#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ywx s ILE 2 N 0.00 1.38 -0.25 1.12 1.01 -1.02 -1.70 121.20 121.74 2ywx s ILE 2 Ca 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 59.93 2ywx s ILE 2 Cb 0.00 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.27 2ywx s ILE 2 CO 0.00 0.40 0.01 0.00 0.00 0.00 0.00 174.94 175.35 2ywx s ILE 4 N 1.47 5.19 -0.15 0.00 1.01 -0.22 -0.13 121.20 128.38 2ywx s ILE 4 Ca 0.04 0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.83 2ywx s ILE 4 Cb -0.16 -3.44 0.01 0.00 0.01 0.00 0.00 42.46 38.89 2ywx s ILE 4 CO -0.01 0.32 -0.21 -0.63 0.00 0.00 0.00 174.94 174.41 2ywx s ILE 5 N 1.34 2.01 -0.16 2.92 1.01 0.49 -0.51 121.20 128.30 2ywx s ILE 5 Ca 0.07 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 59.70 2ywx s ILE 5 Cb -0.15 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 2ywx s ILE 5 CO 0.07 0.54 0.13 -0.04 0.00 0.00 0.00 174.94 175.63 2ywx s MET 6 N 0.96 3.79 0.44 2.79 -1.94 0.14 -1.07 119.30 124.42 2ywx s MET 6 Ca -0.04 -0.19 0.26 0.00 -1.71 0.00 0.00 55.69 54.01 2ywx s MET 6 Cb -0.15 -3.28 0.67 0.00 2.01 0.00 0.00 34.83 34.08 2ywx s MET 6 CO -0.05 0.53 1.73 0.78 -0.01 0.00 0.00 175.02 178.00 2ywx h GLY 7 N 5.84 0.00 -3.79 -0.03 0.00 -1.35 0.14 103.07 103.87 2ywx h GLY 7 Ca -0.48 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 2ywx h GLY 7 CO 0.67 0.00 0.02 -0.45 0.00 0.00 0.00 176.54 176.78 2ywx s SER 8 N -5.85 -0.44 0.00 0.19 0.15 -1.26 -4.10 113.70 102.38 2ywx s SER 8 Ca 0.06 0.25 0.11 0.00 0.70 0.00 0.00 55.95 57.07 2ywx s SER 8 Cb 0.07 0.48 0.51 0.00 -1.71 0.00 0.00 66.02 65.36 2ywx s SER 8 CO 0.62 -0.67 1.33 1.21 1.20 0.00 0.00 173.24 176.93 2ywx n GLU 9 N 0.58 0.05 0.17 5.44 2.13 -1.26 -1.14 120.64 126.61 2ywx n GLU 9 Ca -0.19 0.27 0.13 0.00 0.66 0.00 0.00 57.16 58.04 2ywx n GLU 9 Cb 0.59 -1.50 0.46 0.00 0.27 0.00 0.00 31.44 31.26 2ywx n GLU 9 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2ywx h SER 10 N 0.00 0.00 -0.40 4.31 0.02 -1.99 -2.86 113.55 112.63 2ywx h SER 10 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ywx h SER 10 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2ywx h SER 10 CO 0.00 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.16 2ywx n ASP 11 N -2.58 2.22 -0.17 3.07 8.00 -0.29 -4.44 116.55 122.36 2ywx n ASP 11 Ca 0.03 -1.97 -0.07 0.00 0.71 0.00 0.00 54.79 53.49 2ywx n ASP 11 Cb 0.35 -0.26 0.02 0.00 -0.02 0.00 0.00 41.12 41.21 2ywx n ASP 11 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2ywx h LEU 12 N 2.49 0.59 -0.52 0.64 5.85 -1.68 -0.10 115.31 122.58 2ywx h LEU 12 Ca 0.00 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.77 2ywx h LEU 12 Cb 0.57 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 2ywx h LEU 12 CO 0.00 0.43 0.19 0.07 -0.34 0.00 0.00 178.44 178.80 2ywx h LYS 13 N 0.69 0.37 -0.09 1.25 2.10 -1.85 0.12 116.57 119.16 2ywx h LYS 13 Ca 0.19 -0.02 -0.15 0.00 -2.00 0.00 0.00 60.65 58.66 2ywx h LYS 13 Cb -0.07 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.17 2ywx h LYS 13 CO -0.04 0.24 -0.61 0.82 -2.00 0.00 0.00 179.45 177.86 2ywx h ILE 14 N 0.38 1.37 -0.14 0.07 5.03 -1.83 -3.08 117.51 119.32 2ywx h ILE 14 Ca 0.25 -1.97 -0.09 0.00 -0.12 0.00 0.00 64.86 62.92 2ywx h ILE 14 Cb 0.27 1.98 -0.01 0.00 -3.03 0.00 0.00 36.82 36.02 2ywx h ILE 14 CO -0.25 0.59 -0.33 0.00 -0.68 0.00 0.00 178.15 177.48 2ywx h ALA 15 N 1.12 1.19 0.00 1.87 0.00 -0.13 -2.78 119.26 120.53 2ywx h ALA 15 Ca -0.01 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 2ywx h ALA 15 Cb 1.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2ywx h ALA 15 CO 0.10 0.54 -0.44 0.93 0.00 0.00 0.00 179.25 180.37 2ywx h GLU 16 N 0.23 0.00 -0.85 0.00 5.08 -0.70 -1.97 114.58 116.37 2ywx h GLU 16 Ca 0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2ywx h GLU 16 Cb 0.70 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 2ywx h GLU 16 CO 0.05 0.44 0.52 0.87 -1.00 0.00 0.00 179.01 179.89 2ywx h LYS 17 N 0.00 1.14 0.14 2.33 1.57 -1.43 -0.43 116.57 119.90 2ywx h LYS 17 Ca -0.00 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2ywx h LYS 17 Cb 0.98 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2ywx h LYS 17 CO 0.06 0.80 -0.07 0.00 -0.57 0.00 0.00 179.45 179.66 2ywx h ALA 18 N 1.28 -0.19 -0.51 3.86 0.00 -1.45 -3.10 119.26 119.15 2ywx h ALA 18 Ca 0.30 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.13 2ywx h ALA 18 Cb -0.06 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 2ywx h ALA 18 CO -0.06 -0.46 0.17 0.28 0.00 0.00 0.00 179.25 179.18 2ywx h VAL 19 N -0.49 0.80 -0.24 0.00 2.07 -1.12 -1.30 116.25 115.98 2ywx h VAL 19 Ca -0.02 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.42 2ywx h VAL 19 Cb 0.39 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2ywx h VAL 19 CO 0.03 0.06 0.16 0.78 0.02 0.00 0.00 177.57 178.63 2ywx h ASN 20 N 0.34 0.17 -0.04 0.57 2.35 -1.11 0.17 115.58 118.01 2ywx h ASN 20 Ca 0.25 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.94 2ywx h ASN 20 Cb 0.28 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2ywx h ASN 20 CO -0.27 0.12 -0.17 0.40 -1.65 0.00 0.00 177.43 175.86 2ywx h ILE 21 N 0.19 1.46 -0.38 2.81 1.08 -1.20 -2.78 117.51 118.70 2ywx h ILE 21 Ca 0.10 -1.62 -0.01 0.00 -0.39 0.00 0.00 64.86 62.95 2ywx h ILE 21 Cb 0.17 2.40 -0.02 0.00 -3.07 0.00 0.00 36.82 36.30 2ywx h ILE 21 CO -0.02 0.45 0.21 -0.07 -0.69 0.00 0.00 178.15 178.03 2ywx h LEU 22 N -0.36 0.45 -0.89 1.44 3.38 -0.38 -1.68 115.31 117.27 2ywx h LEU 22 Ca -0.01 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 2ywx h LEU 22 Cb 0.81 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2ywx h LEU 22 CO 0.04 0.36 -0.44 0.11 0.09 0.00 0.00 178.44 178.60 2ywx h LYS 23 N 0.52 0.25 0.00 1.13 1.57 -0.71 -2.41 116.57 116.92 2ywx h LYS 23 Ca 0.14 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2ywx h LYS 23 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2ywx h LYS 23 CO -0.02 0.65 -0.25 0.93 -0.57 0.00 0.00 179.45 180.19 2ywx h GLU 24 N 0.21 0.00 -0.02 3.15 5.08 -1.02 -2.80 114.58 119.18 2ywx h GLU 24 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2ywx h GLU 24 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2ywx h GLU 24 CO 0.07 0.25 -0.21 1.19 -1.00 0.00 0.00 179.01 179.30 2ywx n PHE 25 N -3.35 0.00 -3.45 4.33 3.01 -1.01 -4.97 117.46 112.02 2ywx n PHE 25 Ca 0.01 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.27 2ywx n PHE 25 Cb 0.47 -0.03 0.08 0.00 -0.01 0.00 0.00 39.48 39.98 2ywx n PHE 25 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ywx n GLY 26 N 1.33 -0.38 3.64 1.37 0.00 -0.94 -5.02 105.19 105.19 2ywx n GLY 26 Ca 0.13 0.14 -0.27 0.00 0.00 0.00 0.00 46.02 46.03 2ywx n GLY 26 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ywx s VAL 27 N -3.30 3.59 0.40 1.61 -7.23 -1.02 -5.06 120.40 109.39 2ywx s VAL 27 Ca 0.38 -1.47 -0.25 0.00 -1.81 0.00 0.00 61.98 58.83 2ywx s VAL 27 Cb -0.17 -2.80 -0.08 0.00 0.56 0.00 0.00 36.38 33.89 2ywx s VAL 27 CO 0.67 -0.10 1.14 -1.61 -0.31 0.00 0.00 175.10 174.88 2ywx s GLU 28 N -2.90 4.07 0.08 4.82 0.41 -1.26 -4.77 118.70 119.15 2ywx s GLU 28 Ca 0.27 1.76 -0.27 0.00 -0.41 0.00 0.00 54.97 56.32 2ywx s GLU 28 Cb -0.09 -2.64 0.08 0.00 -1.78 0.00 0.00 34.13 29.70 2ywx s GLU 28 CO 0.18 -0.28 0.92 -0.59 -0.49 0.00 0.00 175.26 174.99 2ywx s PHE 29 N -1.47 -0.24 0.04 1.61 -0.12 -1.26 -2.43 117.98 114.11 2ywx s PHE 29 Ca 0.57 0.01 0.04 0.00 -0.05 0.00 0.00 56.93 57.51 2ywx s PHE 29 Cb -0.29 0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 42.67 2ywx s PHE 29 CO 0.36 -0.70 -0.12 -1.21 -0.05 0.00 0.00 175.22 173.50 2ywx s GLU 30 N -3.22 0.79 -0.14 1.99 0.41 -0.52 -4.92 118.70 113.08 2ywx s GLU 30 Ca 0.09 -0.75 0.01 0.00 -0.41 0.00 0.00 54.97 53.91 2ywx s GLU 30 Cb -0.01 -0.75 0.02 0.00 -1.78 0.00 0.00 34.13 31.60 2ywx s GLU 30 CO -0.03 0.18 -0.17 0.08 -0.49 0.00 0.00 175.26 174.82 2ywx s VAL 31 N -0.97 1.74 0.17 2.63 1.01 -1.26 -1.05 120.40 122.67 2ywx s VAL 31 Ca -0.01 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.26 2ywx s VAL 31 Cb -0.08 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 2ywx s VAL 31 CO 0.01 0.49 -0.11 -0.13 0.00 0.00 0.00 175.10 175.36 2ywx s ARG 32 N 1.21 1.18 -0.11 2.72 1.81 0.34 -5.01 118.95 121.08 2ywx s ARG 32 Ca 0.00 -1.52 0.02 0.00 -1.72 0.00 0.00 55.73 52.52 2ywx s ARG 32 Cb -0.14 -0.80 0.01 0.00 -0.45 0.00 0.00 34.95 33.57 2ywx s ARG 32 CO -0.07 0.10 -0.19 0.08 -0.68 0.00 0.00 175.30 174.54 2ywx s VAL 33 N -3.21 1.73 -0.29 3.52 1.01 -1.26 0.26 120.40 122.17 2ywx s VAL 33 Ca 0.20 -0.79 -0.15 0.00 0.00 0.00 0.00 61.98 61.23 2ywx s VAL 33 Cb 0.02 -1.55 0.10 0.00 0.00 0.00 0.00 36.38 34.95 2ywx s VAL 33 CO 0.03 0.49 0.72 0.00 0.00 0.00 0.00 175.10 176.34 2ywx s ALA 34 N 0.80 -1.98 -0.10 5.51 0.00 0.04 -4.93 121.76 121.10 2ywx s ALA 34 Ca -0.09 2.38 -0.18 0.00 0.00 0.00 0.00 51.96 54.06 2ywx s ALA 34 Cb -0.16 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 2ywx s ALA 34 CO 0.00 -0.52 0.49 0.45 0.00 0.00 0.00 175.76 176.18 2ywx s SER 35 N 1.94 6.73 0.31 0.00 0.15 -1.26 -4.04 113.70 117.52 2ywx s SER 35 Ca -0.09 0.87 0.07 0.00 0.70 0.00 0.00 55.95 57.50 2ywx s SER 35 Cb -0.07 -2.29 0.50 0.00 -1.71 0.00 0.00 66.02 62.45 2ywx s SER 35 CO -0.19 0.03 1.72 0.00 1.20 0.00 0.00 173.24 176.00 2ywx h ALA 36 N 6.48 1.15 0.00 5.45 0.00 -1.88 -0.95 119.26 129.51 2ywx h ALA 36 Ca -0.42 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 53.94 2ywx h ALA 36 Cb 1.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 2ywx h ALA 36 CO 0.74 0.57 -0.83 1.12 0.00 0.00 0.00 179.25 180.85 2ywx h HIS 37 N 0.18 0.00 0.08 0.00 -0.00 -1.97 -3.34 115.15 110.11 2ywx h HIS 37 Ca 0.02 0.00 -0.25 0.00 -0.00 0.00 0.00 60.37 60.14 2ywx h HIS 37 Cb 0.78 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.19 2ywx h HIS 37 CO 0.01 1.30 -1.15 0.00 -0.00 0.00 0.00 177.93 178.09 2ywx h ARG 38 N -1.00 0.19 -2.07 5.12 3.08 -1.98 -3.40 114.38 114.32 2ywx h ARG 38 Ca -0.23 -0.31 -0.51 0.00 0.07 0.00 0.00 59.98 59.00 2ywx h ARG 38 Cb 1.18 0.11 -0.40 0.00 0.08 0.00 0.00 29.97 30.94 2ywx h ARG 38 CO -0.14 1.14 -1.06 0.25 -1.07 0.00 0.00 179.97 179.09 2ywx n THR 39 N -3.48 0.57 0.11 2.04 -2.24 -0.37 -4.94 114.28 105.97 2ywx n THR 39 Ca -0.06 -4.80 0.18 0.00 -2.27 0.00 0.00 64.05 57.11 2ywx n THR 39 Cb 0.99 -0.62 0.75 0.00 -2.10 0.00 0.00 70.33 69.34 2ywx n THR 39 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2ywx h PRO 40 N 3.06 0.00 0.00 -0.78 0.13 -1.66 -0.43 132.00 132.32 2ywx h PRO 40 Ca 0.11 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.16 2ywx h PRO 40 Cb 0.86 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 2ywx h PRO 40 CO 0.57 0.00 -0.35 1.05 -0.23 0.00 0.00 178.00 179.04 2ywx h GLU 41 N 0.00 0.00 0.07 0.86 9.09 -1.92 -2.20 114.58 120.49 2ywx h GLU 41 Ca 0.17 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.34 2ywx h GLU 41 Cb 0.79 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.91 2ywx h GLU 41 CO -0.00 0.35 -0.99 1.25 0.05 0.00 0.00 179.01 179.68 2ywx h LEU 42 N 0.00 0.75 0.21 3.06 5.85 -1.43 -2.34 115.31 121.41 2ywx h LEU 42 Ca -0.00 -0.81 -0.01 0.00 0.84 0.00 0.00 57.88 57.90 2ywx h LEU 42 Cb 1.13 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.93 2ywx h LEU 42 CO 0.05 1.47 -0.10 0.58 -0.34 0.00 0.00 178.44 180.10 2ywx h VAL 43 N 0.12 0.80 -0.37 1.05 2.07 -1.51 0.80 116.25 119.21 2ywx h VAL 43 Ca -0.14 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.44 2ywx h VAL 43 Cb 1.69 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 32.19 2ywx h VAL 43 CO 0.19 0.00 -0.05 -0.08 0.02 0.00 0.00 177.57 177.66 2ywx h GLU 44 N -0.28 0.05 -0.71 1.57 4.81 -1.47 -0.60 114.58 117.94 2ywx h GLU 44 Ca -0.03 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 2ywx h GLU 44 Cb 0.21 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2ywx h GLU 44 CO 0.05 0.03 0.23 1.49 -0.73 0.00 0.00 179.01 180.08 2ywx h GLU 45 N 0.05 1.10 -0.16 1.92 4.81 -1.22 -0.37 114.58 120.70 2ywx h GLU 45 Ca 0.18 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 2ywx h GLU 45 Cb 0.27 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 2ywx h GLU 45 CO -0.34 0.93 -0.08 0.82 -0.73 0.00 0.00 179.01 179.60 2ywx h ILE 46 N 1.06 1.31 0.15 2.32 2.04 -0.24 -3.11 117.51 121.03 2ywx h ILE 46 Ca 0.23 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 2ywx h ILE 46 Cb 0.29 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 2ywx h ILE 46 CO -0.01 0.34 -0.07 0.58 0.00 0.00 0.00 178.15 178.99 2ywx h VAL 47 N 0.02 1.00 -0.00 1.67 2.07 -1.03 -2.17 116.25 117.81 2ywx h VAL 47 Ca 0.04 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2ywx h VAL 47 Cb 0.56 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2ywx h VAL 47 CO 0.02 0.16 0.00 0.11 0.02 0.00 0.00 177.57 177.89 2ywx h LYS 48 N -0.54 0.00 -0.11 1.57 1.57 -1.18 -2.65 116.57 115.23 2ywx h LYS 48 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2ywx h LYS 48 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2ywx h LYS 48 CO 0.03 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.00 2ywx n ASN 49 N -3.54 2.21 -4.79 0.86 3.02 -1.17 -5.02 115.26 106.83 2ywx n ASN 49 Ca -0.03 -1.61 -0.34 0.00 -0.03 0.00 0.00 54.58 52.57 2ywx n ASN 49 Cb 0.08 -0.06 -0.01 0.00 -0.61 0.00 0.00 39.78 39.17 2ywx n ASN 49 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2ywx s SER 50 N -0.95 6.03 0.00 6.41 0.15 -0.82 -4.94 113.70 119.59 2ywx s SER 50 Ca 0.16 1.96 0.17 0.00 0.70 0.00 0.00 55.95 58.94 2ywx s SER 50 Cb 0.10 -2.56 0.40 0.00 -1.71 0.00 0.00 66.02 62.25 2ywx s SER 50 CO 0.14 -1.00 1.32 0.29 1.20 0.00 0.00 173.24 175.20 2ywx n LYS 51 N -1.33 2.51 -2.17 5.44 4.76 -1.26 -5.00 118.16 121.10 2ywx n LYS 51 Ca 0.10 -2.18 -0.40 0.00 -2.87 0.00 0.00 58.31 52.96 2ywx n LYS 51 Cb 0.52 -1.40 -0.02 0.00 -1.84 0.00 0.00 35.03 32.30 2ywx n LYS 51 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ywx s ALA 52 N -1.09 3.32 -0.20 7.82 0.00 -1.26 -4.72 121.76 125.62 2ywx s ALA 52 Ca 0.32 1.15 0.20 0.00 0.00 0.00 0.00 51.96 53.63 2ywx s ALA 52 Cb 0.18 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2ywx s ALA 52 CO 0.24 -0.64 1.00 -0.44 0.00 0.00 0.00 175.76 175.92 2ywx h ASP 53 N 2.98 0.00 -3.68 0.00 3.32 -1.72 -3.46 116.42 113.86 2ywx h ASP 53 Ca -0.49 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.26 2ywx h ASP 53 Cb 1.23 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.48 2ywx h ASP 53 CO 0.64 0.24 -0.74 -0.69 -1.72 0.00 0.00 179.24 176.97 2ywx s VAL 54 N -3.18 0.15 -0.11 -1.35 1.01 -1.24 -3.91 120.40 111.78 2ywx s VAL 54 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 2ywx s VAL 54 Cb 0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.26 2ywx s VAL 54 CO 0.79 0.08 -0.05 -0.36 0.00 0.00 0.00 175.10 175.56 2ywx s PHE 55 N 0.39 2.99 -0.25 5.22 0.08 -0.36 -1.46 117.98 124.59 2ywx s PHE 55 Ca -0.04 -0.12 0.02 0.00 0.12 0.00 0.00 56.93 56.92 2ywx s PHE 55 Cb -0.06 -1.82 0.05 0.00 -0.57 0.00 0.00 43.02 40.62 2ywx s PHE 55 CO -0.01 0.18 -0.12 0.42 -0.10 0.00 0.00 175.22 175.59 2ywx s ILE 56 N -0.31 2.19 -0.16 0.64 1.01 0.82 0.37 121.20 125.76 2ywx s ILE 56 Ca 0.05 -1.52 -0.07 0.00 0.00 0.00 0.00 60.65 59.11 2ywx s ILE 56 Cb -0.13 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2ywx s ILE 56 CO 0.02 0.06 0.06 0.00 0.00 0.00 0.00 174.94 175.08 2ywx s ALA 57 N 1.14 3.41 -0.19 9.38 0.00 0.10 -0.38 121.76 135.23 2ywx s ALA 57 Ca -0.07 -0.74 -0.00 0.00 0.00 0.00 0.00 51.96 51.15 2ywx s ALA 57 Cb -0.19 -1.85 0.05 0.00 0.00 0.00 0.00 23.12 21.12 2ywx s ALA 57 CO -0.06 0.27 -0.05 0.42 0.00 0.00 0.00 175.76 176.34 2ywx s ILE 58 N 0.10 1.22 0.08 0.00 1.01 -0.23 -0.87 121.20 122.50 2ywx s ILE 58 Ca 0.05 -0.79 -0.16 0.00 0.00 0.00 0.00 60.65 59.75 2ywx s ILE 58 Cb -0.12 -1.42 0.03 0.00 0.01 0.00 0.00 42.46 40.95 2ywx s ILE 58 CO 0.01 0.06 0.36 0.00 0.00 0.00 0.00 174.94 175.37 2ywx s ALA 59 N 1.57 -0.84 0.00 9.38 0.00 -1.18 -1.35 121.76 129.34 2ywx s ALA 59 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2ywx s ALA 59 Cb -0.16 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.43 2ywx s ALA 59 CO -0.07 -0.52 0.00 0.41 0.00 0.00 0.00 175.76 175.58 2ywx n GLY 60 N 0.21 4.36 7.00 0.00 0.00 -1.26 -1.94 105.19 113.55 2ywx n GLY 60 Ca -0.17 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.72 2ywx n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ywx n LEU 61 N 0.00 0.00 -4.11 0.99 4.77 -1.25 -1.97 117.00 115.43 2ywx n LEU 61 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.63 2ywx n LEU 61 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 2ywx n LEU 61 CO 0.00 0.00 1.77 0.00 -1.33 0.00 0.00 177.39 177.83 2ywx n ALA 62 N 4.86 2.41 -1.94 -1.18 0.00 -1.26 -1.86 120.51 121.54 2ywx n ALA 62 Ca 0.00 -3.13 -0.43 0.00 0.00 0.00 0.00 53.44 49.88 2ywx n ALA 62 Cb 0.00 -3.56 -0.03 0.00 0.00 0.00 0.00 19.45 15.86 2ywx n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ywx s ALA 63 N 8.29 2.97 -0.63 0.00 0.00 -0.83 -4.79 121.76 126.77 2ywx s ALA 63 Ca 0.64 0.45 0.06 0.00 0.00 0.00 0.00 51.96 53.11 2ywx s ALA 63 Cb 0.07 -3.98 0.02 0.00 0.00 0.00 0.00 23.12 19.22 2ywx s ALA 63 CO 0.14 -2.46 0.56 0.72 0.00 0.00 0.00 175.76 174.72 2ywx n HIS 64 N 10.00 0.00 0.09 0.00 8.25 -1.26 -4.26 115.22 128.04 2ywx n HIS 64 Ca 0.23 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.56 2ywx n HIS 64 Cb 0.46 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.49 2ywx n HIS 64 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2ywx h LEU 65 N 0.86 -0.12 -0.44 2.41 5.85 -1.96 -1.18 115.31 120.74 2ywx h LEU 65 Ca 0.00 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.80 2ywx h LEU 65 Cb 0.22 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 2ywx h LEU 65 CO 0.00 -0.08 0.01 -0.65 -0.34 0.00 0.00 178.44 177.38 2ywx h PRO 66 N -0.14 0.12 -0.59 5.25 0.11 -1.88 0.30 132.00 135.17 2ywx h PRO 66 Ca -0.01 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.09 2ywx h PRO 66 Cb 0.11 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.16 2ywx h PRO 66 CO 0.02 0.08 0.39 0.78 -0.21 0.00 0.00 178.00 179.06 2ywx h GLY 67 N 0.12 0.84 1.22 -0.55 0.00 -1.83 -1.20 103.07 101.67 2ywx h GLY 67 Ca 0.22 -0.31 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 2ywx h GLY 67 CO -0.36 0.31 -0.01 -2.08 0.00 0.00 0.00 176.54 174.40 2ywx h VAL 68 N 0.81 1.26 -0.46 4.60 2.07 -0.58 -1.80 116.25 122.15 2ywx h VAL 68 Ca 0.22 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.56 2ywx h VAL 68 Cb -0.09 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2ywx h VAL 68 CO -0.05 0.39 0.01 0.58 0.02 0.00 0.00 177.57 178.53 2ywx h VAL 69 N 0.86 1.26 -0.05 2.57 2.07 -0.66 -2.88 116.25 119.42 2ywx h VAL 69 Ca 0.16 -1.02 -0.07 0.00 0.82 0.00 0.00 66.70 66.59 2ywx h VAL 69 Cb 0.52 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2ywx h VAL 69 CO 0.03 0.35 -0.29 0.00 0.02 0.00 0.00 177.57 177.68 2ywx h ALA 70 N 0.92 1.43 0.00 1.67 0.00 -1.05 -1.91 119.26 120.32 2ywx h ALA 70 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2ywx h ALA 70 Cb 0.48 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2ywx h ALA 70 CO 0.02 0.42 0.00 -1.13 0.00 0.00 0.00 179.25 178.56 2ywx n SER 71 N -4.17 0.00 -0.43 0.00 3.41 -0.69 -3.04 113.62 108.70 2ywx n SER 71 Ca -0.02 0.30 0.08 0.00 -0.26 0.00 0.00 58.87 58.97 2ywx n SER 71 Cb 0.36 -0.42 0.01 0.00 -0.26 0.00 0.00 64.21 63.90 2ywx n SER 71 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ywx n LEU 72 N -1.42 1.80 -3.82 1.04 4.77 -0.73 -5.02 117.00 113.63 2ywx n LEU 72 Ca 0.07 -0.81 -0.10 0.00 -0.03 0.00 0.00 56.01 55.15 2ywx n LEU 72 Cb 0.23 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.27 2ywx n LEU 72 CO 0.20 0.34 0.12 0.28 -1.33 0.00 0.00 177.39 177.00 2ywx s THR 73 N -1.83 0.05 -2.15 -5.08 -1.32 -1.17 -4.67 115.64 99.47 2ywx s THR 73 Ca 0.15 -1.02 0.18 0.00 -1.21 0.00 0.00 61.69 59.79 2ywx s THR 73 Cb 0.13 -1.62 0.17 0.00 -1.51 0.00 0.00 72.50 69.68 2ywx s THR 73 CO 0.38 -0.25 1.09 0.35 -2.21 0.00 0.00 174.62 173.98 2ywx n THR 74 N -0.26 0.09 -1.92 5.08 -2.24 -1.26 -4.78 114.28 108.99 2ywx n THR 74 Ca -0.10 -0.55 -0.33 0.00 -2.27 0.00 0.00 64.05 60.81 2ywx n THR 74 Cb 0.63 1.29 0.02 0.00 -2.10 0.00 0.00 70.33 70.17 2ywx n THR 74 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ywx s LYS 75 N -1.43 3.14 0.23 -0.78 -0.14 -1.26 -4.95 119.74 114.54 2ywx s LYS 75 Ca 0.22 1.22 -0.31 0.00 -1.36 0.00 0.00 55.97 55.74 2ywx s LYS 75 Cb 0.15 -2.01 -0.11 0.00 -1.68 0.00 0.00 37.83 34.18 2ywx s LYS 75 CO 0.22 -0.96 1.61 -2.14 -0.76 0.00 0.00 175.35 173.32 2ywx s PRO 76 N -4.19 4.17 -0.20 -1.68 0.02 -1.25 -4.87 135.00 127.00 2ywx s PRO 76 Ca 0.64 2.49 0.00 0.00 0.02 0.00 0.00 61.00 64.16 2ywx s PRO 76 Cb -0.17 -3.08 0.02 0.00 0.02 0.00 0.00 34.50 31.29 2ywx s PRO 76 CO 0.40 -0.63 -0.16 0.08 -0.33 0.00 0.00 177.00 176.36 2ywx s VAL 77 N 0.64 2.32 -0.19 3.83 1.01 -1.26 -1.23 120.40 125.52 2ywx s VAL 77 Ca 0.68 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 2ywx s VAL 77 Cb -0.47 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 2ywx s VAL 77 CO 0.38 0.42 0.12 -0.63 0.00 0.00 0.00 175.10 175.39 2ywx s ILE 78 N 1.29 5.34 -0.07 2.22 1.01 0.16 -0.92 121.20 130.24 2ywx s ILE 78 Ca 0.03 0.16 -0.01 0.00 0.00 0.00 0.00 60.65 60.83 2ywx s ILE 78 Cb -0.14 -3.43 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 2ywx s ILE 78 CO -0.10 0.46 0.00 0.00 0.00 0.00 0.00 174.94 175.30 2ywx s ALA 79 N 0.24 3.28 -0.28 9.38 0.00 0.87 0.01 121.76 135.26 2ywx s ALA 79 Ca 0.08 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.23 2ywx s ALA 79 Cb -0.11 -1.44 0.08 0.00 0.00 0.00 0.00 23.12 21.64 2ywx s ALA 79 CO -0.01 0.60 -0.04 0.08 0.00 0.00 0.00 175.76 176.39 2ywx s VAL 80 N -0.93 2.00 0.14 0.00 1.01 -0.05 -2.62 120.40 119.96 2ywx s VAL 80 Ca 0.15 -1.77 -0.30 0.00 0.00 0.00 0.00 61.98 60.06 2ywx s VAL 80 Cb -0.11 -2.28 -0.08 0.00 0.00 0.00 0.00 36.38 33.91 2ywx s VAL 80 CO 0.04 -0.26 1.28 -2.84 0.00 0.00 0.00 175.10 173.32 2ywx s PRO 81 N 1.13 4.40 -0.15 2.72 0.02 -1.26 -3.11 135.00 138.74 2ywx s PRO 81 Ca -0.01 1.96 -0.04 0.00 0.02 0.00 0.00 61.00 62.93 2ywx s PRO 81 Cb -0.19 -3.25 -0.03 0.00 0.02 0.00 0.00 34.50 31.05 2ywx s PRO 81 CO -0.07 -0.27 -0.03 0.08 -0.33 0.00 0.00 177.00 176.37 2ywx s VAL 82 N 0.58 3.94 -0.63 3.83 1.01 -0.82 -0.20 120.40 128.11 2ywx s VAL 82 Ca 0.59 -0.34 -0.25 0.00 0.00 0.00 0.00 61.98 61.97 2ywx s VAL 82 Cb -0.34 -2.72 0.05 0.00 0.00 0.00 0.00 36.38 33.36 2ywx s VAL 82 CO 0.33 0.50 1.06 1.51 0.00 0.00 0.00 175.10 178.51 2ywx s ASP 83 N 0.29 6.26 0.00 3.32 -4.77 -1.26 -3.96 116.67 116.56 2ywx s ASP 83 Ca -0.03 -0.51 0.02 0.00 -3.30 0.00 0.00 52.55 48.73 2ywx s ASP 83 Cb -0.14 -2.48 -0.02 0.00 -1.09 0.00 0.00 42.92 39.20 2ywx s ASP 83 CO 0.03 -1.47 0.10 0.00 0.70 0.00 0.00 175.17 174.52 2ywx n ALA 84 N 8.12 2.23 -3.54 2.11 0.00 -1.26 -4.77 120.51 123.41 2ywx n ALA 84 Ca 0.01 -0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.28 2ywx n ALA 84 Cb 0.47 -0.06 -0.04 0.00 0.00 0.00 0.00 19.45 19.83 2ywx n ALA 84 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2ywx s LYS 85 N -1.11 0.75 -1.66 0.00 2.47 -1.26 -4.97 119.74 113.96 2ywx s LYS 85 Ca 0.01 -0.06 -0.14 0.00 -1.56 0.00 0.00 55.97 54.21 2ywx s LYS 85 Cb 0.01 0.35 0.13 0.00 -1.46 0.00 0.00 37.83 36.86 2ywx s LYS 85 CO 0.07 -0.28 0.65 1.28 0.16 0.00 0.00 175.35 177.22 2ywx n LEU 86 N 0.27 -1.67 -4.41 5.43 4.32 -1.26 -1.73 117.00 117.95 2ywx n LEU 86 Ca -0.10 -1.05 -0.40 0.00 -0.02 0.00 0.00 56.01 54.44 2ywx n LEU 86 Cb 0.60 -2.03 -0.08 0.00 -1.62 0.00 0.00 43.42 40.28 2ywx n LEU 86 CO 0.14 0.31 -0.20 -0.90 -1.22 0.00 0.00 177.39 175.53 2ywx n ASP 87 N -2.72 -1.37 0.00 -1.43 5.75 -1.26 -0.99 116.55 114.53 2ywx n ASP 87 Ca -0.02 -1.21 0.00 0.00 -0.01 0.00 0.00 54.79 53.55 2ywx n ASP 87 Cb 0.54 -1.54 0.00 0.00 -1.03 0.00 0.00 41.12 39.09 2ywx n ASP 87 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ywx n GLY 88 N -1.25 0.60 0.26 6.12 0.00 -0.70 -4.89 105.19 105.32 2ywx n GLY 88 Ca 0.05 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.23 2ywx n GLY 88 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ywx h LEU 89 N 0.00 0.00 0.22 0.99 7.12 -1.24 -2.62 115.31 119.78 2ywx h LEU 89 Ca 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 2ywx h LEU 89 Cb 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.22 2ywx h LEU 89 CO 0.00 0.04 -0.11 0.44 -0.13 0.00 0.00 178.44 178.69 2ywx h ASP 90 N 0.00 -0.25 -0.09 1.25 3.32 -1.80 -3.18 116.42 115.67 2ywx h ASP 90 Ca -0.00 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.08 2ywx h ASP 90 Cb 0.62 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 2ywx h ASP 90 CO 0.01 0.07 0.10 0.00 -1.72 0.00 0.00 179.24 177.70 2ywx h ALA 91 N -1.36 1.67 0.38 3.45 0.00 -1.44 -0.76 119.26 121.19 2ywx h ALA 91 Ca -0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2ywx h ALA 91 Cb 0.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2ywx h ALA 91 CO 0.05 -0.14 -0.18 1.25 0.00 0.00 0.00 179.25 180.23 2ywx h LEU 92 N 0.00 -0.43 -1.17 0.00 6.46 -1.56 -2.99 115.31 115.62 2ywx h LEU 92 Ca 0.04 0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.73 2ywx h LEU 92 Cb 0.24 0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 2ywx h LEU 92 CO -0.00 -0.20 -0.38 -0.07 -0.62 0.00 0.00 178.44 177.17 2ywx h LEU 93 N -0.72 0.07 -2.06 2.25 3.38 -1.52 -0.28 115.31 116.43 2ywx h LEU 93 Ca -0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2ywx h LEU 93 Cb 0.39 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2ywx h LEU 93 CO 0.08 0.44 -0.07 -1.28 0.09 0.00 0.00 178.44 177.71 2ywx h SER 94 N 0.06 0.00 0.00 -0.43 0.87 -1.22 -2.06 113.55 110.76 2ywx h SER 94 Ca 0.00 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.36 2ywx h SER 94 Cb 0.70 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.62 2ywx h SER 94 CO 0.05 0.07 -1.79 -1.54 -0.53 0.00 0.00 176.83 173.10 2ywx n SER 95 N -3.45 2.25 0.08 6.23 3.41 -1.03 -4.68 113.62 116.43 2ywx n SER 95 Ca -0.02 -0.01 -0.18 0.00 -0.26 0.00 0.00 58.87 58.41 2ywx n SER 95 Cb 0.21 0.69 -0.10 0.00 -0.26 0.00 0.00 64.21 64.75 2ywx n SER 95 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2ywx h VAL 96 N 0.00 1.35 0.00 -3.33 3.04 -1.04 -3.36 116.25 112.91 2ywx h VAL 96 Ca -0.31 -2.50 -0.14 0.00 -1.01 0.00 0.00 66.70 62.74 2ywx h VAL 96 Cb 1.68 2.58 -0.05 0.00 -2.01 0.00 0.00 31.29 33.49 2ywx h VAL 96 CO 0.01 0.75 -0.28 0.00 -1.01 0.00 0.00 177.57 177.04 2ywx n GLN 97 N -3.75 1.71 -1.15 4.17 1.13 -0.78 -4.91 117.38 113.81 2ywx n GLN 97 Ca -0.10 -0.75 -0.31 0.00 -1.94 0.00 0.00 57.00 53.90 2ywx n GLN 97 Cb 0.92 -1.77 0.11 0.00 0.11 0.00 0.00 30.24 29.62 2ywx n GLN 97 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2ywx s MET 98 N 0.85 1.89 0.35 -1.09 -1.94 -1.26 -5.02 119.30 113.08 2ywx s MET 98 Ca 0.50 1.19 -0.08 0.00 -1.71 0.00 0.00 55.69 55.59 2ywx s MET 98 Cb 0.24 -1.85 -0.06 0.00 2.01 0.00 0.00 34.83 35.17 2ywx s MET 98 CO 0.00 -1.91 0.66 -1.25 -0.01 0.00 0.00 175.02 172.51 2ywx s PRO 99 N -4.86 3.70 0.15 2.03 0.04 -1.26 -5.01 135.00 129.78 2ywx s PRO 99 Ca 0.62 0.23 -0.33 0.00 0.04 0.00 0.00 61.00 61.56 2ywx s PRO 99 Cb -0.18 -2.52 -0.17 0.00 0.04 0.00 0.00 34.50 31.67 2ywx s PRO 99 CO 0.57 0.09 1.07 -2.30 0.04 0.00 0.00 177.00 176.46 2ywx n PRO 100 N -1.13 0.83 0.00 0.56 -0.02 -1.26 -2.63 135.00 131.34 2ywx n PRO 100 Ca 0.00 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2ywx n PRO 100 Cb 0.54 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 2ywx n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ywx n GLY 101 N 1.93 2.84 2.79 -1.23 0.00 -1.26 -4.95 105.19 105.30 2ywx n GLY 101 Ca 0.16 -0.41 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 2ywx n GLY 101 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ywx n ILE 102 N 0.00 1.48 -1.78 -0.61 2.08 -1.08 -5.11 119.36 114.34 2ywx n ILE 102 Ca 0.00 -4.79 -0.31 0.00 0.56 0.00 0.00 62.75 58.21 2ywx n ILE 102 Cb 0.00 -2.13 0.02 0.00 -0.75 0.00 0.00 39.64 36.78 2ywx n ILE 102 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2ywx s PRO 103 N -1.48 3.36 -0.03 0.38 0.04 -1.26 -4.49 135.00 131.51 2ywx s PRO 103 Ca 0.28 0.85 -0.00 0.00 0.04 0.00 0.00 61.00 62.16 2ywx s PRO 103 Cb -0.01 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.52 2ywx s PRO 103 CO -0.15 -0.76 0.03 0.08 0.04 0.00 0.00 177.00 176.23 2ywx s VAL 104 N -3.09 0.01 -0.30 -0.36 1.01 -1.26 -4.74 120.40 111.67 2ywx s VAL 104 Ca 0.56 0.23 -0.29 0.00 0.00 0.00 0.00 61.98 62.49 2ywx s VAL 104 Cb -0.12 -0.17 0.01 0.00 0.00 0.00 0.00 36.38 36.09 2ywx s VAL 104 CO 0.53 0.14 1.16 0.00 0.00 0.00 0.00 175.10 176.93 2ywx s ALA 105 N 1.38 3.47 -0.11 5.51 0.00 -0.10 -4.89 121.76 127.03 2ywx s ALA 105 Ca -0.05 0.04 -0.03 0.00 0.00 0.00 0.00 51.96 51.91 2ywx s ALA 105 Cb -0.13 -3.70 -0.03 0.00 0.00 0.00 0.00 23.12 19.26 2ywx s ALA 105 CO -0.03 -1.54 0.02 0.99 0.00 0.00 0.00 175.76 175.20 2ywx s THR 106 N 3.85 4.49 0.45 0.00 2.01 -1.26 -0.09 115.64 125.09 2ywx s THR 106 Ca 0.50 -0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.38 2ywx s THR 106 Cb -0.14 -2.92 -0.05 0.00 0.01 0.00 0.00 72.50 69.40 2ywx s THR 106 CO 0.18 0.58 0.08 0.68 -0.69 0.00 0.00 174.62 175.44 2ywx s VAL 107 N -0.60 1.81 1.03 3.82 -7.23 -1.08 -4.97 120.40 113.19 2ywx s VAL 107 Ca 0.10 -1.89 -0.13 0.00 -1.81 0.00 0.00 61.98 58.25 2ywx s VAL 107 Cb -0.12 -2.70 0.13 0.00 0.56 0.00 0.00 36.38 34.25 2ywx s VAL 107 CO 0.02 0.00 0.61 0.61 -0.31 0.00 0.00 175.10 176.03 2ywx n GLY 108 N -1.18 -1.75 3.71 2.32 0.00 -1.26 -4.43 105.19 102.60 2ywx n GLY 108 Ca -0.08 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 2ywx n GLY 108 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ywx s ILE 109 N -2.42 2.97 -0.62 -0.61 1.01 -1.26 -2.29 121.20 117.99 2ywx s ILE 109 Ca 0.61 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.91 2ywx s ILE 109 Cb -0.20 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.85 2ywx s ILE 109 CO 0.65 0.04 0.00 0.47 0.00 0.00 0.00 174.94 176.09 2ywx n ASP 110 N 4.30 -4.88 -3.54 3.58 8.00 0.72 -4.92 116.55 119.81 2ywx n ASP 110 Ca 0.13 0.14 -0.40 0.00 0.71 0.00 0.00 54.79 55.37 2ywx n ASP 110 Cb 0.40 -2.89 -0.01 0.00 -0.02 0.00 0.00 41.12 38.61 2ywx n ASP 110 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2ywx n ARG 111 N -1.26 4.07 0.03 -1.24 5.12 -0.97 -4.68 116.66 117.73 2ywx n ARG 111 Ca -0.06 -3.14 0.00 0.00 -1.93 0.00 0.00 57.85 52.73 2ywx n ARG 111 Cb 0.39 -2.78 0.32 0.00 -1.16 0.00 0.00 32.46 29.23 2ywx n ARG 111 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 2ywx h GLY 112 N 6.70 0.48 0.93 -0.13 0.00 -1.87 -1.70 103.07 107.48 2ywx h GLY 112 Ca 0.67 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.66 2ywx h GLY 112 CO 1.61 0.27 0.06 -2.09 0.00 0.00 0.00 176.54 176.39 2ywx h GLU 113 N 0.43 0.63 0.00 4.80 4.81 -1.84 -1.90 114.58 121.51 2ywx h GLU 113 Ca 0.09 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 2ywx h GLU 113 Cb 0.34 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2ywx h GLU 113 CO 0.01 0.69 -0.27 -0.91 -0.73 0.00 0.00 179.01 177.80 2ywx h ASN 114 N 0.47 0.00 -0.42 1.04 -0.26 -1.85 -1.62 115.58 112.94 2ywx h ASN 114 Ca 0.12 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.71 2ywx h ASN 114 Cb 0.36 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.61 2ywx h ASN 114 CO 0.01 0.27 -0.32 0.00 -1.06 0.00 0.00 177.43 176.33 2ywx h ALA 115 N 1.73 0.60 -0.38 -0.83 0.00 -0.92 -1.37 119.26 118.09 2ywx h ALA 115 Ca -0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 2ywx h ALA 115 Cb 0.63 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2ywx h ALA 115 CO 0.03 0.66 -0.29 0.00 0.00 0.00 0.00 179.25 179.66 2ywx h ALA 116 N 0.80 0.55 -0.56 0.00 0.00 -0.89 -2.01 119.26 117.15 2ywx h ALA 116 Ca 0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 2ywx h ALA 116 Cb 0.91 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2ywx h ALA 116 CO 0.08 0.57 0.19 0.82 0.00 0.00 0.00 179.25 180.91 2ywx h ILE 117 N 0.67 1.23 -0.78 0.00 1.08 -1.29 -0.92 117.51 117.51 2ywx h ILE 117 Ca 0.07 -0.78 0.00 0.00 -0.39 0.00 0.00 64.86 63.76 2ywx h ILE 117 Cb 0.86 0.68 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 2ywx h ILE 117 CO 0.08 0.29 0.49 0.25 -0.69 0.00 0.00 178.15 178.57 2ywx h LEU 118 N 0.78 0.92 -0.80 1.44 5.85 -1.14 -0.12 115.31 122.23 2ywx h LEU 118 Ca 0.18 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 2ywx h LEU 118 Cb 0.26 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2ywx h LEU 118 CO -0.01 0.69 0.27 0.00 -0.34 0.00 0.00 178.44 179.05 2ywx h ALA 119 N 1.26 1.04 -0.31 1.25 0.00 -1.04 -2.21 119.26 119.26 2ywx h ALA 119 Ca 0.28 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2ywx h ALA 119 Cb -0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2ywx h ALA 119 CO -0.06 0.66 -0.33 -0.07 0.00 0.00 0.00 179.25 179.45 2ywx h LEU 120 N 1.12 0.70 -1.38 0.00 3.38 -0.55 -1.58 115.31 117.01 2ywx h LEU 120 Ca 0.25 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2ywx h LEU 120 Cb 0.26 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2ywx h LEU 120 CO -0.01 0.98 0.02 -0.33 0.09 0.00 0.00 178.44 179.19 2ywx h GLU 121 N 0.57 0.43 -0.07 1.13 5.08 -0.71 0.40 114.58 121.40 2ywx h GLU 121 Ca 0.06 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2ywx h GLU 121 Cb 0.84 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 2ywx h GLU 121 CO 0.07 0.44 -0.13 0.82 -1.00 0.00 0.00 179.01 179.22 2ywx h ILE 122 N 0.42 1.40 -0.59 3.13 2.04 -1.03 -3.19 117.51 119.69 2ywx h ILE 122 Ca 0.10 -1.40 -0.05 0.00 1.00 0.00 0.00 64.86 64.51 2ywx h ILE 122 Cb 0.25 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 2ywx h ILE 122 CO 0.00 0.39 0.17 -0.07 0.00 0.00 0.00 178.15 178.65 2ywx h LEU 123 N -0.25 0.83 -2.19 1.44 3.38 -0.83 -2.61 115.31 115.08 2ywx h LEU 123 Ca 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2ywx h LEU 123 Cb 0.69 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2ywx h LEU 123 CO 0.03 0.79 0.27 0.00 0.09 0.00 0.00 178.44 179.62 2ywx h ALA 124 N 1.32 1.30 0.00 1.53 0.00 -0.21 0.18 119.26 123.39 2ywx h ALA 124 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2ywx h ALA 124 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2ywx h ALA 124 CO -0.01 -0.28 0.00 -0.07 0.00 0.00 0.00 179.25 178.89 2ywx h LEU 125 N 0.00 0.00 0.00 0.00 3.38 -1.52 -3.23 115.31 113.94 2ywx h LEU 125 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2ywx h LEU 125 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2ywx h LEU 125 CO -0.00 0.00 -1.04 1.17 0.09 0.00 0.00 178.44 178.66 2ywx n LYS 126 N -2.90 1.79 -3.74 1.13 4.81 0.49 -4.94 118.16 114.80 2ywx n LYS 126 Ca 0.00 -0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.07 2ywx n LYS 126 Cb 0.25 -1.02 -0.12 0.00 0.02 0.00 0.00 35.03 34.17 2ywx n LYS 126 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2ywx s ASP 127 N -2.54 5.31 0.51 3.14 -1.08 -0.36 -4.97 116.67 116.69 2ywx s ASP 127 Ca -0.00 -1.62 0.26 0.00 -0.52 0.00 0.00 52.55 50.66 2ywx s ASP 127 Cb 0.00 -1.86 1.37 0.00 -1.46 0.00 0.00 42.92 40.97 2ywx s ASP 127 CO 0.03 -0.47 2.05 -0.33 0.52 0.00 0.00 175.17 176.97 2ywx h GLU 128 N 8.17 0.00 -0.48 4.34 5.08 -1.89 -2.03 114.58 127.78 2ywx h GLU 128 Ca -0.19 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.10 2ywx h GLU 128 Cb 1.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2ywx h GLU 128 CO 0.68 0.14 -0.00 -0.97 -1.00 0.00 0.00 179.01 177.85 2ywx h ASN 129 N 0.00 0.76 -0.10 1.42 -1.24 -1.93 -1.54 115.58 112.94 2ywx h ASN 129 Ca -0.00 -0.18 -0.23 0.00 0.71 0.00 0.00 56.30 56.59 2ywx h ASN 129 Cb 0.36 -0.20 0.01 0.00 0.73 0.00 0.00 38.32 39.22 2ywx h ASN 129 CO 0.02 0.83 -0.83 0.40 -1.29 0.00 0.00 177.43 176.56 2ywx h ILE 130 N 0.74 1.28 -0.44 2.57 2.04 -1.73 -2.52 117.51 119.46 2ywx h ILE 130 Ca 0.14 -2.03 0.03 0.00 1.00 0.00 0.00 64.86 64.00 2ywx h ILE 130 Cb 0.45 2.06 -0.04 0.00 -0.74 0.00 0.00 36.82 38.55 2ywx h ILE 130 CO 0.02 0.64 0.22 0.00 0.00 0.00 0.00 178.15 179.03 2ywx h ALA 131 N 0.54 0.55 -0.54 1.87 0.00 -1.23 -0.19 119.26 120.25 2ywx h ALA 131 Ca -0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2ywx h ALA 131 Cb 1.46 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 2ywx h ALA 131 CO 0.17 -0.13 0.33 -0.22 0.00 0.00 0.00 179.25 179.40 2ywx h LYS 132 N 0.45 0.74 -0.22 0.00 3.64 -1.29 -2.30 116.57 117.59 2ywx h LYS 132 Ca 0.19 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2ywx h LYS 132 Cb 0.08 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2ywx h LYS 132 CO -0.13 0.53 -0.02 0.87 -2.27 0.00 0.00 179.45 178.44 2ywx h LYS 133 N 0.73 0.33 -0.43 1.90 1.57 -0.93 -2.08 116.57 117.66 2ywx h LYS 133 Ca 0.19 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2ywx h LYS 133 Cb -0.01 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 2ywx h LYS 133 CO -0.04 0.38 0.09 -0.07 -0.57 0.00 0.00 179.45 179.24 2ywx h LEU 134 N 0.32 0.67 -0.82 2.94 3.38 -0.51 0.15 115.31 121.44 2ywx h LEU 134 Ca 0.07 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2ywx h LEU 134 Cb 0.26 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2ywx h LEU 134 CO 0.01 0.74 0.21 0.40 0.09 0.00 0.00 178.44 179.89 2ywx h ILE 135 N 0.57 1.25 -0.38 1.22 2.04 -1.07 -1.42 117.51 119.73 2ywx h ILE 135 Ca 0.13 -0.89 -0.15 0.00 1.00 0.00 0.00 64.86 64.96 2ywx h ILE 135 Cb 0.34 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2ywx h ILE 135 CO 0.00 0.35 -0.35 -0.33 0.00 0.00 0.00 178.15 177.83 2ywx h GLU 136 N 1.05 0.87 -0.81 2.37 5.08 -1.15 -2.23 114.58 119.76 2ywx h GLU 136 Ca 0.23 -0.43 0.02 0.00 -1.00 0.00 0.00 59.36 58.18 2ywx h GLU 136 Cb 0.30 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 2ywx h GLU 136 CO -0.01 1.07 0.53 -0.92 -1.00 0.00 0.00 179.01 178.68 2ywx h TYR 137 N 0.72 0.99 -0.55 4.33 3.20 -0.30 -0.25 116.97 125.10 2ywx h TYR 137 Ca 0.07 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 2ywx h TYR 137 Cb 0.91 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 2ywx h TYR 137 CO 0.05 0.60 -0.02 0.00 -1.64 0.00 0.00 178.16 177.16 2ywx h ARG 138 N 1.05 0.97 -0.17 1.82 3.08 -1.06 -2.16 114.38 117.91 2ywx h ARG 138 Ca 0.31 -0.30 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ywx h ARG 138 Cb -0.06 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2ywx h ARG 138 CO -0.09 0.96 0.10 0.93 -1.07 0.00 0.00 179.97 180.80 2ywx h GLU 139 N 0.88 0.23 -0.96 0.04 4.39 -0.75 -1.50 114.58 116.91 2ywx h GLU 139 Ca 0.16 -0.02 0.15 0.00 0.34 0.00 0.00 59.36 59.99 2ywx h GLU 139 Cb 0.54 -0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 29.05 2ywx h GLU 139 CO 0.03 0.20 0.57 0.87 -1.16 0.00 0.00 179.01 179.52 2ywx h LYS 140 N 0.20 0.79 -0.54 2.33 1.57 -0.81 -1.50 116.57 118.60 2ywx h LYS 140 Ca 0.06 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 2ywx h LYS 140 Cb 0.03 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 2ywx h LYS 140 CO -0.01 0.52 -0.05 0.52 -0.57 0.00 0.00 179.45 179.86 2ywx h MET 141 N 0.81 0.97 -0.50 3.15 2.86 -0.71 -2.53 114.93 118.98 2ywx h MET 141 Ca 0.52 -0.32 -0.04 0.00 -2.06 0.00 0.00 59.70 57.80 2ywx h MET 141 Cb 0.68 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.23 2ywx h MET 141 CO -0.33 0.99 0.15 0.87 1.06 0.00 0.00 176.91 179.65 2ywx h LYS 142 N 0.88 0.74 -0.26 1.72 1.57 -0.31 -2.50 116.57 118.42 2ywx h LYS 142 Ca 0.15 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 2ywx h LYS 142 Cb 0.59 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 2ywx h LYS 142 CO 0.04 0.65 -0.22 0.87 -0.57 0.00 0.00 179.45 180.22 2ywx h LYS 143 N 0.73 0.48 -0.13 3.15 1.79 -1.11 0.01 116.57 121.48 2ywx h LYS 143 Ca 0.17 -0.17 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 2ywx h LYS 143 Cb 0.22 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 2ywx h LYS 143 CO -0.01 0.67 -0.52 0.87 -1.08 0.00 0.00 179.45 179.38 2ywx h LYS 144 N 0.43 0.36 -0.24 3.15 1.57 -1.04 -2.03 116.57 118.78 2ywx h LYS 144 Ca 0.07 -0.22 -0.07 0.00 -1.87 0.00 0.00 60.65 58.56 2ywx h LYS 144 Cb 0.62 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 2ywx h LYS 144 CO 0.04 0.80 -0.14 0.28 -0.57 0.00 0.00 179.45 179.86 2ywx h VAL 145 N 0.29 1.31 -0.71 0.50 2.07 -1.03 -1.69 116.25 116.98 2ywx h VAL 145 Ca 0.01 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.33 2ywx h VAL 145 Cb 1.01 1.60 -0.05 0.00 -1.52 0.00 0.00 31.29 32.33 2ywx h VAL 145 CO 0.09 0.38 0.43 1.88 0.02 0.00 0.00 177.57 180.37 2ywx h TYR 146 N 0.23 0.81 -0.30 1.57 0.05 -0.94 -0.17 116.97 118.21 2ywx h TYR 146 Ca 0.05 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.83 2ywx h TYR 146 Cb 0.65 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 38.12 2ywx h TYR 146 CO 0.07 0.44 0.07 0.00 -1.05 0.00 0.00 178.16 177.68 2ywx h ALA 147 N 1.32 1.55 -0.26 3.88 0.00 -1.23 0.16 119.26 124.69 2ywx h ALA 147 Ca 0.29 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 2ywx h ALA 147 Cb 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2ywx h ALA 147 CO -0.13 0.34 -0.41 0.77 0.00 0.00 0.00 179.25 179.81 2ywx h SER 148 N 0.43 0.82 -0.01 0.00 0.02 -0.34 -1.84 113.55 112.64 2ywx h SER 148 Ca 0.10 -0.52 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2ywx h SER 148 Cb 0.18 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 2ywx h SER 148 CO -0.00 1.18 0.00 -0.78 -1.14 0.00 0.00 176.83 176.09 2ywx h ASP 149 N 0.49 0.01 -0.63 3.07 3.58 -0.34 0.14 116.42 122.74 2ywx h ASP 149 Ca 0.02 -0.12 0.07 0.00 0.42 0.00 0.00 57.03 57.43 2ywx h ASP 149 Cb 1.01 -0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.00 2ywx h ASP 149 CO 0.09 0.12 0.31 -0.33 -2.88 0.00 0.00 179.24 176.56 2ywx h GLU 150 N -0.10 0.55 0.10 0.28 4.39 -0.71 0.36 114.58 119.45 2ywx h GLU 150 Ca 0.00 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 2ywx h GLU 150 Cb 0.12 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2ywx h GLU 150 CO -0.00 0.37 -0.05 -0.22 -1.16 0.00 0.00 179.01 177.95 2ywx h LYS 151 N 0.57 -0.13 -0.40 2.33 3.64 -1.13 -3.03 116.57 118.43 2ywx h LYS 151 Ca 0.29 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 2ywx h LYS 151 Cb 0.25 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2ywx h LYS 151 CO -0.22 0.14 0.22 0.28 -2.27 0.00 0.00 179.45 177.60 2ywx h VAL 152 N -0.39 1.13 -0.62 2.00 2.07 -0.74 -2.25 116.25 117.45 2ywx h VAL 152 Ca -0.01 -0.32 0.07 0.00 0.82 0.00 0.00 66.70 67.26 2ywx h VAL 152 Cb 0.33 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 2ywx h VAL 152 CO 0.02 0.14 0.41 0.50 0.02 0.00 0.00 177.57 178.66 2ywx h LYS 153 N 0.55 0.54 -0.00 1.57 3.64 -0.81 0.47 116.57 122.53 2ywx h LYS 153 Ca 0.14 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2ywx h LYS 153 Cb 0.02 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2ywx h LYS 153 CO -0.02 0.36 -0.04 0.39 -2.27 0.00 0.00 179.45 177.87 2ywx n GLU 154 N -4.48 1.04 -0.06 1.90 -0.58 -0.85 -4.46 120.64 113.15 2ywx n GLU 154 Ca 0.09 -0.31 -0.14 0.00 -0.42 0.00 0.00 57.16 56.38 2ywx n GLU 154 Cb 0.27 -1.49 -0.12 0.00 -0.57 0.00 0.00 31.44 29.53 2ywx n GLU 154 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 2ywx h MET 155 N 0.77 0.01 -0.54 3.49 2.86 -0.88 -3.39 114.93 117.25 2ywx h MET 155 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2ywx h MET 155 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 2ywx h MET 155 CO 0.00 0.88 0.00 1.19 1.06 0.00 0.00 176.91 180.04 2ywx n PHE 156 N -4.66 0.77 1.38 -0.22 3.01 -1.26 -5.15 117.46 111.33 2ywx n PHE 156 Ca -0.10 -0.52 0.11 0.00 1.01 0.00 0.00 57.45 57.96 2ywx n PHE 156 Cb 0.43 -0.04 0.65 0.00 -0.01 0.00 0.00 39.48 40.52 2ywx n PHE 156 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13