#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 3.83 0.10 1.61 0.15 -1.26 -5.07 113.70 113.06 2elj s SER 2 Ca 0.00 1.67 -0.03 0.00 0.70 0.00 0.00 55.95 58.28 2elj s SER 2 Cb 0.00 -2.34 -0.03 0.00 -1.71 0.00 0.00 66.02 61.94 2elj s SER 2 CO 0.00 -2.44 0.07 -0.44 1.20 0.00 0.00 173.24 171.64 2elj s SER 3 N -3.35 0.31 0.00 5.45 0.01 -1.26 -5.18 113.70 109.68 2elj s SER 3 Ca 0.63 -1.01 0.00 0.00 1.31 0.00 0.00 55.95 56.88 2elj s SER 3 Cb -0.18 0.29 0.00 0.00 0.21 0.00 0.00 66.02 66.34 2elj s SER 3 CO 0.57 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 174.12 2elj n GLY 4 N -0.03 7.35 2.79 3.44 0.00 -1.26 -5.16 105.19 112.32 2elj n GLY 4 Ca -0.10 -2.06 -0.17 0.00 0.00 0.00 0.00 46.02 43.70 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 0.72 0.52 -0.29 1.61 1.04 -1.26 -5.03 113.70 111.00 2elj s SER 5 Ca 0.00 0.18 0.17 0.00 0.48 0.00 0.00 55.95 56.78 2elj s SER 5 Cb 0.00 0.04 0.48 0.00 0.10 0.00 0.00 66.02 66.65 2elj s SER 5 CO 0.00 -0.20 1.11 -1.54 0.98 0.00 0.00 173.24 173.59 2elj n SER 6 N 4.80 2.58 0.00 7.02 3.41 -1.26 -5.07 113.62 125.10 2elj n SER 6 Ca -0.15 -2.65 0.00 0.00 -0.26 0.00 0.00 58.87 55.81 2elj n SER 6 Cb 0.50 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2elj n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2elj n GLY 7 N -0.54 3.64 3.46 5.00 0.00 -1.26 -5.19 105.19 110.30 2elj n GLY 7 Ca 0.18 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2elj n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2elj s ASN 8 N 2.00 2.41 -0.08 1.61 2.20 -1.26 -5.16 114.94 116.66 2elj s ASN 8 Ca 0.00 -1.57 -0.00 0.00 -0.94 0.00 0.00 52.86 50.34 2elj s ASN 8 Cb 0.00 0.33 0.03 0.00 -2.00 0.00 0.00 41.25 39.61 2elj s ASN 8 CO 0.00 -0.84 -0.04 -0.32 -2.94 0.00 0.00 177.10 172.96 2elj s MET 9 N -3.79 1.00 0.54 3.55 1.75 -1.26 -5.15 119.30 115.95 2elj s MET 9 Ca 0.29 -0.07 -0.03 0.00 -1.25 0.00 0.00 55.69 54.63 2elj s MET 9 Cb 0.05 -1.18 0.01 0.00 2.84 0.00 0.00 34.83 36.55 2elj s MET 9 CO 0.15 -0.24 0.82 0.95 -0.65 0.00 0.00 175.02 176.05 2elj s THR 10 N 1.66 3.66 -0.12 10.11 -4.23 -1.26 -5.03 115.64 120.42 2elj s THR 10 Ca 0.02 -0.22 -0.14 0.00 -1.18 0.00 0.00 61.69 60.17 2elj s THR 10 Cb -0.13 -3.42 -0.26 0.00 1.34 0.00 0.00 72.50 70.04 2elj s THR 10 CO -0.05 -0.37 0.44 0.40 -0.54 0.00 0.00 174.62 174.50 2elj h ILE 11 N 0.02 0.87 -1.48 2.99 1.08 -1.98 -3.36 117.51 115.65 2elj h ILE 11 Ca -0.45 -2.35 0.48 0.00 -0.39 0.00 0.00 64.86 62.14 2elj h ILE 11 Cb 1.26 2.56 -0.12 0.00 -3.07 0.00 0.00 36.82 37.46 2elj h ILE 11 CO 0.59 0.71 0.99 -1.28 -0.69 0.00 0.00 178.15 178.47 2elj h SER 12 N -0.27 0.17 0.59 1.72 0.87 -2.01 0.37 113.55 114.98 2elj h SER 12 Ca -0.35 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.28 2elj h SER 12 Cb 1.79 0.10 0.01 0.00 -0.44 0.00 0.00 62.40 63.86 2elj h SER 12 CO 0.03 -0.16 -0.28 0.44 -0.53 0.00 0.00 176.83 176.33 2elj h ASP 13 N 0.04 -0.67 -0.87 6.23 5.19 -2.00 -2.40 116.42 121.95 2elj h ASP 13 Ca 0.86 0.02 0.35 0.00 -0.62 0.00 0.00 57.03 57.64 2elj h ASP 13 Cb 2.91 0.17 -0.16 0.00 0.18 0.00 0.00 39.33 42.44 2elj h ASP 13 CO -0.32 -0.43 0.42 -0.38 -3.12 0.00 0.00 179.24 175.41 2elj n ILE 14 N -4.37 -0.36 -0.10 0.35 5.41 0.11 0.19 119.36 120.58 2elj n ILE 14 Ca -0.10 1.78 -0.12 0.00 1.00 0.00 0.00 62.75 65.31 2elj n ILE 14 Cb 0.31 -2.86 -0.04 0.00 -0.71 0.00 0.00 39.64 36.35 2elj n ILE 14 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2elj h GLN 15 N 0.00 0.60 -0.85 0.38 4.20 -1.38 -3.09 115.11 114.97 2elj h GLN 15 Ca 0.72 -0.25 0.14 0.00 0.06 0.00 0.00 58.65 59.32 2elj h GLN 15 Cb 1.86 -0.02 -0.09 0.00 0.30 0.00 0.00 27.48 29.53 2elj h GLN 15 CO -0.68 0.81 0.45 1.12 -0.67 0.00 0.00 178.83 179.86 2elj h HIS 16 N 0.36 0.78 -1.70 2.96 2.07 0.26 -3.43 115.15 116.45 2elj h HIS 16 Ca 0.07 0.03 -0.64 0.00 -2.85 0.00 0.00 60.37 56.99 2elj h HIS 16 Cb 0.61 -0.22 0.11 0.00 2.57 0.00 0.00 27.41 30.49 2elj h HIS 16 CO 0.06 0.20 -0.26 0.00 -3.07 0.00 0.00 177.93 174.85 2elj n ALA 17 N -2.42 -1.71 -0.01 6.11 0.00 -0.88 -4.90 120.51 116.71 2elj n ALA 17 Ca 0.17 0.40 -0.13 0.00 0.00 0.00 0.00 53.44 53.88 2elj n ALA 17 Cb 0.43 -1.79 -0.10 0.00 0.00 0.00 0.00 19.45 17.99 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 1.38 -0.02 -0.91 0.00 0.13 -1.89 -3.24 132.00 127.46 2elj h PRO 18 Ca -0.34 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.86 2elj h PRO 18 Cb 1.40 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.47 2elj h PRO 18 CO 0.58 0.46 0.57 0.38 -0.23 0.00 0.00 178.00 179.76 2elj h ASP 19 N -0.51 0.90 -0.72 1.44 2.03 -1.95 -2.84 116.42 114.78 2elj h ASP 19 Ca -0.00 0.02 0.11 0.00 -0.73 0.00 0.00 57.03 56.42 2elj h ASP 19 Cb 0.49 -0.17 -0.11 0.00 -0.83 0.00 0.00 39.33 38.70 2elj h ASP 19 CO 0.00 0.57 -0.29 0.00 -1.03 0.00 0.00 179.24 178.50 2elj n TYR 20 N -4.58 0.00 -0.40 4.15 9.36 -1.22 0.42 117.16 124.89 2elj n TYR 20 Ca 0.14 0.89 -0.05 0.00 3.32 0.00 0.00 57.90 62.20 2elj n TYR 20 Cb 0.18 -0.76 -0.01 0.00 -0.63 0.00 0.00 39.34 38.13 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 -3.61 -0.31 -0.33 2.98 0.00 -1.07 -0.60 120.51 117.57 2elj n ALA 21 Ca 0.07 0.94 -0.03 0.00 0.00 0.00 0.00 53.44 54.42 2elj n ALA 21 Cb 0.28 -0.33 -0.00 0.00 0.00 0.00 0.00 19.45 19.40 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 -5.39 -0.64 -4.13 0.00 4.77 0.17 -4.52 117.00 107.26 2elj n LEU 22 Ca 0.07 1.47 -0.44 0.00 -0.03 0.00 0.00 56.01 57.08 2elj n LEU 22 Cb 0.35 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2elj n LEU 22 CO -0.14 -1.28 -0.11 0.18 -1.33 0.00 0.00 177.39 174.71 2elj n LEU 23 N -5.18 -1.56 -4.84 2.23 4.77 0.23 -4.93 117.00 107.72 2elj n LEU 23 Ca 0.07 0.99 -0.29 0.00 -0.03 0.00 0.00 56.01 56.74 2elj n LEU 23 Cb 0.30 -0.88 0.16 0.00 -2.33 0.00 0.00 43.42 40.66 2elj n LEU 23 CO -0.12 -3.11 0.78 -0.55 -1.33 0.00 0.00 177.39 173.06 2elj s SER 24 N -0.95 3.28 0.15 -1.43 0.15 -1.26 -4.75 113.70 108.89 2elj s SER 24 Ca 0.59 0.62 -0.26 0.00 0.70 0.00 0.00 55.95 57.60 2elj s SER 24 Cb -0.81 -0.93 0.00 0.00 -1.71 0.00 0.00 66.02 62.57 2elj s SER 24 CO 0.55 -2.66 1.59 0.78 1.20 0.00 0.00 173.24 174.70 2elj h ASN 25 N -1.58 -1.19 0.69 5.45 2.35 -1.93 -0.97 115.58 118.39 2elj h ASN 25 Ca -0.46 0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.44 2elj h ASN 25 Cb 1.29 0.52 -0.00 0.00 0.05 0.00 0.00 38.32 40.18 2elj h ASN 25 CO 0.51 -0.36 -0.42 0.44 -1.65 0.00 0.00 177.43 175.94 2elj h ASP 26 N -0.36 -1.05 -0.97 5.81 3.32 -2.01 -2.80 116.42 118.36 2elj h ASP 26 Ca 0.12 0.06 0.22 0.00 0.02 0.00 0.00 57.03 57.45 2elj h ASP 26 Cb 0.57 0.30 -0.18 0.00 0.22 0.00 0.00 39.33 40.24 2elj h ASP 26 CO -0.47 -0.65 -0.14 -0.33 -1.72 0.00 0.00 179.24 175.93 2elj h GLU 27 N -1.04 0.01 0.18 3.56 4.39 -1.83 0.72 114.58 120.56 2elj h GLU 27 Ca -0.09 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.62 2elj h GLU 27 Cb 0.84 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.44 2elj h GLU 27 CO 0.09 0.00 -0.45 1.96 -1.16 0.00 0.00 179.01 179.46 2elj h GLN 28 N 0.01 -0.70 -0.95 2.33 4.20 -0.93 -1.79 115.11 117.27 2elj h GLN 28 Ca 0.51 0.05 0.09 0.00 0.06 0.00 0.00 58.65 59.36 2elj h GLN 28 Cb 0.90 0.16 -0.12 0.00 0.30 0.00 0.00 27.48 28.72 2elj h GLN 28 CO -0.96 -0.47 -0.56 1.04 -0.67 0.00 0.00 178.83 177.22 2elj n GLN 29 N -5.48 -0.41 0.14 1.46 1.13 0.23 -1.35 117.38 113.09 2elj n GLN 29 Ca -0.08 1.44 -0.12 0.00 -1.94 0.00 0.00 57.00 56.30 2elj n GLN 29 Cb 0.40 -2.12 -0.07 0.00 0.11 0.00 0.00 30.24 28.56 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 -1.06 -0.87 1.08 5.85 -1.28 -1.58 115.31 117.44 2elj h LEU 30 Ca 0.16 0.10 0.36 0.00 0.84 0.00 0.00 57.88 59.34 2elj h LEU 30 Cb 0.40 0.37 -0.16 0.00 0.37 0.00 0.00 40.66 41.64 2elj h LEU 30 CO -0.90 -0.43 0.46 0.00 -0.34 0.00 0.00 178.44 177.22 2elj h ILE 32 N 0.00 0.00 -0.63 0.00 2.04 -0.26 0.21 117.51 118.87 2elj h ILE 32 Ca 0.74 -0.02 0.12 0.00 1.00 0.00 0.00 64.86 66.70 2elj h ILE 32 Cb 1.94 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 37.89 2elj h ILE 32 CO -0.68 0.00 -0.19 1.56 0.00 0.00 0.00 178.15 178.84 2elj h GLN 33 N -0.09 -0.04 0.00 2.37 1.08 -0.49 0.86 115.11 118.81 2elj h GLN 33 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2elj h GLN 33 Cb 0.05 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2elj h GLN 33 CO 0.01 -0.02 0.00 -0.07 -0.95 0.00 0.00 178.83 177.80 2elj h LEU 34 N -0.04 0.00 -0.96 1.46 3.38 -0.62 -3.46 115.31 115.06 2elj h LEU 34 Ca 0.30 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.86 2elj h LEU 34 Cb 0.49 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.35 2elj h LEU 34 CO -0.67 0.00 -0.71 0.29 0.09 0.00 0.00 178.44 177.45 2elj n LYS 35 N -2.87 -7.36 -4.14 1.13 5.02 0.30 -4.99 118.16 105.26 2elj n LYS 35 Ca 0.00 0.78 -0.32 0.00 -2.02 0.00 0.00 58.31 56.75 2elj n LYS 35 Cb 0.25 -5.80 -0.07 0.00 -0.02 0.00 0.00 35.03 29.39 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 -3.33 4.54 0.54 -0.18 1.01 -0.22 -5.02 121.20 118.55 2elj s ILE 36 Ca 0.54 -0.52 -0.18 0.00 0.00 0.00 0.00 60.65 60.48 2elj s ILE 36 Cb -0.25 -3.09 -0.06 0.00 0.01 0.00 0.00 42.46 39.08 2elj s ILE 36 CO 0.75 0.32 1.05 -0.76 0.00 0.00 0.00 174.94 176.30 2elj s LEU 37 N -1.81 3.67 0.37 2.97 1.43 -1.26 -4.74 118.68 119.31 2elj s LEU 37 Ca 0.23 1.89 0.16 0.00 -1.03 0.00 0.00 54.13 55.38 2elj s LEU 37 Cb -0.12 -4.55 0.72 0.00 0.03 0.00 0.00 46.19 42.28 2elj s LEU 37 CO 0.14 -0.99 1.78 1.55 0.23 0.00 0.00 176.35 179.07 2elj h PRO 38 N 1.01 0.00 0.74 1.29 0.13 -1.97 -1.56 132.00 131.63 2elj h PRO 38 Ca -0.48 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.61 2elj h PRO 38 Cb 1.22 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.36 2elj h PRO 38 CO 0.58 0.39 -0.36 -0.22 -0.23 0.00 0.00 178.00 178.17 2elj h LYS 39 N 0.00 -0.96 -0.14 0.86 3.64 -1.98 -2.26 116.57 115.73 2elj h LYS 39 Ca -0.00 0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.38 2elj h LYS 39 Cb 0.79 0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2elj h LYS 39 CO 0.05 -0.62 -0.13 -1.00 -2.27 0.00 0.00 179.45 175.48 2elj h PRO 40 N -1.12 0.33 -0.92 1.90 0.13 -1.97 -2.68 132.00 127.68 2elj h PRO 40 Ca -0.10 -0.18 0.20 0.00 -0.87 0.00 0.00 66.00 65.06 2elj h PRO 40 Cb 0.78 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.85 2elj h PRO 40 CO 0.17 0.72 0.60 -0.92 -0.23 0.00 0.00 178.00 178.34 2elj h TYR 41 N -0.04 0.58 0.00 1.56 3.20 -1.37 0.69 116.97 121.59 2elj h TYR 41 Ca 0.02 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2elj h TYR 41 Cb 0.66 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.75 2elj h TYR 41 CO 0.08 0.15 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.46 2elj h LEU 42 N 0.44 0.00 0.09 2.82 3.38 -1.35 -2.54 115.31 118.15 2elj h LEU 42 Ca 0.48 -0.03 -0.32 0.00 0.09 0.00 0.00 57.88 58.11 2elj h LEU 42 Cb 1.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2elj h LEU 42 CO -0.20 0.01 -1.69 0.58 0.09 0.00 0.00 178.44 177.24 2elj h VAL 43 N 0.00 0.95 0.14 1.22 2.07 0.51 -3.33 116.25 117.82 2elj h VAL 43 Ca 0.00 -2.66 -0.25 0.00 0.82 0.00 0.00 66.70 64.61 2elj h VAL 43 Cb 0.90 2.62 0.03 0.00 -1.52 0.00 0.00 31.29 33.31 2elj h VAL 43 CO 0.00 0.77 -1.08 0.17 0.02 0.00 0.00 177.57 177.45 2elj h LEU 44 N 0.05 0.70 -2.00 2.57 8.10 -0.48 -3.25 115.31 121.01 2elj h LEU 44 Ca -0.30 -0.88 0.17 0.00 0.11 0.00 0.00 57.88 56.99 2elj h LEU 44 Cb 2.02 -0.22 -0.02 0.00 -0.44 0.00 0.00 40.66 41.99 2elj h LEU 44 CO 0.12 1.52 0.43 0.07 -4.11 0.00 0.00 178.44 176.47 2elj h LYS 45 N -0.01 0.00 0.09 0.17 2.10 -1.62 -1.72 116.57 115.58 2elj h LYS 45 Ca -0.18 -0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.47 2elj h LYS 45 Cb 1.81 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.14 2elj h LYS 45 CO 0.21 0.00 -0.04 1.49 -2.00 0.00 0.00 179.45 179.10 2elj h GLU 46 N 0.00 -0.12 -0.64 0.07 4.81 -1.66 -3.19 114.58 113.85 2elj h GLU 46 Ca 0.28 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.65 2elj h GLU 46 Cb 1.14 0.03 -0.12 0.00 0.63 0.00 0.00 28.75 30.42 2elj h GLU 46 CO -0.00 0.34 -0.22 0.28 -0.73 0.00 0.00 179.01 178.68 2elj h VAL 47 N -0.64 0.28 -0.81 0.32 2.07 -1.36 0.16 116.25 116.27 2elj h VAL 47 Ca -0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.67 2elj h VAL 47 Cb 0.51 0.28 -0.10 0.00 -1.52 0.00 0.00 31.29 30.46 2elj h VAL 47 CO 0.02 0.00 0.35 0.24 0.02 0.00 0.00 177.57 178.20 2elj h MET 48 N -0.06 0.45 -0.11 1.57 2.86 -1.57 0.20 114.93 118.28 2elj h MET 48 Ca 0.29 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 2elj h MET 48 Cb 0.51 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 2elj h MET 48 CO -0.68 0.30 0.07 0.74 1.06 0.00 0.00 176.91 178.39 2elj h PHE 49 N 0.47 0.15 -0.24 -0.22 0.04 -0.70 -1.00 116.94 115.44 2elj h PHE 49 Ca 0.46 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 61.18 2elj h PHE 49 Cb 0.75 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.83 2elj h PHE 49 CO -0.15 0.14 -0.06 -0.09 -0.60 0.00 0.00 178.31 177.56 2elj h ARG 50 N 0.11 0.37 0.00 1.51 2.43 -0.39 -1.28 114.38 117.13 2elj h ARG 50 Ca 0.04 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2elj h ARG 50 Cb 0.04 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 2elj h ARG 50 CO -0.01 0.45 0.00 -1.91 -1.51 0.00 0.00 179.97 176.99 2elj n GLU 51 N -4.29 0.14 -0.07 0.20 4.07 0.58 -2.47 120.64 118.80 2elj n GLU 51 Ca 0.00 0.19 -0.07 0.00 -0.06 0.00 0.00 57.16 57.23 2elj n GLU 51 Cb 0.25 -1.69 -0.04 0.00 -0.06 0.00 0.00 31.44 29.90 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 0.00 0.00 -1.08 4.31 3.38 -0.01 -2.96 115.31 118.96 2elj h LEU 52 Ca 0.00 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2elj h LEU 52 Cb 0.54 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2elj h LEU 52 CO 0.00 0.80 0.53 0.17 0.09 0.00 0.00 178.44 180.03 2elj h LEU 53 N -1.00 1.02 -0.51 1.67 8.10 -1.56 0.26 115.31 123.29 2elj h LEU 53 Ca -0.05 -0.05 -0.09 0.00 0.11 0.00 0.00 57.88 57.80 2elj h LEU 53 Cb 0.50 -0.26 -0.02 0.00 -0.44 0.00 0.00 40.66 40.45 2elj h LEU 53 CO -0.03 0.78 -0.03 0.50 -4.11 0.00 0.00 178.44 175.54 2elj h LYS 54 N 1.18 0.93 -0.85 0.17 3.64 -1.66 -2.66 116.57 117.32 2elj h LYS 54 Ca 0.31 -0.31 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2elj h LYS 54 Cb -0.07 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.62 2elj h LYS 54 CO -0.06 0.96 0.13 0.25 -2.27 0.00 0.00 179.45 178.46 2elj n THR 55 N -4.27 1.81 -3.74 1.00 -2.24 -0.94 -4.88 114.28 101.02 2elj n THR 55 Ca 0.01 -0.90 -0.27 0.00 -2.27 0.00 0.00 64.05 60.63 2elj n THR 55 Cb 0.34 -0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 68.04 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 0.08 -0.43 1.56 3.38 0.00 -0.56 -0.73 105.19 108.50 2elj n GLY 56 Ca 0.22 0.04 -0.02 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.84 0.48 2.45 -0.02 0.00 0.81 -5.01 105.19 103.06 2elj n GLY 57 Ca 0.07 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 2elj n GLY 57 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2elj n ASN 58 N -1.54 4.14 -4.28 1.61 2.85 0.09 -5.03 115.26 113.10 2elj n ASN 58 Ca -0.03 -3.51 -0.34 0.00 -0.11 0.00 0.00 54.58 50.60 2elj n ASN 58 Cb 0.52 -0.45 -0.15 0.00 1.24 0.00 0.00 39.78 40.94 2elj n ASN 58 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2elj s LEU 59 N -3.50 2.58 0.17 1.20 2.96 -1.26 -5.02 118.68 115.82 2elj s LEU 59 Ca 0.45 -0.44 0.11 0.00 -0.22 0.00 0.00 54.13 54.02 2elj s LEU 59 Cb 0.41 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 45.45 2elj s LEU 59 CO -0.11 0.07 -0.24 -0.94 -1.32 0.00 0.00 176.35 173.81 2elj s SER 60 N 0.91 3.23 0.29 3.68 1.04 -1.26 -4.95 113.70 116.64 2elj s SER 60 Ca -0.03 -0.83 0.09 0.00 0.48 0.00 0.00 55.95 55.66 2elj s SER 60 Cb -0.15 -0.22 0.88 0.00 0.10 0.00 0.00 66.02 66.63 2elj s SER 60 CO -0.01 0.10 1.36 1.17 0.98 0.00 0.00 173.24 176.84 2elj n LYS 61 N 0.46 -0.06 0.53 4.02 4.81 -1.26 -0.10 118.16 126.56 2elj n LYS 61 Ca -0.14 1.25 -0.21 0.00 -0.87 0.00 0.00 58.31 58.34 2elj n LYS 61 Cb 0.55 -2.09 -0.10 0.00 0.02 0.00 0.00 35.03 33.41 2elj n LYS 61 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 2elj h SER 62 N 0.00 -1.14 -0.27 3.14 0.02 -2.01 -1.79 113.55 111.50 2elj h SER 62 Ca 0.62 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 61.65 2elj h SER 62 Cb 1.46 0.29 -0.04 0.00 0.14 0.00 0.00 62.40 64.25 2elj h SER 62 CO -0.75 -0.81 -0.01 0.00 -1.14 0.00 0.00 176.83 174.12 2elj h ALA 63 N -1.37 0.22 -0.25 3.77 0.00 -0.90 -2.83 119.26 117.91 2elj h ALA 63 Ca -0.14 0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2elj h ALA 63 Cb 1.03 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 2elj h ALA 63 CO 0.23 -0.43 -0.45 0.00 0.00 0.00 0.00 179.25 178.60 2elj n ARG 65 N -5.42 -0.07 0.10 0.00 1.74 -0.68 -0.10 116.66 112.23 2elj n ARG 65 Ca -0.03 1.36 -0.12 0.00 -0.77 0.00 0.00 57.85 58.28 2elj n ARG 65 Cb 0.36 -2.20 -0.08 0.00 -1.02 0.00 0.00 32.46 29.52 2elj n ARG 65 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2elj h GLU 66 N 0.00 -0.27 -0.96 5.56 5.08 -1.12 -3.22 114.58 119.65 2elj h GLU 66 Ca 0.59 0.02 0.25 0.00 -1.00 0.00 0.00 59.36 59.22 2elj h GLU 66 Cb 1.28 0.06 -0.18 0.00 0.50 0.00 0.00 28.75 30.42 2elj h GLU 66 CO -0.84 0.09 0.02 1.25 -1.00 0.00 0.00 179.01 178.53 2elj h LEU 67 N -0.72 -0.47 -8.96 1.33 5.85 0.60 -3.34 115.31 109.60 2elj h LEU 67 Ca -0.03 0.27 -0.63 0.00 0.84 0.00 0.00 57.88 58.33 2elj h LEU 67 Cb 0.49 0.47 -0.15 0.00 0.37 0.00 0.00 40.66 41.85 2elj h LEU 67 CO 0.05 -0.33 -0.29 -0.76 -0.34 0.00 0.00 178.44 176.77 2elj s LEU 68 N -10.96 4.05 -0.67 2.25 1.43 -0.60 -4.97 118.68 109.20 2elj s LEU 68 Ca -0.13 0.25 -0.07 0.00 -1.03 0.00 0.00 54.13 53.15 2elj s LEU 68 Cb 0.28 -2.37 -0.15 0.00 0.03 0.00 0.00 46.19 43.98 2elj s LEU 68 CO 0.78 -0.14 2.90 0.59 0.23 0.00 0.00 176.35 180.71 2elj n ASN 69 N 5.16 5.88 -4.43 2.29 3.02 -1.25 -4.80 115.26 121.13 2elj n ASN 69 Ca -0.10 -2.40 -0.21 0.00 -0.03 0.00 0.00 54.58 51.84 2elj n ASN 69 Cb 0.51 -1.29 -0.10 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 1.96 1.31 0.91 2.41 -4.36 -1.26 -5.13 121.20 117.04 2elj s ILE 70 Ca 0.58 -2.04 -0.15 0.00 -0.26 0.00 0.00 60.65 58.78 2elj s ILE 70 Cb 0.21 -2.64 -0.06 0.00 1.25 0.00 0.00 42.46 41.22 2elj s ILE 70 CO -0.02 -0.13 -0.08 0.47 0.24 0.00 0.00 174.94 175.41 2elj n ASP 71 N -0.63 -3.61 0.19 4.36 9.92 -1.26 -4.76 116.55 120.76 2elj n ASP 71 Ca -0.04 0.33 0.05 0.00 -0.53 0.00 0.00 54.79 54.60 2elj n ASP 71 Cb 0.65 -1.01 0.37 0.00 -0.64 0.00 0.00 41.12 40.50 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 -1.07 0.00 0.09 -0.24 0.13 -1.96 -2.80 132.00 126.15 2elj h PRO 72 Ca -0.44 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.55 2elj h PRO 72 Cb 1.31 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.46 2elj h PRO 72 CO 0.32 0.37 -0.62 0.82 -0.23 0.00 0.00 178.00 178.65 2elj h ILE 73 N 0.00 1.54 -0.47 -3.56 2.04 -2.01 -3.28 117.51 111.77 2elj h ILE 73 Ca -0.00 -2.40 0.04 0.00 1.00 0.00 0.00 64.86 63.50 2elj h ILE 73 Cb 0.77 3.11 -0.04 0.00 -0.74 0.00 0.00 36.82 39.92 2elj h ILE 73 CO 0.05 0.67 0.23 0.11 0.00 0.00 0.00 178.15 179.21 2elj h LYS 74 N -0.43 0.45 -0.17 2.37 1.57 -1.91 -2.38 116.57 116.07 2elj h LYS 74 Ca -0.10 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2elj h LYS 74 Cb 1.45 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.59 2elj h LYS 74 CO 0.12 0.29 -0.42 0.00 -0.57 0.00 0.00 179.45 178.87 2elj h ALA 75 N 1.26 -0.57 -0.83 3.86 0.00 -1.61 -0.86 119.26 120.50 2elj h ALA 75 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.24 2elj h ALA 75 Cb 0.13 0.81 -0.08 0.00 0.00 0.00 0.00 17.79 18.64 2elj h ALA 75 CO -0.15 -0.92 0.45 -2.95 0.00 0.00 0.00 179.25 175.68 2elj h ASN 76 N -0.47 0.58 -0.58 0.00 7.08 -1.56 0.55 115.58 121.19 2elj h ASN 76 Ca 0.08 0.07 0.05 0.00 -3.08 0.00 0.00 56.30 53.43 2elj h ASN 76 Cb 0.62 -0.03 -0.05 0.00 -2.08 0.00 0.00 38.32 36.78 2elj h ASN 76 CO -0.42 0.29 0.29 0.03 -2.08 0.00 0.00 177.43 175.54 2elj h ARG 77 N 0.69 0.54 -0.22 4.14 2.47 -0.69 -1.62 114.38 119.70 2elj h ARG 77 Ca 0.43 -0.03 -0.08 0.00 -1.26 0.00 0.00 59.98 59.04 2elj h ARG 77 Cb 0.53 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 28.72 2elj h ARG 77 CO -0.31 0.36 -0.16 0.82 0.56 0.00 0.00 179.97 181.23 2elj h ILE 78 N 0.56 1.32 -0.05 2.04 2.04 -0.03 -2.86 117.51 120.52 2elj h ILE 78 Ca 0.26 -1.29 0.04 0.00 1.00 0.00 0.00 64.86 64.87 2elj h ILE 78 Cb 0.18 1.68 -0.06 0.00 -0.74 0.00 0.00 36.82 37.88 2elj h ILE 78 CO -0.18 0.39 -0.40 0.22 0.00 0.00 0.00 178.15 178.18 2elj h TYR 79 N 0.18 -1.13 -0.22 1.37 5.03 -0.56 -1.93 116.97 119.70 2elj h TYR 79 Ca 0.04 0.04 0.06 0.00 2.58 0.00 0.00 58.73 61.45 2elj h TYR 79 Cb 0.69 0.51 -0.06 0.00 1.55 0.00 0.00 36.73 39.41 2elj h TYR 79 CO 0.07 -0.47 -0.19 0.22 -1.32 0.00 0.00 178.16 176.47 2elj h ASP 80 N -0.53 -0.61 -0.54 -2.11 1.82 -1.36 -2.57 116.42 110.52 2elj h ASP 80 Ca 0.06 0.12 0.07 0.00 -0.39 0.00 0.00 57.03 56.89 2elj h ASP 80 Cb 0.63 0.30 -0.10 0.00 0.68 0.00 0.00 39.33 40.84 2elj h ASP 80 CO -0.34 -0.23 -0.48 0.15 -1.61 0.00 0.00 179.24 176.73 2elj h PHE 81 N -0.20 -1.44 -0.85 0.28 3.04 -1.19 0.04 116.94 116.63 2elj h PHE 81 Ca 0.13 0.08 0.17 0.00 3.98 0.00 0.00 57.97 62.33 2elj h PHE 81 Cb 0.39 0.70 -0.16 0.00 2.56 0.00 0.00 35.95 39.44 2elj h PHE 81 CO -0.34 -0.44 -0.21 0.74 -2.02 0.00 0.00 178.31 176.03 2elj h PHE 82 N -0.28 -0.45 -0.07 0.41 -1.00 -0.96 1.22 116.94 115.82 2elj h PHE 82 Ca 0.14 0.08 0.01 0.00 2.81 0.00 0.00 57.97 61.01 2elj h PHE 82 Cb 0.57 0.33 -0.00 0.00 3.61 0.00 0.00 35.95 40.46 2elj h PHE 82 CO -0.72 -0.37 0.05 1.96 -1.61 0.00 0.00 178.31 177.62 2elj h GLN 83 N 0.00 0.05 -0.45 1.51 1.08 -0.87 -2.33 115.11 114.10 2elj h GLN 83 Ca 0.41 -0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.67 2elj h GLN 83 Cb 0.63 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.99 2elj h GLN 83 CO -0.88 0.03 0.15 1.03 -0.95 0.00 0.00 178.83 178.22 2elj h SER 84 N 0.05 0.14 -0.38 1.46 0.87 0.23 -0.40 113.55 115.53 2elj h SER 84 Ca 0.03 0.06 -0.19 0.00 -1.23 0.00 0.00 61.79 60.46 2elj h SER 84 Cb 0.06 0.05 -0.11 0.00 -0.44 0.00 0.00 62.40 61.95 2elj h SER 84 CO -0.00 0.11 0.24 0.00 -0.53 0.00 0.00 176.83 176.65 2elj n GLN 85 N -5.02 1.57 -2.72 2.24 1.13 -0.90 -4.84 117.38 108.84 2elj n GLN 85 Ca 0.04 -1.18 -0.11 0.00 -1.94 0.00 0.00 57.00 53.80 2elj n GLN 85 Cb 0.18 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.02 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 -0.12 -1.03 -0.07 1.08 2.85 -0.16 -4.73 115.26 113.08 2elj n ASN 86 Ca 0.23 -0.06 -0.14 0.00 -0.11 0.00 0.00 54.58 54.50 2elj n ASN 86 Cb 0.94 -0.97 -0.06 0.00 1.24 0.00 0.00 39.78 40.93 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 -0.23 0.71 -0.01 1.20 6.55 -1.72 -3.50 115.95 118.95 2elj h TRP 87 Ca -0.16 -0.23 0.00 0.00 0.95 0.00 0.00 58.89 59.45 2elj h TRP 87 Cb 0.91 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 29.07 2elj h TRP 87 CO 0.68 0.95 0.00 -1.33 -1.05 0.00 0.00 178.44 177.69