#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 4.77 -0.31 8.89 2.01 -1.26 -5.08 115.64 124.66 1oy0 s THR 19 Ca 0.00 -0.06 -0.21 0.00 0.31 0.00 0.00 61.69 61.74 1oy0 s THR 19 Cb 0.00 -3.09 -0.01 0.00 0.01 0.00 0.00 72.50 69.42 1oy0 s THR 19 CO 0.00 0.55 0.64 -0.54 -0.69 0.00 0.00 174.62 174.58 1oy0 s LYS 20 N -0.36 3.87 0.24 4.92 1.02 -1.26 -4.82 119.74 123.34 1oy0 s LYS 20 Ca 0.09 0.29 -0.31 0.00 0.02 0.00 0.00 55.97 56.05 1oy0 s LYS 20 Cb -0.12 -3.74 -0.13 0.00 -0.52 0.00 0.00 37.83 33.32 1oy0 s LYS 20 CO 0.02 -0.60 1.57 -0.89 -0.92 0.00 0.00 175.35 174.52 1oy0 n ILE 21 N 5.43 0.60 -4.43 2.17 2.08 0.20 -5.01 119.36 120.40 1oy0 n ILE 21 Ca -0.01 -0.15 -0.22 0.00 0.56 0.00 0.00 62.75 62.94 1oy0 n ILE 21 Cb 0.49 -1.75 -0.10 0.00 -0.75 0.00 0.00 39.64 37.52 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 0.13 1.57 0.27 0.38 1.81 -1.26 -4.18 118.95 117.67 1oy0 s ARG 22 Ca 0.70 -1.78 -0.01 0.00 -1.72 0.00 0.00 55.73 52.91 1oy0 s ARG 22 Cb -0.58 -1.23 0.45 0.00 -0.45 0.00 0.00 34.95 33.14 1oy0 s ARG 22 CO 0.43 0.07 1.88 1.79 -0.68 0.00 0.00 175.30 178.79 1oy0 h THR 23 N 2.27 1.05 -0.17 0.02 1.35 -1.99 -1.30 112.91 114.14 1oy0 h THR 23 Ca -0.40 -0.39 0.05 0.00 -0.55 0.00 0.00 66.41 65.12 1oy0 h THR 23 Cb 1.24 -0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.47 1oy0 h THR 23 CO 0.67 0.21 0.12 1.12 -0.25 0.00 0.00 175.52 177.39 1oy0 h HIS 24 N 1.13 0.00 -0.73 4.73 2.07 -1.98 -0.92 115.15 119.46 1oy0 h HIS 24 Ca 0.44 0.00 0.03 0.00 -2.85 0.00 0.00 60.37 57.99 1oy0 h HIS 24 Cb 0.23 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.17 1oy0 h HIS 24 CO -0.00 0.00 0.46 0.45 -3.07 0.00 0.00 177.93 175.77 1oy0 h HIS 25 N 0.00 0.87 -0.32 6.12 3.86 -1.64 0.42 115.15 124.45 1oy0 h HIS 25 Ca 0.08 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.29 1oy0 h HIS 25 Cb 0.33 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 1oy0 h HIS 25 CO 0.00 0.51 0.09 -0.07 0.86 0.00 0.00 177.93 179.32 1oy0 h LEU 26 N 0.91 0.42 -0.05 2.43 3.38 -1.23 0.12 115.31 121.29 1oy0 h LEU 26 Ca 0.29 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1oy0 h LEU 26 Cb -0.01 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1oy0 h LEU 26 CO -0.10 0.42 -0.04 -0.61 0.09 0.00 0.00 178.44 178.20 1oy0 h GLN 27 N 0.46 0.11 -0.40 1.13 5.75 -1.03 -2.39 115.11 118.75 1oy0 h GLN 27 Ca 0.11 -0.06 0.06 0.00 -0.15 0.00 0.00 58.65 58.61 1oy0 h GLN 27 Cb 0.16 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.66 1oy0 h GLN 27 CO -0.01 0.56 0.08 0.00 -2.65 0.00 0.00 178.83 176.82 1oy0 h ARG 28 N -0.33 0.20 -0.58 1.69 3.08 -0.52 -1.23 114.38 116.68 1oy0 h ARG 28 Ca 0.01 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.13 1oy0 h ARG 28 Cb 0.54 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 1oy0 h ARG 28 CO 0.01 0.13 0.39 -1.49 -1.07 0.00 0.00 179.97 177.95 1oy0 h TRP 29 N 0.21 0.45 -0.39 3.04 6.55 -0.93 0.20 115.95 125.08 1oy0 h TRP 29 Ca 0.19 0.01 -0.10 0.00 0.95 0.00 0.00 58.89 59.94 1oy0 h TRP 29 Cb 0.23 -0.15 -0.02 0.00 -0.86 0.00 0.00 29.16 28.37 1oy0 h TRP 29 CO -0.20 0.22 -0.17 -0.22 -1.05 0.00 0.00 178.44 177.02 1oy0 h LYS 30 N 0.43 0.73 0.04 0.49 3.64 -0.70 0.40 116.57 121.59 1oy0 h LYS 30 Ca 0.27 -0.26 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1oy0 h LYS 30 Cb 0.48 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1oy0 h LYS 30 CO -0.07 0.85 -0.02 0.00 -2.27 0.00 0.00 179.45 177.94 1oy0 h ALA 31 N 1.17 -0.05 0.00 5.00 0.00 -0.30 -2.88 119.26 122.19 1oy0 h ALA 31 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1oy0 h ALA 31 Cb 0.64 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1oy0 h ALA 31 CO 0.05 -0.34 0.00 -0.25 0.00 0.00 0.00 179.25 178.71 1oy0 n ASP 32 N -4.93 0.00 -0.57 0.00 8.00 0.45 -4.86 116.55 114.63 1oy0 n ASP 32 Ca -0.08 -0.36 -0.07 0.00 0.71 0.00 0.00 54.79 54.99 1oy0 n ASP 32 Cb 0.21 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.14 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 0.47 0.82 3.60 0.44 0.00 -0.00 -4.99 105.19 105.53 1oy0 n GLY 33 Ca 0.13 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.27 3.08 -0.42 1.61 5.04 0.12 -5.00 115.29 117.44 1oy0 s HIS 34 Ca 0.00 0.73 -0.26 0.00 -1.54 0.00 0.00 55.06 54.00 1oy0 s HIS 34 Cb 0.00 -3.63 0.02 0.00 0.04 0.00 0.00 32.58 29.01 1oy0 s HIS 34 CO 0.00 -0.83 0.93 0.15 -2.34 0.00 0.00 174.74 172.65 1oy0 s LYS 35 N 3.45 3.67 0.24 2.88 1.02 -1.26 -4.50 119.74 125.23 1oy0 s LYS 35 Ca 0.37 0.34 0.01 0.00 0.02 0.00 0.00 55.97 56.71 1oy0 s LYS 35 Cb -0.12 -3.87 -0.04 0.00 -0.52 0.00 0.00 37.83 33.28 1oy0 s LYS 35 CO 0.19 -1.11 0.41 1.67 -0.92 0.00 0.00 175.35 175.59 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 0.38 0.23 -0.01 0.00 -1.06 0.00 0.00 56.10 55.63 1oy0 s TRP 36 Cb -0.11 -1.77 -0.03 0.00 -1.16 0.00 0.00 33.47 30.40 1oy0 s TRP 36 CO 0.23 0.35 -0.04 0.00 -4.06 0.00 0.00 176.95 173.43 1oy0 s ALA 37 N -1.98 3.05 -0.08 2.67 0.00 -1.26 -1.71 121.76 122.45 1oy0 s ALA 37 Ca 0.37 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.53 1oy0 s ALA 37 Cb -0.10 -1.41 -0.01 0.00 0.00 0.00 0.00 23.12 21.60 1oy0 s ALA 37 CO 0.30 0.44 -0.20 1.41 0.00 0.00 0.00 175.76 177.71 1oy0 s MET 38 N -0.37 2.84 0.05 0.00 0.00 0.17 -4.13 119.30 117.86 1oy0 s MET 38 Ca 0.06 -0.82 0.08 0.00 0.00 0.00 0.00 55.69 55.01 1oy0 s MET 38 Cb -0.12 -2.33 -0.03 0.00 0.00 0.00 0.00 34.83 32.35 1oy0 s MET 38 CO 0.02 0.34 -0.22 -1.17 0.00 0.00 0.00 175.02 173.99 1oy0 s LEU 39 N -0.03 2.17 0.35 4.11 2.96 -1.00 -2.56 118.68 124.68 1oy0 s LEU 39 Ca -0.06 -0.54 -0.23 0.00 -0.22 0.00 0.00 54.13 53.08 1oy0 s LEU 39 Cb -0.15 -1.02 -0.10 0.00 0.50 0.00 0.00 46.19 45.42 1oy0 s LEU 39 CO 0.05 0.17 0.91 0.28 -1.32 0.00 0.00 176.35 176.44 1oy0 s THR 40 N -0.82 4.35 -0.07 3.68 -1.32 -0.90 -1.40 115.64 119.16 1oy0 s THR 40 Ca 0.08 1.58 -0.15 0.00 -1.21 0.00 0.00 61.69 62.00 1oy0 s THR 40 Cb -0.09 -3.82 0.03 0.00 -1.51 0.00 0.00 72.50 67.11 1oy0 s THR 40 CO 0.02 -0.04 0.35 0.00 -2.21 0.00 0.00 174.62 172.74 1oy0 s ALA 41 N -1.84 -0.89 0.00 11.08 0.00 -0.57 -4.04 121.76 125.51 1oy0 s ALA 41 Ca 0.54 0.67 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1oy0 s ALA 41 Cb -0.14 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1oy0 s ALA 41 CO 0.19 -0.23 0.54 0.66 0.00 0.00 0.00 175.76 176.92 1oy0 n TYR 42 N 1.92 0.00 -3.77 0.00 4.01 -1.26 -3.87 117.16 114.19 1oy0 n TYR 42 Ca -0.18 -0.08 -0.09 0.00 -0.16 0.00 0.00 57.90 57.39 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 -0.17 -0.26 0.11 7.72 -4.77 -1.26 -4.80 116.67 113.24 1oy0 s ASP 43 Ca 0.00 -0.53 -0.26 0.00 -3.30 0.00 0.00 52.55 48.46 1oy0 s ASP 43 Cb 0.00 0.61 -0.09 0.00 -1.09 0.00 0.00 42.92 42.35 1oy0 s ASP 43 CO 0.00 -1.12 1.66 0.22 0.70 0.00 0.00 175.17 176.62 1oy0 h TYR 44 N 2.15 -0.56 -0.95 2.11 3.20 -1.87 -1.82 116.97 119.23 1oy0 h TYR 44 Ca -0.27 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.62 1oy0 h TYR 44 Cb 1.26 0.23 -0.05 0.00 1.54 0.00 0.00 36.73 39.72 1oy0 h TYR 44 CO 0.36 -0.31 0.61 0.77 -1.64 0.00 0.00 178.16 177.96 1oy0 h SER 45 N -0.40 1.10 -0.06 -2.11 0.02 -1.96 -0.18 113.55 109.96 1oy0 h SER 45 Ca 0.03 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1oy0 h SER 45 Cb 0.42 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 1oy0 h SER 45 CO -0.11 0.81 -0.02 0.74 -1.14 0.00 0.00 176.83 177.10 1oy0 h THR 46 N 1.29 1.31 -0.62 -2.27 2.02 -1.96 -2.62 112.91 110.05 1oy0 h THR 46 Ca 0.35 -0.98 0.06 0.00 0.77 0.00 0.00 66.41 66.60 1oy0 h THR 46 Cb -0.13 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.07 1oy0 h THR 46 CO -0.07 0.27 0.33 0.00 0.37 0.00 0.00 175.52 176.42 1oy0 h ALA 47 N 0.64 0.83 -0.64 6.16 0.00 -1.12 -1.13 119.26 124.00 1oy0 h ALA 47 Ca 0.01 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.03 1oy0 h ALA 47 Cb 0.44 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 1oy0 h ALA 47 CO 0.01 -0.00 0.30 -0.09 0.00 0.00 0.00 179.25 179.46 1oy0 h ARG 48 N 0.62 0.52 0.24 0.00 9.65 -0.76 0.21 114.38 124.86 1oy0 h ARG 48 Ca 0.28 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.12 1oy0 h ARG 48 Cb 0.19 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1oy0 h ARG 48 CO -0.19 0.34 -0.12 0.82 2.80 0.00 0.00 179.97 183.63 1oy0 h ILE 49 N 0.53 0.81 -0.19 1.20 2.04 -0.94 -1.53 117.51 119.43 1oy0 h ILE 49 Ca 0.31 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1oy0 h ILE 49 Cb 0.32 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1oy0 h ILE 49 CO -0.25 0.06 0.06 -0.26 0.00 0.00 0.00 178.15 177.76 1oy0 h PHE 50 N -0.47 0.26 0.05 1.37 0.05 -0.86 -0.96 116.94 116.38 1oy0 h PHE 50 Ca -0.03 -0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.75 1oy0 h PHE 50 Cb 0.36 -0.08 0.00 0.00 2.00 0.00 0.00 35.95 38.22 1oy0 h PHE 50 CO -0.02 0.23 -0.02 0.22 -0.18 0.00 0.00 178.31 178.53 1oy0 h ASP 51 N 0.27 -0.06 0.00 2.17 3.58 -0.38 -0.73 116.42 121.28 1oy0 h ASP 51 Ca 0.07 -0.33 0.00 0.00 0.42 0.00 0.00 57.03 57.19 1oy0 h ASP 51 Cb 0.09 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.15 1oy0 h ASP 51 CO -0.01 0.30 0.00 -1.84 -2.88 0.00 0.00 179.24 174.82 1oy0 n GLU 52 N -4.95 0.83 0.00 0.28 0.28 -0.60 -1.30 120.64 115.18 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 0.03 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 2.86 -0.55 -1.84 0.00 -0.39 -4.99 120.51 114.89 1oy0 n ALA 53 Ca 0.08 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1oy0 n ALA 53 Cb 0.04 -0.58 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 1.08 0.82 3.68 0.00 0.00 -0.42 -5.02 105.19 105.32 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 2.74 0.15 -0.61 -1.09 -0.32 -4.88 121.20 114.07 1oy0 s ILE 55 Ca 0.00 0.04 -0.01 0.00 -2.23 0.00 0.00 60.65 58.45 1oy0 s ILE 55 Cb 0.00 -3.02 -0.16 0.00 -1.58 0.00 0.00 42.46 37.70 1oy0 s ILE 55 CO 0.00 -0.00 1.36 1.55 -1.23 0.00 0.00 174.94 176.61 1oy0 h PRO 56 N 9.46 0.32 -4.65 2.79 0.13 -1.89 -3.42 132.00 134.75 1oy0 h PRO 56 Ca -0.48 -0.33 -0.54 0.00 -0.87 0.00 0.00 66.00 63.79 1oy0 h PRO 56 Cb 1.23 0.09 -0.33 0.00 0.13 0.00 0.00 31.00 32.11 1oy0 h PRO 56 CO 0.95 1.02 -0.82 0.08 -0.23 0.00 0.00 178.00 178.99 1oy0 s VAL 57 N -3.31 1.25 -0.09 1.56 1.01 -1.26 -0.45 120.40 119.11 1oy0 s VAL 57 Ca -0.05 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1oy0 s VAL 57 Cb 0.10 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 1oy0 s VAL 57 CO 0.85 0.38 -0.18 -0.76 0.00 0.00 0.00 175.10 175.38 1oy0 s LEU 58 N 0.62 2.44 -0.31 3.92 1.43 -0.60 -2.38 118.68 123.80 1oy0 s LEU 58 Ca -0.15 -0.39 -0.04 0.00 -1.03 0.00 0.00 54.13 52.51 1oy0 s LEU 58 Cb -0.16 -1.50 0.04 0.00 0.03 0.00 0.00 46.19 44.59 1oy0 s LEU 58 CO 0.04 0.21 0.05 -0.22 0.23 0.00 0.00 176.35 176.67 1oy0 s LEU 59 N 0.04 3.98 -1.14 1.79 2.96 -0.49 -0.31 118.68 125.50 1oy0 s LEU 59 Ca -0.07 -1.08 -0.19 0.00 -0.22 0.00 0.00 54.13 52.57 1oy0 s LEU 59 Cb -0.15 -1.80 0.09 0.00 0.50 0.00 0.00 46.19 44.84 1oy0 s LEU 59 CO 0.05 -0.26 1.50 -0.69 -1.32 0.00 0.00 176.35 175.63 1oy0 s VAL 60 N 1.36 4.32 0.95 1.68 1.01 -0.13 -1.52 120.40 128.07 1oy0 s VAL 60 Ca -0.02 -1.65 -0.12 0.00 0.00 0.00 0.00 61.98 60.19 1oy0 s VAL 60 Cb -0.19 -5.04 0.16 0.00 0.00 0.00 0.00 36.38 31.31 1oy0 s VAL 60 CO 0.01 -1.85 1.11 -0.83 0.00 0.00 0.00 175.10 173.54 1oy0 s GLY 61 N 4.11 1.57 0.00 4.51 0.00 -1.26 -2.65 107.32 113.60 1oy0 s GLY 61 Ca 0.46 -0.41 0.27 0.00 0.00 0.00 0.00 44.72 45.04 1oy0 s GLY 61 CO -0.02 0.17 1.61 2.09 0.00 0.00 0.00 173.10 176.95 1oy0 n ASP 62 N -3.95 1.44 0.04 1.64 5.75 -1.26 -2.67 116.55 117.54 1oy0 n ASP 62 Ca 0.06 -1.30 0.08 0.00 -0.01 0.00 0.00 54.79 53.62 1oy0 n ASP 62 Cb 0.58 0.08 0.33 0.00 -1.03 0.00 0.00 41.12 41.07 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 -0.08 0.19 0.28 -1.12 3.41 -1.26 -0.98 113.62 114.07 1oy0 n SER 63 Ca 0.15 0.55 0.14 0.00 -0.26 0.00 0.00 58.87 59.46 1oy0 n SER 63 Cb 0.37 -0.59 0.83 0.00 -0.26 0.00 0.00 64.21 64.56 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 1.48 -0.89 7.33 0.00 -1.89 -1.61 119.26 126.04 1oy0 h ALA 64 Ca 0.00 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.03 1oy0 h ALA 64 Cb 0.23 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.91 1oy0 h ALA 64 CO 0.00 0.06 0.46 0.00 0.00 0.00 0.00 179.25 179.77 1oy0 h ALA 65 N 1.95 1.38 0.00 0.00 0.00 -1.33 0.58 119.26 121.85 1oy0 h ALA 65 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1oy0 h ALA 65 Cb 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1oy0 h ALA 65 CO 0.01 -0.12 -0.05 -0.91 0.00 0.00 0.00 179.25 178.18 1oy0 h ASN 66 N 0.62 0.00 0.07 0.00 4.21 -1.40 0.20 115.58 119.28 1oy0 h ASN 66 Ca 0.50 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 58.00 1oy0 h ASN 66 Cb 0.76 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.96 1oy0 h ASN 66 CO -0.39 0.13 -0.05 -0.37 -1.29 0.00 0.00 177.43 175.46 1oy0 h VAL 67 N -0.22 0.90 0.01 2.81 -1.51 -1.52 -0.34 116.25 116.38 1oy0 h VAL 67 Ca 0.00 -0.18 -0.41 0.00 -1.23 0.00 0.00 66.70 64.89 1oy0 h VAL 67 Cb 0.05 1.10 -0.06 0.00 -2.13 0.00 0.00 31.29 30.25 1oy0 h VAL 67 CO 0.00 0.05 -2.27 0.52 -1.23 0.00 0.00 177.57 174.64 1oy0 n VAL 68 N -4.28 1.54 0.90 7.19 0.31 0.20 -4.71 118.33 119.47 1oy0 n VAL 68 Ca -0.03 -0.36 0.10 0.00 -0.01 0.00 0.00 64.34 64.04 1oy0 n VAL 68 Cb 0.13 -1.83 -0.02 0.00 -0.91 0.00 0.00 33.84 31.21 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 -4.09 0.00 -1.22 3.52 4.02 -0.70 -5.00 117.16 113.69 1oy0 n TYR 69 Ca -0.48 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.36 1oy0 n TYR 69 Cb 0.87 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 40.18 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 1.34 0.69 3.79 2.72 0.00 -0.14 -4.96 105.19 108.63 1oy0 n GLY 70 Ca 0.08 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.18 3.65 -2.09 1.61 4.12 0.66 -4.92 117.35 118.21 1oy0 s TYR 71 Ca 0.00 1.75 0.14 0.00 0.02 0.00 0.00 57.07 58.98 1oy0 s TYR 71 Cb 0.00 -2.90 0.62 0.00 -1.52 0.00 0.00 41.96 38.15 1oy0 s TYR 71 CO 0.00 0.19 1.43 -0.40 0.02 0.00 0.00 175.55 176.79 1oy0 n ASP 72 N 0.45 0.95 -3.47 2.29 3.85 -1.26 -3.83 116.55 115.54 1oy0 n ASP 72 Ca 0.02 -1.74 -0.12 0.00 -0.71 0.00 0.00 54.79 52.24 1oy0 n ASP 72 Cb 0.50 -0.09 -0.04 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 -1.83 0.00 -1.14 2.12 2.01 -1.26 -5.03 115.64 110.51 1oy0 s THR 73 Ca 0.23 -1.48 0.15 0.00 0.31 0.00 0.00 61.69 60.91 1oy0 s THR 73 Cb 0.12 -2.53 0.47 0.00 0.01 0.00 0.00 72.50 70.57 1oy0 s THR 73 CO 0.18 0.00 1.40 0.35 -0.69 0.00 0.00 174.62 175.86 1oy0 n THR 74 N -0.50 1.25 0.09 -0.82 -2.24 -1.26 -4.44 114.28 106.37 1oy0 n THR 74 Ca -0.01 -1.12 -0.22 0.00 -2.27 0.00 0.00 64.05 60.43 1oy0 n THR 74 Cb 0.62 0.37 -0.13 0.00 -2.10 0.00 0.00 70.33 69.08 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 2.86 1.30 0.00 2.28 2.07 -1.96 -3.38 116.25 119.43 1oy0 h VAL 75 Ca 0.00 -2.47 -0.16 0.00 0.82 0.00 0.00 66.70 64.89 1oy0 h VAL 75 Cb 0.97 2.76 -0.02 0.00 -1.52 0.00 0.00 31.29 33.48 1oy0 h VAL 75 CO 0.06 0.75 -0.76 1.55 0.02 0.00 0.00 177.57 179.18 1oy0 h PRO 76 N 0.21 0.00 -6.53 1.57 0.13 -1.96 -3.44 132.00 121.97 1oy0 h PRO 76 Ca -0.19 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.34 1oy0 h PRO 76 Cb 1.90 0.00 0.08 0.00 0.13 0.00 0.00 31.00 33.11 1oy0 h PRO 76 CO 0.23 0.76 0.51 1.51 -0.23 0.00 0.00 178.00 180.79 1oy0 n ILE 77 N -3.56 1.01 -3.91 -3.56 3.06 -1.26 -4.98 119.36 106.17 1oy0 n ILE 77 Ca -0.00 -0.25 -0.21 0.00 -2.50 0.00 0.00 62.75 59.78 1oy0 n ILE 77 Cb 0.76 -1.32 -0.04 0.00 0.54 0.00 0.00 39.64 39.58 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 0.17 5.29 0.26 9.51 1.04 -1.26 -4.55 113.70 124.17 1oy0 s SER 78 Ca 0.68 -0.46 -0.02 0.00 0.48 0.00 0.00 55.95 56.63 1oy0 s SER 78 Cb -0.69 -1.05 0.45 0.00 0.10 0.00 0.00 66.02 64.82 1oy0 s SER 78 CO 0.51 -0.27 1.83 0.40 0.98 0.00 0.00 173.24 176.69 1oy0 h ILE 79 N 1.33 0.95 0.00 -1.02 2.04 -1.96 -0.90 117.51 117.97 1oy0 h ILE 79 Ca -0.45 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1oy0 h ILE 79 Cb 1.25 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1oy0 h ILE 79 CO 0.59 0.17 0.00 0.44 0.00 0.00 0.00 178.15 179.35 1oy0 h ASP 80 N 0.95 0.00 0.34 1.72 3.32 -2.01 0.28 116.42 121.02 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 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1oy0 h ASP 80 CO -0.23 0.00 -0.17 -0.62 -1.72 0.00 0.00 179.24 176.50 1oy0 n GLU 81 N -2.96 0.70 -0.06 3.56 1.02 -0.35 -4.30 120.64 118.24 1oy0 n GLU 81 Ca -0.00 -0.31 -0.13 0.00 -0.02 0.00 0.00 57.16 56.70 1oy0 n GLU 81 Cb 0.23 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.11 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 -0.88 0.95 -0.26 -4.62 4.77 -0.18 -4.60 117.00 112.19 1oy0 n LEU 82 Ca 0.13 0.14 0.01 0.00 -0.03 0.00 0.00 56.01 56.27 1oy0 n LEU 82 Cb 0.30 -0.37 0.09 0.00 -2.33 0.00 0.00 43.42 41.11 1oy0 n LEU 82 CO 0.25 0.27 0.71 0.40 -1.33 0.00 0.00 177.39 177.69 1oy0 h ILE 83 N -0.43 0.25 0.00 -0.08 2.04 -1.21 0.33 117.51 118.41 1oy0 h ILE 83 Ca -0.31 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 1oy0 h ILE 83 Cb 1.28 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1oy0 h ILE 83 CO -0.19 0.00 -0.09 1.55 0.00 0.00 0.00 178.15 179.42 1oy0 h PRO 84 N -0.00 0.00 -0.22 2.37 0.13 -1.84 -0.74 132.00 131.70 1oy0 h PRO 84 Ca 0.36 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.28 1oy0 h PRO 84 Cb 0.55 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.68 1oy0 h PRO 84 CO -0.77 0.09 -0.68 -0.07 -0.23 0.00 0.00 178.00 176.34 1oy0 h LEU 85 N 0.00 0.97 -0.26 1.56 3.38 -0.69 -2.81 115.31 117.46 1oy0 h LEU 85 Ca -0.00 -0.58 0.02 0.00 0.09 0.00 0.00 57.88 57.40 1oy0 h LEU 85 Cb 0.16 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1oy0 h LEU 85 CO 0.01 1.39 0.13 0.58 0.09 0.00 0.00 178.44 180.64 1oy0 h VAL 86 N 0.61 0.99 -0.86 1.22 2.07 -0.13 -0.08 116.25 120.07 1oy0 h VAL 86 Ca -0.02 -0.09 0.11 0.00 0.82 0.00 0.00 66.70 67.52 1oy0 h VAL 86 Cb 1.30 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.69 1oy0 h VAL 86 CO 0.14 0.05 0.49 0.03 0.02 0.00 0.00 177.57 178.30 1oy0 h ARG 87 N 0.27 0.75 -0.23 1.57 3.08 -1.12 0.34 114.38 119.04 1oy0 h ARG 87 Ca 0.11 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1oy0 h ARG 87 Cb 0.03 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1oy0 h ARG 87 CO -0.08 0.50 0.07 0.78 -1.07 0.00 0.00 179.97 180.17 1oy0 h GLY 88 N 0.78 0.39 1.08 0.04 0.00 -1.05 -1.88 103.07 102.43 1oy0 h GLY 88 Ca 0.43 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 1oy0 h GLY 88 CO -0.28 0.22 0.29 -2.08 0.00 0.00 0.00 176.54 174.69 1oy0 h VAL 89 N 0.20 1.26 -0.66 4.60 2.07 -0.08 -1.60 116.25 122.05 1oy0 h VAL 89 Ca 0.07 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1oy0 h VAL 89 Cb 0.25 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1oy0 h VAL 89 CO -0.00 0.34 0.39 0.58 0.02 0.00 0.00 177.57 178.90 1oy0 h VAL 90 N 1.13 1.19 0.00 2.57 2.07 -0.15 -1.70 116.25 121.35 1oy0 h VAL 90 Ca 0.26 -0.42 -0.14 0.00 0.82 0.00 0.00 66.70 67.22 1oy0 h VAL 90 Cb 0.23 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1oy0 h VAL 90 CO -0.02 0.20 -0.66 0.03 0.02 0.00 0.00 177.57 177.13 1oy0 h ARG 91 N 0.90 0.00 0.00 1.57 3.08 -0.79 -3.29 114.38 115.85 1oy0 h ARG 91 Ca 0.24 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 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 0.66 -0.46 0.78 -1.07 0.00 0.00 179.97 179.84 1oy0 h GLY 92 N 2.19 0.00 -6.69 0.04 0.00 -0.49 -3.40 103.07 94.72 1oy0 h GLY 92 Ca -0.01 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1oy0 h GLY 92 CO 0.09 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.96 1oy0 n ALA 93 N -2.15 3.44 0.31 3.60 0.00 -0.72 -2.57 120.51 122.42 1oy0 n ALA 93 Ca 0.02 -4.31 0.19 0.00 0.00 0.00 0.00 53.44 49.34 1oy0 n ALA 93 Cb 0.56 -0.94 1.03 0.00 0.00 0.00 0.00 19.45 20.10 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 5.03 0.00 0.00 0.00 0.11 -1.79 -2.77 132.00 132.58 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 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1oy0 h PRO 94 CO 0.68 0.02 -1.06 0.72 -0.21 0.00 0.00 178.00 178.14 1oy0 n HIS 95 N -3.37 0.00 -2.68 0.65 8.25 -1.26 -4.81 115.22 112.00 1oy0 n HIS 95 Ca -0.03 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.15 1oy0 n HIS 95 Cb 0.12 -0.11 -0.01 0.00 1.12 0.00 0.00 29.99 31.11 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 -2.75 3.38 -0.47 -1.41 0.00 -1.05 -0.63 121.76 118.84 1oy0 s ALA 96 Ca 0.03 -0.40 -0.20 0.00 0.00 0.00 0.00 51.96 51.39 1oy0 s ALA 96 Cb 0.12 -2.64 0.04 0.00 0.00 0.00 0.00 23.12 20.64 1oy0 s ALA 96 CO 0.69 -0.25 0.64 -1.17 0.00 0.00 0.00 175.76 175.67 1oy0 s LEU 97 N -4.48 4.64 -0.26 0.00 2.96 0.40 -4.69 118.68 117.27 1oy0 s LEU 97 Ca 0.49 -0.55 -0.20 0.00 -0.22 0.00 0.00 54.13 53.65 1oy0 s LEU 97 Cb -0.10 -2.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.95 1oy0 s LEU 97 CO 0.41 -0.83 0.62 -0.69 -1.32 0.00 0.00 176.35 174.54 1oy0 s VAL 98 N 2.79 4.99 -0.19 1.68 1.01 -1.26 -1.55 120.40 127.87 1oy0 s VAL 98 Ca 0.20 1.10 -0.06 0.00 0.00 0.00 0.00 61.98 63.23 1oy0 s VAL 98 Cb -0.16 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1oy0 s VAL 98 CO 0.16 0.03 0.02 -0.69 0.00 0.00 0.00 175.10 174.62 1oy0 s VAL 99 N 2.48 4.21 -0.20 2.92 1.01 0.58 -1.26 120.40 130.14 1oy0 s VAL 99 Ca 0.26 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.91 1oy0 s VAL 99 Cb -0.15 -2.89 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 1oy0 s VAL 99 CO 0.09 0.44 0.11 0.00 0.00 0.00 0.00 175.10 175.74 1oy0 s ALA 100 N 0.74 3.58 -0.09 5.51 0.00 0.14 -0.95 121.76 130.68 1oy0 s ALA 100 Ca 0.01 -0.74 -0.25 0.00 0.00 0.00 0.00 51.96 50.98 1oy0 s ALA 100 Cb -0.14 -2.10 -0.03 0.00 0.00 0.00 0.00 23.12 20.85 1oy0 s ALA 100 CO 0.02 0.11 0.80 0.34 0.00 0.00 0.00 175.76 177.03 1oy0 s ASP 101 N 0.47 7.04 -0.15 0.00 2.15 -1.08 -0.18 116.67 124.91 1oy0 s ASP 101 Ca 0.06 1.27 -0.29 0.00 0.43 0.00 0.00 52.55 54.02 1oy0 s ASP 101 Cb -0.12 -2.46 -0.00 0.00 -0.30 0.00 0.00 42.92 40.04 1oy0 s ASP 101 CO -0.00 -0.25 1.03 -0.76 -0.17 0.00 0.00 175.17 175.02 1oy0 s LEU 102 N 1.35 4.19 0.75 -1.34 1.43 -0.60 -4.81 118.68 119.65 1oy0 s LEU 102 Ca 0.40 1.49 -0.14 0.00 -1.03 0.00 0.00 54.13 54.84 1oy0 s LEU 102 Cb -0.18 -3.55 0.05 0.00 0.03 0.00 0.00 46.19 42.54 1oy0 s LEU 102 CO 0.18 -0.55 1.20 -2.84 0.23 0.00 0.00 176.35 174.57 1oy0 s PRO 103 N 2.53 2.06 0.21 1.29 0.02 -1.26 -4.81 135.00 135.04 1oy0 s PRO 103 Ca 0.47 1.72 -0.32 0.00 0.02 0.00 0.00 61.00 62.89 1oy0 s PRO 103 Cb -0.17 -1.83 -0.13 0.00 0.02 0.00 0.00 34.50 32.39 1oy0 s PRO 103 CO 0.13 -1.89 1.51 0.34 -0.33 0.00 0.00 177.00 176.77 1oy0 n PHE 104 N -2.86 2.30 0.00 6.54 7.35 -1.26 -2.01 117.46 127.52 1oy0 n PHE 104 Ca 0.13 0.33 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 1oy0 n PHE 104 Cb 0.50 -2.52 0.00 0.00 0.35 0.00 0.00 39.48 37.82 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 2.76 2.49 0.04 7.13 0.00 -1.26 -4.92 105.19 111.43 1oy0 n GLY 105 Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.30 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 0.15 0.00 1.61 3.41 -0.85 -4.28 113.62 113.66 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 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 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 -1.17 0.00 0.23 7.33 0.18 -1.26 -3.50 117.16 118.97 1oy0 n TYR 107 Ca 0.15 0.00 0.10 0.00 1.88 0.00 0.00 57.90 60.03 1oy0 n TYR 107 Cb 0.25 0.00 0.54 0.00 -0.38 0.00 0.00 39.34 39.75 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 -2.95 114.58 109.28 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 0.21 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 1oy0 h GLU 108 CO 0.00 0.21 -0.18 0.00 -1.40 0.00 0.00 179.01 177.64 1oy0 h ALA 109 N 1.79 1.42 0.00 3.43 0.00 -1.89 -3.48 119.26 120.53 1oy0 h ALA 109 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1oy0 h ALA 109 Cb 0.62 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1oy0 h ALA 109 CO 0.03 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.92 1oy0 n GLY 110 N -0.73 -0.09 0.16 0.00 0.00 -1.12 -4.94 105.19 98.48 1oy0 n GLY 110 Ca -0.02 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.16 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 4.47 -0.14 -0.32 1.61 0.11 -1.87 -1.98 132.00 133.88 1oy0 h PRO 111 Ca 0.00 0.01 0.07 0.00 0.11 0.00 0.00 66.00 66.19 1oy0 h PRO 111 Cb 0.00 0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.06 1oy0 h PRO 111 CO 0.00 -0.09 -0.22 1.15 -0.21 0.00 0.00 178.00 178.62 1oy0 h THR 112 N -0.15 0.40 0.53 -1.15 2.02 -1.96 0.63 112.91 113.23 1oy0 h THR 112 Ca 0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 1oy0 h THR 112 Cb 0.26 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1oy0 h THR 112 CO -0.19 0.00 -0.27 0.00 0.37 0.00 0.00 175.52 175.43 1oy0 h ALA 113 N 0.97 -0.73 -0.83 6.16 0.00 -1.85 -1.75 119.26 121.22 1oy0 h ALA 113 Ca 0.17 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.05 1oy0 h ALA 113 Cb 0.44 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 1oy0 h ALA 113 CO -0.44 -0.91 0.44 0.00 0.00 0.00 0.00 179.25 178.34 1oy0 h ALA 114 N -0.26 1.23 -0.42 0.00 0.00 -0.80 -0.94 119.26 118.07 1oy0 h ALA 114 Ca -0.07 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1oy0 h ALA 114 Cb 0.57 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1oy0 h ALA 114 CO 0.11 -0.04 0.16 1.25 0.00 0.00 0.00 179.25 180.72 1oy0 h LEU 115 N 0.66 0.59 -0.44 0.00 5.85 0.45 -0.31 115.31 122.10 1oy0 h LEU 115 Ca 0.44 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 1oy0 h LEU 115 Cb 0.56 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1oy0 h LEU 115 CO -0.33 0.61 0.26 0.00 -0.34 0.00 0.00 178.44 178.64 1oy0 h ALA 116 N 1.00 0.57 0.15 1.25 0.00 -0.45 0.40 119.26 122.18 1oy0 h ALA 116 Ca 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1oy0 h ALA 116 Cb 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1oy0 h ALA 116 CO -0.01 0.06 -0.07 0.00 0.00 0.00 0.00 179.25 179.23 1oy0 h ALA 117 N 1.12 -0.20 -0.63 0.00 0.00 -0.99 -2.23 119.26 116.32 1oy0 h ALA 117 Ca 0.16 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1oy0 h ALA 117 Cb 0.01 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1oy0 h ALA 117 CO -0.03 -0.61 0.40 0.00 0.00 0.00 0.00 179.25 179.02 1oy0 h ALA 118 N 0.64 0.81 -0.57 0.00 0.00 -0.90 -1.70 119.26 117.55 1oy0 h ALA 118 Ca -0.02 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.94 1oy0 h ALA 118 Cb 0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1oy0 h ALA 118 CO 0.03 0.18 0.38 1.15 0.00 0.00 0.00 179.25 181.00 1oy0 h THR 119 N 0.81 0.93 -0.31 0.00 2.02 -0.71 -0.77 112.91 114.89 1oy0 h THR 119 Ca 0.24 -0.15 -0.08 0.00 0.77 0.00 0.00 66.41 67.19 1oy0 h THR 119 Cb -0.04 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 1oy0 h THR 119 CO -0.08 0.08 -0.11 0.03 0.37 0.00 0.00 175.52 175.81 1oy0 h ARG 120 N 0.44 0.62 0.00 6.66 3.08 -0.70 -0.12 114.38 124.36 1oy0 h ARG 120 Ca 0.26 -0.26 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1oy0 h ARG 120 Cb 0.44 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1oy0 h ARG 120 CO -0.07 0.83 -0.14 0.74 -1.07 0.00 0.00 179.97 180.26 1oy0 h PHE 121 N 0.38 0.00 0.00 3.04 -1.00 -0.75 0.15 116.94 118.76 1oy0 h PHE 121 Ca 0.07 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.82 1oy0 h PHE 121 Cb 0.62 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.18 1oy0 h PHE 121 CO 0.06 0.14 -0.41 -0.07 -1.61 0.00 0.00 178.31 176.41 1oy0 h LEU 122 N 0.00 0.00 -1.00 1.54 3.38 -1.11 -0.99 115.31 117.13 1oy0 h LEU 122 Ca -0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1oy0 h LEU 122 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1oy0 h LEU 122 CO 0.02 0.81 0.14 0.11 0.09 0.00 0.00 178.44 179.61 1oy0 h LYS 123 N -1.00 0.86 0.00 1.13 1.57 -1.05 -1.28 116.57 116.80 1oy0 h LYS 123 Ca -0.05 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.52 1oy0 h LYS 123 Cb 0.52 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 1oy0 h LYS 123 CO -0.03 0.77 -1.00 -3.47 -0.57 0.00 0.00 179.45 175.15 1oy0 n ASP 124 N -4.27 1.91 0.25 0.86 -0.08 0.45 -4.52 116.55 111.15 1oy0 n ASP 124 Ca 0.04 0.39 0.08 0.00 -1.51 0.00 0.00 54.79 53.80 1oy0 n ASP 124 Cb 0.23 -0.77 0.63 0.00 2.34 0.00 0.00 41.12 43.54 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 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1oy0 h GLY 125 CO -0.03 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.12 1oy0 n GLY 126 N -1.16 0.57 3.66 4.60 0.00 -0.48 -3.16 105.19 109.23 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 -2.04 1.25 -0.13 4.61 0.00 -0.61 -4.96 121.76 119.87 1oy0 s ALA 127 Ca 0.00 0.37 0.19 0.00 0.00 0.00 0.00 51.96 52.52 1oy0 s ALA 127 Cb 0.00 -3.37 -0.27 0.00 0.00 0.00 0.00 23.12 19.47 1oy0 s ALA 127 CO 0.00 -2.78 0.21 0.72 0.00 0.00 0.00 175.76 173.91 1oy0 n HIS 128 N -4.23 0.00 -3.81 0.00 8.25 -0.39 -4.58 115.22 110.46 1oy0 n HIS 128 Ca 0.10 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.46 1oy0 n HIS 128 Cb 0.53 -0.80 -0.04 0.00 1.12 0.00 0.00 29.99 30.80 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 -2.84 -0.80 0.17 -1.41 0.00 -1.11 -4.35 121.76 111.42 1oy0 s ALA 129 Ca -0.09 -0.38 0.08 0.00 0.00 0.00 0.00 51.96 51.57 1oy0 s ALA 129 Cb 0.09 0.89 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1oy0 s ALA 129 CO 0.84 -0.83 -0.16 0.14 0.00 0.00 0.00 175.76 175.75 1oy0 s VAL 130 N -3.91 1.68 -0.19 0.00 -7.23 -0.77 0.25 120.40 110.22 1oy0 s VAL 130 Ca 0.12 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.26 1oy0 s VAL 130 Cb -0.01 -1.87 -0.01 0.00 0.56 0.00 0.00 36.38 35.05 1oy0 s VAL 130 CO 0.01 -0.46 -0.07 -0.75 -0.31 0.00 0.00 175.10 173.51 1oy0 s LYS 131 N -3.14 3.39 -0.26 4.82 2.20 0.75 -0.61 119.74 126.88 1oy0 s LYS 131 Ca 0.17 -0.64 -0.03 0.00 -0.36 0.00 0.00 55.97 55.11 1oy0 s LYS 131 Cb -0.03 -2.89 0.02 0.00 -1.51 0.00 0.00 37.83 33.42 1oy0 s LYS 131 CO 0.06 -0.05 -0.02 -1.17 -0.36 0.00 0.00 175.35 173.81 1oy0 s LEU 132 N 1.08 3.42 -0.02 5.43 2.96 -0.78 -1.56 118.68 129.21 1oy0 s LEU 132 Ca 0.01 -0.84 -0.25 0.00 -0.22 0.00 0.00 54.13 52.83 1oy0 s LEU 132 Cb -0.15 -1.73 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1oy0 s LEU 132 CO -0.01 -0.15 0.77 -0.70 -1.32 0.00 0.00 176.35 174.94 1oy0 s GLU 133 N 1.37 4.48 0.00 1.98 2.12 -1.26 -3.01 118.70 124.39 1oy0 s GLU 133 Ca 0.01 1.04 0.00 0.00 0.36 0.00 0.00 54.97 56.38 1oy0 s GLU 133 Cb -0.17 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.80 1oy0 s GLU 133 CO -0.02 0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.23 1oy0 n GLY 134 N 2.82 2.96 0.00 -1.50 0.00 -0.18 -4.96 105.19 104.33 1oy0 n GLY 134 Ca -0.00 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.75 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 -1.40 2.62 0.29 -0.02 0.00 -1.26 -4.42 105.19 101.00 1oy0 n GLY 135 Ca 0.00 -1.78 0.09 0.00 0.00 0.00 0.00 46.02 44.33 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 0.16 0.00 1.61 5.08 -1.86 0.91 114.58 120.48 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 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1oy0 h GLU 136 CO 0.00 0.11 0.48 0.07 -1.00 0.00 0.00 179.01 178.67 1oy0 h ARG 137 N 0.16 0.00 -0.17 2.33 0.11 -1.99 0.78 114.38 115.60 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 0.90 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.98 1oy0 h ARG 137 CO -0.65 0.00 0.00 0.28 0.10 0.00 0.00 179.97 179.70 1oy0 n VAL 138 N -2.47 0.42 -0.25 0.08 0.31 0.31 -4.62 118.33 112.11 1oy0 n VAL 138 Ca -0.01 -0.71 -0.01 0.00 -0.01 0.00 0.00 64.34 63.60 1oy0 n VAL 138 Cb 0.51 0.94 0.10 0.00 -0.91 0.00 0.00 33.84 34.49 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 2.36 0.95 -0.59 3.52 0.00 -0.89 -1.53 119.26 123.07 1oy0 h ALA 139 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1oy0 h ALA 139 Cb 0.62 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1oy0 h ALA 139 CO 0.00 0.11 0.26 1.49 0.00 0.00 0.00 179.25 181.11 1oy0 h GLU 140 N 0.76 0.46 -0.24 0.00 4.81 -1.82 0.11 114.58 118.66 1oy0 h GLU 140 Ca 0.31 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1oy0 h GLU 140 Cb 0.17 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1oy0 h GLU 140 CO -0.17 0.31 0.08 1.96 -0.73 0.00 0.00 179.01 180.45 1oy0 h GLN 141 N 0.48 0.37 -0.88 1.92 7.50 -1.71 -1.77 115.11 121.02 1oy0 h GLN 141 Ca 0.28 -0.08 0.03 0.00 0.50 0.00 0.00 58.65 59.39 1oy0 h GLN 141 Cb 0.29 -0.05 -0.05 0.00 0.05 0.00 0.00 27.48 27.71 1oy0 h GLN 141 CO -0.25 0.45 0.57 0.82 -1.50 0.00 0.00 178.83 178.93 1oy0 h ILE 142 N 0.22 1.15 -0.24 2.54 2.04 -0.63 -2.04 117.51 120.56 1oy0 h ILE 142 Ca 0.08 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1oy0 h ILE 142 Cb 0.23 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.24 1oy0 h ILE 142 CO -0.00 0.20 0.12 0.00 0.00 0.00 0.00 178.15 178.47 1oy0 h ALA 143 N 1.36 0.31 0.04 1.87 0.00 -0.57 -0.66 119.26 121.61 1oy0 h ALA 143 Ca 0.35 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1oy0 h ALA 143 Cb -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1oy0 h ALA 143 CO -0.11 -0.14 -0.14 0.00 0.00 0.00 0.00 179.25 178.86 1oy0 h LEU 145 N -0.26 -0.24 -0.73 0.00 3.38 -1.32 -0.42 115.31 115.72 1oy0 h LEU 145 Ca 0.03 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.13 1oy0 h LEU 145 Cb 0.30 0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.05 1oy0 h LEU 145 CO -0.11 -0.15 0.35 0.74 0.09 0.00 0.00 178.44 179.37 1oy0 h THR 146 N -0.22 0.79 0.00 0.22 2.02 -0.94 0.25 112.91 115.02 1oy0 h THR 146 Ca -0.00 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 66.94 1oy0 h THR 146 Cb 0.20 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 1oy0 h THR 146 CO -0.01 0.10 -0.21 0.00 0.37 0.00 0.00 175.52 175.78 1oy0 h ALA 147 N 1.47 1.10 0.00 6.16 0.00 -0.52 -1.78 119.26 125.69 1oy0 h ALA 147 Ca 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1oy0 h ALA 147 Cb 0.45 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1oy0 h ALA 147 CO -0.31 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.20 1oy0 n ALA 148 N -2.25 2.19 -0.10 0.00 0.00 0.73 -4.87 120.51 116.21 1oy0 n ALA 148 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1oy0 n ALA 148 Cb 0.37 -1.44 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 1.16 0.94 3.46 0.00 0.00 -0.67 -5.07 105.19 105.01 1oy0 n GLY 149 Ca 0.06 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 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 4.77 0.13 -0.61 1.01 -0.41 -5.00 121.20 119.08 1oy0 s ILE 150 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 60.65 59.95 1oy0 s ILE 150 Cb 0.00 -3.45 -0.10 0.00 0.01 0.00 0.00 42.46 38.92 1oy0 s ILE 150 CO 0.00 0.04 1.75 -2.84 0.00 0.00 0.00 174.94 173.88 1oy0 s PRO 151 N 1.64 4.16 -0.11 2.79 0.02 -1.26 -3.45 135.00 138.78 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 -3.47 0.00 0.00 0.02 0.00 0.00 34.50 30.88 1oy0 s PRO 151 CO 0.07 -0.78 -0.22 0.08 -0.33 0.00 0.00 177.00 175.82 1oy0 s VAL 152 N 2.32 2.18 -0.26 3.83 1.01 -1.26 -1.85 120.40 126.36 1oy0 s VAL 152 Ca 0.77 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 61.69 1oy0 s VAL 152 Cb -0.45 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1oy0 s VAL 152 CO 0.34 0.55 0.15 -0.32 0.00 0.00 0.00 175.10 175.83 1oy0 s MET 153 N 0.46 3.90 0.80 2.72 1.75 0.22 -1.40 119.30 127.75 1oy0 s MET 153 Ca -0.15 -0.35 -0.11 0.00 -1.25 0.00 0.00 55.69 53.83 1oy0 s MET 153 Cb -0.17 -3.55 0.09 0.00 2.84 0.00 0.00 34.83 34.03 1oy0 s MET 153 CO 0.06 -0.13 1.15 0.00 -0.65 0.00 0.00 175.02 175.46 1oy0 s ALA 154 N 1.57 2.74 -0.26 4.11 0.00 0.05 -1.86 121.76 128.10 1oy0 s ALA 154 Ca 0.07 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 1oy0 s ALA 154 Cb -0.15 -2.86 0.15 0.00 0.00 0.00 0.00 23.12 20.25 1oy0 s ALA 154 CO 0.08 -1.65 0.42 -1.58 0.00 0.00 0.00 175.76 173.03 1oy0 s HIS 155 N -3.53 -1.00 0.28 0.00 5.04 -1.16 -0.48 115.29 114.44 1oy0 s HIS 155 Ca 0.63 0.92 0.12 0.00 -1.54 0.00 0.00 55.06 55.19 1oy0 s HIS 155 Cb -0.10 0.09 -0.05 0.00 0.04 0.00 0.00 32.58 32.56 1oy0 s HIS 155 CO 0.48 -0.78 -0.19 0.96 -2.34 0.00 0.00 174.74 172.86 1oy0 s ILE 156 N 2.60 2.51 0.11 0.89 -4.36 0.29 -1.01 121.20 122.24 1oy0 s ILE 156 Ca 0.14 -2.38 0.02 0.00 -0.26 0.00 0.00 60.65 58.17 1oy0 s ILE 156 Cb -0.15 -2.31 -0.01 0.00 1.25 0.00 0.00 42.46 41.24 1oy0 s ILE 156 CO -0.19 -0.39 0.09 0.61 0.24 0.00 0.00 174.94 175.30 1oy0 n GLY 157 N -0.60 3.69 2.98 6.27 0.00 -1.26 -2.27 105.19 114.00 1oy0 n GLY 157 Ca -0.05 -1.78 -0.30 0.00 0.00 0.00 0.00 46.02 43.89 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 -2.38 2.08 -0.38 1.61 5.36 -1.25 -4.58 117.98 118.44 1oy0 s PHE 158 Ca 0.12 -1.23 0.02 0.00 -0.96 0.00 0.00 56.93 54.89 1oy0 s PHE 158 Cb 0.01 -1.53 0.11 0.00 -0.34 0.00 0.00 43.02 41.27 1oy0 s PHE 158 CO 0.09 -0.66 0.14 0.95 -1.46 0.00 0.00 175.22 174.27 1oy0 s THR 159 N 1.51 1.67 0.28 0.12 -4.23 -1.26 -4.92 115.64 108.81 1oy0 s THR 159 Ca 0.03 -2.22 -0.27 0.00 -1.18 0.00 0.00 61.69 58.06 1oy0 s THR 159 Cb -0.14 -2.21 -0.15 0.00 1.34 0.00 0.00 72.50 71.34 1oy0 s THR 159 CO -0.09 -0.72 0.71 -2.65 -0.54 0.00 0.00 174.62 171.32 1oy0 n PRO 160 N 4.14 0.65 0.00 3.99 -0.02 -1.26 -4.71 135.00 137.78 1oy0 n PRO 160 Ca 0.03 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1oy0 n PRO 160 Cb 0.39 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 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 1.66 1.93 0.34 -1.23 0.00 -1.26 -5.03 105.19 101.60 1oy0 n GLY 175 Ca 0.13 0.10 0.17 0.00 0.00 0.00 0.00 46.02 46.43 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 -0.38 1.61 3.32 -2.01 -1.78 116.42 117.18 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 -0.10 0.00 -1.72 0.00 0.00 179.24 177.42 1oy0 h ALA 177 N 1.77 0.25 -0.32 3.45 0.00 -1.96 0.02 119.26 122.47 1oy0 h ALA 177 Ca 0.11 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.21 1oy0 h ALA 177 Cb 0.56 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1oy0 h ALA 177 CO -0.00 -0.46 0.22 0.00 0.00 0.00 0.00 179.25 179.01 1oy0 h ALA 178 N 1.37 1.99 0.07 0.00 0.00 -1.69 -0.17 119.26 120.83 1oy0 h ALA 178 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1oy0 h ALA 178 Cb 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1oy0 h ALA 178 CO -0.40 -0.05 -0.03 0.93 0.00 0.00 0.00 179.25 179.70 1oy0 h GLU 179 N 0.25 -0.08 -0.49 0.00 5.08 -1.10 -2.42 114.58 115.81 1oy0 h GLU 179 Ca 0.14 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1oy0 h GLU 179 Cb 0.24 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1oy0 h GLU 179 CO -0.03 0.21 0.29 0.37 -1.00 0.00 0.00 179.01 178.85 1oy0 h GLN 180 N -0.38 0.56 -0.54 2.33 5.75 -0.34 0.15 115.11 122.64 1oy0 h GLN 180 Ca -0.01 -0.03 0.09 0.00 -0.15 0.00 0.00 58.65 58.55 1oy0 h GLN 180 Cb 0.33 -0.13 -0.07 0.00 1.07 0.00 0.00 27.48 28.68 1oy0 h GLN 180 CO 0.01 0.37 0.13 1.15 -2.65 0.00 0.00 178.83 177.85 1oy0 h THR 181 N 0.58 0.72 -0.13 2.39 2.02 -1.04 0.42 112.91 117.86 1oy0 h THR 181 Ca 0.20 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.28 1oy0 h THR 181 Cb 0.03 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1oy0 h THR 181 CO -0.09 0.05 0.07 0.40 0.37 0.00 0.00 175.52 176.32 1oy0 h ILE 182 N 0.28 1.10 -0.72 3.11 2.04 -0.83 0.16 117.51 122.65 1oy0 h ILE 182 Ca 0.28 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1oy0 h ILE 182 Cb 0.37 1.05 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 1oy0 h ILE 182 CO -0.34 0.09 0.41 0.00 0.00 0.00 0.00 178.15 178.31 1oy0 h ALA 183 N 0.96 0.97 -0.13 1.87 0.00 0.34 0.04 119.26 123.31 1oy0 h ALA 183 Ca 0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1oy0 h ALA 183 Cb 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1oy0 h ALA 183 CO -0.01 0.09 0.05 -0.44 0.00 0.00 0.00 179.25 178.94 1oy0 h ASP 184 N 0.74 0.19 -0.76 0.00 3.32 0.20 0.20 116.42 120.31 1oy0 h ASP 184 Ca 0.32 -0.17 0.09 0.00 0.02 0.00 0.00 57.03 57.29 1oy0 h ASP 184 Cb 0.20 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 1oy0 h ASP 184 CO -0.19 0.31 0.41 0.00 -1.72 0.00 0.00 179.24 178.05 1oy0 h ALA 185 N 0.88 1.07 0.34 3.45 0.00 -0.06 0.21 119.26 125.15 1oy0 h ALA 185 Ca 0.04 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1oy0 h ALA 185 Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1oy0 h ALA 185 CO -0.00 0.02 -0.16 0.82 0.00 0.00 0.00 179.25 179.93 1oy0 h ILE 186 N 0.69 0.59 -0.47 0.00 2.04 -0.72 -2.65 117.51 117.00 1oy0 h ILE 186 Ca 0.37 -0.65 0.08 0.00 1.00 0.00 0.00 64.86 65.66 1oy0 h ILE 186 Cb 0.36 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 1oy0 h ILE 186 CO -0.25 0.11 0.10 0.00 0.00 0.00 0.00 178.15 178.11 1oy0 h ALA 187 N -0.40 0.53 -0.57 1.87 0.00 -0.35 0.06 119.26 120.39 1oy0 h ALA 187 Ca -0.05 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1oy0 h ALA 187 Cb 0.53 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1oy0 h ALA 187 CO 0.08 -0.30 0.30 0.28 0.00 0.00 0.00 179.25 179.61 1oy0 h VAL 188 N 0.24 0.97 -0.42 0.00 2.07 -0.64 0.53 116.25 118.99 1oy0 h VAL 188 Ca 0.23 -0.20 -0.15 0.00 0.82 0.00 0.00 66.70 67.40 1oy0 h VAL 188 Cb 0.29 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1oy0 h VAL 188 CO -0.29 0.11 -0.32 0.00 0.02 0.00 0.00 177.57 177.08 1oy0 h ALA 189 N 1.30 0.62 -0.92 1.67 0.00 -1.06 -2.78 119.26 118.09 1oy0 h ALA 189 Ca 0.25 -0.43 0.04 0.00 0.00 0.00 0.00 54.91 54.77 1oy0 h ALA 189 Cb 0.14 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1oy0 h ALA 189 CO -0.16 0.68 0.60 0.93 0.00 0.00 0.00 179.25 181.30 1oy0 h GLU 190 N 0.80 1.10 0.00 0.00 4.39 -0.42 -1.27 114.58 119.18 1oy0 h GLU 190 Ca 0.08 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1oy0 h GLU 190 Cb 0.91 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1oy0 h GLU 190 CO 0.08 0.73 -0.05 0.00 -1.16 0.00 0.00 179.01 178.62 1oy0 h ALA 191 N 1.47 1.22 0.00 3.43 0.00 -0.63 -3.46 119.26 121.29 1oy0 h ALA 191 Ca 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1oy0 h ALA 191 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1oy0 h ALA 191 CO -0.12 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1oy0 n GLY 192 N -0.82 0.95 3.60 0.00 0.00 -0.48 -3.48 105.19 104.96 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 -0.50 1.12 4.61 0.00 -1.15 -4.76 120.51 119.83 1oy0 n ALA 193 Ca 0.00 0.48 0.14 0.00 0.00 0.00 0.00 53.44 54.06 1oy0 n ALA 193 Cb 0.00 -2.09 0.63 0.00 0.00 0.00 0.00 19.45 17.99 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 2.08 0.00 -3.64 0.00 1.16 -0.49 -4.79 117.46 111.78 1oy0 n PHE 194 Ca 0.16 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.71 1oy0 n PHE 194 Cb 0.23 -0.42 -0.01 0.00 -1.61 0.00 0.00 39.48 37.67 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 -2.88 -1.94 -0.06 1.98 0.00 -1.26 -4.20 121.76 113.41 1oy0 s ALA 195 Ca 0.18 0.74 -0.05 0.00 0.00 0.00 0.00 51.96 52.83 1oy0 s ALA 195 Cb 0.19 0.37 0.02 0.00 0.00 0.00 0.00 23.12 23.70 1oy0 s ALA 195 CO 0.52 -0.90 0.15 0.54 0.00 0.00 0.00 175.76 176.07 1oy0 s VAL 196 N -2.84 -0.01 -0.15 0.00 0.11 -0.71 -0.77 120.40 116.03 1oy0 s VAL 196 Ca 0.11 0.02 -0.15 0.00 -2.93 0.00 0.00 61.98 59.03 1oy0 s VAL 196 Cb 0.01 -0.22 -0.05 0.00 -1.53 0.00 0.00 36.38 34.59 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 0.20 5.28 -0.33 2.04 1.01 0.36 0.19 120.40 129.15 1oy0 s VAL 197 Ca -0.01 0.63 -0.03 0.00 0.00 0.00 0.00 61.98 62.57 1oy0 s VAL 197 Cb -0.02 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.74 1oy0 s VAL 197 CO -0.01 0.38 0.06 -0.04 0.00 0.00 0.00 175.10 175.49 1oy0 s MET 198 N 0.47 2.44 -0.18 2.72 -1.94 0.08 -0.54 119.30 122.36 1oy0 s MET 198 Ca 0.18 -1.31 -0.04 0.00 -1.71 0.00 0.00 55.69 52.82 1oy0 s MET 198 Cb -0.13 -3.32 -0.02 0.00 2.01 0.00 0.00 34.83 33.37 1oy0 s MET 198 CO 0.05 -0.69 -0.04 -2.00 -0.01 0.00 0.00 175.02 172.33 1oy0 s GLU 199 N 1.29 3.55 -1.27 2.03 2.12 -0.96 -2.55 118.70 122.91 1oy0 s GLU 199 Ca -0.02 -0.57 -0.03 0.00 0.36 0.00 0.00 54.97 54.70 1oy0 s GLU 199 Cb -0.20 -2.93 0.01 0.00 0.26 0.00 0.00 34.13 31.26 1oy0 s GLU 199 CO -0.00 0.09 1.06 -1.33 -0.54 0.00 0.00 175.26 174.54 1oy0 n MET 200 N 3.97 -7.06 -4.52 4.30 2.81 -1.00 -3.94 117.12 111.68 1oy0 n MET 200 Ca -0.18 0.83 -0.33 0.00 -1.81 0.00 0.00 57.70 56.21 1oy0 n MET 200 Cb 0.52 -5.85 -0.13 0.00 -0.71 0.00 0.00 33.22 27.05 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 -3.35 3.63 -0.28 2.03 1.01 -1.01 -4.01 120.40 118.42 1oy0 s VAL 201 Ca 0.23 -0.45 -0.40 0.00 0.00 0.00 0.00 61.98 61.35 1oy0 s VAL 201 Cb -0.10 -2.57 -0.15 0.00 0.00 0.00 0.00 36.38 33.55 1oy0 s VAL 201 CO 0.73 0.50 1.76 -2.65 0.00 0.00 0.00 175.10 175.45 1oy0 n PRO 202 N 3.51 1.19 -0.33 2.72 -0.02 -1.26 -4.19 135.00 136.63 1oy0 n PRO 202 Ca -0.18 0.44 0.27 0.00 -2.02 0.00 0.00 63.50 62.01 1oy0 n PRO 202 Cb 0.53 -2.13 0.51 0.00 -0.02 0.00 0.00 33.50 32.38 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 7.33 1.92 0.65 3.55 0.00 -1.89 0.17 119.26 130.98 1oy0 h ALA 203 Ca -0.46 0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1oy0 h ALA 203 Cb 1.32 0.36 0.01 0.00 0.00 0.00 0.00 17.79 19.47 1oy0 h ALA 203 CO 0.96 -0.81 -0.31 0.93 0.00 0.00 0.00 179.25 180.02 1oy0 h GLU 204 N 0.05 -0.84 -0.72 0.00 4.39 -1.87 0.12 114.58 115.71 1oy0 h GLU 204 Ca 0.78 0.06 0.04 0.00 0.34 0.00 0.00 59.36 60.57 1oy0 h GLU 204 Cb 1.93 0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 30.73 1oy0 h GLU 204 CO -0.77 -0.56 0.44 1.25 -1.16 0.00 0.00 179.01 178.21 1oy0 h LEU 205 N -0.87 0.71 0.07 1.33 5.85 -1.24 -2.38 115.31 118.78 1oy0 h LEU 205 Ca -0.09 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.65 1oy0 h LEU 205 Cb 0.67 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1oy0 h LEU 205 CO 0.14 0.48 -0.14 0.00 -0.34 0.00 0.00 178.44 178.59 1oy0 h ALA 206 N 1.33 -0.21 -0.59 1.25 0.00 -0.59 -1.20 119.26 119.25 1oy0 h ALA 206 Ca 0.30 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.31 1oy0 h ALA 206 Cb 0.07 0.22 -0.12 0.00 0.00 0.00 0.00 17.79 17.96 1oy0 h ALA 206 CO -0.13 -0.65 -0.26 1.15 0.00 0.00 0.00 179.25 179.36 1oy0 h THR 207 N -0.26 0.26 0.92 0.00 2.02 -0.26 0.16 112.91 115.75 1oy0 h THR 207 Ca 0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 1oy0 h THR 207 Cb 0.29 0.26 0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1oy0 h THR 207 CO -0.09 0.00 -0.46 1.56 0.37 0.00 0.00 175.52 176.90 1oy0 h GLN 208 N -0.10 -1.22 -0.83 6.66 4.20 -1.18 -1.72 115.11 120.92 1oy0 h GLN 208 Ca 0.26 0.08 0.21 0.00 0.06 0.00 0.00 58.65 59.26 1oy0 h GLN 208 Cb 0.52 0.28 -0.13 0.00 0.30 0.00 0.00 27.48 28.44 1oy0 h GLN 208 CO -0.66 -0.81 0.17 0.82 -0.67 0.00 0.00 178.83 177.69 1oy0 h ILE 209 N -1.27 0.36 -0.37 2.54 2.04 -0.62 0.79 117.51 120.98 1oy0 h ILE 209 Ca -0.13 -0.07 0.05 0.00 1.00 0.00 0.00 64.86 65.72 1oy0 h ILE 209 Cb 0.98 0.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 1oy0 h ILE 209 CO 0.19 0.04 0.10 0.74 0.00 0.00 0.00 178.15 179.22 1oy0 h THR 210 N 0.20 0.85 0.00 -0.27 2.02 -0.46 0.11 112.91 115.36 1oy0 h THR 210 Ca 0.49 -0.08 -0.11 0.00 0.77 0.00 0.00 66.41 67.48 1oy0 h THR 210 Cb 0.94 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1oy0 h THR 210 CO -0.63 0.04 -0.52 1.23 0.37 0.00 0.00 175.52 176.02 1oy0 h GLY 211 N 0.24 0.00 2.00 2.16 0.00 0.77 -3.18 103.07 105.05 1oy0 h GLY 211 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.42 1oy0 h GLY 211 CO -0.21 0.00 -0.39 1.70 0.00 0.00 0.00 176.54 177.64 1oy0 h LYS 212 N 0.00 0.00 -6.39 4.80 3.64 0.14 -3.46 116.57 115.30 1oy0 h LYS 212 Ca -0.01 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.83 1oy0 h LYS 212 Cb 0.94 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.73 1oy0 h LYS 212 CO 0.07 0.39 -0.16 -0.51 -2.27 0.00 0.00 179.45 176.97 1oy0 s LEU 213 N -6.47 4.16 0.05 5.20 1.43 0.27 -4.99 118.68 118.33 1oy0 s LEU 213 Ca 0.04 0.79 0.10 0.00 -1.03 0.00 0.00 54.13 54.03 1oy0 s LEU 213 Cb 0.08 -3.56 -0.21 0.00 0.03 0.00 0.00 46.19 42.53 1oy0 s LEU 213 CO 0.72 -0.08 1.01 0.74 0.23 0.00 0.00 176.35 178.97 1oy0 h THR 214 N 1.84 1.27 -3.55 5.49 2.02 -1.89 -3.46 112.91 114.63 1oy0 h THR 214 Ca -0.47 -3.02 -0.50 0.00 0.77 0.00 0.00 66.41 63.19 1oy0 h THR 214 Cb 1.17 2.62 -0.00 0.00 -1.74 0.00 0.00 68.15 70.20 1oy0 h THR 214 CO 0.69 0.72 0.04 0.27 0.37 0.00 0.00 175.52 177.61 1oy0 s ILE 215 N -2.68 4.86 0.57 3.11 -4.36 -1.26 -5.03 121.20 116.41 1oy0 s ILE 215 Ca -0.01 0.45 -0.20 0.00 -0.26 0.00 0.00 60.65 60.63 1oy0 s ILE 215 Cb 0.09 -3.73 -0.04 0.00 1.25 0.00 0.00 42.46 40.03 1oy0 s ILE 215 CO 0.82 -0.46 1.29 -2.84 0.24 0.00 0.00 174.94 174.00 1oy0 s PRO 216 N -3.75 3.03 -0.13 0.37 0.02 -1.26 -4.86 135.00 128.43 1oy0 s PRO 216 Ca 0.49 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.58 1oy0 s PRO 216 Cb -0.10 -2.11 -0.01 0.00 0.02 0.00 0.00 34.50 32.30 1oy0 s PRO 216 CO 0.31 -1.23 -0.14 0.95 -0.33 0.00 0.00 177.00 176.56 1oy0 s THR 217 N -1.41 2.96 -0.24 0.99 -4.23 -1.26 -1.74 115.64 110.71 1oy0 s THR 217 Ca 0.75 -0.69 -0.04 0.00 -1.18 0.00 0.00 61.69 60.52 1oy0 s THR 217 Cb -0.37 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.24 1oy0 s THR 217 CO 0.42 0.53 -0.01 -0.69 -0.54 0.00 0.00 174.62 174.32 1oy0 s VAL 218 N 0.36 3.46 0.20 2.29 1.01 0.13 -1.31 120.40 126.54 1oy0 s VAL 218 Ca -0.11 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.30 1oy0 s VAL 218 Cb -0.16 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 1oy0 s VAL 218 CO 0.06 0.30 0.21 -0.83 0.00 0.00 0.00 175.10 174.84 1oy0 s GLY 219 N 1.46 1.55 -0.28 4.51 0.00 -0.11 -0.74 107.32 113.71 1oy0 s GLY 219 Ca 0.04 -1.25 0.01 0.00 0.00 0.00 0.00 44.72 43.52 1oy0 s GLY 219 CO -0.02 -1.27 0.39 -1.50 0.00 0.00 0.00 173.10 170.71 1oy0 s ILE 220 N -1.90 -0.61 -0.70 0.90 2.07 -1.06 -0.71 121.20 119.19 1oy0 s ILE 220 Ca 0.33 -0.27 -0.02 0.00 -1.41 0.00 0.00 60.65 59.27 1oy0 s ILE 220 Cb -0.09 -0.96 0.00 0.00 0.13 0.00 0.00 42.46 41.54 1oy0 s ILE 220 CO 0.25 -0.27 0.32 0.61 -1.91 0.00 0.00 174.94 173.94 1oy0 n GLY 221 N 5.35 0.15 0.07 1.50 0.00 -1.26 -2.36 105.19 108.63 1oy0 n GLY 221 Ca -0.00 -0.35 0.01 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.75 2.44 0.00 4.61 0.00 -1.26 -2.40 120.51 121.15 1oy0 n ALA 222 Ca -0.04 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1oy0 n ALA 222 Cb 0.55 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 0.32 0.94 0.05 0.00 0.00 -1.26 -3.74 105.19 101.49 1oy0 n GLY 223 Ca 0.01 -2.09 0.13 0.00 0.00 0.00 0.00 46.02 44.08 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 0.70 0.13 -2.31 1.61 -0.04 -1.26 -4.49 135.00 129.35 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 6.49 -3.95 3.54 3.02 -1.26 -4.89 115.26 116.35 1oy0 n ASN 225 Ca 0.06 -3.20 -0.13 0.00 -0.03 0.00 0.00 54.58 51.27 1oy0 n ASN 225 Cb 0.39 -1.39 -0.13 0.00 -0.61 0.00 0.00 39.78 38.03 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 5.64 0.00 -5.04 0.00 3.32 -1.54 -3.44 116.42 115.35 1oy0 h ASP 227 Ca -0.28 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.80 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 0.48 0.00 0.16 -0.83 -1.72 0.00 0.00 179.24 177.33 1oy0 s GLY 228 N -3.95 -0.06 0.12 2.75 0.00 -0.55 -2.83 107.32 102.80 1oy0 s GLY 228 Ca -0.04 -0.29 0.07 0.00 0.00 0.00 0.00 44.72 44.46 1oy0 s GLY 228 CO 0.38 -0.15 -0.18 1.20 0.00 0.00 0.00 173.10 174.35 1oy0 s GLN 229 N -3.91 1.11 -0.02 2.90 -1.52 -0.69 -0.94 119.66 116.59 1oy0 s GLN 229 Ca 0.11 -1.23 -0.01 0.00 -1.95 0.00 0.00 55.36 52.28 1oy0 s GLN 229 Cb -0.04 -1.18 0.01 0.00 -0.22 0.00 0.00 33.01 31.58 1oy0 s GLN 229 CO 0.04 0.25 0.04 0.54 -0.25 0.00 0.00 175.29 175.92 1oy0 s VAL 230 N -1.69 -0.02 0.03 1.09 0.11 0.11 0.46 120.40 120.49 1oy0 s VAL 230 Ca 0.09 0.06 -0.02 0.00 -2.93 0.00 0.00 61.98 59.18 1oy0 s VAL 230 Cb -0.07 -0.08 -0.02 0.00 -1.53 0.00 0.00 36.38 34.67 1oy0 s VAL 230 CO 0.04 0.02 0.00 -0.76 -3.33 0.00 0.00 175.10 171.08 1oy0 s LEU 231 N 0.33 2.20 -0.30 2.54 1.43 -1.06 -4.42 118.68 119.40 1oy0 s LEU 231 Ca -0.03 -0.63 -0.29 0.00 -1.03 0.00 0.00 54.13 52.15 1oy0 s LEU 231 Cb -0.04 0.25 0.01 0.00 0.03 0.00 0.00 46.19 46.44 1oy0 s LEU 231 CO -0.01 -0.42 1.17 -0.69 0.23 0.00 0.00 176.35 176.63 1oy0 s VAL 232 N -2.35 4.35 0.52 -1.59 1.01 -1.26 -2.13 120.40 118.95 1oy0 s VAL 232 Ca -0.08 1.55 0.33 0.00 0.00 0.00 0.00 61.98 63.79 1oy0 s VAL 232 Cb -0.03 -4.29 0.52 0.00 0.00 0.00 0.00 36.38 32.57 1oy0 s VAL 232 CO -0.04 -0.46 1.82 4.11 0.00 0.00 0.00 175.10 180.52 1oy0 h TRP 233 N 8.56 0.09 -0.98 5.22 5.08 -1.93 0.27 115.95 132.26 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 -0.03 -0.06 0.00 -3.00 0.00 0.00 29.16 27.16 1oy0 h TRP 233 CO 0.85 0.01 0.64 1.96 -1.28 0.00 0.00 178.44 180.62 1oy0 h GLN 234 N 0.05 1.21 0.05 0.12 1.08 -1.90 0.14 115.11 115.86 1oy0 h GLN 234 Ca 0.54 -0.07 -0.14 0.00 -1.45 0.00 0.00 58.65 57.53 1oy0 h GLN 234 Cb 2.07 -0.27 0.01 0.00 -0.05 0.00 0.00 27.48 29.24 1oy0 h GLN 234 CO -0.05 0.80 -0.58 -0.44 -0.95 0.00 0.00 178.83 177.62 1oy0 h ASP 235 N 1.24 0.42 -0.91 1.46 3.32 -0.84 0.39 116.42 121.51 1oy0 h ASP 235 Ca 0.39 -0.85 0.18 0.00 0.02 0.00 0.00 57.03 56.76 1oy0 h ASP 235 Cb -0.01 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 39.33 1oy0 h ASP 235 CO -0.12 1.23 0.59 -0.03 -1.72 0.00 0.00 179.24 179.18 1oy0 h MET 236 N -0.33 0.55 -0.28 3.56 4.05 -1.00 -2.00 114.93 119.47 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 1.36 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 32.03 1oy0 h MET 236 CO 0.11 0.37 0.00 0.00 0.23 0.00 0.00 176.91 177.62 1oy0 n ALA 237 N -2.46 2.81 -3.49 0.39 0.00 0.01 -0.78 120.51 117.00 1oy0 n ALA 237 Ca 0.19 -2.03 -0.17 0.00 0.00 0.00 0.00 53.44 51.43 1oy0 n ALA 237 Cb 0.58 -0.65 0.01 0.00 0.00 0.00 0.00 19.45 19.40 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 -0.25 -1.20 0.00 0.00 0.00 -0.75 -0.58 105.19 102.40 1oy0 n GLY 238 Ca 0.19 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.73 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 -2.74 0.00 -4.52 1.61 7.35 0.13 -0.18 117.46 119.11 1oy0 n PHE 239 Ca -0.14 0.00 -0.27 0.00 -0.76 0.00 0.00 57.45 56.29 1oy0 n PHE 239 Cb 0.59 -0.01 -0.17 0.00 0.35 0.00 0.00 39.48 40.25 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 -1.35 2.11 0.33 -2.13 1.04 -1.22 -4.80 113.70 107.69 1oy0 s SER 240 Ca 0.00 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.08 1oy0 s SER 240 Cb 0.01 -0.95 0.00 0.00 0.10 0.00 0.00 66.02 65.18 1oy0 s SER 240 CO 0.04 0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.89 1oy0 n GLY 241 N 4.03 0.75 0.00 7.32 0.00 -1.26 -4.59 105.19 111.43 1oy0 n GLY 241 Ca -0.20 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 2.20 0.39 -2.75 4.61 0.00 -1.26 -4.99 120.51 118.70 1oy0 n ALA 242 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 53.44 52.96 1oy0 n ALA 242 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.07 3.84 -0.39 0.00 2.20 -1.26 -4.97 119.74 119.09 1oy0 s LYS 243 Ca 0.00 -1.91 -0.28 0.00 -0.36 0.00 0.00 55.97 53.42 1oy0 s LYS 243 Cb 0.00 -5.23 0.02 0.00 -1.51 0.00 0.00 37.83 31.11 1oy0 s LYS 243 CO 0.00 -2.01 1.05 -0.08 -0.36 0.00 0.00 175.35 173.96 1oy0 s THR 244 N 3.33 4.42 1.24 3.43 -1.32 -1.26 -5.01 115.64 120.47 1oy0 s THR 244 Ca 0.44 1.38 -0.16 0.00 -1.21 0.00 0.00 61.69 62.14 1oy0 s THR 244 Cb -0.01 -4.46 0.30 0.00 -1.51 0.00 0.00 72.50 66.82 1oy0 s THR 244 CO -0.02 -0.69 1.01 0.00 -2.21 0.00 0.00 174.62 172.70 1oy0 s ALA 245 N 3.89 -0.37 0.18 11.08 0.00 -1.26 -4.88 121.76 130.40 1oy0 s ALA 245 Ca 0.44 -0.47 -0.13 0.00 0.00 0.00 0.00 51.96 51.80 1oy0 s ALA 245 Cb -0.10 -3.10 0.15 0.00 0.00 0.00 0.00 23.12 20.07 1oy0 s ALA 245 CO 0.22 -3.99 1.76 0.00 0.00 0.00 0.00 175.76 173.75 1oy0 h ARG 246 N -2.82 0.38 0.00 0.00 3.08 -2.05 -2.56 114.38 110.40 1oy0 h ARG 246 Ca -0.54 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.48 1oy0 h ARG 246 Cb 1.34 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1oy0 h ARG 246 CO 0.43 0.25 0.00 1.97 -1.07 0.00 0.00 179.97 181.55 1oy0 n PHE 247 N -4.97 0.00 -4.42 3.04 1.16 -1.26 -4.74 117.46 106.28 1oy0 n PHE 247 Ca 0.05 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.29 1oy0 n PHE 247 Cb 0.18 -0.18 -0.11 0.00 -1.61 0.00 0.00 39.48 37.75 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 -2.37 4.03 -0.20 1.97 1.01 -0.97 -4.54 120.40 119.33 1oy0 s VAL 248 Ca 0.23 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 61.83 1oy0 s VAL 248 Cb 0.14 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 1oy0 s VAL 248 CO 0.28 0.54 -0.00 -0.75 0.00 0.00 0.00 175.10 175.17 1oy0 s LYS 249 N -0.23 3.60 -0.77 2.72 2.20 -1.26 -4.68 119.74 121.32 1oy0 s LYS 249 Ca 0.04 -0.53 -0.26 0.00 -0.36 0.00 0.00 55.97 54.86 1oy0 s LYS 249 Cb -0.13 -3.08 0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1oy0 s LYS 249 CO 0.02 -0.01 1.32 0.50 -0.36 0.00 0.00 175.35 176.83 1oy0 s ARG 250 N 1.05 3.22 0.00 4.03 3.52 -1.26 -4.57 118.95 124.94 1oy0 s ARG 250 Ca 0.02 -0.32 0.30 0.00 -0.13 0.00 0.00 55.73 55.59 1oy0 s ARG 250 Cb -0.14 -4.34 1.77 0.00 -1.56 0.00 0.00 34.95 30.68 1oy0 s ARG 250 CO 0.01 -2.18 2.11 0.66 -0.81 0.00 0.00 175.30 175.09 1oy0 n TYR 251 N 9.45 0.00 -0.15 5.12 4.02 0.04 -4.93 117.16 130.72 1oy0 n TYR 251 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1oy0 n TYR 251 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.81 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 -0.99 0.00 -3.01 -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 53.44 1oy0 n ALA 252 Cb 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.52 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 0.44 2.89 0.10 0.00 4.64 -1.25 -3.16 116.55 120.21 1oy0 n ASP 253 Ca 0.00 -3.38 0.04 0.00 -1.38 0.00 0.00 54.79 50.08 1oy0 n ASP 253 Cb 0.00 -0.58 0.47 0.00 -1.04 0.00 0.00 41.12 39.97 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 2.15 1.10 0.30 5.18 2.07 -0.85 -0.72 116.25 125.47 1oy0 h VAL 254 Ca 0.12 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1oy0 h VAL 254 Cb 0.74 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1oy0 h VAL 254 CO 0.68 0.12 -0.14 1.23 0.02 0.00 0.00 177.57 179.47 1oy0 h GLY 255 N 0.46 -0.42 0.62 2.17 0.00 -0.66 -1.97 103.07 103.28 1oy0 h GLY 255 Ca 0.08 0.16 0.06 0.00 0.00 0.00 0.00 47.33 47.63 1oy0 h GLY 255 CO -0.01 -0.15 0.32 -1.33 0.00 0.00 0.00 176.54 175.37 1oy0 h GLY 256 N -0.62 0.90 0.79 4.60 0.00 -1.61 -0.29 103.07 106.85 1oy0 h GLY 256 Ca -0.04 -0.21 0.11 0.00 0.00 0.00 0.00 47.33 47.19 1oy0 h GLY 256 CO 0.07 0.11 0.51 -2.09 0.00 0.00 0.00 176.54 175.13 1oy0 h GLU 257 N 0.58 0.62 -0.01 4.80 4.22 -1.04 0.10 114.58 123.85 1oy0 h GLU 257 Ca 0.29 -0.04 -0.15 0.00 0.08 0.00 0.00 59.36 59.54 1oy0 h GLU 257 Cb 0.22 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1oy0 h GLU 257 CO -0.20 0.41 -0.68 1.25 -2.18 0.00 0.00 179.01 177.60 1oy0 h LEU 258 N 0.63 0.07 -0.19 1.64 5.85 -0.29 -2.83 115.31 120.19 1oy0 h LEU 258 Ca 0.37 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 1oy0 h LEU 258 Cb 0.56 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1oy0 h LEU 258 CO -0.14 0.73 0.10 0.03 -0.34 0.00 0.00 178.44 178.82 1oy0 h ARG 259 N 0.04 0.28 -0.02 1.25 3.08 0.22 -1.68 114.38 117.55 1oy0 h ARG 259 Ca -0.01 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1oy0 h ARG 259 Cb 1.20 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 1oy0 h ARG 259 CO 0.09 0.30 0.00 0.07 -1.07 0.00 0.00 179.97 179.36 1oy0 h ARG 260 N 0.19 0.04 -0.92 0.04 -0.00 -1.51 0.20 114.38 112.41 1oy0 h ARG 260 Ca 0.07 -0.01 0.26 0.00 -0.00 0.00 0.00 59.98 60.29 1oy0 h ARG 260 Cb 0.11 -0.00 -0.16 0.00 -0.00 0.00 0.00 29.97 29.91 1oy0 h ARG 260 CO -0.01 0.31 0.15 0.00 -0.00 0.00 0.00 179.97 180.42 1oy0 h ALA 261 N 0.73 1.25 -0.02 0.08 0.00 -1.41 1.62 119.26 121.51 1oy0 h ALA 261 Ca 0.01 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1oy0 h ALA 261 Cb 0.29 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1oy0 h ALA 261 CO 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 179.25 178.68 1oy0 h ALA 262 N 1.88 0.03 -0.75 0.00 0.00 -0.96 -1.39 119.26 118.07 1oy0 h ALA 262 Ca 0.58 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.23 1oy0 h ALA 262 Cb 1.22 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1oy0 h ALA 262 CO -0.78 -0.19 0.49 0.52 0.00 0.00 0.00 179.25 179.29 1oy0 h MET 263 N -0.45 0.97 -0.29 0.00 2.07 0.27 0.75 114.93 118.25 1oy0 h MET 263 Ca 0.00 -0.06 -0.06 0.00 -2.07 0.00 0.00 59.70 57.51 1oy0 h MET 263 Cb 0.55 -0.22 -0.01 0.00 -1.87 0.00 0.00 31.60 30.06 1oy0 h MET 263 CO 0.01 0.64 -0.05 0.37 1.07 0.00 0.00 176.91 178.95 1oy0 h GLN 264 N 1.00 0.55 -0.42 1.72 4.15 0.21 -1.70 115.11 120.62 1oy0 h GLN 264 Ca 0.28 -0.20 0.08 0.00 0.77 0.00 0.00 58.65 59.57 1oy0 h GLN 264 Cb -0.10 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.49 1oy0 h GLN 264 CO -0.07 0.73 -0.00 -0.92 -1.93 0.00 0.00 178.83 176.64 1oy0 h TYR 265 N 0.32 -0.03 -0.25 3.99 3.20 -0.85 -0.36 116.97 122.99 1oy0 h TYR 265 Ca 0.08 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.01 1oy0 h TYR 265 Cb 0.52 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.84 1oy0 h TYR 265 CO 0.05 -0.09 0.05 0.00 -1.64 0.00 0.00 178.16 176.53 1oy0 h ALA 266 N 1.37 0.26 -0.62 1.82 0.00 -0.62 -1.46 119.26 120.01 1oy0 h ALA 266 Ca 0.21 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1oy0 h ALA 266 Cb 0.30 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1oy0 h ALA 266 CO -0.35 -0.37 0.22 0.37 0.00 0.00 0.00 179.25 179.13 1oy0 h GLN 267 N 0.15 0.94 -0.33 0.00 4.15 -0.76 -1.02 115.11 118.25 1oy0 h GLN 267 Ca 0.11 -0.19 -0.04 0.00 0.77 0.00 0.00 58.65 59.31 1oy0 h GLN 267 Cb 0.11 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 1oy0 h GLN 267 CO -0.15 0.82 0.02 0.93 -1.93 0.00 0.00 178.83 178.52 1oy0 h GLU 268 N 0.87 0.50 -0.10 1.69 5.08 -0.83 0.61 114.58 122.41 1oy0 h GLU 268 Ca 0.20 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1oy0 h GLU 268 Cb 0.25 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1oy0 h GLU 268 CO -0.01 0.51 0.01 0.28 -1.00 0.00 0.00 179.01 178.81 1oy0 h VAL 269 N 0.49 1.22 -0.42 3.13 2.07 -0.82 0.84 116.25 122.77 1oy0 h VAL 269 Ca 0.11 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 1oy0 h VAL 269 Cb 0.28 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1oy0 h VAL 269 CO 0.01 0.20 0.07 0.00 0.02 0.00 0.00 177.57 177.86 1oy0 h ALA 270 N 0.78 1.33 -0.25 1.67 0.00 -0.56 -2.05 119.26 120.18 1oy0 h ALA 270 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1oy0 h ALA 270 Cb 0.30 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1oy0 h ALA 270 CO 0.00 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.13 1oy0 n GLY 271 N -0.91 0.15 3.55 0.00 0.00 0.21 -4.88 105.19 103.31 1oy0 n GLY 271 Ca 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.90 0.11 0.16 -0.02 0.00 -0.55 -4.77 105.19 101.01 1oy0 n GLY 272 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.11 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 1.33 -3.96 1.61 -1.51 -1.13 -3.43 116.25 109.16 1oy0 h VAL 273 Ca 0.00 -1.80 -0.54 0.00 -1.23 0.00 0.00 66.70 63.13 1oy0 h VAL 273 Cb 0.29 1.98 -0.31 0.00 -2.13 0.00 0.00 31.29 31.12 1oy0 h VAL 273 CO 0.00 0.51 -0.83 0.12 -1.23 0.00 0.00 177.57 176.14 1oy0 s PHE 274 N -3.79 1.58 0.59 5.19 5.36 -0.60 -3.51 117.98 122.80 1oy0 s PHE 274 Ca -0.02 -0.42 -0.13 0.00 -0.96 0.00 0.00 56.93 55.40 1oy0 s PHE 274 Cb 0.13 -1.06 -0.05 0.00 -0.34 0.00 0.00 43.02 41.70 1oy0 s PHE 274 CO 0.74 -0.13 1.02 -1.25 -1.46 0.00 0.00 175.22 174.14 1oy0 s PRO 275 N -0.02 3.62 0.00 10.12 0.04 -1.26 -4.03 135.00 143.47 1oy0 s PRO 275 Ca -0.02 0.89 0.00 0.00 0.04 0.00 0.00 61.00 61.91 1oy0 s PRO 275 Cb -0.10 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1oy0 s PRO 275 CO 0.01 -0.55 0.00 0.00 0.04 0.00 0.00 177.00 176.51 1oy0 n ALA 276 N -2.32 0.00 -0.05 8.56 0.00 -1.23 -4.98 120.51 120.50 1oy0 n ALA 276 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.38 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 1.10 0.05 0.00 9.92 -1.26 -3.67 116.55 122.69 1oy0 n ASP 277 Ca 0.00 0.21 0.03 0.00 -0.53 0.00 0.00 54.79 54.50 1oy0 n ASP 277 Cb 0.00 -0.05 0.18 0.00 -0.64 0.00 0.00 41.12 40.60 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 -3.11 0.04 0.00 -1.24 0.28 -1.26 -5.30 120.64 110.05 1oy0 n GLU 278 Ca -0.27 0.51 0.07 0.00 -0.16 0.00 0.00 57.16 57.30 1oy0 n GLU 278 Cb 1.07 -1.69 0.06 0.00 1.43 0.00 0.00 31.44 32.31 1oy0 n GLU 278 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69