#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oy0 s THR 19 N 0.00 5.27 -0.32 8.89 2.01 -1.26 -5.06 115.64 125.17 1oy0 s THR 19 Ca 0.00 0.57 -0.21 0.00 0.31 0.00 0.00 61.69 62.36 1oy0 s THR 19 Cb 0.00 -3.61 -0.00 0.00 0.01 0.00 0.00 72.50 68.89 1oy0 s THR 19 CO 0.00 0.48 0.66 -0.54 -0.69 0.00 0.00 174.62 174.53 1oy0 s LYS 20 N -0.20 3.85 0.25 4.92 1.02 -1.26 -4.82 119.74 123.49 1oy0 s LYS 20 Ca 0.18 0.27 -0.31 0.00 0.02 0.00 0.00 55.97 56.13 1oy0 s LYS 20 Cb -0.14 -3.75 -0.13 0.00 -0.52 0.00 0.00 37.83 33.30 1oy0 s LYS 20 CO 0.06 -0.64 1.54 -0.89 -0.92 0.00 0.00 175.35 174.51 1oy0 n ILE 21 N 5.48 0.75 -4.43 2.17 2.08 0.18 -5.00 119.36 120.58 1oy0 n ILE 21 Ca -0.00 -0.19 -0.21 0.00 0.56 0.00 0.00 62.75 62.91 1oy0 n ILE 21 Cb 0.49 -1.74 -0.10 0.00 -0.75 0.00 0.00 39.64 37.54 1oy0 n ILE 21 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 1oy0 s ARG 22 N -0.10 1.55 0.26 0.38 1.81 -1.26 -4.19 118.95 117.40 1oy0 s ARG 22 Ca 0.69 -1.79 -0.03 0.00 -1.72 0.00 0.00 55.73 52.88 1oy0 s ARG 22 Cb -0.58 -1.14 0.40 0.00 -0.45 0.00 0.00 34.95 33.19 1oy0 s ARG 22 CO 0.46 0.03 1.88 1.79 -0.68 0.00 0.00 175.30 178.77 1oy0 h THR 23 N 2.28 1.07 -0.20 0.02 1.35 -1.99 -1.59 112.91 113.86 1oy0 h THR 23 Ca -0.40 -0.39 0.06 0.00 -0.55 0.00 0.00 66.41 65.13 1oy0 h THR 23 Cb 1.23 -0.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.48 1oy0 h THR 23 CO 0.67 0.21 0.14 1.12 -0.25 0.00 0.00 175.52 177.41 1oy0 h HIS 24 N 1.14 0.00 -0.75 4.73 2.07 -1.98 -0.87 115.15 119.49 1oy0 h HIS 24 Ca 0.43 0.00 0.03 0.00 -2.85 0.00 0.00 60.37 57.98 1oy0 h HIS 24 Cb 0.18 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.12 1oy0 h HIS 24 CO -0.01 0.00 0.48 0.45 -3.07 0.00 0.00 177.93 175.78 1oy0 h HIS 25 N 0.00 0.90 -0.26 6.12 3.86 -1.69 0.66 115.15 124.74 1oy0 h HIS 25 Ca 0.09 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.29 1oy0 h HIS 25 Cb 0.38 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1oy0 h HIS 25 CO 0.00 0.52 -0.01 -0.07 0.86 0.00 0.00 177.93 179.23 1oy0 h LEU 26 N 0.94 0.36 -0.02 2.43 3.38 -1.23 -0.02 115.31 121.16 1oy0 h LEU 26 Ca 0.30 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 1oy0 h LEU 26 Cb -0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1oy0 h LEU 26 CO -0.10 0.43 -0.02 -0.61 0.09 0.00 0.00 178.44 178.23 1oy0 h GLN 27 N 0.38 0.04 -0.48 1.13 5.75 -1.04 -2.45 115.11 118.43 1oy0 h GLN 27 Ca 0.08 -0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.64 1oy0 h GLN 27 Cb 0.27 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.76 1oy0 h GLN 27 CO 0.01 0.52 0.11 0.00 -2.65 0.00 0.00 178.83 176.81 1oy0 h ARG 28 N -0.43 0.25 -0.44 1.69 3.08 -0.49 -0.98 114.38 117.05 1oy0 h ARG 28 Ca 0.00 -0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.10 1oy0 h ARG 28 Cb 0.51 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 1oy0 h ARG 28 CO 0.00 0.16 0.30 -1.49 -1.07 0.00 0.00 179.97 177.88 1oy0 h TRP 29 N 0.25 0.34 -0.32 3.04 6.55 -0.96 0.24 115.95 125.10 1oy0 h TRP 29 Ca 0.23 0.01 -0.11 0.00 0.95 0.00 0.00 58.89 59.98 1oy0 h TRP 29 Cb 0.30 -0.11 -0.01 0.00 -0.86 0.00 0.00 29.16 28.47 1oy0 h TRP 29 CO -0.21 0.18 -0.25 -0.22 -1.05 0.00 0.00 178.44 176.90 1oy0 h LYS 30 N 0.34 0.62 0.08 0.49 3.64 -0.70 0.39 116.57 121.44 1oy0 h LYS 30 Ca 0.19 -0.25 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1oy0 h LYS 30 Cb 0.33 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1oy0 h LYS 30 CO -0.04 0.82 -0.04 0.00 -2.27 0.00 0.00 179.45 177.91 1oy0 h ALA 31 N 1.18 -0.11 0.00 5.00 0.00 -0.17 -2.91 119.26 122.25 1oy0 h ALA 31 Ca 0.08 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1oy0 h ALA 31 Cb 0.72 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1oy0 h ALA 31 CO 0.05 -0.36 0.00 -0.25 0.00 0.00 0.00 179.25 178.69 1oy0 n ASP 32 N -4.96 0.00 -0.51 0.00 8.00 0.50 -4.86 116.55 114.72 1oy0 n ASP 32 Ca -0.08 -0.27 -0.06 0.00 0.71 0.00 0.00 54.79 55.08 1oy0 n ASP 32 Cb 0.22 -0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 1oy0 n ASP 32 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oy0 n GLY 33 N 0.40 0.78 3.61 0.44 0.00 -0.00 -4.99 105.19 105.42 1oy0 n GLY 33 Ca 0.12 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 1oy0 n GLY 33 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1oy0 s HIS 34 N -2.24 3.09 -0.43 1.61 5.04 0.12 -5.00 115.29 117.47 1oy0 s HIS 34 Ca 0.00 0.80 -0.25 0.00 -1.54 0.00 0.00 55.06 54.07 1oy0 s HIS 34 Cb 0.00 -3.62 0.02 0.00 0.04 0.00 0.00 32.58 29.02 1oy0 s HIS 34 CO 0.00 -0.80 0.92 0.15 -2.34 0.00 0.00 174.74 172.67 1oy0 s LYS 35 N 3.45 3.63 0.23 2.88 1.02 -1.26 -4.50 119.74 125.19 1oy0 s LYS 35 Ca 0.38 0.29 0.01 0.00 0.02 0.00 0.00 55.97 56.67 1oy0 s LYS 35 Cb -0.12 -3.88 -0.04 0.00 -0.52 0.00 0.00 37.83 33.27 1oy0 s LYS 35 CO 0.18 -1.13 0.40 1.67 -0.92 0.00 0.00 175.35 175.56 1oy0 s TRP 36 N 3.65 3.48 -0.11 3.18 1.48 -1.13 -4.97 118.94 124.52 1oy0 s TRP 36 Ca 0.37 0.25 -0.02 0.00 -1.06 0.00 0.00 56.10 55.64 1oy0 s TRP 36 Cb -0.11 -1.79 -0.03 0.00 -1.16 0.00 0.00 33.47 30.39 1oy0 s TRP 36 CO 0.24 0.36 -0.04 0.00 -4.06 0.00 0.00 176.95 173.44 1oy0 s ALA 37 N -1.96 3.03 -0.09 2.67 0.00 -1.26 -1.67 121.76 122.47 1oy0 s ALA 37 Ca 0.37 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.52 1oy0 s ALA 37 Cb -0.10 -1.42 -0.01 0.00 0.00 0.00 0.00 23.12 21.59 1oy0 s ALA 37 CO 0.30 0.41 -0.18 1.41 0.00 0.00 0.00 175.76 177.70 1oy0 s MET 38 N -0.27 2.92 0.05 0.00 0.00 0.17 -4.12 119.30 118.05 1oy0 s MET 38 Ca 0.04 -0.78 0.08 0.00 0.00 0.00 0.00 55.69 55.04 1oy0 s MET 38 Cb -0.13 -2.40 -0.03 0.00 0.00 0.00 0.00 34.83 32.28 1oy0 s MET 38 CO 0.02 0.34 -0.23 -1.17 0.00 0.00 0.00 175.02 173.98 1oy0 s LEU 39 N -0.01 2.19 0.36 4.11 2.96 -1.00 -2.64 118.68 124.65 1oy0 s LEU 39 Ca -0.06 -0.57 -0.23 0.00 -0.22 0.00 0.00 54.13 53.05 1oy0 s LEU 39 Cb -0.15 -1.10 -0.10 0.00 0.50 0.00 0.00 46.19 45.34 1oy0 s LEU 39 CO 0.05 0.19 0.92 0.28 -1.32 0.00 0.00 176.35 176.46 1oy0 s THR 40 N -0.84 4.35 -0.06 3.68 -1.32 -0.93 -1.43 115.64 119.09 1oy0 s THR 40 Ca 0.09 1.58 -0.13 0.00 -1.21 0.00 0.00 61.69 62.02 1oy0 s THR 40 Cb -0.09 -3.79 0.03 0.00 -1.51 0.00 0.00 72.50 67.13 1oy0 s THR 40 CO 0.02 -0.08 0.32 0.00 -2.21 0.00 0.00 174.62 172.67 1oy0 s ALA 41 N -1.88 -0.80 0.00 11.08 0.00 -0.60 -4.05 121.76 125.52 1oy0 s ALA 41 Ca 0.55 0.57 0.00 0.00 0.00 0.00 0.00 51.96 53.08 1oy0 s ALA 41 Cb -0.14 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.81 1oy0 s ALA 41 CO 0.18 -0.22 0.54 0.66 0.00 0.00 0.00 175.76 176.93 1oy0 n TYR 42 N 1.93 0.00 -3.78 0.00 4.01 -1.26 -3.89 117.16 114.17 1oy0 n TYR 42 Ca -0.18 -0.10 -0.09 0.00 -0.16 0.00 0.00 57.90 57.37 1oy0 n TYR 42 Cb 0.57 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 1oy0 n TYR 42 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 1oy0 s ASP 43 N -0.19 -0.26 0.11 7.72 -4.77 -1.26 -4.79 116.67 113.23 1oy0 s ASP 43 Ca 0.00 -0.53 -0.24 0.00 -3.30 0.00 0.00 52.55 48.48 1oy0 s ASP 43 Cb 0.00 0.62 -0.07 0.00 -1.09 0.00 0.00 42.92 42.37 1oy0 s ASP 43 CO 0.00 -1.13 1.67 0.22 0.70 0.00 0.00 175.17 176.63 1oy0 h TYR 44 N 2.14 -0.41 -0.89 2.11 3.20 -1.87 -1.79 116.97 119.46 1oy0 h TYR 44 Ca -0.26 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.61 1oy0 h TYR 44 Cb 1.26 0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.67 1oy0 h TYR 44 CO 0.37 -0.23 0.54 0.77 -1.64 0.00 0.00 178.16 177.97 1oy0 h SER 45 N -0.27 1.07 -0.03 -2.11 0.02 -1.96 -0.21 113.55 110.05 1oy0 h SER 45 Ca 0.05 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1oy0 h SER 45 Cb 0.33 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1oy0 h SER 45 CO -0.14 0.81 -0.00 0.74 -1.14 0.00 0.00 176.83 177.10 1oy0 h THR 46 N 1.23 1.27 -0.65 -2.27 2.02 -1.96 -2.60 112.91 109.95 1oy0 h THR 46 Ca 0.32 -0.82 0.06 0.00 0.77 0.00 0.00 66.41 66.74 1oy0 h THR 46 Cb -0.06 1.76 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 1oy0 h THR 46 CO -0.06 0.22 0.35 0.00 0.37 0.00 0.00 175.52 176.40 1oy0 h ALA 47 N 0.68 0.86 -0.70 6.16 0.00 -1.13 -1.15 119.26 123.98 1oy0 h ALA 47 Ca 0.01 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1oy0 h ALA 47 Cb 0.35 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 1oy0 h ALA 47 CO 0.00 0.02 0.34 -0.09 0.00 0.00 0.00 179.25 179.52 1oy0 h ARG 48 N 0.65 0.57 0.32 0.00 9.65 -0.76 0.16 114.38 124.97 1oy0 h ARG 48 Ca 0.29 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.12 1oy0 h ARG 48 Cb 0.19 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1oy0 h ARG 48 CO -0.19 0.38 -0.15 0.82 2.80 0.00 0.00 179.97 183.63 1oy0 h ILE 49 N 0.59 0.71 -0.28 1.20 2.04 -0.87 -1.50 117.51 119.39 1oy0 h ILE 49 Ca 0.34 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1oy0 h ILE 49 Cb 0.35 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1oy0 h ILE 49 CO -0.26 0.06 0.19 -0.26 0.00 0.00 0.00 178.15 177.88 1oy0 h PHE 50 N -0.60 0.36 0.09 1.37 0.05 -0.88 -0.73 116.94 116.60 1oy0 h PHE 50 Ca -0.04 0.01 -0.00 0.00 3.82 0.00 0.00 57.97 61.75 1oy0 h PHE 50 Cb 0.43 -0.12 0.00 0.00 2.00 0.00 0.00 35.95 38.27 1oy0 h PHE 50 CO -0.01 0.22 -0.04 0.22 -0.18 0.00 0.00 178.31 178.52 1oy0 h ASP 51 N 0.38 -0.10 0.00 2.17 3.58 -0.46 -0.76 116.42 121.24 1oy0 h ASP 51 Ca 0.10 -0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.27 1oy0 h ASP 51 Cb -0.04 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1oy0 h ASP 51 CO -0.02 0.24 0.00 -1.84 -2.88 0.00 0.00 179.24 174.74 1oy0 n GLU 52 N -4.99 0.78 0.00 0.28 0.28 -0.58 -1.17 120.64 115.24 1oy0 n GLU 52 Ca -0.08 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.00 1oy0 n GLU 52 Cb 0.20 -1.20 0.02 0.00 1.43 0.00 0.00 31.44 31.90 1oy0 n GLU 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1oy0 n ALA 53 N -0.70 2.96 -0.56 -1.84 0.00 -0.32 -4.99 120.51 115.06 1oy0 n ALA 53 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1oy0 n ALA 53 Cb 0.03 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 18.90 1oy0 n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oy0 n GLY 54 N 1.11 0.78 3.68 0.00 0.00 -0.32 -5.02 105.19 105.42 1oy0 n GLY 54 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1oy0 n GLY 54 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oy0 s ILE 55 N -3.12 2.67 0.14 -0.61 -1.09 -0.35 -4.89 121.20 113.97 1oy0 s ILE 55 Ca 0.00 0.07 -0.01 0.00 -2.23 0.00 0.00 60.65 58.48 1oy0 s ILE 55 Cb 0.00 -3.04 -0.17 0.00 -1.58 0.00 0.00 42.46 37.66 1oy0 s ILE 55 CO 0.00 -0.00 1.33 1.55 -1.23 0.00 0.00 174.94 176.58 1oy0 h PRO 56 N 9.04 0.30 -4.63 2.79 0.13 -1.89 -3.42 132.00 134.32 1oy0 h PRO 56 Ca -0.47 -0.34 -0.54 0.00 -0.87 0.00 0.00 66.00 63.79 1oy0 h PRO 56 Cb 1.22 0.10 -0.34 0.00 0.13 0.00 0.00 31.00 32.11 1oy0 h PRO 56 CO 0.95 1.04 -0.82 0.08 -0.23 0.00 0.00 178.00 179.02 1oy0 s VAL 57 N -3.19 1.25 -0.09 1.56 1.01 -1.26 -0.35 120.40 119.32 1oy0 s VAL 57 Ca -0.04 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1oy0 s VAL 57 Cb 0.09 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.32 1oy0 s VAL 57 CO 0.85 0.38 -0.17 -0.76 0.00 0.00 0.00 175.10 175.40 1oy0 s LEU 58 N 0.67 2.52 -0.31 3.92 1.43 -0.59 -2.36 118.68 123.96 1oy0 s LEU 58 Ca -0.14 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.56 1oy0 s LEU 58 Cb -0.16 -1.53 0.04 0.00 0.03 0.00 0.00 46.19 44.57 1oy0 s LEU 58 CO 0.04 0.22 0.04 -0.22 0.23 0.00 0.00 176.35 176.65 1oy0 s LEU 59 N 0.01 3.97 -1.29 1.79 2.96 -0.51 -0.16 118.68 125.44 1oy0 s LEU 59 Ca -0.06 -1.14 -0.16 0.00 -0.22 0.00 0.00 54.13 52.55 1oy0 s LEU 59 Cb -0.15 -1.77 0.10 0.00 0.50 0.00 0.00 46.19 44.87 1oy0 s LEU 59 CO 0.05 -0.26 1.70 0.52 -1.32 0.00 0.00 176.35 177.03 1oy0 n VAL 60 N 4.71 4.01 -0.95 1.68 0.31 -0.08 -1.55 118.33 126.46 1oy0 n VAL 60 Ca -0.13 -4.21 -0.30 0.00 -0.01 0.00 0.00 64.34 59.69 1oy0 n VAL 60 Cb 0.44 -2.41 0.17 0.00 -0.91 0.00 0.00 33.84 31.14 1oy0 n VAL 60 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1oy0 s GLY 61 N 3.58 1.61 0.00 2.92 0.00 -1.26 -2.70 107.32 111.47 1oy0 s GLY 61 Ca 0.50 0.04 0.29 0.00 0.00 0.00 0.00 44.72 45.55 1oy0 s GLY 61 CO 0.04 0.57 1.91 2.09 0.00 0.00 0.00 173.10 177.72 1oy0 n ASP 62 N -4.20 0.62 0.09 1.64 5.75 -1.26 -2.58 116.55 116.61 1oy0 n ASP 62 Ca 0.07 -0.90 0.10 0.00 -0.01 0.00 0.00 54.79 54.05 1oy0 n ASP 62 Cb 0.54 -0.03 0.43 0.00 -1.03 0.00 0.00 41.12 41.04 1oy0 n ASP 62 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1oy0 n SER 63 N -0.69 0.46 0.29 -1.12 3.41 -1.26 -1.57 113.62 113.13 1oy0 n SER 63 Ca 0.18 0.61 0.14 0.00 -0.26 0.00 0.00 58.87 59.54 1oy0 n SER 63 Cb 0.26 -0.71 0.85 0.00 -0.26 0.00 0.00 64.21 64.35 1oy0 n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oy0 h ALA 64 N 2.35 1.51 -0.94 7.33 0.00 -1.88 -1.46 119.26 126.17 1oy0 h ALA 64 Ca 0.00 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.06 1oy0 h ALA 64 Cb 0.33 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.01 1oy0 h ALA 64 CO 0.00 0.04 0.53 0.00 0.00 0.00 0.00 179.25 179.82 1oy0 h ALA 65 N 1.97 1.52 0.00 0.00 0.00 -1.55 0.64 119.26 121.84 1oy0 h ALA 65 Ca -0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1oy0 h ALA 65 Cb 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1oy0 h ALA 65 CO 0.00 -0.10 -0.04 -0.91 0.00 0.00 0.00 179.25 178.20 1oy0 h ASN 66 N 0.67 0.00 0.02 0.00 4.21 -1.37 0.28 115.58 119.38 1oy0 h ASN 66 Ca 0.54 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 58.05 1oy0 h ASN 66 Cb 0.85 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.05 1oy0 h ASN 66 CO -0.40 0.09 -0.01 -0.37 -1.29 0.00 0.00 177.43 175.45 1oy0 h VAL 67 N -0.14 0.82 0.01 2.81 -1.51 -1.51 -0.09 116.25 116.64 1oy0 h VAL 67 Ca 0.00 -0.05 -0.42 0.00 -1.23 0.00 0.00 66.70 65.00 1oy0 h VAL 67 Cb 0.04 1.03 -0.06 0.00 -2.13 0.00 0.00 31.29 30.16 1oy0 h VAL 67 CO 0.00 0.01 -2.37 0.52 -1.23 0.00 0.00 177.57 174.50 1oy0 n VAL 68 N -4.25 1.53 0.85 7.19 0.31 0.22 -4.71 118.33 119.47 1oy0 n VAL 68 Ca -0.03 -0.40 0.09 0.00 -0.01 0.00 0.00 64.34 63.99 1oy0 n VAL 68 Cb 0.10 -1.79 0.01 0.00 -0.91 0.00 0.00 33.84 31.25 1oy0 n VAL 68 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1oy0 n TYR 69 N -4.01 0.00 -1.19 3.52 4.02 -0.67 -4.99 117.16 113.84 1oy0 n TYR 69 Ca -0.49 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.34 1oy0 n TYR 69 Cb 0.90 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 40.19 1oy0 n TYR 69 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1oy0 n GLY 70 N 1.26 0.80 3.78 2.72 0.00 -0.05 -4.96 105.19 108.75 1oy0 n GLY 70 Ca 0.08 -0.80 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 1oy0 n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oy0 s TYR 71 N -2.21 3.60 -2.11 1.61 4.12 0.92 -4.92 117.35 118.37 1oy0 s TYR 71 Ca 0.00 1.75 0.16 0.00 0.02 0.00 0.00 57.07 59.00 1oy0 s TYR 71 Cb 0.00 -2.95 0.74 0.00 -1.52 0.00 0.00 41.96 38.22 1oy0 s TYR 71 CO 0.00 0.05 1.51 -0.40 0.02 0.00 0.00 175.55 176.73 1oy0 n ASP 72 N 0.39 0.89 -3.72 2.29 3.85 -1.26 -3.83 116.55 115.17 1oy0 n ASP 72 Ca 0.03 -1.67 -0.11 0.00 -0.71 0.00 0.00 54.79 52.32 1oy0 n ASP 72 Cb 0.50 -0.07 -0.05 0.00 -1.35 0.00 0.00 41.12 40.15 1oy0 n ASP 72 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1oy0 s THR 73 N -1.86 0.00 -1.81 2.12 2.01 -1.26 -5.04 115.64 109.81 1oy0 s THR 73 Ca 0.26 -1.51 0.19 0.00 0.31 0.00 0.00 61.69 60.94 1oy0 s THR 73 Cb 0.13 -2.41 0.49 0.00 0.01 0.00 0.00 72.50 70.71 1oy0 s THR 73 CO 0.20 0.00 1.41 0.35 -0.69 0.00 0.00 174.62 175.89 1oy0 n THR 74 N -0.44 0.84 -0.01 -0.82 -2.24 -1.26 -4.47 114.28 105.87 1oy0 n THR 74 Ca -0.01 -0.92 -0.17 0.00 -2.27 0.00 0.00 64.05 60.68 1oy0 n THR 74 Cb 0.62 0.65 -0.08 0.00 -2.10 0.00 0.00 70.33 69.42 1oy0 n THR 74 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1oy0 h VAL 75 N 3.69 1.32 0.00 2.28 2.07 -1.96 -3.36 116.25 120.30 1oy0 h VAL 75 Ca 0.00 -1.98 -0.15 0.00 0.82 0.00 0.00 66.70 65.40 1oy0 h VAL 75 Cb 0.90 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 32.82 1oy0 h VAL 75 CO 0.00 0.61 -0.71 1.55 0.02 0.00 0.00 177.57 179.04 1oy0 h PRO 76 N 0.32 0.00 -6.55 1.57 0.13 -1.96 -3.44 132.00 122.07 1oy0 h PRO 76 Ca -0.06 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.48 1oy0 h PRO 76 Cb 1.36 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.57 1oy0 h PRO 76 CO 0.15 0.71 0.57 1.51 -0.23 0.00 0.00 178.00 180.71 1oy0 n ILE 77 N -3.57 0.89 -3.94 -3.56 3.06 -1.26 -4.98 119.36 106.00 1oy0 n ILE 77 Ca -0.00 -0.22 -0.22 0.00 -2.50 0.00 0.00 62.75 59.81 1oy0 n ILE 77 Cb 0.72 -1.39 -0.04 0.00 0.54 0.00 0.00 39.64 39.47 1oy0 n ILE 77 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1oy0 s SER 78 N 0.28 5.27 0.26 9.51 1.04 -1.26 -4.53 113.70 124.27 1oy0 s SER 78 Ca 0.69 -0.46 -0.02 0.00 0.48 0.00 0.00 55.95 56.65 1oy0 s SER 78 Cb -0.68 -1.07 0.46 0.00 0.10 0.00 0.00 66.02 64.84 1oy0 s SER 78 CO 0.49 -0.25 1.81 0.40 0.98 0.00 0.00 173.24 176.68 1oy0 h ILE 79 N 1.37 0.89 0.00 -1.02 2.04 -1.95 -0.30 117.51 118.53 1oy0 h ILE 79 Ca -0.46 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 1oy0 h ILE 79 Cb 1.25 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1oy0 h ILE 79 CO 0.60 0.15 -0.02 0.44 0.00 0.00 0.00 178.15 179.32 1oy0 h ASP 80 N 0.83 0.00 0.35 1.72 3.32 -2.01 0.27 116.42 120.91 1oy0 h ASP 80 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 1oy0 h ASP 80 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1oy0 h ASP 80 CO -0.27 0.02 -0.13 -0.62 -1.72 0.00 0.00 179.24 176.52 1oy0 n GLU 81 N -3.13 0.70 -0.07 3.56 1.02 -0.14 -4.27 120.64 118.31 1oy0 n GLU 81 Ca -0.01 -0.26 -0.14 0.00 -0.02 0.00 0.00 57.16 56.73 1oy0 n GLU 81 Cb 0.24 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.12 1oy0 n GLU 81 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1oy0 n LEU 82 N -0.92 0.98 -0.26 -4.62 4.77 -0.10 -4.59 117.00 112.25 1oy0 n LEU 82 Ca 0.14 0.15 0.03 0.00 -0.03 0.00 0.00 56.01 56.31 1oy0 n LEU 82 Cb 0.29 -0.38 0.12 0.00 -2.33 0.00 0.00 43.42 41.12 1oy0 n LEU 82 CO 0.24 0.28 0.76 0.40 -1.33 0.00 0.00 177.39 177.74 1oy0 h ILE 83 N -0.45 0.28 -0.04 -0.08 2.04 -1.24 0.36 117.51 118.37 1oy0 h ILE 83 Ca -0.33 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 1oy0 h ILE 83 Cb 1.29 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1oy0 h ILE 83 CO -0.20 0.01 -0.10 1.55 0.00 0.00 0.00 178.15 179.41 1oy0 h PRO 84 N 0.04 0.06 -0.22 2.37 0.13 -1.84 -1.01 132.00 131.53 1oy0 h PRO 84 Ca 0.39 -0.01 -0.20 0.00 -0.87 0.00 0.00 66.00 65.31 1oy0 h PRO 84 Cb 0.65 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.77 1oy0 h PRO 84 CO -0.73 0.17 -0.65 -0.07 -0.23 0.00 0.00 178.00 176.48 1oy0 h LEU 85 N 0.06 0.91 -0.28 1.56 3.38 -0.66 -2.75 115.31 117.53 1oy0 h LEU 85 Ca 0.01 -0.53 0.02 0.00 0.09 0.00 0.00 57.88 57.46 1oy0 h LEU 85 Cb 0.22 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1oy0 h LEU 85 CO 0.01 1.33 0.15 0.58 0.09 0.00 0.00 178.44 180.60 1oy0 h VAL 86 N 0.58 1.00 -0.81 1.22 2.07 -0.10 -0.30 116.25 119.92 1oy0 h VAL 86 Ca -0.01 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.50 1oy0 h VAL 86 Cb 1.26 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 1oy0 h VAL 86 CO 0.14 0.06 0.45 0.03 0.02 0.00 0.00 177.57 178.27 1oy0 h ARG 87 N 0.31 0.73 -0.18 1.57 3.08 -1.15 0.36 114.38 119.09 1oy0 h ARG 87 Ca 0.11 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1oy0 h ARG 87 Cb 0.02 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1oy0 h ARG 87 CO -0.07 0.48 0.07 0.78 -1.07 0.00 0.00 179.97 180.16 1oy0 h GLY 88 N 0.75 0.28 1.05 0.04 0.00 -1.05 -1.87 103.07 102.27 1oy0 h GLY 88 Ca 0.40 -0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.54 1oy0 h GLY 88 CO -0.26 0.14 0.39 -2.08 0.00 0.00 0.00 176.54 174.74 1oy0 h VAL 89 N 0.13 1.26 -0.66 4.60 2.07 -0.16 -1.53 116.25 121.97 1oy0 h VAL 89 Ca 0.06 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 1oy0 h VAL 89 Cb 0.17 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 1oy0 h VAL 89 CO -0.00 0.32 0.40 0.58 0.02 0.00 0.00 177.57 178.88 1oy0 h VAL 90 N 1.21 1.19 -0.00 2.57 2.07 -0.11 -1.72 116.25 121.45 1oy0 h VAL 90 Ca 0.29 -0.41 -0.15 0.00 0.82 0.00 0.00 66.70 67.25 1oy0 h VAL 90 Cb 0.14 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1oy0 h VAL 90 CO -0.03 0.20 -0.71 0.03 0.02 0.00 0.00 177.57 177.07 1oy0 h ARG 91 N 0.91 0.00 0.00 1.57 3.08 -0.74 -3.29 114.38 115.91 1oy0 h ARG 91 Ca 0.24 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 1oy0 h ARG 91 Cb -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1oy0 h ARG 91 CO -0.04 0.71 -0.39 0.78 -1.07 0.00 0.00 179.97 179.96 1oy0 h GLY 92 N 2.12 0.00 -6.76 0.04 0.00 -0.56 -3.40 103.07 94.51 1oy0 h GLY 92 Ca -0.01 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.71 1oy0 h GLY 92 CO 0.09 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.97 1oy0 n ALA 93 N -2.13 3.40 0.30 3.60 0.00 -0.72 -2.58 120.51 122.39 1oy0 n ALA 93 Ca 0.02 -4.29 0.17 0.00 0.00 0.00 0.00 53.44 49.35 1oy0 n ALA 93 Cb 0.54 -0.95 0.96 0.00 0.00 0.00 0.00 19.45 20.00 1oy0 n ALA 93 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1oy0 h PRO 94 N 5.14 0.00 0.00 0.00 0.11 -1.79 -2.86 132.00 132.60 1oy0 h PRO 94 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1oy0 h PRO 94 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1oy0 h PRO 94 CO 0.67 0.03 -1.02 0.72 -0.21 0.00 0.00 178.00 178.19 1oy0 n HIS 95 N -3.48 0.00 -2.71 0.65 8.25 -1.26 -4.82 115.22 111.86 1oy0 n HIS 95 Ca -0.02 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.15 1oy0 n HIS 95 Cb 0.13 -0.09 -0.01 0.00 1.12 0.00 0.00 29.99 31.14 1oy0 n HIS 95 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1oy0 s ALA 96 N -2.72 3.39 -0.47 -1.41 0.00 -1.08 -0.65 121.76 118.82 1oy0 s ALA 96 Ca 0.03 -0.41 -0.20 0.00 0.00 0.00 0.00 51.96 51.38 1oy0 s ALA 96 Cb 0.12 -2.62 0.04 0.00 0.00 0.00 0.00 23.12 20.66 1oy0 s ALA 96 CO 0.69 -0.24 0.64 -1.17 0.00 0.00 0.00 175.76 175.68 1oy0 s LEU 97 N -4.45 4.68 -0.25 0.00 2.96 0.52 -4.69 118.68 117.44 1oy0 s LEU 97 Ca 0.48 -0.58 -0.21 0.00 -0.22 0.00 0.00 54.13 53.60 1oy0 s LEU 97 Cb -0.10 -2.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.97 1oy0 s LEU 97 CO 0.41 -0.83 0.68 -0.69 -1.32 0.00 0.00 176.35 174.59 1oy0 s VAL 98 N 2.76 4.94 -0.19 1.68 1.01 -1.26 -1.54 120.40 127.81 1oy0 s VAL 98 Ca 0.19 1.22 -0.05 0.00 0.00 0.00 0.00 61.98 63.34 1oy0 s VAL 98 Cb -0.16 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1oy0 s VAL 98 CO 0.16 -0.01 -0.00 -0.69 0.00 0.00 0.00 175.10 174.56 1oy0 s VAL 99 N 2.60 4.05 -0.23 2.92 1.01 0.78 -1.27 120.40 130.25 1oy0 s VAL 99 Ca 0.28 -0.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.87 1oy0 s VAL 99 Cb -0.15 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.36 1oy0 s VAL 99 CO 0.08 0.45 0.15 0.00 0.00 0.00 0.00 175.10 175.78 1oy0 s ALA 100 N 0.77 3.62 0.11 5.51 0.00 0.80 -0.91 121.76 131.66 1oy0 s ALA 100 Ca 0.00 -0.85 -0.28 0.00 0.00 0.00 0.00 51.96 50.83 1oy0 s ALA 100 Cb -0.14 -2.29 -0.06 0.00 0.00 0.00 0.00 23.12 20.62 1oy0 s ALA 100 CO 0.02 -0.13 0.88 0.34 0.00 0.00 0.00 175.76 176.87 1oy0 s ASP 101 N 0.92 7.42 -0.13 0.00 2.15 -1.10 -0.20 116.67 125.73 1oy0 s ASP 101 Ca 0.08 1.69 -0.26 0.00 0.43 0.00 0.00 52.55 54.49 1oy0 s ASP 101 Cb -0.13 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.93 1oy0 s ASP 101 CO 0.03 0.02 0.84 -0.76 -0.17 0.00 0.00 175.17 175.14 1oy0 s LEU 102 N -0.31 4.22 0.79 -1.34 1.43 -0.33 -4.81 118.68 118.33 1oy0 s LEU 102 Ca 0.42 1.26 -0.13 0.00 -1.03 0.00 0.00 54.13 54.65 1oy0 s LEU 102 Cb -0.23 -3.27 0.07 0.00 0.03 0.00 0.00 46.19 42.79 1oy0 s LEU 102 CO 0.28 -0.34 1.19 -2.84 0.23 0.00 0.00 176.35 174.87 1oy0 s PRO 103 N 1.81 1.79 0.24 1.29 0.02 -1.26 -4.81 135.00 134.07 1oy0 s PRO 103 Ca 0.40 1.71 -0.31 0.00 0.02 0.00 0.00 61.00 62.82 1oy0 s PRO 103 Cb -0.17 -1.80 -0.13 0.00 0.02 0.00 0.00 34.50 32.42 1oy0 s PRO 103 CO 0.15 -2.09 1.55 0.34 -0.33 0.00 0.00 177.00 176.62 1oy0 n PHE 104 N -3.19 2.51 0.00 6.54 7.35 -1.26 -2.15 117.46 127.26 1oy0 n PHE 104 Ca 0.13 0.29 0.00 0.00 -0.76 0.00 0.00 57.45 57.11 1oy0 n PHE 104 Cb 0.51 -2.55 0.00 0.00 0.35 0.00 0.00 39.48 37.78 1oy0 n PHE 104 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1oy0 n GLY 105 N 2.62 2.35 0.05 7.13 0.00 -1.26 -4.91 105.19 111.17 1oy0 n GLY 105 Ca 0.12 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.28 1oy0 n GLY 105 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1oy0 n SER 106 N 0.00 0.23 0.00 1.61 3.41 -0.92 -4.29 113.62 113.67 1oy0 n SER 106 Ca 0.00 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 1oy0 n SER 106 Cb 0.00 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1oy0 n SER 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oy0 n TYR 107 N -1.15 0.00 0.23 7.33 0.18 -1.26 -3.56 117.16 118.93 1oy0 n TYR 107 Ca 0.14 0.00 0.11 0.00 1.88 0.00 0.00 57.90 60.03 1oy0 n TYR 107 Cb 0.26 0.00 0.51 0.00 -0.38 0.00 0.00 39.34 39.73 1oy0 n TYR 107 CO 0.00 0.00 0.00 0.93 -2.08 0.00 0.00 176.86 175.71 1oy0 h GLU 108 N 0.00 0.00 0.00 -3.48 3.07 -1.94 -3.02 114.58 109.21 1oy0 h GLU 108 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 1oy0 h GLU 108 Cb 0.24 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 1oy0 h GLU 108 CO 0.00 0.19 -0.17 0.00 -1.40 0.00 0.00 179.01 177.63 1oy0 h ALA 109 N 1.81 1.36 0.00 3.43 0.00 -1.89 -3.48 119.26 120.49 1oy0 h ALA 109 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1oy0 h ALA 109 Cb 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1oy0 h ALA 109 CO 0.02 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.89 1oy0 n GLY 110 N -0.68 0.05 0.09 0.00 0.00 -1.14 -4.94 105.19 98.57 1oy0 n GLY 110 Ca -0.02 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.15 1oy0 n GLY 110 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1oy0 h PRO 111 N 4.76 0.01 -0.28 1.61 0.11 -1.87 -1.94 132.00 134.40 1oy0 h PRO 111 Ca 0.00 -0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.17 1oy0 h PRO 111 Cb 0.00 -0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.04 1oy0 h PRO 111 CO 0.00 0.01 -0.17 1.15 -0.21 0.00 0.00 178.00 178.78 1oy0 h THR 112 N 0.02 0.50 0.53 -1.15 2.02 -1.96 0.66 112.91 113.52 1oy0 h THR 112 Ca 0.08 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 1oy0 h THR 112 Cb 0.11 0.50 0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1oy0 h THR 112 CO -0.16 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.48 1oy0 h ALA 113 N 1.03 -0.71 -0.91 6.16 0.00 -1.86 -1.86 119.26 121.11 1oy0 h ALA 113 Ca 0.15 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 55.04 1oy0 h ALA 113 Cb 0.38 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 1oy0 h ALA 113 CO -0.37 -0.90 0.53 0.00 0.00 0.00 0.00 179.25 178.50 1oy0 h ALA 114 N -0.23 1.39 -0.40 0.00 0.00 -0.79 -0.82 119.26 118.40 1oy0 h ALA 114 Ca -0.07 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1oy0 h ALA 114 Cb 0.55 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1oy0 h ALA 114 CO 0.12 0.04 0.08 1.25 0.00 0.00 0.00 179.25 180.74 1oy0 h LEU 115 N 0.78 0.61 -0.40 0.00 5.85 0.52 -0.49 115.31 122.18 1oy0 h LEU 115 Ca 0.48 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1oy0 h LEU 115 Cb 0.59 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1oy0 h LEU 115 CO -0.32 0.70 0.23 0.00 -0.34 0.00 0.00 178.44 178.71 1oy0 h ALA 116 N 0.94 0.51 0.17 1.25 0.00 -0.46 -0.01 119.26 121.66 1oy0 h ALA 116 Ca 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1oy0 h ALA 116 Cb 0.34 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1oy0 h ALA 116 CO 0.00 0.03 -0.09 0.00 0.00 0.00 0.00 179.25 179.19 1oy0 h ALA 117 N 1.09 -0.24 -0.79 0.00 0.00 -1.02 -2.12 119.26 116.17 1oy0 h ALA 117 Ca 0.14 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1oy0 h ALA 117 Cb 0.04 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1oy0 h ALA 117 CO -0.02 -0.64 0.52 0.00 0.00 0.00 0.00 179.25 179.11 1oy0 h ALA 118 N 0.59 1.02 -0.33 0.00 0.00 -0.97 -1.58 119.26 117.99 1oy0 h ALA 118 Ca -0.02 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1oy0 h ALA 118 Cb 0.20 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1oy0 h ALA 118 CO 0.02 0.38 0.22 1.15 0.00 0.00 0.00 179.25 181.03 1oy0 h THR 119 N 1.04 1.04 -0.28 0.00 2.02 -0.75 -1.15 112.91 114.84 1oy0 h THR 119 Ca 0.30 -0.13 -0.08 0.00 0.77 0.00 0.00 66.41 67.28 1oy0 h THR 119 Cb -0.07 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1oy0 h THR 119 CO -0.08 0.07 -0.13 0.03 0.37 0.00 0.00 175.52 175.77 1oy0 h ARG 120 N 0.37 0.57 0.00 6.66 3.08 -0.62 -0.16 114.38 124.29 1oy0 h ARG 120 Ca 0.13 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1oy0 h ARG 120 Cb 0.06 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1oy0 h ARG 120 CO -0.03 0.82 -0.11 0.74 -1.07 0.00 0.00 179.97 180.32 1oy0 h PHE 121 N 0.31 0.00 0.00 3.04 -1.00 -0.79 0.97 116.94 119.47 1oy0 h PHE 121 Ca 0.06 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.79 1oy0 h PHE 121 Cb 0.64 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.20 1oy0 h PHE 121 CO 0.06 0.11 -0.52 -0.07 -1.61 0.00 0.00 178.31 176.28 1oy0 h LEU 122 N 0.00 0.00 -0.88 1.54 3.38 -1.15 -0.97 115.31 117.23 1oy0 h LEU 122 Ca -0.00 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 1oy0 h LEU 122 Cb 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1oy0 h LEU 122 CO 0.01 0.91 0.08 0.11 0.09 0.00 0.00 178.44 179.64 1oy0 h LYS 123 N -1.00 0.92 0.00 1.13 1.57 -1.07 -1.70 116.57 116.42 1oy0 h LYS 123 Ca -0.08 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.42 1oy0 h LYS 123 Cb 0.65 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1oy0 h LYS 123 CO -0.05 0.86 -1.00 -3.47 -0.57 0.00 0.00 179.45 175.21 1oy0 n ASP 124 N -4.23 1.90 0.25 0.86 -0.08 0.27 -4.52 116.55 111.00 1oy0 n ASP 124 Ca 0.04 0.42 0.09 0.00 -1.51 0.00 0.00 54.79 53.82 1oy0 n ASP 124 Cb 0.27 -0.79 0.63 0.00 2.34 0.00 0.00 41.12 43.57 1oy0 n ASP 124 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1oy0 h GLY 125 N -1.00 0.00 0.00 0.27 0.00 -0.99 -3.46 103.07 97.89 1oy0 h GLY 125 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1oy0 h GLY 125 CO -0.04 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.11 1oy0 n GLY 126 N -1.11 0.60 3.65 4.60 0.00 -0.47 -3.11 105.19 109.33 1oy0 n GLY 126 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 1oy0 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy0 s ALA 127 N -2.16 1.12 -0.12 4.61 0.00 -0.58 -4.96 121.76 119.67 1oy0 s ALA 127 Ca 0.00 0.36 0.19 0.00 0.00 0.00 0.00 51.96 52.50 1oy0 s ALA 127 Cb 0.00 -3.37 -0.28 0.00 0.00 0.00 0.00 23.12 19.47 1oy0 s ALA 127 CO 0.00 -2.88 0.24 0.72 0.00 0.00 0.00 175.76 173.84 1oy0 n HIS 128 N -4.30 0.00 -3.84 0.00 8.25 -0.39 -4.59 115.22 110.35 1oy0 n HIS 128 Ca 0.09 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.46 1oy0 n HIS 128 Cb 0.53 -0.75 -0.04 0.00 1.12 0.00 0.00 29.99 30.85 1oy0 n HIS 128 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1oy0 s ALA 129 N -2.89 -0.74 0.18 -1.41 0.00 -1.11 -4.36 121.76 111.43 1oy0 s ALA 129 Ca -0.09 -0.45 0.08 0.00 0.00 0.00 0.00 51.96 51.50 1oy0 s ALA 129 Cb 0.09 0.91 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 1oy0 s ALA 129 CO 0.83 -0.84 -0.16 0.14 0.00 0.00 0.00 175.76 175.73 1oy0 s VAL 130 N -3.92 1.71 -0.18 0.00 -7.23 -0.74 -0.14 120.40 109.89 1oy0 s VAL 130 Ca 0.13 -2.05 -0.02 0.00 -1.81 0.00 0.00 61.98 58.23 1oy0 s VAL 130 Cb -0.01 -1.91 -0.01 0.00 0.56 0.00 0.00 36.38 35.01 1oy0 s VAL 130 CO 0.02 -0.48 -0.08 -0.75 -0.31 0.00 0.00 175.10 173.49 1oy0 s LYS 131 N -3.24 3.38 -0.26 4.82 2.20 0.71 -0.50 119.74 126.85 1oy0 s LYS 131 Ca 0.18 -0.65 -0.02 0.00 -0.36 0.00 0.00 55.97 55.12 1oy0 s LYS 131 Cb -0.03 -2.84 0.03 0.00 -1.51 0.00 0.00 37.83 33.48 1oy0 s LYS 131 CO 0.06 -0.02 -0.04 -1.17 -0.36 0.00 0.00 175.35 173.82 1oy0 s LEU 132 N 0.98 3.37 -0.03 5.43 2.96 -0.77 -1.19 118.68 129.44 1oy0 s LEU 132 Ca -0.01 -0.91 -0.25 0.00 -0.22 0.00 0.00 54.13 52.73 1oy0 s LEU 132 Cb -0.15 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 1oy0 s LEU 132 CO -0.00 -0.15 0.79 -0.70 -1.32 0.00 0.00 176.35 174.96 1oy0 s GLU 133 N 1.33 4.48 0.00 1.98 2.12 -1.26 -3.02 118.70 124.33 1oy0 s GLU 133 Ca -0.00 1.06 0.00 0.00 0.36 0.00 0.00 54.97 56.38 1oy0 s GLU 133 Cb -0.17 -3.44 0.00 0.00 0.26 0.00 0.00 34.13 30.78 1oy0 s GLU 133 CO -0.03 0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.17 1oy0 n GLY 134 N 2.94 2.75 0.00 -1.50 0.00 -0.24 -4.96 105.19 104.17 1oy0 n GLY 134 Ca 0.01 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1oy0 n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oy0 n GLY 135 N -1.34 2.86 0.29 -0.02 0.00 -1.26 -4.42 105.19 101.30 1oy0 n GLY 135 Ca 0.00 -1.76 0.09 0.00 0.00 0.00 0.00 46.02 44.35 1oy0 n GLY 135 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1oy0 h GLU 136 N 0.00 0.15 0.00 1.61 5.08 -1.86 0.93 114.58 120.49 1oy0 h GLU 136 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1oy0 h GLU 136 Cb 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1oy0 h GLU 136 CO 0.00 0.10 0.49 0.07 -1.00 0.00 0.00 179.01 178.66 1oy0 h ARG 137 N 0.15 0.00 -0.20 2.33 0.11 -1.99 0.87 114.38 115.64 1oy0 h ARG 137 Ca 0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.56 1oy0 h ARG 137 Cb 0.91 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.99 1oy0 h ARG 137 CO -0.67 0.00 0.00 0.28 0.10 0.00 0.00 179.97 179.68 1oy0 n VAL 138 N -2.58 0.45 -0.22 0.08 0.31 0.32 -4.62 118.33 112.06 1oy0 n VAL 138 Ca -0.01 -0.73 -0.02 0.00 -0.01 0.00 0.00 64.34 63.57 1oy0 n VAL 138 Cb 0.52 0.93 0.09 0.00 -0.91 0.00 0.00 33.84 34.47 1oy0 n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1oy0 h ALA 139 N 2.61 0.87 -0.56 3.52 0.00 -0.87 -1.58 119.26 123.24 1oy0 h ALA 139 Ca 0.00 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1oy0 h ALA 139 Cb 0.67 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1oy0 h ALA 139 CO 0.00 0.04 0.24 1.49 0.00 0.00 0.00 179.25 181.02 1oy0 h GLU 140 N 0.67 0.43 -0.27 0.00 4.81 -1.82 0.87 114.58 119.28 1oy0 h GLU 140 Ca 0.29 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.48 1oy0 h GLU 140 Cb 0.17 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1oy0 h GLU 140 CO -0.18 0.29 0.10 1.96 -0.73 0.00 0.00 179.01 180.45 1oy0 h GLN 141 N 0.45 0.41 -0.93 1.92 7.50 -1.73 -1.74 115.11 120.99 1oy0 h GLN 141 Ca 0.27 -0.08 0.03 0.00 0.50 0.00 0.00 58.65 59.36 1oy0 h GLN 141 Cb 0.27 -0.06 -0.05 0.00 0.05 0.00 0.00 27.48 27.68 1oy0 h GLN 141 CO -0.24 0.46 0.61 0.82 -1.50 0.00 0.00 178.83 178.97 1oy0 h ILE 142 N 0.28 1.18 -0.19 2.54 2.04 -0.70 -2.12 117.51 120.53 1oy0 h ILE 142 Ca 0.09 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1oy0 h ILE 142 Cb 0.21 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 1oy0 h ILE 142 CO -0.01 0.22 0.10 0.00 0.00 0.00 0.00 178.15 178.46 1oy0 h ALA 143 N 1.37 0.25 0.12 1.87 0.00 -0.57 -0.87 119.26 121.43 1oy0 h ALA 143 Ca 0.36 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.20 1oy0 h ALA 143 Cb -0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1oy0 h ALA 143 CO -0.11 -0.20 -0.17 0.00 0.00 0.00 0.00 179.25 178.77 1oy0 h LEU 145 N -0.35 -0.25 -0.68 0.00 3.38 -1.34 -0.36 115.31 115.71 1oy0 h LEU 145 Ca 0.02 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.11 1oy0 h LEU 145 Cb 0.36 0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 1oy0 h LEU 145 CO -0.08 -0.14 0.31 0.74 0.09 0.00 0.00 178.44 179.36 1oy0 h THR 146 N -0.18 0.82 0.00 0.22 2.02 -1.00 0.17 112.91 114.95 1oy0 h THR 146 Ca 0.02 -0.18 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 1oy0 h THR 146 Cb 0.20 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1oy0 h THR 146 CO -0.06 0.10 -0.22 0.00 0.37 0.00 0.00 175.52 175.71 1oy0 h ALA 147 N 1.43 1.16 0.00 6.16 0.00 -0.40 -1.72 119.26 125.88 1oy0 h ALA 147 Ca 0.34 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1oy0 h ALA 147 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1oy0 h ALA 147 CO -0.28 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1oy0 n ALA 148 N -2.28 2.18 -0.13 0.00 0.00 0.47 -4.87 120.51 115.89 1oy0 n ALA 148 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1oy0 n ALA 148 Cb 0.36 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1oy0 n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oy0 n GLY 149 N 1.17 0.93 3.47 0.00 0.00 -0.65 -5.07 105.19 105.04 1oy0 n GLY 149 Ca 0.06 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1oy0 n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oy0 s ILE 150 N -2.00 4.86 0.13 -0.61 1.01 -0.40 -5.00 121.20 119.19 1oy0 s ILE 150 Ca 0.00 -0.35 -0.31 0.00 0.00 0.00 0.00 60.65 59.99 1oy0 s ILE 150 Cb 0.00 -3.49 -0.10 0.00 0.01 0.00 0.00 42.46 38.88 1oy0 s ILE 150 CO 0.00 0.03 1.75 -2.84 0.00 0.00 0.00 174.94 173.88 1oy0 s PRO 151 N 1.65 4.15 -0.12 2.79 0.02 -1.26 -3.47 135.00 138.77 1oy0 s PRO 151 Ca 0.05 2.52 0.03 0.00 0.02 0.00 0.00 61.00 63.62 1oy0 s PRO 151 Cb -0.17 -3.44 0.00 0.00 0.02 0.00 0.00 34.50 30.90 1oy0 s PRO 151 CO 0.08 -0.78 -0.21 0.08 -0.33 0.00 0.00 177.00 175.84 1oy0 s VAL 152 N 2.24 2.26 -0.27 3.83 1.01 -1.26 -1.79 120.40 126.42 1oy0 s VAL 152 Ca 0.77 -0.93 -0.10 0.00 0.00 0.00 0.00 61.98 61.71 1oy0 s VAL 152 Cb -0.45 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 1oy0 s VAL 152 CO 0.34 0.55 0.17 -0.32 0.00 0.00 0.00 175.10 175.84 1oy0 s MET 153 N 0.53 3.92 0.79 2.72 1.75 0.34 -1.41 119.30 127.94 1oy0 s MET 153 Ca -0.13 -0.34 -0.11 0.00 -1.25 0.00 0.00 55.69 53.86 1oy0 s MET 153 Cb -0.17 -3.60 0.07 0.00 2.84 0.00 0.00 34.83 33.98 1oy0 s MET 153 CO 0.05 -0.16 1.15 0.00 -0.65 0.00 0.00 175.02 175.41 1oy0 s ALA 154 N 1.67 2.74 -0.26 4.11 0.00 0.09 -1.84 121.76 128.28 1oy0 s ALA 154 Ca 0.07 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.32 1oy0 s ALA 154 Cb -0.16 -2.90 0.14 0.00 0.00 0.00 0.00 23.12 20.21 1oy0 s ALA 154 CO 0.09 -1.60 0.40 -1.58 0.00 0.00 0.00 175.76 173.08 1oy0 s HIS 155 N -3.52 -0.93 0.28 0.00 5.04 -1.17 -0.36 115.29 114.63 1oy0 s HIS 155 Ca 0.62 0.84 0.12 0.00 -1.54 0.00 0.00 55.06 55.10 1oy0 s HIS 155 Cb -0.11 0.05 -0.05 0.00 0.04 0.00 0.00 32.58 32.51 1oy0 s HIS 155 CO 0.48 -0.77 -0.20 0.96 -2.34 0.00 0.00 174.74 172.87 1oy0 s ILE 156 N 2.58 2.47 0.08 0.89 -4.36 0.32 -1.08 121.20 122.09 1oy0 s ILE 156 Ca 0.13 -2.40 0.02 0.00 -0.26 0.00 0.00 60.65 58.14 1oy0 s ILE 156 Cb -0.15 -2.29 -0.01 0.00 1.25 0.00 0.00 42.46 41.26 1oy0 s ILE 156 CO -0.18 -0.40 0.06 0.61 0.24 0.00 0.00 174.94 175.27 1oy0 n GLY 157 N -0.60 3.79 2.98 6.27 0.00 -1.26 -2.29 105.19 114.08 1oy0 n GLY 157 Ca -0.05 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 43.93 1oy0 n GLY 157 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1oy0 s PHE 158 N -2.25 2.08 -0.38 1.61 5.36 -1.25 -4.57 117.98 118.57 1oy0 s PHE 158 Ca 0.09 -1.23 0.02 0.00 -0.96 0.00 0.00 56.93 54.85 1oy0 s PHE 158 Cb 0.00 -1.52 0.11 0.00 -0.34 0.00 0.00 43.02 41.28 1oy0 s PHE 158 CO 0.06 -0.66 0.14 0.95 -1.46 0.00 0.00 175.22 174.26 1oy0 s THR 159 N 1.51 1.68 0.29 0.12 -4.23 -1.26 -4.92 115.64 108.84 1oy0 s THR 159 Ca 0.03 -2.27 -0.27 0.00 -1.18 0.00 0.00 61.69 58.01 1oy0 s THR 159 Cb -0.14 -2.22 -0.15 0.00 1.34 0.00 0.00 72.50 71.33 1oy0 s THR 159 CO -0.09 -0.73 0.69 -2.65 -0.54 0.00 0.00 174.62 171.29 1oy0 n PRO 160 N 4.08 0.62 0.00 3.99 -0.02 -1.26 -4.72 135.00 137.69 1oy0 n PRO 160 Ca 0.03 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1oy0 n PRO 160 Cb 0.39 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1oy0 n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oy0 n GLY 175 N 1.68 1.64 0.34 -1.23 0.00 -1.26 -5.03 105.19 101.34 1oy0 n GLY 175 Ca 0.13 0.19 0.17 0.00 0.00 0.00 0.00 46.02 46.52 1oy0 n GLY 175 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1oy0 h ASP 176 N 0.00 0.00 -0.37 1.61 3.32 -2.01 -1.76 116.42 117.21 1oy0 h ASP 176 Ca 0.00 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.13 1oy0 h ASP 176 Cb 0.00 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 1oy0 h ASP 176 CO 0.00 0.00 -0.11 0.00 -1.72 0.00 0.00 179.24 177.41 1oy0 h ALA 177 N 1.76 0.22 -0.38 3.45 0.00 -1.96 0.27 119.26 122.62 1oy0 h ALA 177 Ca 0.13 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.25 1oy0 h ALA 177 Cb 0.63 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1oy0 h ALA 177 CO -0.00 -0.47 0.26 0.00 0.00 0.00 0.00 179.25 179.04 1oy0 h ALA 178 N 1.33 2.02 0.09 0.00 0.00 -1.69 -0.56 119.26 120.46 1oy0 h ALA 178 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1oy0 h ALA 178 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1oy0 h ALA 178 CO -0.40 -0.09 -0.04 0.93 0.00 0.00 0.00 179.25 179.65 1oy0 h GLU 179 N 0.27 -0.12 -0.56 0.00 5.08 -1.04 -2.31 114.58 115.90 1oy0 h GLU 179 Ca 0.17 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1oy0 h GLU 179 Cb 0.33 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1oy0 h GLU 179 CO -0.03 0.15 0.34 0.37 -1.00 0.00 0.00 179.01 178.83 1oy0 h GLN 180 N -0.38 0.65 -0.59 2.33 5.75 -0.37 0.17 115.11 122.68 1oy0 h GLN 180 Ca -0.01 -0.04 0.09 0.00 -0.15 0.00 0.00 58.65 58.54 1oy0 h GLN 180 Cb 0.32 -0.15 -0.07 0.00 1.07 0.00 0.00 27.48 28.65 1oy0 h GLN 180 CO 0.02 0.43 0.22 1.15 -2.65 0.00 0.00 178.83 178.00 1oy0 h THR 181 N 0.67 0.78 -0.11 2.39 2.02 -1.10 0.44 112.91 118.01 1oy0 h THR 181 Ca 0.22 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 1oy0 h THR 181 Cb 0.02 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1oy0 h THR 181 CO -0.10 0.07 0.05 0.40 0.37 0.00 0.00 175.52 176.32 1oy0 h ILE 182 N 0.40 1.12 -0.70 3.11 2.04 -0.72 0.10 117.51 122.86 1oy0 h ILE 182 Ca 0.29 -0.34 0.07 0.00 1.00 0.00 0.00 64.86 65.88 1oy0 h ILE 182 Cb 0.35 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.52 1oy0 h ILE 182 CO -0.29 0.10 0.39 0.00 0.00 0.00 0.00 178.15 178.35 1oy0 h ALA 183 N 0.92 0.96 -0.22 1.87 0.00 0.26 0.06 119.26 123.11 1oy0 h ALA 183 Ca 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1oy0 h ALA 183 Cb 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1oy0 h ALA 183 CO -0.00 0.05 0.07 -0.44 0.00 0.00 0.00 179.25 178.92 1oy0 h ASP 184 N 0.70 0.32 -0.76 0.00 3.32 0.22 0.16 116.42 120.38 1oy0 h ASP 184 Ca 0.32 -0.21 0.08 0.00 0.02 0.00 0.00 57.03 57.24 1oy0 h ASP 184 Cb 0.24 -0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 1oy0 h ASP 184 CO -0.20 0.45 0.43 0.00 -1.72 0.00 0.00 179.24 178.19 1oy0 h ALA 185 N 0.89 1.05 0.35 3.45 0.00 -0.17 0.19 119.26 125.02 1oy0 h ALA 185 Ca 0.07 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1oy0 h ALA 185 Cb 0.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1oy0 h ALA 185 CO -0.00 0.07 -0.17 0.82 0.00 0.00 0.00 179.25 179.98 1oy0 h ILE 186 N 0.74 0.58 -0.41 0.00 2.04 -0.72 -2.69 117.51 117.05 1oy0 h ILE 186 Ca 0.36 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.66 1oy0 h ILE 186 Cb 0.29 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 1oy0 h ILE 186 CO -0.22 0.11 0.05 0.00 0.00 0.00 0.00 178.15 178.08 1oy0 h ALA 187 N -0.41 0.42 -0.70 1.87 0.00 -0.47 0.21 119.26 120.17 1oy0 h ALA 187 Ca -0.05 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1oy0 h ALA 187 Cb 0.53 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1oy0 h ALA 187 CO 0.08 -0.35 0.41 0.28 0.00 0.00 0.00 179.25 179.66 1oy0 h VAL 188 N 0.16 1.00 -0.32 0.00 2.07 -0.69 0.43 116.25 118.91 1oy0 h VAL 188 Ca 0.20 -0.26 -0.18 0.00 0.82 0.00 0.00 66.70 67.29 1oy0 h VAL 188 Cb 0.27 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1oy0 h VAL 188 CO -0.30 0.14 -0.49 0.00 0.02 0.00 0.00 177.57 176.94 1oy0 h ALA 189 N 1.35 0.52 -0.88 1.67 0.00 -1.08 -2.82 119.26 118.02 1oy0 h ALA 189 Ca 0.31 -0.49 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1oy0 h ALA 189 Cb 0.15 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1oy0 h ALA 189 CO -0.17 0.68 0.58 0.93 0.00 0.00 0.00 179.25 181.28 1oy0 h GLU 190 N 0.69 1.10 0.00 0.00 4.39 -0.41 -1.40 114.58 118.96 1oy0 h GLU 190 Ca 0.03 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1oy0 h GLU 190 Cb 1.09 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.49 1oy0 h GLU 190 CO 0.11 0.73 -0.03 0.00 -1.16 0.00 0.00 179.01 178.66 1oy0 h ALA 191 N 1.47 1.14 0.00 3.43 0.00 -0.67 -3.46 119.26 121.17 1oy0 h ALA 191 Ca 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1oy0 h ALA 191 Cb -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1oy0 h ALA 191 CO -0.09 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1oy0 n GLY 192 N -0.80 1.00 3.61 0.00 0.00 -0.53 -3.48 105.19 105.00 1oy0 n GLY 192 Ca -0.02 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.51 1oy0 n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy0 n ALA 193 N 0.00 -0.19 1.23 4.61 0.00 -1.16 -4.75 120.51 120.25 1oy0 n ALA 193 Ca 0.00 0.47 0.14 0.00 0.00 0.00 0.00 53.44 54.06 1oy0 n ALA 193 Cb 0.00 -2.14 0.66 0.00 0.00 0.00 0.00 19.45 17.97 1oy0 n ALA 193 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1oy0 n PHE 194 N 2.27 0.00 -3.64 0.00 1.16 -0.50 -4.80 117.46 111.96 1oy0 n PHE 194 Ca 0.16 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.72 1oy0 n PHE 194 Cb 0.24 -0.36 -0.01 0.00 -1.61 0.00 0.00 39.48 37.74 1oy0 n PHE 194 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1oy0 s ALA 195 N -2.76 -1.97 -0.06 1.98 0.00 -1.26 -4.21 121.76 113.49 1oy0 s ALA 195 Ca 0.22 0.72 -0.06 0.00 0.00 0.00 0.00 51.96 52.84 1oy0 s ALA 195 Cb 0.20 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.71 1oy0 s ALA 195 CO 0.50 -0.92 0.17 0.54 0.00 0.00 0.00 175.76 176.05 1oy0 s VAL 196 N -2.80 -0.00 -0.16 0.00 0.11 -0.70 -0.74 120.40 116.12 1oy0 s VAL 196 Ca 0.11 0.01 -0.15 0.00 -2.93 0.00 0.00 61.98 59.03 1oy0 s VAL 196 Cb 0.01 -0.25 -0.05 0.00 -1.53 0.00 0.00 36.38 34.57 1oy0 s VAL 196 CO -0.03 0.01 0.33 -0.69 -3.33 0.00 0.00 175.10 171.39 1oy0 s VAL 197 N 0.19 5.28 -0.36 2.04 1.01 0.51 0.17 120.40 129.23 1oy0 s VAL 197 Ca -0.01 0.62 -0.05 0.00 0.00 0.00 0.00 61.98 62.54 1oy0 s VAL 197 Cb -0.02 -3.67 0.06 0.00 0.00 0.00 0.00 36.38 32.76 1oy0 s VAL 197 CO -0.00 0.37 0.14 -0.04 0.00 0.00 0.00 175.10 175.57 1oy0 s MET 198 N 0.56 2.46 -0.18 2.72 -1.94 0.24 -0.52 119.30 122.64 1oy0 s MET 198 Ca 0.18 -1.39 -0.04 0.00 -1.71 0.00 0.00 55.69 52.74 1oy0 s MET 198 Cb -0.13 -3.51 -0.02 0.00 2.01 0.00 0.00 34.83 33.18 1oy0 s MET 198 CO 0.05 -0.81 -0.04 -2.00 -0.01 0.00 0.00 175.02 172.21 1oy0 s GLU 199 N 1.33 3.54 -1.26 2.03 2.12 -0.97 -2.57 118.70 122.92 1oy0 s GLU 199 Ca 0.01 -0.57 -0.04 0.00 0.36 0.00 0.00 54.97 54.73 1oy0 s GLU 199 Cb -0.21 -2.95 0.00 0.00 0.26 0.00 0.00 34.13 31.24 1oy0 s GLU 199 CO 0.01 0.06 1.08 -1.33 -0.54 0.00 0.00 175.26 174.54 1oy0 n MET 200 N 4.05 -7.19 -4.37 4.30 2.81 -0.99 -3.93 117.12 111.79 1oy0 n MET 200 Ca -0.18 0.84 -0.34 0.00 -1.81 0.00 0.00 57.70 56.22 1oy0 n MET 200 Cb 0.52 -5.88 -0.13 0.00 -0.71 0.00 0.00 33.22 27.03 1oy0 n MET 200 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1oy0 s VAL 201 N -3.34 3.78 -0.31 2.03 1.01 -1.01 -4.04 120.40 118.51 1oy0 s VAL 201 Ca 0.24 -0.39 -0.41 0.00 0.00 0.00 0.00 61.98 61.42 1oy0 s VAL 201 Cb -0.11 -2.66 -0.16 0.00 0.00 0.00 0.00 36.38 33.45 1oy0 s VAL 201 CO 0.73 0.48 1.75 -2.65 0.00 0.00 0.00 175.10 175.41 1oy0 n PRO 202 N 3.71 1.03 -0.32 2.72 -0.02 -1.26 -4.21 135.00 136.64 1oy0 n PRO 202 Ca -0.17 0.38 0.29 0.00 -2.02 0.00 0.00 63.50 61.97 1oy0 n PRO 202 Cb 0.52 -2.05 0.54 0.00 -0.02 0.00 0.00 33.50 32.49 1oy0 n PRO 202 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oy0 h ALA 203 N 7.14 2.03 0.68 3.55 0.00 -1.89 0.14 119.26 130.90 1oy0 h ALA 203 Ca -0.46 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1oy0 h ALA 203 Cb 1.32 0.32 0.01 0.00 0.00 0.00 0.00 17.79 19.44 1oy0 h ALA 203 CO 0.97 -0.84 -0.33 0.93 0.00 0.00 0.00 179.25 179.98 1oy0 h GLU 204 N 0.07 -0.88 -0.64 0.00 4.39 -1.87 0.14 114.58 115.79 1oy0 h GLU 204 Ca 0.80 0.06 0.04 0.00 0.34 0.00 0.00 59.36 60.61 1oy0 h GLU 204 Cb 2.03 0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 30.83 1oy0 h GLU 204 CO -0.75 -0.58 0.37 1.25 -1.16 0.00 0.00 179.01 178.14 1oy0 h LEU 205 N -0.94 0.58 0.06 1.33 5.85 -1.30 -2.34 115.31 118.55 1oy0 h LEU 205 Ca -0.09 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.66 1oy0 h LEU 205 Cb 0.71 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1oy0 h LEU 205 CO 0.15 0.39 -0.17 0.00 -0.34 0.00 0.00 178.44 178.47 1oy0 h ALA 206 N 1.31 -0.25 -0.65 1.25 0.00 -0.67 -1.33 119.26 118.92 1oy0 h ALA 206 Ca 0.28 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.29 1oy0 h ALA 206 Cb 0.11 0.28 -0.12 0.00 0.00 0.00 0.00 17.79 18.05 1oy0 h ALA 206 CO -0.15 -0.68 -0.26 1.15 0.00 0.00 0.00 179.25 179.31 1oy0 h THR 207 N -0.31 0.22 0.97 0.00 2.02 -0.20 0.20 112.91 115.82 1oy0 h THR 207 Ca 0.04 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 1oy0 h THR 207 Cb 0.34 0.22 0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1oy0 h THR 207 CO -0.12 0.00 -0.47 1.56 0.37 0.00 0.00 175.52 176.86 1oy0 h GLN 208 N -0.08 -1.26 -0.86 6.66 4.20 -1.18 -1.79 115.11 120.80 1oy0 h GLN 208 Ca 0.29 0.09 0.22 0.00 0.06 0.00 0.00 58.65 59.30 1oy0 h GLN 208 Cb 0.54 0.29 -0.14 0.00 0.30 0.00 0.00 27.48 28.47 1oy0 h GLN 208 CO -0.71 -0.84 0.23 0.82 -0.67 0.00 0.00 178.83 177.66 1oy0 h ILE 209 N -1.33 0.35 -0.43 2.54 2.04 -0.64 0.69 117.51 120.74 1oy0 h ILE 209 Ca -0.13 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 65.69 1oy0 h ILE 209 Cb 1.00 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 1oy0 h ILE 209 CO 0.22 0.04 0.20 0.74 0.00 0.00 0.00 178.15 179.35 1oy0 h THR 210 N 0.22 0.94 0.00 -0.27 2.02 -0.39 0.24 112.91 115.67 1oy0 h THR 210 Ca 0.53 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.47 1oy0 h THR 210 Cb 1.04 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1oy0 h THR 210 CO -0.63 0.07 -0.51 1.23 0.37 0.00 0.00 175.52 176.05 1oy0 h GLY 211 N 0.40 0.00 1.89 2.16 0.00 0.78 -3.20 103.07 105.10 1oy0 h GLY 211 Ca 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.47 1oy0 h GLY 211 CO -0.15 0.00 -0.30 1.70 0.00 0.00 0.00 176.54 177.79 1oy0 h LYS 212 N 0.00 0.00 -6.35 4.80 3.64 0.11 -3.46 116.57 115.31 1oy0 h LYS 212 Ca -0.01 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.83 1oy0 h LYS 212 Cb 0.96 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 1oy0 h LYS 212 CO 0.07 0.19 -0.19 -0.51 -2.27 0.00 0.00 179.45 176.73 1oy0 s LEU 213 N -6.23 4.18 0.06 5.20 1.43 -0.02 -4.99 118.68 118.32 1oy0 s LEU 213 Ca 0.05 0.75 0.11 0.00 -1.03 0.00 0.00 54.13 54.01 1oy0 s LEU 213 Cb 0.06 -3.51 -0.19 0.00 0.03 0.00 0.00 46.19 42.58 1oy0 s LEU 213 CO 0.71 -0.05 1.00 0.74 0.23 0.00 0.00 176.35 178.98 1oy0 h THR 214 N 1.87 1.17 -3.53 5.49 2.02 -1.89 -3.46 112.91 114.58 1oy0 h THR 214 Ca -0.47 -2.89 -0.50 0.00 0.77 0.00 0.00 66.41 63.32 1oy0 h THR 214 Cb 1.17 2.56 -0.00 0.00 -1.74 0.00 0.00 68.15 70.14 1oy0 h THR 214 CO 0.70 0.67 0.03 0.27 0.37 0.00 0.00 175.52 177.55 1oy0 s ILE 215 N -2.71 4.86 0.55 3.11 -4.36 -1.26 -5.03 121.20 116.37 1oy0 s ILE 215 Ca -0.01 0.44 -0.21 0.00 -0.26 0.00 0.00 60.65 60.61 1oy0 s ILE 215 Cb 0.09 -3.72 -0.04 0.00 1.25 0.00 0.00 42.46 40.03 1oy0 s ILE 215 CO 0.81 -0.43 1.33 -2.84 0.24 0.00 0.00 174.94 174.06 1oy0 s PRO 216 N -3.69 3.10 -0.14 0.37 0.02 -1.26 -4.85 135.00 128.55 1oy0 s PRO 216 Ca 0.49 2.17 -0.00 0.00 0.02 0.00 0.00 61.00 63.67 1oy0 s PRO 216 Cb -0.10 -2.20 -0.01 0.00 0.02 0.00 0.00 34.50 32.20 1oy0 s PRO 216 CO 0.30 -1.20 -0.13 0.95 -0.33 0.00 0.00 177.00 176.59 1oy0 s THR 217 N -1.34 3.02 -0.25 0.99 -4.23 -1.26 -1.71 115.64 110.85 1oy0 s THR 217 Ca 0.73 -0.67 -0.05 0.00 -1.18 0.00 0.00 61.69 60.52 1oy0 s THR 217 Cb -0.39 -2.27 -0.00 0.00 1.34 0.00 0.00 72.50 71.18 1oy0 s THR 217 CO 0.45 0.52 0.02 -0.69 -0.54 0.00 0.00 174.62 174.38 1oy0 s VAL 218 N 0.49 3.67 0.18 2.29 1.01 0.13 -1.20 120.40 126.95 1oy0 s VAL 218 Ca -0.09 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.35 1oy0 s VAL 218 Cb -0.16 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 1oy0 s VAL 218 CO 0.04 0.26 0.21 -0.83 0.00 0.00 0.00 175.10 174.78 1oy0 s GLY 219 N 1.49 1.63 -0.28 4.51 0.00 0.04 -0.60 107.32 114.11 1oy0 s GLY 219 Ca 0.04 -1.19 0.01 0.00 0.00 0.00 0.00 44.72 43.58 1oy0 s GLY 219 CO -0.00 -1.20 0.37 -1.50 0.00 0.00 0.00 173.10 170.77 1oy0 s ILE 220 N -1.82 -0.56 -0.68 0.90 2.07 -1.06 -0.65 121.20 119.40 1oy0 s ILE 220 Ca 0.32 -0.32 -0.03 0.00 -1.41 0.00 0.00 60.65 59.21 1oy0 s ILE 220 Cb -0.10 -0.96 0.00 0.00 0.13 0.00 0.00 42.46 41.53 1oy0 s ILE 220 CO 0.26 -0.32 0.38 0.61 -1.91 0.00 0.00 174.94 173.96 1oy0 n GLY 221 N 5.34 0.18 0.02 1.50 0.00 -1.26 -2.35 105.19 108.62 1oy0 n GLY 221 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1oy0 n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy0 n ALA 222 N -3.01 2.38 0.00 4.61 0.00 -1.26 -2.41 120.51 120.82 1oy0 n ALA 222 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1oy0 n ALA 222 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1oy0 n ALA 222 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oy0 n GLY 223 N 0.34 0.97 0.05 0.00 0.00 -1.26 -3.71 105.19 101.57 1oy0 n GLY 223 Ca 0.00 -2.09 0.13 0.00 0.00 0.00 0.00 46.02 44.06 1oy0 n GLY 223 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oy0 n PRO 224 N 0.62 0.13 -2.32 1.61 -0.04 -1.26 -4.49 135.00 129.26 1oy0 n PRO 224 Ca 0.00 0.09 -0.42 0.00 -0.04 0.00 0.00 63.50 63.13 1oy0 n PRO 224 Cb 0.00 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1oy0 n PRO 224 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1oy0 n ASN 225 N -1.86 6.43 -3.96 3.54 3.02 -1.26 -4.88 115.26 116.29 1oy0 n ASN 225 Ca 0.06 -3.20 -0.13 0.00 -0.03 0.00 0.00 54.58 51.28 1oy0 n ASN 225 Cb 0.39 -1.39 -0.13 0.00 -0.61 0.00 0.00 39.78 38.04 1oy0 n ASN 225 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1oy0 h ASP 227 N 5.49 0.00 -5.04 0.00 3.32 -1.50 -3.44 116.42 115.25 1oy0 h ASP 227 Ca -0.29 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.79 1oy0 h ASP 227 Cb 1.20 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.68 1oy0 h ASP 227 CO 0.47 0.00 0.16 -0.83 -1.72 0.00 0.00 179.24 177.32 1oy0 s GLY 228 N -3.99 -0.08 0.13 2.75 0.00 -0.52 -2.84 107.32 102.77 1oy0 s GLY 228 Ca -0.04 -0.26 0.08 0.00 0.00 0.00 0.00 44.72 44.49 1oy0 s GLY 228 CO 0.40 -0.14 -0.18 1.20 0.00 0.00 0.00 173.10 174.37 1oy0 s GLN 229 N -3.90 1.16 -0.02 2.90 -1.52 -0.67 -0.78 119.66 116.83 1oy0 s GLN 229 Ca 0.11 -1.27 -0.01 0.00 -1.95 0.00 0.00 55.36 52.23 1oy0 s GLN 229 Cb -0.04 -1.26 0.01 0.00 -0.22 0.00 0.00 33.01 31.50 1oy0 s GLN 229 CO 0.03 0.27 0.04 0.54 -0.25 0.00 0.00 175.29 175.92 1oy0 s VAL 230 N -1.73 -0.01 0.03 1.09 0.11 0.18 0.44 120.40 120.51 1oy0 s VAL 230 Ca 0.11 0.04 -0.04 0.00 -2.93 0.00 0.00 61.98 59.15 1oy0 s VAL 230 Cb -0.07 -0.07 -0.02 0.00 -1.53 0.00 0.00 36.38 34.69 1oy0 s VAL 230 CO 0.05 0.01 0.05 -0.76 -3.33 0.00 0.00 175.10 171.12 1oy0 s LEU 231 N 0.20 1.98 -0.26 2.54 1.43 -1.08 -4.40 118.68 119.09 1oy0 s LEU 231 Ca -0.02 -0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 1oy0 s LEU 231 Cb -0.02 0.42 0.00 0.00 0.03 0.00 0.00 46.19 46.62 1oy0 s LEU 231 CO -0.01 -0.44 1.16 -0.69 0.23 0.00 0.00 176.35 176.61 1oy0 s VAL 232 N -2.24 4.41 0.52 -1.59 1.01 -1.26 -2.19 120.40 119.06 1oy0 s VAL 232 Ca -0.08 1.66 0.31 0.00 0.00 0.00 0.00 61.98 63.87 1oy0 s VAL 232 Cb -0.04 -4.24 0.49 0.00 0.00 0.00 0.00 36.38 32.60 1oy0 s VAL 232 CO -0.03 -0.33 1.86 4.11 0.00 0.00 0.00 175.10 180.70 1oy0 h TRP 233 N 8.25 0.07 -0.91 5.22 5.08 -1.93 0.14 115.95 131.88 1oy0 h TRP 233 Ca -0.23 0.00 0.03 0.00 1.08 0.00 0.00 58.89 59.78 1oy0 h TRP 233 Cb 1.08 -0.02 -0.05 0.00 -3.00 0.00 0.00 29.16 27.16 1oy0 h TRP 233 CO 0.82 0.01 0.59 1.96 -1.28 0.00 0.00 178.44 180.54 1oy0 h GLN 234 N 0.05 1.12 0.04 0.12 1.08 -1.90 -0.29 115.11 115.32 1oy0 h GLN 234 Ca 0.48 -0.07 -0.16 0.00 -1.45 0.00 0.00 58.65 57.45 1oy0 h GLN 234 Cb 1.82 -0.25 0.01 0.00 -0.05 0.00 0.00 27.48 29.02 1oy0 h GLN 234 CO -0.03 0.74 -0.64 -0.44 -0.95 0.00 0.00 178.83 177.51 1oy0 h ASP 235 N 1.15 0.50 -0.86 1.46 3.32 -1.09 0.38 116.42 121.28 1oy0 h ASP 235 Ca 0.36 -0.82 0.16 0.00 0.02 0.00 0.00 57.03 56.76 1oy0 h ASP 235 Cb -0.01 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 39.32 1oy0 h ASP 235 CO -0.12 1.26 0.56 -0.03 -1.72 0.00 0.00 179.24 179.19 1oy0 h MET 236 N -0.20 0.53 -0.24 3.56 4.05 -1.01 -2.18 114.93 119.43 1oy0 h MET 236 Ca -0.09 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 1oy0 h MET 236 Cb 1.39 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 32.07 1oy0 h MET 236 CO 0.12 0.35 0.00 0.00 0.23 0.00 0.00 176.91 177.61 1oy0 n ALA 237 N -2.47 2.85 -3.52 0.39 0.00 -0.15 -0.87 120.51 116.73 1oy0 n ALA 237 Ca 0.17 -2.22 -0.16 0.00 0.00 0.00 0.00 53.44 51.23 1oy0 n ALA 237 Cb 0.55 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.35 1oy0 n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oy0 n GLY 238 N -0.50 -1.27 0.00 0.00 0.00 -0.82 -0.54 105.19 102.06 1oy0 n GLY 238 Ca 0.20 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.76 1oy0 n GLY 238 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1oy0 n PHE 239 N -2.40 0.00 -4.40 1.61 7.35 0.13 -0.04 117.46 119.71 1oy0 n PHE 239 Ca -0.19 0.00 -0.25 0.00 -0.76 0.00 0.00 57.45 56.25 1oy0 n PHE 239 Cb 0.62 0.00 -0.17 0.00 0.35 0.00 0.00 39.48 40.28 1oy0 n PHE 239 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1oy0 s SER 240 N -1.02 1.81 0.39 -2.13 1.04 -1.22 -4.81 113.70 107.76 1oy0 s SER 240 Ca 0.00 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.14 1oy0 s SER 240 Cb 0.00 -0.81 0.00 0.00 0.10 0.00 0.00 66.02 65.31 1oy0 s SER 240 CO 0.00 -0.01 0.00 0.61 0.98 0.00 0.00 173.24 174.82 1oy0 n GLY 241 N 4.08 0.48 0.00 7.32 0.00 -1.26 -4.60 105.19 111.21 1oy0 n GLY 241 Ca -0.21 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1oy0 n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy0 n ALA 242 N 1.12 1.07 -2.61 4.61 0.00 -1.26 -4.97 120.51 118.47 1oy0 n ALA 242 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 1oy0 n ALA 242 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1oy0 n ALA 242 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1oy0 s LYS 243 N -0.39 3.76 -0.37 0.00 2.20 -1.26 -4.97 119.74 118.72 1oy0 s LYS 243 Ca 0.00 -1.56 -0.28 0.00 -0.36 0.00 0.00 55.97 53.77 1oy0 s LYS 243 Cb 0.00 -5.38 0.02 0.00 -1.51 0.00 0.00 37.83 30.96 1oy0 s LYS 243 CO 0.00 -2.18 1.02 -0.08 -0.36 0.00 0.00 175.35 173.75 1oy0 s THR 244 N 4.38 4.49 1.17 3.43 -1.32 -1.26 -5.02 115.64 121.52 1oy0 s THR 244 Ca 0.48 1.42 -0.15 0.00 -1.21 0.00 0.00 61.69 62.23 1oy0 s THR 244 Cb 0.01 -4.41 0.28 0.00 -1.51 0.00 0.00 72.50 66.87 1oy0 s THR 244 CO -0.03 -0.59 1.04 0.00 -2.21 0.00 0.00 174.62 172.83 1oy0 s ALA 245 N 3.70 -0.08 0.12 11.08 0.00 -1.26 -4.90 121.76 130.42 1oy0 s ALA 245 Ca 0.43 -0.41 -0.20 0.00 0.00 0.00 0.00 51.96 51.78 1oy0 s ALA 245 Cb -0.11 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 1oy0 s ALA 245 CO 0.19 -3.69 1.71 0.00 0.00 0.00 0.00 175.76 173.97 1oy0 h ARG 246 N -2.56 0.00 0.00 0.00 3.08 -2.06 -2.49 114.38 110.35 1oy0 h ARG 246 Ca -0.56 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.49 1oy0 h ARG 246 Cb 1.33 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.38 1oy0 h ARG 246 CO 0.48 0.00 0.00 1.97 -1.07 0.00 0.00 179.97 181.35 1oy0 n PHE 247 N -5.19 0.00 -4.43 3.04 1.16 -1.26 -4.72 117.46 106.06 1oy0 n PHE 247 Ca -0.03 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.21 1oy0 n PHE 247 Cb 0.12 -0.17 -0.11 0.00 -1.61 0.00 0.00 39.48 37.71 1oy0 n PHE 247 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1oy0 s VAL 248 N -2.34 4.02 -0.21 1.97 1.01 -0.94 -4.54 120.40 119.38 1oy0 s VAL 248 Ca 0.20 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 1oy0 s VAL 248 Cb 0.12 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 1oy0 s VAL 248 CO 0.24 0.55 -0.01 -0.75 0.00 0.00 0.00 175.10 175.13 1oy0 s LYS 249 N -0.32 3.55 -0.76 2.72 2.20 -1.26 -4.66 119.74 121.21 1oy0 s LYS 249 Ca 0.06 -0.55 -0.27 0.00 -0.36 0.00 0.00 55.97 54.85 1oy0 s LYS 249 Cb -0.12 -3.06 0.03 0.00 -1.51 0.00 0.00 37.83 33.16 1oy0 s LYS 249 CO 0.02 -0.04 1.34 0.50 -0.36 0.00 0.00 175.35 176.81 1oy0 s ARG 250 N 1.12 3.19 0.00 4.03 3.52 -1.26 -4.58 118.95 124.97 1oy0 s ARG 250 Ca 0.02 -0.28 0.30 0.00 -0.13 0.00 0.00 55.73 55.65 1oy0 s ARG 250 Cb -0.14 -4.33 1.79 0.00 -1.56 0.00 0.00 34.95 30.71 1oy0 s ARG 250 CO 0.01 -2.21 2.14 0.66 -0.81 0.00 0.00 175.30 175.09 1oy0 n TYR 251 N 9.59 0.00 -0.07 5.12 4.02 -0.05 -4.93 117.16 130.83 1oy0 n TYR 251 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 1oy0 n TYR 251 Cb 0.49 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1oy0 n TYR 251 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1oy0 n ALA 252 N -1.02 0.00 -2.98 -0.72 0.00 -1.24 -4.98 120.51 109.56 1oy0 n ALA 252 Ca 0.22 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.43 1oy0 n ALA 252 Cb 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.54 1oy0 n ALA 252 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1oy0 n ASP 253 N 0.27 3.00 0.11 0.00 4.64 -1.25 -3.13 116.55 120.19 1oy0 n ASP 253 Ca 0.00 -3.39 0.05 0.00 -1.38 0.00 0.00 54.79 50.08 1oy0 n ASP 253 Cb 0.00 -0.57 0.50 0.00 -1.04 0.00 0.00 41.12 40.01 1oy0 n ASP 253 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1oy0 h VAL 254 N 2.23 1.08 0.14 5.18 2.07 -0.81 -0.77 116.25 125.36 1oy0 h VAL 254 Ca 0.12 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1oy0 h VAL 254 Cb 0.75 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1oy0 h VAL 254 CO 0.69 0.08 -0.07 1.23 0.02 0.00 0.00 177.57 179.52 1oy0 h GLY 255 N 0.37 -0.20 0.75 2.17 0.00 -0.54 -2.12 103.07 103.50 1oy0 h GLY 255 Ca 0.08 0.07 0.05 0.00 0.00 0.00 0.00 47.33 47.53 1oy0 h GLY 255 CO -0.01 -0.07 0.36 -1.33 0.00 0.00 0.00 176.54 175.48 1oy0 h GLY 256 N -0.45 0.91 0.83 4.60 0.00 -1.58 -0.70 103.07 106.68 1oy0 h GLY 256 Ca -0.02 -0.26 0.12 0.00 0.00 0.00 0.00 47.33 47.17 1oy0 h GLY 256 CO 0.03 0.18 0.49 -2.09 0.00 0.00 0.00 176.54 175.14 1oy0 h GLU 257 N 0.68 0.53 -0.01 4.80 4.22 -1.06 0.10 114.58 123.84 1oy0 h GLU 257 Ca 0.27 -0.03 -0.16 0.00 0.08 0.00 0.00 59.36 59.52 1oy0 h GLU 257 Cb 0.12 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1oy0 h GLU 257 CO -0.15 0.35 -0.72 1.25 -2.18 0.00 0.00 179.01 177.55 1oy0 h LEU 258 N 0.54 0.06 -0.23 1.64 5.85 -0.46 -2.85 115.31 119.86 1oy0 h LEU 258 Ca 0.35 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 1oy0 h LEU 258 Cb 0.61 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1oy0 h LEU 258 CO -0.12 0.76 0.10 0.03 -0.34 0.00 0.00 178.44 178.87 1oy0 h ARG 259 N 0.03 0.33 0.01 1.25 3.08 0.14 -1.73 114.38 117.50 1oy0 h ARG 259 Ca -0.01 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1oy0 h ARG 259 Cb 1.28 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1oy0 h ARG 259 CO 0.10 0.36 -0.00 0.07 -1.07 0.00 0.00 179.97 179.42 1oy0 h ARG 260 N 0.23 -0.01 -0.94 0.04 -0.00 -1.51 0.17 114.38 112.36 1oy0 h ARG 260 Ca 0.08 0.00 0.27 0.00 -0.00 0.00 0.00 59.98 60.33 1oy0 h ARG 260 Cb 0.14 0.00 -0.17 0.00 -0.00 0.00 0.00 29.97 29.94 1oy0 h ARG 260 CO -0.01 0.27 0.17 0.00 -0.00 0.00 0.00 179.97 180.40 1oy0 h ALA 261 N 0.70 1.33 -0.03 0.08 0.00 -1.42 1.81 119.26 121.74 1oy0 h ALA 261 Ca -0.00 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1oy0 h ALA 261 Cb 0.28 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1oy0 h ALA 261 CO 0.00 -0.58 -0.05 0.00 0.00 0.00 0.00 179.25 178.62 1oy0 h ALA 262 N 1.90 0.05 -0.52 0.00 0.00 -0.99 -1.56 119.26 118.15 1oy0 h ALA 262 Ca 0.61 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1oy0 h ALA 262 Cb 1.31 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 1oy0 h ALA 262 CO -0.80 -0.14 0.33 0.52 0.00 0.00 0.00 179.25 179.17 1oy0 h MET 263 N -0.42 0.69 -0.37 0.00 2.07 0.27 0.75 114.93 117.92 1oy0 h MET 263 Ca 0.00 -0.05 -0.04 0.00 -2.07 0.00 0.00 59.70 57.54 1oy0 h MET 263 Cb 0.60 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 30.17 1oy0 h MET 263 CO 0.01 0.48 0.07 0.37 1.07 0.00 0.00 176.91 178.91 1oy0 h GLN 264 N 0.70 0.61 -0.37 1.72 4.15 0.25 -1.64 115.11 120.53 1oy0 h GLN 264 Ca 0.19 -0.16 0.07 0.00 0.77 0.00 0.00 58.65 59.52 1oy0 h GLN 264 Cb -0.05 -0.07 -0.07 0.00 0.21 0.00 0.00 27.48 27.50 1oy0 h GLN 264 CO -0.04 0.66 -0.05 -0.92 -1.93 0.00 0.00 178.83 176.55 1oy0 h TYR 265 N 0.45 -0.12 -0.26 3.99 3.20 -0.90 -0.44 116.97 122.89 1oy0 h TYR 265 Ca 0.11 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.05 1oy0 h TYR 265 Cb 0.34 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.69 1oy0 h TYR 265 CO 0.02 -0.12 0.03 0.00 -1.64 0.00 0.00 178.16 176.45 1oy0 h ALA 266 N 1.35 0.25 -0.65 1.82 0.00 -0.58 -1.42 119.26 120.03 1oy0 h ALA 266 Ca 0.18 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1oy0 h ALA 266 Cb 0.27 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1oy0 h ALA 266 CO -0.35 -0.39 0.27 0.37 0.00 0.00 0.00 179.25 179.15 1oy0 h GLN 267 N 0.12 0.96 -0.37 0.00 4.15 -0.76 -1.19 115.11 118.03 1oy0 h GLN 267 Ca 0.12 -0.17 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 1oy0 h GLN 267 Cb 0.13 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 1oy0 h GLN 267 CO -0.17 0.80 0.07 0.93 -1.93 0.00 0.00 178.83 178.53 1oy0 h GLU 268 N 0.91 0.55 -0.17 1.69 5.08 -0.81 0.57 114.58 122.39 1oy0 h GLU 268 Ca 0.22 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1oy0 h GLU 268 Cb 0.19 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1oy0 h GLU 268 CO -0.02 0.52 0.01 0.28 -1.00 0.00 0.00 179.01 178.80 1oy0 h VAL 269 N 0.53 1.24 -0.32 3.13 2.07 -0.79 0.10 116.25 122.22 1oy0 h VAL 269 Ca 0.12 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 1oy0 h VAL 269 Cb 0.23 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1oy0 h VAL 269 CO -0.00 0.24 -0.06 0.00 0.02 0.00 0.00 177.57 177.76 1oy0 h ALA 270 N 0.79 1.30 -0.17 1.67 0.00 -0.60 -2.29 119.26 119.97 1oy0 h ALA 270 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1oy0 h ALA 270 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1oy0 h ALA 270 CO 0.01 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.13 1oy0 n GLY 271 N -0.76 -0.05 3.45 0.00 0.00 0.20 -4.89 105.19 103.14 1oy0 n GLY 271 Ca 0.01 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1oy0 n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oy0 n GLY 272 N 0.94 0.13 0.16 -0.02 0.00 -0.49 -4.78 105.19 101.12 1oy0 n GLY 272 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1oy0 n GLY 272 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1oy0 h VAL 273 N 0.00 1.34 -3.94 1.61 -1.51 -1.11 -3.43 116.25 109.22 1oy0 h VAL 273 Ca 0.00 -1.83 -0.55 0.00 -1.23 0.00 0.00 66.70 63.09 1oy0 h VAL 273 Cb 0.33 2.00 -0.31 0.00 -2.13 0.00 0.00 31.29 31.17 1oy0 h VAL 273 CO 0.00 0.52 -0.83 0.12 -1.23 0.00 0.00 177.57 176.14 1oy0 s PHE 274 N -3.77 1.66 0.58 5.19 5.36 -0.61 -3.52 117.98 122.87 1oy0 s PHE 274 Ca -0.02 -0.46 -0.13 0.00 -0.96 0.00 0.00 56.93 55.36 1oy0 s PHE 274 Cb 0.13 -1.11 -0.05 0.00 -0.34 0.00 0.00 43.02 41.64 1oy0 s PHE 274 CO 0.74 -0.15 1.02 -1.25 -1.46 0.00 0.00 175.22 174.12 1oy0 s PRO 275 N -0.00 3.68 0.00 10.12 0.04 -1.26 -4.06 135.00 143.52 1oy0 s PRO 275 Ca -0.03 0.87 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1oy0 s PRO 275 Cb -0.11 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1oy0 s PRO 275 CO 0.02 -0.50 0.00 0.00 0.04 0.00 0.00 177.00 176.56 1oy0 n ALA 276 N -2.27 0.00 -0.04 8.56 0.00 -1.23 -4.98 120.51 120.54 1oy0 n ALA 276 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.37 1oy0 n ALA 276 Cb 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.85 1oy0 n ALA 276 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1oy0 n ASP 277 N 0.00 1.23 0.06 0.00 9.92 -1.26 -3.68 116.55 122.83 1oy0 n ASP 277 Ca 0.00 0.20 0.04 0.00 -0.53 0.00 0.00 54.79 54.50 1oy0 n ASP 277 Cb 0.00 -0.15 0.21 0.00 -0.64 0.00 0.00 41.12 40.54 1oy0 n ASP 277 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1oy0 n GLU 278 N -3.15 0.05 0.00 -1.24 0.28 -1.26 -5.30 120.64 110.02 1oy0 n GLU 278 Ca -0.28 0.51 0.07 0.00 -0.16 0.00 0.00 57.16 57.29 1oy0 n GLU 278 Cb 1.06 -1.74 0.06 0.00 1.43 0.00 0.00 31.44 32.25 1oy0 n GLU 278 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69