#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 -0.65 1.20 3.38 -1.98 -2.42 115.31 114.83 1ojx h LEU 4 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 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 0.33 0.34 0.74 0.09 0.00 0.00 178.44 179.94 1ojx h THR 5 N 0.00 1.21 -0.71 0.22 2.02 -1.96 -0.24 112.91 113.45 1ojx h THR 5 Ca -0.00 -0.56 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 1ojx h THR 5 Cb 1.19 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 1ojx h THR 5 CO 0.04 0.24 0.18 -0.33 0.37 0.00 0.00 175.52 176.02 1ojx h GLU 6 N 0.90 1.13 -0.37 6.66 5.08 -1.84 -0.91 114.58 125.23 1ojx h GLU 6 Ca 0.23 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1ojx h GLU 6 Cb 0.07 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1ojx h GLU 6 CO -0.03 0.99 0.18 -0.22 -1.00 0.00 0.00 179.01 178.93 1ojx h LYS 7 N 1.08 0.53 -0.52 2.33 3.64 -1.25 -1.75 116.57 120.63 1ojx h LYS 7 Ca 0.22 -0.08 0.08 0.00 -1.27 0.00 0.00 60.65 59.61 1ojx h LYS 7 Cb 0.36 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.02 1ojx h LYS 7 CO 0.00 0.48 0.16 0.35 -2.27 0.00 0.00 179.45 178.17 1ojx h PHE 8 N 0.46 0.28 -0.43 1.91 3.57 -0.68 -2.30 116.94 119.75 1ojx h PHE 8 Ca 0.13 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 1ojx h PHE 8 Cb 0.12 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 1ojx h PHE 8 CO -0.01 0.06 -0.10 -0.07 -2.23 0.00 0.00 178.31 175.96 1ojx h LEU 9 N 0.33 0.76 -0.78 0.59 3.38 -0.95 0.81 115.31 119.44 1ojx h LEU 9 Ca 0.26 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1ojx h LEU 9 Cb 0.31 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1ojx h LEU 9 CO -0.29 0.88 0.09 -0.09 0.09 0.00 0.00 178.44 179.13 1ojx h ARG 10 N 0.70 1.02 0.06 1.13 2.43 -1.03 -0.42 114.38 118.27 1ojx h ARG 10 Ca 0.12 -0.26 -0.20 0.00 -0.81 0.00 0.00 59.98 58.82 1ojx h ARG 10 Cb 0.57 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1ojx h ARG 10 CO 0.04 0.94 -1.06 0.82 -1.51 0.00 0.00 179.97 179.19 1ojx h ILE 11 N 0.95 1.17 -0.03 1.20 2.04 -1.17 -3.35 117.51 118.32 1ojx h ILE 11 Ca 0.19 -2.33 0.00 0.00 1.00 0.00 0.00 64.86 63.72 1ojx h ILE 11 Cb 0.43 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.23 1ojx h ILE 11 CO 0.01 0.57 0.00 0.49 0.00 0.00 0.00 178.15 179.22 1ojx n PHE 12 N -4.22 0.01 -2.73 1.37 3.72 0.26 -4.58 117.46 111.28 1ojx n PHE 12 Ca -0.24 -0.01 -0.04 0.00 -0.05 0.00 0.00 57.45 57.12 1ojx n PHE 12 Cb 0.75 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.37 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 1.11 2.64 -0.13 4.37 0.00 -0.18 -4.49 120.51 123.83 1ojx n ALA 13 Ca 0.12 -2.15 0.18 0.00 0.00 0.00 0.00 53.44 51.58 1ojx n ALA 13 Cb 0.49 -0.90 0.56 0.00 0.00 0.00 0.00 19.45 19.61 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 2.18 0.29 -0.01 0.00 0.11 -1.66 -0.61 114.38 114.69 1ojx h ARG 14 Ca -0.23 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.83 1ojx h ARG 14 Cb 1.26 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.28 1ojx h ARG 14 CO 0.11 0.19 -0.12 0.54 0.10 0.00 0.00 179.97 180.79 1ojx n ARG 15 N -4.44 0.85 0.00 0.08 1.74 -1.26 -4.92 116.66 108.70 1ojx n ARG 15 Ca 0.14 -0.35 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1ojx n ARG 15 Cb 0.59 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 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 1.26 2.39 3.29 -0.13 0.00 -0.23 -5.04 105.19 106.73 1ojx n GLY 16 Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.81 1.29 -0.01 1.61 -0.14 -1.26 -4.96 119.74 115.46 1ojx s LYS 17 Ca 0.00 -1.66 0.01 0.00 -1.36 0.00 0.00 55.97 52.96 1ojx s LYS 17 Cb 0.00 -0.34 0.01 0.00 -1.68 0.00 0.00 37.83 35.82 1ojx s LYS 17 CO 0.00 -0.19 -0.03 0.45 -0.76 0.00 0.00 175.35 174.82 1ojx s SER 18 N -3.26 0.43 -0.15 2.83 0.15 -0.68 -4.56 113.70 108.46 1ojx s SER 18 Ca 0.31 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1ojx s SER 18 Cb 0.07 -0.10 0.02 0.00 -1.71 0.00 0.00 66.02 64.30 1ojx s SER 18 CO 0.09 0.01 -0.14 -0.63 1.20 0.00 0.00 173.24 173.77 1ojx s ILE 19 N 0.20 1.58 -0.13 6.45 1.01 -1.26 -1.60 121.20 127.46 1ojx s ILE 19 Ca -0.02 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 1ojx s ILE 19 Cb -0.05 -1.49 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 1ojx s ILE 19 CO -0.00 0.45 -0.06 -0.63 0.00 0.00 0.00 174.94 174.69 1ojx s ILE 20 N 1.48 3.70 -0.49 2.92 -1.09 -0.24 -1.11 121.20 126.37 1ojx s ILE 20 Ca 0.05 -0.44 -0.21 0.00 -2.23 0.00 0.00 60.65 57.82 1ojx s ILE 20 Cb -0.13 -2.59 0.04 0.00 -1.58 0.00 0.00 42.46 38.21 1ojx s ILE 20 CO -0.11 0.52 0.69 -0.22 -1.23 0.00 0.00 174.94 174.59 1ojx s LEU 21 N 0.10 4.63 0.11 2.97 2.96 -0.18 -0.78 118.68 128.49 1ojx s LEU 21 Ca -0.02 -0.58 -0.28 0.00 -0.22 0.00 0.00 54.13 53.02 1ojx s LEU 21 Cb -0.14 -2.63 -0.06 0.00 0.50 0.00 0.00 46.19 43.86 1ojx s LEU 21 CO 0.03 -0.91 0.89 0.00 -1.32 0.00 0.00 176.35 175.05 1ojx s ALA 22 N 2.94 3.30 -0.29 5.97 0.00 0.48 -1.79 121.76 132.37 1ojx s ALA 22 Ca 0.21 0.48 0.19 0.00 0.00 0.00 0.00 51.96 52.85 1ojx s ALA 22 Cb -0.16 -3.17 0.48 0.00 0.00 0.00 0.00 23.12 20.27 1ojx s ALA 22 CO 0.16 0.05 1.19 0.98 0.00 0.00 0.00 175.76 178.14 1ojx n TYR 23 N 2.55 0.36 0.91 0.00 9.36 -0.69 -4.32 117.16 125.34 1ojx n TYR 23 Ca -0.00 -2.14 0.09 0.00 3.32 0.00 0.00 57.90 59.16 1ojx n TYR 23 Cb 0.49 0.21 0.27 0.00 -0.63 0.00 0.00 39.34 39.68 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 -0.71 2.03 -0.12 2.98 5.75 -1.25 -4.55 116.55 120.69 1ojx n ASP 24 Ca 0.02 -1.87 0.09 0.00 -0.01 0.00 0.00 54.79 53.01 1ojx n ASP 24 Cb 0.82 -0.20 0.43 0.00 -1.03 0.00 0.00 41.12 41.15 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 2.44 0.59 -0.46 2.11 2.76 -1.94 -2.67 115.15 117.98 1ojx h HIS 25 Ca 0.00 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.21 1ojx h HIS 25 Cb 0.55 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.29 1ojx h HIS 25 CO 0.20 0.30 0.31 0.78 -1.30 0.00 0.00 177.93 178.22 1ojx h GLY 26 N 0.57 0.59 0.39 5.26 0.00 -1.81 0.95 103.07 109.03 1ojx h GLY 26 Ca 0.28 -0.21 -0.35 0.00 0.00 0.00 0.00 47.33 47.05 1ojx h GLY 26 CO -0.09 0.18 -1.99 4.51 0.00 0.00 0.00 176.54 179.16 1ojx n ILE 27 N -4.48 1.69 -0.19 2.60 3.06 -1.13 -2.98 119.36 117.93 1ojx n ILE 27 Ca 0.05 -0.54 -0.08 0.00 -2.50 0.00 0.00 62.75 59.68 1ojx n ILE 27 Cb 0.14 -1.74 0.05 0.00 0.54 0.00 0.00 39.64 38.63 1ojx n ILE 27 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 1ojx h GLU 28 N -0.15 1.03 0.00 9.51 4.39 -1.16 -3.36 114.58 124.84 1ojx h GLU 28 Ca -0.45 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 58.93 1ojx h GLU 28 Cb 1.89 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.44 1ojx h GLU 28 CO -0.01 1.01 -0.39 0.72 -1.16 0.00 0.00 179.01 179.18 1ojx n HIS 29 N -4.18 0.00 0.00 4.33 8.25 0.25 -2.44 115.22 121.43 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 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 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 1.37 -1.41 0.02 -1.41 0.00 -0.71 -4.66 105.19 98.39 1ojx n GLY 30 Ca 0.00 -1.57 0.13 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.61 1.03 -0.18 1.61 -0.04 -1.26 -4.17 135.00 130.39 1ojx n PRO 31 Ca 0.00 -0.05 -0.02 0.00 -0.04 0.00 0.00 63.50 63.39 1ojx n PRO 31 Cb 0.00 -1.40 0.08 0.00 -0.04 0.00 0.00 33.50 32.14 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 3.81 0.66 -0.13 0.55 0.00 -1.98 -1.74 119.26 120.43 1ojx h ALA 32 Ca 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ojx h ALA 32 Cb 0.02 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ojx h ALA 32 CO 0.00 -0.21 -0.14 -0.44 0.00 0.00 0.00 179.25 178.46 1ojx h ASP 33 N 0.36 0.19 -0.31 0.00 3.32 -1.92 -1.66 116.42 116.40 1ojx h ASP 33 Ca 0.26 -0.04 0.09 0.00 0.02 0.00 0.00 57.03 57.37 1ojx h ASP 33 Cb 0.30 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1ojx h ASP 33 CO -0.27 0.35 0.44 -0.26 -1.72 0.00 0.00 179.24 177.78 1ojx h PHE 34 N 0.19 0.00 0.00 4.55 0.04 -1.59 -2.07 116.94 118.05 1ojx h PHE 34 Ca 0.04 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 1ojx h PHE 34 Cb 0.37 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 1ojx h PHE 34 CO 0.00 0.00 -0.11 0.52 -0.60 0.00 0.00 178.31 178.12 1ojx h MET 35 N 0.00 0.00 0.00 1.51 2.86 -1.36 -1.88 114.93 116.06 1ojx h MET 35 Ca 0.15 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 1ojx h MET 35 Cb 1.03 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.68 1ojx h MET 35 CO -0.00 0.11 -0.08 -0.44 1.06 0.00 0.00 176.91 177.56 1ojx h ASP 36 N 0.00 0.00 -1.58 1.22 3.32 -1.58 -3.36 116.42 114.45 1ojx h ASP 36 Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.70 1ojx h ASP 36 Cb 0.26 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 39.55 1ojx h ASP 36 CO 0.01 0.08 -0.71 -3.20 -1.72 0.00 0.00 179.24 173.71 1ojx n ASN 37 N -3.20 -2.15 0.28 6.45 5.15 -0.98 -4.75 115.26 116.06 1ojx n ASN 37 Ca 0.01 -2.69 0.18 0.00 -0.60 0.00 0.00 54.58 51.48 1ojx n ASN 37 Cb 0.37 0.74 0.95 0.00 -0.53 0.00 0.00 39.78 41.31 1ojx n ASN 37 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1ojx h PRO 38 N 5.25 0.00 -0.74 1.20 0.13 -1.51 0.67 132.00 137.00 1ojx h PRO 38 Ca 0.15 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.49 1ojx h PRO 38 Cb 1.02 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1ojx h PRO 38 CO 0.17 0.00 0.64 -0.44 -0.23 0.00 0.00 178.00 178.14 1ojx h ASP 39 N 0.00 0.00 0.73 1.44 3.32 -1.96 -2.50 116.42 117.45 1ojx h ASP 39 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1ojx h ASP 39 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1ojx h ASP 39 CO -0.00 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.98 1ojx n SER 40 N -3.94 0.69 0.10 6.45 3.41 0.23 -2.02 113.62 118.54 1ojx n SER 40 Ca 0.15 0.67 0.12 0.00 -0.26 0.00 0.00 58.87 59.56 1ojx n SER 40 Cb 0.90 -0.82 0.45 0.00 -0.26 0.00 0.00 64.21 64.49 1ojx n SER 40 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ojx n ALA 41 N -1.78 1.95 -2.49 7.33 0.00 -0.94 -4.67 120.51 119.90 1ojx n ALA 41 Ca 0.02 0.02 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 1ojx n ALA 41 Cb 0.23 -1.42 -0.09 0.00 0.00 0.00 0.00 19.45 18.17 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 -4.21 6.17 0.56 0.00 2.15 -0.86 -4.97 116.67 115.51 1ojx s ASP 42 Ca 0.08 -0.65 0.26 0.00 0.43 0.00 0.00 52.55 52.67 1ojx s ASP 42 Cb 0.11 -2.20 1.50 0.00 -0.30 0.00 0.00 42.92 42.02 1ojx s ASP 42 CO 0.48 -0.51 2.03 -0.65 -0.17 0.00 0.00 175.17 176.35 1ojx h PRO 43 N 8.66 0.00 -0.68 4.34 0.11 -1.86 -1.80 132.00 140.76 1ojx h PRO 43 Ca -0.27 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 1ojx h PRO 43 Cb 1.12 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 1ojx h PRO 43 CO 0.76 0.00 0.38 0.93 -0.21 0.00 0.00 178.00 179.86 1ojx h GLU 44 N 0.00 0.95 -0.93 1.05 5.08 -1.93 -2.07 114.58 116.73 1ojx h GLU 44 Ca 0.16 -0.11 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1ojx h GLU 44 Cb 0.75 -0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 1ojx h GLU 44 CO -0.00 0.71 0.61 -0.92 -1.00 0.00 0.00 179.01 178.41 1ojx h TYR 45 N 0.94 1.12 -0.18 4.33 3.20 -1.61 -2.17 116.97 122.60 1ojx h TYR 45 Ca 0.24 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 1ojx h TYR 45 Cb 0.03 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 37.92 1ojx h TYR 45 CO -0.01 0.63 0.05 0.82 -1.64 0.00 0.00 178.16 178.01 1ojx h ILE 46 N 1.14 1.20 -0.36 1.81 1.08 -1.36 -0.91 117.51 120.10 1ojx h ILE 46 Ca 0.38 -0.62 0.03 0.00 -0.39 0.00 0.00 64.86 64.26 1ojx h ILE 46 Cb 0.07 1.27 -0.03 0.00 -3.07 0.00 0.00 36.82 35.06 1ojx h ILE 46 CO -0.13 0.19 0.17 -0.07 -0.69 0.00 0.00 178.15 177.63 1ojx h LEU 47 N 0.11 0.25 -1.18 1.44 3.38 -1.28 -2.13 115.31 115.89 1ojx h LEU 47 Ca 0.06 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1ojx h LEU 47 Cb 0.25 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1ojx h LEU 47 CO -0.00 0.18 0.51 -0.09 0.09 0.00 0.00 178.44 179.13 1ojx h ARG 48 N 0.36 1.06 -0.37 1.13 2.43 -1.35 -1.91 114.38 115.73 1ojx h ARG 48 Ca 0.16 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1ojx h ARG 48 Cb 0.07 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1ojx h ARG 48 CO -0.12 0.72 0.16 1.25 -1.51 0.00 0.00 179.97 180.47 1ojx h LEU 49 N 1.09 0.49 -0.68 3.80 5.85 -0.70 0.15 115.31 125.31 1ojx h LEU 49 Ca 0.29 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1ojx h LEU 49 Cb -0.10 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 1ojx h LEU 49 CO -0.06 0.51 0.19 0.00 -0.34 0.00 0.00 178.44 178.74 1ojx h ALA 50 N 1.00 0.90 0.13 1.25 0.00 -1.11 -1.83 119.26 119.60 1ojx h ALA 50 Ca 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1ojx h ALA 50 Cb 0.16 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1ojx h ALA 50 CO -0.01 0.59 -0.06 -0.09 0.00 0.00 0.00 179.25 179.67 1ojx h ARG 51 N 1.01 -0.17 -0.07 0.00 2.43 -1.24 -1.06 114.38 115.28 1ojx h ARG 51 Ca 0.22 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.33 1ojx h ARG 51 Cb 0.33 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1ojx h ARG 51 CO -0.00 0.04 -0.28 -0.44 -1.51 0.00 0.00 179.97 177.78 1ojx h ASP 52 N -0.37 0.12 0.45 -3.80 3.32 -0.84 -2.48 116.42 112.82 1ojx h ASP 52 Ca -0.02 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1ojx h ASP 52 Cb 0.30 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1ojx h ASP 52 CO 0.03 0.40 -0.42 0.00 -1.72 0.00 0.00 179.24 177.53 1ojx n ALA 53 N -2.48 3.39 -2.06 3.45 0.00 -0.70 -4.96 120.51 117.15 1ojx n ALA 53 Ca -0.02 -0.35 -0.06 0.00 0.00 0.00 0.00 53.44 53.02 1ojx n ALA 53 Cb 0.36 -1.14 -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 1.46 0.17 3.72 0.00 0.00 -0.93 -4.76 105.19 104.86 1ojx n GLY 54 Ca 0.07 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.27 2.32 -0.27 1.61 0.08 -0.45 -5.00 117.98 114.00 1ojx s PHE 55 Ca 0.00 1.35 0.20 0.00 0.12 0.00 0.00 56.93 58.60 1ojx s PHE 55 Cb 0.00 -3.14 0.11 0.00 -0.57 0.00 0.00 43.02 39.42 1ojx s PHE 55 CO 0.00 -2.31 1.31 -0.44 -0.10 0.00 0.00 175.22 173.67 1ojx h ASP 56 N -1.49 0.00 -5.66 1.36 3.32 -1.43 -3.46 116.42 109.05 1ojx h ASP 56 Ca -0.48 0.00 0.30 0.00 0.02 0.00 0.00 57.03 56.87 1ojx h ASP 56 Cb 1.27 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.71 1ojx h ASP 56 CO 0.53 0.21 0.76 -0.83 -1.72 0.00 0.00 179.24 178.20 1ojx s GLY 57 N -4.40 -0.38 0.09 2.75 0.00 -1.23 -4.15 107.32 100.01 1ojx s GLY 57 Ca 0.03 0.60 0.06 0.00 0.00 0.00 0.00 44.72 45.41 1ojx s GLY 57 CO 0.74 0.11 -0.14 -1.34 0.00 0.00 0.00 173.10 172.46 1ojx s VAL 58 N -2.59 1.23 -0.24 1.40 -7.23 -0.53 -1.01 120.40 111.43 1ojx s VAL 58 Ca 0.14 -1.51 -0.03 0.00 -1.81 0.00 0.00 61.98 58.77 1ojx s VAL 58 Cb 0.04 -1.31 0.01 0.00 0.56 0.00 0.00 36.38 35.68 1ojx s VAL 58 CO -0.03 -0.31 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.73 1ojx s VAL 59 N -1.67 3.23 0.09 1.32 1.01 -0.74 -0.98 120.40 122.66 1ojx s VAL 59 Ca 0.03 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.32 1ojx s VAL 59 Cb -0.08 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1ojx s VAL 59 CO 0.03 0.27 -0.20 -0.36 0.00 0.00 0.00 175.10 174.83 1ojx s PHE 60 N 1.41 1.75 0.85 5.22 0.08 -0.94 -1.69 117.98 124.66 1ojx s PHE 60 Ca 0.03 -0.41 -0.11 0.00 0.12 0.00 0.00 56.93 56.55 1ojx s PHE 60 Cb -0.16 -0.97 0.10 0.00 -0.57 0.00 0.00 43.02 41.42 1ojx s PHE 60 CO -0.03 0.18 1.09 -0.65 -0.10 0.00 0.00 175.22 175.71 1ojx s GLN 61 N -1.80 1.61 0.29 0.44 -1.52 -1.26 -1.25 119.66 116.17 1ojx s GLN 61 Ca 0.06 0.82 -0.02 0.00 -1.95 0.00 0.00 55.36 54.28 1ojx s GLN 61 Cb -0.10 -1.85 0.44 0.00 -0.22 0.00 0.00 33.01 31.28 1ojx s GLN 61 CO 0.04 -2.00 1.93 0.07 -0.25 0.00 0.00 175.29 175.08 1ojx h ARG 62 N -1.37 1.10 -0.28 2.91 0.11 -1.95 -1.41 114.38 113.50 1ojx h ARG 62 Ca -0.48 -0.07 -0.14 0.00 0.10 0.00 0.00 59.98 59.39 1ojx h ARG 62 Cb 1.27 -0.25 -0.01 0.00 1.11 0.00 0.00 29.97 32.09 1ojx h ARG 62 CO 0.55 0.73 -0.41 0.78 0.10 0.00 0.00 179.97 181.72 1ojx h GLY 63 N 1.14 0.73 1.03 0.08 0.00 -1.98 0.01 103.07 104.08 1ojx h GLY 63 Ca 0.36 -0.75 -0.16 0.00 0.00 0.00 0.00 47.33 46.79 1ojx h GLY 63 CO -0.11 0.67 -0.47 -2.22 0.00 0.00 0.00 176.54 174.41 1ojx h ILE 64 N 0.55 1.30 -0.15 2.60 1.08 -1.88 -2.54 117.51 118.48 1ojx h ILE 64 Ca 0.04 -1.68 -0.00 0.00 -0.39 0.00 0.00 64.86 62.83 1ojx h ILE 64 Cb 0.94 1.78 -0.01 0.00 -3.07 0.00 0.00 36.82 36.46 1ojx h ILE 64 CO 0.09 0.53 0.09 0.00 -0.69 0.00 0.00 178.15 178.17 1ojx h ALA 65 N 0.63 0.19 -0.65 1.87 0.00 -1.13 -1.36 119.26 118.81 1ojx h ALA 65 Ca 0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ojx h ALA 65 Cb 1.08 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1ojx h ALA 65 CO 0.11 -0.30 0.42 1.49 0.00 0.00 0.00 179.25 180.97 1ojx h GLU 66 N 0.17 0.82 0.00 0.00 4.81 -1.02 0.02 114.58 119.38 1ojx h GLU 66 Ca 0.05 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 1ojx h GLU 66 Cb 0.03 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1ojx h GLU 66 CO -0.01 0.55 -0.84 0.87 -0.73 0.00 0.00 179.01 178.84 1ojx h LYS 67 N 0.85 0.00 0.00 1.92 6.56 -1.41 -3.42 116.57 121.07 1ojx h LYS 67 Ca 0.25 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 1ojx h LYS 67 Cb -0.05 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.61 1ojx h LYS 67 CO -0.07 0.21 -0.48 0.66 -2.06 0.00 0.00 179.45 177.71 1ojx n TYR 68 N -2.94 0.00 -2.10 -1.35 4.01 -0.52 -5.07 117.16 109.19 1ojx n TYR 68 Ca -0.02 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.31 1ojx n TYR 68 Cb 0.68 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.68 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 -1.19 3.13 -0.05 -0.72 5.04 -0.01 -4.92 117.35 118.63 1ojx s TYR 69 Ca 0.00 1.07 0.08 0.00 -2.44 0.00 0.00 57.07 55.78 1ojx s TYR 69 Cb 0.00 -3.73 0.12 0.00 0.35 0.00 0.00 41.96 38.70 1ojx s TYR 69 CO 0.00 -2.39 1.00 -0.40 -1.34 0.00 0.00 175.55 172.42 1ojx n ASP 70 N 2.68 1.62 0.00 4.32 5.68 -1.26 -4.96 116.55 124.63 1ojx n ASP 70 Ca 0.07 -2.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.03 1ojx n ASP 70 Cb 0.41 -0.21 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 1ojx n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ojx n GLY 71 N -0.75 0.66 0.13 6.12 0.00 -1.26 -4.91 105.19 105.17 1ojx n GLY 71 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.99 -3.44 113.55 110.45 1ojx h SER 72 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 1ojx h SER 72 Cb 0.06 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.87 1ojx h SER 72 CO 0.00 0.29 -0.74 -0.69 -0.87 0.00 0.00 176.83 174.82 1ojx s VAL 73 N -3.11 0.26 0.37 0.95 1.01 -1.26 -4.97 120.40 113.65 1ojx s VAL 73 Ca 0.01 -0.20 -0.27 0.00 0.00 0.00 0.00 61.98 61.52 1ojx s VAL 73 Cb 0.08 -0.24 -0.12 0.00 0.00 0.00 0.00 36.38 36.11 1ojx s VAL 73 CO 0.76 0.03 1.25 -2.65 0.00 0.00 0.00 175.10 174.49 1ojx n PRO 74 N 2.89 1.97 -4.89 2.72 -0.02 -1.26 -4.76 135.00 131.66 1ojx n PRO 74 Ca -0.13 0.70 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 1ojx n PRO 74 Cb 0.59 -2.30 -0.15 0.00 -0.02 0.00 0.00 33.50 31.62 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 -1.09 2.52 -0.34 2.45 2.96 -1.26 -1.45 118.68 122.47 1ojx s LEU 75 Ca 0.58 -0.40 -0.13 0.00 -0.22 0.00 0.00 54.13 53.95 1ojx s LEU 75 Cb -0.56 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 1ojx s LEU 75 CO 0.61 0.16 0.25 -0.63 -1.32 0.00 0.00 176.35 175.42 1ojx s ILE 76 N 0.38 5.27 -0.46 6.68 1.01 -0.15 -1.09 121.20 132.85 1ojx s ILE 76 Ca -0.13 -0.16 -0.25 0.00 0.00 0.00 0.00 60.65 60.11 1ojx s ILE 76 Cb -0.16 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.62 1ojx s ILE 76 CO 0.06 -0.00 0.88 -0.22 0.00 0.00 0.00 174.94 175.66 1ojx s LEU 77 N 1.76 4.09 -0.41 2.97 1.98 -0.54 -2.22 118.68 126.31 1ojx s LEU 77 Ca 0.07 0.04 -0.29 0.00 -2.89 0.00 0.00 54.13 51.06 1ojx s LEU 77 Cb -0.17 -3.11 0.01 0.00 0.66 0.00 0.00 46.19 43.58 1ojx s LEU 77 CO 0.11 -1.00 1.30 -0.75 -1.89 0.00 0.00 176.35 174.11 1ojx s LYS 78 N 3.59 3.69 0.11 1.98 2.47 -0.38 -1.15 119.74 130.05 1ojx s LYS 78 Ca 0.35 0.88 -0.03 0.00 -1.56 0.00 0.00 55.97 55.60 1ojx s LYS 78 Cb -0.11 -3.96 -0.18 0.00 -1.46 0.00 0.00 37.83 32.12 1ojx s LYS 78 CO 0.25 -1.42 1.23 -0.07 0.16 0.00 0.00 175.35 175.50 1ojx h LEU 79 N 11.63 0.42 -9.65 5.43 3.38 -1.40 -3.40 115.31 121.73 1ojx h LEU 79 Ca -0.26 -0.39 -0.55 0.00 0.09 0.00 0.00 57.88 56.77 1ojx h LEU 79 Cb 1.09 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 1ojx h LEU 79 CO 1.09 1.25 -0.61 0.54 0.09 0.00 0.00 178.44 180.80 1ojx s ASN 80 N -7.08 4.88 -0.15 -0.43 4.22 -1.26 -0.74 114.94 114.37 1ojx s ASN 80 Ca -0.04 -0.48 -0.28 0.00 -2.14 0.00 0.00 52.86 49.92 1ojx s ASN 80 Cb 0.08 -1.05 0.08 0.00 1.28 0.00 0.00 41.25 41.65 1ojx s ASN 80 CO 0.87 0.01 0.76 -0.83 -2.04 0.00 0.00 177.10 175.87 1ojx s GLY 81 N -3.58 -0.49 0.30 0.45 0.00 -1.20 -4.87 107.32 97.93 1ojx s GLY 81 Ca 0.31 1.75 0.03 0.00 0.00 0.00 0.00 44.72 46.81 1ojx s GLY 81 CO 0.21 1.30 0.13 -1.59 0.00 0.00 0.00 173.10 173.15 1ojx s LYS 82 N -0.55 1.57 0.28 2.90 -2.85 -1.26 -4.27 119.74 115.56 1ojx s LYS 82 Ca -0.05 -1.89 0.08 0.00 -1.00 0.00 0.00 55.97 53.12 1ojx s LYS 82 Cb -0.02 -0.27 -0.04 0.00 -2.06 0.00 0.00 37.83 35.44 1ojx s LYS 82 CO 0.05 -0.38 0.13 0.95 0.10 0.00 0.00 175.35 176.19 1ojx s THR 83 N -3.60 3.72 -1.05 3.79 -4.23 -1.26 -3.54 115.64 109.47 1ojx s THR 83 Ca 0.35 -1.64 0.27 0.00 -1.18 0.00 0.00 61.69 59.50 1ojx s THR 83 Cb 0.06 -3.10 0.25 0.00 1.34 0.00 0.00 72.50 71.06 1ojx s THR 83 CO 0.16 -0.31 1.88 0.35 -0.54 0.00 0.00 174.62 176.16 1ojx n THR 84 N -1.09 0.13 0.24 3.99 -2.24 -1.02 -3.40 114.28 110.88 1ojx n THR 84 Ca -0.06 0.03 0.11 0.00 -2.27 0.00 0.00 64.05 61.87 1ojx n THR 84 Cb 0.59 -0.57 0.55 0.00 -2.10 0.00 0.00 70.33 68.81 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 -9.79 3.22 3.38 -1.94 -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 0.44 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.23 1ojx h LEU 85 CO 0.00 0.18 0.59 -0.47 0.09 0.00 0.00 178.44 178.83 1ojx s TYR 86 N -3.78 3.28 -0.61 1.13 5.04 -1.22 -4.98 117.35 116.21 1ojx s TYR 86 Ca -0.00 1.45 0.10 0.00 -2.44 0.00 0.00 57.07 56.18 1ojx s TYR 86 Cb 0.11 -3.53 -0.08 0.00 0.35 0.00 0.00 41.96 38.81 1ojx s TYR 86 CO 0.61 -1.44 0.49 0.09 -1.34 0.00 0.00 175.55 173.96 1ojx n ASN 87 N 1.48 0.69 -2.65 4.32 3.02 -1.26 -5.03 115.26 115.83 1ojx n ASN 87 Ca 0.01 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1ojx n ASN 87 Cb 0.43 0.85 0.00 0.00 -0.61 0.00 0.00 39.78 40.45 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 1.14 -2.09 3.73 7.41 0.00 -1.26 -4.98 105.19 109.14 1ojx n GLY 88 Ca 0.03 -1.48 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.05 2.70 -1.68 1.61 -0.58 -1.26 -4.86 120.64 115.52 1ojx n GLU 89 Ca 0.00 0.96 -0.47 0.00 -0.42 0.00 0.00 57.16 57.23 1ojx n GLU 89 Cb 0.00 -2.76 -0.04 0.00 -0.57 0.00 0.00 31.44 28.06 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 2.72 2.16 -3.73 3.49 -0.02 -1.26 -4.82 135.00 133.55 1ojx n PRO 90 Ca 0.11 0.79 -0.14 0.00 -2.02 0.00 0.00 63.50 62.24 1ojx n PRO 90 Cb 0.36 -2.60 -0.09 0.00 -0.02 0.00 0.00 33.50 31.14 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 2.77 0.02 -0.12 -1.45 0.11 -1.26 -4.49 120.40 115.98 1ojx s VAL 91 Ca 0.87 -0.16 -0.04 0.00 -2.93 0.00 0.00 61.98 59.72 1ojx s VAL 91 Cb -0.69 -0.62 0.06 0.00 -1.53 0.00 0.00 36.38 33.60 1ojx s VAL 91 CO 0.46 -0.09 0.15 -0.55 -3.33 0.00 0.00 175.10 171.74 1ojx s SER 92 N -0.41 1.17 0.15 3.54 0.15 -1.26 -4.75 113.70 112.29 1ojx s SER 92 Ca -0.05 0.05 0.04 0.00 0.70 0.00 0.00 55.95 56.68 1ojx s SER 92 Cb -0.03 0.17 -0.04 0.00 -1.71 0.00 0.00 66.02 64.41 1ojx s SER 92 CO 0.03 -0.28 0.17 0.68 1.20 0.00 0.00 173.24 175.04 1ojx s VAL 93 N 2.26 4.75 0.21 4.45 -7.23 -1.26 -4.76 120.40 118.82 1ojx s VAL 93 Ca 0.04 -0.92 -0.31 0.00 -1.81 0.00 0.00 61.98 58.98 1ojx s VAL 93 Cb -0.13 -3.42 -0.10 0.00 0.56 0.00 0.00 36.38 33.29 1ojx s VAL 93 CO -0.07 -0.08 1.49 0.00 -0.31 0.00 0.00 175.10 176.13 1ojx s ALA 94 N -1.71 3.69 -1.49 1.32 0.00 -1.26 -3.26 121.76 119.04 1ojx s ALA 94 Ca 0.32 1.34 0.14 0.00 0.00 0.00 0.00 51.96 53.76 1ojx s ALA 94 Cb -0.11 -3.58 0.29 0.00 0.00 0.00 0.00 23.12 19.72 1ojx s ALA 94 CO 0.25 -0.75 1.19 0.27 0.00 0.00 0.00 175.76 176.71 1ojx n ASN 95 N 3.10 2.82 -3.67 0.00 0.23 0.08 -4.94 115.26 112.88 1ojx n ASN 95 Ca 0.10 -1.84 -0.15 0.00 -0.53 0.00 0.00 54.58 52.16 1ojx n ASN 95 Cb 0.40 -0.18 -0.08 0.00 -2.08 0.00 0.00 39.78 37.84 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 -1.04 5.92 0.20 0.00 1.04 -1.26 -4.89 113.70 113.67 1ojx s SER 97 Ca -0.11 0.11 -0.09 0.00 0.48 0.00 0.00 55.95 56.35 1ojx s SER 97 Cb -0.03 -1.46 0.13 0.00 0.10 0.00 0.00 66.02 64.75 1ojx s SER 97 CO 0.06 -0.56 1.75 0.58 0.98 0.00 0.00 173.24 176.04 1ojx h VAL 98 N 0.62 1.26 -0.80 5.02 2.07 -1.96 -2.05 116.25 120.41 1ojx h VAL 98 Ca -0.46 -0.85 0.05 0.00 0.82 0.00 0.00 66.70 66.26 1ojx h VAL 98 Cb 1.25 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 1ojx h VAL 98 CO 0.56 0.34 0.49 -0.08 0.02 0.00 0.00 177.57 178.90 1ojx h GLU 99 N 1.06 0.88 -0.47 1.57 4.81 -1.95 -1.36 114.58 119.13 1ojx h GLU 99 Ca 0.24 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.29 1ojx h GLU 99 Cb 0.26 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1ojx h GLU 99 CO -0.01 0.58 -0.19 0.93 -0.73 0.00 0.00 179.01 179.59 1ojx h GLU 100 N 0.91 0.93 -0.96 1.92 5.08 -1.92 -2.52 114.58 118.02 1ojx h GLU 100 Ca 0.35 -0.38 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1ojx h GLU 100 Cb 0.14 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.29 1ojx h GLU 100 CO -0.16 1.04 0.62 0.00 -1.00 0.00 0.00 179.01 179.51 1ojx h ALA 101 N 0.96 1.29 -0.44 3.43 0.00 -0.84 -0.27 119.26 123.40 1ojx h ALA 101 Ca 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ojx h ALA 101 Cb 0.74 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ojx h ALA 101 CO 0.06 0.47 0.27 0.28 0.00 0.00 0.00 179.25 180.33 1ojx h VAL 102 N 1.18 1.14 -0.23 0.00 2.07 -1.01 -1.79 116.25 117.60 1ojx h VAL 102 Ca 0.39 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 1ojx h VAL 102 Cb 0.05 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1ojx h VAL 102 CO -0.14 0.14 0.05 -1.28 0.02 0.00 0.00 177.57 176.36 1ojx h SER 103 N 0.59 0.30 0.12 0.57 0.87 -0.88 -1.94 113.55 113.19 1ojx h SER 103 Ca 0.16 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1ojx h SER 103 Cb -0.01 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1ojx h SER 103 CO -0.03 0.32 -0.01 0.18 -0.53 0.00 0.00 176.83 176.76 1ojx n LEU 104 N -4.40 0.21 0.00 2.23 4.77 -0.21 -4.92 117.00 114.70 1ojx n LEU 104 Ca 0.00 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1ojx n LEU 104 Cb 0.16 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1ojx n LEU 104 CO 0.36 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1ojx n GLY 105 N 1.09 0.81 3.77 -0.72 0.00 -0.73 -4.91 105.19 104.50 1ojx n GLY 105 Ca 0.21 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.32 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 3.17 -0.89 4.61 0.00 -0.72 -4.62 121.76 121.30 1ojx s ALA 106 Ca 0.00 0.98 0.19 0.00 0.00 0.00 0.00 51.96 53.13 1ojx s ALA 106 Cb 0.00 -3.38 -0.21 0.00 0.00 0.00 0.00 23.12 19.52 1ojx s ALA 106 CO 0.00 -0.53 0.82 0.43 0.00 0.00 0.00 175.76 176.48 1ojx n SER 107 N 0.10 0.91 -3.66 0.00 7.64 -0.25 -4.74 113.62 113.62 1ojx n SER 107 Ca 0.04 -0.93 -0.10 0.00 1.01 0.00 0.00 58.87 58.89 1ojx n SER 107 Cb 0.46 1.03 -0.02 0.00 -1.01 0.00 0.00 64.21 64.67 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 -2.86 -1.28 0.13 -0.43 0.00 -1.12 -4.17 121.76 112.03 1ojx s ALA 108 Ca 0.07 0.01 0.10 0.00 0.00 0.00 0.00 51.96 52.15 1ojx s ALA 108 Cb 0.15 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 24.09 1ojx s ALA 108 CO 0.80 -0.87 -0.26 0.14 0.00 0.00 0.00 175.76 175.57 1ojx s VAL 109 N -3.84 2.16 0.08 0.00 -7.23 -0.71 -1.46 120.40 109.39 1ojx s VAL 109 Ca 0.07 -1.74 0.08 0.00 -1.81 0.00 0.00 61.98 58.57 1ojx s VAL 109 Cb -0.03 -1.93 -0.03 0.00 0.56 0.00 0.00 36.38 34.95 1ojx s VAL 109 CO -0.03 0.04 -0.21 -0.83 -0.31 0.00 0.00 175.10 173.76 1ojx s GLY 110 N -2.09 1.18 -0.22 2.32 0.00 -0.30 -0.71 107.32 107.50 1ojx s GLY 110 Ca 0.13 -1.16 -0.14 0.00 0.00 0.00 0.00 44.72 43.56 1ojx s GLY 110 CO 0.06 -1.13 0.54 -0.47 0.00 0.00 0.00 173.10 172.10 1ojx s TYR 111 N -1.01 -0.78 -0.13 1.90 5.04 -0.71 -1.02 117.35 120.64 1ojx s TYR 111 Ca 0.07 1.64 -0.13 0.00 -2.44 0.00 0.00 57.07 56.21 1ojx s TYR 111 Cb -0.09 0.40 -0.05 0.00 0.35 0.00 0.00 41.96 42.56 1ojx s TYR 111 CO 0.03 -0.40 0.28 0.99 -1.34 0.00 0.00 175.55 175.11 1ojx s THR 112 N 1.28 5.29 0.10 4.34 2.01 -1.26 -1.01 115.64 126.39 1ojx s THR 112 Ca -0.08 0.53 0.08 0.00 0.31 0.00 0.00 61.69 62.54 1ojx s THR 112 Cb -0.06 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 1ojx s THR 112 CO -0.13 0.46 -0.17 0.27 -0.69 0.00 0.00 174.62 174.36 1ojx s ILE 113 N -0.01 2.90 -0.67 1.82 -4.36 -0.50 -4.85 121.20 115.54 1ojx s ILE 113 Ca 0.17 -1.40 0.05 0.00 -0.26 0.00 0.00 60.65 59.21 1ojx s ILE 113 Cb -0.13 -2.31 0.17 0.00 1.25 0.00 0.00 42.46 41.44 1ojx s ILE 113 CO 0.05 0.16 0.48 -0.31 0.24 0.00 0.00 174.94 175.55 1ojx s TYR 114 N -1.10 3.30 0.31 1.37 2.02 -1.26 -2.00 117.35 119.98 1ojx s TYR 114 Ca 0.18 -3.23 -0.29 0.00 -0.37 0.00 0.00 57.07 53.36 1ojx s TYR 114 Cb -0.11 -2.52 -0.13 0.00 -0.40 0.00 0.00 41.96 38.81 1ojx s TYR 114 CO 0.09 -0.58 1.27 -2.30 -1.57 0.00 0.00 175.55 172.46 1ojx n PRO 115 N 2.07 1.96 0.00 -1.71 -0.02 -1.26 -1.96 135.00 134.08 1ojx n PRO 115 Ca 0.21 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1ojx n PRO 115 Cb 0.36 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 1.20 3.24 3.68 -1.23 0.00 -1.26 -2.06 105.19 108.76 1ojx n GLY 116 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 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 0.06 1.80 0.19 1.61 2.88 -0.83 -2.41 113.62 116.93 1ojx n SER 117 Ca 0.00 0.90 0.18 0.00 -1.33 0.00 0.00 58.87 58.62 1ojx n SER 117 Cb 0.00 -1.49 0.79 0.00 -0.75 0.00 0.00 64.21 62.76 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 0.97 0.00 -3.41 0.46 0.00 -1.87 -0.78 103.07 98.44 1ojx h GLY 118 Ca -0.49 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.71 1ojx h GLY 118 CO 0.54 0.00 0.15 0.69 0.00 0.00 0.00 176.54 177.92 1ojx n PHE 119 N -3.45 2.17 -0.12 5.60 0.99 -1.26 -4.69 117.46 116.70 1ojx n PHE 119 Ca 0.03 -1.03 0.02 0.00 -0.00 0.00 0.00 57.45 56.48 1ojx n PHE 119 Cb 0.48 -0.59 0.33 0.00 -1.00 0.00 0.00 39.48 38.70 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 3.01 0.78 -0.90 -1.08 4.11 -1.39 -1.10 114.58 118.01 1ojx h GLU 120 Ca 0.15 -0.05 0.03 0.00 0.07 0.00 0.00 59.36 59.57 1ojx h GLU 120 Cb 2.13 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 31.15 1ojx h GLU 120 CO 0.60 0.52 0.59 0.11 0.07 0.00 0.00 179.01 180.90 1ojx h TRP 121 N 0.80 1.10 -0.53 2.06 5.08 -1.83 -1.37 115.95 121.26 1ojx h TRP 121 Ca 0.22 0.03 -0.04 0.00 1.08 0.00 0.00 58.89 60.18 1ojx h TRP 121 Cb -0.08 -0.37 -0.02 0.00 -3.00 0.00 0.00 29.16 25.69 1ojx h TRP 121 CO -0.00 0.65 0.19 -0.22 -1.28 0.00 0.00 178.44 177.77 1ojx h LYS 122 N 1.14 0.80 -0.04 0.12 3.64 -1.55 -1.56 116.57 119.11 1ojx h LYS 122 Ca 0.35 -0.16 -0.18 0.00 -1.27 0.00 0.00 60.65 59.39 1ojx h LYS 122 Cb -0.01 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1ojx h LYS 122 CO -0.10 0.72 -0.75 0.52 -2.27 0.00 0.00 179.45 177.57 1ojx h MET 123 N 0.72 0.29 -0.51 1.90 2.86 -1.46 -2.44 114.93 116.29 1ojx h MET 123 Ca 0.17 -0.25 -0.12 0.00 -2.06 0.00 0.00 59.70 57.44 1ojx h MET 123 Cb 0.24 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 1ojx h MET 123 CO -0.01 0.92 -0.15 0.74 1.06 0.00 0.00 176.91 179.47 1ojx h PHE 124 N 0.19 1.12 -0.40 -0.22 0.04 -1.11 0.11 116.94 116.66 1ojx h PHE 124 Ca -0.03 -0.24 -0.00 0.00 2.80 0.00 0.00 57.97 60.49 1ojx h PHE 124 Cb 1.33 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 39.19 1ojx h PHE 124 CO 0.03 1.06 0.25 1.49 -0.60 0.00 0.00 178.31 180.54 1ojx h GLU 125 N 0.88 0.54 -0.21 1.51 4.81 -1.31 -1.68 114.58 119.12 1ojx h GLU 125 Ca 0.13 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.18 1ojx h GLU 125 Cb 0.71 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 1ojx h GLU 125 CO 0.05 0.40 -0.37 1.49 -0.73 0.00 0.00 179.01 179.85 1ojx h GLU 126 N 0.53 0.63 -0.54 1.92 4.81 -1.30 -3.10 114.58 117.53 1ojx h GLU 126 Ca 0.14 -0.39 0.06 0.00 -0.13 0.00 0.00 59.36 59.05 1ojx h GLU 126 Cb -0.01 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 1ojx h GLU 126 CO -0.03 1.00 0.36 1.25 -0.73 0.00 0.00 179.01 180.87 1ojx h LEU 127 N 0.32 0.43 -0.87 1.64 5.85 -0.69 -1.41 115.31 120.57 1ojx h LEU 127 Ca 0.01 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.77 1ojx h LEU 127 Cb 0.96 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 1ojx h LEU 127 CO 0.08 0.28 0.56 0.00 -0.34 0.00 0.00 178.44 179.02 1ojx h ALA 128 N 1.71 1.16 -0.23 1.25 0.00 -1.22 0.13 119.26 122.06 1ojx h ALA 128 Ca 0.24 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1ojx h ALA 128 Cb 0.30 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ojx h ALA 128 CO -0.06 0.39 -0.45 0.00 0.00 0.00 0.00 179.25 179.12 1ojx h ARG 129 N 1.08 0.71 -0.54 0.00 3.08 -1.34 -2.41 114.38 114.96 1ojx h ARG 129 Ca 0.35 -0.46 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1ojx h ARG 129 Cb 0.03 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1ojx h ARG 129 CO -0.13 1.08 0.26 0.82 -1.07 0.00 0.00 179.97 180.94 1ojx h ILE 130 N 0.42 1.20 -0.31 2.04 2.04 -0.91 -1.81 117.51 120.18 1ojx h ILE 130 Ca 0.01 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.32 1ojx h ILE 130 Cb 1.06 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1ojx h ILE 130 CO 0.10 0.22 0.20 0.50 0.00 0.00 0.00 178.15 179.17 1ojx h LYS 131 N 0.72 0.40 -0.77 2.37 1.63 -0.77 0.17 116.57 120.32 1ojx h LYS 131 Ca 0.18 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 59.98 1ojx h LYS 131 Cb 0.11 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.61 1ojx h LYS 131 CO -0.02 0.26 0.50 -0.09 -3.45 0.00 0.00 179.45 176.65 1ojx h ARG 132 N 0.41 0.96 -0.45 1.90 2.43 -1.30 -1.76 114.38 116.57 1ojx h ARG 132 Ca 0.12 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 1ojx h ARG 132 Cb -0.04 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 1ojx h ARG 132 CO -0.03 0.63 -0.19 -0.44 -1.51 0.00 0.00 179.97 178.43 1ojx h ASP 133 N 0.98 0.90 -0.67 -3.80 3.32 -0.95 -1.93 116.42 114.28 1ojx h ASP 133 Ca 0.30 -0.32 0.08 0.00 0.02 0.00 0.00 57.03 57.11 1ojx h ASP 133 Cb -0.03 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.20 1ojx h ASP 133 CO -0.09 1.07 0.32 0.00 -1.72 0.00 0.00 179.24 178.82 1ojx h ALA 134 N 1.00 0.90 -0.29 3.45 0.00 -0.26 -0.22 119.26 123.85 1ojx h ALA 134 Ca 0.11 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ojx h ALA 134 Cb 0.73 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ojx h ALA 134 CO 0.06 -0.07 0.07 0.28 0.00 0.00 0.00 179.25 179.59 1ojx h VAL 135 N 0.57 1.21 -0.63 0.00 2.07 -1.19 0.44 116.25 118.71 1ojx h VAL 135 Ca 0.32 -0.70 0.04 0.00 0.82 0.00 0.00 66.70 67.18 1ojx h VAL 135 Cb 0.33 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.18 1ojx h VAL 135 CO -0.25 0.23 0.37 0.50 0.02 0.00 0.00 177.57 178.43 1ojx h LYS 136 N 0.30 0.68 -0.02 1.57 3.64 -0.94 -2.85 116.57 118.95 1ojx h LYS 136 Ca 0.09 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1ojx h LYS 136 Cb 0.28 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ojx h LYS 136 CO 0.00 0.45 -0.12 1.19 -2.27 0.00 0.00 179.45 178.71 1ojx n PHE 137 N -4.76 0.00 -3.56 1.91 3.72 -0.13 -4.97 117.46 109.66 1ojx n PHE 137 Ca 0.07 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.24 1ojx n PHE 137 Cb 0.12 -0.03 0.08 0.00 -0.94 0.00 0.00 39.48 38.71 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 0.12 -5.81 -4.49 4.37 2.03 0.04 -5.02 116.55 107.80 1ojx n ASP 138 Ca 0.15 -0.54 -0.35 0.00 0.52 0.00 0.00 54.79 54.57 1ojx n ASP 138 Cb 0.40 -4.99 -0.12 0.00 -0.72 0.00 0.00 41.12 35.70 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 -7.11 3.37 0.44 -2.67 1.02 -0.57 -5.04 118.68 108.12 1ojx s LEU 139 Ca 0.51 -0.14 -0.25 0.00 0.02 0.00 0.00 54.13 54.27 1ojx s LEU 139 Cb -0.22 -1.85 -0.09 0.00 0.02 0.00 0.00 46.19 44.05 1ojx s LEU 139 CO 0.72 0.10 1.33 -2.65 0.02 0.00 0.00 176.35 175.87 1ojx n PRO 140 N 4.02 2.03 -3.68 1.29 -0.02 -1.26 -4.52 135.00 132.87 1ojx n PRO 140 Ca -0.17 0.72 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 1ojx n PRO 140 Cb 0.52 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.41 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 -2.14 3.97 -0.24 2.45 2.96 -1.26 -1.74 118.68 122.67 1ojx s LEU 141 Ca 0.62 0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 54.49 1ojx s LEU 141 Cb -0.48 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.11 1ojx s LEU 141 CO 0.57 0.02 0.04 -0.69 -1.32 0.00 0.00 176.35 174.98 1ojx s VAL 142 N 1.31 4.09 -0.22 1.68 1.01 0.11 -1.13 120.40 127.26 1ojx s VAL 142 Ca 0.07 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1ojx s VAL 142 Cb -0.14 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 1ojx s VAL 142 CO 0.06 0.36 0.06 -0.69 0.00 0.00 0.00 175.10 174.90 1ojx s VAL 143 N 1.57 4.48 -0.43 2.92 1.01 -0.72 -1.74 120.40 127.50 1ojx s VAL 143 Ca 0.06 -0.13 -0.27 0.00 0.00 0.00 0.00 61.98 61.65 1ojx s VAL 143 Cb -0.15 -3.06 0.02 0.00 0.00 0.00 0.00 36.38 33.19 1ojx s VAL 143 CO 0.02 0.39 0.99 0.26 0.00 0.00 0.00 175.10 176.75 1ojx s TRP 144 N 1.11 2.96 -0.41 5.22 0.23 -0.18 -1.37 118.94 126.50 1ojx s TRP 144 Ca 0.04 0.64 -0.07 0.00 -2.03 0.00 0.00 56.10 54.69 1ojx s TRP 144 Cb -0.14 -3.96 0.09 0.00 0.03 0.00 0.00 33.47 29.49 1ojx s TRP 144 CO 0.03 -1.03 0.23 0.45 0.96 0.00 0.00 176.95 177.60 1ojx s SER 145 N 2.14 5.48 -0.60 2.95 0.15 -0.67 -1.40 113.70 121.75 1ojx s SER 145 Ca 0.41 -1.67 0.04 0.00 0.70 0.00 0.00 55.95 55.43 1ojx s SER 145 Cb -0.10 -1.92 0.17 0.00 -1.71 0.00 0.00 66.02 62.45 1ojx s SER 145 CO 0.24 -0.54 0.43 -0.31 1.20 0.00 0.00 173.24 174.27 1ojx s TYR 146 N 1.33 2.75 0.02 3.44 2.02 -0.85 -4.61 117.35 121.45 1ojx s TYR 146 Ca 0.04 -2.99 -0.38 0.00 -0.37 0.00 0.00 57.07 53.37 1ojx s TYR 146 Cb -0.23 -2.15 -0.17 0.00 -0.40 0.00 0.00 41.96 39.01 1ojx s TYR 146 CO -0.00 -0.65 1.33 -2.30 -1.57 0.00 0.00 175.55 172.36 1ojx n PRO 147 N 2.35 0.89 -3.63 -1.71 -0.02 -1.26 -4.14 135.00 127.47 1ojx n PRO 147 Ca 0.22 0.32 -0.11 0.00 -2.02 0.00 0.00 63.50 61.90 1ojx n PRO 147 Cb 0.39 -1.94 -0.07 0.00 -0.02 0.00 0.00 33.50 31.86 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 0.73 0.66 0.51 -0.52 3.52 -0.87 -4.87 118.95 118.12 1ojx s ARG 148 Ca 0.88 0.76 0.00 0.00 -0.13 0.00 0.00 55.73 57.24 1ojx s ARG 148 Cb -1.04 0.32 0.00 0.00 -1.56 0.00 0.00 34.95 32.67 1ojx s ARG 148 CO 0.51 -0.08 0.00 0.41 -0.81 0.00 0.00 175.30 175.33 1ojx n GLY 149 N 2.38 -2.27 7.00 8.12 0.00 -1.26 -2.04 105.19 117.12 1ojx n GLY 149 Ca -0.13 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.28 3.17 0.22 -0.02 0.00 -1.01 -1.83 105.19 105.43 1ojx n GLY 150 Ca 0.00 0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.19 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 1.15 -2.34 1.61 5.02 -1.26 -4.87 118.16 131.47 1ojx n LYS 151 Ca 0.00 -0.45 -0.43 0.00 -2.02 0.00 0.00 58.31 55.42 1ojx n LYS 151 Cb 0.00 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.50 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 -2.16 4.12 0.00 -0.18 1.01 -0.76 -4.88 120.40 117.55 1ojx s VAL 152 Ca 0.38 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.73 1ojx s VAL 152 Cb 0.21 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1ojx s VAL 152 CO 0.39 -0.11 0.00 1.33 0.00 0.00 0.00 175.10 176.72 1ojx n VAL 153 N 5.32 0.00 -3.75 2.92 0.24 -1.26 -4.49 118.33 117.31 1ojx n VAL 153 Ca 0.14 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.16 1ojx n VAL 153 Cb 0.44 0.08 -0.16 0.00 -1.47 0.00 0.00 33.84 32.73 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 -2.23 3.35 0.19 -1.34 3.84 -1.26 -5.01 114.94 112.48 1ojx s ASN 154 Ca 0.00 -1.11 0.24 0.00 0.21 0.00 0.00 52.86 52.20 1ojx s ASN 154 Cb 0.00 -0.72 0.91 0.00 -0.55 0.00 0.00 41.25 40.88 1ojx s ASN 154 CO 0.00 -0.33 1.72 -0.62 -2.79 0.00 0.00 177.10 175.08 1ojx n GLU 155 N 4.96 0.18 -0.25 0.43 1.02 -1.26 -2.80 120.64 122.92 1ojx n GLU 155 Ca -0.07 0.30 0.08 0.00 -0.02 0.00 0.00 57.16 57.44 1ojx n GLU 155 Cb 0.45 -1.78 0.21 0.00 -0.02 0.00 0.00 31.44 30.31 1ojx n GLU 155 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1ojx n THR 156 N -2.10 1.05 -2.07 2.62 -2.24 -1.26 -4.53 114.28 105.74 1ojx n THR 156 Ca 0.04 -1.02 -0.40 0.00 -2.27 0.00 0.00 64.05 60.40 1ojx n THR 156 Cb 0.30 0.48 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 1ojx n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ojx s ALA 157 N -1.06 3.32 0.23 6.98 0.00 -1.12 -4.37 121.76 125.74 1ojx s ALA 157 Ca 0.32 1.24 -0.06 0.00 0.00 0.00 0.00 51.96 53.45 1ojx s ALA 157 Cb 0.17 -3.48 0.40 0.00 0.00 0.00 0.00 23.12 20.21 1ojx s ALA 157 CO 0.21 -0.78 1.71 -1.35 0.00 0.00 0.00 175.76 175.56 1ojx h PRO 158 N 2.84 0.34 0.00 0.00 0.11 -1.92 -1.05 132.00 132.32 1ojx h PRO 158 Ca -0.49 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 1ojx h PRO 158 Cb 1.24 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1ojx h PRO 158 CO 0.63 0.22 -0.41 1.05 -0.21 0.00 0.00 178.00 179.29 1ojx h GLU 159 N 0.35 0.00 0.05 1.05 9.09 -1.96 -2.06 114.58 121.10 1ojx h GLU 159 Ca 0.38 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.61 1ojx h GLU 159 Cb 0.59 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.71 1ojx h GLU 159 CO -0.42 0.41 -0.74 0.82 0.05 0.00 0.00 179.01 179.13 1ojx h ILE 160 N 0.00 1.44 -0.52 -1.06 1.08 -1.56 -2.41 117.51 114.48 1ojx h ILE 160 Ca -0.00 -2.26 -0.07 0.00 -0.39 0.00 0.00 64.86 62.14 1ojx h ILE 160 Cb 0.77 2.78 -0.02 0.00 -3.07 0.00 0.00 36.82 37.29 1ojx h ILE 160 CO 0.05 0.65 0.06 0.58 -0.69 0.00 0.00 178.15 178.81 1ojx h VAL 161 N -0.13 1.26 -0.64 1.67 2.07 -1.28 -1.00 116.25 118.19 1ojx h VAL 161 Ca -0.11 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.43 1ojx h VAL 161 Cb 1.48 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 1ojx h VAL 161 CO 0.14 0.35 0.43 0.00 0.02 0.00 0.00 177.57 178.51 1ojx h ALA 162 N 0.97 0.81 -0.34 1.67 0.00 -1.46 -1.75 119.26 119.17 1ojx h ALA 162 Ca 0.16 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1ojx h ALA 162 Cb 0.44 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1ojx h ALA 162 CO 0.01 0.24 0.21 -0.92 0.00 0.00 0.00 179.25 178.80 1ojx h TYR 163 N 0.87 0.40 -0.72 0.00 -0.00 -1.26 -1.00 116.97 115.26 1ojx h TYR 163 Ca 0.24 0.01 0.11 0.00 -0.00 0.00 0.00 58.73 59.09 1ojx h TYR 163 Cb -0.10 -0.13 -0.08 0.00 -0.00 0.00 0.00 36.73 36.42 1ojx h TYR 163 CO -0.03 0.25 0.33 0.00 -0.00 0.00 0.00 178.16 178.71 1ojx h ALA 164 N 1.14 1.00 -0.27 1.82 0.00 -0.85 -0.24 119.26 121.86 1ojx h ALA 164 Ca 0.13 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1ojx h ALA 164 Cb -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ojx h ALA 164 CO -0.04 -0.11 -0.05 0.00 0.00 0.00 0.00 179.25 179.05 1ojx h ALA 165 N 1.47 0.37 -0.47 0.00 0.00 -0.96 -2.75 119.26 116.92 1ojx h ALA 165 Ca 0.37 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1ojx h ALA 165 Cb 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1ojx h ALA 165 CO -0.32 0.16 0.00 -0.09 0.00 0.00 0.00 179.25 179.01 1ojx h ARG 166 N 0.27 0.82 -0.88 0.00 9.65 -0.65 -2.41 114.38 121.18 1ojx h ARG 166 Ca 0.07 -0.26 0.05 0.00 -1.10 0.00 0.00 59.98 58.74 1ojx h ARG 166 Cb 0.51 -0.08 -0.06 0.00 -1.39 0.00 0.00 29.97 28.95 1ojx h ARG 166 CO 0.02 0.87 0.56 0.82 2.80 0.00 0.00 179.97 185.05 1ojx h ILE 167 N 0.68 1.10 -0.46 1.20 2.04 -1.05 -0.58 117.51 120.44 1ojx h ILE 167 Ca 0.13 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 1ojx h ILE 167 Cb 0.50 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1ojx h ILE 167 CO 0.02 0.19 0.14 0.00 0.00 0.00 0.00 178.15 178.51 1ojx h ALA 168 N 1.39 0.60 -0.06 1.87 0.00 -1.17 -1.63 119.26 120.25 1ojx h ALA 168 Ca 0.36 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1ojx h ALA 168 Cb 0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1ojx h ALA 168 CO -0.14 0.25 -0.20 1.25 0.00 0.00 0.00 179.25 180.40 1ojx h LEU 169 N 0.60 -0.60 -1.41 0.00 5.85 -0.95 -1.68 115.31 117.12 1ojx h LEU 169 Ca 0.15 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.97 1ojx h LEU 169 Cb 0.26 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 1ojx h LEU 169 CO -0.00 -0.26 0.40 -0.33 -0.34 0.00 0.00 178.44 177.91 1ojx h GLU 170 N -0.29 0.79 -0.01 1.25 4.39 -0.87 -2.70 114.58 117.15 1ojx h GLU 170 Ca 0.08 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1ojx h GLU 170 Cb 0.40 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1ojx h GLU 170 CO -0.23 0.53 -0.22 1.28 -1.16 0.00 0.00 179.01 179.21 1ojx n LEU 171 N -4.45 0.75 0.00 1.33 4.77 -0.64 -4.95 117.00 113.82 1ojx n LEU 171 Ca 0.06 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1ojx n LEU 171 Cb 0.05 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1ojx n LEU 171 CO 0.36 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1ojx n GLY 172 N 1.34 1.34 3.70 -0.72 0.00 -1.02 -4.99 105.19 104.84 1ojx n GLY 172 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.99 1.34 0.07 4.61 0.00 -0.65 -4.89 120.51 120.00 1ojx n ALA 173 Ca 0.00 0.37 0.10 0.00 0.00 0.00 0.00 53.44 53.91 1ojx n ALA 173 Cb 0.00 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.14 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 1.01 0.65 -3.65 0.00 8.00 -0.28 -4.80 116.55 117.48 1ojx n ASP 174 Ca 0.06 0.26 -0.10 0.00 0.71 0.00 0.00 54.79 55.71 1ojx n ASP 174 Cb 0.35 0.78 -0.04 0.00 -0.02 0.00 0.00 41.12 42.19 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 -3.36 -0.99 0.06 2.24 0.00 -1.10 -4.34 121.76 114.27 1ojx s ALA 175 Ca -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 1ojx s ALA 175 Cb 0.10 0.78 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 1ojx s ALA 175 CO 0.82 -0.72 0.07 0.00 0.00 0.00 0.00 175.76 175.92 1ojx s MET 176 N -3.83 0.67 -0.08 0.00 0.23 -0.84 -1.76 119.30 113.69 1ojx s MET 176 Ca 0.05 -1.01 -0.00 0.00 -1.03 0.00 0.00 55.69 53.70 1ojx s MET 176 Cb 0.00 0.25 0.02 0.00 -1.53 0.00 0.00 34.83 33.58 1ojx s MET 176 CO -0.08 -0.16 -0.05 0.21 -2.03 0.00 0.00 175.02 172.90 1ojx s LYS 177 N -3.50 1.12 0.12 3.16 2.20 -0.47 -0.32 119.74 122.04 1ojx s LYS 177 Ca 0.03 -0.12 0.02 0.00 -0.36 0.00 0.00 55.97 55.53 1ojx s LYS 177 Cb 0.04 -1.24 -0.04 0.00 -1.51 0.00 0.00 37.83 35.08 1ojx s LYS 177 CO -0.09 -0.22 -0.05 0.96 -0.36 0.00 0.00 175.35 175.59 1ojx s ILE 178 N 1.56 0.70 0.44 5.43 -4.36 -0.75 -1.67 121.20 122.55 1ojx s ILE 178 Ca 0.00 -1.95 -0.23 0.00 -0.26 0.00 0.00 60.65 58.22 1ojx s ILE 178 Cb -0.13 -1.79 -0.08 0.00 1.25 0.00 0.00 42.46 41.71 1ojx s ILE 178 CO -0.05 -0.78 1.09 -0.54 0.24 0.00 0.00 174.94 174.91 1ojx s LYS 179 N -3.85 3.92 0.30 0.37 1.02 -1.26 -0.64 119.74 119.60 1ojx s LYS 179 Ca 0.15 1.58 -0.28 0.00 0.02 0.00 0.00 55.97 57.43 1ojx s LYS 179 Cb 0.05 -2.39 -0.09 0.00 -0.52 0.00 0.00 37.83 34.88 1ojx s LYS 179 CO -0.03 -0.37 1.06 -0.47 -0.92 0.00 0.00 175.35 174.63 1ojx s TYR 180 N -1.69 3.58 -0.34 3.18 5.04 -1.26 -4.89 117.35 120.97 1ojx s TYR 180 Ca 0.62 1.73 0.25 0.00 -2.44 0.00 0.00 57.07 57.23 1ojx s TYR 180 Cb -0.23 -3.19 0.55 0.00 0.35 0.00 0.00 41.96 39.43 1ojx s TYR 180 CO 0.28 -0.39 1.69 1.79 -1.34 0.00 0.00 175.55 177.58 1ojx h THR 181 N 2.90 0.00 0.00 4.34 1.35 -1.95 -3.45 112.91 116.11 1ojx h THR 181 Ca -0.47 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 1ojx h THR 181 Cb 1.21 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.52 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 0.89 0.42 3.29 5.82 0.00 -1.26 -4.87 105.19 109.48 1ojx n GLY 182 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.77 -0.30 0.46 1.61 -4.77 -1.26 -5.07 116.67 104.57 1ojx s ASP 183 Ca 0.00 0.33 0.23 0.00 -3.30 0.00 0.00 52.55 49.81 1ojx s ASP 183 Cb 0.00 0.46 1.10 0.00 -1.09 0.00 0.00 42.92 43.38 1ojx s ASP 183 CO 0.00 -0.40 1.93 1.55 0.70 0.00 0.00 175.17 178.95 1ojx h PRO 184 N 4.12 0.00 0.22 2.11 0.13 -1.98 -2.50 132.00 134.11 1ojx h PRO 184 Ca -0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 1ojx h PRO 184 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1ojx h PRO 184 CO 0.37 0.22 -0.11 -0.22 -0.23 0.00 0.00 178.00 178.03 1ojx h LYS 185 N 0.00 -0.29 -0.36 0.86 3.64 -1.97 -0.80 116.57 117.65 1ojx h LYS 185 Ca -0.00 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.32 1ojx h LYS 185 Cb 0.56 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1ojx h LYS 185 CO 0.03 0.06 -0.08 1.79 -2.27 0.00 0.00 179.45 178.97 1ojx h THR 186 N -0.69 1.23 -0.03 1.00 1.35 -2.00 -2.69 112.91 111.09 1ojx h THR 186 Ca -0.03 -1.02 -0.09 0.00 -0.55 0.00 0.00 66.41 64.72 1ojx h THR 186 Cb 0.48 1.05 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 1ojx h THR 186 CO 0.05 0.34 -0.42 0.15 -0.25 0.00 0.00 175.52 175.39 1ojx h PHE 187 N 0.56 0.07 -0.04 4.73 3.57 -1.45 -2.76 116.94 121.62 1ojx h PHE 187 Ca 0.11 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 1ojx h PHE 187 Cb 0.48 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1ojx h PHE 187 CO 0.02 0.47 -0.18 0.66 -2.23 0.00 0.00 178.31 177.05 1ojx h SER 188 N 0.05 0.06 -0.49 0.41 4.64 -0.79 -2.19 113.55 115.24 1ojx h SER 188 Ca 0.00 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 1ojx h SER 188 Cb 0.76 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1ojx h SER 188 CO 0.06 0.25 -0.21 -0.25 -0.87 0.00 0.00 176.83 175.80 1ojx h TRP 189 N 0.07 1.16 -0.55 4.77 2.91 -1.46 -1.20 115.95 121.64 1ojx h TRP 189 Ca 0.01 -0.28 -0.01 0.00 1.13 0.00 0.00 58.89 59.74 1ojx h TRP 189 Cb 0.36 -0.27 -0.03 0.00 -0.51 0.00 0.00 29.16 28.71 1ojx h TRP 189 CO 0.00 1.11 0.31 0.00 -1.03 0.00 0.00 178.44 178.83 1ojx h ALA 190 N 0.87 0.70 -0.91 2.65 0.00 -1.41 -1.89 119.26 119.28 1ojx h ALA 190 Ca 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ojx h ALA 190 Cb 0.80 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1ojx h ALA 190 CO 0.07 0.21 0.52 0.28 0.00 0.00 0.00 179.25 180.33 1ojx h VAL 191 N 0.74 1.26 -0.30 0.00 2.07 -1.31 -2.65 116.25 116.05 1ojx h VAL 191 Ca 0.19 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 1ojx h VAL 191 Cb 0.03 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1ojx h VAL 191 CO -0.03 0.28 0.15 0.50 0.02 0.00 0.00 177.57 178.49 1ojx h LYS 192 N 1.26 0.43 0.00 1.57 1.63 -0.84 -2.81 116.57 117.81 1ojx h LYS 192 Ca 0.32 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 60.06 1ojx h LYS 192 Cb -0.01 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.54 1ojx h LYS 192 CO -0.06 0.40 0.00 -0.39 -3.45 0.00 0.00 179.45 175.95 1ojx h VAL 193 N 0.36 0.00 0.00 2.00 -1.51 -1.25 -1.68 116.25 114.18 1ojx h VAL 193 Ca 0.10 -0.48 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 1ojx h VAL 193 Cb 0.11 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 1ojx h VAL 193 CO -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.33 1ojx n ALA 194 N -1.94 1.95 -0.92 5.19 0.00 -1.01 -4.65 120.51 119.14 1ojx n ALA 194 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1ojx n ALA 194 Cb 0.33 -1.40 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 0.62 3.62 0.00 0.00 0.00 -0.63 -1.83 105.19 106.97 1ojx n GLY 195 Ca 0.04 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.06 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 0.02 -3.24 1.61 5.02 -1.26 -4.74 118.16 129.57 1ojx n LYS 196 Ca 0.00 0.28 -0.40 0.00 -2.02 0.00 0.00 58.31 56.17 1ojx n LYS 196 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.43 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 -2.95 5.07 0.49 -0.18 1.01 -0.76 -5.05 120.40 118.04 1ojx s VAL 197 Ca 0.06 0.88 -0.22 0.00 0.00 0.00 0.00 61.98 62.71 1ojx s VAL 197 Cb 0.08 -3.83 -0.07 0.00 0.00 0.00 0.00 36.38 32.56 1ojx s VAL 197 CO 0.21 0.09 1.19 -2.16 0.00 0.00 0.00 175.10 174.43 1ojx s PRO 198 N 2.26 3.58 -0.16 2.72 0.04 -1.26 -4.85 135.00 137.32 1ojx s PRO 198 Ca 0.21 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 63.04 1ojx s PRO 198 Cb -0.16 -2.30 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 1ojx s PRO 198 CO 0.09 -0.71 -0.07 0.08 0.04 0.00 0.00 177.00 176.42 1ojx s VAL 199 N -1.55 3.45 -0.15 -0.36 1.01 -1.26 -1.98 120.40 119.56 1ojx s VAL 199 Ca 0.67 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 1ojx s VAL 199 Cb -0.30 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1ojx s VAL 199 CO 0.35 0.49 0.03 -0.76 0.00 0.00 0.00 175.10 175.21 1ojx s LEU 200 N 0.63 3.67 0.09 3.92 1.43 0.56 -1.17 118.68 127.81 1ojx s LEU 200 Ca -0.04 0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 52.81 1ojx s LEU 200 Cb -0.15 -1.90 -0.07 0.00 0.03 0.00 0.00 46.19 44.10 1ojx s LEU 200 CO 0.03 0.23 1.36 -0.32 0.23 0.00 0.00 176.35 177.88 1ojx s MET 201 N 0.05 4.33 0.23 1.70 -2.45 -0.39 -1.81 119.30 120.95 1ojx s MET 201 Ca 0.04 2.02 -0.30 0.00 -1.25 0.00 0.00 55.69 56.20 1ojx s MET 201 Cb -0.13 -3.31 -0.09 0.00 1.25 0.00 0.00 34.83 32.56 1ojx s MET 201 CO 0.01 -0.43 1.25 0.45 1.05 0.00 0.00 175.02 177.35 1ojx s SER 202 N 1.21 6.99 -0.00 1.11 0.15 0.19 -0.89 113.70 122.46 1ojx s SER 202 Ca 0.64 2.37 -0.25 0.00 0.70 0.00 0.00 55.95 59.42 1ojx s SER 202 Cb -0.35 -2.62 -0.17 0.00 -1.71 0.00 0.00 66.02 61.17 1ojx s SER 202 CO 0.30 -0.43 1.21 1.23 1.20 0.00 0.00 173.24 176.75 1ojx h GLY 203 N 4.82 -0.34 0.00 9.45 0.00 -1.75 -3.41 103.07 111.84 1ojx h GLY 203 Ca -0.46 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1ojx h GLY 203 CO 0.73 -0.12 0.00 0.61 0.00 0.00 0.00 176.54 177.76 1ojx n GLY 204 N -0.15 -0.18 3.69 4.60 0.00 -1.26 -4.98 105.19 106.92 1ojx n GLY 204 Ca -0.09 -1.91 -0.34 0.00 0.00 0.00 0.00 46.02 43.68 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 -0.34 0.41 -1.67 1.61 -0.02 -1.26 -4.45 135.00 129.28 1ojx n PRO 205 Ca 0.00 0.21 -0.46 0.00 -2.02 0.00 0.00 63.50 61.23 1ojx n PRO 205 Cb 0.00 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.00 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 -2.88 2.18 -1.65 -0.52 4.81 -1.26 -4.82 118.16 114.03 1ojx n LYS 206 Ca 0.14 0.79 -0.30 0.00 -0.87 0.00 0.00 58.31 58.07 1ojx n LYS 206 Cb 0.50 -2.57 0.07 0.00 0.02 0.00 0.00 35.03 33.05 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 1.07 3.41 0.16 3.15 -4.23 -1.26 -4.98 115.64 112.96 1ojx s THR 207 Ca 0.79 0.46 -0.11 0.00 -1.18 0.00 0.00 61.69 61.65 1ojx s THR 207 Cb -0.67 -3.27 0.04 0.00 1.34 0.00 0.00 72.50 69.94 1ojx s THR 207 CO 0.38 -0.60 1.63 0.11 -0.54 0.00 0.00 174.62 175.60 1ojx h LYS 208 N -0.89 0.96 -5.78 3.99 1.57 -1.99 -3.43 116.57 111.00 1ojx h LYS 208 Ca -0.46 -0.29 -0.49 0.00 -1.87 0.00 0.00 60.65 57.54 1ojx h LYS 208 Cb 1.25 -0.09 -0.17 0.00 0.08 0.00 0.00 32.23 33.29 1ojx h LYS 208 CO 0.60 0.95 -0.77 0.95 -0.57 0.00 0.00 179.45 180.61 1ojx s THR 209 N -5.07 1.72 0.30 -0.16 -4.23 -1.26 -5.04 115.64 101.90 1ojx s THR 209 Ca -0.12 -1.93 -0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1ojx s THR 209 Cb 0.12 -1.82 0.27 0.00 1.34 0.00 0.00 72.50 72.41 1ojx s THR 209 CO 0.83 -0.38 1.94 -0.33 -0.54 0.00 0.00 174.62 176.14 1ojx h GLU 210 N 3.17 1.03 -0.75 3.99 5.08 -2.00 -2.56 114.58 122.54 1ojx h GLU 210 Ca -0.41 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 57.91 1ojx h GLU 210 Cb 1.21 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 1ojx h GLU 210 CO 0.53 0.68 0.49 1.49 -1.00 0.00 0.00 179.01 181.20 1ojx h GLU 211 N 1.06 0.92 -0.53 2.33 4.57 -1.98 -1.47 114.58 119.47 1ojx h GLU 211 Ca 0.35 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.47 1ojx h GLU 211 Cb 0.07 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 1ojx h GLU 211 CO -0.11 0.61 0.31 -0.44 -1.18 0.00 0.00 179.01 178.19 1ojx h ASP 212 N 0.95 0.65 -0.30 1.04 3.32 -1.87 -1.87 116.42 118.33 1ojx h ASP 212 Ca 0.29 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 1ojx h ASP 212 Cb -0.01 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1ojx h ASP 212 CO -0.08 0.53 0.08 0.15 -1.72 0.00 0.00 179.24 178.20 1ojx h PHE 213 N 0.71 0.50 -0.72 4.55 3.57 -1.33 -2.64 116.94 121.58 1ojx h PHE 213 Ca 0.19 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.67 1ojx h PHE 213 Cb 0.01 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 1ojx h PHE 213 CO -0.02 0.54 0.47 -0.07 -2.23 0.00 0.00 178.31 177.00 1ojx h LEU 214 N 0.32 0.73 -0.67 0.59 3.38 -1.07 -1.57 115.31 117.02 1ojx h LEU 214 Ca 0.10 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1ojx h LEU 214 Cb 0.28 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1ojx h LEU 214 CO 0.00 0.50 0.12 0.50 0.09 0.00 0.00 178.44 179.65 1ojx h LYS 215 N 0.84 1.10 -0.38 1.13 3.64 -1.25 -1.52 116.57 120.14 1ojx h LYS 215 Ca 0.29 -0.29 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1ojx h LYS 215 Cb 0.10 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1ojx h LYS 215 CO -0.09 1.00 0.17 1.96 -2.27 0.00 0.00 179.45 180.22 1ojx h GLN 216 N 1.03 0.56 -0.63 1.90 4.20 -0.95 -2.48 115.11 118.74 1ojx h GLN 216 Ca 0.21 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 1ojx h GLN 216 Cb 0.42 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1ojx h GLN 216 CO 0.01 0.51 0.30 0.28 -0.67 0.00 0.00 178.83 179.27 1ojx h VAL 217 N 0.47 1.20 -0.64 -0.54 2.07 -1.17 -1.95 116.25 115.69 1ojx h VAL 217 Ca 0.13 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1ojx h VAL 217 Cb 0.15 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 1ojx h VAL 217 CO -0.01 0.24 0.32 -0.08 0.02 0.00 0.00 177.57 178.05 1ojx h GLU 218 N 0.89 0.93 -0.42 1.57 4.81 -1.04 -1.95 114.58 119.37 1ojx h GLU 218 Ca 0.22 -0.13 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 1ojx h GLU 218 Cb 0.09 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1ojx h GLU 218 CO -0.03 0.73 -0.18 0.78 -0.73 0.00 0.00 179.01 179.59 1ojx h GLY 219 N 0.89 0.87 0.77 1.92 0.00 -1.01 -1.61 103.07 104.89 1ojx h GLY 219 Ca 0.22 -0.71 0.03 0.00 0.00 0.00 0.00 47.33 46.87 1ojx h GLY 219 CO -0.03 0.65 0.05 -2.08 0.00 0.00 0.00 176.54 175.13 1ojx h VAL 220 N 0.71 0.91 -0.63 4.60 2.07 -1.13 -1.19 116.25 121.60 1ojx h VAL 220 Ca 0.11 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.48 1ojx h VAL 220 Cb 0.69 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1ojx h VAL 220 CO 0.05 0.02 0.02 -0.07 0.02 0.00 0.00 177.57 177.62 1ojx h LEU 221 N 0.14 1.07 -1.18 2.57 3.38 -1.22 -2.51 115.31 117.55 1ojx h LEU 221 Ca 0.10 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1ojx h LEU 221 Cb 0.09 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1ojx h LEU 221 CO -0.12 1.10 0.55 -0.08 0.09 0.00 0.00 178.44 179.98 1ojx h GLU 222 N 1.00 1.09 0.00 1.13 4.81 -1.09 -1.63 114.58 119.89 1ojx h GLU 222 Ca 0.18 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1ojx h GLU 222 Cb 0.54 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1ojx h GLU 222 CO 0.03 0.72 0.00 0.00 -0.73 0.00 0.00 179.01 179.03 1ojx n ALA 223 N -2.41 1.84 -0.22 2.92 0.00 -0.47 -4.90 120.51 117.27 1ojx n ALA 223 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1ojx n ALA 223 Cb 0.03 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.19 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 0.33 0.87 3.80 0.00 0.00 -0.61 -4.38 105.19 105.20 1ojx n GLY 224 Ca 0.05 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 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 2.53 0.21 4.61 0.00 -0.96 -4.91 121.76 121.24 1ojx s ALA 225 Ca 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 1ojx s ALA 225 Cb 0.00 -3.22 0.16 0.00 0.00 0.00 0.00 23.12 20.06 1ojx s ALA 225 CO 0.00 -1.40 1.52 1.25 0.00 0.00 0.00 175.76 177.14 1ojx h LEU 226 N -0.79 0.51 0.00 0.00 5.85 -1.47 -3.44 115.31 115.97 1ojx h LEU 226 Ca -0.44 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.00 1ojx h LEU 226 Cb 1.22 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1ojx h LEU 226 CO 0.55 0.97 0.00 0.61 -0.34 0.00 0.00 178.44 180.23 1ojx n GLY 227 N 0.26 -0.62 3.02 3.75 0.00 -1.22 -1.69 105.19 108.69 1ojx n GLY 227 Ca -0.03 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.00 0.32 -0.33 -0.61 -4.36 -0.63 -1.27 121.20 110.32 1ojx s ILE 228 Ca 0.00 -1.01 0.02 0.00 -0.26 0.00 0.00 60.65 59.40 1ojx s ILE 228 Cb 0.00 -0.45 0.09 0.00 1.25 0.00 0.00 42.46 43.35 1ojx s ILE 228 CO 0.00 -0.45 0.03 0.00 0.24 0.00 0.00 174.94 174.76 1ojx s ALA 229 N -1.46 2.86 -0.06 2.27 0.00 -0.07 -1.08 121.76 124.21 1ojx s ALA 229 Ca -0.13 -2.27 0.04 0.00 0.00 0.00 0.00 51.96 49.60 1ojx s ALA 229 Cb -0.10 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 1ojx s ALA 229 CO -0.00 -1.55 -0.16 0.54 0.00 0.00 0.00 175.76 174.59 1ojx s VAL 230 N 1.03 2.87 0.00 0.00 0.11 0.04 -2.00 120.40 122.45 1ojx s VAL 230 Ca 0.04 -0.78 0.00 0.00 -2.93 0.00 0.00 61.98 58.31 1ojx s VAL 230 Cb -0.20 -2.12 0.00 0.00 -1.53 0.00 0.00 36.38 32.53 1ojx s VAL 230 CO -0.06 0.58 0.00 0.61 -3.33 0.00 0.00 175.10 172.90 1ojx n GLY 231 N 2.62 0.70 0.33 6.54 0.00 -1.26 -0.39 105.19 113.74 1ojx n GLY 231 Ca -0.17 -0.01 0.15 0.00 0.00 0.00 0.00 46.02 45.98 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 0.52 0.00 1.61 3.08 -1.85 -0.36 114.38 117.38 1ojx h ARG 232 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1ojx h ARG 232 Cb 0.00 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1ojx h ARG 232 CO 0.00 0.35 0.00 0.09 -1.07 0.00 0.00 179.97 179.34 1ojx n ASN 233 N -4.93 0.00 -0.02 7.04 3.02 -1.26 -1.50 115.26 117.61 1ojx n ASN 233 Ca 0.24 0.27 -0.03 0.00 -0.03 0.00 0.00 54.58 55.04 1ojx n ASN 233 Cb 0.67 -0.38 -0.01 0.00 -0.61 0.00 0.00 39.78 39.45 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 -1.38 0.65 1.08 2.41 0.31 -0.29 -4.85 118.33 116.26 1ojx n VAL 234 Ca 0.05 0.29 0.13 0.00 -0.01 0.00 0.00 64.34 64.80 1ojx n VAL 234 Cb 0.13 -1.71 0.61 0.00 -0.91 0.00 0.00 33.84 31.97 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 -3.27 0.00 1.46 3.52 4.27 -0.37 -2.22 117.44 120.83 1ojx n TRP 235 Ca -0.05 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.70 1ojx n TRP 235 Cb 0.17 -0.39 0.55 0.00 -1.36 0.00 0.00 31.31 30.28 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 -1.39 1.13 -3.65 -2.67 7.27 -0.56 -4.70 117.38 112.81 1ojx n GLN 236 Ca 0.10 -0.56 -0.37 0.00 0.07 0.00 0.00 57.00 56.23 1ojx n GLN 236 Cb 0.26 -1.49 -0.06 0.00 2.41 0.00 0.00 30.24 31.36 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 -2.25 3.73 0.47 3.69 0.52 -0.94 -4.41 118.95 119.75 1ojx s ARG 237 Ca 0.33 0.19 0.14 0.00 -0.52 0.00 0.00 55.73 55.87 1ojx s ARG 237 Cb 0.20 -3.19 1.09 0.00 0.52 0.00 0.00 34.95 33.57 1ojx s ARG 237 CO 0.42 0.72 2.06 0.00 0.02 0.00 0.00 175.30 178.52 1ojx h ARG 238 N 4.72 0.07 -1.29 3.54 2.47 -1.88 -2.54 114.38 119.47 1ojx h ARG 238 Ca -0.53 -0.01 -0.70 0.00 -1.26 0.00 0.00 59.98 57.49 1ojx h ARG 238 Cb 1.22 -0.01 -0.29 0.00 -1.65 0.00 0.00 29.97 29.23 1ojx h ARG 238 CO 0.61 0.14 0.81 -0.40 0.56 0.00 0.00 179.97 181.68 1ojx n ASP 239 N -4.43 7.45 -0.15 7.04 5.75 -1.26 -4.81 116.55 126.14 1ojx n ASP 239 Ca -0.02 -3.80 -0.03 0.00 -0.01 0.00 0.00 54.79 50.93 1ojx n ASP 239 Cb 0.16 -0.96 0.05 0.00 -1.03 0.00 0.00 41.12 39.34 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 2.32 0.51 -0.21 2.12 0.00 -1.66 -1.79 119.26 120.55 1ojx h ALA 240 Ca 0.58 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 55.47 1ojx h ALA 240 Cb 0.62 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1ojx h ALA 240 CO 1.49 -0.32 -0.33 1.25 0.00 0.00 0.00 179.25 181.35 1ojx h LEU 241 N 0.22 0.65 -0.36 0.00 5.85 -1.88 -1.54 115.31 118.26 1ojx h LEU 241 Ca 0.23 -0.52 0.04 0.00 0.84 0.00 0.00 57.88 58.47 1ojx h LEU 241 Cb 0.30 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 1ojx h LEU 241 CO -0.31 1.05 0.11 0.50 -0.34 0.00 0.00 178.44 179.45 1ojx h LYS 242 N 0.28 0.24 -0.38 1.25 3.64 -1.90 -1.71 116.57 118.00 1ojx h LYS 242 Ca 0.02 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 1ojx h LYS 242 Cb 0.91 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1ojx h LYS 242 CO 0.07 0.16 -0.24 0.35 -2.27 0.00 0.00 179.45 177.53 1ojx h PHE 243 N 0.25 0.86 -0.86 1.91 3.57 -1.29 -2.23 116.94 119.15 1ojx h PHE 243 Ca 0.16 -0.20 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 1ojx h PHE 243 Cb 0.15 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 1ojx h PHE 243 CO -0.16 0.92 0.52 0.00 -2.23 0.00 0.00 178.31 177.37 1ojx h ALA 244 N 1.07 1.10 -0.41 2.41 0.00 -1.02 -0.96 119.26 121.46 1ojx h ALA 244 Ca 0.09 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1ojx h ALA 244 Cb 0.75 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1ojx h ALA 244 CO 0.06 0.56 -0.12 0.00 0.00 0.00 0.00 179.25 179.75 1ojx h ARG 245 N 1.19 0.73 -0.52 0.00 3.08 -1.05 -1.72 114.38 116.09 1ojx h ARG 245 Ca 0.31 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1ojx h ARG 245 Cb -0.05 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1ojx h ARG 245 CO -0.06 0.83 0.11 0.00 -1.07 0.00 0.00 179.97 179.78 1ojx h ALA 246 N 1.20 1.21 -0.55 0.04 0.00 -0.79 -2.32 119.26 118.05 1ojx h ALA 246 Ca 0.11 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1ojx h ALA 246 Cb 0.59 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1ojx h ALA 246 CO 0.04 0.54 -0.02 -0.07 0.00 0.00 0.00 179.25 179.73 1ojx h LEU 247 N 0.78 0.98 -0.53 0.00 3.38 -0.79 -2.68 115.31 116.45 1ojx h LEU 247 Ca 0.17 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.84 1ojx h LEU 247 Cb 0.31 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1ojx h LEU 247 CO 0.00 1.06 0.32 0.00 0.09 0.00 0.00 178.44 179.92 1ojx h ALA 248 N 0.95 0.68 -0.78 1.53 0.00 -1.16 -0.94 119.26 119.54 1ojx h ALA 248 Ca 0.15 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ojx h ALA 248 Cb 0.57 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1ojx h ALA 248 CO 0.03 0.04 0.49 1.49 0.00 0.00 0.00 179.25 181.30 1ojx h GLU 249 N 0.64 1.05 0.00 0.00 4.57 -1.25 -0.71 114.58 118.88 1ojx h GLU 249 Ca 0.21 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1ojx h GLU 249 Cb 0.01 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.38 1ojx h GLU 249 CO -0.09 0.72 -0.00 1.25 -1.18 0.00 0.00 179.01 179.71 1ojx h LEU 250 N 1.06 -0.00 -0.04 1.64 5.85 -1.21 -1.60 115.31 121.00 1ojx h LEU 250 Ca 0.28 -0.30 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1ojx h LEU 250 Cb -0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1ojx h LEU 250 CO -0.06 0.29 -0.25 0.58 -0.34 0.00 0.00 178.44 178.67 1ojx h VAL 251 N -0.30 1.47 0.00 1.05 2.07 -1.06 -3.31 116.25 116.17 1ojx h VAL 251 Ca -0.00 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1ojx h VAL 251 Cb 0.30 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1ojx h VAL 251 CO 0.00 0.48 -0.67 1.88 0.02 0.00 0.00 177.57 179.28 1ojx h TYR 252 N -0.32 0.00 0.00 1.57 0.05 -1.25 -3.46 116.97 113.56 1ojx h TYR 252 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.76 1ojx h TYR 252 Cb 0.92 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.66 1ojx h TYR 252 CO 0.14 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.66