#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ypf s VAL 4 N 0.00 4.36 0.37 3.53 0.11 -1.26 -5.02 120.40 122.48 1ypf s VAL 4 Ca 0.00 -0.47 -0.11 0.00 -2.93 0.00 0.00 61.98 58.47 1ypf s VAL 4 Cb 0.00 -2.94 0.03 0.00 -1.53 0.00 0.00 36.38 31.95 1ypf s VAL 4 CO 0.00 0.42 0.67 0.72 -3.33 0.00 0.00 175.10 173.58 1ypf s PHE 5 N -1.07 0.46 0.37 1.54 -0.12 -1.26 -5.07 117.98 112.82 1ypf s PHE 5 Ca 0.19 -0.96 0.06 0.00 -0.05 0.00 0.00 56.93 56.17 1ypf s PHE 5 Cb -0.12 0.49 -0.02 0.00 -0.63 0.00 0.00 43.02 42.74 1ypf s PHE 5 CO 0.09 -1.40 0.23 -3.47 -0.05 0.00 0.00 175.22 170.62 1ypf n ASP 6 N -1.37 0.10 -0.25 1.98 -0.08 -1.26 -2.92 116.55 112.75 1ypf n ASP 6 Ca -0.05 -3.20 0.02 0.00 -1.51 0.00 0.00 54.79 50.06 1ypf n ASP 6 Cb 0.60 1.42 0.11 0.00 2.34 0.00 0.00 41.12 45.59 1ypf n ASP 6 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 1ypf h TYR 7 N 1.91 -0.25 0.00 -0.67 0.05 -1.94 -0.80 116.97 115.28 1ypf h TYR 7 Ca -0.27 0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.57 1ypf h TYR 7 Cb 1.21 0.22 0.00 0.00 1.01 0.00 0.00 36.73 39.18 1ypf h TYR 7 CO 0.00 -0.28 0.00 1.05 -1.05 0.00 0.00 178.16 177.88 1ypf h GLU 8 N 0.04 0.00 0.00 4.88 9.09 -1.96 -2.34 114.58 124.30 1ypf h GLU 8 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.77 1ypf h GLU 8 Cb 0.59 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.69 1ypf h GLU 8 CO -0.70 0.00 -0.53 -0.25 0.05 0.00 0.00 179.01 177.58 1ypf n ASP 9 N -2.74 0.58 -4.76 3.06 8.00 -0.31 -4.71 116.55 115.68 1ypf n ASP 9 Ca -0.01 0.02 -0.36 0.00 0.71 0.00 0.00 54.79 55.16 1ypf n ASP 9 Cb 0.16 0.13 -0.08 0.00 -0.02 0.00 0.00 41.12 41.32 1ypf n ASP 9 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ypf s ILE 10 N -3.09 5.26 -0.09 0.53 -1.09 -0.88 -0.87 121.20 120.96 1ypf s ILE 10 Ca 0.09 0.13 0.04 0.00 -2.23 0.00 0.00 60.65 58.67 1ypf s ILE 10 Cb 0.15 -3.35 -0.00 0.00 -1.58 0.00 0.00 42.46 37.69 1ypf s ILE 10 CO 0.70 0.52 -0.23 -1.10 -1.23 0.00 0.00 174.94 173.59 1ypf s GLN 11 N -0.19 2.81 0.21 2.79 -1.52 -0.67 -4.98 119.66 118.11 1ypf s GLN 11 Ca 0.10 -0.83 -0.21 0.00 -1.95 0.00 0.00 55.36 52.46 1ypf s GLN 11 Cb -0.12 -2.18 -0.08 0.00 -0.22 0.00 0.00 33.01 30.42 1ypf s GLN 11 CO 0.01 0.20 0.74 -0.51 -0.25 0.00 0.00 175.29 175.48 1ypf s LEU 12 N 0.28 4.39 -0.20 2.90 1.43 -1.26 -1.09 118.68 125.13 1ypf s LEU 12 Ca -0.16 1.47 -0.13 0.00 -1.03 0.00 0.00 54.13 54.28 1ypf s LEU 12 Cb -0.17 -3.53 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 1ypf s LEU 12 CO 0.07 0.07 0.28 -0.63 0.23 0.00 0.00 176.35 176.37 1ypf s ILE 13 N -1.45 5.29 0.56 -0.59 1.01 -0.68 -4.97 121.20 120.37 1ypf s ILE 13 Ca 0.42 0.48 -0.20 0.00 0.00 0.00 0.00 60.65 61.34 1ypf s ILE 13 Cb -0.18 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 1ypf s ILE 13 CO 0.22 0.33 1.25 -2.84 0.00 0.00 0.00 174.94 173.90 1ypf s PRO 14 N 0.93 3.11 0.38 2.79 0.02 -1.26 -4.42 135.00 136.54 1ypf s PRO 14 Ca 0.14 1.96 0.08 0.00 0.02 0.00 0.00 61.00 63.20 1ypf s PRO 14 Cb -0.14 -2.09 -0.07 0.00 0.02 0.00 0.00 34.50 32.22 1ypf s PRO 14 CO 0.05 -1.13 -0.02 0.00 -0.33 0.00 0.00 177.00 175.56 1ypf s ALA 15 N -1.48 3.11 0.01 -1.55 0.00 0.04 -5.02 121.76 116.88 1ypf s ALA 15 Ca 0.74 -2.20 -0.36 0.00 0.00 0.00 0.00 51.96 50.15 1ypf s ALA 15 Cb -0.34 0.03 -0.14 0.00 0.00 0.00 0.00 23.12 22.67 1ypf s ALA 15 CO 0.38 -0.03 1.62 1.17 0.00 0.00 0.00 175.76 178.89 1ypf n LYS 16 N -0.91 1.75 -2.39 0.00 4.81 -1.26 -4.02 118.16 116.13 1ypf n LYS 16 Ca -0.05 0.63 -0.42 0.00 -0.87 0.00 0.00 58.31 57.61 1ypf n LYS 16 Cb 0.65 -2.38 -0.03 0.00 0.02 0.00 0.00 35.03 33.30 1ypf n LYS 16 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ypf n ILE 18 N 3.91 0.27 -4.14 0.00 -5.35 -1.26 -5.02 119.36 107.76 1ypf n ILE 18 Ca 0.09 -0.63 -0.29 0.00 -0.27 0.00 0.00 62.75 61.65 1ypf n ILE 18 Cb 0.46 0.88 -0.08 0.00 -1.74 0.00 0.00 39.64 39.16 1ypf n ILE 18 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1ypf s VAL 19 N -0.32 4.00 -0.66 7.28 -7.23 -1.26 -5.01 120.40 117.20 1ypf s VAL 19 Ca 0.01 -1.09 0.24 0.00 -1.81 0.00 0.00 61.98 59.34 1ypf s VAL 19 Cb 0.01 -2.94 0.01 0.00 0.56 0.00 0.00 36.38 34.02 1ypf s VAL 19 CO 0.01 0.05 1.27 0.59 -0.31 0.00 0.00 175.10 176.72 1ypf n ASN 20 N 0.34 0.66 -3.64 4.85 3.02 -1.26 -4.91 115.26 114.32 1ypf n ASN 20 Ca -0.10 0.03 -0.12 0.00 -0.03 0.00 0.00 54.58 54.36 1ypf n ASN 20 Cb 0.53 0.29 -0.07 0.00 -0.61 0.00 0.00 39.78 39.91 1ypf n ASN 20 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ypf s SER 21 N -4.07 -0.78 0.36 6.41 0.15 -1.26 -5.02 113.70 109.49 1ypf s SER 21 Ca 0.06 1.44 0.21 0.00 0.70 0.00 0.00 55.95 58.37 1ypf s SER 21 Cb 0.14 1.43 1.30 0.00 -1.71 0.00 0.00 66.02 67.18 1ypf s SER 21 CO 0.73 -0.24 1.50 0.54 1.20 0.00 0.00 173.24 176.97 1ypf n ARG 22 N 3.08 -0.05 0.26 5.44 1.74 -1.26 -0.17 116.66 125.70 1ypf n ARG 22 Ca -0.15 1.30 0.18 0.00 -0.77 0.00 0.00 57.85 58.41 1ypf n ARG 22 Cb 0.56 -2.36 0.89 0.00 -1.02 0.00 0.00 32.46 30.52 1ypf n ARG 22 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1ypf h SER 23 N 0.00 0.00 0.90 0.55 0.02 -1.95 0.20 113.55 113.27 1ypf h SER 23 Ca 0.81 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.76 1ypf h SER 23 Cb 2.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.75 1ypf h SER 23 CO -0.70 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 174.37 1ypf n GLU 24 N -3.33 0.22 -3.24 3.45 1.02 0.77 -4.85 120.64 114.68 1ypf n GLU 24 Ca 0.00 0.39 -0.39 0.00 -0.02 0.00 0.00 57.16 57.14 1ypf n GLU 24 Cb 0.34 -1.88 -0.06 0.00 -0.02 0.00 0.00 31.44 29.83 1ypf n GLU 24 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ypf s ASP 26 N 0.10 6.14 0.00 0.00 -1.08 0.64 -4.91 116.67 117.57 1ypf s ASP 26 Ca 0.30 -0.24 0.19 0.00 -0.52 0.00 0.00 52.55 52.28 1ypf s ASP 26 Cb -0.17 -2.18 0.52 0.00 -1.46 0.00 0.00 42.92 39.64 1ypf s ASP 26 CO 0.15 -0.29 1.44 0.35 0.52 0.00 0.00 175.17 177.34 1ypf n THR 27 N 5.19 0.68 -1.85 1.71 -2.24 -1.26 -2.26 114.28 114.24 1ypf n THR 27 Ca -0.10 -0.73 -0.32 0.00 -2.27 0.00 0.00 64.05 60.62 1ypf n THR 27 Cb 0.50 0.49 0.03 0.00 -2.10 0.00 0.00 70.33 69.25 1ypf n THR 27 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ypf s THR 28 N -1.32 3.62 0.01 4.28 -4.23 -1.20 -4.03 115.64 112.77 1ypf s THR 28 Ca 0.38 0.72 -0.03 0.00 -1.18 0.00 0.00 61.69 61.58 1ypf s THR 28 Cb 0.20 -3.26 -0.01 0.00 1.34 0.00 0.00 72.50 70.77 1ypf s THR 28 CO 0.27 -0.50 0.04 0.54 -0.54 0.00 0.00 174.62 174.44 1ypf s VAL 29 N -2.51 0.10 -0.09 2.29 0.11 -0.68 -4.75 120.40 114.86 1ypf s VAL 29 Ca 0.64 -0.84 -0.02 0.00 -2.93 0.00 0.00 61.98 58.83 1ypf s VAL 29 Cb -0.17 -0.37 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 1ypf s VAL 29 CO 0.42 -0.46 -0.01 -0.89 -3.33 0.00 0.00 175.10 170.83 1ypf s THR 30 N -1.50 4.22 -0.16 5.04 2.01 -1.26 -0.09 115.64 123.90 1ypf s THR 30 Ca -0.15 -0.28 -0.03 0.00 0.31 0.00 0.00 61.69 61.55 1ypf s THR 30 Cb -0.09 -2.78 0.05 0.00 0.01 0.00 0.00 72.50 69.70 1ypf s THR 30 CO -0.00 0.59 0.04 -0.22 -0.69 0.00 0.00 174.62 174.34 1ypf s LEU 31 N -0.76 0.92 0.00 4.42 2.96 -0.54 -5.01 118.68 120.68 1ypf s LEU 31 Ca 0.12 -0.62 0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1ypf s LEU 31 Cb -0.11 -0.51 0.00 0.00 0.50 0.00 0.00 46.19 46.07 1ypf s LEU 31 CO 0.02 -0.29 0.00 0.61 -1.32 0.00 0.00 176.35 175.38 1ypf n GLY 32 N 5.11 3.71 0.71 7.98 0.00 -1.26 -2.99 105.19 118.45 1ypf n GLY 32 Ca -0.08 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.01 1ypf n GLY 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ypf n LYS 33 N 13.83 1.95 -4.38 1.61 5.02 -1.26 -4.92 118.16 130.00 1ypf n LYS 33 Ca 0.00 -1.41 -0.25 0.00 -2.02 0.00 0.00 58.31 54.63 1ypf n LYS 33 Cb 0.00 -1.44 -0.13 0.00 -0.02 0.00 0.00 35.03 33.44 1ypf n LYS 33 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1ypf s HIS 34 N -1.79 1.84 -0.11 2.13 3.76 -1.16 -5.14 115.29 114.82 1ypf s HIS 34 Ca 0.34 -0.40 -0.03 0.00 -0.15 0.00 0.00 55.06 54.81 1ypf s HIS 34 Cb 0.19 -1.03 -0.03 0.00 1.11 0.00 0.00 32.58 32.82 1ypf s HIS 34 CO 0.29 0.19 0.02 0.21 -0.85 0.00 0.00 174.74 174.60 1ypf s LYS 35 N -1.74 3.24 0.19 1.40 2.20 -1.26 -1.47 119.74 122.29 1ypf s LYS 35 Ca 0.07 -0.39 0.07 0.00 -0.36 0.00 0.00 55.97 55.37 1ypf s LYS 35 Cb -0.10 -2.90 -0.05 0.00 -1.51 0.00 0.00 37.83 33.28 1ypf s LYS 35 CO 0.04 0.60 -0.14 -0.06 -0.36 0.00 0.00 175.35 175.43 1ypf s PHE 36 N -0.59 1.62 0.22 4.03 0.08 0.87 -4.94 117.98 119.27 1ypf s PHE 36 Ca 0.10 -0.59 -0.07 0.00 0.12 0.00 0.00 56.93 56.48 1ypf s PHE 36 Cb -0.12 -0.77 0.17 0.00 -0.57 0.00 0.00 43.02 41.73 1ypf s PHE 36 CO 0.02 0.30 1.78 0.87 -0.10 0.00 0.00 175.22 178.09 1ypf h LYS 37 N 2.72 1.19 -4.25 0.44 1.57 -1.38 -1.81 116.57 115.05 1ypf h LYS 37 Ca -0.38 -0.22 -0.21 0.00 -1.87 0.00 0.00 60.65 57.97 1ypf h LYS 37 Cb 1.21 -0.19 -0.20 0.00 0.08 0.00 0.00 32.23 33.13 1ypf h LYS 37 CO 0.61 0.97 -0.71 -0.51 -0.57 0.00 0.00 179.45 179.23 1ypf s LEU 38 N -9.70 2.27 -0.15 2.94 1.43 -1.26 -3.27 118.68 110.95 1ypf s LEU 38 Ca -0.12 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 52.39 1ypf s LEU 38 Cb 0.16 -0.00 0.07 0.00 0.03 0.00 0.00 46.19 46.44 1ypf s LEU 38 CO 0.84 -0.29 2.19 -0.81 0.23 0.00 0.00 176.35 178.51 1ypf n PRO 39 N 1.38 1.49 -4.20 1.29 -0.04 -1.26 -4.70 135.00 128.96 1ypf n PRO 39 Ca -0.22 -0.84 -0.16 0.00 -0.04 0.00 0.00 63.50 62.23 1ypf n PRO 39 Cb 0.55 -1.39 -0.11 0.00 -0.04 0.00 0.00 33.50 32.51 1ypf n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ypf s VAL 40 N -0.96 1.09 -0.15 0.52 -7.23 -1.26 -0.61 120.40 111.79 1ypf s VAL 40 Ca 0.21 -1.62 -0.11 0.00 -1.81 0.00 0.00 61.98 58.66 1ypf s VAL 40 Cb 0.15 -1.37 0.05 0.00 0.56 0.00 0.00 36.38 35.76 1ypf s VAL 40 CO -0.02 -0.47 0.38 0.54 -0.31 0.00 0.00 175.10 175.23 1ypf s VAL 41 N -2.20 -0.02 0.58 1.32 0.11 -0.46 -4.51 120.40 115.23 1ypf s VAL 41 Ca 0.06 0.06 -0.19 0.00 -2.93 0.00 0.00 61.98 58.97 1ypf s VAL 41 Cb -0.04 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.21 1ypf s VAL 41 CO 0.01 0.02 1.22 -2.84 -3.33 0.00 0.00 175.10 170.19 1ypf s PRO 42 N 0.90 3.06 0.26 1.54 0.02 -1.26 -0.60 135.00 138.91 1ypf s PRO 42 Ca -0.06 1.86 -0.31 0.00 0.02 0.00 0.00 61.00 62.52 1ypf s PRO 42 Cb -0.06 -2.00 -0.13 0.00 0.02 0.00 0.00 34.50 32.33 1ypf s PRO 42 CO -0.07 -1.15 1.40 0.00 -0.33 0.00 0.00 177.00 176.86 1ypf n ALA 43 N -1.44 1.27 -1.61 -1.55 0.00 -0.31 -4.62 120.51 112.25 1ypf n ALA 43 Ca 0.13 0.40 -0.41 0.00 0.00 0.00 0.00 53.44 53.56 1ypf n ALA 43 Cb 0.49 -2.29 -0.01 0.00 0.00 0.00 0.00 19.45 17.64 1ypf n ALA 43 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ypf n ASN 44 N 1.93 6.31 -4.08 0.00 6.94 -1.26 -4.29 115.26 120.80 1ypf n ASN 44 Ca 0.10 -2.76 -0.14 0.00 -0.02 0.00 0.00 54.58 51.76 1ypf n ASN 44 Cb 0.33 -1.59 -0.12 0.00 -2.36 0.00 0.00 39.78 36.05 1ypf n ASN 44 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1ypf s MET 45 N 2.30 0.59 0.52 -3.83 -1.94 -1.26 -4.38 119.30 111.30 1ypf s MET 45 Ca 0.57 -0.80 0.33 0.00 -1.71 0.00 0.00 55.69 54.08 1ypf s MET 45 Cb 0.16 -0.40 1.43 0.00 2.01 0.00 0.00 34.83 38.02 1ypf s MET 45 CO -0.07 0.08 1.98 -0.56 -0.01 0.00 0.00 175.02 176.44 1ypf h GLN 46 N 4.46 0.00 0.00 2.03 3.07 -1.89 -0.51 115.11 122.27 1ypf h GLN 46 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.37 1ypf h GLN 46 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.76 1ypf h GLN 46 CO 0.41 0.00 0.00 0.25 0.09 0.00 0.00 178.83 179.58 1ypf n THR 47 N -2.95 0.39 0.00 1.86 -2.24 -1.26 -4.34 114.28 105.74 1ypf n THR 47 Ca 0.00 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1ypf n THR 47 Cb 0.26 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 1ypf n THR 47 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1ypf n ILE 48 N -1.47 0.00 -4.37 2.28 2.08 -0.42 -4.48 119.36 112.98 1ypf n ILE 48 Ca 0.06 0.00 -0.27 0.00 0.56 0.00 0.00 62.75 63.10 1ypf n ILE 48 Cb 0.26 -1.03 -0.13 0.00 -0.75 0.00 0.00 39.64 38.00 1ypf n ILE 48 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 1ypf s ILE 49 N -1.98 2.11 0.14 1.39 2.07 -0.33 -4.72 121.20 119.87 1ypf s ILE 49 Ca 0.00 -1.77 0.01 0.00 -1.41 0.00 0.00 60.65 57.48 1ypf s ILE 49 Cb 0.00 -1.90 -0.00 0.00 0.13 0.00 0.00 42.46 40.69 1ypf s ILE 49 CO 0.00 -0.01 0.17 -0.90 -1.91 0.00 0.00 174.94 172.28 1ypf n ASP 50 N 0.79 -0.45 -0.14 4.50 5.68 -1.26 -4.41 116.55 121.26 1ypf n ASP 50 Ca -0.17 -1.82 -0.06 0.00 -0.50 0.00 0.00 54.79 52.24 1ypf n ASP 50 Cb 0.54 0.90 0.11 0.00 -1.14 0.00 0.00 41.12 41.52 1ypf n ASP 50 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1ypf h GLU 51 N 0.00 0.88 -0.12 0.11 3.07 -2.01 -0.74 114.58 115.77 1ypf h GLU 51 Ca -0.10 -0.27 -0.01 0.00 -0.50 0.00 0.00 59.36 58.47 1ypf h GLU 51 Cb 0.49 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1ypf h GLU 51 CO 0.15 0.90 0.02 0.00 -1.40 0.00 0.00 179.01 178.68 1ypf h ARG 52 N 0.81 0.21 -0.69 2.33 2.47 -1.99 -1.91 114.38 115.60 1ypf h ARG 52 Ca 0.15 -0.05 0.01 0.00 -1.26 0.00 0.00 59.98 58.82 1ypf h ARG 52 Cb 0.54 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.80 1ypf h ARG 52 CO 0.03 0.40 0.46 0.82 0.56 0.00 0.00 179.97 182.24 1ypf h ILE 53 N -0.02 1.17 -0.67 2.04 2.04 -1.88 -1.99 117.51 118.21 1ypf h ILE 53 Ca 0.04 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1ypf h ILE 53 Cb 0.29 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 1ypf h ILE 53 CO 0.00 0.17 0.42 0.00 0.00 0.00 0.00 178.15 178.75 1ypf h ALA 54 N 1.26 1.48 -0.21 1.87 0.00 -1.07 -0.61 119.26 121.99 1ypf h ALA 54 Ca 0.26 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1ypf h ALA 54 Cb -0.10 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 1ypf h ALA 54 CO -0.06 0.46 -0.15 1.15 0.00 0.00 0.00 179.25 180.65 1ypf h THR 55 N 0.91 1.32 -0.39 0.00 2.02 -1.12 -0.75 112.91 114.91 1ypf h THR 55 Ca 0.24 -1.27 0.07 0.00 0.77 0.00 0.00 66.41 66.22 1ypf h THR 55 Cb -0.07 1.69 -0.06 0.00 -1.74 0.00 0.00 68.15 67.97 1ypf h THR 55 CO -0.05 0.39 0.02 0.22 0.37 0.00 0.00 175.52 176.47 1ypf h TYR 56 N 0.17 0.02 0.01 3.16 3.20 -1.06 -0.76 116.97 121.70 1ypf h TYR 56 Ca 0.04 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 1ypf h TYR 56 Cb 0.68 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.00 1ypf h TYR 56 CO 0.07 -0.05 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.46 1ypf h LEU 57 N 0.13 -0.01 -0.91 2.82 3.38 -1.02 -2.75 115.31 116.95 1ypf h LEU 57 Ca 0.19 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1ypf h LEU 57 Cb 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1ypf h LEU 57 CO -0.30 0.19 -0.05 0.00 0.09 0.00 0.00 178.44 178.37 1ypf h ALA 58 N 0.78 1.09 0.00 1.53 0.00 -1.06 -1.27 119.26 120.33 1ypf h ALA 58 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1ypf h ALA 58 Cb 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ypf h ALA 58 CO 0.00 0.57 0.00 0.93 0.00 0.00 0.00 179.25 180.75 1ypf h GLU 59 N 0.69 0.00 -0.04 0.00 5.08 -1.01 -2.80 114.58 116.49 1ypf h GLU 59 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ypf h GLU 59 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1ypf h GLU 59 CO 0.03 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.13 1ypf n ASN 60 N -3.01 2.34 -1.94 1.42 3.02 -0.92 -5.01 115.26 111.16 1ypf n ASN 60 Ca -0.02 -2.57 -0.15 0.00 -0.03 0.00 0.00 54.58 51.81 1ypf n ASN 60 Cb 0.14 -0.25 0.01 0.00 -0.61 0.00 0.00 39.78 39.07 1ypf n ASN 60 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ypf n ASN 61 N -0.87 -4.68 -4.87 6.41 4.13 -0.90 -4.84 115.26 109.64 1ypf n ASN 61 Ca 0.09 -0.10 -0.37 0.00 1.68 0.00 0.00 54.58 55.89 1ypf n ASN 61 Cb 0.48 -3.70 -0.06 0.00 -1.54 0.00 0.00 39.78 34.96 1ypf n ASN 61 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1ypf s TYR 62 N -2.86 3.63 0.34 3.10 2.02 -0.53 -1.05 117.35 122.01 1ypf s TYR 62 Ca 0.09 0.66 -0.28 0.00 -0.37 0.00 0.00 57.07 57.17 1ypf s TYR 62 Cb -0.04 -2.04 -0.10 0.00 -0.40 0.00 0.00 41.96 39.38 1ypf s TYR 62 CO 0.11 0.71 1.22 0.12 -1.57 0.00 0.00 175.55 176.14 1ypf s PHE 63 N -1.02 3.17 0.09 2.71 5.36 -1.26 -3.98 117.98 123.05 1ypf s PHE 63 Ca 0.17 1.52 -0.01 0.00 -0.96 0.00 0.00 56.93 57.65 1ypf s PHE 63 Cb -0.13 -3.51 -0.04 0.00 -0.34 0.00 0.00 43.02 39.00 1ypf s PHE 63 CO 0.07 -1.41 0.01 1.52 -1.46 0.00 0.00 175.22 173.95 1ypf s TYR 64 N -1.22 0.67 -0.08 10.12 -0.85 -1.26 -4.60 117.35 120.12 1ypf s TYR 64 Ca 0.50 -1.14 -0.02 0.00 -0.52 0.00 0.00 57.07 55.89 1ypf s TYR 64 Cb -0.36 -0.42 0.04 0.00 0.38 0.00 0.00 41.96 41.60 1ypf s TYR 64 CO 0.46 -0.45 0.04 0.42 -1.52 0.00 0.00 175.55 174.50 1ypf s ILE 65 N -3.98 0.16 0.48 -3.49 1.01 -1.26 -4.73 121.20 109.39 1ypf s ILE 65 Ca 0.15 0.13 -0.21 0.00 0.00 0.00 0.00 60.65 60.72 1ypf s ILE 65 Cb 0.08 -0.45 -0.08 0.00 0.01 0.00 0.00 42.46 42.02 1ypf s ILE 65 CO -0.05 0.12 1.05 -0.32 0.00 0.00 0.00 174.94 175.75 1ypf s MET 66 N 2.05 3.81 0.82 2.79 -2.45 -0.77 -4.33 119.30 121.22 1ypf s MET 66 Ca 0.04 1.43 -0.12 0.00 -1.25 0.00 0.00 55.69 55.79 1ypf s MET 66 Cb -0.13 -2.16 0.08 0.00 1.25 0.00 0.00 34.83 33.87 1ypf s MET 66 CO -0.05 -0.44 1.14 -3.38 1.05 0.00 0.00 175.02 173.34 1ypf s HIS 67 N -1.89 2.86 -0.27 4.11 -3.43 -1.26 -2.91 115.29 112.50 1ypf s HIS 67 Ca 0.66 0.91 0.09 0.00 -0.80 0.00 0.00 55.06 55.92 1ypf s HIS 67 Cb -0.18 -3.32 0.45 0.00 -1.43 0.00 0.00 32.58 28.10 1ypf s HIS 67 CO 0.22 -1.86 1.30 2.89 -2.00 0.00 0.00 174.74 175.30 1ypf n ARG 68 N -3.42 2.20 0.16 -0.38 1.85 -1.26 -4.63 116.66 111.18 1ypf n ARG 68 Ca 0.07 -3.50 0.01 0.00 -1.00 0.00 0.00 57.85 53.43 1ypf n ARG 68 Cb 0.59 -1.86 0.29 0.00 -1.05 0.00 0.00 32.46 30.43 1ypf n ARG 68 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 1ypf h PHE 69 N 1.33 0.03 -2.26 2.89 3.57 -1.95 -3.27 116.94 117.29 1ypf h PHE 69 Ca 0.17 -0.01 -0.61 0.00 3.53 0.00 0.00 57.97 61.06 1ypf h PHE 69 Cb 1.29 -0.01 -0.42 0.00 2.79 0.00 0.00 35.95 39.61 1ypf h PHE 69 CO 0.88 0.46 -0.55 1.04 -2.23 0.00 0.00 178.31 177.91 1ypf n GLN 70 N -4.01 2.56 0.32 1.11 6.02 -1.26 -4.94 117.38 117.17 1ypf n GLN 70 Ca -0.02 -4.67 0.18 0.00 -0.01 0.00 0.00 57.00 52.49 1ypf n GLN 70 Cb 0.47 -2.27 1.05 0.00 1.02 0.00 0.00 30.24 30.51 1ypf n GLN 70 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1ypf h PRO 71 N 4.27 0.00 0.00 -1.09 0.13 -1.93 -0.70 132.00 132.68 1ypf h PRO 71 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1ypf h PRO 71 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1ypf h PRO 71 CO 0.85 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.67 1ypf h GLU 72 N 0.00 0.00 -0.00 0.86 9.09 -1.92 -2.91 114.58 119.70 1ypf h GLU 72 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1ypf h GLU 72 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1ypf h GLU 72 CO 0.00 0.00 -0.24 1.63 0.05 0.00 0.00 179.01 180.45 1ypf n LYS 73 N -2.95 0.45 -0.08 1.06 5.02 -0.27 -4.42 118.16 116.97 1ypf n LYS 73 Ca -0.00 -0.20 -0.09 0.00 -2.02 0.00 0.00 58.31 55.99 1ypf n LYS 73 Cb 0.24 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.82 1ypf n LYS 73 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ypf h ARG 74 N 0.50 0.77 -0.56 1.97 3.08 -1.67 -0.86 114.38 117.61 1ypf h ARG 74 Ca 0.00 -0.36 -0.07 0.00 0.07 0.00 0.00 59.98 59.63 1ypf h ARG 74 Cb 0.45 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1ypf h ARG 74 CO 0.00 0.98 0.09 0.82 -1.07 0.00 0.00 179.97 180.79 1ypf h ILE 75 N 0.65 1.25 -0.20 2.04 2.04 -1.81 -0.90 117.51 120.58 1ypf h ILE 75 Ca 0.07 -0.97 -0.06 0.00 1.00 0.00 0.00 64.86 64.91 1ypf h ILE 75 Cb 0.85 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1ypf h ILE 75 CO 0.07 0.35 -0.09 0.77 0.00 0.00 0.00 178.15 179.25 1ypf h SER 76 N 0.82 0.43 -0.55 1.72 4.64 -1.82 -2.35 113.55 116.44 1ypf h SER 76 Ca 0.17 -0.41 0.11 0.00 -0.47 0.00 0.00 61.79 61.19 1ypf h SER 76 Cb 0.41 -0.12 -0.11 0.00 -0.31 0.00 0.00 62.40 62.28 1ypf h SER 76 CO 0.01 0.75 -0.18 0.15 -0.87 0.00 0.00 176.83 176.69 1ypf h PHE 77 N 0.12 -0.42 0.18 4.77 3.57 -1.05 0.12 116.94 124.22 1ypf h PHE 77 Ca 0.05 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1ypf h PHE 77 Cb 0.58 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1ypf h PHE 77 CO 0.06 -0.28 -0.13 0.82 -2.23 0.00 0.00 178.31 176.56 1ypf h ILE 78 N -0.05 0.73 -0.78 1.41 2.04 -1.08 -1.34 117.51 118.45 1ypf h ILE 78 Ca 0.26 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.18 1ypf h ILE 78 Cb 0.45 0.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.20 1ypf h ILE 78 CO -0.59 0.00 0.47 -0.09 0.00 0.00 0.00 178.15 177.93 1ypf h ARG 79 N -0.31 0.83 -0.11 2.37 2.43 -0.78 -1.79 114.38 117.02 1ypf h ARG 79 Ca -0.01 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 1ypf h ARG 79 Cb 0.27 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1ypf h ARG 79 CO 0.00 0.55 -0.36 -0.44 -1.51 0.00 0.00 179.97 178.21 1ypf h ASP 80 N 0.85 0.51 -0.28 -3.80 5.19 -0.60 -2.48 116.42 115.80 1ypf h ASP 80 Ca 0.35 -0.61 0.04 0.00 -0.62 0.00 0.00 57.03 56.19 1ypf h ASP 80 Cb 0.19 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.51 1ypf h ASP 80 CO -0.18 1.03 0.03 0.24 -3.12 0.00 0.00 179.24 177.24 1ypf h MET 81 N 0.02 0.12 0.00 3.56 2.86 -0.91 -2.55 114.93 118.03 1ypf h MET 81 Ca -0.01 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 1ypf h MET 81 Cb 0.98 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1ypf h MET 81 CO 0.08 0.08 -0.22 1.96 1.06 0.00 0.00 176.91 179.86 1ypf h GLN 82 N 0.12 0.00 0.00 1.72 4.20 -1.30 -0.42 115.11 119.44 1ypf h GLN 82 Ca 0.13 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 1ypf h GLN 82 Cb 0.16 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1ypf h GLN 82 CO -0.20 0.22 -0.34 0.66 -0.67 0.00 0.00 178.83 178.51 1ypf h SER 83 N 0.00 0.00 -0.38 1.46 4.64 -1.07 -2.68 113.55 115.52 1ypf h SER 83 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ypf h SER 83 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1ypf h SER 83 CO 0.03 0.34 0.00 0.54 -0.87 0.00 0.00 176.83 176.87 1ypf n ARG 84 N -3.23 1.87 -2.04 4.77 1.74 -0.41 -4.92 116.66 114.44 1ypf n ARG 84 Ca 0.02 -1.35 -0.12 0.00 -0.77 0.00 0.00 57.85 55.63 1ypf n ARG 84 Cb 0.63 -1.29 -0.02 0.00 -1.02 0.00 0.00 32.46 30.76 1ypf n ARG 84 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ypf n GLY 85 N 1.10 0.18 3.66 -0.13 0.00 -1.01 -5.02 105.19 103.96 1ypf n GLY 85 Ca 0.13 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1ypf n GLY 85 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ypf s LEU 86 N -3.29 3.34 0.34 0.99 1.43 -0.30 -4.99 118.68 116.18 1ypf s LEU 86 Ca 0.00 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.55 1ypf s LEU 86 Cb 0.00 -2.07 -0.10 0.00 0.03 0.00 0.00 46.19 44.04 1ypf s LEU 86 CO 0.00 0.16 1.38 -0.63 0.23 0.00 0.00 176.35 177.49 1ypf s ILE 87 N -1.34 2.50 -0.24 -0.59 1.01 -1.26 -3.46 121.20 117.81 1ypf s ILE 87 Ca 0.25 0.49 -0.06 0.00 0.00 0.00 0.00 60.65 61.33 1ypf s ILE 87 Cb -0.11 -3.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 1ypf s ILE 87 CO 0.17 0.11 0.03 0.00 0.00 0.00 0.00 174.94 175.26 1ypf s ALA 88 N -1.00 3.03 -0.15 9.38 0.00 -1.26 -4.87 121.76 126.90 1ypf s ALA 88 Ca 0.51 -1.18 -0.01 0.00 0.00 0.00 0.00 51.96 51.28 1ypf s ALA 88 Cb -0.42 -1.96 0.04 0.00 0.00 0.00 0.00 23.12 20.78 1ypf s ALA 88 CO 0.55 -0.52 -0.01 0.45 0.00 0.00 0.00 175.76 176.23 1ypf s SER 89 N 1.55 2.50 0.36 0.00 0.15 -1.26 -1.15 113.70 115.86 1ypf s SER 89 Ca 0.06 -0.54 0.04 0.00 0.70 0.00 0.00 55.95 56.20 1ypf s SER 89 Cb -0.15 -0.69 -0.05 0.00 -1.71 0.00 0.00 66.02 63.41 1ypf s SER 89 CO 0.01 -0.22 0.07 0.27 1.20 0.00 0.00 173.24 174.57 1ypf s ILE 90 N 1.79 1.10 0.04 6.45 -4.36 -0.38 -1.84 121.20 124.00 1ypf s ILE 90 Ca 0.02 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.47 1ypf s ILE 90 Cb -0.15 -2.67 -0.03 0.00 1.25 0.00 0.00 42.46 40.86 1ypf s ILE 90 CO -0.07 0.00 -0.15 -0.44 0.24 0.00 0.00 174.94 174.52 1ypf s SER 91 N -3.55 4.04 0.12 4.36 0.01 -1.15 -1.11 113.70 116.42 1ypf s SER 91 Ca 0.32 -0.37 0.02 0.00 1.31 0.00 0.00 55.95 57.23 1ypf s SER 91 Cb 0.07 -0.73 -0.04 0.00 0.21 0.00 0.00 66.02 65.53 1ypf s SER 91 CO 0.15 0.25 -0.06 0.68 0.41 0.00 0.00 173.24 174.66 1ypf s VAL 92 N -0.98 0.77 0.00 3.43 -7.23 0.49 -4.68 120.40 112.19 1ypf s VAL 92 Ca 0.16 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.37 1ypf s VAL 92 Cb -0.11 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.06 1ypf s VAL 92 CO 0.07 -0.80 0.00 0.61 -0.31 0.00 0.00 175.10 174.67 1ypf n GLY 93 N -0.10 2.69 0.00 2.32 0.00 -1.26 -1.20 105.19 107.64 1ypf n GLY 93 Ca -0.11 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1ypf n GLY 93 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ypf n VAL 94 N 0.00 0.13 -1.23 1.61 0.24 -1.26 -4.88 118.33 112.94 1ypf n VAL 94 Ca 0.00 -0.35 -0.30 0.00 -2.04 0.00 0.00 64.34 61.65 1ypf n VAL 94 Cb 0.00 1.26 0.13 0.00 -1.47 0.00 0.00 33.84 33.76 1ypf n VAL 94 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1ypf s LYS 95 N -0.13 1.42 0.30 7.34 1.02 -1.26 -4.86 119.74 123.57 1ypf s LYS 95 Ca 0.00 0.85 0.00 0.00 0.02 0.00 0.00 55.97 56.85 1ypf s LYS 95 Cb 0.00 -1.83 0.52 0.00 -0.52 0.00 0.00 37.83 36.01 1ypf s LYS 95 CO 0.00 -2.14 1.92 1.49 -0.92 0.00 0.00 175.35 175.70 1ypf h GLU 96 N -1.47 1.01 0.00 1.68 4.81 -2.01 0.91 114.58 119.51 1ypf h GLU 96 Ca -0.49 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.66 1ypf h GLU 96 Cb 1.28 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.43 1ypf h GLU 96 CO 0.54 0.67 -0.11 0.38 -0.73 0.00 0.00 179.01 179.76 1ypf h ASP 97 N 1.04 0.00 0.69 1.04 2.03 -2.00 -2.02 116.42 117.20 1ypf h ASP 97 Ca 0.38 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.53 1ypf h ASP 97 Cb 0.16 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.64 1ypf h ASP 97 CO -0.14 0.11 -0.69 -0.33 -1.03 0.00 0.00 179.24 177.16 1ypf h GLU 98 N 0.00 0.00 -0.96 4.15 4.39 -1.17 -1.11 114.58 119.89 1ypf h GLU 98 Ca -0.00 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 1ypf h GLU 98 Cb 0.27 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.87 1ypf h GLU 98 CO 0.01 0.70 0.63 1.88 -1.16 0.00 0.00 179.01 181.07 1ypf h TYR 99 N 0.00 1.19 -0.36 4.33 -1.99 -1.17 -2.11 116.97 116.87 1ypf h TYR 99 Ca -0.01 0.03 -0.15 0.00 2.00 0.00 0.00 58.73 60.60 1ypf h TYR 99 Cb 1.23 -0.40 -0.01 0.00 2.00 0.00 0.00 36.73 39.55 1ypf h TYR 99 CO 0.00 0.72 -0.36 0.93 -0.00 0.00 0.00 178.16 179.44 1ypf h GLU 100 N 1.26 0.88 -0.34 4.88 4.39 -1.25 -2.41 114.58 121.99 1ypf h GLU 100 Ca 0.37 -0.47 0.02 0.00 0.34 0.00 0.00 59.36 59.62 1ypf h GLU 100 Cb -0.07 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 1ypf h GLU 100 CO -0.10 1.11 0.18 0.35 -1.16 0.00 0.00 179.01 179.39 1ypf h PHE 101 N 0.68 0.33 -0.53 4.33 3.57 -0.98 0.32 116.94 124.66 1ypf h PHE 101 Ca 0.06 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1ypf h PHE 101 Cb 0.96 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 1ypf h PHE 101 CO 0.07 0.19 0.30 0.28 -2.23 0.00 0.00 178.31 176.91 1ypf h VAL 102 N 0.37 1.18 -0.64 1.41 2.07 -1.38 -1.56 116.25 117.69 1ypf h VAL 102 Ca 0.14 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1ypf h VAL 102 Cb 0.03 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1ypf h VAL 102 CO -0.08 0.19 0.27 1.56 0.02 0.00 0.00 177.57 179.52 1ypf h GLN 103 N 0.72 0.96 -0.60 1.57 4.20 -0.79 -1.74 115.11 119.42 1ypf h GLN 103 Ca 0.19 -0.17 0.12 0.00 0.06 0.00 0.00 58.65 58.85 1ypf h GLN 103 Cb 0.03 -0.16 -0.10 0.00 0.30 0.00 0.00 27.48 27.56 1ypf h GLN 103 CO -0.03 0.80 0.04 0.37 -0.67 0.00 0.00 178.83 179.34 1ypf h GLN 104 N 0.90 0.15 -0.61 1.46 4.15 -0.08 -1.29 115.11 119.80 1ypf h GLN 104 Ca 0.22 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.59 1ypf h GLN 104 Cb 0.19 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 1ypf h GLN 104 CO -0.02 0.10 0.22 -0.07 -1.93 0.00 0.00 178.83 177.14 1ypf h LEU 105 N 0.16 0.82 -0.36 -2.39 3.38 -0.46 -2.16 115.31 114.30 1ypf h LEU 105 Ca 0.32 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1ypf h LEU 105 Cb 0.50 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1ypf h LEU 105 CO -0.48 0.75 0.00 0.00 0.09 0.00 0.00 178.44 178.80 1ypf n ALA 106 N -2.45 1.66 -0.08 1.53 0.00 -0.50 -1.35 120.51 119.32 1ypf n ALA 106 Ca 0.05 0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.41 1ypf n ALA 106 Cb 0.18 -1.31 -0.10 0.00 0.00 0.00 0.00 19.45 18.22 1ypf n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ypf n ALA 107 N -1.64 1.62 1.71 0.00 0.00 -0.84 -3.36 120.51 117.99 1ypf n ALA 107 Ca 0.03 -0.88 0.02 0.00 0.00 0.00 0.00 53.44 52.60 1ypf n ALA 107 Cb 0.20 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.72 1ypf n ALA 107 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ypf n GLU 108 N -2.80 1.21 -4.21 0.00 1.02 -1.06 -4.92 120.64 109.88 1ypf n GLU 108 Ca -0.29 -0.33 -0.31 0.00 -0.02 0.00 0.00 57.16 56.21 1ypf n GLU 108 Cb 0.91 -1.08 -0.06 0.00 -0.02 0.00 0.00 31.44 31.19 1ypf n GLU 108 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1ypf n HIS 109 N -0.24 -1.44 -3.43 -0.32 8.25 -0.72 -4.93 115.22 112.39 1ypf n HIS 109 Ca 0.04 0.69 -0.38 0.00 -0.26 0.00 0.00 57.72 57.80 1ypf n HIS 109 Cb 0.08 -3.03 -0.09 0.00 1.12 0.00 0.00 29.99 28.08 1ypf n HIS 109 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ypf s LEU 110 N -7.22 4.08 -0.28 2.41 1.43 -0.46 -5.04 118.68 113.61 1ypf s LEU 110 Ca 0.19 0.33 0.03 0.00 -1.03 0.00 0.00 54.13 53.64 1ypf s LEU 110 Cb -0.10 -2.40 0.07 0.00 0.03 0.00 0.00 46.19 43.78 1ypf s LEU 110 CO 0.96 -0.11 -0.06 -0.89 0.23 0.00 0.00 176.35 176.47 1ypf s THR 111 N 1.69 2.23 0.45 5.49 2.01 -1.26 -4.44 115.64 121.81 1ypf s THR 111 Ca 0.15 -1.82 -0.23 0.00 0.31 0.00 0.00 61.69 60.09 1ypf s THR 111 Cb -0.15 -2.41 -0.07 0.00 0.01 0.00 0.00 72.50 69.87 1ypf s THR 111 CO 0.09 -0.19 1.19 -2.16 -0.69 0.00 0.00 174.62 172.86 1ypf s PRO 112 N 1.05 3.78 0.33 4.92 0.04 -1.26 -4.91 135.00 138.95 1ypf s PRO 112 Ca -0.03 1.85 0.03 0.00 0.04 0.00 0.00 61.00 62.89 1ypf s PRO 112 Cb -0.20 -2.47 0.59 0.00 0.04 0.00 0.00 34.50 32.46 1ypf s PRO 112 CO -0.06 -0.56 1.89 0.93 0.04 0.00 0.00 177.00 179.25 1ypf h GLU 113 N 2.16 0.62 -3.99 4.56 3.07 -1.48 -3.39 114.58 116.13 1ypf h GLU 113 Ca -0.49 -0.11 -0.40 0.00 -0.50 0.00 0.00 59.36 57.85 1ypf h GLU 113 Cb 1.25 -0.10 -0.34 0.00 -0.84 0.00 0.00 28.75 28.72 1ypf h GLU 113 CO 0.61 0.58 -0.77 0.71 -1.40 0.00 0.00 179.01 178.73 1ypf s TYR 114 N -5.14 0.71 -0.11 4.33 2.02 -0.98 -0.72 117.35 117.46 1ypf s TYR 114 Ca -0.08 -0.19 0.02 0.00 -0.37 0.00 0.00 57.07 56.45 1ypf s TYR 114 Cb 0.16 -0.65 0.01 0.00 -0.40 0.00 0.00 41.96 41.08 1ypf s TYR 114 CO 0.77 -0.19 -0.17 0.42 -1.57 0.00 0.00 175.55 174.81 1ypf s ILE 115 N 0.96 1.66 -0.29 2.71 1.01 0.35 -1.25 121.20 126.35 1ypf s ILE 115 Ca -0.10 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 59.72 1ypf s ILE 115 Cb -0.14 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.83 1ypf s ILE 115 CO -0.00 0.47 0.11 -0.89 0.00 0.00 0.00 174.94 174.63 1ypf s THR 116 N 0.90 4.35 -0.43 2.92 2.01 -0.27 -0.96 115.64 124.16 1ypf s THR 116 Ca -0.08 -0.46 -0.28 0.00 0.31 0.00 0.00 61.69 61.19 1ypf s THR 116 Cb -0.15 -3.19 0.02 0.00 0.01 0.00 0.00 72.50 69.19 1ypf s THR 116 CO -0.01 0.12 1.05 -0.63 -0.69 0.00 0.00 174.62 174.46 1ypf s ILE 117 N 1.58 4.37 -0.32 1.82 1.01 -0.51 -0.38 121.20 128.76 1ypf s ILE 117 Ca 0.04 1.22 0.04 0.00 0.00 0.00 0.00 60.65 61.95 1ypf s ILE 117 Cb -0.17 -4.50 0.09 0.00 0.01 0.00 0.00 42.46 37.90 1ypf s ILE 117 CO 0.05 -0.81 0.02 -0.62 0.00 0.00 0.00 174.94 173.57 1ypf s ASP 118 N 2.20 4.69 0.00 3.58 2.15 -0.34 -2.89 116.67 126.05 1ypf s ASP 118 Ca 0.44 -2.01 0.03 0.00 0.43 0.00 0.00 52.55 51.44 1ypf s ASP 118 Cb -0.09 -1.59 -0.01 0.00 -0.30 0.00 0.00 42.92 40.93 1ypf s ASP 118 CO 0.26 -0.35 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.17 1ypf s ILE 119 N 0.96 0.85 0.11 4.11 -1.09 -1.06 -4.79 121.20 120.28 1ypf s ILE 119 Ca 0.07 -0.55 -0.22 0.00 -2.23 0.00 0.00 60.65 57.73 1ypf s ILE 119 Cb -0.19 -0.73 -0.10 0.00 -1.58 0.00 0.00 42.46 39.86 1ypf s ILE 119 CO -0.08 0.17 1.72 0.00 -1.23 0.00 0.00 174.94 175.53 1ypf h ALA 120 N 5.69 0.03 -3.00 9.38 0.00 -1.90 0.10 119.26 129.56 1ypf h ALA 120 Ca -0.33 0.03 -0.68 0.00 0.00 0.00 0.00 54.91 53.94 1ypf h ALA 120 Cb 1.18 0.07 -0.38 0.00 0.00 0.00 0.00 17.79 18.66 1ypf h ALA 120 CO 0.48 -0.50 -0.31 -1.58 0.00 0.00 0.00 179.25 177.34 1ypf s HIS 121 N -6.19 3.68 -0.77 0.00 5.65 -1.26 -4.35 115.29 112.04 1ypf s HIS 121 Ca -0.13 -3.08 0.26 0.00 0.25 0.00 0.00 55.06 52.36 1ypf s HIS 121 Cb 0.08 -3.06 0.72 0.00 -1.18 0.00 0.00 32.58 29.14 1ypf s HIS 121 CO 0.67 -0.70 1.64 0.41 -0.65 0.00 0.00 174.74 176.11 1ypf n GLY 122 N 2.46 -1.55 3.56 1.59 0.00 0.58 -4.40 105.19 107.43 1ypf n GLY 122 Ca 0.18 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1ypf n GLY 122 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ypf s HIS 123 N -3.09 2.16 0.13 1.61 5.65 -1.24 -4.63 115.29 115.88 1ypf s HIS 123 Ca 0.10 -0.10 -0.23 0.00 0.25 0.00 0.00 55.06 55.08 1ypf s HIS 123 Cb 0.14 -4.35 0.06 0.00 -1.18 0.00 0.00 32.58 27.26 1ypf s HIS 123 CO 0.63 -1.80 0.58 -1.54 -0.65 0.00 0.00 174.74 171.96 1ypf s SER 124 N 6.48 -0.53 0.48 9.88 1.04 -1.26 -5.03 113.70 124.76 1ypf s SER 124 Ca 0.59 0.03 0.27 0.00 0.48 0.00 0.00 55.95 57.32 1ypf s SER 124 Cb -0.03 0.57 1.07 0.00 0.10 0.00 0.00 66.02 67.74 1ypf s SER 124 CO -0.03 -0.91 1.88 0.78 0.98 0.00 0.00 173.24 175.94 1ypf h ASN 125 N 2.18 0.00 -0.39 7.02 2.35 -1.97 -1.55 115.58 123.23 1ypf h ASN 125 Ca -0.33 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.43 1ypf h ASN 125 Cb 1.28 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.63 1ypf h ASN 125 CO 0.39 0.15 0.23 0.00 -1.65 0.00 0.00 177.43 176.56 1ypf h ALA 126 N 1.85 0.49 -0.25 -0.83 0.00 -1.95 0.36 119.26 118.93 1ypf h ALA 126 Ca -0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1ypf h ALA 126 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ypf h ALA 126 CO 0.02 -0.10 -0.34 0.28 0.00 0.00 0.00 179.25 179.11 1ypf h VAL 127 N 0.47 1.31 -0.56 0.00 2.07 -1.74 -2.60 116.25 115.21 1ypf h VAL 127 Ca 0.15 -1.53 0.05 0.00 0.82 0.00 0.00 66.70 66.19 1ypf h VAL 127 Cb -0.01 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1ypf h VAL 127 CO -0.06 0.48 0.30 0.40 0.02 0.00 0.00 177.57 178.71 1ypf h ILE 128 N 0.38 0.96 -0.30 4.57 2.04 -1.05 -0.68 117.51 123.43 1ypf h ILE 128 Ca 0.03 -0.19 -0.13 0.00 1.00 0.00 0.00 64.86 65.56 1ypf h ILE 128 Cb 0.92 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 1ypf h ILE 128 CO 0.08 0.10 -0.35 0.78 0.00 0.00 0.00 178.15 178.76 1ypf h ASN 129 N 0.56 0.69 -0.65 1.72 2.35 -0.95 -2.15 115.58 117.16 1ypf h ASN 129 Ca 0.25 -0.29 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 1ypf h ASN 129 Cb 0.15 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1ypf h ASN 129 CO -0.17 0.98 0.13 -0.03 -1.65 0.00 0.00 177.43 176.70 1ypf h MET 130 N 0.56 1.07 -0.19 0.81 4.05 -1.13 -0.12 114.93 119.98 1ypf h MET 130 Ca 0.06 -0.26 0.04 0.00 -0.28 0.00 0.00 59.70 59.25 1ypf h MET 130 Cb 0.86 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.49 1ypf h MET 130 CO 0.07 0.96 -0.03 0.82 0.23 0.00 0.00 176.91 178.97 1ypf h ILE 131 N 1.01 0.83 -0.61 1.77 2.04 -0.87 -0.12 117.51 121.56 1ypf h ILE 131 Ca 0.21 -0.01 -0.06 0.00 1.00 0.00 0.00 64.86 66.00 1ypf h ILE 131 Cb 0.39 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 1ypf h ILE 131 CO 0.01 0.00 0.14 1.56 0.00 0.00 0.00 178.15 179.86 1ypf h GLN 132 N 0.03 0.97 -0.21 2.37 4.20 -1.16 -1.17 115.11 120.13 1ypf h GLN 132 Ca 0.09 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1ypf h GLN 132 Cb 0.13 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1ypf h GLN 132 CO -0.18 0.87 0.07 1.25 -0.67 0.00 0.00 178.83 180.17 1ypf h HIS 133 N 0.92 0.33 -0.48 2.96 2.76 -0.83 -2.41 115.15 118.40 1ypf h HIS 133 Ca 0.20 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 1ypf h HIS 133 Cb 0.34 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.18 1ypf h HIS 133 CO 0.02 0.39 0.31 0.82 -1.30 0.00 0.00 177.93 178.17 1ypf h ILE 134 N 0.18 1.13 0.00 6.26 2.04 -0.75 -2.30 117.51 124.07 1ypf h ILE 134 Ca 0.07 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1ypf h ILE 134 Cb 0.20 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1ypf h ILE 134 CO -0.00 0.13 -0.07 0.11 0.00 0.00 0.00 178.15 178.31 1ypf h LYS 135 N 0.64 0.00 0.07 2.37 1.79 -1.18 0.15 116.57 120.42 1ypf h LYS 135 Ca 0.17 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.51 1ypf h LYS 135 Cb -0.06 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.61 1ypf h LYS 135 CO -0.04 0.07 -0.57 0.87 -1.08 0.00 0.00 179.45 178.71 1ypf h LYS 136 N 0.00 0.26 0.00 3.15 1.57 -1.12 -3.32 116.57 117.11 1ypf h LYS 136 Ca -0.00 -0.37 -0.09 0.00 -1.87 0.00 0.00 60.65 58.31 1ypf h LYS 136 Cb 0.49 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 1ypf h LYS 136 CO 0.01 1.13 -1.45 0.72 -0.57 0.00 0.00 179.45 179.29 1ypf n HIS 137 N -4.27 0.73 -3.19 -1.35 8.25 -0.89 -4.51 115.22 109.99 1ypf n HIS 137 Ca -0.12 0.23 -0.22 0.00 -0.26 0.00 0.00 57.72 57.35 1ypf n HIS 137 Cb 0.69 -0.93 -0.05 0.00 1.12 0.00 0.00 29.99 30.82 1ypf n HIS 137 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ypf n LEU 138 N -2.69 1.09 0.23 2.41 4.77 0.52 -4.65 117.00 118.68 1ypf n LEU 138 Ca -0.07 -4.98 0.16 0.00 -0.03 0.00 0.00 56.01 51.10 1ypf n LEU 138 Cb 0.71 0.48 0.83 0.00 -2.33 0.00 0.00 43.42 43.12 1ypf n LEU 138 CO 0.42 2.20 1.14 -0.65 -1.33 0.00 0.00 177.39 179.17 1ypf h PRO 139 N 3.47 0.00 -0.00 3.23 0.11 -1.71 -1.24 132.00 135.85 1ypf h PRO 139 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1ypf h PRO 139 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1ypf h PRO 139 CO 0.54 0.00 -0.17 0.39 -0.21 0.00 0.00 178.00 178.55 1ypf n GLU 140 N -3.90 0.33 -2.48 1.05 -0.58 -1.26 -4.88 120.64 108.93 1ypf n GLU 140 Ca 0.00 -0.11 -0.41 0.00 -0.42 0.00 0.00 57.16 56.22 1ypf n GLU 140 Cb 0.25 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.59 1ypf n GLU 140 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1ypf s SER 141 N -2.74 7.19 -0.33 1.62 0.01 -0.47 -4.90 113.70 114.07 1ypf s SER 141 Ca 0.21 2.07 -0.26 0.00 1.31 0.00 0.00 55.95 59.28 1ypf s SER 141 Cb 0.19 -2.60 0.01 0.00 0.21 0.00 0.00 66.02 63.84 1ypf s SER 141 CO 0.54 -0.31 0.92 0.12 0.41 0.00 0.00 173.24 174.92 1ypf s PHE 142 N 0.18 3.15 -0.26 2.43 5.36 0.11 -4.89 117.98 124.06 1ypf s PHE 142 Ca 0.52 0.91 -0.09 0.00 -0.96 0.00 0.00 56.93 57.31 1ypf s PHE 142 Cb -0.30 -3.50 -0.04 0.00 -0.34 0.00 0.00 43.02 38.85 1ypf s PHE 142 CO 0.33 -0.71 0.14 0.08 -1.46 0.00 0.00 175.22 173.60 1ypf s VAL 143 N 3.33 4.91 -0.20 3.12 1.01 -1.26 -0.50 120.40 130.81 1ypf s VAL 143 Ca 0.38 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.34 1ypf s VAL 143 Cb -0.13 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 1ypf s VAL 143 CO 0.15 0.30 0.01 -0.63 0.00 0.00 0.00 175.10 174.93 1ypf s ILE 144 N 1.57 4.02 0.00 2.22 1.01 -0.14 -0.44 121.20 129.45 1ypf s ILE 144 Ca 0.07 -0.29 0.08 0.00 0.00 0.00 0.00 60.65 60.51 1ypf s ILE 144 Cb -0.15 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.47 1ypf s ILE 144 CO 0.07 0.42 -0.25 0.00 0.00 0.00 0.00 174.94 175.19 1ypf s ALA 145 N 1.01 2.06 0.00 9.38 0.00 -0.36 -1.42 121.76 132.43 1ypf s ALA 145 Ca 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.87 1ypf s ALA 145 Cb -0.14 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.49 1ypf s ALA 145 CO 0.02 0.50 0.00 0.41 0.00 0.00 0.00 175.76 176.69 1ypf n GLY 146 N 2.23 -1.23 3.90 0.00 0.00 -1.14 -0.94 105.19 108.01 1ypf n GLY 146 Ca -0.16 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 1ypf n GLY 146 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ypf s ASN 147 N -2.77 6.44 0.28 1.61 -0.87 0.02 -2.55 114.94 117.11 1ypf s ASN 147 Ca 0.00 0.47 0.05 0.00 -1.57 0.00 0.00 52.86 51.81 1ypf s ASN 147 Cb 0.00 -2.05 -0.06 0.00 -0.02 0.00 0.00 41.25 39.13 1ypf s ASN 147 CO 0.00 0.20 -0.02 0.68 -2.57 0.00 0.00 177.10 175.38 1ypf s VAL 148 N -1.42 1.42 0.00 1.60 -7.23 -0.64 -0.30 120.40 113.83 1ypf s VAL 148 Ca 0.32 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 1ypf s VAL 148 Cb -0.13 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.31 1ypf s VAL 148 CO 0.21 -0.24 0.37 0.61 -0.31 0.00 0.00 175.10 175.74 1ypf n GLY 149 N -0.57 -1.97 3.07 2.32 0.00 -1.26 -1.00 105.19 105.78 1ypf n GLY 149 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 1ypf n GLY 149 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ypf s THR 150 N 0.00 0.44 0.34 2.61 -4.23 -1.26 -4.90 115.64 108.64 1ypf s THR 150 Ca 0.00 -1.30 0.01 0.00 -1.18 0.00 0.00 61.69 59.22 1ypf s THR 150 Cb 0.00 -0.85 0.25 0.00 1.34 0.00 0.00 72.50 73.24 1ypf s THR 150 CO 0.00 -0.58 1.98 1.55 -0.54 0.00 0.00 174.62 177.04 1ypf h PRO 151 N 4.07 0.87 -0.79 3.99 0.13 -1.86 -1.83 132.00 136.58 1ypf h PRO 151 Ca -0.35 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.70 1ypf h PRO 151 Cb 1.19 -0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 1ypf h PRO 151 CO 0.48 0.60 0.42 1.05 -0.23 0.00 0.00 178.00 180.32 1ypf h GLU 152 N 0.89 1.10 -0.27 0.86 9.09 -1.96 -1.65 114.58 122.64 1ypf h GLU 152 Ca 0.23 -0.13 -0.07 0.00 0.05 0.00 0.00 59.36 59.45 1ypf h GLU 152 Cb -0.06 -0.21 -0.01 0.00 -1.65 0.00 0.00 28.75 26.82 1ypf h GLU 152 CO -0.05 0.82 -0.09 0.00 0.05 0.00 0.00 179.01 179.74 1ypf h ALA 153 N 1.36 0.37 -0.31 1.06 0.00 -1.88 -1.40 119.26 118.45 1ypf h ALA 153 Ca 0.28 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ypf h ALA 153 Cb 0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1ypf h ALA 153 CO -0.04 0.21 0.05 0.28 0.00 0.00 0.00 179.25 179.75 1ypf h VAL 154 N 0.28 0.84 -0.20 0.00 2.07 -1.23 -1.03 116.25 116.98 1ypf h VAL 154 Ca 0.06 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.57 1ypf h VAL 154 Cb 0.58 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 1ypf h VAL 154 CO 0.03 0.03 -0.03 0.03 0.02 0.00 0.00 177.57 177.65 1ypf h ARG 155 N 0.16 0.02 -0.75 1.57 2.47 -1.22 0.10 114.38 116.74 1ypf h ARG 155 Ca 0.15 -0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.82 1ypf h ARG 155 Cb 0.17 -0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.45 1ypf h ARG 155 CO -0.20 0.01 0.29 1.49 0.56 0.00 0.00 179.97 182.12 1ypf h GLU 156 N 0.02 1.11 -0.10 0.04 4.81 -1.02 0.54 114.58 119.98 1ypf h GLU 156 Ca 0.09 -0.20 -0.18 0.00 -0.13 0.00 0.00 59.36 58.94 1ypf h GLU 156 Cb 0.14 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.34 1ypf h GLU 156 CO -0.19 0.90 -0.66 -0.07 -0.73 0.00 0.00 179.01 178.27 1ypf h LEU 157 N 1.08 0.75 -0.10 1.64 4.07 -0.79 -1.09 115.31 120.86 1ypf h LEU 157 Ca 0.25 -0.66 0.02 0.00 0.08 0.00 0.00 57.88 57.57 1ypf h LEU 157 Cb 0.21 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.71 1ypf h LEU 157 CO -0.02 1.29 -0.01 -0.33 -1.08 0.00 0.00 178.44 178.29 1ypf h GLU 158 N 0.26 0.02 -0.55 1.13 5.08 -0.69 -1.94 114.58 117.88 1ypf h GLU 158 Ca -0.05 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1ypf h GLU 158 Cb 1.30 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 1ypf h GLU 158 CO 0.13 0.01 0.37 -0.91 -1.00 0.00 0.00 179.01 177.61 1ypf h ASN 159 N 0.02 0.53 0.63 1.42 2.35 -0.87 -1.31 115.58 118.34 1ypf h ASN 159 Ca 0.05 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1ypf h ASN 159 Cb 0.06 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.31 1ypf h ASN 159 CO -0.09 0.36 0.00 0.00 -1.65 0.00 0.00 177.43 176.05 1ypf h ALA 160 N 1.68 1.00 0.00 -0.83 0.00 -0.73 -3.46 119.26 116.93 1ypf h ALA 160 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ypf h ALA 160 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ypf h ALA 160 CO -0.06 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1ypf n GLY 161 N -0.26 0.96 3.77 0.00 0.00 -0.50 -4.45 105.19 104.70 1ypf n GLY 161 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1ypf n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ypf s ALA 162 N -1.89 3.31 -0.87 4.61 0.00 -0.77 -4.91 121.76 121.24 1ypf s ALA 162 Ca 0.00 1.49 0.25 0.00 0.00 0.00 0.00 51.96 53.70 1ypf s ALA 162 Cb 0.00 -3.59 0.52 0.00 0.00 0.00 0.00 23.12 20.05 1ypf s ALA 162 CO 0.00 -1.16 1.43 -0.25 0.00 0.00 0.00 175.76 175.79 1ypf n ASP 163 N -0.04 0.52 -3.55 0.00 8.00 0.42 -4.64 116.55 117.25 1ypf n ASP 163 Ca 0.04 -0.04 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 1ypf n ASP 163 Cb 0.41 0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.63 1ypf n ASP 163 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ypf s ALA 164 N -3.06 -1.52 0.13 2.24 0.00 -0.86 -4.12 121.76 114.57 1ypf s ALA 164 Ca 0.10 0.30 0.09 0.00 0.00 0.00 0.00 51.96 52.44 1ypf s ALA 164 Cb 0.16 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 1ypf s ALA 164 CO 0.69 -0.85 -0.21 0.95 0.00 0.00 0.00 175.76 176.35 1ypf s THR 165 N -3.74 1.81 -0.20 0.00 -4.23 -0.91 -1.23 115.64 107.15 1ypf s THR 165 Ca 0.04 -1.69 -0.04 0.00 -1.18 0.00 0.00 61.69 58.82 1ypf s THR 165 Cb -0.02 -1.70 -0.01 0.00 1.34 0.00 0.00 72.50 72.10 1ypf s THR 165 CO -0.07 -0.13 -0.04 -0.75 -0.54 0.00 0.00 174.62 173.09 1ypf s LYS 166 N -2.22 3.45 -0.17 3.99 2.20 -0.11 -0.91 119.74 125.97 1ypf s LYS 166 Ca 0.10 -0.60 -0.03 0.00 -0.36 0.00 0.00 55.97 55.08 1ypf s LYS 166 Cb -0.09 -2.98 -0.02 0.00 -1.51 0.00 0.00 37.83 33.23 1ypf s LYS 166 CO 0.05 -0.08 -0.05 0.08 -0.36 0.00 0.00 175.35 175.00 1ypf s VAL 167 N 1.19 3.69 0.00 4.02 1.01 0.01 -1.62 120.40 128.70 1ypf s VAL 167 Ca 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1ypf s VAL 167 Cb -0.14 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1ypf s VAL 167 CO -0.01 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.18 1ypf n GLY 168 N 3.82 3.51 2.76 4.51 0.00 -0.17 -0.35 105.19 119.27 1ypf n GLY 168 Ca -0.18 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1ypf n GLY 168 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ypf s ILE 169 N 0.00 1.18 -0.99 -0.61 -1.09 -1.26 -4.38 121.20 114.04 1ypf s ILE 169 Ca 0.00 -1.83 -0.11 0.00 -2.23 0.00 0.00 60.65 56.48 1ypf s ILE 169 Cb 0.00 -1.87 -0.01 0.00 -1.58 0.00 0.00 42.46 39.00 1ypf s ILE 169 CO 0.00 -0.73 0.76 0.61 -1.23 0.00 0.00 174.94 174.35 1ypf n GLY 170 N 4.41 -1.12 0.19 6.18 0.00 -1.26 0.19 105.19 113.78 1ypf n GLY 170 Ca 0.02 0.50 0.06 0.00 0.00 0.00 0.00 46.02 46.60 1ypf n GLY 170 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ypf h PRO 171 N -1.02 0.00 -7.10 1.61 0.13 -1.85 -2.03 132.00 121.74 1ypf h PRO 171 Ca -0.51 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.10 1ypf h PRO 171 Cb 1.28 0.00 0.10 0.00 0.13 0.00 0.00 31.00 32.51 1ypf h PRO 171 CO 0.42 0.36 0.46 0.20 -0.23 0.00 0.00 178.00 179.20 1ypf s GLY 172 N -4.34 2.68 0.49 1.56 0.00 -1.26 -3.39 107.32 103.05 1ypf s GLY 172 Ca -0.00 0.94 0.27 0.00 0.00 0.00 0.00 44.72 45.93 1ypf s GLY 172 CO 0.68 1.32 1.91 0.50 0.00 0.00 0.00 173.10 177.51 1ypf h LYS 173 N 0.91 0.00 -0.18 2.90 1.79 -1.92 -3.13 116.57 116.95 1ypf h LYS 173 Ca -0.50 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 57.77 1ypf h LYS 173 Cb 1.29 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 31.60 1ypf h LYS 173 CO 0.55 0.14 -0.97 1.33 -1.08 0.00 0.00 179.45 179.43 1ypf n VAL 174 N -3.32 0.86 -1.83 0.50 0.24 -1.26 -4.84 118.33 108.67 1ypf n VAL 174 Ca 0.00 -2.10 -0.29 0.00 -2.04 0.00 0.00 64.34 59.91 1ypf n VAL 174 Cb 0.37 0.75 0.09 0.00 -1.47 0.00 0.00 33.84 33.57 1ypf n VAL 174 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ypf h ILE 176 N -1.06 0.85 -0.25 0.00 1.08 -1.96 -2.52 117.51 113.65 1ypf h ILE 176 Ca -0.47 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.06 1ypf h ILE 176 Cb 1.32 0.85 -0.06 0.00 -3.07 0.00 0.00 36.82 35.86 1ypf h ILE 176 CO 0.65 0.00 -0.12 0.74 -0.69 0.00 0.00 178.15 178.73 1ypf h THR 177 N -0.11 0.62 0.00 -0.27 2.02 -1.92 0.30 112.91 113.55 1ypf h THR 177 Ca 0.02 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.22 1ypf h THR 177 Cb 0.13 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1ypf h THR 177 CO -0.06 0.00 -0.14 0.50 0.37 0.00 0.00 175.52 176.19 1ypf h LYS 178 N -0.09 -0.23 -0.29 6.66 3.64 -1.69 -1.21 116.57 123.36 1ypf h LYS 178 Ca 0.13 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 1ypf h LYS 178 Cb 0.29 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1ypf h LYS 178 CO -0.31 -0.15 -0.04 0.82 -2.27 0.00 0.00 179.45 177.49 1ypf h ILE 179 N -0.24 1.27 0.00 2.00 1.08 -1.06 -2.44 117.51 118.13 1ypf h ILE 179 Ca 0.05 -1.04 -0.21 0.00 -0.39 0.00 0.00 64.86 63.26 1ypf h ILE 179 Cb 0.30 1.36 -0.03 0.00 -3.07 0.00 0.00 36.82 35.38 1ypf h ILE 179 CO -0.14 0.33 -1.22 0.11 -0.69 0.00 0.00 178.15 176.55 1ypf h LYS 180 N 0.32 0.00 0.00 2.37 1.79 -0.37 -3.40 116.57 117.28 1ypf h LYS 180 Ca 0.08 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.51 1ypf h LYS 180 Cb 0.51 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.15 1ypf h LYS 180 CO 0.02 0.62 -1.45 0.25 -1.08 0.00 0.00 179.45 177.82 1ypf n THR 181 N -3.14 0.14 -0.99 -0.16 -2.24 -0.46 -5.02 114.28 102.41 1ypf n THR 181 Ca -0.07 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1ypf n THR 181 Cb 0.92 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1ypf n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ypf n GLY 182 N 2.12 0.78 3.62 3.38 0.00 -0.92 -5.03 105.19 109.15 1ypf n GLY 182 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1ypf n GLY 182 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ypf s PHE 183 N -3.16 2.84 -1.79 1.61 0.08 -1.26 -5.03 117.98 111.27 1ypf s PHE 183 Ca 0.00 -0.11 0.00 0.00 0.12 0.00 0.00 56.93 56.94 1ypf s PHE 183 Cb 0.00 -1.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.99 1ypf s PHE 183 CO 0.00 0.46 0.00 0.41 -0.10 0.00 0.00 175.22 175.99 1ypf n GLY 184 N 0.56 0.59 1.01 4.36 0.00 -1.26 -4.11 105.19 106.34 1ypf n GLY 184 Ca -0.12 -2.16 0.10 0.00 0.00 0.00 0.00 46.02 43.84 1ypf n GLY 184 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ypf n THR 185 N 3.22 0.63 -1.88 2.61 -2.24 0.13 -4.96 114.28 111.79 1ypf n THR 185 Ca 0.00 -0.70 -0.42 0.00 -2.27 0.00 0.00 64.05 60.65 1ypf n THR 185 Cb 0.00 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 1ypf n THR 185 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ypf s GLY 186 N -1.18 1.50 0.00 3.38 0.00 -0.76 -1.50 107.32 108.75 1ypf s GLY 186 Ca 0.38 1.32 0.00 0.00 0.00 0.00 0.00 44.72 46.42 1ypf s GLY 186 CO 0.27 2.86 0.00 0.61 0.00 0.00 0.00 173.10 176.84 1ypf n GLY 187 N 3.97 1.43 1.94 0.20 0.00 -1.22 -4.83 105.19 106.68 1ypf n GLY 187 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1ypf n GLY 187 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1ypf n TRP 188 N -2.00 0.11 -0.29 1.61 4.27 -0.56 -4.47 117.44 116.11 1ypf n TRP 188 Ca 0.00 -1.12 -0.01 0.00 -3.89 0.00 0.00 57.50 52.48 1ypf n TRP 188 Cb 0.00 0.15 0.12 0.00 -1.36 0.00 0.00 31.31 30.22 1ypf n TRP 188 CO 0.00 0.00 0.00 0.37 -2.29 0.00 0.00 177.69 175.77 1ypf h GLN 189 N 1.28 0.91 -0.48 -2.67 5.75 -1.55 -0.69 115.11 117.66 1ypf h GLN 189 Ca -0.29 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.12 1ypf h GLN 189 Cb 1.56 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.88 1ypf h GLN 189 CO 0.02 0.60 0.19 1.25 -2.65 0.00 0.00 178.83 178.24 1ypf h LEU 190 N 0.94 0.68 -0.80 -2.39 5.85 -1.89 -0.14 115.31 117.54 1ypf h LEU 190 Ca 0.34 -0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.78 1ypf h LEU 190 Cb 0.11 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1ypf h LEU 190 CO -0.15 0.67 -0.24 0.00 -0.34 0.00 0.00 178.44 178.38 1ypf h ALA 191 N 1.03 0.98 -0.72 1.25 0.00 -1.35 -1.59 119.26 118.86 1ypf h ALA 191 Ca 0.16 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ypf h ALA 191 Cb 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1ypf h ALA 191 CO -0.01 0.60 0.46 0.00 0.00 0.00 0.00 179.25 180.30 1ypf h ALA 192 N 1.18 0.91 -0.03 0.00 0.00 -0.83 -1.26 119.26 119.22 1ypf h ALA 192 Ca 0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ypf h ALA 192 Cb 0.70 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ypf h ALA 192 CO 0.05 0.35 0.02 1.25 0.00 0.00 0.00 179.25 180.93 1ypf h LEU 193 N 0.98 0.04 -0.53 0.00 5.85 -0.74 -1.63 115.31 119.28 1ypf h LEU 193 Ca 0.26 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.98 1ypf h LEU 193 Cb -0.08 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 40.86 1ypf h LEU 193 CO -0.05 0.12 0.12 -0.09 -0.34 0.00 0.00 178.44 178.20 1ypf h ARG 194 N -0.03 0.26 -0.10 1.25 2.43 -1.14 0.48 114.38 117.52 1ypf h ARG 194 Ca 0.01 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ypf h ARG 194 Cb 0.09 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1ypf h ARG 194 CO -0.00 0.17 0.05 2.35 -1.51 0.00 0.00 179.97 181.03 1ypf h TRP 195 N 0.26 0.14 -0.71 2.20 7.01 -1.00 -1.52 115.95 122.33 1ypf h TRP 195 Ca 0.27 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.20 1ypf h TRP 195 Cb 0.36 -0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 27.35 1ypf h TRP 195 CO -0.22 0.18 0.19 0.00 -2.79 0.00 0.00 178.44 175.79 1ypf h ALA 197 N 1.09 1.11 0.00 0.00 0.00 -0.61 -2.65 119.26 118.21 1ypf h ALA 197 Ca 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1ypf h ALA 197 Cb 0.35 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ypf h ALA 197 CO -0.00 0.55 -0.08 0.87 0.00 0.00 0.00 179.25 180.59 1ypf h LYS 198 N 0.57 0.00 0.00 0.00 1.57 -1.27 -2.31 116.57 115.12 1ypf h LYS 198 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1ypf h LYS 198 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1ypf h LYS 198 CO 0.04 0.08 -0.52 0.00 -0.57 0.00 0.00 179.45 178.47 1ypf n ALA 199 N -2.34 3.11 -2.46 3.86 0.00 -1.01 -4.98 120.51 116.69 1ypf n ALA 199 Ca -0.02 -0.27 -0.39 0.00 0.00 0.00 0.00 53.44 52.76 1ypf n ALA 199 Cb 0.17 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 1ypf n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ypf s ALA 200 N -3.09 3.54 -0.54 0.00 0.00 -0.87 -4.82 121.76 115.98 1ypf s ALA 200 Ca 0.09 -0.03 0.22 0.00 0.00 0.00 0.00 51.96 52.24 1ypf s ALA 200 Cb 0.15 -2.65 -0.12 0.00 0.00 0.00 0.00 23.12 20.50 1ypf s ALA 200 CO 0.70 0.25 0.85 -1.13 0.00 0.00 0.00 175.76 176.43 1ypf n SER 201 N 2.45 0.55 -4.59 0.00 3.41 -1.26 -4.99 113.62 109.19 1ypf n SER 201 Ca -0.09 -0.33 -0.24 0.00 -0.26 0.00 0.00 58.87 57.95 1ypf n SER 201 Cb 0.51 1.15 -0.09 0.00 -0.26 0.00 0.00 64.21 65.53 1ypf n SER 201 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1ypf s LYS 202 N -3.24 2.04 0.45 4.33 1.02 -1.26 -5.10 119.74 117.98 1ypf s LYS 202 Ca 0.02 -1.64 -0.23 0.00 0.02 0.00 0.00 55.97 54.13 1ypf s LYS 202 Cb 0.15 -1.96 -0.10 0.00 -0.52 0.00 0.00 37.83 35.39 1ypf s LYS 202 CO 0.85 0.27 0.87 -2.30 -0.92 0.00 0.00 175.35 174.11 1ypf n PRO 203 N -0.84 1.06 -4.84 -1.68 -0.02 -1.26 -4.82 135.00 122.60 1ypf n PRO 203 Ca -0.05 0.38 -0.33 0.00 -2.02 0.00 0.00 63.50 61.49 1ypf n PRO 203 Cb 0.61 -1.91 -0.14 0.00 -0.02 0.00 0.00 33.50 32.03 1ypf n PRO 203 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ypf s ILE 204 N -1.38 3.00 -0.34 4.25 1.01 -1.26 -2.13 121.20 124.35 1ypf s ILE 204 Ca 0.65 -0.70 -0.16 0.00 0.00 0.00 0.00 60.65 60.44 1ypf s ILE 204 Cb -0.54 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1ypf s ILE 204 CO 0.56 0.55 0.41 -0.63 0.00 0.00 0.00 174.94 175.83 1ypf s ILE 205 N 0.01 5.12 -0.21 2.92 1.01 -0.09 -0.64 121.20 129.31 1ypf s ILE 205 Ca -0.04 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.49 1ypf s ILE 205 Cb -0.14 -3.87 -0.00 0.00 0.01 0.00 0.00 42.46 38.45 1ypf s ILE 205 CO 0.04 -0.13 0.90 0.00 0.00 0.00 0.00 174.94 175.75 1ypf s ALA 206 N 2.14 3.61 -0.39 9.38 0.00 0.28 -0.81 121.76 135.97 1ypf s ALA 206 Ca 0.14 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1ypf s ALA 206 Cb -0.16 -3.36 0.11 0.00 0.00 0.00 0.00 23.12 19.71 1ypf s ALA 206 CO 0.12 -0.88 0.15 0.34 0.00 0.00 0.00 175.76 175.50 1ypf s ASP 207 N 1.24 5.02 0.00 0.00 2.15 0.53 -0.09 116.67 125.52 1ypf s ASP 207 Ca 0.39 -2.16 0.00 0.00 0.43 0.00 0.00 52.55 51.22 1ypf s ASP 207 Cb -0.16 -1.74 0.00 0.00 -0.30 0.00 0.00 42.92 40.72 1ypf s ASP 207 CO 0.09 -0.46 0.00 0.61 -0.17 0.00 0.00 175.17 175.24 1ypf n GLY 208 N 4.35 0.73 2.62 2.66 0.00 -0.98 -4.52 105.19 110.06 1ypf n GLY 208 Ca 0.01 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.95 1ypf n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ypf n GLY 209 N 0.62 0.36 3.66 -0.02 0.00 -1.26 -4.96 105.19 103.58 1ypf n GLY 209 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ypf n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ypf s ILE 210 N -1.85 4.81 -0.03 -0.61 -1.09 -1.26 -4.90 121.20 116.27 1ypf s ILE 210 Ca 0.00 1.72 0.08 0.00 -2.23 0.00 0.00 60.65 60.21 1ypf s ILE 210 Cb 0.00 -4.18 -0.12 0.00 -1.58 0.00 0.00 42.46 36.59 1ypf s ILE 210 CO 0.00 -0.07 0.17 0.54 -1.23 0.00 0.00 174.94 174.36 1ypf n ARG 211 N 5.81 0.47 -4.07 2.79 1.74 -1.26 -4.73 116.66 117.41 1ypf n ARG 211 Ca 0.07 -0.07 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1ypf n ARG 211 Cb 0.48 -1.16 -0.10 0.00 -1.02 0.00 0.00 32.46 30.66 1ypf n ARG 211 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1ypf s THR 212 N -2.48 0.20 0.47 0.55 -4.23 -1.26 -5.00 115.64 103.89 1ypf s THR 212 Ca -0.02 -1.74 0.18 0.00 -1.18 0.00 0.00 61.69 58.92 1ypf s THR 212 Cb 0.05 -1.54 0.23 0.00 1.34 0.00 0.00 72.50 72.58 1ypf s THR 212 CO 0.31 -0.92 2.05 0.78 -0.54 0.00 0.00 174.62 176.30 1ypf h ASN 213 N 3.08 0.00 0.20 3.99 2.35 -2.00 -2.22 115.58 120.99 1ypf h ASN 213 Ca -0.34 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.40 1ypf h ASN 213 Cb 1.15 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.52 1ypf h ASN 213 CO 0.64 0.13 -0.05 1.23 -1.65 0.00 0.00 177.43 177.73 1ypf h GLY 214 N 0.46 0.00 2.00 2.83 0.00 -1.96 -2.13 103.07 104.27 1ypf h GLY 214 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1ypf h GLY 214 CO 0.02 0.00 -0.06 -0.55 0.00 0.00 0.00 176.54 175.94 1ypf h ASP 215 N 0.00 0.00 0.34 0.19 3.32 -1.81 -2.64 116.42 115.83 1ypf h ASP 215 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1ypf h ASP 215 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1ypf h ASP 215 CO 0.01 0.06 -0.16 0.58 -1.72 0.00 0.00 179.24 178.01 1ypf h VAL 216 N 0.00 0.68 -0.79 -1.35 2.07 -1.51 -0.29 116.25 115.06 1ypf h VAL 216 Ca -0.00 -0.22 0.10 0.00 0.82 0.00 0.00 66.70 67.40 1ypf h VAL 216 Cb 0.57 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 31.06 1ypf h VAL 216 CO 0.01 0.04 0.43 0.00 0.02 0.00 0.00 177.57 178.07 1ypf h ALA 217 N 0.04 1.12 -0.54 1.67 0.00 -1.62 -1.74 119.26 118.19 1ypf h ALA 217 Ca -0.05 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ypf h ALA 217 Cb 0.43 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1ypf h ALA 217 CO 0.08 0.03 0.34 0.87 0.00 0.00 0.00 179.25 180.57 1ypf h LYS 218 N 0.71 0.67 -0.93 0.00 1.57 -1.45 0.98 116.57 118.13 1ypf h LYS 218 Ca 0.39 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1ypf h LYS 218 Cb 0.39 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 1ypf h LYS 218 CO -0.27 0.44 0.58 0.77 -0.57 0.00 0.00 179.45 180.41 1ypf h SER 219 N 0.69 1.09 -0.21 0.86 0.02 -0.50 -2.54 113.55 112.97 1ypf h SER 219 Ca 0.21 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1ypf h SER 219 Cb -0.04 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.22 1ypf h SER 219 CO -0.06 0.82 0.10 0.40 -1.14 0.00 0.00 176.83 176.95 1ypf h ILE 220 N 1.27 1.13 -0.72 3.27 1.08 -0.87 0.12 117.51 122.79 1ypf h ILE 220 Ca 0.34 -0.38 0.14 0.00 -0.39 0.00 0.00 64.86 64.56 1ypf h ILE 220 Cb -0.09 1.01 -0.09 0.00 -3.07 0.00 0.00 36.82 34.57 1ypf h ILE 220 CO -0.07 0.13 0.25 -0.09 -0.69 0.00 0.00 178.15 177.69 1ypf h ARG 221 N 0.21 0.38 -0.49 2.37 9.65 -0.54 -1.80 114.38 124.15 1ypf h ARG 221 Ca 0.07 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 1ypf h ARG 221 Cb 0.11 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 1ypf h ARG 221 CO -0.01 0.25 0.00 1.19 2.80 0.00 0.00 179.97 184.20 1ypf n PHE 222 N -5.04 1.70 0.00 2.20 3.72 -0.98 -4.75 117.46 114.30 1ypf n PHE 222 Ca 0.13 -0.76 0.00 0.00 -0.05 0.00 0.00 57.45 56.77 1ypf n PHE 222 Cb 0.40 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 1ypf n PHE 222 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ypf n GLY 223 N 0.35 1.79 3.80 1.37 0.00 0.24 -3.51 105.19 109.23 1ypf n GLY 223 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 1ypf n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ypf s ALA 224 N -2.00 2.73 -0.19 4.61 0.00 -0.24 -4.66 121.76 122.01 1ypf s ALA 224 Ca 0.00 0.48 -0.05 0.00 0.00 0.00 0.00 51.96 52.39 1ypf s ALA 224 Cb 0.00 -3.25 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 1ypf s ALA 224 CO 0.00 -0.78 -0.21 2.41 0.00 0.00 0.00 175.76 177.18 1ypf n THR 225 N -1.85 1.08 -4.82 0.00 -1.04 0.18 -4.56 114.28 103.27 1ypf n THR 225 Ca 0.09 -0.34 -0.30 0.00 -2.04 0.00 0.00 64.05 61.46 1ypf n THR 225 Cb 0.53 -1.49 -0.14 0.00 -1.82 0.00 0.00 70.33 67.40 1ypf n THR 225 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1ypf s MET 226 N -2.37 1.84 -0.26 -2.82 -2.45 -1.09 -4.70 119.30 107.45 1ypf s MET 226 Ca -0.27 -1.10 -0.03 0.00 -1.25 0.00 0.00 55.69 53.05 1ypf s MET 226 Cb 0.09 -2.02 0.02 0.00 1.25 0.00 0.00 34.83 34.17 1ypf s MET 226 CO 0.39 0.51 -0.03 0.08 1.05 0.00 0.00 175.02 177.02 1ypf s VAL 227 N -0.85 3.09 -0.15 10.11 1.01 0.22 -0.56 120.40 133.27 1ypf s VAL 227 Ca 0.13 -0.95 -0.24 0.00 0.00 0.00 0.00 61.98 60.91 1ypf s VAL 227 Cb -0.10 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1ypf s VAL 227 CO 0.03 0.18 0.76 -0.32 0.00 0.00 0.00 175.10 175.75 1ypf s MET 228 N 1.36 4.31 -0.10 2.72 -2.45 0.87 -1.35 119.30 124.66 1ypf s MET 228 Ca 0.01 0.91 0.03 0.00 -1.25 0.00 0.00 55.69 55.39 1ypf s MET 228 Cb -0.17 -3.55 0.01 0.00 1.25 0.00 0.00 34.83 32.37 1ypf s MET 228 CO -0.03 -0.22 -0.21 0.42 1.05 0.00 0.00 175.02 176.03 1ypf s ILE 229 N 1.79 1.83 0.00 10.11 1.01 0.23 -2.31 121.20 133.86 1ypf s ILE 229 Ca 0.36 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 60.14 1ypf s ILE 229 Cb -0.17 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.70 1ypf s ILE 229 CO 0.13 0.51 0.00 0.61 0.00 0.00 0.00 174.94 176.19 1ypf n GLY 230 N 3.73 -0.33 0.31 6.18 0.00 -1.26 -1.16 105.19 112.66 1ypf n GLY 230 Ca -0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.95 1ypf n GLY 230 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ypf h SER 231 N 0.00 0.36 0.44 1.61 4.64 -1.94 0.24 113.55 118.89 1ypf h SER 231 Ca 0.00 0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.44 1ypf h SER 231 Cb 0.00 0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1ypf h SER 231 CO 0.00 0.02 -0.14 -0.07 -0.87 0.00 0.00 176.83 175.77 1ypf h LEU 232 N 0.43 0.00 -0.38 5.97 3.38 -1.87 -1.98 115.31 120.86 1ypf h LEU 232 Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.52 1ypf h LEU 232 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1ypf h LEU 232 CO -0.51 0.14 -0.59 0.49 0.09 0.00 0.00 178.44 178.06 1ypf n PHE 233 N -3.63 0.00 -2.66 1.13 3.72 0.02 -4.95 117.46 111.09 1ypf n PHE 233 Ca -0.02 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.02 1ypf n PHE 233 Cb 0.27 -0.08 -0.05 0.00 -0.94 0.00 0.00 39.48 38.68 1ypf n PHE 233 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ypf s ALA 234 N -2.75 3.11 -0.11 4.37 0.00 -0.75 -4.24 121.76 121.40 1ypf s ALA 234 Ca 0.15 0.60 -0.00 0.00 0.00 0.00 0.00 51.96 52.71 1ypf s ALA 234 Cb 0.18 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 20.07 1ypf s ALA 234 CO 0.68 -0.04 0.01 0.41 0.00 0.00 0.00 175.76 176.82 1ypf n GLY 235 N 0.25 0.41 3.92 0.00 0.00 -1.26 -4.85 105.19 103.66 1ypf n GLY 235 Ca 0.04 -0.80 -0.26 0.00 0.00 0.00 0.00 46.02 45.00 1ypf n GLY 235 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ypf s HIS 236 N -2.23 3.52 0.23 1.61 4.02 -1.26 -1.24 115.29 119.95 1ypf s HIS 236 Ca 0.01 0.62 -0.06 0.00 1.02 0.00 0.00 55.06 56.65 1ypf s HIS 236 Cb -0.00 -2.12 0.41 0.00 -1.02 0.00 0.00 32.58 29.85 1ypf s HIS 236 CO 0.01 -0.05 1.71 1.49 1.02 0.00 0.00 174.74 178.91 1ypf h GLU 237 N 0.68 0.32 0.00 1.40 4.57 -1.47 0.23 114.58 120.32 1ypf h GLU 237 Ca -0.48 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1ypf h GLU 237 Cb 1.21 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 1ypf h GLU 237 CO 0.62 0.21 0.00 0.93 -1.18 0.00 0.00 179.01 179.59 1ypf h GLU 238 N 0.33 0.00 -7.13 1.92 3.07 -1.95 -3.45 114.58 107.36 1ypf h GLU 238 Ca 0.39 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.74 1ypf h GLU 238 Cb 0.61 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 28.61 1ypf h GLU 238 CO -0.44 0.00 0.41 -1.12 -1.40 0.00 0.00 179.01 176.46 1ypf s SER 239 N -5.02 5.42 0.51 1.42 0.01 0.81 -4.92 113.70 111.93 1ypf s SER 239 Ca 0.01 2.14 -0.19 0.00 1.31 0.00 0.00 55.95 59.22 1ypf s SER 239 Cb 0.09 -2.57 -0.12 0.00 0.21 0.00 0.00 66.02 63.63 1ypf s SER 239 CO 0.45 -1.42 0.24 -2.65 0.41 0.00 0.00 173.24 170.26 1ypf n PRO 240 N -1.75 0.28 0.00 12.44 -0.02 -1.26 -4.81 135.00 139.86 1ypf n PRO 240 Ca 0.11 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1ypf n PRO 240 Cb 0.51 -1.34 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 1ypf n PRO 240 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ypf n GLY 241 N 2.11 -1.46 3.33 -1.23 0.00 -1.26 -4.87 105.19 101.81 1ypf n GLY 241 Ca 0.10 -2.13 -0.27 0.00 0.00 0.00 0.00 46.02 43.71 1ypf n GLY 241 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ypf s GLU 242 N -0.15 1.45 0.19 1.61 -1.05 -1.26 -5.09 118.70 114.39 1ypf s GLU 242 Ca 0.00 -1.16 -0.28 0.00 -0.15 0.00 0.00 54.97 53.38 1ypf s GLU 242 Cb 0.00 -1.73 -0.08 0.00 -0.44 0.00 0.00 34.13 31.88 1ypf s GLU 242 CO 0.00 0.43 0.88 0.99 0.95 0.00 0.00 175.26 178.50 1ypf s THR 243 N -0.96 4.26 -0.70 1.83 2.01 -1.26 -4.29 115.64 116.53 1ypf s THR 243 Ca 0.10 1.93 0.04 0.00 0.31 0.00 0.00 61.69 64.08 1ypf s THR 243 Cb -0.10 -4.25 0.29 0.00 0.01 0.00 0.00 72.50 68.45 1ypf s THR 243 CO 0.04 0.48 0.98 -0.38 -0.69 0.00 0.00 174.62 175.04 1ypf n ILE 244 N 1.76 3.22 0.00 1.82 5.41 0.78 -4.97 119.36 127.37 1ypf n ILE 244 Ca -0.03 -5.48 0.00 0.00 1.00 0.00 0.00 62.75 58.24 1ypf n ILE 244 Cb 0.48 -1.84 0.00 0.00 -0.71 0.00 0.00 39.64 37.57 1ypf n ILE 244 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1ypf n ASN 268 N 0.50 0.00 0.00 4.38 0.23 -1.26 -0.16 115.26 118.95 1ypf n ASN 268 Ca 0.31 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.36 1ypf n ASN 268 Cb 0.38 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1ypf n ASN 268 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 1ypf n VAL 269 N 0.00 0.00 -2.71 3.53 0.31 -1.26 -4.09 118.33 114.11 1ypf n VAL 269 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1ypf n VAL 269 Cb 0.00 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.01 1ypf n VAL 269 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ypf n GLU 270 N 13.93 1.15 0.00 5.55 1.02 -1.26 -5.11 120.64 135.93 1ypf n GLU 270 Ca 0.00 -2.46 0.00 0.00 -0.02 0.00 0.00 57.16 54.68 1ypf n GLU 270 Cb 0.00 -0.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.77 1ypf n GLU 270 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ypf n GLY 271 N -0.28 -0.14 3.81 0.62 0.00 -1.26 -5.05 105.19 102.89 1ypf n GLY 271 Ca 0.04 -1.25 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 1ypf n GLY 271 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ypf s LYS 272 N -4.68 3.13 0.14 1.61 1.02 -1.26 -5.06 119.74 114.63 1ypf s LYS 272 Ca 0.00 1.10 0.08 0.00 0.02 0.00 0.00 55.97 57.17 1ypf s LYS 272 Cb 0.00 -2.01 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 1ypf s LYS 272 CO 0.00 -0.96 -0.18 0.15 -0.92 0.00 0.00 175.35 173.45 1ypf s LYS 273 N -4.49 1.16 0.00 1.68 3.01 0.78 -3.73 119.74 118.16 1ypf s LYS 273 Ca 0.61 -1.30 0.00 0.00 -1.01 0.00 0.00 55.97 54.28 1ypf s LYS 273 Cb -0.15 -1.22 0.00 0.00 -1.01 0.00 0.00 37.83 35.45 1ypf s LYS 273 CO 0.45 0.25 0.00 -0.12 0.51 0.00 0.00 175.35 176.44 1ypf n MET 274 N 0.56 0.00 0.00 1.68 1.56 0.43 0.27 117.12 121.62 1ypf n MET 274 Ca -0.15 0.04 0.00 0.00 -0.27 0.00 0.00 57.70 57.32 1ypf n MET 274 Cb 0.56 -0.47 0.00 0.00 2.15 0.00 0.00 33.22 35.46 1ypf n MET 274 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 1ypf n PHE 275 N -2.28 0.00 -3.25 1.12 3.01 -1.26 -4.19 117.46 110.61 1ypf n PHE 275 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.39 1ypf n PHE 275 Cb 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 1ypf n PHE 275 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1ypf s VAL 276 N -0.54 -0.71 0.03 -4.37 1.01 -1.26 -5.13 120.40 109.43 1ypf s VAL 276 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1ypf s VAL 276 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 36.09 1ypf s VAL 276 CO 0.00 -0.26 0.00 1.21 0.00 0.00 0.00 175.10 176.05 1ypf n GLU 277 N 4.21 -0.22 -3.70 2.72 4.07 -1.26 -4.99 120.64 121.48 1ypf n GLU 277 Ca 0.12 0.15 -0.16 0.00 -0.06 0.00 0.00 57.16 57.22 1ypf n GLU 277 Cb 0.52 -0.27 -0.15 0.00 -0.06 0.00 0.00 31.44 31.48 1ypf n GLU 277 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1ypf s HIS 278 N -1.52 -0.18 -2.50 4.31 5.65 -1.24 0.16 115.29 119.97 1ypf s HIS 278 Ca 0.00 0.57 0.20 0.00 0.25 0.00 0.00 55.06 56.08 1ypf s HIS 278 Cb 0.00 -0.19 0.15 0.00 -1.18 0.00 0.00 32.58 31.36 1ypf s HIS 278 CO 0.00 -0.23 1.13 1.63 -0.65 0.00 0.00 174.74 176.62 1ypf n LYS 279 N 4.89 1.80 0.00 2.88 5.02 -0.38 -4.96 118.16 127.41 1ypf n LYS 279 Ca -0.13 -1.67 0.00 0.00 -2.02 0.00 0.00 58.31 54.49 1ypf n LYS 279 Cb 0.50 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1ypf n LYS 279 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ypf n GLY 280 N 1.15 0.51 3.73 0.72 0.00 -1.26 -4.87 105.19 105.17 1ypf n GLY 280 Ca 0.12 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 1ypf n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ypf s SER 281 N -4.00 6.61 0.30 1.61 1.04 -1.26 -1.07 113.70 116.94 1ypf s SER 281 Ca 0.00 0.72 0.06 0.00 0.48 0.00 0.00 55.95 57.21 1ypf s SER 281 Cb 0.00 -2.25 0.72 0.00 0.10 0.00 0.00 66.02 64.59 1ypf s SER 281 CO 0.00 0.05 1.79 0.25 0.98 0.00 0.00 173.24 176.31 1ypf h LEU 282 N 6.61 0.80 -1.01 2.42 5.85 -1.95 -1.57 115.31 126.46 1ypf h LEU 282 Ca -0.42 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.42 1ypf h LEU 282 Cb 1.18 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.09 1ypf h LEU 282 CO 0.75 0.31 0.66 -0.08 -0.34 0.00 0.00 178.44 179.74 1ypf h GLU 283 N 0.79 1.29 -0.38 1.25 4.81 -2.00 -1.35 114.58 118.99 1ypf h GLU 283 Ca 0.57 -0.08 -0.13 0.00 -0.13 0.00 0.00 59.36 59.59 1ypf h GLU 283 Cb 0.85 -0.29 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1ypf h GLU 283 CO -0.36 0.85 -0.29 -0.44 -0.73 0.00 0.00 179.01 178.04 1ypf h ASP 284 N 1.33 0.86 -0.68 1.04 3.32 -1.71 -2.19 116.42 118.39 1ypf h ASP 284 Ca 0.38 -0.35 0.01 0.00 0.02 0.00 0.00 57.03 57.09 1ypf h ASP 284 Cb -0.09 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.19 1ypf h ASP 284 CO -0.10 1.09 0.45 0.74 -1.72 0.00 0.00 179.24 179.70 1ypf h THR 285 N 0.70 1.18 -0.34 0.35 2.02 -1.04 -1.51 112.91 114.27 1ypf h THR 285 Ca 0.08 -0.32 -0.13 0.00 0.77 0.00 0.00 66.41 66.81 1ypf h THR 285 Cb 0.84 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1ypf h THR 285 CO 0.07 0.17 -0.30 -0.07 0.37 0.00 0.00 175.52 175.77 1ypf h LEU 286 N 0.92 0.75 -0.25 2.58 3.38 -1.14 0.13 115.31 121.68 1ypf h LEU 286 Ca 0.25 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1ypf h LEU 286 Cb -0.10 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1ypf h LEU 286 CO -0.05 1.00 0.13 0.40 0.09 0.00 0.00 178.44 180.01 1ypf h ILE 287 N 0.62 1.12 -0.43 1.22 2.04 -1.24 -1.30 117.51 119.54 1ypf h ILE 287 Ca 0.07 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 1ypf h ILE 287 Cb 0.81 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1ypf h ILE 287 CO 0.07 0.12 0.14 -0.08 0.00 0.00 0.00 178.15 178.40 1ypf h GLU 288 N 0.29 0.66 -0.93 2.37 4.81 -1.15 -0.22 114.58 120.40 1ypf h GLU 288 Ca 0.09 -0.14 0.15 0.00 -0.13 0.00 0.00 59.36 59.33 1ypf h GLU 288 Cb 0.07 -0.10 -0.09 0.00 0.63 0.00 0.00 28.75 29.26 1ypf h GLU 288 CO -0.01 0.63 0.54 0.52 -0.73 0.00 0.00 179.01 179.96 1ypf h MET 289 N 0.55 0.75 -0.30 1.92 2.86 -0.91 0.15 114.93 119.95 1ypf h MET 289 Ca 0.14 -0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.59 1ypf h MET 289 Cb 0.24 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.73 1ypf h MET 289 CO -0.01 0.50 -0.39 1.49 1.06 0.00 0.00 176.91 179.56 1ypf h GLU 290 N 0.77 0.79 -0.42 1.72 4.81 -0.61 -1.38 114.58 120.27 1ypf h GLU 290 Ca 0.50 -0.45 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1ypf h GLU 290 Cb 0.65 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 1ypf h GLU 290 CO -0.33 1.08 0.19 1.96 -0.73 0.00 0.00 179.01 181.19 1ypf h GLN 291 N 0.56 0.60 -0.73 1.92 4.20 -0.48 -0.92 115.11 120.25 1ypf h GLN 291 Ca 0.04 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1ypf h GLN 291 Cb 0.98 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.62 1ypf h GLN 291 CO 0.09 0.53 0.42 -0.44 -0.67 0.00 0.00 178.83 178.77 1ypf h ASP 292 N 0.53 0.89 -0.26 1.46 3.32 -0.69 -1.44 116.42 120.23 1ypf h ASP 292 Ca 0.14 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 1ypf h ASP 292 Cb 0.13 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1ypf h ASP 292 CO -0.02 0.71 -0.08 0.25 -1.72 0.00 0.00 179.24 178.38 1ypf h LEU 293 N 1.00 0.63 -0.83 1.55 5.85 -1.07 -1.43 115.31 121.01 1ypf h LEU 293 Ca 0.26 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1ypf h LEU 293 Cb -0.00 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1ypf h LEU 293 CO -0.05 0.75 0.48 1.56 -0.34 0.00 0.00 178.44 180.85 1ypf h GLN 294 N 0.60 1.14 -0.72 1.25 4.20 -0.82 -1.27 115.11 119.48 1ypf h GLN 294 Ca 0.11 -0.12 0.02 0.00 0.06 0.00 0.00 58.65 58.72 1ypf h GLN 294 Cb 0.50 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 28.01 1ypf h GLN 294 CO 0.03 0.82 0.47 0.77 -0.67 0.00 0.00 178.83 180.25 1ypf h SER 295 N 1.15 0.79 -0.39 1.46 0.02 -0.84 -0.46 113.55 115.27 1ypf h SER 295 Ca 0.30 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.28 1ypf h SER 295 Cb -0.01 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 1ypf h SER 295 CO -0.05 0.56 0.14 0.28 -1.14 0.00 0.00 176.83 176.62 1ypf h SER 296 N 0.94 0.14 -0.77 3.07 0.02 -0.89 -0.45 113.55 115.61 1ypf h SER 296 Ca 0.28 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.24 1ypf h SER 296 Cb -0.06 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 1ypf h SER 296 CO -0.08 0.12 0.36 0.40 -1.14 0.00 0.00 176.83 176.48 1ypf h ILE 297 N 0.29 1.25 0.23 3.27 2.04 -0.93 -0.70 117.51 122.96 1ypf h ILE 297 Ca 0.18 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1ypf h ILE 297 Cb 0.16 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 1ypf h ILE 297 CO -0.19 0.31 -0.23 -1.28 0.00 0.00 0.00 178.15 176.76 1ypf h SER 298 N 1.12 -0.63 -0.16 1.72 0.87 -0.44 -2.40 113.55 113.64 1ypf h SER 298 Ca 0.27 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1ypf h SER 298 Cb 0.14 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1ypf h SER 298 CO -0.03 -0.34 0.10 1.88 -0.53 0.00 0.00 176.83 177.91 1ypf h TYR 299 N -0.49 0.20 0.00 2.24 0.05 -0.85 -2.19 116.97 115.92 1ypf h TYR 299 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ypf h TYR 299 Cb 0.46 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.14 1ypf h TYR 299 CO -0.16 0.12 0.00 0.00 -1.05 0.00 0.00 178.16 177.07 1ypf n ALA 300 N -2.52 2.06 -1.60 3.88 0.00 -0.29 -0.78 120.51 121.26 1ypf n ALA 300 Ca -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 53.44 53.30 1ypf n ALA 300 Cb 0.08 -1.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 1ypf n ALA 300 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ypf n GLY 301 N 0.32 0.42 0.72 0.00 0.00 -0.82 -4.51 105.19 101.31 1ypf n GLY 301 Ca 0.10 -0.84 -0.05 0.00 0.00 0.00 0.00 46.02 45.23 1ypf n GLY 301 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ypf n GLY 302 N -1.76 3.92 0.00 -0.02 0.00 -1.08 -4.69 105.19 101.56 1ypf n GLY 302 Ca -0.04 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.03 1ypf n GLY 302 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ypf n THR 303 N -0.20 0.00 -4.19 2.61 -2.24 -1.26 -4.43 114.28 104.58 1ypf n THR 303 Ca -0.01 -0.40 -0.12 0.00 -2.27 0.00 0.00 64.05 61.26 1ypf n THR 303 Cb 0.13 1.14 -0.10 0.00 -2.10 0.00 0.00 70.33 69.40 1ypf n THR 303 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1ypf s LYS 304 N -0.26 1.14 0.25 -0.78 -2.85 -1.26 -0.26 119.74 115.73 1ypf s LYS 304 Ca 0.00 -1.59 -0.03 0.00 -1.00 0.00 0.00 55.97 53.35 1ypf s LYS 304 Cb 0.00 0.26 0.43 0.00 -2.06 0.00 0.00 37.83 36.46 1ypf s LYS 304 CO 0.00 -0.36 1.82 1.25 0.10 0.00 0.00 175.35 178.16 1ypf h LEU 305 N 2.67 0.76 -2.27 2.77 5.85 -1.75 -1.43 115.31 121.90 1ypf h LEU 305 Ca -0.36 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1ypf h LEU 305 Cb 1.24 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1ypf h LEU 305 CO 0.54 0.43 0.00 0.44 -0.34 0.00 0.00 178.44 179.51 1ypf h ASP 306 N 0.86 0.00 -0.18 1.25 3.32 -1.93 -1.52 116.42 118.22 1ypf h ASP 306 Ca 0.42 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.49 1ypf h ASP 306 Cb 0.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1ypf h ASP 306 CO -0.24 0.00 0.12 0.77 -1.72 0.00 0.00 179.24 178.17 1ypf h SER 307 N 0.00 0.14 -0.01 6.45 4.64 -1.65 -1.73 113.55 121.39 1ypf h SER 307 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1ypf h SER 307 Cb 0.10 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1ypf h SER 307 CO 0.00 0.10 -0.02 0.40 -0.87 0.00 0.00 176.83 176.44 1ypf h ILE 308 N 0.16 1.06 0.00 0.95 2.04 -1.46 -3.09 117.51 117.18 1ypf h ILE 308 Ca 0.08 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1ypf h ILE 308 Cb 0.10 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1ypf h ILE 308 CO -0.01 0.08 0.00 0.03 0.00 0.00 0.00 178.15 178.25 1ypf h ARG 309 N 0.10 0.00 -0.02 2.37 3.08 -1.48 -3.14 114.38 115.29 1ypf h ARG 309 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1ypf h ARG 309 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1ypf h ARG 309 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.15 1ypf n THR 310 N -2.73 1.55 -2.06 2.04 -2.24 -1.17 -4.92 114.28 104.76 1ypf n THR 310 Ca -0.01 -1.74 -0.33 0.00 -2.27 0.00 0.00 64.05 59.71 1ypf n THR 310 Cb 0.16 0.06 0.01 0.00 -2.10 0.00 0.00 70.33 68.45 1ypf n THR 310 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ypf s VAL 311 N -2.11 3.85 0.78 2.28 -7.23 -1.18 -5.07 120.40 111.72 1ypf s VAL 311 Ca 0.20 0.87 -0.11 0.00 -1.81 0.00 0.00 61.98 61.14 1ypf s VAL 311 Cb 0.17 -3.40 0.07 0.00 0.56 0.00 0.00 36.38 33.79 1ypf s VAL 311 CO 0.03 -0.52 1.14 -0.62 -0.31 0.00 0.00 175.10 174.82 1ypf s ASP 312 N -2.82 4.61 0.17 4.85 2.15 -1.26 -4.93 116.67 119.43 1ypf s ASP 312 Ca 0.63 0.73 -0.13 0.00 0.43 0.00 0.00 52.55 54.21 1ypf s ASP 312 Cb -0.16 -1.26 0.01 0.00 -0.30 0.00 0.00 42.92 41.21 1ypf s ASP 312 CO 0.37 -1.82 0.38 -0.72 -0.17 0.00 0.00 175.17 173.21 1ypf s TYR 313 N -3.50 0.15 0.18 -5.34 -0.85 -1.26 -1.69 117.35 105.04 1ypf s TYR 313 Ca 0.61 -0.51 0.07 0.00 -0.52 0.00 0.00 57.07 56.72 1ypf s TYR 313 Cb -0.11 0.14 -0.04 0.00 0.38 0.00 0.00 41.96 42.32 1ypf s TYR 313 CO 0.48 -0.79 -0.14 0.14 -1.52 0.00 0.00 175.55 173.72 1ypf s VAL 314 N -3.92 1.60 -0.31 -3.49 -7.23 -0.25 -4.93 120.40 101.87 1ypf s VAL 314 Ca 0.13 -2.09 -0.06 0.00 -1.81 0.00 0.00 61.98 58.14 1ypf s VAL 314 Cb 0.02 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 35.05 1ypf s VAL 314 CO -0.02 -0.57 0.07 -0.69 -0.31 0.00 0.00 175.10 173.58 1ypf s VAL 315 N -2.84 3.77 0.64 1.32 1.01 -1.26 -1.67 120.40 121.38 1ypf s VAL 315 Ca 0.19 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 1ypf s VAL 315 Cb -0.01 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1ypf s VAL 315 CO 0.05 -0.01 1.04 0.68 0.00 0.00 0.00 175.10 176.86 1ypf s VAL 316 N 1.44 4.51 -0.02 2.92 -7.23 -0.05 -5.03 120.40 116.94 1ypf s VAL 316 Ca 0.01 0.81 -0.00 0.00 -1.81 0.00 0.00 61.98 60.99 1ypf s VAL 316 Cb -0.18 -3.77 -0.00 0.00 0.56 0.00 0.00 36.38 32.99 1ypf s VAL 316 CO 0.02 -1.06 -0.00 0.50 -0.31 0.00 0.00 175.10 174.24 1ypf h LYS 317 N -0.41 0.00 -5.24 4.82 3.64 -1.98 -3.44 116.57 113.96 1ypf h LYS 317 Ca -0.44 0.00 -0.62 0.00 -1.27 0.00 0.00 60.65 58.32 1ypf h LYS 317 Cb 1.20 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.88 1ypf h LYS 317 CO 0.61 0.00 -0.14 -0.80 -2.27 0.00 0.00 179.45 176.85 1ypf s ASN 318 N -3.50 6.33 0.00 4.20 0.01 -1.26 -4.96 114.94 115.76 1ypf s ASN 318 Ca -0.00 0.39 0.05 0.00 -0.71 0.00 0.00 52.86 52.59 1ypf s ASN 318 Cb 0.00 -2.24 -0.03 0.00 0.41 0.00 0.00 41.25 39.39 1ypf s ASN 318 CO 0.00 -0.23 0.31 -1.54 -1.51 0.00 0.00 177.10 174.13 1ypf n SER 319 N 5.41 0.49 -0.87 -1.22 3.41 -1.26 -5.07 113.62 114.52 1ypf n SER 319 Ca -0.07 -0.75 0.11 0.00 -0.26 0.00 0.00 58.87 57.91 1ypf n SER 319 Cb 0.50 0.78 0.09 0.00 -0.26 0.00 0.00 64.21 65.32 1ypf n SER 319 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18