55 1.20 0.00 0.00 173.24 174.30 2elj s SER 3 N -2.28 7.25 0.24 5.45 0.15 -1.26 -5.07 113.70 118.19 2elj s SER 3 Ca -0.03 1.75 0.06 0.00 0.70 0.00 0.00 55.95 58.43 2elj s SER 3 Cb 0.00 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 2elj s SER 3 CO -0.06 -0.08 0.28 -0.83 1.20 0.00 0.00 173.24 173.75 2elj s GLY 4 N -1.68 1.33 -0.00 9.45 0.00 -1.26 -5.12 107.32 110.05 2elj s GLY 4 Ca 0.50 -1.31 -0.01 0.00 0.00 0.00 0.00 44.72 43.89 2elj s GLY 4 CO 0.22 -1.34 0.13 -1.35 0.00 0.00 0.00 173.10 170.76 2elj s SER 5 N -3.87 6.01 0.07 1.64 1.04 -1.26 -5.12 113.70 112.21 2elj s SER 5 Ca 0.33 0.23 0.08 0.00 0.48 0.00 0.00 55.95 57.08 2elj s SER 5 Cb -0.09 -1.80 -0.03 0.00 0.10 0.00 0.00 66.02 64.20 2elj s SER 5 CO 0.27 0.26 -0.22 -0.55 0.98 0.00 0.00 173.24 173.98 2elj s SER 6 N -1.89 2.63 0.23 7.02 0.15 -1.26 -5.06 113.70 115.53 2elj s SER 6 Ca 0.26 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.30 2elj s SER 6 Cb -0.12 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.00 2elj s SER 6 CO 0.17 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.35 2elj n GLY 7 N 1.49 -3.55 3.72 9.45 0.00 -1.26 -4.90 105.19 110.14 2elj n GLY 7 Ca -0.18 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 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 -3.14 7.21 0.98 1.61 0.01 -1.26 -5.04 114.94 115.32 2elj s ASN 8 Ca 0.00 1.46 -0.11 0.00 -0.71 0.00 0.00 52.86 53.50 2elj s ASN 8 Cb 0.00 -2.50 0.18 0.00 0.41 0.00 0.00 41.25 39.34 2elj s ASN 8 CO 0.00 -0.16 1.10 0.00 -1.51 0.00 0.00 177.10 176.53 2elj s MET 9 N 0.73 0.51 0.47 -0.60 0.23 -1.26 -5.06 119.30 114.33 2elj s MET 9 Ca 0.44 1.22 0.02 0.00 -1.03 0.00 0.00 55.69 56.35 2elj s MET 9 Cb -0.20 -1.69 -0.01 0.00 -1.53 0.00 0.00 34.83 31.40 2elj s MET 9 CO 0.24 -2.87 0.06 0.99 -2.03 0.00 0.00 175.02 171.41 2elj s THR 10 N -2.64 0.85 0.16 3.16 2.01 -1.26 -5.05 115.64 112.86 2elj s THR 10 Ca 0.67 -2.00 -0.09 0.00 0.31 0.00 0.00 61.69 60.57 2elj s THR 10 Cb -0.23 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 2elj s THR 10 CO 0.60 0.00 1.49 0.40 -0.69 0.00 0.00 174.62 176.41 2elj h ILE 11 N 1.51 1.28 -0.69 1.82 5.03 -1.95 -3.00 117.51 121.51 2elj h ILE 11 Ca -0.40 -1.60 0.15 0.00 -0.12 0.00 0.00 64.86 62.90 2elj h ILE 11 Cb 1.30 1.46 -0.04 0.00 -3.03 0.00 0.00 36.82 36.51 2elj h ILE 11 CO 0.65 0.53 0.47 -1.28 -0.68 0.00 0.00 178.15 177.84 2elj h SER 12 N 0.69 0.27 -0.05 1.72 0.87 -1.99 -1.39 113.55 113.67 2elj h SER 12 Ca 0.05 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2elj h SER 12 Cb 1.00 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.92 2elj h SER 12 CO 0.10 0.14 0.02 0.44 -0.53 0.00 0.00 176.83 177.00 2elj h ASP 13 N 0.29 0.07 0.42 6.23 5.19 -1.94 -0.47 116.42 126.20 2elj h ASP 13 Ca 0.34 -0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.59 2elj h ASP 13 Cb 0.91 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 40.39 2elj h ASP 13 CO -0.08 0.20 -0.34 0.40 -3.12 0.00 0.00 179.24 176.30 2elj h ILE 14 N -0.07 0.30 -0.38 0.35 2.04 -1.34 -2.07 117.51 116.34 2elj h ILE 14 Ca 0.02 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.94 2elj h ILE 14 Cb 0.15 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2elj h ILE 14 CO -0.00 0.00 0.26 1.56 0.00 0.00 0.00 178.15 179.97 2elj h GLN 15 N -0.75 0.21 -0.17 2.37 4.20 -1.46 -2.17 115.11 117.34 2elj h GLN 15 Ca -0.04 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.69 2elj h GLN 15 Cb 0.65 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.36 2elj h GLN 15 CO -0.02 0.14 0.01 1.25 -0.67 0.00 0.00 178.83 179.54 2elj h HIS 16 N 0.22 0.00 -2.63 2.96 2.76 -0.37 -3.43 115.15 114.66 2elj h HIS 16 Ca 0.17 0.01 -0.60 0.00 -2.20 0.00 0.00 60.37 57.76 2elj h HIS 16 Cb 0.40 0.02 0.11 0.00 1.55 0.00 0.00 27.41 29.49 2elj h HIS 16 CO -0.00 -0.01 0.23 0.00 -1.30 0.00 0.00 177.93 176.85 2elj n ALA 17 N -2.28 0.11 0.03 5.26 0.00 -0.82 -4.89 120.51 117.92 2elj n ALA 17 Ca -0.03 0.39 -0.06 0.00 0.00 0.00 0.00 53.44 53.74 2elj n ALA 17 Cb 0.09 -2.08 0.13 0.00 0.00 0.00 0.00 19.45 17.59 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 2.25 0.46 0.00 0.00 0.13 -1.87 -2.77 132.00 130.20 2elj h PRO 18 Ca -0.41 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 2elj h PRO 18 Cb 1.33 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2elj h PRO 18 CO 0.62 0.81 0.00 0.38 -0.23 0.00 0.00 178.00 179.58 2elj h ASP 19 N 0.37 0.00 0.28 1.44 2.03 -1.93 -3.22 116.42 115.40 2elj h ASP 19 Ca 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 2elj h ASP 19 Cb 0.91 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.39 2elj h ASP 19 CO 0.08 0.00 -0.34 0.22 -1.03 0.00 0.00 179.24 178.17 2elj h TYR 20 N 0.00 -0.93 -0.93 4.15 3.20 -1.74 -2.59 116.97 118.13 2elj h TYR 20 Ca 0.00 0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.07 2elj h TYR 20 Cb 0.41 0.37 -0.18 0.00 1.54 0.00 0.00 36.73 38.87 2elj h TYR 20 CO 0.00 -0.47 -0.21 0.00 -1.64 0.00 0.00 178.16 175.84 2elj n ALA 21 N -2.66 0.25 -0.32 1.82 0.00 -1.21 -0.39 120.51 117.99 2elj n ALA 21 Ca -0.09 1.02 -0.02 0.00 0.00 0.00 0.00 53.44 54.35 2elj n ALA 21 Cb 0.35 -0.63 0.01 0.00 0.00 0.00 0.00 19.45 19.19 2elj n ALA 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2elj n LEU 22 N -5.51 -0.60 -4.52 0.00 4.77 -0.98 -4.45 117.00 105.72 2elj n LEU 22 Ca 0.16 1.43 -0.58 0.00 -0.03 0.00 0.00 56.01 56.98 2elj n LEU 22 Cb 0.49 -0.30 -0.08 0.00 -2.33 0.00 0.00 43.42 41.20 2elj n LEU 22 CO -0.11 -1.26 0.64 0.18 -1.33 0.00 0.00 177.39 175.52 2elj n LEU 23 N -5.16 0.28 -4.54 2.23 4.77 0.48 -4.88 117.00 110.18 2elj n LEU 23 Ca 0.07 1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 56.91 2elj n LEU 23 Cb 0.30 -0.96 0.23 0.00 -2.33 0.00 0.00 43.42 40.66 2elj n LEU 23 CO -0.11 -1.74 0.56 -0.44 -1.33 0.00 0.00 177.39 174.32 2elj s SER 24 N 0.19 1.46 0.18 -1.43 0.01 -1.26 -4.50 113.70 108.35 2elj s SER 24 Ca 0.91 1.67 -0.15 0.00 1.31 0.00 0.00 55.95 59.69 2elj s SER 24 Cb -1.23 -2.36 0.16 0.00 0.21 0.00 0.00 66.02 62.80 2elj s SER 24 CO 0.56 -3.93 1.68 0.78 0.41 0.00 0.00 173.24 172.75 2elj h ASN 25 N -2.43 -0.24 -0.49 2.44 2.35 -1.91 0.20 115.58 115.48 2elj h ASN 25 Ca -0.57 0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.21 2elj h ASN 25 Cb 1.32 0.22 -0.02 0.00 0.05 0.00 0.00 38.32 39.89 2elj h ASN 25 CO 0.48 -0.08 -0.01 0.44 -1.65 0.00 0.00 177.43 176.61 2elj h ASP 26 N 0.09 0.87 -0.22 5.81 5.19 -2.02 -3.07 116.42 123.07 2elj h ASP 26 Ca 0.23 -0.31 0.01 0.00 -0.62 0.00 0.00 57.03 56.34 2elj h ASP 26 Cb 0.35 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 2elj h ASP 26 CO -0.41 0.97 0.12 -0.33 -3.12 0.00 0.00 179.24 176.47 2elj h GLU 27 N 0.74 0.24 -0.21 3.56 5.08 -1.62 -3.00 114.58 119.38 2elj h GLU 27 Ca 0.14 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.53 2elj h GLU 27 Cb 0.53 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.66 2elj h GLU 27 CO 0.03 0.16 -0.41 1.96 -1.00 0.00 0.00 179.01 179.75 2elj h GLN 28 N 0.25 -0.42 -0.76 2.33 4.20 -0.59 -0.90 115.11 119.22 2elj h GLN 28 Ca 0.09 0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.90 2elj h GLN 28 Cb 0.01 0.10 -0.10 0.00 0.30 0.00 0.00 27.48 27.78 2elj h GLN 28 CO -0.05 -0.28 -0.53 1.96 -0.67 0.00 0.00 178.83 179.26 2elj h GLN 29 N -0.43 -0.11 0.27 1.46 1.08 -1.43 -0.76 115.11 115.19 2elj h GLN 29 Ca 0.10 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2elj h GLN 29 Cb 0.61 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.04 2elj h GLN 29 CO -0.44 -0.07 -0.39 1.25 -0.95 0.00 0.00 178.83 178.23 2elj h LEU 30 N -0.11 -1.11 -0.88 1.46 5.85 -1.38 -1.57 115.31 117.57 2elj h LEU 30 Ca 0.12 0.10 0.34 0.00 0.84 0.00 0.00 57.88 59.29 2elj h LEU 30 Cb 0.43 0.38 -0.16 0.00 0.37 0.00 0.00 40.66 41.68 2elj h LEU 30 CO -0.77 -0.48 0.39 0.00 -0.34 0.00 0.00 178.44 177.24 2elj h ILE 32 N 0.00 1.21 0.10 0.00 2.04 -0.34 0.06 117.51 120.58 2elj h ILE 32 Ca 0.70 -0.92 0.02 0.00 1.00 0.00 0.00 64.86 65.66 2elj h ILE 32 Cb 1.80 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 39.67 2elj h ILE 32 CO -0.70 0.23 -0.20 1.56 0.00 0.00 0.00 178.15 179.04 2elj h GLN 33 N -0.48 -0.36 0.00 2.37 1.08 0.14 -0.76 115.11 117.09 2elj h GLN 33 Ca -0.01 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2elj h GLN 33 Cb 0.43 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 2elj h GLN 33 CO 0.01 -0.24 0.00 1.28 -0.95 0.00 0.00 178.83 178.93 2elj n LEU 34 N -5.33 0.50 -2.51 1.46 4.77 0.20 -4.87 117.00 111.22 2elj n LEU 34 Ca -0.06 0.63 -0.20 0.00 -0.03 0.00 0.00 56.01 56.34 2elj n LEU 34 Cb 0.24 -0.57 0.01 0.00 -2.33 0.00 0.00 43.42 40.77 2elj n LEU 34 CO 0.27 -0.51 -0.12 0.29 -1.33 0.00 0.00 177.39 175.99 2elj n LYS 35 N -2.06 -3.10 -3.93 3.23 5.02 -0.14 -4.99 118.16 112.18 2elj n LYS 35 Ca 0.02 0.89 -0.29 0.00 -2.02 0.00 0.00 58.31 56.91 2elj n LYS 35 Cb 0.20 -5.53 -0.04 0.00 -0.02 0.00 0.00 35.03 29.64 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 -3.05 5.35 0.41 -0.18 1.01 -0.32 -4.97 121.20 119.45 2elj s ILE 36 Ca 0.15 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.16 2elj s ILE 36 Cb -0.06 -3.66 -0.07 0.00 0.01 0.00 0.00 42.46 38.67 2elj s ILE 36 CO 0.18 0.05 0.80 -0.76 0.00 0.00 0.00 174.94 175.21 2elj s LEU 37 N -2.78 3.83 0.32 2.97 1.43 -1.26 -4.66 118.68 118.52 2elj s LEU 37 Ca 0.35 1.23 0.10 0.00 -1.03 0.00 0.00 54.13 54.78 2elj s LEU 37 Cb -0.12 -4.11 0.52 0.00 0.03 0.00 0.00 46.19 42.51 2elj s LEU 37 CO 0.28 -0.41 1.71 1.55 0.23 0.00 0.00 176.35 179.72 2elj h PRO 38 N 1.33 0.05 0.63 1.29 0.13 -1.93 -1.95 132.00 131.54 2elj h PRO 38 Ca -0.47 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2elj h PRO 38 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2elj h PRO 38 CO 0.64 0.52 -0.42 -0.22 -0.23 0.00 0.00 178.00 178.28 2elj h LYS 39 N 0.04 -0.96 -0.08 0.86 3.64 -1.94 -1.46 116.57 116.67 2elj h LYS 39 Ca -0.00 0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 2elj h LYS 39 Cb 0.87 0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2elj h LYS 39 CO 0.06 -0.64 -0.07 -1.00 -2.27 0.00 0.00 179.45 175.53 2elj h PRO 40 N -1.00 0.19 -0.75 1.90 0.13 -1.98 -3.01 132.00 127.47 2elj h PRO 40 Ca -0.08 -0.10 0.22 0.00 -0.87 0.00 0.00 66.00 65.17 2elj h PRO 40 Cb 0.82 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.93 2elj h PRO 40 CO 0.06 0.62 0.55 -0.92 -0.23 0.00 0.00 178.00 178.07 2elj h TYR 41 N -0.24 0.00 0.01 1.56 5.03 -1.39 0.19 116.97 122.13 2elj h TYR 41 Ca 0.01 0.00 -0.24 0.00 2.58 0.00 0.00 58.73 61.08 2elj h TYR 41 Cb 0.58 0.00 0.01 0.00 1.55 0.00 0.00 36.73 38.87 2elj h TYR 41 CO 0.09 0.00 -1.00 -0.07 -1.32 0.00 0.00 178.16 175.86 2elj h LEU 42 N 0.00 0.67 0.61 2.82 3.38 -1.18 -2.03 115.31 119.58 2elj h LEU 42 Ca 0.36 -0.54 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 2elj h LEU 42 Cb 1.46 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 42.01 2elj h LEU 42 CO -0.00 1.35 -0.29 0.58 0.09 0.00 0.00 178.44 180.16 2elj h VAL 43 N 0.28 0.21 -0.47 1.22 2.07 -0.53 -2.37 116.25 116.66 2elj h VAL 43 Ca -0.10 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 2elj h VAL 43 Cb 1.64 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2elj h VAL 43 CO 0.18 0.03 0.24 0.17 0.02 0.00 0.00 177.57 178.21 2elj h LEU 44 N -1.10 0.58 -0.37 2.57 8.10 -1.45 -2.55 115.31 121.09 2elj h LEU 44 Ca -0.08 -0.04 0.02 0.00 0.11 0.00 0.00 57.88 57.89 2elj h LEU 44 Cb 0.68 -0.15 -0.03 0.00 -0.44 0.00 0.00 40.66 40.72 2elj h LEU 44 CO 0.14 0.48 0.20 0.50 -4.11 0.00 0.00 178.44 175.65 2elj h LYS 45 N 0.65 0.39 0.02 0.17 3.64 -1.33 -2.83 116.57 117.28 2elj h LYS 45 Ca 0.17 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2elj h LYS 45 Cb 0.05 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2elj h LYS 45 CO -0.02 0.26 -0.05 1.49 -2.27 0.00 0.00 179.45 178.86 2elj h GLU 46 N 0.40 -0.09 -0.93 1.90 4.57 -1.01 -2.81 114.58 116.63 2elj h GLU 46 Ca 0.15 0.01 0.18 0.00 -1.18 0.00 0.00 59.36 58.52 2elj h GLU 46 Cb 0.04 0.02 -0.18 0.00 -0.16 0.00 0.00 28.75 28.48 2elj h GLU 46 CO -0.09 -0.06 -0.23 0.28 -1.18 0.00 0.00 179.01 177.73 2elj h VAL 47 N -0.09 0.07 0.30 0.32 2.07 -1.28 0.42 116.25 118.07 2elj h VAL 47 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2elj h VAL 47 Cb 0.10 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.91 2elj h VAL 47 CO -0.04 0.00 -0.46 0.24 0.02 0.00 0.00 177.57 177.34 2elj h MET 48 N -0.00 -0.79 -0.94 1.57 2.86 -1.38 0.18 114.93 116.43 2elj h MET 48 Ca 0.44 0.05 0.17 0.00 -2.06 0.00 0.00 59.70 58.31 2elj h MET 48 Cb 0.67 0.18 -0.10 0.00 0.06 0.00 0.00 31.60 32.41 2elj h MET 48 CO -0.95 -0.52 0.53 0.74 1.06 0.00 0.00 176.91 177.77 2elj h PHE 49 N -0.82 0.94 0.46 -0.22 0.04 -0.94 0.77 116.94 117.17 2elj h PHE 49 Ca -0.02 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 2elj h PHE 49 Cb 0.77 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.65 2elj h PHE 49 CO -0.31 0.21 -0.22 -0.09 -0.60 0.00 0.00 178.31 177.29 2elj h ARG 50 N 0.70 -0.60 0.00 1.51 2.43 -0.28 -1.05 114.38 117.09 2elj h ARG 50 Ca 0.53 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.73 2elj h ARG 50 Cb 0.80 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2elj h ARG 50 CO -0.38 -0.31 -0.07 1.49 -1.51 0.00 0.00 179.97 179.19 2elj h GLU 51 N -0.85 0.00 -0.02 0.20 4.57 -0.02 -0.34 114.58 118.13 2elj h GLU 51 Ca -0.06 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 57.88 2elj h GLU 51 Cb 0.57 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.17 2elj h GLU 51 CO 0.10 0.07 -0.95 -0.07 -1.18 0.00 0.00 179.01 176.99 2elj h LEU 52 N 0.00 0.68 0.25 1.64 3.38 0.76 -2.92 115.31 119.11 2elj h LEU 52 Ca -0.00 -0.53 -0.34 0.00 0.09 0.00 0.00 57.88 57.10 2elj h LEU 52 Cb 0.32 -0.21 0.04 0.00 0.09 0.00 0.00 40.66 40.90 2elj h LEU 52 CO 0.01 1.33 -1.48 0.17 0.09 0.00 0.00 178.44 178.56 2elj h LEU 53 N 0.31 0.84 0.00 1.67 8.10 -0.69 0.17 115.31 125.71 2elj h LEU 53 Ca -0.09 -0.92 0.02 0.00 0.11 0.00 0.00 57.88 57.00 2elj h LEU 53 Cb 1.59 -0.27 -0.03 0.00 -0.44 0.00 0.00 40.66 41.51 2elj h LEU 53 CO 0.17 1.71 -0.15 0.50 -4.11 0.00 0.00 178.44 176.56 2elj h LYS 54 N 0.13 -0.24 0.00 0.17 3.64 -1.16 -2.56 116.57 116.54 2elj h LYS 54 Ca -0.26 0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.01 2elj h LYS 54 Cb 2.16 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 34.02 2elj h LYS 54 CO 0.27 -0.16 -0.59 1.79 -2.27 0.00 0.00 179.45 178.49 2elj h THR 55 N -0.25 1.06 -0.54 1.00 1.35 -1.64 -3.48 112.91 110.40 2elj h THR 55 Ca 0.05 -2.36 0.00 0.00 -0.55 0.00 0.00 66.41 63.55 2elj h THR 55 Cb 0.32 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 2elj h THR 55 CO -0.14 0.58 0.00 0.61 -0.25 0.00 0.00 175.52 176.31 2elj n GLY 56 N 1.07 0.92 0.42 5.82 0.00 -0.40 -4.58 105.19 108.43 2elj n GLY 56 Ca 0.01 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.55 0.79 2.52 -0.02 0.00 0.47 -5.00 105.19 103.40 2elj n GLY 57 Ca 0.00 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.42 3.21 -4.26 1.61 4.13 -1.26 -5.05 115.26 113.21 2elj n ASN 58 Ca 0.00 -3.16 -0.33 0.00 1.68 0.00 0.00 54.58 52.77 2elj n ASN 58 Cb 0.16 -0.47 -0.15 0.00 -1.54 0.00 0.00 39.78 37.77 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 -3.44 2.45 0.56 3.41 2.96 -1.26 -5.05 118.68 118.31 2elj s LEU 59 Ca 0.38 -0.47 0.04 0.00 -0.22 0.00 0.00 54.13 53.86 2elj s LEU 59 Cb 0.41 -1.55 0.04 0.00 0.50 0.00 0.00 46.19 45.59 2elj s LEU 59 CO -0.06 0.09 0.35 -0.94 -1.32 0.00 0.00 176.35 174.47 2elj s SER 60 N 0.78 4.54 0.41 3.68 1.04 -1.26 -4.98 113.70 117.90 2elj s SER 60 Ca -0.06 -1.36 0.22 0.00 0.48 0.00 0.00 55.95 55.23 2elj s SER 60 Cb -0.15 0.56 0.61 0.00 0.10 0.00 0.00 66.02 67.14 2elj s SER 60 CO 0.00 -1.13 1.69 0.50 0.98 0.00 0.00 173.24 175.29 2elj h LYS 61 N 0.79 0.00 0.11 4.02 1.63 -2.00 -2.57 116.57 118.54 2elj h LYS 61 Ca -0.37 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.16 2elj h LYS 61 Cb 1.31 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.94 2elj h LYS 61 CO 0.59 0.23 -1.39 0.66 -3.45 0.00 0.00 179.45 176.10 2elj h SER 62 N 0.00 0.36 0.46 4.20 4.64 -2.01 -3.33 113.55 117.87 2elj h SER 62 Ca -0.00 -0.84 -0.02 0.00 -0.47 0.00 0.00 61.79 60.45 2elj h SER 62 Cb 0.95 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2elj h SER 62 CO 0.03 1.60 -0.22 0.00 -0.87 0.00 0.00 176.83 177.37 2elj h ALA 63 N -0.06 -0.62 -0.86 5.18 0.00 -1.96 -3.13 119.26 117.80 2elj h ALA 63 Ca -0.30 -0.17 0.15 0.00 0.00 0.00 0.00 54.91 54.59 2elj h ALA 63 Cb 1.73 0.24 -0.15 0.00 0.00 0.00 0.00 17.79 19.61 2elj h ALA 63 CO 0.05 -0.78 -0.31 0.00 0.00 0.00 0.00 179.25 178.21 2elj h ARG 65 N -0.04 0.46 0.16 0.00 3.08 -1.65 0.12 114.38 116.51 2elj h ARG 65 Ca 0.35 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.37 2elj h ARG 65 Cb 0.61 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2elj h ARG 65 CO -0.89 0.31 -0.08 1.49 -1.07 0.00 0.00 179.97 179.73 2elj h GLU 66 N 0.48 -0.20 0.01 0.04 4.81 0.33 -1.98 114.58 118.06 2elj h GLU 66 Ca 0.68 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.94 2elj h GLU 66 Cb 1.41 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.78 2elj h GLU 66 CO -0.53 0.22 -0.51 1.25 -0.73 0.00 0.00 179.01 178.72 2elj h LEU 67 N -0.88 -1.56 -1.24 1.64 5.85 -0.08 -1.32 115.31 117.72 2elj h LEU 67 Ca -0.02 0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.95 2elj h LEU 67 Cb 0.52 0.59 -0.06 0.00 0.37 0.00 0.00 40.66 42.08 2elj h LEU 67 CO 0.04 -0.50 0.55 -0.07 -0.34 0.00 0.00 178.44 178.12 2elj h LEU 68 N -0.64 0.79 -1.00 2.25 3.38 -0.95 -3.46 115.31 115.67 2elj h LEU 68 Ca 0.01 0.01 -0.31 0.00 0.09 0.00 0.00 57.88 57.68 2elj h LEU 68 Cb 0.69 -0.15 0.11 0.00 0.09 0.00 0.00 40.66 41.39 2elj h LEU 68 CO -0.33 0.49 -0.54 -3.20 0.09 0.00 0.00 178.44 174.94 2elj n ASN 69 N -4.50 -5.00 -4.35 -0.43 5.15 -0.50 -5.02 115.26 100.61 2elj n ASN 69 Ca 0.13 -0.43 -0.18 0.00 -0.60 0.00 0.00 54.58 53.50 2elj n ASN 69 Cb 0.25 -4.07 -0.10 0.00 -0.53 0.00 0.00 39.78 35.33 2elj n ASN 69 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2elj s ILE 70 N -3.26 1.25 0.46 -1.44 -4.36 -1.24 -5.08 121.20 107.54 2elj s ILE 70 Ca 0.40 -2.07 -0.16 0.00 -0.26 0.00 0.00 60.65 58.57 2elj s ILE 70 Cb -0.18 -2.33 -0.13 0.00 1.25 0.00 0.00 42.46 41.07 2elj s ILE 70 CO 0.57 -0.36 -0.14 0.47 0.24 0.00 0.00 174.94 175.73 2elj n ASP 71 N -0.45 -3.32 -0.09 4.36 9.92 -1.26 -4.75 116.55 120.96 2elj n ASP 71 Ca -0.06 0.56 -0.12 0.00 -0.53 0.00 0.00 54.79 54.65 2elj n ASP 71 Cb 0.63 -0.74 0.01 0.00 -0.64 0.00 0.00 41.12 40.38 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 -0.05 0.83 -0.34 -0.24 0.13 -1.99 -2.82 132.00 127.52 2elj h PRO 72 Ca -0.36 -0.44 -0.15 0.00 -0.87 0.00 0.00 66.00 64.18 2elj h PRO 72 Cb 1.27 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2elj h PRO 72 CO 0.36 1.08 -0.36 0.82 -0.23 0.00 0.00 178.00 179.67 2elj h ILE 73 N 0.68 1.28 -0.49 -3.56 2.04 -1.99 -1.22 117.51 114.25 2elj h ILE 73 Ca 0.05 -1.53 0.02 0.00 1.00 0.00 0.00 64.86 64.40 2elj h ILE 73 Cb 0.97 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 2elj h ILE 73 CO 0.09 0.50 0.31 0.11 0.00 0.00 0.00 178.15 179.17 2elj h LYS 74 N 0.64 0.60 0.29 2.37 1.79 -1.90 -2.91 116.57 117.45 2elj h LYS 74 Ca 0.05 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.47 2elj h LYS 74 Cb 0.95 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.46 2elj h LYS 74 CO 0.09 0.40 -0.14 0.00 -1.08 0.00 0.00 179.45 178.72 2elj h ALA 75 N 1.20 -0.38 -0.82 3.86 0.00 -1.48 -2.96 119.26 118.68 2elj h ALA 75 Ca 0.19 -0.19 0.27 0.00 0.00 0.00 0.00 54.91 55.17 2elj h ALA 75 Cb -0.02 0.15 -0.15 0.00 0.00 0.00 0.00 17.79 17.76 2elj h ALA 75 CO -0.07 -0.49 0.16 0.09 0.00 0.00 0.00 179.25 178.94 2elj n ASN 76 N -5.08 0.03 0.10 0.00 3.02 -0.46 0.58 115.26 113.45 2elj n ASN 76 Ca -0.09 1.38 -0.13 0.00 -0.03 0.00 0.00 54.58 55.71 2elj n ASN 76 Cb 0.27 -0.56 -0.08 0.00 -0.61 0.00 0.00 39.78 38.79 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 -0.27 0.30 3.52 -0.00 -1.51 -3.16 114.38 113.26 2elj h ARG 77 Ca 0.56 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 60.07 2elj h ARG 77 Cb 1.30 0.06 -0.03 0.00 0.00 0.00 0.00 29.97 31.30 2elj h ARG 77 CO -0.72 0.08 -0.44 0.82 0.00 0.00 0.00 179.97 179.70 2elj h ILE 78 N -0.66 0.12 -0.85 2.04 2.04 0.31 -2.21 117.51 118.29 2elj h ILE 78 Ca -0.03 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.96 2elj h ILE 78 Cb 0.47 0.12 -0.14 0.00 -0.74 0.00 0.00 36.82 36.53 2elj h ILE 78 CO 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 178.15 177.86 2elj n TYR 79 N -5.50 0.00 0.15 1.37 4.19 0.53 0.06 117.16 117.96 2elj n TYR 79 Ca -0.09 1.05 -0.13 0.00 3.31 0.00 0.00 57.90 62.03 2elj n TYR 79 Cb 0.41 -0.81 -0.06 0.00 0.49 0.00 0.00 39.34 39.37 2elj n TYR 79 CO 0.00 0.00 0.00 0.22 0.91 0.00 0.00 176.86 177.99 2elj h ASP 80 N 0.00 -0.60 -0.94 2.98 3.58 -1.44 -2.86 116.42 117.13 2elj h ASP 80 Ca 0.29 0.06 0.14 0.00 0.42 0.00 0.00 57.03 57.94 2elj h ASP 80 Cb 0.50 0.21 -0.15 0.00 1.72 0.00 0.00 39.33 41.61 2elj h ASP 80 CO -0.84 -0.33 -0.40 0.15 -2.88 0.00 0.00 179.24 174.94 2elj h PHE 81 N -0.47 -1.14 -0.95 0.28 3.57 0.24 0.70 116.94 119.18 2elj h PHE 81 Ca 0.00 0.10 0.27 0.00 3.53 0.00 0.00 57.97 61.88 2elj h PHE 81 Cb 0.45 0.63 -0.14 0.00 2.79 0.00 0.00 35.95 39.68 2elj h PHE 81 CO -0.17 -0.40 0.43 0.74 -2.23 0.00 0.00 178.31 176.68 2elj h PHE 82 N -0.03 0.70 0.00 0.41 -1.00 -1.13 1.05 116.94 116.94 2elj h PHE 82 Ca 0.32 0.04 -0.09 0.00 2.81 0.00 0.00 57.97 61.04 2elj h PHE 82 Cb 0.58 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.97 2elj h PHE 82 CO -0.85 -0.16 -0.45 1.96 -1.61 0.00 0.00 178.31 177.20 2elj h GLN 83 N 0.31 0.00 -0.46 1.51 4.20 0.40 -2.13 115.11 118.94 2elj h GLN 83 Ca 0.65 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.44 2elj h GLN 83 Cb 1.38 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.09 2elj h GLN 83 CO -0.61 0.45 0.03 1.03 -0.67 0.00 0.00 178.83 179.06 2elj h SER 84 N 0.00 -0.13 -0.55 1.46 0.87 0.20 0.44 113.55 115.84 2elj h SER 84 Ca -0.00 0.10 -0.27 0.00 -1.23 0.00 0.00 61.79 60.38 2elj h SER 84 Cb 0.84 0.17 -0.16 0.00 -0.44 0.00 0.00 62.40 62.81 2elj h SER 84 CO 0.06 -0.03 0.35 0.00 -0.53 0.00 0.00 176.83 176.67 2elj n GLN 85 N -5.18 1.84 -2.75 2.24 1.13 -1.17 -4.85 117.38 108.63 2elj n GLN 85 Ca 0.04 -1.72 -0.06 0.00 -1.94 0.00 0.00 57.00 53.32 2elj n GLN 85 Cb 0.24 -1.69 -0.01 0.00 0.11 0.00 0.00 30.24 28.89 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 -0.37 -1.10 -0.06 1.08 5.15 0.14 -4.76 115.26 115.35 2elj n ASN 86 Ca 0.33 0.25 -0.13 0.00 -0.60 0.00 0.00 54.58 54.43 2elj n ASN 86 Cb 1.14 -1.07 -0.07 0.00 -0.53 0.00 0.00 39.78 39.26 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 -0.12 0.47 0.00 1.20 6.55 -1.59 -3.49 115.95 118.96 2elj h TRP 87 Ca -0.08 -0.14 0.00 0.00 0.95 0.00 0.00 58.89 59.62 2elj h TRP 87 Cb 1.04 -0.10 0.00 0.00 -0.86 0.00 0.00 29.16 29.24 2elj h TRP 87 CO 0.86 0.76 0.00 0.00 -1.05 0.00 0.00 178.44 179.00