#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ojx h LEU 4 N 0.00 0.00 -0.58 1.20 3.38 -1.98 -2.85 115.31 114.49 1ojx h LEU 4 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ojx h LEU 4 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1ojx h LEU 4 CO 0.00 0.31 0.36 0.74 0.09 0.00 0.00 178.44 179.93 1ojx h THR 5 N 0.00 1.17 -0.46 0.22 2.02 -1.96 -1.34 112.91 112.55 1ojx h THR 5 Ca -0.00 -0.36 -0.08 0.00 0.77 0.00 0.00 66.41 66.74 1ojx h THR 5 Cb 1.24 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 1ojx h THR 5 CO 0.04 0.17 -0.05 -0.33 0.37 0.00 0.00 175.52 175.72 1ojx h GLU 6 N 0.78 0.80 -0.52 6.66 5.08 -1.87 -1.35 114.58 124.15 1ojx h GLU 6 Ca 0.21 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1ojx h GLU 6 Cb -0.03 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1ojx h GLU 6 CO -0.04 0.84 0.13 -0.22 -1.00 0.00 0.00 179.01 178.72 1ojx h LYS 7 N 0.73 0.82 -0.36 2.33 3.64 -1.41 -1.94 116.57 120.39 1ojx h LYS 7 Ca 0.13 -0.19 0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1ojx h LYS 7 Cb 0.52 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 1ojx h LYS 7 CO 0.03 0.78 0.16 0.35 -2.27 0.00 0.00 179.45 178.50 1ojx h PHE 8 N 0.71 0.30 -0.72 1.91 3.57 -0.87 -2.38 116.94 119.47 1ojx h PHE 8 Ca 0.16 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 1ojx h PHE 8 Cb 0.32 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 1ojx h PHE 8 CO 0.02 0.15 0.29 -0.07 -2.23 0.00 0.00 178.31 176.47 1ojx h LEU 9 N 0.34 0.98 -0.75 0.59 3.38 -1.10 -0.01 115.31 118.73 1ojx h LEU 9 Ca 0.15 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1ojx h LEU 9 Cb 0.08 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1ojx h LEU 9 CO -0.12 0.87 0.24 -0.09 0.09 0.00 0.00 178.44 179.43 1ojx h ARG 10 N 1.04 1.17 0.16 1.13 2.43 -1.03 0.87 114.38 120.13 1ojx h ARG 10 Ca 0.24 -0.25 -0.29 0.00 -0.81 0.00 0.00 59.98 58.87 1ojx h ARG 10 Cb 0.20 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1ojx h ARG 10 CO -0.02 0.99 -1.44 0.82 -1.51 0.00 0.00 179.97 178.80 1ojx h ILE 11 N 1.12 1.09 -0.01 1.20 2.04 -1.28 -3.36 117.51 118.30 1ojx h ILE 11 Ca 0.24 -2.48 0.00 0.00 1.00 0.00 0.00 64.86 63.62 1ojx h ILE 11 Cb 0.31 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1ojx h ILE 11 CO -0.01 0.76 -0.09 0.49 0.00 0.00 0.00 178.15 179.31 1ojx n PHE 12 N -3.83 0.00 -2.73 1.37 3.72 -0.03 -4.59 117.46 111.37 1ojx n PHE 12 Ca -0.23 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.12 1ojx n PHE 12 Cb 0.96 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.56 1ojx n PHE 12 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ojx n ALA 13 N 0.41 2.82 0.12 4.37 0.00 0.29 -4.52 120.51 123.99 1ojx n ALA 13 Ca 0.07 -2.57 0.15 0.00 0.00 0.00 0.00 53.44 51.09 1ojx n ALA 13 Cb 0.30 -0.92 0.68 0.00 0.00 0.00 0.00 19.45 19.51 1ojx n ALA 13 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1ojx h ARG 14 N 2.55 0.00 -0.01 0.00 0.11 -1.69 -0.91 114.38 114.44 1ojx h ARG 14 Ca -0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.91 1ojx h ARG 14 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 1ojx h ARG 14 CO 0.26 0.00 -0.09 0.54 0.10 0.00 0.00 179.97 180.78 1ojx n ARG 15 N -4.41 1.33 0.00 0.08 1.74 -1.26 -4.93 116.66 109.21 1ojx n ARG 15 Ca 0.04 -0.75 0.00 0.00 -0.77 0.00 0.00 57.85 56.37 1ojx n ARG 15 Cb 0.38 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 1ojx n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ojx n GLY 16 N 1.23 2.53 3.42 -0.13 0.00 -0.35 -5.04 105.19 106.86 1ojx n GLY 16 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 1ojx n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ojx s LYS 17 N -0.26 1.59 -0.01 1.61 -0.14 -1.26 -4.98 119.74 116.28 1ojx s LYS 17 Ca 0.00 -1.86 0.02 0.00 -1.36 0.00 0.00 55.97 52.76 1ojx s LYS 17 Cb 0.00 -0.81 0.00 0.00 -1.68 0.00 0.00 37.83 35.34 1ojx s LYS 17 CO 0.00 -0.17 -0.06 0.45 -0.76 0.00 0.00 175.35 174.81 1ojx s SER 18 N -3.45 0.78 -0.13 2.83 0.15 -0.66 -4.58 113.70 108.64 1ojx s SER 18 Ca 0.35 -0.12 0.01 0.00 0.70 0.00 0.00 55.95 56.89 1ojx s SER 18 Cb 0.08 -0.16 0.02 0.00 -1.71 0.00 0.00 66.02 64.25 1ojx s SER 18 CO 0.14 0.05 -0.14 -0.63 1.20 0.00 0.00 173.24 173.87 1ojx s ILE 19 N 0.09 1.47 -0.14 6.45 1.01 -1.26 -1.84 121.20 126.98 1ojx s ILE 19 Ca -0.01 -0.59 -0.00 0.00 0.00 0.00 0.00 60.65 60.05 1ojx s ILE 19 Cb -0.05 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 41.02 1ojx s ILE 19 CO -0.00 0.44 -0.13 -0.63 0.00 0.00 0.00 174.94 174.62 1ojx s ILE 20 N 1.37 3.01 -0.51 2.92 -1.09 -0.48 -1.40 121.20 125.02 1ojx s ILE 20 Ca 0.02 -0.67 -0.24 0.00 -2.23 0.00 0.00 60.65 57.52 1ojx s ILE 20 Cb -0.13 -2.27 0.04 0.00 -1.58 0.00 0.00 42.46 38.51 1ojx s ILE 20 CO -0.08 0.52 0.92 -0.22 -1.23 0.00 0.00 174.94 174.85 1ojx s LEU 21 N 0.52 4.09 0.12 2.97 2.96 -0.25 -1.04 118.68 128.05 1ojx s LEU 21 Ca -0.09 -0.19 -0.27 0.00 -0.22 0.00 0.00 54.13 53.37 1ojx s LEU 21 Cb -0.16 -2.95 -0.07 0.00 0.50 0.00 0.00 46.19 43.51 1ojx s LEU 21 CO 0.04 -1.14 0.85 0.00 -1.32 0.00 0.00 176.35 174.78 1ojx s ALA 22 N 3.81 3.35 -0.31 5.97 0.00 -0.09 -1.59 121.76 132.89 1ojx s ALA 22 Ca 0.32 0.44 0.17 0.00 0.00 0.00 0.00 51.96 52.89 1ojx s ALA 22 Cb -0.12 -3.10 0.46 0.00 0.00 0.00 0.00 23.12 20.36 1ojx s ALA 22 CO 0.22 0.11 1.25 0.98 0.00 0.00 0.00 175.76 178.32 1ojx n TYR 23 N 2.33 -0.22 0.59 0.00 9.36 -0.74 -4.34 117.16 124.16 1ojx n TYR 23 Ca -0.02 -2.09 0.10 0.00 3.32 0.00 0.00 57.90 59.22 1ojx n TYR 23 Cb 0.49 0.51 0.27 0.00 -0.63 0.00 0.00 39.34 39.98 1ojx n TYR 23 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1ojx n ASP 24 N -0.80 2.73 0.11 2.98 5.75 -1.25 -4.55 116.55 121.52 1ojx n ASP 24 Ca -0.01 -1.91 0.07 0.00 -0.01 0.00 0.00 54.79 52.93 1ojx n ASP 24 Cb 0.83 -0.24 0.54 0.00 -1.03 0.00 0.00 41.12 41.22 1ojx n ASP 24 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 1ojx h HIS 25 N 3.38 0.26 -0.94 2.11 2.76 -1.93 -2.64 115.15 118.15 1ojx h HIS 25 Ca 0.00 0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.26 1ojx h HIS 25 Cb 0.75 -0.09 -0.07 0.00 1.55 0.00 0.00 27.41 29.56 1ojx h HIS 25 CO 0.24 0.16 0.59 0.78 -1.30 0.00 0.00 177.93 178.39 1ojx h GLY 26 N 0.28 1.45 0.50 5.26 0.00 -1.81 -0.19 103.07 108.57 1ojx h GLY 26 Ca 0.10 -0.42 -0.30 0.00 0.00 0.00 0.00 47.33 46.71 1ojx h GLY 26 CO -0.02 0.25 -1.55 1.19 0.00 0.00 0.00 176.54 176.41 1ojx h ILE 27 N 1.03 0.91 -0.59 2.60 2.10 -1.84 -2.84 117.51 118.88 1ojx h ILE 27 Ca 0.42 -2.36 -0.08 0.00 1.08 0.00 0.00 64.86 63.92 1ojx h ILE 27 Cb 0.26 2.59 -0.02 0.00 -1.09 0.00 0.00 36.82 38.56 1ojx h ILE 27 CO -0.20 0.70 0.04 -0.33 -1.08 0.00 0.00 178.15 177.28 1ojx h GLU 28 N -0.29 0.99 0.00 2.19 4.39 -1.35 -3.37 114.58 117.14 1ojx h GLU 28 Ca -0.34 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 59.08 1ojx h GLU 28 Cb 1.78 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.32 1ojx h GLU 28 CO 0.03 0.95 -0.50 0.72 -1.16 0.00 0.00 179.01 179.06 1ojx n HIS 29 N -4.20 0.00 0.00 4.33 8.25 -0.17 -2.69 115.22 120.74 1ojx n HIS 29 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1ojx n HIS 29 Cb 0.31 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1ojx n HIS 29 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ojx n GLY 30 N 1.57 -1.33 0.00 -1.41 0.00 -0.65 -4.71 105.19 98.66 1ojx n GLY 30 Ca 0.00 -1.59 0.13 0.00 0.00 0.00 0.00 46.02 44.56 1ojx n GLY 30 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ojx n PRO 31 N -1.63 0.62 -0.28 1.61 -0.04 -1.26 -4.25 135.00 129.76 1ojx n PRO 31 Ca 0.00 0.02 0.09 0.00 -0.04 0.00 0.00 63.50 63.57 1ojx n PRO 31 Cb 0.00 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.20 1ojx n PRO 31 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ojx h ALA 32 N 3.49 1.24 0.00 0.55 0.00 -1.97 -0.41 119.26 122.16 1ojx h ALA 32 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ojx h ALA 32 Cb 0.13 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ojx h ALA 32 CO 0.00 -0.26 0.00 -0.44 0.00 0.00 0.00 179.25 178.55 1ojx h ASP 33 N 0.44 0.00 0.44 0.00 3.32 -1.93 -2.53 116.42 116.16 1ojx h ASP 33 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 1ojx h ASP 33 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1ojx h ASP 33 CO -0.46 0.00 0.00 -0.26 -1.72 0.00 0.00 179.24 176.80 1ojx h PHE 34 N 0.00 0.00 -0.34 4.55 0.04 -1.36 -3.31 116.94 116.52 1ojx h PHE 34 Ca 0.00 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.68 1ojx h PHE 34 Cb 0.47 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 1ojx h PHE 34 CO 0.00 0.00 -0.17 0.52 -0.60 0.00 0.00 178.31 178.06 1ojx h MET 35 N 0.00 0.62 -0.45 1.51 2.86 -1.57 -3.04 114.93 114.85 1ojx h MET 35 Ca 0.00 -0.21 0.08 0.00 -2.06 0.00 0.00 59.70 57.51 1ojx h MET 35 Cb 0.22 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.76 1ojx h MET 35 CO 0.00 0.76 0.06 -0.44 1.06 0.00 0.00 176.91 178.35 1ojx h ASP 36 N 0.56 -0.06 -3.16 1.22 5.19 -1.81 -3.28 116.42 115.07 1ojx h ASP 36 Ca 0.09 0.09 -0.61 0.00 -0.62 0.00 0.00 57.03 55.98 1ojx h ASP 36 Cb 0.61 0.14 -0.40 0.00 0.18 0.00 0.00 39.33 39.85 1ojx h ASP 36 CO 0.04 -0.00 -0.71 0.21 -3.12 0.00 0.00 179.24 175.66 1ojx s ASN 37 N -5.29 3.70 0.56 6.45 2.47 -1.21 -4.84 114.94 116.78 1ojx s ASN 37 Ca -0.13 -3.28 0.27 0.00 0.42 0.00 0.00 52.86 50.15 1ojx s ASN 37 Cb 0.15 -1.21 1.47 0.00 -1.45 0.00 0.00 41.25 40.21 1ojx s ASN 37 CO 0.72 -0.17 1.98 -0.65 -3.72 0.00 0.00 177.10 175.26 1ojx h PRO 38 N 5.91 0.00 -0.03 0.43 0.11 -1.59 0.39 132.00 137.21 1ojx h PRO 38 Ca 0.11 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.23 1ojx h PRO 38 Cb 0.85 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 1ojx h PRO 38 CO 0.57 0.00 0.09 -0.44 -0.21 0.00 0.00 178.00 178.01 1ojx h ASP 39 N 0.00 0.00 0.36 -2.05 3.32 -1.94 -2.34 116.42 113.78 1ojx h ASP 39 Ca 0.23 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1ojx h ASP 39 Cb 1.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.58 1ojx h ASP 39 CO -0.00 0.00 -0.01 0.77 -1.72 0.00 0.00 179.24 178.28 1ojx h SER 40 N 0.00 0.00 0.88 6.45 4.64 -1.17 -1.59 113.55 122.76 1ojx h SER 40 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1ojx h SER 40 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1ojx h SER 40 CO -0.00 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 1ojx h ALA 41 N 1.99 1.00 -2.47 5.18 0.00 -1.63 -3.43 119.26 119.90 1ojx h ALA 41 Ca -0.00 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.20 1ojx h ALA 41 Cb 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 17.78 1ojx h ALA 41 CO 0.00 0.00 -0.37 0.34 0.00 0.00 0.00 179.25 179.22 1ojx s ASP 42 N -4.94 6.13 0.55 0.00 2.15 -0.60 -4.98 116.67 114.99 1ojx s ASP 42 Ca 0.03 -0.81 0.24 0.00 0.43 0.00 0.00 52.55 52.44 1ojx s ASP 42 Cb 0.09 -2.18 1.48 0.00 -0.30 0.00 0.00 42.92 42.01 1ojx s ASP 42 CO 0.47 -0.48 2.10 -0.65 -0.17 0.00 0.00 175.17 176.44 1ojx h PRO 43 N 8.65 0.00 -0.73 4.34 0.11 -1.85 -1.29 132.00 141.23 1ojx h PRO 43 Ca -0.27 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.86 1ojx h PRO 43 Cb 1.12 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 1ojx h PRO 43 CO 0.74 0.00 0.47 0.93 -0.21 0.00 0.00 178.00 179.94 1ojx h GLU 44 N 0.00 0.93 -0.78 1.05 5.08 -1.93 -2.09 114.58 116.83 1ojx h GLU 44 Ca 0.10 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1ojx h GLU 44 Cb 0.46 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1ojx h GLU 44 CO -0.00 0.61 0.38 -0.92 -1.00 0.00 0.00 179.01 178.08 1ojx h TYR 45 N 0.96 1.12 -0.60 4.33 3.20 -1.50 -1.95 116.97 122.52 1ojx h TYR 45 Ca 0.28 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.08 1ojx h TYR 45 Cb -0.07 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 37.83 1ojx h TYR 45 CO -0.03 0.81 0.31 0.82 -1.64 0.00 0.00 178.16 178.43 1ojx h ILE 46 N 1.11 1.20 -0.58 1.81 1.08 -1.27 -0.61 117.51 120.25 1ojx h ILE 46 Ca 0.27 -0.53 -0.07 0.00 -0.39 0.00 0.00 64.86 64.14 1ojx h ILE 46 Cb 0.11 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 1ojx h ILE 46 CO -0.03 0.22 0.09 -0.07 -0.69 0.00 0.00 178.15 177.66 1ojx h LEU 47 N 0.81 0.92 -0.83 1.44 3.38 -1.15 -1.62 115.31 118.27 1ojx h LEU 47 Ca 0.21 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1ojx h LEU 47 Cb 0.07 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1ojx h LEU 47 CO -0.03 0.95 0.37 0.03 0.09 0.00 0.00 178.44 179.85 1ojx h ARG 48 N 0.85 1.22 -0.29 1.13 3.08 -1.09 -1.78 114.38 117.51 1ojx h ARG 48 Ca 0.17 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1ojx h ARG 48 Cb 0.43 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1ojx h ARG 48 CO 0.01 0.96 0.05 1.25 -1.07 0.00 0.00 179.97 181.17 1ojx h LEU 49 N 1.20 0.45 -0.82 3.04 5.85 -0.93 0.14 115.31 124.25 1ojx h LEU 49 Ca 0.28 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 1ojx h LEU 49 Cb 0.16 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1ojx h LEU 49 CO -0.03 0.59 0.33 0.00 -0.34 0.00 0.00 178.44 178.99 1ojx h ALA 50 N 0.88 1.06 0.05 1.25 0.00 -1.19 -1.58 119.26 119.73 1ojx h ALA 50 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ojx h ALA 50 Cb 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ojx h ALA 50 CO 0.00 0.67 -0.02 -0.09 0.00 0.00 0.00 179.25 179.81 1ojx h ARG 51 N 1.17 -0.06 0.00 0.00 2.43 -1.17 -1.02 114.38 115.73 1ojx h ARG 51 Ca 0.27 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.37 1ojx h ARG 51 Cb 0.21 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1ojx h ARG 51 CO -0.02 0.23 -0.34 -0.44 -1.51 0.00 0.00 179.97 177.89 1ojx h ASP 52 N -0.36 0.00 0.94 -3.80 3.32 -0.57 -2.38 116.42 113.57 1ojx h ASP 52 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1ojx h ASP 52 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1ojx h ASP 52 CO 0.01 0.34 -0.33 0.00 -1.72 0.00 0.00 179.24 177.54 1ojx n ALA 53 N -2.42 2.80 -2.06 3.45 0.00 -0.61 -4.96 120.51 116.72 1ojx n ALA 53 Ca -0.02 -0.19 -0.06 0.00 0.00 0.00 0.00 53.44 53.17 1ojx n ALA 53 Cb 0.40 -1.29 -0.00 0.00 0.00 0.00 0.00 19.45 18.56 1ojx n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ojx n GLY 54 N 1.40 0.16 3.77 0.00 0.00 -0.90 -4.75 105.19 104.89 1ojx n GLY 54 Ca 0.05 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 1ojx n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ojx s PHE 55 N -2.30 2.56 -0.14 1.61 0.08 -0.42 -5.01 117.98 114.37 1ojx s PHE 55 Ca 0.00 1.03 0.17 0.00 0.12 0.00 0.00 56.93 58.26 1ojx s PHE 55 Cb 0.00 -3.24 -0.08 0.00 -0.57 0.00 0.00 43.02 39.13 1ojx s PHE 55 CO 0.00 -2.20 0.98 -0.44 -0.10 0.00 0.00 175.22 173.45 1ojx h ASP 56 N -1.39 0.00 -5.46 1.36 3.32 -1.54 -3.45 116.42 109.26 1ojx h ASP 56 Ca -0.49 0.00 0.22 0.00 0.02 0.00 0.00 57.03 56.77 1ojx h ASP 56 Cb 1.30 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.76 1ojx h ASP 56 CO 0.59 0.49 0.58 -0.83 -1.72 0.00 0.00 179.24 178.36 1ojx s GLY 57 N -4.67 -0.26 0.09 2.75 0.00 -1.23 -4.09 107.32 99.91 1ojx s GLY 57 Ca -0.01 0.25 0.05 0.00 0.00 0.00 0.00 44.72 45.01 1ojx s GLY 57 CO 0.80 0.17 -0.14 -1.34 0.00 0.00 0.00 173.10 172.59 1ojx s VAL 58 N -3.00 1.19 -0.25 1.40 -7.23 -0.57 -1.09 120.40 110.85 1ojx s VAL 58 Ca 0.13 -1.51 -0.03 0.00 -1.81 0.00 0.00 61.98 58.76 1ojx s VAL 58 Cb 0.00 -1.30 0.02 0.00 0.56 0.00 0.00 36.38 35.66 1ojx s VAL 58 CO 0.01 -0.33 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.74 1ojx s VAL 59 N -1.75 3.11 0.09 1.32 1.01 -0.62 -0.83 120.40 122.74 1ojx s VAL 59 Ca 0.03 -0.92 0.09 0.00 0.00 0.00 0.00 61.98 61.18 1ojx s VAL 59 Cb -0.07 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1ojx s VAL 59 CO 0.02 0.20 -0.22 -0.36 0.00 0.00 0.00 175.10 174.73 1ojx s PHE 60 N 1.37 1.94 0.79 5.22 0.08 -0.98 -1.79 117.98 124.61 1ojx s PHE 60 Ca 0.01 -0.40 -0.12 0.00 0.12 0.00 0.00 56.93 56.55 1ojx s PHE 60 Cb -0.16 -1.09 0.07 0.00 -0.57 0.00 0.00 43.02 41.26 1ojx s PHE 60 CO -0.03 0.20 1.10 -0.65 -0.10 0.00 0.00 175.22 175.74 1ojx s GLN 61 N -1.71 2.12 0.37 0.44 -1.52 -1.26 -1.40 119.66 116.70 1ojx s GLN 61 Ca 0.09 0.59 0.05 0.00 -1.95 0.00 0.00 55.36 54.14 1ojx s GLN 61 Cb -0.10 -1.93 0.73 0.00 -0.22 0.00 0.00 33.01 31.50 1ojx s GLN 61 CO 0.04 -1.58 2.02 0.07 -0.25 0.00 0.00 175.29 175.58 1ojx h ARG 62 N -1.06 0.72 -0.36 2.91 0.11 -1.95 -2.00 114.38 112.75 1ojx h ARG 62 Ca -0.47 -0.04 -0.16 0.00 0.10 0.00 0.00 59.98 59.41 1ojx h ARG 62 Cb 1.27 -0.16 -0.00 0.00 1.11 0.00 0.00 29.97 32.18 1ojx h ARG 62 CO 0.60 0.47 -0.39 0.78 0.10 0.00 0.00 179.97 181.54 1ojx h GLY 63 N 0.74 0.98 0.97 0.08 0.00 -1.97 -0.92 103.07 102.95 1ojx h GLY 63 Ca 0.22 -1.02 -0.10 0.00 0.00 0.00 0.00 47.33 46.44 1ojx h GLY 63 CO -0.05 0.92 -0.16 -2.22 0.00 0.00 0.00 176.54 175.02 1ojx h ILE 64 N 0.70 1.28 -0.30 2.60 1.08 -1.87 -2.59 117.51 118.42 1ojx h ILE 64 Ca 0.05 -1.28 -0.01 0.00 -0.39 0.00 0.00 64.86 63.24 1ojx h ILE 64 Cb 0.98 1.36 -0.01 0.00 -3.07 0.00 0.00 36.82 36.07 1ojx h ILE 64 CO 0.09 0.42 0.16 0.00 -0.69 0.00 0.00 178.15 178.13 1ojx h ALA 65 N 0.79 0.39 -0.59 1.87 0.00 -1.27 -0.38 119.26 120.07 1ojx h ALA 65 Ca 0.08 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ojx h ALA 65 Cb 0.70 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1ojx h ALA 65 CO 0.05 -0.07 0.37 1.49 0.00 0.00 0.00 179.25 181.08 1ojx h GLU 66 N 0.37 0.70 0.00 0.00 4.81 -1.14 -1.19 114.58 118.13 1ojx h GLU 66 Ca 0.11 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.15 1ojx h GLU 66 Cb 0.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1ojx h GLU 66 CO -0.02 0.47 -0.95 0.87 -0.73 0.00 0.00 179.01 178.65 1ojx h LYS 67 N 0.72 0.00 0.00 1.92 6.56 -1.38 -3.42 116.57 120.97 1ojx h LYS 67 Ca 0.24 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.83 1ojx h LYS 67 Cb 0.01 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 1ojx h LYS 67 CO -0.10 0.48 -0.62 0.66 -2.06 0.00 0.00 179.45 177.82 1ojx n TYR 68 N -3.11 0.00 -1.97 -1.35 4.01 -0.16 -5.06 117.16 109.52 1ojx n TYR 68 Ca -0.03 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.29 1ojx n TYR 68 Cb 0.81 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.81 1ojx n TYR 68 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1ojx s TYR 69 N -1.47 2.93 0.00 -0.72 5.04 -0.45 -4.90 117.35 117.78 1ojx s TYR 69 Ca 0.00 0.60 0.00 0.00 -2.44 0.00 0.00 57.07 55.23 1ojx s TYR 69 Cb 0.00 -3.90 0.00 0.00 0.35 0.00 0.00 41.96 38.41 1ojx s TYR 69 CO 0.00 -3.36 0.92 -0.40 -1.34 0.00 0.00 175.55 171.37 1ojx n ASP 70 N 4.39 1.78 0.00 4.32 5.75 -1.26 -4.96 116.55 126.56 1ojx n ASP 70 Ca 0.14 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 53.07 1ojx n ASP 70 Cb 0.40 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 1ojx n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ojx n GLY 71 N -0.43 0.53 0.17 6.12 0.00 -1.26 -4.92 105.19 105.41 1ojx n GLY 71 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1ojx n GLY 71 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ojx h SER 72 N 0.00 0.00 -3.91 1.61 4.64 -1.98 -3.45 113.55 110.47 1ojx h SER 72 Ca 0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 1ojx h SER 72 Cb 0.06 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 61.89 1ojx h SER 72 CO 0.00 0.18 -0.67 -0.69 -0.87 0.00 0.00 176.83 174.78 1ojx s VAL 73 N -3.15 0.01 0.39 0.95 1.01 -1.26 -4.97 120.40 113.39 1ojx s VAL 73 Ca 0.04 -0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.64 1ojx s VAL 73 Cb 0.07 -0.10 -0.11 0.00 0.00 0.00 0.00 36.38 36.25 1ojx s VAL 73 CO 0.72 -0.06 1.28 -2.65 0.00 0.00 0.00 175.10 174.39 1ojx n PRO 74 N 2.86 2.01 -4.47 2.72 -0.02 -1.26 -4.76 135.00 132.08 1ojx n PRO 74 Ca -0.14 0.71 -0.34 0.00 -2.02 0.00 0.00 63.50 61.72 1ojx n PRO 74 Cb 0.59 -2.37 -0.13 0.00 -0.02 0.00 0.00 33.50 31.57 1ojx n PRO 74 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1ojx s LEU 75 N -1.45 2.98 -0.29 2.45 2.96 -1.26 -1.52 118.68 122.55 1ojx s LEU 75 Ca 0.59 -0.25 -0.14 0.00 -0.22 0.00 0.00 54.13 54.11 1ojx s LEU 75 Cb -0.53 -1.71 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 1ojx s LEU 75 CO 0.60 0.14 0.30 -0.63 -1.32 0.00 0.00 176.35 175.44 1ojx s ILE 76 N 0.53 5.22 -0.43 6.68 1.01 -0.01 -0.82 121.20 133.39 1ojx s ILE 76 Ca -0.05 0.30 -0.24 0.00 0.00 0.00 0.00 60.65 60.65 1ojx s ILE 76 Cb -0.15 -3.67 0.02 0.00 0.01 0.00 0.00 42.46 38.68 1ojx s ILE 76 CO 0.03 0.13 0.84 -0.22 0.00 0.00 0.00 174.94 175.72 1ojx s LEU 77 N 1.94 4.13 -0.45 2.97 1.98 -0.36 -2.31 118.68 126.57 1ojx s LEU 77 Ca 0.11 0.10 -0.29 0.00 -2.89 0.00 0.00 54.13 51.16 1ojx s LEU 77 Cb -0.16 -3.07 0.03 0.00 0.66 0.00 0.00 46.19 43.65 1ojx s LEU 77 CO 0.11 -0.92 1.17 -0.75 -1.89 0.00 0.00 176.35 174.07 1ojx s LYS 78 N 3.42 3.74 0.10 1.98 2.47 -0.49 -0.66 119.74 130.29 1ojx s LYS 78 Ca 0.33 0.66 -0.00 0.00 -1.56 0.00 0.00 55.97 55.40 1ojx s LYS 78 Cb -0.12 -3.91 -0.24 0.00 -1.46 0.00 0.00 37.83 32.10 1ojx s LYS 78 CO 0.23 -1.36 1.20 -0.07 0.16 0.00 0.00 175.35 175.50 1ojx h LEU 79 N 11.25 0.28 -9.54 5.43 3.38 -1.44 -3.40 115.31 121.28 1ojx h LEU 79 Ca -0.23 -0.29 -0.58 0.00 0.09 0.00 0.00 57.88 56.86 1ojx h LEU 79 Cb 1.07 -0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.62 1ojx h LEU 79 CO 1.11 1.22 -0.65 0.54 0.09 0.00 0.00 178.44 180.76 1ojx s ASN 80 N -6.99 4.72 -0.20 -0.43 4.22 -1.26 -0.31 114.94 114.68 1ojx s ASN 80 Ca -0.02 -0.49 -0.27 0.00 -2.14 0.00 0.00 52.86 49.94 1ojx s ASN 80 Cb 0.08 -0.97 0.07 0.00 1.28 0.00 0.00 41.25 41.72 1ojx s ASN 80 CO 0.86 0.05 0.70 -0.83 -2.04 0.00 0.00 177.10 175.84 1ojx s GLY 81 N -3.28 -0.55 0.26 0.45 0.00 -1.20 -4.85 107.32 98.15 1ojx s GLY 81 Ca 0.29 1.80 0.01 0.00 0.00 0.00 0.00 44.72 46.82 1ojx s GLY 81 CO 0.19 1.50 0.12 -1.59 0.00 0.00 0.00 173.10 173.32 1ojx s LYS 82 N -0.10 1.41 0.32 2.90 -2.85 -1.26 -4.29 119.74 115.86 1ojx s LYS 82 Ca -0.03 -1.77 0.08 0.00 -1.00 0.00 0.00 55.97 53.25 1ojx s LYS 82 Cb -0.03 -0.11 -0.04 0.00 -2.06 0.00 0.00 37.83 35.58 1ojx s LYS 82 CO 0.04 -0.35 0.16 0.95 0.10 0.00 0.00 175.35 176.25 1ojx s THR 83 N -3.80 3.34 -1.18 3.79 -4.23 -1.26 -3.60 115.64 108.69 1ojx s THR 83 Ca 0.38 -1.62 0.29 0.00 -1.18 0.00 0.00 61.69 59.55 1ojx s THR 83 Cb 0.07 -3.05 0.33 0.00 1.34 0.00 0.00 72.50 71.20 1ojx s THR 83 CO 0.14 -0.22 1.94 0.35 -0.54 0.00 0.00 174.62 176.29 1ojx n THR 84 N -1.17 0.00 0.19 3.99 -2.24 -1.09 -3.32 114.28 110.64 1ojx n THR 84 Ca -0.04 -0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.81 1ojx n THR 84 Cb 0.60 -0.43 0.30 0.00 -2.10 0.00 0.00 70.33 68.70 1ojx n THR 84 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ojx h LEU 85 N 0.03 0.00 -9.74 3.22 3.38 -1.95 -3.45 115.31 106.80 1ojx h LEU 85 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1ojx h LEU 85 Cb 0.42 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.22 1ojx h LEU 85 CO 0.00 0.33 0.67 -0.47 0.09 0.00 0.00 178.44 179.06 1ojx s TYR 86 N -3.44 3.16 -0.57 1.13 5.04 -1.21 -4.96 117.35 116.51 1ojx s TYR 86 Ca 0.02 1.23 0.07 0.00 -2.44 0.00 0.00 57.07 55.95 1ojx s TYR 86 Cb 0.09 -3.66 -0.02 0.00 0.35 0.00 0.00 41.96 38.72 1ojx s TYR 86 CO 0.68 -2.03 0.47 -1.71 -1.34 0.00 0.00 175.55 171.62 1ojx n ASN 87 N 2.11 0.84 -2.51 4.32 5.15 -1.26 -5.02 115.26 118.89 1ojx n ASN 87 Ca 0.05 -0.92 0.00 0.00 -0.60 0.00 0.00 54.58 53.11 1ojx n ASN 87 Cb 0.42 0.60 0.00 0.00 -0.53 0.00 0.00 39.78 40.27 1ojx n ASN 87 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ojx n GLY 88 N 0.87 -1.42 3.72 8.20 0.00 -1.26 -4.97 105.19 110.32 1ojx n GLY 88 Ca 0.03 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.03 1ojx n GLY 88 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ojx n GLU 89 N -0.76 2.53 -1.67 1.61 -0.58 -1.26 -4.85 120.64 115.67 1ojx n GLU 89 Ca 0.00 0.90 -0.47 0.00 -0.42 0.00 0.00 57.16 57.18 1ojx n GLU 89 Cb 0.00 -2.67 -0.04 0.00 -0.57 0.00 0.00 31.44 28.15 1ojx n GLU 89 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1ojx n PRO 90 N 2.62 2.13 -3.68 3.49 -0.02 -1.26 -4.81 135.00 133.47 1ojx n PRO 90 Ca 0.11 0.77 -0.14 0.00 -2.02 0.00 0.00 63.50 62.23 1ojx n PRO 90 Cb 0.35 -2.56 -0.08 0.00 -0.02 0.00 0.00 33.50 31.18 1ojx n PRO 90 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ojx s VAL 91 N 1.93 0.00 -0.14 -1.45 0.11 -1.26 -4.50 120.40 115.09 1ojx s VAL 91 Ca 0.83 -0.01 -0.04 0.00 -2.93 0.00 0.00 61.98 59.84 1ojx s VAL 91 Cb -0.69 -0.80 0.07 0.00 -1.53 0.00 0.00 36.38 33.43 1ojx s VAL 91 CO 0.43 -0.01 0.17 -0.55 -3.33 0.00 0.00 175.10 171.81 1ojx s SER 92 N 0.22 1.25 0.16 3.54 0.15 -1.26 -4.76 113.70 113.00 1ojx s SER 92 Ca -0.01 -0.03 0.03 0.00 0.70 0.00 0.00 55.95 56.65 1ojx s SER 92 Cb -0.04 0.22 -0.04 0.00 -1.71 0.00 0.00 66.02 64.46 1ojx s SER 92 CO 0.01 -0.29 0.24 0.68 1.20 0.00 0.00 173.24 175.08 1ojx s VAL 93 N 2.28 5.06 0.23 4.45 -7.23 -1.26 -4.77 120.40 119.15 1ojx s VAL 93 Ca 0.04 -0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 59.07 1ojx s VAL 93 Cb -0.14 -3.61 -0.10 0.00 0.56 0.00 0.00 36.38 33.09 1ojx s VAL 93 CO -0.09 -0.12 1.44 0.00 -0.31 0.00 0.00 175.10 176.03 1ojx s ALA 94 N -1.77 3.64 -1.43 1.32 0.00 -1.26 -3.26 121.76 119.00 1ojx s ALA 94 Ca 0.33 1.31 0.13 0.00 0.00 0.00 0.00 51.96 53.73 1ojx s ALA 94 Cb -0.11 -3.56 0.19 0.00 0.00 0.00 0.00 23.12 19.64 1ojx s ALA 94 CO 0.27 -0.72 1.04 0.27 0.00 0.00 0.00 175.76 176.62 1ojx n ASN 95 N 2.67 2.42 -3.75 0.00 0.23 0.58 -4.94 115.26 112.47 1ojx n ASN 95 Ca 0.08 -1.70 -0.13 0.00 -0.53 0.00 0.00 54.58 52.30 1ojx n ASN 95 Cb 0.40 -0.09 -0.09 0.00 -2.08 0.00 0.00 39.78 37.92 1ojx n ASN 95 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ojx s SER 97 N -0.82 5.94 0.21 0.00 1.04 -1.26 -4.88 113.70 113.93 1ojx s SER 97 Ca -0.09 0.45 -0.10 0.00 0.48 0.00 0.00 55.95 56.69 1ojx s SER 97 Cb -0.04 -1.74 0.17 0.00 0.10 0.00 0.00 66.02 64.51 1ojx s SER 97 CO 0.03 -0.65 1.87 0.58 0.98 0.00 0.00 173.24 176.05 1ojx h VAL 98 N 0.37 1.16 -0.77 5.02 2.07 -1.95 -1.91 116.25 120.24 1ojx h VAL 98 Ca -0.47 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 66.78 1ojx h VAL 98 Cb 1.24 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 1ojx h VAL 98 CO 0.59 0.18 0.47 -0.08 0.02 0.00 0.00 177.57 178.74 1ojx h GLU 99 N 0.97 0.84 -0.34 1.57 4.81 -1.95 -1.32 114.58 119.15 1ojx h GLU 99 Ca 0.28 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.35 1ojx h GLU 99 Cb -0.06 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 1ojx h GLU 99 CO -0.08 0.55 -0.24 0.93 -0.73 0.00 0.00 179.01 179.45 1ojx h GLU 100 N 0.86 0.66 -0.68 1.92 5.08 -1.88 -2.86 114.58 117.68 1ojx h GLU 100 Ca 0.34 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1ojx h GLU 100 Cb 0.16 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1ojx h GLU 100 CO -0.17 0.84 0.41 0.00 -1.00 0.00 0.00 179.01 179.09 1ojx h ALA 101 N 1.16 0.87 -0.63 3.43 0.00 -0.54 -2.06 119.26 121.50 1ojx h ALA 101 Ca 0.08 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1ojx h ALA 101 Cb 0.71 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1ojx h ALA 101 CO 0.05 0.35 0.32 0.28 0.00 0.00 0.00 179.25 180.26 1ojx h VAL 102 N 0.93 0.91 0.00 0.00 2.07 -1.11 -2.36 116.25 116.69 1ojx h VAL 102 Ca 0.24 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 1ojx h VAL 102 Cb -0.02 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1ojx h VAL 102 CO -0.04 0.11 -0.29 -1.28 0.02 0.00 0.00 177.57 176.09 1ojx h SER 103 N 0.58 0.00 0.00 0.57 0.87 -1.19 -2.51 113.55 111.88 1ojx h SER 103 Ca 0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 1ojx h SER 103 Cb 0.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1ojx h SER 103 CO -0.21 0.29 -0.00 0.18 -0.53 0.00 0.00 176.83 176.55 1ojx n LEU 104 N -3.97 0.86 0.00 2.23 4.77 -0.83 -4.92 117.00 115.14 1ojx n LEU 104 Ca -0.02 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1ojx n LEU 104 Cb 0.35 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1ojx n LEU 104 CO 0.36 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1ojx n GLY 105 N 1.11 0.83 3.77 -0.72 0.00 -0.94 -4.90 105.19 104.33 1ojx n GLY 105 Ca 0.21 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 1ojx n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ojx s ALA 106 N -2.00 3.18 -0.80 4.61 0.00 -0.93 -4.62 121.76 121.20 1ojx s ALA 106 Ca 0.00 0.97 0.21 0.00 0.00 0.00 0.00 51.96 53.15 1ojx s ALA 106 Cb 0.00 -3.38 -0.20 0.00 0.00 0.00 0.00 23.12 19.54 1ojx s ALA 106 CO 0.00 -0.52 0.86 0.43 0.00 0.00 0.00 175.76 176.53 1ojx n SER 107 N 0.14 0.77 -3.67 0.00 7.64 -0.00 -4.74 113.62 113.75 1ojx n SER 107 Ca 0.04 -0.73 -0.10 0.00 1.01 0.00 0.00 58.87 59.09 1ojx n SER 107 Cb 0.46 1.13 -0.03 0.00 -1.01 0.00 0.00 64.21 64.76 1ojx n SER 107 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ojx s ALA 108 N -3.11 -1.09 0.14 -0.43 0.00 -1.09 -4.23 121.76 111.95 1ojx s ALA 108 Ca 0.05 -0.06 0.11 0.00 0.00 0.00 0.00 51.96 52.05 1ojx s ALA 108 Cb 0.16 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 1ojx s ALA 108 CO 0.86 -0.80 -0.26 0.14 0.00 0.00 0.00 175.76 175.71 1ojx s VAL 109 N -3.84 2.21 0.10 0.00 -7.23 -0.59 -1.22 120.40 109.82 1ojx s VAL 109 Ca 0.07 -1.78 0.10 0.00 -1.81 0.00 0.00 61.98 58.56 1ojx s VAL 109 Cb -0.01 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 1ojx s VAL 109 CO -0.05 0.04 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.69 1ojx s GLY 110 N -2.14 1.43 -0.21 2.32 0.00 0.16 -0.44 107.32 108.44 1ojx s GLY 110 Ca 0.14 -1.34 -0.10 0.00 0.00 0.00 0.00 44.72 43.42 1ojx s GLY 110 CO 0.06 -1.30 0.50 -0.47 0.00 0.00 0.00 173.10 171.90 1ojx s TYR 111 N -0.98 -0.83 -0.06 1.90 5.04 -0.52 -1.09 117.35 120.81 1ojx s TYR 111 Ca 0.12 1.64 -0.20 0.00 -2.44 0.00 0.00 57.07 56.19 1ojx s TYR 111 Cb -0.10 0.41 -0.05 0.00 0.35 0.00 0.00 41.96 42.58 1ojx s TYR 111 CO 0.04 -0.45 0.56 0.99 -1.34 0.00 0.00 175.55 175.35 1ojx s THR 112 N 1.85 5.06 0.13 4.34 2.01 -1.26 -1.15 115.64 126.62 1ojx s THR 112 Ca -0.08 1.15 0.09 0.00 0.31 0.00 0.00 61.69 63.16 1ojx s THR 112 Cb -0.09 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1ojx s THR 112 CO -0.15 0.36 -0.16 0.27 -0.69 0.00 0.00 174.62 174.25 1ojx s ILE 113 N 0.29 2.96 -0.64 1.82 -4.36 -0.61 -4.83 121.20 115.83 1ojx s ILE 113 Ca 0.30 -1.54 0.05 0.00 -0.26 0.00 0.00 60.65 59.20 1ojx s ILE 113 Cb -0.17 -2.39 0.19 0.00 1.25 0.00 0.00 42.46 41.34 1ojx s ILE 113 CO 0.14 0.04 0.53 -1.22 0.24 0.00 0.00 174.94 174.67 1ojx n TYR 114 N 0.59 2.54 -1.65 1.37 4.01 -1.26 -1.72 117.16 121.04 1ojx n TYR 114 Ca -0.14 -4.10 -0.45 0.00 -0.16 0.00 0.00 57.90 53.06 1ojx n TYR 114 Cb 0.53 -0.47 -0.02 0.00 -0.31 0.00 0.00 39.34 39.08 1ojx n TYR 114 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1ojx n PRO 115 N 1.84 1.78 0.00 -0.72 -0.02 -1.26 -2.11 135.00 134.51 1ojx n PRO 115 Ca 0.24 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1ojx n PRO 115 Cb 0.39 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1ojx n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ojx n GLY 116 N 1.51 3.15 3.66 -1.23 0.00 -1.26 -2.02 105.19 109.00 1ojx n GLY 116 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1ojx n GLY 116 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ojx n SER 117 N 0.10 1.59 0.08 1.61 2.88 -0.75 -2.57 113.62 116.56 1ojx n SER 117 Ca 0.00 0.92 0.21 0.00 -1.33 0.00 0.00 58.87 58.67 1ojx n SER 117 Cb 0.00 -1.45 0.73 0.00 -0.75 0.00 0.00 64.21 62.74 1ojx n SER 117 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1ojx h GLY 118 N 1.08 0.00 -3.08 0.46 0.00 -1.87 -0.39 103.07 99.27 1ojx h GLY 118 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1ojx h GLY 118 CO 0.54 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.77 1ojx n PHE 119 N -3.64 1.75 -0.37 5.60 0.99 -1.26 -4.69 117.46 115.84 1ojx n PHE 119 Ca 0.08 -0.73 0.05 0.00 -0.00 0.00 0.00 57.45 56.85 1ojx n PHE 119 Cb 0.67 -0.43 0.21 0.00 -1.00 0.00 0.00 39.48 38.94 1ojx n PHE 119 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.76 177.81 1ojx h GLU 120 N 3.59 1.04 -0.95 -1.08 4.11 -1.31 -1.34 114.58 118.64 1ojx h GLU 120 Ca 0.00 -0.06 0.11 0.00 0.07 0.00 0.00 59.36 59.47 1ojx h GLU 120 Cb 1.78 -0.23 -0.07 0.00 0.50 0.00 0.00 28.75 30.72 1ojx h GLU 120 CO 0.39 0.69 0.61 0.11 0.07 0.00 0.00 179.01 180.88 1ojx h TRP 121 N 1.07 1.04 -0.57 2.06 5.08 -1.83 -1.30 115.95 121.50 1ojx h TRP 121 Ca 0.47 0.03 -0.05 0.00 1.08 0.00 0.00 58.89 60.42 1ojx h TRP 121 Cb 0.36 -0.34 -0.02 0.00 -3.00 0.00 0.00 29.16 26.17 1ojx h TRP 121 CO -0.00 0.46 0.17 -0.22 -1.28 0.00 0.00 178.44 177.56 1ojx h LYS 122 N 0.95 0.89 -0.01 0.12 3.64 -1.60 -0.75 116.57 119.81 1ojx h LYS 122 Ca 0.45 -0.20 -0.18 0.00 -1.27 0.00 0.00 60.65 59.45 1ojx h LYS 122 Cb 0.44 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1ojx h LYS 122 CO -0.21 0.81 -0.81 0.52 -2.27 0.00 0.00 179.45 177.49 1ojx h MET 123 N 0.80 0.15 -0.42 1.90 2.86 -1.42 -2.36 114.93 116.43 1ojx h MET 123 Ca 0.18 -0.15 -0.14 0.00 -2.06 0.00 0.00 59.70 57.53 1ojx h MET 123 Cb 0.30 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1ojx h MET 123 CO -0.00 0.87 -0.29 0.74 1.06 0.00 0.00 176.91 179.29 1ojx h PHE 124 N 0.09 1.07 -0.69 -0.22 0.04 -1.11 -0.27 116.94 115.85 1ojx h PHE 124 Ca -0.03 -0.28 -0.03 0.00 2.80 0.00 0.00 57.97 60.42 1ojx h PHE 124 Cb 1.40 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 39.28 1ojx h PHE 124 CO 0.02 1.09 0.30 1.49 -0.60 0.00 0.00 178.31 180.61 1ojx h GLU 125 N 0.77 1.02 -0.16 1.51 4.81 -1.11 -2.16 114.58 119.26 1ojx h GLU 125 Ca 0.09 -0.17 -0.22 0.00 -0.13 0.00 0.00 59.36 58.92 1ojx h GLU 125 Cb 0.86 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 30.08 1ojx h GLU 125 CO 0.08 0.83 -0.76 1.49 -0.73 0.00 0.00 179.01 179.92 1ojx h GLU 126 N 0.98 0.80 -0.47 1.92 4.81 -1.36 -3.18 114.58 118.08 1ojx h GLU 126 Ca 0.23 -0.64 0.02 0.00 -0.13 0.00 0.00 59.36 58.84 1ojx h GLU 126 Cb 0.17 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1ojx h GLU 126 CO -0.02 1.25 0.31 1.25 -0.73 0.00 0.00 179.01 181.07 1ojx h LEU 127 N 0.54 0.49 -0.78 1.64 5.85 -0.94 -1.51 115.31 120.60 1ojx h LEU 127 Ca -0.05 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1ojx h LEU 127 Cb 1.39 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.25 1ojx h LEU 127 CO 0.16 0.35 0.49 0.00 -0.34 0.00 0.00 178.44 179.10 1ojx h ALA 128 N 1.72 1.03 -0.37 1.25 0.00 -1.37 0.15 119.26 121.68 1ojx h ALA 128 Ca 0.18 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1ojx h ALA 128 Cb 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1ojx h ALA 128 CO -0.04 0.27 -0.06 0.00 0.00 0.00 0.00 179.25 179.42 1ojx h ARG 129 N 0.93 0.70 -0.47 0.00 3.08 -1.37 -2.34 114.38 114.92 1ojx h ARG 129 Ca 0.32 -0.25 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 1ojx h ARG 129 Cb 0.06 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1ojx h ARG 129 CO -0.13 0.83 0.05 0.82 -1.07 0.00 0.00 179.97 180.47 1ojx h ILE 130 N 0.50 1.25 -0.39 2.04 2.04 -0.97 -2.12 117.51 119.87 1ojx h ILE 130 Ca 0.10 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.01 1ojx h ILE 130 Cb 0.55 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1ojx h ILE 130 CO 0.03 0.33 0.25 0.50 0.00 0.00 0.00 178.15 179.27 1ojx h LYS 131 N 0.65 0.51 -0.70 2.37 1.63 -0.72 0.67 116.57 120.98 1ojx h LYS 131 Ca 0.14 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 59.94 1ojx h LYS 131 Cb 0.42 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.89 1ojx h LYS 131 CO 0.01 0.35 0.44 -0.09 -3.45 0.00 0.00 179.45 176.71 1ojx h ARG 132 N 0.52 0.83 -0.41 1.90 2.43 -1.26 -2.19 114.38 116.20 1ojx h ARG 132 Ca 0.14 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.14 1ojx h ARG 132 Cb -0.05 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.30 1ojx h ARG 132 CO -0.03 0.55 -0.22 -0.44 -1.51 0.00 0.00 179.97 178.32 1ojx h ASP 133 N 0.85 0.83 -0.71 -3.80 3.32 -1.07 -2.23 116.42 113.61 1ojx h ASP 133 Ca 0.28 -0.30 0.06 0.00 0.02 0.00 0.00 57.03 57.09 1ojx h ASP 133 Cb 0.03 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.30 1ojx h ASP 133 CO -0.11 1.02 0.42 0.00 -1.72 0.00 0.00 179.24 178.84 1ojx h ALA 134 N 1.04 0.96 -0.24 3.45 0.00 -0.46 -0.06 119.26 123.96 1ojx h ALA 134 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1ojx h ALA 134 Cb 0.74 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1ojx h ALA 134 CO 0.06 0.12 0.09 0.28 0.00 0.00 0.00 179.25 179.79 1ojx h VAL 135 N 0.77 1.18 -0.82 0.00 2.07 -1.33 -0.12 116.25 117.99 1ojx h VAL 135 Ca 0.31 -0.56 0.03 0.00 0.82 0.00 0.00 66.70 67.31 1ojx h VAL 135 Cb 0.17 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 1ojx h VAL 135 CO -0.17 0.18 0.52 0.50 0.02 0.00 0.00 177.57 178.63 1ojx h LYS 136 N 0.22 0.99 -0.07 1.57 3.64 -0.86 -2.57 116.57 119.50 1ojx h LYS 136 Ca 0.08 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1ojx h LYS 136 Cb 0.20 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1ojx h LYS 136 CO -0.00 0.65 0.00 1.19 -2.27 0.00 0.00 179.45 179.02 1ojx n PHE 137 N -4.58 0.07 -3.63 1.91 3.72 -0.09 -4.97 117.46 109.88 1ojx n PHE 137 Ca 0.10 -0.03 -0.23 0.00 -0.05 0.00 0.00 57.45 57.24 1ojx n PHE 137 Cb 0.09 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.70 1ojx n PHE 137 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1ojx n ASP 138 N 0.69 -4.18 -4.32 4.37 2.03 -0.18 -5.01 116.55 109.96 1ojx n ASP 138 Ca 0.17 -0.65 -0.34 0.00 0.52 0.00 0.00 54.79 54.49 1ojx n ASP 138 Cb 0.45 -4.69 -0.14 0.00 -0.72 0.00 0.00 41.12 36.02 1ojx n ASP 138 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ojx s LEU 139 N -6.97 2.70 0.47 -2.67 1.02 -0.49 -5.04 118.68 107.70 1ojx s LEU 139 Ca 0.36 -0.39 -0.24 0.00 0.02 0.00 0.00 54.13 53.88 1ojx s LEU 139 Cb -0.17 -1.64 -0.08 0.00 0.02 0.00 0.00 46.19 44.32 1ojx s LEU 139 CO 0.76 0.08 1.35 -2.65 0.02 0.00 0.00 176.35 175.91 1ojx n PRO 140 N 4.12 1.98 -3.65 1.29 -0.02 -1.26 -4.53 135.00 132.94 1ojx n PRO 140 Ca -0.19 0.71 -0.38 0.00 -2.02 0.00 0.00 63.50 61.63 1ojx n PRO 140 Cb 0.52 -2.53 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 1ojx n PRO 140 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1ojx s LEU 141 N -2.50 3.91 -0.29 2.45 2.96 -1.26 -1.54 118.68 122.41 1ojx s LEU 141 Ca 0.64 -0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 54.25 1ojx s LEU 141 Cb -0.46 -2.04 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 1ojx s LEU 141 CO 0.55 -0.09 0.11 -0.69 -1.32 0.00 0.00 176.35 174.92 1ojx s VAL 142 N 1.68 4.37 -0.25 1.68 1.01 0.42 -0.44 120.40 128.88 1ojx s VAL 142 Ca 0.06 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.51 1ojx s VAL 142 Cb -0.16 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1ojx s VAL 142 CO 0.08 0.14 0.16 -0.69 0.00 0.00 0.00 175.10 174.78 1ojx s VAL 143 N 1.59 5.28 -0.52 2.92 1.01 -0.50 -1.44 120.40 128.74 1ojx s VAL 143 Ca 0.05 0.15 -0.26 0.00 0.00 0.00 0.00 61.98 61.92 1ojx s VAL 143 Cb -0.17 -3.47 0.03 0.00 0.00 0.00 0.00 36.38 32.78 1ojx s VAL 143 CO 0.05 0.33 0.99 0.26 0.00 0.00 0.00 175.10 176.73 1ojx s TRP 144 N 1.21 2.81 -0.42 5.22 0.23 -0.30 -0.78 118.94 126.91 1ojx s TRP 144 Ca 0.07 0.24 -0.10 0.00 -2.03 0.00 0.00 56.10 54.29 1ojx s TRP 144 Cb -0.14 -4.14 0.07 0.00 0.03 0.00 0.00 33.47 29.29 1ojx s TRP 144 CO 0.06 -1.30 0.27 0.45 0.96 0.00 0.00 176.95 177.39 1ojx s SER 145 N 2.63 5.70 -0.56 2.95 0.15 -0.62 -1.58 113.70 122.37 1ojx s SER 145 Ca 0.36 -1.42 0.04 0.00 0.70 0.00 0.00 55.95 55.63 1ojx s SER 145 Cb -0.10 -2.01 0.16 0.00 -1.71 0.00 0.00 66.02 62.36 1ojx s SER 145 CO 0.24 -0.53 0.40 -0.31 1.20 0.00 0.00 173.24 174.24 1ojx s TYR 146 N 1.46 2.46 0.18 3.44 2.02 -0.70 -4.64 117.35 121.58 1ojx s TYR 146 Ca 0.03 -2.85 -0.33 0.00 -0.37 0.00 0.00 57.07 53.54 1ojx s TYR 146 Cb -0.23 -1.96 -0.14 0.00 -0.40 0.00 0.00 41.96 39.23 1ojx s TYR 146 CO 0.03 -0.68 1.44 -2.30 -1.57 0.00 0.00 175.55 172.47 1ojx n PRO 147 N 2.51 1.85 -3.62 -1.71 -0.02 -1.26 -4.19 135.00 128.56 1ojx n PRO 147 Ca 0.22 0.66 -0.13 0.00 -2.02 0.00 0.00 63.50 62.23 1ojx n PRO 147 Cb 0.39 -2.35 -0.07 0.00 -0.02 0.00 0.00 33.50 31.46 1ojx n PRO 147 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1ojx s ARG 148 N 0.27 0.78 0.16 -0.52 3.52 -0.86 -4.87 118.95 117.43 1ojx s ARG 148 Ca 0.76 0.84 0.00 0.00 -0.13 0.00 0.00 55.73 57.19 1ojx s ARG 148 Cb -0.73 0.38 0.00 0.00 -1.56 0.00 0.00 34.95 33.04 1ojx s ARG 148 CO 0.45 -0.11 0.00 0.41 -0.81 0.00 0.00 175.30 175.24 1ojx n GLY 149 N 2.41 -2.68 7.00 8.12 0.00 -1.26 -1.82 105.19 116.96 1ojx n GLY 149 Ca -0.14 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.20 1ojx n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ojx n GLY 150 N -0.56 3.54 0.17 -0.02 0.00 -1.06 -1.92 105.19 105.34 1ojx n GLY 150 Ca 0.00 -0.05 0.15 0.00 0.00 0.00 0.00 46.02 46.12 1ojx n GLY 150 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ojx n LYS 151 N 14.00 1.03 -2.44 1.61 5.02 -1.26 -4.88 118.16 131.24 1ojx n LYS 151 Ca 0.00 -0.34 -0.42 0.00 -2.02 0.00 0.00 58.31 55.53 1ojx n LYS 151 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.49 1ojx n LYS 151 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ojx s VAL 152 N -2.20 4.04 0.00 -0.18 1.01 -0.81 -4.93 120.40 117.33 1ojx s VAL 152 Ca 0.37 1.49 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1ojx s VAL 152 Cb 0.21 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1ojx s VAL 152 CO 0.41 0.13 0.00 0.52 0.00 0.00 0.00 175.10 176.16 1ojx n VAL 153 N 3.77 0.00 -3.32 2.92 0.31 -1.26 -4.52 118.33 116.23 1ojx n VAL 153 Ca 0.08 0.06 -0.41 0.00 -0.01 0.00 0.00 64.34 64.06 1ojx n VAL 153 Cb 0.46 -0.97 -0.09 0.00 -0.91 0.00 0.00 33.84 32.34 1ojx n VAL 153 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1ojx s ASN 154 N -3.58 6.24 0.31 4.52 0.01 -1.26 -4.95 114.94 116.22 1ojx s ASN 154 Ca 0.00 -0.22 0.26 0.00 -0.71 0.00 0.00 52.86 52.19 1ojx s ASN 154 Cb 0.00 -2.23 0.90 0.00 0.41 0.00 0.00 41.25 40.33 1ojx s ASN 154 CO 0.00 -0.44 1.76 -0.33 -1.51 0.00 0.00 177.10 176.59 1ojx h GLU 155 N 8.51 0.00 -0.22 -0.60 5.08 -1.94 -2.71 114.58 122.69 1ojx h GLU 155 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1ojx h GLU 155 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1ojx h GLU 155 CO 0.74 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 179.00 1ojx n THR 156 N -2.48 0.27 -1.76 1.13 -2.24 -1.26 -4.33 114.28 103.61 1ojx n THR 156 Ca 0.03 -0.56 -0.41 0.00 -2.27 0.00 0.00 64.05 60.83 1ojx n THR 156 Cb 0.35 0.97 -0.00 0.00 -2.10 0.00 0.00 70.33 69.54 1ojx n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ojx n ALA 157 N 1.13 2.14 -0.26 6.98 0.00 -1.03 -4.47 120.51 125.00 1ojx n ALA 157 Ca 0.17 0.35 0.07 0.00 0.00 0.00 0.00 53.44 54.03 1ojx n ALA 157 Cb 0.53 -2.39 0.21 0.00 0.00 0.00 0.00 19.45 17.80 1ojx n ALA 157 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ojx h PRO 158 N 2.99 0.38 0.00 0.00 0.11 -1.91 -1.73 132.00 131.84 1ojx h PRO 158 Ca -0.49 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.51 1ojx h PRO 158 Cb 1.25 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1ojx h PRO 158 CO 0.65 0.25 -0.40 1.05 -0.21 0.00 0.00 178.00 179.34 1ojx h GLU 159 N 0.40 0.00 -0.04 1.05 9.09 -1.96 -2.24 114.58 120.87 1ojx h GLU 159 Ca 0.44 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.74 1ojx h GLU 159 Cb 0.72 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.83 1ojx h GLU 159 CO -0.45 0.40 -0.40 0.82 0.05 0.00 0.00 179.01 179.43 1ojx h ILE 160 N 0.00 1.44 -0.73 -1.06 1.08 -1.67 -2.12 117.51 114.45 1ojx h ILE 160 Ca -0.00 -1.87 -0.06 0.00 -0.39 0.00 0.00 64.86 62.54 1ojx h ILE 160 Cb 0.92 2.47 -0.03 0.00 -3.07 0.00 0.00 36.82 37.11 1ojx h ILE 160 CO 0.05 0.54 0.23 0.58 -0.69 0.00 0.00 178.15 178.85 1ojx h VAL 161 N -0.18 1.26 -0.62 1.67 2.07 -1.38 0.45 116.25 119.52 1ojx h VAL 161 Ca -0.04 -0.91 -0.06 0.00 0.82 0.00 0.00 66.70 66.52 1ojx h VAL 161 Cb 1.08 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1ojx h VAL 161 CO 0.08 0.36 0.15 0.00 0.02 0.00 0.00 177.57 178.18 1ojx h ALA 162 N 1.11 1.10 -0.52 1.67 0.00 -1.48 -1.69 119.26 119.45 1ojx h ALA 162 Ca 0.24 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1ojx h ALA 162 Cb 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ojx h ALA 162 CO -0.01 0.60 0.16 -0.92 0.00 0.00 0.00 179.25 179.09 1ojx h TYR 163 N 0.92 0.83 -0.60 0.00 -0.00 -0.82 -1.82 116.97 115.48 1ojx h TYR 163 Ca 0.20 -0.08 0.07 0.00 -0.00 0.00 0.00 58.73 58.91 1ojx h TYR 163 Cb 0.33 -0.24 -0.06 0.00 -0.00 0.00 0.00 36.73 36.76 1ojx h TYR 163 CO 0.02 0.72 0.30 0.00 -0.00 0.00 0.00 178.16 179.20 1ojx h ALA 164 N 1.02 0.79 -0.21 1.82 0.00 -0.70 -0.40 119.26 121.59 1ojx h ALA 164 Ca 0.17 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1ojx h ALA 164 Cb 0.27 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ojx h ALA 164 CO -0.01 -0.07 -0.14 0.00 0.00 0.00 0.00 179.25 179.03 1ojx h ALA 165 N 1.35 0.30 -0.64 0.00 0.00 -1.15 -2.78 119.26 116.33 1ojx h ALA 165 Ca 0.28 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1ojx h ALA 165 Cb 0.24 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ojx h ALA 165 CO -0.21 0.17 0.20 -0.09 0.00 0.00 0.00 179.25 179.31 1ojx h ARG 166 N 0.15 1.01 -0.54 0.00 9.65 -1.03 -2.66 114.38 120.95 1ojx h ARG 166 Ca 0.04 -0.22 0.02 0.00 -1.10 0.00 0.00 59.98 58.72 1ojx h ARG 166 Cb 0.66 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 29.06 1ojx h ARG 166 CO 0.04 0.89 0.34 0.82 2.80 0.00 0.00 179.97 184.85 1ojx h ILE 167 N 0.93 1.08 -0.72 1.20 2.04 -1.06 -1.33 117.51 119.66 1ojx h ILE 167 Ca 0.21 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1ojx h ILE 167 Cb 0.30 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 1ojx h ILE 167 CO -0.01 0.12 0.47 0.00 0.00 0.00 0.00 178.15 178.73 1ojx h ALA 168 N 1.23 0.93 -0.14 1.87 0.00 -1.27 -1.19 119.26 120.69 1ojx h ALA 168 Ca 0.21 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1ojx h ALA 168 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1ojx h ALA 168 CO -0.08 0.28 0.08 1.25 0.00 0.00 0.00 179.25 180.78 1ojx h LEU 169 N 0.93 0.12 -1.27 0.00 5.85 -1.22 -1.12 115.31 118.60 1ojx h LEU 169 Ca 0.28 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.96 1ojx h LEU 169 Cb -0.04 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1ojx h LEU 169 CO -0.08 0.09 0.01 -0.33 -0.34 0.00 0.00 178.44 177.79 1ojx h GLU 170 N 0.16 0.50 -0.00 1.25 4.39 -0.60 -2.75 114.58 117.54 1ojx h GLU 170 Ca 0.06 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1ojx h GLU 170 Cb 0.00 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 1ojx h GLU 170 CO -0.03 0.52 -0.19 1.28 -1.16 0.00 0.00 179.01 179.43 1ojx n LEU 171 N -4.30 0.38 0.00 1.33 4.77 -0.51 -4.95 117.00 113.72 1ojx n LEU 171 Ca 0.01 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1ojx n LEU 171 Cb 0.23 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1ojx n LEU 171 CO 0.39 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1ojx n GLY 172 N 1.40 1.28 3.64 -0.72 0.00 -1.04 -4.98 105.19 104.77 1ojx n GLY 172 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 1ojx n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ojx n ALA 173 N -0.98 0.50 0.00 4.61 0.00 -0.44 -4.91 120.51 119.29 1ojx n ALA 173 Ca 0.00 0.39 0.01 0.00 0.00 0.00 0.00 53.44 53.84 1ojx n ALA 173 Cb 0.00 -2.14 -0.11 0.00 0.00 0.00 0.00 19.45 17.20 1ojx n ALA 173 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ojx n ASP 174 N 1.22 0.48 -3.83 0.00 8.00 0.42 -4.80 116.55 118.04 1ojx n ASP 174 Ca 0.08 0.21 -0.09 0.00 0.71 0.00 0.00 54.79 55.70 1ojx n ASP 174 Cb 0.33 0.78 -0.06 0.00 -0.02 0.00 0.00 41.12 42.15 1ojx n ASP 174 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ojx s ALA 175 N -3.01 -0.34 0.05 2.24 0.00 -1.04 -4.36 121.76 115.30 1ojx s ALA 175 Ca -0.05 -0.56 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 1ojx s ALA 175 Cb 0.09 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 1ojx s ALA 175 CO 0.84 -0.59 -0.01 0.00 0.00 0.00 0.00 175.76 175.99 1ojx s MET 176 N -3.88 0.57 -0.09 0.00 0.23 -0.75 -1.41 119.30 113.98 1ojx s MET 176 Ca 0.08 -1.09 0.01 0.00 -1.03 0.00 0.00 55.69 53.66 1ojx s MET 176 Cb 0.04 0.20 0.02 0.00 -1.53 0.00 0.00 34.83 33.56 1ojx s MET 176 CO -0.08 -0.11 -0.10 0.21 -2.03 0.00 0.00 175.02 172.92 1ojx s LYS 177 N -3.47 1.57 0.08 3.16 2.20 0.04 -0.66 119.74 122.66 1ojx s LYS 177 Ca 0.03 -0.32 -0.01 0.00 -0.36 0.00 0.00 55.97 55.31 1ojx s LYS 177 Cb 0.05 -1.46 -0.04 0.00 -1.51 0.00 0.00 37.83 34.86 1ojx s LYS 177 CO -0.08 -0.12 -0.00 0.96 -0.36 0.00 0.00 175.35 175.74 1ojx s ILE 178 N 1.18 0.22 0.46 5.43 -4.36 -0.70 -1.59 121.20 121.84 1ojx s ILE 178 Ca -0.05 -1.86 -0.21 0.00 -0.26 0.00 0.00 60.65 58.27 1ojx s ILE 178 Cb -0.14 -1.72 -0.08 0.00 1.25 0.00 0.00 42.46 41.76 1ojx s ILE 178 CO -0.02 -0.80 1.05 -0.54 0.24 0.00 0.00 174.94 174.87 1ojx s LYS 179 N -3.96 3.89 0.29 0.37 1.02 -1.26 -0.60 119.74 119.49 1ojx s LYS 179 Ca 0.13 1.44 -0.28 0.00 0.02 0.00 0.00 55.97 57.28 1ojx s LYS 179 Cb 0.08 -2.24 -0.09 0.00 -0.52 0.00 0.00 37.83 35.05 1ojx s LYS 179 CO -0.05 -0.36 0.98 -0.47 -0.92 0.00 0.00 175.35 174.53 1ojx s TYR 180 N -1.85 3.75 -0.59 3.18 5.04 -1.26 -4.88 117.35 120.73 1ojx s TYR 180 Ca 0.64 1.81 0.25 0.00 -2.44 0.00 0.00 57.07 57.33 1ojx s TYR 180 Cb -0.19 -3.04 0.55 0.00 0.35 0.00 0.00 41.96 39.63 1ojx s TYR 180 CO 0.23 0.07 1.63 1.79 -1.34 0.00 0.00 175.55 177.93 1ojx h THR 181 N 2.88 0.00 0.00 4.34 1.35 -1.95 -3.45 112.91 116.08 1ojx h THR 181 Ca -0.46 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.71 1ojx h THR 181 Cb 1.20 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 1ojx h THR 181 CO 0.66 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.54 1ojx n GLY 182 N 1.23 0.32 3.25 5.82 0.00 -1.26 -4.91 105.19 109.64 1ojx n GLY 182 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1ojx n GLY 182 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ojx s ASP 183 N -2.54 -0.31 0.37 1.61 -4.77 -1.26 -5.07 116.67 104.69 1ojx s ASP 183 Ca 0.00 0.48 0.06 0.00 -3.30 0.00 0.00 52.55 49.78 1ojx s ASP 183 Cb 0.00 0.57 0.70 0.00 -1.09 0.00 0.00 42.92 43.10 1ojx s ASP 183 CO 0.00 -0.26 1.93 1.55 0.70 0.00 0.00 175.17 179.10 1ojx h PRO 184 N 4.88 0.48 0.44 2.11 0.13 -1.98 -2.19 132.00 135.88 1ojx h PRO 184 Ca -0.28 -0.08 -0.02 0.00 -0.87 0.00 0.00 66.00 64.75 1ojx h PRO 184 Cb 1.18 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ojx h PRO 184 CO 0.33 0.47 -0.21 -0.22 -0.23 0.00 0.00 178.00 178.13 1ojx h LYS 185 N 0.47 -0.57 -0.39 0.86 3.64 -1.97 -0.74 116.57 117.86 1ojx h LYS 185 Ca 0.11 0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.45 1ojx h LYS 185 Cb 0.23 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1ojx h LYS 185 CO 0.00 -0.34 -0.07 1.79 -2.27 0.00 0.00 179.45 178.56 1ojx h THR 186 N -0.67 1.24 -0.24 1.00 1.35 -1.98 -2.62 112.91 110.99 1ojx h THR 186 Ca -0.06 -1.03 -0.05 0.00 -0.55 0.00 0.00 66.41 64.71 1ojx h THR 186 Cb 0.49 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.91 1ojx h THR 186 CO 0.10 0.35 -0.09 0.15 -0.25 0.00 0.00 175.52 175.78 1ojx h PHE 187 N 0.62 0.40 0.00 4.73 3.57 -1.33 -2.58 116.94 122.35 1ojx h PHE 187 Ca 0.12 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 1ojx h PHE 187 Cb 0.49 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1ojx h PHE 187 CO 0.02 0.47 -0.28 0.66 -2.23 0.00 0.00 178.31 176.96 1ojx h SER 188 N 0.36 0.00 -0.49 0.41 4.64 -0.74 -1.45 113.55 116.28 1ojx h SER 188 Ca 0.07 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.28 1ojx h SER 188 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1ojx h SER 188 CO 0.02 0.28 -0.13 -0.25 -0.87 0.00 0.00 176.83 175.88 1ojx h TRP 189 N 0.00 1.08 -0.38 4.77 2.91 -1.40 -0.14 115.95 122.79 1ojx h TRP 189 Ca -0.00 -0.24 0.01 0.00 1.13 0.00 0.00 58.89 59.79 1ojx h TRP 189 Cb 0.53 -0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 28.89 1ojx h TRP 189 CO 0.00 1.04 0.24 0.00 -1.03 0.00 0.00 178.44 178.69 1ojx h ALA 190 N 0.89 0.48 -0.87 2.65 0.00 -1.35 -1.76 119.26 119.29 1ojx h ALA 190 Ca 0.12 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1ojx h ALA 190 Cb 0.69 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 1ojx h ALA 190 CO 0.05 -0.08 0.55 0.28 0.00 0.00 0.00 179.25 180.05 1ojx h VAL 191 N 0.49 1.09 -0.38 0.00 2.07 -1.14 -2.44 116.25 115.94 1ojx h VAL 191 Ca 0.14 -0.36 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 1ojx h VAL 191 Cb -0.04 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.68 1ojx h VAL 191 CO -0.04 0.19 -0.04 0.50 0.02 0.00 0.00 177.57 178.20 1ojx h LYS 192 N 1.04 0.70 0.00 1.57 1.63 -0.62 -3.07 116.57 117.82 1ojx h LYS 192 Ca 0.36 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1ojx h LYS 192 Cb 0.09 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 1ojx h LYS 192 CO -0.15 0.82 0.00 -0.39 -3.45 0.00 0.00 179.45 176.28 1ojx h VAL 193 N 0.52 0.00 0.00 2.00 -1.51 -1.21 -2.18 116.25 113.87 1ojx h VAL 193 Ca 0.10 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 1ojx h VAL 193 Cb 0.53 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 1ojx h VAL 193 CO 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.37 1ojx h ALA 194 N 2.17 1.00 -0.80 5.19 0.00 -1.34 -3.42 119.26 122.06 1ojx h ALA 194 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ojx h ALA 194 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ojx h ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1ojx n GLY 195 N 0.05 3.00 0.01 0.00 0.00 -0.82 -2.03 105.19 105.41 1ojx n GLY 195 Ca 0.01 -0.21 0.07 0.00 0.00 0.00 0.00 46.02 45.89 1ojx n GLY 195 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ojx n LYS 196 N 13.61 0.01 -3.19 1.61 5.02 -1.26 -4.72 118.16 129.24 1ojx n LYS 196 Ca 0.00 0.30 -0.40 0.00 -2.02 0.00 0.00 58.31 56.19 1ojx n LYS 196 Cb 0.00 -1.53 -0.06 0.00 -0.02 0.00 0.00 35.03 33.42 1ojx n LYS 196 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ojx s VAL 197 N -3.03 5.06 0.59 -0.18 1.01 -0.86 -5.05 120.40 117.94 1ojx s VAL 197 Ca 0.06 1.04 -0.18 0.00 0.00 0.00 0.00 61.98 62.90 1ojx s VAL 197 Cb 0.08 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1ojx s VAL 197 CO 0.24 0.13 1.14 -2.16 0.00 0.00 0.00 175.10 174.45 1ojx s PRO 198 N 1.90 3.09 -0.13 2.72 0.04 -1.26 -4.85 135.00 136.52 1ojx s PRO 198 Ca 0.25 1.60 0.03 0.00 0.04 0.00 0.00 61.00 62.92 1ojx s PRO 198 Cb -0.16 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1ojx s PRO 198 CO 0.10 -1.06 -0.22 0.08 0.04 0.00 0.00 177.00 175.95 1ojx s VAL 199 N -1.89 2.18 -0.12 -0.36 1.01 -1.26 -1.82 120.40 118.14 1ojx s VAL 199 Ca 0.72 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.71 1ojx s VAL 199 Cb -0.24 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1ojx s VAL 199 CO 0.32 0.55 0.01 -0.76 0.00 0.00 0.00 175.10 175.22 1ojx s LEU 200 N 0.62 3.59 0.13 3.92 1.43 0.16 -1.25 118.68 127.29 1ojx s LEU 200 Ca -0.11 0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 1ojx s LEU 200 Cb -0.16 -1.85 -0.07 0.00 0.03 0.00 0.00 46.19 44.14 1ojx s LEU 200 CO 0.03 0.29 1.17 -0.32 0.23 0.00 0.00 176.35 177.75 1ojx s MET 201 N -0.37 4.49 0.15 1.70 -2.45 -0.68 -1.72 119.30 120.43 1ojx s MET 201 Ca 0.07 1.79 -0.30 0.00 -1.25 0.00 0.00 55.69 56.00 1ojx s MET 201 Cb -0.12 -3.29 -0.07 0.00 1.25 0.00 0.00 34.83 32.59 1ojx s MET 201 CO 0.02 -0.12 1.20 0.45 1.05 0.00 0.00 175.02 177.62 1ojx s SER 202 N 0.45 7.09 0.05 1.11 0.15 0.23 -1.32 113.70 121.46 1ojx s SER 202 Ca 0.54 2.17 -0.36 0.00 0.70 0.00 0.00 55.95 59.01 1ojx s SER 202 Cb -0.30 -2.60 -0.20 0.00 -1.71 0.00 0.00 66.02 61.21 1ojx s SER 202 CO 0.33 -0.39 1.51 1.23 1.20 0.00 0.00 173.24 177.11 1ojx h GLY 203 N 5.69 -1.31 0.00 9.45 0.00 -1.64 -3.42 103.07 111.84 1ojx h GLY 203 Ca -0.44 0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1ojx h GLY 203 CO 0.76 -0.48 0.00 0.61 0.00 0.00 0.00 176.54 177.44 1ojx n GLY 204 N -1.50 -0.26 3.62 4.60 0.00 -1.26 -4.99 105.19 105.41 1ojx n GLY 204 Ca -0.16 -1.89 -0.37 0.00 0.00 0.00 0.00 46.02 43.60 1ojx n GLY 204 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ojx n PRO 205 N -0.40 0.81 -1.69 1.61 -0.02 -1.26 -4.46 135.00 129.59 1ojx n PRO 205 Ca 0.00 0.32 -0.44 0.00 -2.02 0.00 0.00 63.50 61.36 1ojx n PRO 205 Cb 0.00 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 1ojx n PRO 205 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ojx n LYS 206 N -1.26 2.38 -1.87 -0.52 4.81 -1.26 -4.83 118.16 115.61 1ojx n LYS 206 Ca 0.14 0.86 -0.31 0.00 -0.87 0.00 0.00 58.31 58.13 1ojx n LYS 206 Cb 0.48 -2.64 0.03 0.00 0.02 0.00 0.00 35.03 32.92 1ojx n LYS 206 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1ojx s THR 207 N 0.85 4.04 0.17 3.15 -4.23 -1.26 -4.99 115.64 113.37 1ojx s THR 207 Ca 0.76 0.66 -0.14 0.00 -1.18 0.00 0.00 61.69 61.79 1ojx s THR 207 Cb -0.61 -3.65 0.07 0.00 1.34 0.00 0.00 72.50 69.65 1ojx s THR 207 CO 0.38 -0.87 1.83 0.11 -0.54 0.00 0.00 174.62 175.53 1ojx h LYS 208 N -0.51 0.71 -5.50 3.99 1.57 -1.99 -3.44 116.57 111.39 1ojx h LYS 208 Ca -0.45 -0.05 -0.45 0.00 -1.87 0.00 0.00 60.65 57.84 1ojx h LYS 208 Cb 1.22 -0.16 -0.14 0.00 0.08 0.00 0.00 32.23 33.23 1ojx h LYS 208 CO 0.63 0.48 -0.72 0.95 -0.57 0.00 0.00 179.45 180.22 1ojx s THR 209 N -6.11 1.65 0.30 -0.16 -4.23 -1.26 -5.04 115.64 100.79 1ojx s THR 209 Ca -0.13 -2.18 0.01 0.00 -1.18 0.00 0.00 61.69 58.21 1ojx s THR 209 Cb 0.12 -2.12 0.15 0.00 1.34 0.00 0.00 72.50 71.99 1ojx s THR 209 CO 0.75 -0.54 1.84 -0.33 -0.54 0.00 0.00 174.62 175.80 1ojx h GLU 210 N 2.51 0.69 -0.53 3.99 5.08 -2.00 -2.94 114.58 121.38 1ojx h GLU 210 Ca -0.38 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 57.80 1ojx h GLU 210 Cb 1.22 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 1ojx h GLU 210 CO 0.63 0.67 0.21 1.49 -1.00 0.00 0.00 179.01 181.01 1ojx h GLU 211 N 0.66 0.76 -0.26 2.33 4.57 -1.99 -1.82 114.58 118.83 1ojx h GLU 211 Ca 0.14 -0.11 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 1ojx h GLU 211 Cb 0.34 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1ojx h GLU 211 CO 0.01 0.63 0.12 -0.44 -1.18 0.00 0.00 179.01 178.14 1ojx h ASP 212 N 0.75 0.17 -0.36 1.04 3.32 -1.93 -1.06 116.42 118.34 1ojx h ASP 212 Ca 0.18 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 1ojx h ASP 212 Cb 0.16 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1ojx h ASP 212 CO -0.02 0.13 0.05 0.15 -1.72 0.00 0.00 179.24 177.83 1ojx h PHE 213 N 0.25 0.65 -0.91 4.55 3.57 -1.47 -2.37 116.94 121.22 1ojx h PHE 213 Ca 0.11 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.55 1ojx h PHE 213 Cb 0.04 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.56 1ojx h PHE 213 CO -0.10 0.67 0.60 -0.07 -2.23 0.00 0.00 178.31 177.17 1ojx h LEU 214 N 0.44 0.97 -0.73 0.59 3.38 -1.16 -1.45 115.31 117.35 1ojx h LEU 214 Ca 0.11 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1ojx h LEU 214 Cb 0.38 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1ojx h LEU 214 CO 0.01 0.66 0.35 0.50 0.09 0.00 0.00 178.44 180.05 1ojx h LYS 215 N 1.12 1.05 -0.44 1.13 3.64 -1.05 -1.31 116.57 120.71 1ojx h LYS 215 Ca 0.37 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1ojx h LYS 215 Cb 0.05 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 1ojx h LYS 215 CO -0.12 0.82 0.26 1.96 -2.27 0.00 0.00 179.45 180.10 1ojx h GLN 216 N 1.02 0.60 -0.86 1.90 4.20 -0.80 -2.24 115.11 118.94 1ojx h GLN 216 Ca 0.25 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 1ojx h GLN 216 Cb 0.11 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 1ojx h GLN 216 CO -0.03 0.46 0.43 0.28 -0.67 0.00 0.00 178.83 179.29 1ojx h VAL 217 N 0.58 1.26 -0.88 -0.54 2.07 -1.07 -1.43 116.25 116.23 1ojx h VAL 217 Ca 0.16 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1ojx h VAL 217 Cb 0.01 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 1ojx h VAL 217 CO -0.03 0.30 0.53 -0.08 0.02 0.00 0.00 177.57 178.31 1ojx h GLU 218 N 1.21 1.19 -0.46 1.57 4.81 -1.00 -1.75 114.58 120.15 1ojx h GLU 218 Ca 0.30 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 59.33 1ojx h GLU 218 Cb 0.09 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1ojx h GLU 218 CO -0.04 0.84 -0.07 0.78 -0.73 0.00 0.00 179.01 179.78 1ojx h GLY 219 N 1.21 0.93 0.69 1.92 0.00 -0.87 -1.55 103.07 105.39 1ojx h GLY 219 Ca 0.31 -0.74 0.06 0.00 0.00 0.00 0.00 47.33 46.96 1ojx h GLY 219 CO -0.06 0.68 0.36 -2.08 0.00 0.00 0.00 176.54 175.44 1ojx h VAL 220 N 0.70 0.97 -0.32 4.60 2.07 -1.01 -0.84 116.25 122.41 1ojx h VAL 220 Ca 0.12 -0.23 -0.11 0.00 0.82 0.00 0.00 66.70 67.30 1ojx h VAL 220 Cb 0.61 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1ojx h VAL 220 CO 0.04 0.12 -0.24 -0.07 0.02 0.00 0.00 177.57 177.44 1ojx h LEU 221 N 0.67 0.76 -1.22 2.57 3.38 -1.21 -2.53 115.31 117.73 1ojx h LEU 221 Ca 0.29 -0.44 0.08 0.00 0.09 0.00 0.00 57.88 57.90 1ojx h LEU 221 Cb 0.18 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1ojx h LEU 221 CO -0.18 1.04 0.56 -0.08 0.09 0.00 0.00 178.44 179.87 1ojx h GLU 222 N 0.48 0.87 0.00 1.13 4.81 -1.11 -1.56 114.58 119.20 1ojx h GLU 222 Ca 0.06 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1ojx h GLU 222 Cb 0.79 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.98 1ojx h GLU 222 CO 0.06 0.58 0.00 0.00 -0.73 0.00 0.00 179.01 178.92 1ojx n ALA 223 N -2.41 1.75 -0.37 2.92 0.00 -0.34 -4.89 120.51 117.16 1ojx n ALA 223 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1ojx n ALA 223 Cb 0.27 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1ojx n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ojx n GLY 224 N 0.19 0.79 3.76 0.00 0.00 -0.59 -4.44 105.19 104.91 1ojx n GLY 224 Ca 0.04 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 1ojx n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ojx s ALA 225 N -2.00 2.36 0.32 4.61 0.00 -0.97 -4.90 121.76 121.18 1ojx s ALA 225 Ca 0.00 0.50 0.05 0.00 0.00 0.00 0.00 51.96 52.51 1ojx s ALA 225 Cb 0.00 -3.32 0.55 0.00 0.00 0.00 0.00 23.12 20.35 1ojx s ALA 225 CO 0.00 -1.49 1.82 1.25 0.00 0.00 0.00 175.76 177.34 1ojx h LEU 226 N -0.34 0.43 0.00 0.00 5.85 -1.51 -3.44 115.31 116.31 1ojx h LEU 226 Ca -0.46 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1ojx h LEU 226 Cb 1.25 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.16 1ojx h LEU 226 CO 0.53 0.60 0.00 0.61 -0.34 0.00 0.00 178.44 179.83 1ojx n GLY 227 N -0.66 -0.52 3.08 3.75 0.00 -1.24 -1.66 105.19 107.93 1ojx n GLY 227 Ca 0.00 -0.74 -0.15 0.00 0.00 0.00 0.00 46.02 45.13 1ojx n GLY 227 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ojx s ILE 228 N -3.98 0.67 -0.37 -0.61 -4.36 -0.77 -1.68 121.20 110.09 1ojx s ILE 228 Ca 0.00 -1.01 -0.00 0.00 -0.26 0.00 0.00 60.65 59.37 1ojx s ILE 228 Cb 0.00 -0.69 0.10 0.00 1.25 0.00 0.00 42.46 43.12 1ojx s ILE 228 CO 0.00 -0.27 0.13 0.00 0.24 0.00 0.00 174.94 175.04 1ojx s ALA 229 N -1.17 3.03 -0.10 2.27 0.00 -0.44 -1.38 121.76 123.97 1ojx s ALA 229 Ca -0.06 -2.45 -0.01 0.00 0.00 0.00 0.00 51.96 49.44 1ojx s ALA 229 Cb -0.09 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.80 1ojx s ALA 229 CO 0.01 -1.70 -0.06 0.54 0.00 0.00 0.00 175.76 174.55 1ojx s VAL 230 N 1.07 3.76 0.00 0.00 0.11 -0.21 -1.59 120.40 123.54 1ojx s VAL 230 Ca 0.07 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 1ojx s VAL 230 Cb -0.21 -2.58 0.00 0.00 -1.53 0.00 0.00 36.38 32.06 1ojx s VAL 230 CO -0.05 0.56 0.00 0.61 -3.33 0.00 0.00 175.10 172.89 1ojx n GLY 231 N 2.71 0.67 0.29 6.54 0.00 -1.26 -0.91 105.19 113.24 1ojx n GLY 231 Ca -0.18 -0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.93 1ojx n GLY 231 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ojx h ARG 232 N 0.00 0.40 0.00 1.61 3.08 -1.85 -1.07 114.38 116.54 1ojx h ARG 232 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ojx h ARG 232 Cb 0.00 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1ojx h ARG 232 CO 0.00 0.26 0.00 0.09 -1.07 0.00 0.00 179.97 179.25 1ojx n ASN 233 N -5.04 0.00 -0.01 7.04 3.02 -1.26 -1.38 115.26 117.63 1ojx n ASN 233 Ca 0.18 0.26 -0.02 0.00 -0.03 0.00 0.00 54.58 54.96 1ojx n ASN 233 Cb 0.52 -0.36 -0.01 0.00 -0.61 0.00 0.00 39.78 39.33 1ojx n ASN 233 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1ojx n VAL 234 N -1.36 0.46 0.91 2.41 0.31 -0.51 -4.84 118.33 115.71 1ojx n VAL 234 Ca 0.04 0.30 0.12 0.00 -0.01 0.00 0.00 64.34 64.79 1ojx n VAL 234 Cb 0.09 -1.59 0.54 0.00 -0.91 0.00 0.00 33.84 31.98 1ojx n VAL 234 CO 0.00 0.00 0.00 -2.67 -1.32 0.00 0.00 176.83 172.84 1ojx n TRP 235 N -3.03 0.00 1.68 3.52 4.27 -0.62 -2.19 117.44 121.06 1ojx n TRP 235 Ca -0.03 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.72 1ojx n TRP 235 Cb 0.11 -0.45 0.65 0.00 -1.36 0.00 0.00 31.31 30.27 1ojx n TRP 235 CO 0.00 0.00 0.00 0.94 -2.29 0.00 0.00 177.69 176.34 1ojx n GLN 236 N -1.45 1.39 -3.87 -2.67 7.27 -0.48 -4.66 117.38 112.91 1ojx n GLN 236 Ca 0.07 -0.57 -0.35 0.00 0.07 0.00 0.00 57.00 56.22 1ojx n GLN 236 Cb 0.26 -1.46 -0.05 0.00 2.41 0.00 0.00 30.24 31.40 1ojx n GLN 236 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1ojx s ARG 237 N -1.97 3.46 0.44 3.69 0.52 -0.93 -4.36 118.95 119.79 1ojx s ARG 237 Ca 0.40 -0.19 0.24 0.00 -0.52 0.00 0.00 55.73 55.66 1ojx s ARG 237 Cb 0.20 -3.15 0.87 0.00 0.52 0.00 0.00 34.95 33.40 1ojx s ARG 237 CO 0.33 0.73 1.80 0.00 0.02 0.00 0.00 175.30 178.18 1ojx h ARG 238 N 4.43 0.00 -0.97 3.54 3.08 -1.88 -2.43 114.38 120.15 1ojx h ARG 238 Ca -0.52 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 58.87 1ojx h ARG 238 Cb 1.21 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.96 1ojx h ARG 238 CO 0.63 0.21 0.68 -0.40 -1.07 0.00 0.00 179.97 180.02 1ojx n ASP 239 N -3.34 7.23 -0.16 7.04 5.75 -1.26 -4.84 116.55 126.97 1ojx n ASP 239 Ca 0.00 -3.78 -0.03 0.00 -0.01 0.00 0.00 54.79 50.98 1ojx n ASP 239 Cb 0.44 -0.90 0.05 0.00 -1.03 0.00 0.00 41.12 39.68 1ojx n ASP 239 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ojx h ALA 240 N 1.98 0.39 -0.31 2.12 0.00 -1.65 -1.69 119.26 120.10 1ojx h ALA 240 Ca 0.58 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.58 1ojx h ALA 240 Cb 0.97 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1ojx h ALA 240 CO 1.48 -0.42 -0.15 1.25 0.00 0.00 0.00 179.25 181.41 1ojx h LEU 241 N 0.04 0.66 -0.32 0.00 5.85 -1.88 0.54 115.31 120.20 1ojx h LEU 241 Ca 0.25 -0.41 0.04 0.00 0.84 0.00 0.00 57.88 58.60 1ojx h LEU 241 Cb 0.38 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1ojx h LEU 241 CO -0.48 0.93 0.07 0.50 -0.34 0.00 0.00 178.44 179.12 1ojx h LYS 242 N 0.40 0.19 -0.39 1.25 3.64 -1.89 -1.13 116.57 118.64 1ojx h LYS 242 Ca 0.07 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 1ojx h LYS 242 Cb 0.68 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1ojx h LYS 242 CO 0.05 0.12 -0.06 0.35 -2.27 0.00 0.00 179.45 177.63 1ojx h PHE 243 N 0.19 0.81 -0.96 1.91 3.57 -1.15 -2.35 116.94 118.97 1ojx h PHE 243 Ca 0.15 -0.17 0.11 0.00 3.53 0.00 0.00 57.97 61.60 1ojx h PHE 243 Cb 0.16 -0.20 -0.08 0.00 2.79 0.00 0.00 35.95 38.61 1ojx h PHE 243 CO -0.17 0.85 0.59 0.00 -2.23 0.00 0.00 178.31 177.35 1ojx h ALA 244 N 0.85 1.42 -0.27 2.41 0.00 -0.72 -0.12 119.26 122.83 1ojx h ALA 244 Ca 0.10 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1ojx h ALA 244 Cb 0.57 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1ojx h ALA 244 CO 0.03 0.20 -0.26 0.00 0.00 0.00 0.00 179.25 179.22 1ojx h ARG 245 N 0.95 0.52 -0.55 0.00 3.08 -1.03 -1.19 114.38 116.16 1ojx h ARG 245 Ca 0.47 -0.21 -0.08 0.00 0.07 0.00 0.00 59.98 60.24 1ojx h ARG 245 Cb 0.44 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1ojx h ARG 245 CO -0.26 0.74 0.04 0.00 -1.07 0.00 0.00 179.97 179.42 1ojx h ALA 246 N 1.26 1.03 -0.47 0.04 0.00 -0.74 -2.23 119.26 118.15 1ojx h ALA 246 Ca 0.06 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1ojx h ALA 246 Cb 0.70 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1ojx h ALA 246 CO 0.05 0.61 0.03 -0.07 0.00 0.00 0.00 179.25 179.87 1ojx h LEU 247 N 0.85 0.79 -0.55 0.00 3.38 -0.67 -2.32 115.31 116.79 1ojx h LEU 247 Ca 0.17 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.90 1ojx h LEU 247 Cb 0.45 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 1ojx h LEU 247 CO 0.02 0.89 0.27 0.00 0.09 0.00 0.00 178.44 179.71 1ojx h ALA 248 N 0.93 0.72 -0.70 1.53 0.00 -1.17 -0.20 119.26 120.37 1ojx h ALA 248 Ca 0.14 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ojx h ALA 248 Cb 0.46 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1ojx h ALA 248 CO 0.02 -0.09 0.33 1.49 0.00 0.00 0.00 179.25 181.01 1ojx h GLU 249 N 0.51 1.01 0.33 0.00 4.57 -1.24 -1.14 114.58 118.62 1ojx h GLU 249 Ca 0.25 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 58.27 1ojx h GLU 249 Cb 0.19 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 1ojx h GLU 249 CO -0.19 0.80 -0.16 1.25 -1.18 0.00 0.00 179.01 179.53 1ojx h LEU 250 N 0.98 -0.37 -0.16 1.64 5.85 -1.09 -2.26 115.31 119.90 1ojx h LEU 250 Ca 0.24 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 1ojx h LEU 250 Cb 0.12 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 1ojx h LEU 250 CO -0.03 -0.09 -0.16 0.58 -0.34 0.00 0.00 178.44 178.40 1ojx h VAL 251 N -0.66 1.34 0.00 1.05 2.07 -0.97 -3.21 116.25 115.87 1ojx h VAL 251 Ca -0.04 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.15 1ojx h VAL 251 Cb 0.47 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1ojx h VAL 251 CO 0.07 0.39 -0.32 -1.22 0.02 0.00 0.00 177.57 176.51 1ojx n TYR 252 N -4.52 0.19 0.00 1.57 4.01 -0.44 -4.83 117.16 113.13 1ojx n TYR 252 Ca -0.06 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1ojx n TYR 252 Cb 0.38 -0.46 0.00 0.00 -0.31 0.00 0.00 39.34 38.94 1ojx n TYR 252 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81