#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 -0.40 1.20 3.38 -1.98 -2.46 115.31 115.05 1ojx h LEU 4 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1ojx h LEU 4 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1ojx h LEU 4 CO 0.00 0.20 0.01 0.74 0.09 0.00 0.00 178.44 179.48 1ojx h THR 5 N 0.00 1.26 -0.77 0.22 2.02 -1.96 -1.07 112.91 112.60 1ojx h THR 5 Ca -0.00 -1.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.17 1ojx h THR 5 Cb 0.91 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 68.40 1ojx h THR 5 CO 0.03 0.34 0.45 -0.33 0.37 0.00 0.00 175.52 176.38 1ojx h GLU 6 N 0.53 1.06 -0.44 6.66 5.08 -1.85 -0.91 114.58 124.71 1ojx h GLU 6 Ca 0.11 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1ojx h GLU 6 Cb 0.47 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1ojx h GLU 6 CO 0.02 0.76 0.25 -0.22 -1.00 0.00 0.00 179.01 178.81 1ojx h LYS 7 N 1.06 0.61 -0.61 2.33 3.64 -1.37 -2.23 116.57 120.00 1ojx h LYS 7 Ca 0.28 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 1ojx h LYS 7 Cb -0.02 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 31.63 1ojx h LYS 7 CO -0.05 0.48 0.31 0.35 -2.27 0.00 0.00 179.45 178.27 1ojx h PHE 8 N 0.58 0.56 -0.14 1.91 3.57 -0.67 -2.52 116.94 120.23 1ojx h PHE 8 Ca 0.16 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.58 1ojx h PHE 8 Cb 0.04 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1ojx h PHE 8 CO -0.02 0.25 -0.34 -0.07 -2.23 0.00 0.00 178.31 175.89 1ojx h LEU 9 N 0.57 0.28 -0.46 0.59 3.38 -0.92 -0.35 115.31 118.40 1ojx h LEU 9 Ca 0.28 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.99 1ojx h LEU 9 Cb 0.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1ojx h LEU 9 CO -0.20 0.61 -0.36 -0.09 0.09 0.00 0.00 178.44 178.50 1ojx h ARG 10 N 0.24 0.89 0.12 1.13 2.43 -1.17 -0.54 114.38 117.47 1ojx h ARG 10 Ca 0.03 -0.45 -0.25 0.00 -0.81 0.00 0.00 59.98 58.50 1ojx h ARG 10 Cb 0.72 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 1ojx h ARG 10 CO 0.05 1.10 -1.23 0.82 -1.51 0.00 0.00 179.97 179.20 1ojx h ILE 11 N 0.74 1.17 -0.01 1.20 2.04 -1.28 -3.36 117.51 118.00 1ojx h ILE 11 Ca 0.07 -2.43 0.00 0.00 1.00 0.00 0.00 64.86 63.50 1ojx h ILE 11 Cb 0.93 2.84 0.00 0.00 -0.74 0.00 0.00 36.82 39.85 1ojx h ILE 11 CO 0.09 0.69 -0.38 0.49 0.00 0.00 0.00 178.15 179.04 1ojx n PHE 12 N -4.00 0.00 -2.77 1.37 3.72 -0.16 -4.61 117.46 111.00 1ojx n PHE 12 Ca -0.22 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.15 1ojx n PHE 12 Cb 0.87 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.46 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 -0.32 2.78 0.16 4.37 0.00 -0.23 -4.49 120.51 122.77 1ojx n ALA 13 Ca 0.06 -2.64 0.14 0.00 0.00 0.00 0.00 53.44 51.00 1ojx n ALA 13 Cb 0.31 -0.89 0.69 0.00 0.00 0.00 0.00 19.45 19.56 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 -0.06 0.00 0.11 -1.66 -1.20 114.38 114.12 1ojx h ARG 14 Ca -0.16 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.92 1ojx h ARG 14 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1ojx h ARG 14 CO 0.22 0.00 0.00 0.54 0.10 0.00 0.00 179.97 180.83 1ojx n ARG 15 N -4.36 1.49 0.00 0.08 1.74 -1.26 -4.91 116.66 109.44 1ojx n ARG 15 Ca 0.02 -0.73 0.00 0.00 -0.77 0.00 0.00 57.85 56.37 1ojx n ARG 15 Cb 0.30 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 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 1.08 3.37 3.26 -0.13 0.00 -0.45 -5.02 105.19 107.30 1ojx n GLY 16 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.97 1.36 -0.01 1.61 -0.14 -1.26 -4.97 119.74 115.36 1ojx s LYS 17 Ca 0.00 -1.74 -0.00 0.00 -1.36 0.00 0.00 55.97 52.86 1ojx s LYS 17 Cb 0.00 0.04 0.00 0.00 -1.68 0.00 0.00 37.83 36.20 1ojx s LYS 17 CO 0.00 -0.38 0.02 0.45 -0.76 0.00 0.00 175.35 174.67 1ojx s SER 18 N -3.26 -0.01 -0.14 2.83 0.15 -0.61 -4.53 113.70 108.14 1ojx s SER 18 Ca 0.38 0.03 0.00 0.00 0.70 0.00 0.00 55.95 57.06 1ojx s SER 18 Cb 0.07 0.02 0.02 0.00 -1.71 0.00 0.00 66.02 64.42 1ojx s SER 18 CO 0.14 -0.02 -0.12 -0.63 1.20 0.00 0.00 173.24 173.82 1ojx s ILE 19 N 0.10 1.39 -0.14 6.45 1.01 -1.26 -1.72 121.20 127.03 1ojx s ILE 19 Ca -0.01 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 60.08 1ojx s ILE 19 Cb -0.01 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 1ojx s ILE 19 CO -0.00 0.41 -0.05 -0.63 0.00 0.00 0.00 174.94 174.67 1ojx s ILE 20 N 1.56 3.83 -0.49 2.92 -1.09 -0.33 -1.22 121.20 126.38 1ojx s ILE 20 Ca 0.05 -0.39 -0.22 0.00 -2.23 0.00 0.00 60.65 57.86 1ojx s ILE 20 Cb -0.13 -2.65 0.04 0.00 -1.58 0.00 0.00 42.46 38.13 1ojx s ILE 20 CO -0.10 0.52 0.76 -0.22 -1.23 0.00 0.00 174.94 174.67 1ojx s LEU 21 N 0.13 4.42 0.11 2.97 2.96 -0.43 -0.67 118.68 128.17 1ojx s LEU 21 Ca -0.01 -0.39 -0.27 0.00 -0.22 0.00 0.00 54.13 53.23 1ojx s LEU 21 Cb -0.14 -2.77 -0.06 0.00 0.50 0.00 0.00 46.19 43.72 1ojx s LEU 21 CO 0.03 -0.96 0.85 0.00 -1.32 0.00 0.00 176.35 174.95 1ojx s ALA 22 N 3.22 3.34 -0.30 5.97 0.00 0.09 -2.00 121.76 132.09 1ojx s ALA 22 Ca 0.25 0.43 0.19 0.00 0.00 0.00 0.00 51.96 52.83 1ojx s ALA 22 Cb -0.14 -3.10 0.47 0.00 0.00 0.00 0.00 23.12 20.35 1ojx s ALA 22 CO 0.19 0.10 1.23 0.98 0.00 0.00 0.00 175.76 178.26 1ojx n TYR 23 N 2.41 0.05 0.79 0.00 9.36 -0.80 -4.35 117.16 124.62 1ojx n TYR 23 Ca -0.02 -2.08 0.10 0.00 3.32 0.00 0.00 57.90 59.22 1ojx n TYR 23 Cb 0.49 0.39 0.28 0.00 -0.63 0.00 0.00 39.34 39.87 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 -0.81 2.32 0.11 2.98 5.75 -1.25 -4.59 116.55 121.07 1ojx n ASP 24 Ca -0.01 -1.87 0.04 0.00 -0.01 0.00 0.00 54.79 52.94 1ojx n ASP 24 Cb 0.83 -0.21 0.46 0.00 -1.03 0.00 0.00 41.12 41.17 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 2.86 0.28 -0.87 2.11 2.76 -1.94 -2.64 115.15 117.71 1ojx h HIS 25 Ca 0.00 -0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.27 1ojx h HIS 25 Cb 0.64 -0.09 -0.06 0.00 1.55 0.00 0.00 27.41 29.45 1ojx h HIS 25 CO 0.21 0.27 0.56 0.78 -1.30 0.00 0.00 177.93 178.45 1ojx h GLY 26 N 0.51 1.21 0.45 5.26 0.00 -1.81 0.13 103.07 108.83 1ojx h GLY 26 Ca 0.07 -0.33 -0.29 0.00 0.00 0.00 0.00 47.33 46.78 1ojx h GLY 26 CO 0.00 0.16 -1.53 1.19 0.00 0.00 0.00 176.54 176.37 1ojx h ILE 27 N 0.79 0.90 -0.64 2.60 2.10 -1.83 -3.02 117.51 118.41 1ojx h ILE 27 Ca 0.41 -2.34 -0.09 0.00 1.08 0.00 0.00 64.86 63.93 1ojx h ILE 27 Cb 0.51 2.56 -0.02 0.00 -1.09 0.00 0.00 36.82 38.77 1ojx h ILE 27 CO -0.18 0.67 0.05 -0.33 -1.08 0.00 0.00 178.15 177.28 1ojx h GLU 28 N -0.36 1.10 0.00 2.19 4.39 -1.26 -3.37 114.58 117.28 1ojx h GLU 28 Ca -0.34 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.03 1ojx h GLU 28 Cb 1.73 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.27 1ojx h GLU 28 CO 0.01 1.04 -0.56 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 0.34 -2.52 115.22 121.42 1ojx n HIS 29 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1ojx n HIS 29 Cb 0.32 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.43 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 1.74 -1.45 0.04 -1.41 0.00 -0.45 -4.65 105.19 99.01 1ojx n GLY 30 Ca 0.00 -1.56 0.16 0.00 0.00 0.00 0.00 46.02 44.62 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 1.06 -0.19 1.61 -0.04 -1.26 -4.33 135.00 130.22 1ojx n PRO 31 Ca 0.00 -0.09 -0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1ojx n PRO 31 Cb 0.00 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.06 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 4.03 0.66 0.00 0.55 0.00 -1.97 -0.91 119.26 121.62 1ojx h ALA 32 Ca 0.00 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1ojx h ALA 32 Cb 0.05 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ojx h ALA 32 CO 0.00 -0.30 -0.04 -0.44 0.00 0.00 0.00 179.25 178.47 1ojx h ASP 33 N 0.26 0.00 0.05 0.00 3.32 -1.92 -2.06 116.42 116.07 1ojx h ASP 33 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 1ojx h ASP 33 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1ojx h ASP 33 CO -0.37 0.04 0.00 -0.26 -1.72 0.00 0.00 179.24 176.93 1ojx h PHE 34 N 0.00 0.00 -0.14 4.55 0.04 -1.46 -3.23 116.94 116.70 1ojx h PHE 34 Ca -0.00 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.63 1ojx h PHE 34 Cb 0.26 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 1ojx h PHE 34 CO 0.00 0.00 -0.52 0.52 -0.60 0.00 0.00 178.31 177.71 1ojx h MET 35 N 0.00 0.38 -0.82 1.51 2.86 -1.50 -2.91 114.93 114.46 1ojx h MET 35 Ca 0.00 -0.23 0.07 0.00 -2.06 0.00 0.00 59.70 57.48 1ojx h MET 35 Cb 0.03 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 1ojx h MET 35 CO 0.00 0.81 0.54 -0.44 1.06 0.00 0.00 176.91 178.88 1ojx h ASP 36 N 0.30 0.78 -2.50 1.22 3.32 -1.79 -3.31 116.42 114.44 1ojx h ASP 36 Ca 0.01 0.01 -0.59 0.00 0.02 0.00 0.00 57.03 56.48 1ojx h ASP 36 Cb 1.01 -0.16 -0.39 0.00 0.22 0.00 0.00 39.33 40.02 1ojx h ASP 36 CO 0.09 0.49 -0.92 0.21 -1.72 0.00 0.00 179.24 177.39 1ojx s ASN 37 N -6.08 2.01 0.54 6.45 2.47 -1.20 -4.82 114.94 114.30 1ojx s ASN 37 Ca -0.11 -2.96 0.23 0.00 0.42 0.00 0.00 52.86 50.44 1ojx s ASN 37 Cb 0.20 -0.54 1.39 0.00 -1.45 0.00 0.00 41.25 40.85 1ojx s ASN 37 CO 0.79 -0.19 2.05 -0.65 -3.72 0.00 0.00 177.10 175.37 1ojx h PRO 38 N 5.89 0.00 -0.20 0.43 0.11 -1.61 -0.07 132.00 136.56 1ojx h PRO 38 Ca 0.21 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.38 1ojx h PRO 38 Cb 0.91 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1ojx h PRO 38 CO 0.38 0.00 0.32 -0.44 -0.21 0.00 0.00 178.00 178.05 1ojx h ASP 39 N 0.00 0.00 0.31 -2.05 3.32 -1.95 -2.39 116.42 113.66 1ojx h ASP 39 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1ojx h ASP 39 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1ojx h ASP 39 CO -0.00 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.29 1ojx h SER 40 N 0.00 0.00 0.96 6.45 4.64 -1.25 -1.84 113.55 122.50 1ojx h SER 40 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1ojx h SER 40 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1ojx h SER 40 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1ojx n ALA 41 N -1.97 1.98 -2.49 5.18 0.00 -0.90 -4.70 120.51 117.61 1ojx n ALA 41 Ca -0.01 -0.01 -0.43 0.00 0.00 0.00 0.00 53.44 52.99 1ojx n ALA 41 Cb 0.13 -1.40 -0.09 0.00 0.00 0.00 0.00 19.45 18.10 1ojx n ALA 41 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ojx s ASP 42 N -3.83 6.18 0.54 0.00 -1.08 -0.69 -4.97 116.67 112.81 1ojx s ASP 42 Ca 0.09 -0.73 0.24 0.00 -0.52 0.00 0.00 52.55 51.63 1ojx s ASP 42 Cb 0.12 -2.22 1.40 0.00 -1.46 0.00 0.00 42.92 40.77 1ojx s ASP 42 CO 0.45 -0.57 2.02 -0.65 0.52 0.00 0.00 175.17 176.94 1ojx h PRO 43 N 8.72 0.00 -0.92 4.34 0.11 -1.85 -1.31 132.00 141.08 1ojx h PRO 43 Ca -0.26 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1ojx h PRO 43 Cb 1.11 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 1ojx h PRO 43 CO 0.79 0.00 0.56 0.93 -0.21 0.00 0.00 178.00 180.07 1ojx h GLU 44 N 0.00 1.25 -0.69 1.05 5.08 -1.93 -1.73 114.58 117.61 1ojx h GLU 44 Ca 0.20 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1ojx h GLU 44 Cb 0.84 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1ojx h GLU 44 CO -0.00 0.87 0.41 -0.92 -1.00 0.00 0.00 179.01 178.38 1ojx h TYR 45 N 1.27 0.91 -0.56 4.33 3.20 -1.50 -2.34 116.97 122.27 1ojx h TYR 45 Ca 0.33 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.19 1ojx h TYR 45 Cb -0.05 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 37.89 1ojx h TYR 45 CO 0.00 0.62 0.31 0.82 -1.64 0.00 0.00 178.16 178.27 1ojx h ILE 46 N 0.94 1.19 -0.67 1.81 1.08 -1.26 -0.71 117.51 119.88 1ojx h ILE 46 Ca 0.25 -0.47 -0.05 0.00 -0.39 0.00 0.00 64.86 64.20 1ojx h ILE 46 Cb -0.03 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.17 1ojx h ILE 46 CO -0.05 0.20 0.22 -0.07 -0.69 0.00 0.00 178.15 177.77 1ojx h LEU 47 N 0.76 0.97 -0.85 1.44 3.38 -1.18 -2.09 115.31 117.74 1ojx h LEU 47 Ca 0.20 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1ojx h LEU 47 Cb 0.04 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1ojx h LEU 47 CO -0.03 0.91 0.15 0.03 0.09 0.00 0.00 178.44 179.59 1ojx h ARG 48 N 0.98 1.01 -0.21 1.13 3.08 -1.10 -2.08 114.38 117.18 1ojx h ARG 48 Ca 0.22 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1ojx h ARG 48 Cb 0.28 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1ojx h ARG 48 CO -0.01 0.90 0.06 1.25 -1.07 0.00 0.00 179.97 181.10 1ojx h LEU 49 N 0.96 0.32 -0.67 3.04 5.85 -0.91 -0.14 115.31 123.75 1ojx h LEU 49 Ca 0.20 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1ojx h LEU 49 Cb 0.35 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1ojx h LEU 49 CO 0.00 0.46 0.44 0.00 -0.34 0.00 0.00 178.44 179.00 1ojx h ALA 50 N 0.87 0.86 -0.15 1.25 0.00 -1.29 -1.08 119.26 119.73 1ojx h ALA 50 Ca 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1ojx h ALA 50 Cb 0.26 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ojx h ALA 50 CO -0.00 0.27 -0.01 -0.09 0.00 0.00 0.00 179.25 179.42 1ojx h ARG 51 N 0.90 0.27 0.00 0.00 2.43 -1.30 -0.78 114.38 115.90 1ojx h ARG 51 Ca 0.25 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1ojx h ARG 51 Cb -0.09 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1ojx h ARG 51 CO -0.06 0.51 -0.38 -0.44 -1.51 0.00 0.00 179.97 178.09 1ojx h ASP 52 N -0.01 0.00 0.48 -3.80 3.32 -0.85 -2.00 116.42 113.56 1ojx h ASP 52 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1ojx h ASP 52 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1ojx h ASP 52 CO 0.01 0.38 -0.29 0.00 -1.72 0.00 0.00 179.24 177.63 1ojx n ALA 53 N -2.43 3.09 -2.21 3.45 0.00 -0.42 -4.96 120.51 117.03 1ojx n ALA 53 Ca -0.02 -0.31 -0.09 0.00 0.00 0.00 0.00 53.44 53.03 1ojx n ALA 53 Cb 0.43 -1.22 -0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 1.42 0.02 3.79 0.00 0.00 -0.75 -4.74 105.19 104.91 1ojx n GLY 54 Ca 0.09 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.48 2.76 -0.35 1.61 0.08 -0.33 -5.01 117.98 114.26 1ojx s PHE 55 Ca 0.01 1.24 0.23 0.00 0.12 0.00 0.00 56.93 58.53 1ojx s PHE 55 Cb -0.01 -3.09 0.18 0.00 -0.57 0.00 0.00 43.02 39.54 1ojx s PHE 55 CO 0.02 -1.81 1.33 -0.44 -0.10 0.00 0.00 175.22 174.22 1ojx h ASP 56 N -1.12 0.00 -5.91 1.36 3.32 -1.47 -3.45 116.42 109.15 1ojx h ASP 56 Ca -0.47 -0.00 0.37 0.00 0.02 0.00 0.00 57.03 56.95 1ojx h ASP 56 Cb 1.26 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.69 1ojx h ASP 56 CO 0.57 0.00 0.94 -0.83 -1.72 0.00 0.00 179.24 178.20 1ojx s GLY 57 N -4.27 -0.40 0.08 2.75 0.00 -1.24 -4.10 107.32 100.14 1ojx s GLY 57 Ca 0.03 0.69 0.05 0.00 0.00 0.00 0.00 44.72 45.50 1ojx s GLY 57 CO 0.73 1.56 -0.14 -1.34 0.00 0.00 0.00 173.10 173.91 1ojx s VAL 58 N -2.14 1.18 -0.26 1.40 -7.23 -0.58 -1.31 120.40 111.47 1ojx s VAL 58 Ca 0.18 -1.42 -0.05 0.00 -1.81 0.00 0.00 61.98 58.89 1ojx s VAL 58 Cb 0.05 -1.21 0.00 0.00 0.56 0.00 0.00 36.38 35.79 1ojx s VAL 58 CO -0.05 -0.27 0.01 -0.69 -0.31 0.00 0.00 175.10 173.79 1ojx s VAL 59 N -1.51 3.55 0.11 1.32 1.01 -0.85 -1.16 120.40 122.88 1ojx s VAL 59 Ca 0.01 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.42 1ojx s VAL 59 Cb -0.09 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1ojx s VAL 59 CO 0.02 0.24 -0.23 -0.36 0.00 0.00 0.00 175.10 174.77 1ojx s PHE 60 N 1.46 1.99 0.77 5.22 0.08 -0.99 -1.91 117.98 124.61 1ojx s PHE 60 Ca 0.03 -0.40 -0.11 0.00 0.12 0.00 0.00 56.93 56.57 1ojx s PHE 60 Cb -0.16 -1.08 0.05 0.00 -0.57 0.00 0.00 43.02 41.26 1ojx s PHE 60 CO -0.01 0.26 1.08 -0.65 -0.10 0.00 0.00 175.22 175.81 1ojx s GLN 61 N -1.99 2.34 0.24 0.44 -1.52 -1.26 -1.35 119.66 116.56 1ojx s GLN 61 Ca 0.10 0.78 -0.05 0.00 -1.95 0.00 0.00 55.36 54.24 1ojx s GLN 61 Cb -0.10 -1.94 0.43 0.00 -0.22 0.00 0.00 33.01 31.18 1ojx s GLN 61 CO 0.05 -1.48 1.73 0.07 -0.25 0.00 0.00 175.29 175.42 1ojx h ARG 62 N -0.99 0.43 -0.58 2.91 0.11 -1.94 -1.67 114.38 112.64 1ojx h ARG 62 Ca -0.46 -0.03 -0.09 0.00 0.10 0.00 0.00 59.98 59.51 1ojx h ARG 62 Cb 1.25 -0.10 -0.02 0.00 1.11 0.00 0.00 29.97 32.21 1ojx h ARG 62 CO 0.58 0.28 0.02 0.78 0.10 0.00 0.00 179.97 181.73 1ojx h GLY 63 N 0.44 1.08 0.98 0.08 0.00 -1.97 0.23 103.07 103.91 1ojx h GLY 63 Ca 0.40 -0.76 -0.12 0.00 0.00 0.00 0.00 47.33 46.84 1ojx h GLY 63 CO -0.39 0.70 -0.29 -2.22 0.00 0.00 0.00 176.54 174.35 1ojx h ILE 64 N 0.92 1.30 -0.51 2.60 1.08 -1.84 -2.40 117.51 118.66 1ojx h ILE 64 Ca 0.17 -1.46 0.01 0.00 -0.39 0.00 0.00 64.86 63.19 1ojx h ILE 64 Cb 0.51 1.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.81 1ojx h ILE 64 CO 0.02 0.47 0.33 0.00 -0.69 0.00 0.00 178.15 178.29 1ojx h ALA 65 N 0.71 0.64 -0.48 1.87 0.00 -1.10 -0.39 119.26 120.52 1ojx h ALA 65 Ca 0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1ojx h ALA 65 Cb 0.86 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1ojx h ALA 65 CO 0.07 0.08 0.18 1.49 0.00 0.00 0.00 179.25 181.07 1ojx h GLU 66 N 0.68 0.73 0.00 0.00 4.81 -0.89 -2.12 114.58 117.79 1ojx h GLU 66 Ca 0.19 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 1ojx h GLU 66 Cb -0.07 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1ojx h GLU 66 CO -0.04 0.66 -0.79 0.87 -0.73 0.00 0.00 179.01 178.98 1ojx h LYS 67 N 0.64 0.00 0.00 1.92 6.56 -1.38 -3.42 116.57 120.89 1ojx h LYS 67 Ca 0.16 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.75 1ojx h LYS 67 Cb 0.22 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.88 1ojx h LYS 67 CO -0.01 0.29 -0.62 0.66 -2.06 0.00 0.00 179.45 177.71 1ojx n TYR 68 N -3.02 0.00 -1.83 -1.35 4.01 -0.16 -5.07 117.16 109.75 1ojx n TYR 68 Ca -0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 1ojx n TYR 68 Cb 0.71 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.71 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 -1.57 2.94 -0.00 -0.72 5.04 -0.80 -4.89 117.35 117.35 1ojx s TYR 69 Ca 0.00 0.56 0.00 0.00 -2.44 0.00 0.00 57.07 55.19 1ojx s TYR 69 Cb 0.00 -4.03 0.00 0.00 0.35 0.00 0.00 41.96 38.28 1ojx s TYR 69 CO 0.00 -3.77 0.89 -0.40 -1.34 0.00 0.00 175.55 170.93 1ojx n ASP 70 N 3.56 1.56 0.00 4.32 5.75 -1.26 -4.96 116.55 125.51 1ojx n ASP 70 Ca 0.13 -1.79 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 1ojx n ASP 70 Cb 0.37 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 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 -0.40 0.55 0.17 6.12 0.00 -1.26 -4.92 105.19 105.46 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 -3.75 1.61 4.64 -1.98 -3.44 113.55 110.63 1ojx h SER 72 Ca 0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 1ojx h SER 72 Cb 0.12 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.93 1ojx h SER 72 CO 0.00 0.20 -0.67 -0.69 -0.87 0.00 0.00 176.83 174.81 1ojx s VAL 73 N -3.12 -0.00 0.35 0.95 1.01 -1.26 -4.98 120.40 113.35 1ojx s VAL 73 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 61.98 61.75 1ojx s VAL 73 Cb 0.07 -0.07 -0.12 0.00 0.00 0.00 0.00 36.38 36.25 1ojx s VAL 73 CO 0.72 0.00 1.18 -2.65 0.00 0.00 0.00 175.10 174.34 1ojx n PRO 74 N 3.06 1.80 -4.58 2.72 -0.02 -1.26 -4.75 135.00 131.97 1ojx n PRO 74 Ca -0.12 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.66 1ojx n PRO 74 Cb 0.60 -2.17 -0.13 0.00 -0.02 0.00 0.00 33.50 31.78 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 -0.63 2.99 -0.32 2.45 2.96 -1.26 -1.52 118.68 123.34 1ojx s LEU 75 Ca 0.58 -0.23 -0.12 0.00 -0.22 0.00 0.00 54.13 54.15 1ojx s LEU 75 Cb -0.60 -1.70 -0.02 0.00 0.50 0.00 0.00 46.19 44.38 1ojx s LEU 75 CO 0.61 0.17 0.20 -0.63 -1.32 0.00 0.00 176.35 175.38 1ojx s ILE 76 N 0.36 5.06 -0.42 6.68 1.01 -0.31 -0.91 121.20 132.66 1ojx s ILE 76 Ca -0.07 -0.23 -0.22 0.00 0.00 0.00 0.00 60.65 60.12 1ojx s ILE 76 Cb -0.15 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.77 1ojx s ILE 76 CO 0.04 0.05 0.75 -0.22 0.00 0.00 0.00 174.94 175.56 1ojx s LEU 77 N 1.69 4.27 -0.42 2.97 1.98 -0.68 -2.34 118.68 126.16 1ojx s LEU 77 Ca 0.06 -0.05 -0.29 0.00 -2.89 0.00 0.00 54.13 50.96 1ojx s LEU 77 Cb -0.17 -2.92 0.02 0.00 0.66 0.00 0.00 46.19 43.78 1ojx s LEU 77 CO 0.09 -0.83 1.25 -0.75 -1.89 0.00 0.00 176.35 174.22 1ojx s LYS 78 N 3.12 3.71 0.08 1.98 2.47 -0.46 -0.78 119.74 129.88 1ojx s LYS 78 Ca 0.28 0.81 -0.03 0.00 -1.56 0.00 0.00 55.97 55.47 1ojx s LYS 78 Cb -0.13 -3.94 -0.27 0.00 -1.46 0.00 0.00 37.83 32.04 1ojx s LYS 78 CO 0.20 -1.39 1.16 -0.07 0.16 0.00 0.00 175.35 175.42 1ojx h LEU 79 N 11.47 0.40 -9.70 5.43 3.38 -1.37 -3.39 115.31 121.52 1ojx h LEU 79 Ca -0.25 -0.42 -0.55 0.00 0.09 0.00 0.00 57.88 56.75 1ojx h LEU 79 Cb 1.08 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 1ojx h LEU 79 CO 1.10 1.32 -0.59 0.54 0.09 0.00 0.00 178.44 180.89 1ojx s ASN 80 N -7.11 5.10 -0.01 -0.43 4.22 -1.26 -0.86 114.94 114.58 1ojx s ASN 80 Ca -0.04 -0.37 -0.29 0.00 -2.14 0.00 0.00 52.86 50.02 1ojx s ASN 80 Cb 0.07 -1.18 0.07 0.00 1.28 0.00 0.00 41.25 41.50 1ojx s ASN 80 CO 0.88 0.02 0.66 -0.83 -2.04 0.00 0.00 177.10 175.79 1ojx s GLY 81 N -3.49 -0.59 0.30 0.45 0.00 -1.22 -4.86 107.32 97.92 1ojx s GLY 81 Ca 0.31 1.16 0.04 0.00 0.00 0.00 0.00 44.72 46.23 1ojx s GLY 81 CO 0.22 0.81 0.19 -1.59 0.00 0.00 0.00 173.10 172.73 1ojx s LYS 82 N -1.66 1.61 0.27 2.90 -2.85 -1.26 -4.25 119.74 114.50 1ojx s LYS 82 Ca -0.09 -1.92 0.09 0.00 -1.00 0.00 0.00 55.97 53.05 1ojx s LYS 82 Cb -0.00 0.06 -0.04 0.00 -2.06 0.00 0.00 37.83 35.79 1ojx s LYS 82 CO 0.06 -0.51 0.06 0.95 0.10 0.00 0.00 175.35 176.00 1ojx s THR 83 N -3.61 3.62 -0.97 3.79 -4.23 -1.26 -3.54 115.64 109.43 1ojx s THR 83 Ca 0.37 -1.78 0.26 0.00 -1.18 0.00 0.00 61.69 59.36 1ojx s THR 83 Cb 0.04 -2.98 0.22 0.00 1.34 0.00 0.00 72.50 71.13 1ojx s THR 83 CO 0.20 -0.35 1.84 0.35 -0.54 0.00 0.00 174.62 176.12 1ojx n THR 84 N -0.99 0.23 0.20 3.99 -2.24 -1.05 -3.32 114.28 111.09 1ojx n THR 84 Ca -0.06 0.02 0.06 0.00 -2.27 0.00 0.00 64.05 61.80 1ojx n THR 84 Cb 0.59 -0.60 0.39 0.00 -2.10 0.00 0.00 70.33 68.61 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 0.00 0.00 -9.78 3.22 3.38 -1.95 -3.44 115.31 106.73 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 0.48 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.28 1ojx h LEU 85 CO 0.00 0.35 0.69 -0.47 0.09 0.00 0.00 178.44 179.10 1ojx s TYR 86 N -3.80 3.08 -0.55 1.13 5.04 -1.21 -4.96 117.35 116.08 1ojx s TYR 86 Ca -0.01 1.22 0.10 0.00 -2.44 0.00 0.00 57.07 55.94 1ojx s TYR 86 Cb 0.12 -3.72 -0.09 0.00 0.35 0.00 0.00 41.96 38.62 1ojx s TYR 86 CO 0.68 -2.19 0.46 0.09 -1.34 0.00 0.00 175.55 173.25 1ojx n ASN 87 N 1.80 0.61 -2.69 4.32 3.02 -1.26 -5.03 115.26 116.03 1ojx n ASN 87 Ca 0.04 -0.80 -0.05 0.00 -0.03 0.00 0.00 54.58 53.74 1ojx n ASN 87 Cb 0.41 0.90 0.04 0.00 -0.61 0.00 0.00 39.78 40.52 1ojx n ASN 87 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ojx n GLY 88 N 1.16 -2.58 3.76 7.41 0.00 -1.26 -4.98 105.19 108.71 1ojx n GLY 88 Ca 0.02 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1ojx n GLY 88 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ojx s GLU 89 N -3.37 4.14 0.02 1.61 0.41 -1.26 -4.85 118.70 115.40 1ojx s GLU 89 Ca 0.11 2.53 -0.34 0.00 -0.41 0.00 0.00 54.97 56.85 1ojx s GLU 89 Cb -0.01 -3.02 -0.13 0.00 -1.78 0.00 0.00 34.13 29.19 1ojx s GLU 89 CO 0.08 -0.55 1.73 -2.30 -0.49 0.00 0.00 175.26 173.73 1ojx n PRO 90 N 1.56 2.11 -3.71 0.39 -0.02 -1.26 -4.83 135.00 129.23 1ojx n PRO 90 Ca 0.05 0.77 -0.13 0.00 -2.02 0.00 0.00 63.50 62.17 1ojx n PRO 90 Cb 0.39 -2.57 -0.09 0.00 -0.02 0.00 0.00 33.50 31.20 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 2.61 -0.00 -0.13 -1.45 0.11 -1.26 -4.52 120.40 115.76 1ojx s VAL 91 Ca 0.87 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.88 1ojx s VAL 91 Cb -0.70 -0.67 0.06 0.00 -1.53 0.00 0.00 36.38 33.54 1ojx s VAL 91 CO 0.46 0.00 0.14 -0.55 -3.33 0.00 0.00 175.10 171.82 1ojx s SER 92 N 0.27 1.36 0.14 3.54 0.15 -1.26 -4.75 113.70 113.15 1ojx s SER 92 Ca -0.00 -0.07 0.04 0.00 0.70 0.00 0.00 55.95 56.61 1ojx s SER 92 Cb -0.03 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.34 1ojx s SER 92 CO 0.00 -0.29 0.15 0.68 1.20 0.00 0.00 173.24 174.99 1ojx s VAL 93 N 2.24 4.69 0.28 4.45 -7.23 -1.26 -4.78 120.40 118.78 1ojx s VAL 93 Ca 0.04 -0.91 -0.30 0.00 -1.81 0.00 0.00 61.98 59.00 1ojx s VAL 93 Cb -0.14 -3.36 -0.11 0.00 0.56 0.00 0.00 36.38 33.33 1ojx s VAL 93 CO -0.08 -0.04 1.52 0.00 -0.31 0.00 0.00 175.10 176.19 1ojx s ALA 94 N -1.66 3.69 -1.29 1.32 0.00 -1.26 -3.39 121.76 119.16 1ojx s ALA 94 Ca 0.31 1.47 0.12 0.00 0.00 0.00 0.00 51.96 53.86 1ojx s ALA 94 Cb -0.11 -3.61 0.19 0.00 0.00 0.00 0.00 23.12 19.59 1ojx s ALA 94 CO 0.24 -0.88 1.03 0.27 0.00 0.00 0.00 175.76 176.42 1ojx n ASN 95 N 2.16 2.39 -3.75 0.00 0.23 -0.04 -4.94 115.26 111.30 1ojx n ASN 95 Ca 0.07 -1.70 -0.13 0.00 -0.53 0.00 0.00 54.58 52.29 1ojx n ASN 95 Cb 0.39 -0.10 -0.09 0.00 -2.08 0.00 0.00 39.78 37.90 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 -1.26 6.06 0.18 0.00 1.04 -1.26 -4.90 113.70 113.56 1ojx s SER 97 Ca -0.13 0.07 -0.11 0.00 0.48 0.00 0.00 55.95 56.26 1ojx s SER 97 Cb -0.05 -1.55 0.09 0.00 0.10 0.00 0.00 66.02 64.61 1ojx s SER 97 CO 0.04 -0.40 1.75 0.58 0.98 0.00 0.00 173.24 176.19 1ojx h VAL 98 N 0.82 1.23 -0.54 5.02 2.07 -1.95 -1.63 116.25 121.27 1ojx h VAL 98 Ca -0.48 -0.70 0.06 0.00 0.82 0.00 0.00 66.70 66.40 1ojx h VAL 98 Cb 1.24 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 1ojx h VAL 98 CO 0.57 0.28 0.25 -0.08 0.02 0.00 0.00 177.57 178.60 1ojx h GLU 99 N 0.88 0.45 -0.41 1.57 4.81 -1.95 -1.37 114.58 118.56 1ojx h GLU 99 Ca 0.21 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1ojx h GLU 99 Cb 0.18 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1ojx h GLU 99 CO -0.02 0.30 0.04 0.93 -0.73 0.00 0.00 179.01 179.53 1ojx h GLU 100 N 0.47 0.64 -0.83 1.92 5.08 -1.91 -2.44 114.58 117.51 1ojx h GLU 100 Ca 0.25 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1ojx h GLU 100 Cb 0.22 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1ojx h GLU 100 CO -0.21 0.64 0.37 0.00 -1.00 0.00 0.00 179.01 178.81 1ojx h ALA 101 N 1.43 1.09 -0.51 3.43 0.00 -0.35 -1.25 119.26 123.10 1ojx h ALA 101 Ca 0.13 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1ojx h ALA 101 Cb 0.33 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1ojx h ALA 101 CO 0.01 0.67 0.31 0.28 0.00 0.00 0.00 179.25 180.52 1ojx h VAL 102 N 1.19 1.07 0.00 0.00 2.07 -0.99 -2.39 116.25 117.20 1ojx h VAL 102 Ca 0.28 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.55 1ojx h VAL 102 Cb 0.16 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1ojx h VAL 102 CO -0.03 0.11 -0.19 -1.28 0.02 0.00 0.00 177.57 176.21 1ojx h SER 103 N 0.63 0.00 0.25 0.57 0.87 -0.90 -2.51 113.55 112.46 1ojx h SER 103 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1ojx h SER 103 Cb -0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1ojx h SER 103 CO -0.08 0.19 -0.07 0.18 -0.53 0.00 0.00 176.83 176.52 1ojx n LEU 104 N -4.08 0.49 0.00 2.23 4.77 -0.54 -4.94 117.00 114.93 1ojx n LEU 104 Ca -0.02 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1ojx n LEU 104 Cb 0.26 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1ojx n LEU 104 CO 0.35 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1ojx n GLY 105 N 1.21 0.88 3.77 -0.72 0.00 -0.94 -4.90 105.19 104.48 1ojx n GLY 105 Ca 0.17 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 3.21 -0.91 4.61 0.00 -0.94 -4.62 121.76 121.11 1ojx s ALA 106 Ca 0.00 1.11 0.21 0.00 0.00 0.00 0.00 51.96 53.28 1ojx s ALA 106 Cb 0.00 -3.44 -0.24 0.00 0.00 0.00 0.00 23.12 19.44 1ojx s ALA 106 CO 0.00 -0.69 0.86 0.43 0.00 0.00 0.00 175.76 176.36 1ojx n SER 107 N 0.12 0.91 -3.66 0.00 7.64 -0.09 -4.76 113.62 113.78 1ojx n SER 107 Ca 0.04 -0.91 -0.09 0.00 1.01 0.00 0.00 58.87 58.92 1ojx n SER 107 Cb 0.45 1.09 -0.02 0.00 -1.01 0.00 0.00 64.21 64.72 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 -3.05 -1.33 0.15 -0.43 0.00 -1.10 -4.16 121.76 111.85 1ojx s ALA 108 Ca 0.07 0.02 0.11 0.00 0.00 0.00 0.00 51.96 52.16 1ojx s ALA 108 Cb 0.16 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 24.11 1ojx s ALA 108 CO 0.87 -0.89 -0.23 0.14 0.00 0.00 0.00 175.76 175.64 1ojx s VAL 109 N -3.84 2.44 0.10 0.00 -7.23 -0.41 -1.68 120.40 109.77 1ojx s VAL 109 Ca 0.07 -1.82 0.10 0.00 -1.81 0.00 0.00 61.98 58.52 1ojx s VAL 109 Cb -0.03 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 1ojx s VAL 109 CO -0.03 0.00 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.69 1ojx s GLY 110 N -2.35 1.44 -0.18 2.32 0.00 0.04 -0.34 107.32 108.25 1ojx s GLY 110 Ca 0.18 -1.35 -0.11 0.00 0.00 0.00 0.00 44.72 43.44 1ojx s GLY 110 CO 0.09 -1.32 0.44 -0.47 0.00 0.00 0.00 173.10 171.83 1ojx s TYR 111 N -1.02 -0.62 -0.09 1.90 5.04 -0.58 -0.97 117.35 121.01 1ojx s TYR 111 Ca 0.11 1.34 -0.15 0.00 -2.44 0.00 0.00 57.07 55.93 1ojx s TYR 111 Cb -0.10 0.28 -0.05 0.00 0.35 0.00 0.00 41.96 42.44 1ojx s TYR 111 CO 0.05 -0.34 0.38 0.99 -1.34 0.00 0.00 175.55 175.28 1ojx s THR 112 N 1.24 5.18 0.16 4.34 2.01 -1.26 -1.17 115.64 126.14 1ojx s THR 112 Ca -0.08 0.75 0.10 0.00 0.31 0.00 0.00 61.69 62.76 1ojx s THR 112 Cb -0.07 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1ojx s THR 112 CO -0.11 0.45 -0.20 0.27 -0.69 0.00 0.00 174.62 174.35 1ojx s ILE 113 N -0.13 2.67 -0.64 1.82 -4.36 -0.53 -4.85 121.20 115.18 1ojx s ILE 113 Ca 0.22 -1.75 0.05 0.00 -0.26 0.00 0.00 60.65 58.91 1ojx s ILE 113 Cb -0.15 -2.26 0.19 0.00 1.25 0.00 0.00 42.46 41.49 1ojx s ILE 113 CO 0.09 -0.02 0.53 -1.22 0.24 0.00 0.00 174.94 174.56 1ojx n TYR 114 N 0.48 2.59 -1.64 1.37 4.01 -1.26 -1.80 117.16 120.91 1ojx n TYR 114 Ca -0.14 -4.11 -0.45 0.00 -0.16 0.00 0.00 57.90 53.04 1ojx n TYR 114 Cb 0.54 -0.48 -0.03 0.00 -0.31 0.00 0.00 39.34 39.07 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 1.83 1.78 0.00 -0.72 -0.02 -1.26 -1.90 135.00 134.71 1ojx n PRO 115 Ca 0.23 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1ojx n PRO 115 Cb 0.39 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 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 1.92 3.16 3.75 -1.23 0.00 -1.26 -1.89 105.19 109.65 1ojx n GLY 116 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1ojx n GLY 116 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ojx s SER 117 N 0.02 5.42 0.64 1.61 0.15 -0.80 -2.50 113.70 118.24 1ojx s SER 117 Ca 0.00 2.73 0.30 0.00 0.70 0.00 0.00 55.95 59.67 1ojx s SER 117 Cb 0.00 -2.63 1.60 0.00 -1.71 0.00 0.00 66.02 63.27 1ojx s SER 117 CO 0.00 -1.46 1.93 1.23 1.20 0.00 0.00 173.24 176.14 1ojx h GLY 118 N 1.60 0.00 -2.87 9.45 0.00 -1.88 0.10 103.07 109.48 1ojx h GLY 118 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1ojx h GLY 118 CO 0.58 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.81 1ojx n PHE 119 N -3.20 1.59 -0.24 5.60 3.01 -1.26 -4.66 117.46 118.29 1ojx n PHE 119 Ca 0.01 -0.72 0.10 0.00 1.01 0.00 0.00 57.45 57.85 1ojx n PHE 119 Cb 0.45 -0.37 0.37 0.00 -0.01 0.00 0.00 39.48 39.92 1ojx n PHE 119 CO 0.00 0.00 0.00 1.05 1.01 0.00 0.00 176.76 178.82 1ojx h GLU 120 N 3.43 0.69 -0.50 -1.08 4.11 -1.04 -0.32 114.58 119.86 1ojx h GLU 120 Ca 0.00 -0.04 0.02 0.00 0.07 0.00 0.00 59.36 59.41 1ojx h GLU 120 Cb 1.66 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.73 1ojx h GLU 120 CO 0.34 0.46 0.33 0.11 0.07 0.00 0.00 179.01 180.32 1ojx h TRP 121 N 0.71 0.59 -0.48 2.06 5.08 -1.83 -1.68 115.95 120.41 1ojx h TRP 121 Ca 0.41 0.01 -0.10 0.00 1.08 0.00 0.00 58.89 60.29 1ojx h TRP 121 Cb 0.58 -0.20 -0.02 0.00 -3.00 0.00 0.00 29.16 26.53 1ojx h TRP 121 CO -0.00 0.35 -0.10 -0.22 -1.28 0.00 0.00 178.44 177.19 1ojx h LYS 122 N 0.62 0.91 -0.10 0.12 3.64 -1.41 -1.86 116.57 118.49 1ojx h LYS 122 Ca 0.20 -0.34 -0.21 0.00 -1.27 0.00 0.00 60.65 59.03 1ojx h LYS 122 Cb 0.02 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1ojx h LYS 122 CO -0.05 0.99 -0.78 0.52 -2.27 0.00 0.00 179.45 177.86 1ojx h MET 123 N 0.76 0.58 -0.66 1.90 2.86 -1.43 -2.57 114.93 116.36 1ojx h MET 123 Ca 0.12 -0.49 -0.07 0.00 -2.06 0.00 0.00 59.70 57.21 1ojx h MET 123 Cb 0.65 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.39 1ojx h MET 123 CO 0.04 1.11 0.15 0.74 1.06 0.00 0.00 176.91 180.02 1ojx h PHE 124 N 0.39 1.12 -0.37 -0.22 0.04 -1.27 0.28 116.94 116.91 1ojx h PHE 124 Ca -0.05 -0.14 -0.01 0.00 2.80 0.00 0.00 57.97 60.58 1ojx h PHE 124 Cb 1.39 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 39.20 1ojx h PHE 124 CO 0.06 0.93 0.20 1.49 -0.60 0.00 0.00 178.31 180.40 1ojx h GLU 125 N 0.99 0.52 -0.21 1.51 4.81 -1.32 -2.28 114.58 118.61 1ojx h GLU 125 Ca 0.21 -0.06 -0.21 0.00 -0.13 0.00 0.00 59.36 59.17 1ojx h GLU 125 Cb 0.38 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.67 1ojx h GLU 125 CO 0.00 0.43 -0.67 1.49 -0.73 0.00 0.00 179.01 179.53 1ojx h GLU 126 N 0.48 0.83 -0.43 1.92 4.81 -1.33 -3.01 114.58 117.84 1ojx h GLU 126 Ca 0.13 -0.61 0.04 0.00 -0.13 0.00 0.00 59.36 58.79 1ojx h GLU 126 Cb 0.06 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1ojx h GLU 126 CO -0.02 1.23 0.29 1.25 -0.73 0.00 0.00 179.01 181.03 1ojx h LEU 127 N 0.59 0.39 -0.77 1.64 5.85 -0.89 -1.42 115.31 120.70 1ojx h LEU 127 Ca -0.02 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1ojx h LEU 127 Cb 1.30 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 1ojx h LEU 127 CO 0.14 0.26 0.51 0.00 -0.34 0.00 0.00 178.44 179.02 1ojx h ALA 128 N 1.75 0.99 -0.32 1.25 0.00 -1.27 0.22 119.26 121.88 1ojx h ALA 128 Ca 0.18 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1ojx h ALA 128 Cb 0.16 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1ojx h ALA 128 CO -0.04 0.37 -0.37 0.00 0.00 0.00 0.00 179.25 179.21 1ojx h ARG 129 N 1.03 0.81 -0.36 0.00 3.08 -1.32 -2.61 114.38 115.01 1ojx h ARG 129 Ca 0.29 -0.45 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 1ojx h ARG 129 Cb -0.09 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1ojx h ARG 129 CO -0.07 1.08 0.17 0.82 -1.07 0.00 0.00 179.97 180.90 1ojx h ILE 130 N 0.58 1.17 -0.45 2.04 2.04 -0.97 -2.04 117.51 119.88 1ojx h ILE 130 Ca 0.04 -0.48 0.06 0.00 1.00 0.00 0.00 64.86 65.48 1ojx h ILE 130 Cb 0.96 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.82 1ojx h ILE 130 CO 0.09 0.18 0.15 0.50 0.00 0.00 0.00 178.15 179.06 1ojx h LYS 131 N 0.44 0.30 -0.87 2.37 1.63 -0.62 0.12 116.57 119.95 1ojx h LYS 131 Ca 0.12 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.88 1ojx h LYS 131 Cb 0.13 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.65 1ojx h LYS 131 CO -0.01 0.20 0.45 -0.09 -3.45 0.00 0.00 179.45 176.55 1ojx h ARG 132 N 0.31 1.23 -0.39 1.90 2.43 -1.36 -1.93 114.38 116.56 1ojx h ARG 132 Ca 0.21 -0.16 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 1ojx h ARG 132 Cb 0.22 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1ojx h ARG 132 CO -0.23 0.92 -0.24 -0.44 -1.51 0.00 0.00 179.97 178.47 1ojx h ASP 133 N 1.22 0.80 -0.76 -3.80 3.32 -1.02 -2.30 116.42 113.88 1ojx h ASP 133 Ca 0.30 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ojx h ASP 133 Cb 0.06 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 1ojx h ASP 133 CO -0.04 1.01 0.48 0.00 -1.72 0.00 0.00 179.24 178.96 1ojx h ALA 134 N 1.05 0.97 -0.43 3.45 0.00 -0.34 -0.55 119.26 123.41 1ojx h ALA 134 Ca 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ojx h ALA 134 Cb 0.75 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1ojx h ALA 134 CO 0.06 0.41 0.20 0.28 0.00 0.00 0.00 179.25 180.20 1ojx h VAL 135 N 1.04 1.19 -0.67 0.00 2.07 -1.35 -0.19 116.25 118.33 1ojx h VAL 135 Ca 0.28 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1ojx h VAL 135 Cb -0.08 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1ojx h VAL 135 CO -0.06 0.21 0.39 0.50 0.02 0.00 0.00 177.57 178.64 1ojx h LYS 136 N 0.56 0.92 -0.10 1.57 3.64 -0.89 -2.95 116.57 119.33 1ojx h LYS 136 Ca 0.15 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1ojx h LYS 136 Cb 0.14 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1ojx h LYS 136 CO -0.02 0.67 0.00 1.19 -2.27 0.00 0.00 179.45 179.02 1ojx n PHE 137 N -4.55 0.11 -3.72 1.91 3.72 -0.26 -4.98 117.46 109.70 1ojx n PHE 137 Ca 0.05 -0.05 -0.25 0.00 -0.05 0.00 0.00 57.45 57.15 1ojx n PHE 137 Cb 0.07 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.66 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 0.66 -4.75 -4.38 4.37 2.03 -0.20 -5.01 116.55 109.28 1ojx n ASP 138 Ca 0.17 -0.67 -0.34 0.00 0.52 0.00 0.00 54.79 54.47 1ojx n ASP 138 Cb 0.44 -4.49 -0.14 0.00 -0.72 0.00 0.00 41.12 36.21 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 -7.13 2.96 0.37 -2.67 1.02 -0.52 -5.04 118.68 107.66 1ojx s LEU 139 Ca 0.49 -0.30 -0.28 0.00 0.02 0.00 0.00 54.13 54.06 1ojx s LEU 139 Cb -0.23 -1.72 -0.11 0.00 0.02 0.00 0.00 46.19 44.14 1ojx s LEU 139 CO 0.78 0.08 1.45 -2.65 0.02 0.00 0.00 176.35 176.03 1ojx n PRO 140 N 4.11 2.57 -3.54 1.29 -0.02 -1.26 -4.52 135.00 133.63 1ojx n PRO 140 Ca -0.18 0.90 -0.39 0.00 -2.02 0.00 0.00 63.50 61.81 1ojx n PRO 140 Cb 0.52 -2.61 -0.11 0.00 -0.02 0.00 0.00 33.50 31.29 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 -1.77 4.15 -0.25 2.45 2.96 -1.26 -1.29 118.68 123.67 1ojx s LEU 141 Ca 0.54 -0.06 -0.08 0.00 -0.22 0.00 0.00 54.13 54.31 1ojx s LEU 141 Cb -0.50 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 43.98 1ojx s LEU 141 CO 0.63 -0.12 0.08 -0.69 -1.32 0.00 0.00 176.35 174.92 1ojx s VAL 142 N 1.82 4.36 -0.22 1.68 1.01 0.54 -0.57 120.40 129.01 1ojx s VAL 142 Ca 0.08 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 1ojx s VAL 142 Cb -0.16 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1ojx s VAL 142 CO 0.11 0.33 0.07 -0.69 0.00 0.00 0.00 175.10 174.92 1ojx s VAL 143 N 1.62 4.51 -0.39 2.92 1.01 -0.65 -1.53 120.40 127.89 1ojx s VAL 143 Ca 0.06 -0.12 -0.25 0.00 0.00 0.00 0.00 61.98 61.68 1ojx s VAL 143 Cb -0.15 -3.08 0.02 0.00 0.00 0.00 0.00 36.38 33.17 1ojx s VAL 143 CO 0.04 0.38 0.88 0.26 0.00 0.00 0.00 175.10 176.66 1ojx s TRP 144 N 1.16 3.06 -0.37 5.22 0.23 -0.31 -1.37 118.94 126.55 1ojx s TRP 144 Ca 0.04 0.62 -0.06 0.00 -2.03 0.00 0.00 56.10 54.68 1ojx s TRP 144 Cb -0.14 -3.64 0.07 0.00 0.03 0.00 0.00 33.47 29.78 1ojx s TRP 144 CO 0.03 -0.85 0.15 0.45 0.96 0.00 0.00 176.95 177.69 1ojx s SER 145 N 1.95 5.32 -0.52 2.95 0.15 -0.69 -1.45 113.70 121.41 1ojx s SER 145 Ca 0.36 -1.44 0.03 0.00 0.70 0.00 0.00 55.95 55.60 1ojx s SER 145 Cb -0.12 -1.86 0.15 0.00 -1.71 0.00 0.00 66.02 62.47 1ojx s SER 145 CO 0.20 -0.42 0.32 -0.31 1.20 0.00 0.00 173.24 174.24 1ojx s TYR 146 N 1.33 2.46 0.12 3.44 2.02 -0.75 -4.64 117.35 121.34 1ojx s TYR 146 Ca 0.01 -2.77 -0.35 0.00 -0.37 0.00 0.00 57.07 53.59 1ojx s TYR 146 Cb -0.21 -2.11 -0.15 0.00 -0.40 0.00 0.00 41.96 39.09 1ojx s TYR 146 CO 0.00 -0.72 1.52 -2.30 -1.57 0.00 0.00 175.55 172.48 1ojx n PRO 147 N 2.95 1.80 -3.64 -1.71 -0.02 -1.26 -4.08 135.00 129.05 1ojx n PRO 147 Ca 0.14 0.65 -0.07 0.00 -2.02 0.00 0.00 63.50 62.20 1ojx n PRO 147 Cb 0.36 -2.38 -0.07 0.00 -0.02 0.00 0.00 33.50 31.39 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 0.95 0.53 0.05 -0.52 3.52 -0.79 -4.85 118.95 117.83 1ojx s ARG 148 Ca 0.82 0.74 0.00 0.00 -0.13 0.00 0.00 55.73 57.16 1ojx s ARG 148 Cb -0.78 0.20 0.00 0.00 -1.56 0.00 0.00 34.95 32.82 1ojx s ARG 148 CO 0.42 -0.08 0.00 0.41 -0.81 0.00 0.00 175.30 175.24 1ojx n GLY 149 N 2.96 -3.40 7.00 8.12 0.00 -1.26 -2.38 105.19 116.23 1ojx n GLY 149 Ca -0.15 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.30 3.48 0.10 -0.02 0.00 -1.04 -1.74 105.19 105.66 1ojx n GLY 150 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 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 0.91 -2.43 1.61 5.02 -1.26 -4.88 118.16 131.14 1ojx n LYS 151 Ca 0.00 -0.19 -0.43 0.00 -2.02 0.00 0.00 58.31 55.67 1ojx n LYS 151 Cb 0.00 -1.50 -0.02 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 -2.22 4.28 -0.04 -0.18 1.01 -0.71 -4.88 120.40 117.66 1ojx s VAL 152 Ca 0.38 1.54 0.03 0.00 0.00 0.00 0.00 61.98 63.94 1ojx s VAL 152 Cb 0.21 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 1ojx s VAL 152 CO 0.41 -0.16 0.09 1.33 0.00 0.00 0.00 175.10 176.77 1ojx n VAL 153 N 5.44 0.00 -3.56 2.92 0.24 -1.26 -4.56 118.33 117.54 1ojx n VAL 153 Ca 0.14 -0.17 -0.29 0.00 -2.04 0.00 0.00 64.34 61.99 1ojx n VAL 153 Cb 0.45 0.57 -0.15 0.00 -1.47 0.00 0.00 33.84 33.23 1ojx n VAL 153 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1ojx s ASN 154 N -2.12 3.35 0.45 -1.34 2.47 -1.26 -5.02 114.94 111.46 1ojx s ASN 154 Ca -0.01 -1.19 0.31 0.00 0.42 0.00 0.00 52.86 52.40 1ojx s ASN 154 Cb 0.02 -0.36 1.42 0.00 -1.45 0.00 0.00 41.25 40.88 1ojx s ASN 154 CO 0.14 -0.42 1.92 -0.33 -3.72 0.00 0.00 177.10 174.69 1ojx h GLU 155 N 8.39 0.00 -0.50 0.43 5.08 -1.93 -2.23 114.58 123.82 1ojx h GLU 155 Ca -0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1ojx h GLU 155 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1ojx h GLU 155 CO 0.41 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.67 1ojx n THR 156 N -2.70 0.85 -1.78 1.13 -2.24 -1.26 -4.45 114.28 103.83 1ojx n THR 156 Ca 0.00 -0.92 -0.41 0.00 -2.27 0.00 0.00 64.05 60.45 1ojx n THR 156 Cb 0.20 0.64 -0.00 0.00 -2.10 0.00 0.00 70.33 69.06 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 1.19 2.39 -0.26 6.98 0.00 -0.84 -4.52 120.51 125.45 1ojx n ALA 157 Ca 0.18 0.34 0.04 0.00 0.00 0.00 0.00 53.44 54.00 1ojx n ALA 157 Cb 0.54 -2.42 0.17 0.00 0.00 0.00 0.00 19.45 17.74 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 2.98 0.49 -0.03 0.00 0.11 -1.91 -1.75 132.00 131.89 1ojx h PRO 158 Ca -0.51 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 1ojx h PRO 158 Cb 1.24 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1ojx h PRO 158 CO 0.64 0.32 -0.41 1.05 -0.21 0.00 0.00 178.00 179.39 1ojx h GLU 159 N 0.51 0.06 0.05 1.05 9.09 -1.96 -1.80 114.58 121.58 1ojx h GLU 159 Ca 0.40 -0.03 -0.24 0.00 0.05 0.00 0.00 59.36 59.54 1ojx h GLU 159 Cb 0.55 -0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.67 1ojx h GLU 159 CO -0.36 0.47 -0.96 0.82 0.05 0.00 0.00 179.01 179.03 1ojx h ILE 160 N 0.06 1.34 -0.58 -1.06 1.08 -1.71 -2.26 117.51 114.38 1ojx h ILE 160 Ca 0.00 -2.29 -0.10 0.00 -0.39 0.00 0.00 64.86 62.09 1ojx h ILE 160 Cb 0.75 2.61 -0.02 0.00 -3.07 0.00 0.00 36.82 37.10 1ojx h ILE 160 CO 0.06 0.69 -0.03 0.58 -0.69 0.00 0.00 178.15 178.75 1ojx h VAL 161 N 0.15 1.27 -0.36 1.67 2.07 -1.31 0.14 116.25 119.87 1ojx h VAL 161 Ca -0.13 -1.18 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 1ojx h VAL 161 Cb 1.65 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1ojx h VAL 161 CO 0.19 0.42 -0.02 0.00 0.02 0.00 0.00 177.57 178.18 1ojx h ALA 162 N 0.96 1.30 -0.46 1.67 0.00 -1.40 -1.84 119.26 119.50 1ojx h ALA 162 Ca 0.16 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1ojx h ALA 162 Cb 0.59 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1ojx h ALA 162 CO 0.04 0.47 -0.02 -0.92 0.00 0.00 0.00 179.25 178.82 1ojx h TYR 163 N 0.55 0.90 -0.43 0.00 -0.00 -0.99 -2.08 116.97 114.91 1ojx h TYR 163 Ca 0.11 -0.16 0.05 0.00 -0.00 0.00 0.00 58.73 58.73 1ojx h TYR 163 Cb 0.38 -0.23 -0.05 0.00 -0.00 0.00 0.00 36.73 36.83 1ojx h TYR 163 CO 0.01 0.88 0.16 0.00 -0.00 0.00 0.00 178.16 179.21 1ojx h ALA 164 N 0.91 0.52 -0.23 1.82 0.00 -0.67 -1.68 119.26 119.92 1ojx h ALA 164 Ca 0.13 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ojx h ALA 164 Cb 0.53 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1ojx h ALA 164 CO 0.03 -0.23 0.12 0.00 0.00 0.00 0.00 179.25 179.17 1ojx h ALA 165 N 1.28 0.30 -0.53 0.00 0.00 -1.16 -2.88 119.26 116.27 1ojx h ALA 165 Ca 0.20 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1ojx h ALA 165 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ojx h ALA 165 CO -0.20 -0.16 0.01 -0.09 0.00 0.00 0.00 179.25 178.81 1ojx h ARG 166 N 0.26 0.94 -0.69 0.00 9.65 -1.14 -2.80 114.38 120.60 1ojx h ARG 166 Ca 0.08 -0.29 0.03 0.00 -1.10 0.00 0.00 59.98 58.70 1ojx h ARG 166 Cb 0.08 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 28.53 1ojx h ARG 166 CO -0.01 0.95 0.42 0.82 2.80 0.00 0.00 179.97 184.95 1ojx h ILE 167 N 0.81 1.07 -0.64 1.20 2.04 -1.29 -0.97 117.51 119.74 1ojx h ILE 167 Ca 0.15 -0.28 0.01 0.00 1.00 0.00 0.00 64.86 65.74 1ojx h ILE 167 Cb 0.52 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1ojx h ILE 167 CO 0.03 0.15 0.42 0.00 0.00 0.00 0.00 178.15 178.75 1ojx h ALA 168 N 1.30 0.81 -0.28 1.87 0.00 -1.37 -1.16 119.26 120.44 1ojx h ALA 168 Ca 0.28 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1ojx h ALA 168 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1ojx h ALA 168 CO -0.12 0.24 0.16 1.25 0.00 0.00 0.00 179.25 180.78 1ojx h LEU 169 N 0.87 0.26 -1.37 0.00 5.85 -1.18 -1.63 115.31 118.11 1ojx h LEU 169 Ca 0.24 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.93 1ojx h LEU 169 Cb -0.10 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1ojx h LEU 169 CO -0.05 0.19 0.08 -0.33 -0.34 0.00 0.00 178.44 177.99 1ojx h GLU 170 N 0.33 0.50 -0.00 1.25 4.39 -0.64 -2.76 114.58 117.65 1ojx h GLU 170 Ca 0.11 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1ojx h GLU 170 Cb 0.00 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 1ojx h GLU 170 CO -0.05 0.47 -0.44 1.28 -1.16 0.00 0.00 179.01 179.10 1ojx n LEU 171 N -4.34 0.47 0.00 1.33 4.77 -0.49 -4.95 117.00 113.79 1ojx n LEU 171 Ca 0.02 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1ojx n LEU 171 Cb 0.18 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1ojx n LEU 171 CO 0.38 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1ojx n GLY 172 N 1.49 1.45 3.72 -0.72 0.00 -1.04 -4.98 105.19 105.11 1ojx n GLY 172 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.92 1.53 0.04 4.61 0.00 -0.63 -4.90 120.51 120.24 1ojx n ALA 173 Ca 0.00 0.29 0.06 0.00 0.00 0.00 0.00 53.44 53.79 1ojx n ALA 173 Cb 0.00 -2.30 -0.07 0.00 0.00 0.00 0.00 19.45 17.07 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 0.27 0.62 -3.83 0.00 8.00 0.26 -4.80 116.55 117.07 1ojx n ASP 174 Ca 0.05 0.25 -0.09 0.00 0.71 0.00 0.00 54.79 55.71 1ojx n ASP 174 Cb 0.39 0.72 -0.05 0.00 -0.02 0.00 0.00 41.12 42.16 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 -3.19 -0.58 0.06 2.24 0.00 -1.10 -4.33 121.76 114.86 1ojx s ALA 175 Ca -0.04 -0.48 -0.04 0.00 0.00 0.00 0.00 51.96 51.40 1ojx s ALA 175 Cb 0.10 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 24.06 1ojx s ALA 175 CO 0.82 -0.75 0.07 0.00 0.00 0.00 0.00 175.76 175.90 1ojx s MET 176 N -3.91 0.69 -0.11 0.00 0.23 -0.89 -1.64 119.30 113.66 1ojx s MET 176 Ca 0.12 -1.06 0.01 0.00 -1.03 0.00 0.00 55.69 53.74 1ojx s MET 176 Cb 0.00 0.26 0.02 0.00 -1.53 0.00 0.00 34.83 33.58 1ojx s MET 176 CO -0.01 -0.17 -0.13 0.21 -2.03 0.00 0.00 175.02 172.89 1ojx s LYS 177 N -3.69 1.96 0.17 3.16 2.20 -0.47 -1.02 119.74 122.05 1ojx s LYS 177 Ca 0.04 -0.46 0.01 0.00 -0.36 0.00 0.00 55.97 55.21 1ojx s LYS 177 Cb 0.05 -1.75 -0.04 0.00 -1.51 0.00 0.00 37.83 34.58 1ojx s LYS 177 CO -0.10 -0.12 0.03 0.96 -0.36 0.00 0.00 175.35 175.76 1ojx s ILE 178 N 1.16 0.52 0.44 5.43 -4.36 -0.74 -1.70 121.20 121.95 1ojx s ILE 178 Ca -0.04 -1.96 -0.21 0.00 -0.26 0.00 0.00 60.65 58.18 1ojx s ILE 178 Cb -0.14 -2.16 -0.10 0.00 1.25 0.00 0.00 42.46 41.31 1ojx s ILE 178 CO -0.03 -0.42 0.97 -0.54 0.24 0.00 0.00 174.94 175.16 1ojx s LYS 179 N -3.96 4.13 0.27 0.37 1.02 -1.26 -0.67 119.74 119.64 1ojx s LYS 179 Ca 0.25 1.18 -0.29 0.00 0.02 0.00 0.00 55.97 57.14 1ojx s LYS 179 Cb 0.07 -2.17 -0.09 0.00 -0.52 0.00 0.00 37.83 35.11 1ojx s LYS 179 CO 0.04 -0.12 0.95 -0.47 -0.92 0.00 0.00 175.35 174.83 1ojx s TYR 180 N -2.12 3.88 -0.52 3.18 5.04 -1.26 -4.90 117.35 120.64 1ojx s TYR 180 Ca 0.63 1.87 0.25 0.00 -2.44 0.00 0.00 57.07 57.38 1ojx s TYR 180 Cb -0.11 -2.97 0.57 0.00 0.35 0.00 0.00 41.96 39.80 1ojx s TYR 180 CO 0.15 0.35 1.69 1.79 -1.34 0.00 0.00 175.55 178.19 1ojx h THR 181 N 2.96 0.00 0.00 4.34 1.35 -1.95 -3.45 112.91 116.16 1ojx h THR 181 Ca -0.46 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 1ojx h THR 181 Cb 1.20 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 1ojx h THR 181 CO 0.67 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 1ojx n GLY 182 N 1.10 0.32 3.39 5.82 0.00 -1.26 -4.91 105.19 109.65 1ojx n GLY 182 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.24 -0.48 0.42 1.61 -4.77 -1.26 -5.07 116.67 104.88 1ojx s ASP 183 Ca 0.00 0.80 0.13 0.00 -3.30 0.00 0.00 52.55 50.17 1ojx s ASP 183 Cb 0.00 0.82 0.92 0.00 -1.09 0.00 0.00 42.92 43.57 1ojx s ASP 183 CO 0.00 -0.29 1.96 1.55 0.70 0.00 0.00 175.17 179.09 1ojx h PRO 184 N 4.71 0.08 0.28 2.11 0.13 -1.97 -2.49 132.00 134.85 1ojx h PRO 184 Ca -0.28 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 1ojx h PRO 184 Cb 1.17 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1ojx h PRO 184 CO 0.26 0.25 -0.14 -0.22 -0.23 0.00 0.00 178.00 177.92 1ojx h LYS 185 N 0.08 -0.37 -0.24 0.86 3.64 -1.97 -0.25 116.57 118.32 1ojx h LYS 185 Ca 0.01 0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.29 1ojx h LYS 185 Cb 0.35 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1ojx h LYS 185 CO 0.02 -0.15 -0.39 1.79 -2.27 0.00 0.00 179.45 178.45 1ojx h THR 186 N -0.52 1.30 -0.08 1.00 1.35 -1.99 -2.64 112.91 111.34 1ojx h THR 186 Ca -0.04 -1.55 -0.08 0.00 -0.55 0.00 0.00 66.41 64.19 1ojx h THR 186 Cb 0.39 1.54 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 1ojx h THR 186 CO 0.06 0.49 -0.32 0.15 -0.25 0.00 0.00 175.52 175.65 1ojx h PHE 187 N 0.46 0.16 -0.00 4.73 3.57 -1.39 -2.69 116.94 121.78 1ojx h PHE 187 Ca 0.04 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1ojx h PHE 187 Cb 0.89 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1ojx h PHE 187 CO 0.04 0.46 -0.20 0.66 -2.23 0.00 0.00 178.31 177.04 1ojx h SER 188 N 0.13 0.00 -0.48 0.41 4.64 -0.65 -1.77 113.55 115.83 1ojx h SER 188 Ca 0.02 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.26 1ojx h SER 188 Cb 0.64 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.71 1ojx h SER 188 CO 0.05 0.20 -0.01 -0.25 -0.87 0.00 0.00 176.83 175.95 1ojx h TRP 189 N 0.00 0.94 -0.70 4.77 2.91 -1.44 -1.13 115.95 121.29 1ojx h TRP 189 Ca -0.00 -0.16 -0.00 0.00 1.13 0.00 0.00 58.89 59.85 1ojx h TRP 189 Cb 0.35 -0.24 -0.03 0.00 -0.51 0.00 0.00 29.16 28.72 1ojx h TRP 189 CO 0.00 0.89 0.43 0.00 -1.03 0.00 0.00 178.44 178.73 1ojx h ALA 190 N 0.92 0.90 -0.74 2.65 0.00 -1.38 -1.42 119.26 120.20 1ojx h ALA 190 Ca 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ojx h ALA 190 Cb 0.52 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ojx h ALA 190 CO 0.03 0.36 0.33 0.28 0.00 0.00 0.00 179.25 180.25 1ojx h VAL 191 N 0.96 1.24 -0.38 0.00 2.07 -1.25 -2.74 116.25 116.14 1ojx h VAL 191 Ca 0.25 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 1ojx h VAL 191 Cb -0.05 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 1ojx h VAL 191 CO -0.05 0.30 0.12 0.50 0.02 0.00 0.00 177.57 178.46 1ojx h LYS 192 N 1.04 0.60 0.00 1.57 3.64 -0.65 -3.00 116.57 119.77 1ojx h LYS 192 Ca 0.25 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1ojx h LYS 192 Cb 0.16 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1ojx h LYS 192 CO -0.03 0.61 0.00 -0.39 -2.27 0.00 0.00 179.45 177.37 1ojx h VAL 193 N 0.48 0.00 0.00 2.00 -1.51 -1.20 -1.33 116.25 114.69 1ojx h VAL 193 Ca 0.12 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 1ojx h VAL 193 Cb 0.26 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1ojx h VAL 193 CO -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.34 1ojx n ALA 194 N -1.86 1.85 -0.80 5.19 0.00 -1.04 -4.63 120.51 119.23 1ojx n ALA 194 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1ojx n ALA 194 Cb 0.35 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1ojx n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ojx n GLY 195 N 0.40 3.61 0.04 0.00 0.00 -0.50 -2.13 105.19 106.60 1ojx n GLY 195 Ca 0.03 0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.16 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 14.00 0.06 -3.23 1.61 5.02 -1.26 -4.72 118.16 129.64 1ojx n LYS 196 Ca 0.00 0.29 -0.40 0.00 -2.02 0.00 0.00 58.31 56.18 1ojx n LYS 196 Cb 0.00 -1.60 -0.07 0.00 -0.02 0.00 0.00 35.03 33.34 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 -3.09 5.08 0.58 -0.18 1.01 -0.91 -5.05 120.40 117.84 1ojx s VAL 197 Ca 0.06 0.94 -0.18 0.00 0.00 0.00 0.00 61.98 62.81 1ojx s VAL 197 Cb 0.10 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1ojx s VAL 197 CO 0.31 0.12 1.11 -2.16 0.00 0.00 0.00 175.10 174.48 1ojx s PRO 198 N 2.03 3.23 -0.12 2.72 0.04 -1.26 -4.85 135.00 136.78 1ojx s PRO 198 Ca 0.23 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.78 1ojx s PRO 198 Cb -0.15 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 1ojx s PRO 198 CO 0.09 -0.93 -0.17 0.08 0.04 0.00 0.00 177.00 176.11 1ojx s VAL 199 N -2.00 2.65 -0.11 -0.36 1.01 -1.26 -2.10 120.40 118.23 1ojx s VAL 199 Ca 0.70 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1ojx s VAL 199 Cb -0.22 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1ojx s VAL 199 CO 0.31 0.53 -0.04 -0.76 0.00 0.00 0.00 175.10 175.15 1ojx s LEU 200 N 0.43 3.32 0.02 3.92 1.43 -0.19 -0.86 118.68 126.76 1ojx s LEU 200 Ca -0.13 -0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 1ojx s LEU 200 Cb -0.16 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 1ojx s LEU 200 CO 0.06 0.29 1.23 -0.32 0.23 0.00 0.00 176.35 177.84 1ojx s MET 201 N -0.35 4.39 0.23 1.70 -2.45 -0.53 -1.79 119.30 120.49 1ojx s MET 201 Ca 0.06 1.78 -0.30 0.00 -1.25 0.00 0.00 55.69 55.98 1ojx s MET 201 Cb -0.12 -3.43 -0.09 0.00 1.25 0.00 0.00 34.83 32.44 1ojx s MET 201 CO 0.02 -0.36 1.28 0.45 1.05 0.00 0.00 175.02 177.46 1ojx s SER 202 N 1.28 6.93 0.03 1.11 0.15 0.16 -0.72 113.70 122.64 1ojx s SER 202 Ca 0.59 2.43 -0.29 0.00 0.70 0.00 0.00 55.95 59.38 1ojx s SER 202 Cb -0.29 -2.62 -0.17 0.00 -1.71 0.00 0.00 66.02 61.24 1ojx s SER 202 CO 0.27 -0.48 1.31 1.23 1.20 0.00 0.00 173.24 176.77 1ojx h GLY 203 N 4.84 -0.86 0.00 9.45 0.00 -1.64 -3.42 103.07 111.45 1ojx h GLY 203 Ca -0.46 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1ojx h GLY 203 CO 0.74 -0.31 0.00 0.61 0.00 0.00 0.00 176.54 177.58 1ojx n GLY 204 N -0.85 -0.10 3.73 4.60 0.00 -1.26 -4.98 105.19 106.34 1ojx n GLY 204 Ca -0.12 -1.92 -0.36 0.00 0.00 0.00 0.00 46.02 43.62 1ojx n GLY 204 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ojx s PRO 205 N -1.10 2.42 0.09 1.61 0.02 -1.26 -4.48 135.00 132.30 1ojx s PRO 205 Ca 0.00 2.00 -0.34 0.00 0.02 0.00 0.00 61.00 62.68 1ojx s PRO 205 Cb 0.00 -1.84 -0.14 0.00 0.02 0.00 0.00 34.50 32.54 1ojx s PRO 205 CO 0.00 -1.68 1.61 1.17 -0.33 0.00 0.00 177.00 177.77 1ojx n LYS 206 N -2.12 2.00 -1.58 5.54 4.81 -1.26 -4.86 118.16 120.69 1ojx n LYS 206 Ca 0.15 0.73 -0.30 0.00 -0.87 0.00 0.00 58.31 58.02 1ojx n LYS 206 Cb 0.49 -2.49 0.10 0.00 0.02 0.00 0.00 35.03 33.14 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 1.55 2.75 0.13 3.15 -4.23 -1.26 -4.98 115.64 112.75 1ojx s THR 207 Ca 0.83 0.24 -0.15 0.00 -1.18 0.00 0.00 61.69 61.44 1ojx s THR 207 Cb -0.73 -3.02 -0.01 0.00 1.34 0.00 0.00 72.50 70.09 1ojx s THR 207 CO 0.42 -0.32 1.60 0.11 -0.54 0.00 0.00 174.62 175.90 1ojx h LYS 208 N -1.17 0.71 -5.41 3.99 1.57 -1.99 -3.44 116.57 110.82 1ojx h LYS 208 Ca -0.48 -0.20 -0.41 0.00 -1.87 0.00 0.00 60.65 57.69 1ojx h LYS 208 Cb 1.29 -0.08 -0.18 0.00 0.08 0.00 0.00 32.23 33.34 1ojx h LYS 208 CO 0.61 0.76 -0.76 0.95 -0.57 0.00 0.00 179.45 180.44 1ojx s THR 209 N -5.14 1.34 0.30 -0.16 -4.23 -1.26 -5.03 115.64 101.47 1ojx s THR 209 Ca -0.13 -1.76 0.02 0.00 -1.18 0.00 0.00 61.69 58.64 1ojx s THR 209 Cb 0.10 -1.57 0.29 0.00 1.34 0.00 0.00 72.50 72.66 1ojx s THR 209 CO 0.79 -0.44 1.88 -0.33 -0.54 0.00 0.00 174.62 175.98 1ojx h GLU 210 N 3.44 0.96 0.00 3.99 5.08 -2.01 -2.34 114.58 123.70 1ojx h GLU 210 Ca -0.40 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 57.84 1ojx h GLU 210 Cb 1.20 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1ojx h GLU 210 CO 0.52 0.63 -0.31 1.49 -1.00 0.00 0.00 179.01 180.34 1ojx h GLU 211 N 0.99 0.00 -0.25 2.33 4.57 -1.99 -1.52 114.58 118.71 1ojx h GLU 211 Ca 0.43 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.60 1ojx h GLU 211 Cb 0.35 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1ojx h GLU 211 CO -0.19 0.31 0.12 -0.44 -1.18 0.00 0.00 179.01 177.63 1ojx h ASP 212 N 0.00 0.33 -0.35 1.04 3.32 -1.83 -1.73 116.42 117.20 1ojx h ASP 212 Ca -0.00 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 1ojx h ASP 212 Cb 0.57 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1ojx h ASP 212 CO 0.04 0.36 0.05 0.15 -1.72 0.00 0.00 179.24 178.12 1ojx h PHE 213 N 0.27 0.62 -0.58 4.55 3.57 -1.37 -2.30 116.94 121.70 1ojx h PHE 213 Ca 0.09 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1ojx h PHE 213 Cb 0.12 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.66 1ojx h PHE 213 CO -0.02 0.65 0.32 -0.07 -2.23 0.00 0.00 178.31 176.95 1ojx h LEU 214 N 0.41 0.71 -0.70 0.59 3.38 -1.28 -0.87 115.31 117.56 1ojx h LEU 214 Ca 0.11 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1ojx h LEU 214 Cb 0.37 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1ojx h LEU 214 CO 0.01 0.58 0.12 0.50 0.09 0.00 0.00 178.44 179.74 1ojx h LYS 215 N 0.81 1.12 -0.45 1.13 3.64 -1.16 -1.23 116.57 120.43 1ojx h LYS 215 Ca 0.21 -0.29 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 1ojx h LYS 215 Cb 0.03 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1ojx h LYS 215 CO -0.03 1.01 0.15 1.96 -2.27 0.00 0.00 179.45 180.27 1ojx h GLN 216 N 1.05 0.69 -0.94 1.90 4.20 -0.79 -2.62 115.11 118.61 1ojx h GLN 216 Ca 0.21 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1ojx h GLN 216 Cb 0.43 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.06 1ojx h GLN 216 CO 0.01 0.66 0.62 0.28 -0.67 0.00 0.00 178.83 179.74 1ojx h VAL 217 N 0.59 1.24 -0.89 -0.54 2.07 -0.97 -1.69 116.25 116.06 1ojx h VAL 217 Ca 0.15 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1ojx h VAL 217 Cb 0.25 -0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.84 1ojx h VAL 217 CO -0.01 0.23 0.49 -0.08 0.02 0.00 0.00 177.57 178.23 1ojx h GLU 218 N 1.28 1.24 -0.49 1.57 4.81 -1.07 -1.98 114.58 119.93 1ojx h GLU 218 Ca 0.34 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 1ojx h GLU 218 Cb -0.15 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 28.97 1ojx h GLU 218 CO -0.07 0.90 -0.05 0.78 -0.73 0.00 0.00 179.01 179.83 1ojx h GLY 219 N 1.24 0.98 0.78 1.92 0.00 -1.06 -1.35 103.07 105.58 1ojx h GLY 219 Ca 0.31 -0.76 0.03 0.00 0.00 0.00 0.00 47.33 46.92 1ojx h GLY 219 CO -0.05 0.70 0.23 -2.08 0.00 0.00 0.00 176.54 175.33 1ojx h VAL 220 N 0.76 0.98 -0.50 4.60 2.07 -0.95 -0.89 116.25 122.31 1ojx h VAL 220 Ca 0.13 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.42 1ojx h VAL 220 Cb 0.59 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1ojx h VAL 220 CO 0.04 0.08 0.01 -0.07 0.02 0.00 0.00 177.57 177.65 1ojx h LEU 221 N 0.45 0.86 -1.54 2.57 3.38 -1.32 -2.53 115.31 117.18 1ojx h LEU 221 Ca 0.19 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 57.91 1ojx h LEU 221 Cb 0.09 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1ojx h LEU 221 CO -0.13 0.96 0.38 -0.08 0.09 0.00 0.00 178.44 179.66 1ojx h GLU 222 N 0.75 0.56 0.00 1.13 4.81 -1.00 -1.76 114.58 119.08 1ojx h GLU 222 Ca 0.14 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1ojx h GLU 222 Cb 0.51 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1ojx h GLU 222 CO 0.02 0.37 0.00 0.00 -0.73 0.00 0.00 179.01 178.67 1ojx n ALA 223 N -2.48 2.21 -0.22 2.92 0.00 -0.36 -4.90 120.51 117.68 1ojx n ALA 223 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1ojx n ALA 223 Cb 0.21 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.26 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 0.92 0.89 3.75 0.00 0.00 -0.66 -4.40 105.19 105.68 1ojx n GLY 224 Ca 0.10 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 2.24 0.28 4.61 0.00 -0.98 -4.93 121.76 120.98 1ojx s ALA 225 Ca 0.00 0.52 0.06 0.00 0.00 0.00 0.00 51.96 52.54 1ojx s ALA 225 Cb 0.00 -3.34 0.41 0.00 0.00 0.00 0.00 23.12 20.18 1ojx s ALA 225 CO 0.00 -1.69 1.67 1.25 0.00 0.00 0.00 175.76 177.00 1ojx h LEU 226 N -0.58 0.28 0.00 0.00 5.85 -1.33 -3.44 115.31 116.09 1ojx h LEU 226 Ca -0.46 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.14 1ojx h LEU 226 Cb 1.25 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1ojx h LEU 226 CO 0.51 0.68 0.00 0.61 -0.34 0.00 0.00 178.44 179.91 1ojx n GLY 227 N -0.11 -0.51 3.14 3.75 0.00 -1.22 -1.57 105.19 108.66 1ojx n GLY 227 Ca -0.02 -0.75 -0.17 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.99 0.93 -0.34 -0.61 -4.36 -0.70 -1.46 121.20 110.68 1ojx s ILE 228 Ca 0.00 -1.24 0.01 0.00 -0.26 0.00 0.00 60.65 59.15 1ojx s ILE 228 Cb 0.00 -0.93 0.08 0.00 1.25 0.00 0.00 42.46 42.86 1ojx s ILE 228 CO 0.00 -0.28 0.05 0.00 0.24 0.00 0.00 174.94 174.95 1ojx s ALA 229 N -1.33 2.90 -0.09 2.27 0.00 0.10 -1.19 121.76 124.42 1ojx s ALA 229 Ca -0.04 -2.22 0.01 0.00 0.00 0.00 0.00 51.96 49.70 1ojx s ALA 229 Cb -0.10 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 20.98 1ojx s ALA 229 CO 0.02 -1.54 -0.11 0.54 0.00 0.00 0.00 175.76 174.67 1ojx s VAL 230 N 1.09 3.30 0.00 0.00 0.11 0.16 -1.58 120.40 123.47 1ojx s VAL 230 Ca 0.03 -0.61 0.00 0.00 -2.93 0.00 0.00 61.98 58.47 1ojx s VAL 230 Cb -0.20 -2.35 0.00 0.00 -1.53 0.00 0.00 36.38 32.30 1ojx s VAL 230 CO -0.05 0.56 0.00 0.61 -3.33 0.00 0.00 175.10 172.90 1ojx n GLY 231 N 2.76 0.57 0.35 6.54 0.00 -1.26 -0.73 105.19 113.42 1ojx n GLY 231 Ca -0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.89 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 0.99 0.00 1.61 3.08 -1.86 -1.43 114.38 116.77 1ojx h ARG 232 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1ojx h ARG 232 Cb 0.00 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.83 1ojx h ARG 232 CO 0.00 0.66 0.00 0.09 -1.07 0.00 0.00 179.97 179.65 1ojx n ASN 233 N -4.60 0.00 -0.03 7.04 3.02 -1.26 -1.30 115.26 118.13 1ojx n ASN 233 Ca 0.16 0.29 -0.03 0.00 -0.03 0.00 0.00 54.58 54.97 1ojx n ASN 233 Cb 0.27 -0.39 -0.01 0.00 -0.61 0.00 0.00 39.78 39.03 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 -1.39 0.55 0.71 2.41 0.31 -0.64 -4.80 118.33 115.47 1ojx n VAL 234 Ca 0.05 0.34 0.12 0.00 -0.01 0.00 0.00 64.34 64.84 1ojx n VAL 234 Cb 0.14 -1.74 0.48 0.00 -0.91 0.00 0.00 33.84 31.81 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 -3.19 0.36 0.95 3.52 4.27 -0.63 -2.16 117.44 120.56 1ojx n TRP 235 Ca -0.05 0.12 0.13 0.00 -3.89 0.00 0.00 57.50 53.82 1ojx n TRP 235 Cb 0.17 -0.69 0.49 0.00 -1.36 0.00 0.00 31.31 29.92 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 -1.81 0.04 -3.30 -2.67 7.27 -0.42 -4.70 117.38 111.79 1ojx n GLN 236 Ca 0.05 0.02 -0.37 0.00 0.07 0.00 0.00 57.00 56.78 1ojx n GLN 236 Cb 0.31 -1.54 -0.06 0.00 2.41 0.00 0.00 30.24 31.37 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 -3.02 4.09 0.43 3.69 0.52 -0.92 -4.30 118.95 119.45 1ojx s ARG 237 Ca 0.13 0.62 0.24 0.00 -0.52 0.00 0.00 55.73 56.19 1ojx s ARG 237 Cb 0.18 -3.05 0.79 0.00 0.52 0.00 0.00 34.95 33.39 1ojx s ARG 237 CO 0.59 0.54 1.77 0.00 0.02 0.00 0.00 175.30 178.21 1ojx h ARG 238 N 3.94 0.00 -1.05 3.54 3.08 -1.87 -2.61 114.38 119.42 1ojx h ARG 238 Ca -0.49 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 58.88 1ojx h ARG 238 Cb 1.20 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 30.96 1ojx h ARG 238 CO 0.65 0.22 0.89 -0.40 -1.07 0.00 0.00 179.97 180.25 1ojx n ASP 239 N -3.31 7.71 -0.15 7.04 5.75 -1.26 -4.82 116.55 127.51 1ojx n ASP 239 Ca 0.01 -3.79 -0.03 0.00 -0.01 0.00 0.00 54.79 50.97 1ojx n ASP 239 Cb 0.47 -0.98 0.04 0.00 -1.03 0.00 0.00 41.12 39.62 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 2.04 0.37 -0.23 2.12 0.00 -1.67 -1.79 119.26 120.10 1ojx h ALA 240 Ca 0.61 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.64 1ojx h ALA 240 Cb 0.78 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1ojx h ALA 240 CO 1.59 -0.42 -0.03 1.25 0.00 0.00 0.00 179.25 181.64 1ojx h LEU 241 N 0.04 0.43 -0.80 0.00 5.85 -1.88 0.09 115.31 119.05 1ojx h LEU 241 Ca 0.23 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.64 1ojx h LEU 241 Cb 0.35 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1ojx h LEU 241 CO -0.45 0.66 0.52 0.50 -0.34 0.00 0.00 178.44 179.33 1ojx h LYS 242 N 0.18 0.99 -0.11 1.25 3.64 -1.89 -1.41 116.57 119.22 1ojx h LYS 242 Ca 0.06 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.19 1ojx h LYS 242 Cb 0.46 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1ojx h LYS 242 CO 0.02 0.65 -0.74 0.35 -2.27 0.00 0.00 179.45 177.46 1ojx h PHE 243 N 1.02 0.73 -0.53 1.91 3.57 -1.23 -2.65 116.94 119.76 1ojx h PHE 243 Ca 0.31 -0.32 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1ojx h PHE 243 Cb -0.03 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.56 1ojx h PHE 243 CO -0.03 1.10 0.30 0.00 -2.23 0.00 0.00 178.31 177.45 1ojx h ALA 244 N 0.81 0.68 -0.20 2.41 0.00 -0.68 -0.64 119.26 121.64 1ojx h ALA 244 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1ojx h ALA 244 Cb 1.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1ojx h ALA 244 CO 0.14 -0.02 -0.11 0.00 0.00 0.00 0.00 179.25 179.26 1ojx h ARG 245 N 0.58 0.32 -0.17 0.00 3.08 -1.25 -0.84 114.38 116.10 1ojx h ARG 245 Ca 0.22 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.07 1ojx h ARG 245 Cb 0.07 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1ojx h ARG 245 CO -0.12 0.44 -0.42 0.00 -1.07 0.00 0.00 179.97 178.79 1ojx h ALA 246 N 1.59 0.96 -0.45 0.04 0.00 -1.03 -2.51 119.26 117.87 1ojx h ALA 246 Ca 0.06 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 1ojx h ALA 246 Cb 0.38 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1ojx h ALA 246 CO 0.02 0.63 -0.20 -0.07 0.00 0.00 0.00 179.25 179.63 1ojx h LEU 247 N 0.33 0.94 -0.43 0.00 3.38 -0.50 -2.33 115.31 116.70 1ojx h LEU 247 Ca 0.03 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.63 1ojx h LEU 247 Cb 0.88 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1ojx h LEU 247 CO 0.07 1.13 0.22 0.00 0.09 0.00 0.00 178.44 179.96 1ojx h ALA 248 N 0.84 0.54 -0.67 1.53 0.00 -1.10 -0.24 119.26 120.16 1ojx h ALA 248 Ca 0.10 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1ojx h ALA 248 Cb 0.77 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1ojx h ALA 248 CO 0.06 -0.13 0.19 1.49 0.00 0.00 0.00 179.25 180.87 1ojx h GLU 249 N 0.45 1.03 -0.13 0.00 4.81 -1.37 0.17 114.58 119.54 1ojx h GLU 249 Ca 0.18 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1ojx h GLU 249 Cb 0.07 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 1ojx h GLU 249 CO -0.12 0.89 0.02 1.25 -0.73 0.00 0.00 179.01 180.33 1ojx h LEU 250 N 0.99 0.20 0.06 1.64 5.85 -0.96 -0.99 115.31 122.10 1ojx h LEU 250 Ca 0.22 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1ojx h LEU 250 Cb 0.30 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1ojx h LEU 250 CO -0.01 0.41 -0.03 0.58 -0.34 0.00 0.00 178.44 179.06 1ojx h VAL 251 N -0.01 1.26 0.04 1.05 2.07 -0.87 -2.54 116.25 117.25 1ojx h VAL 251 Ca 0.04 -1.50 -0.22 0.00 0.82 0.00 0.00 66.70 65.84 1ojx h VAL 251 Cb 0.29 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 1ojx h VAL 251 CO 0.00 0.35 -1.01 1.88 0.02 0.00 0.00 177.57 178.81 1ojx h TYR 252 N -0.79 0.22 0.00 1.57 0.05 -0.80 -3.34 116.97 113.88 1ojx h TYR 252 Ca -0.01 -0.15 -0.13 0.00 0.05 0.00 0.00 58.73 58.50 1ojx h TYR 252 Cb 0.63 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.34 1ojx h TYR 252 CO 0.14 1.05 -0.99 0.78 -1.05 0.00 0.00 178.16 178.10 1ojx h GLY 253 N 2.23 0.00 2.00 3.88 0.00 -1.27 -3.42 103.07 106.50 1ojx h GLY 253 Ca -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.20 1ojx h GLY 253 CO 0.15 0.00 -0.34 -1.33 0.00 0.00 0.00 176.54 175.02 1ojx h GLY 254 N 3.63 0.00 0.00 4.60 0.00 -1.48 -3.50 103.07 106.33 1ojx h GLY 254 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1ojx h GLY 254 CO 0.05 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.76