#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xe7 n ASN 10 N 0.00 0.27 -3.92 0.00 4.13 -1.26 -4.34 115.26 110.14 1xe7 n ASN 10 Ca 0.00 0.74 -0.13 0.00 1.68 0.00 0.00 54.58 56.86 1xe7 n ASN 10 Cb 0.00 -1.35 -0.14 0.00 -1.54 0.00 0.00 39.78 36.75 1xe7 n ASN 10 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1xe7 s ALA 11 N -1.65 0.21 0.37 5.41 0.00 -0.19 -4.89 121.76 121.01 1xe7 s ALA 11 Ca 0.74 -0.16 -0.26 0.00 0.00 0.00 0.00 51.96 52.27 1xe7 s ALA 11 Cb -0.39 -0.03 -0.09 0.00 0.00 0.00 0.00 23.12 22.61 1xe7 s ALA 11 CO 0.49 0.03 1.14 0.00 0.00 0.00 0.00 175.76 177.43 1xe7 s ALA 12 N -0.21 3.22 -0.75 0.00 0.00 -1.26 -4.72 121.76 118.04 1xe7 s ALA 12 Ca -0.01 0.93 -0.19 0.00 0.00 0.00 0.00 51.96 52.70 1xe7 s ALA 12 Cb -0.02 -3.36 0.13 0.00 0.00 0.00 0.00 23.12 19.87 1xe7 s ALA 12 CO -0.00 -0.41 0.90 0.42 0.00 0.00 0.00 175.76 176.67 1xe7 s ILE 13 N -1.38 4.84 -0.54 0.00 1.01 -1.26 -4.92 121.20 118.95 1xe7 s ILE 13 Ca 0.54 -1.33 0.06 0.00 0.00 0.00 0.00 60.65 59.93 1xe7 s ILE 13 Cb -0.30 -4.61 0.24 0.00 0.01 0.00 0.00 42.46 37.79 1xe7 s ILE 13 CO 0.38 -1.29 0.61 -0.62 0.00 0.00 0.00 174.94 174.02 1xe7 n GLU 14 N 6.25 1.63 -1.61 2.79 1.02 -1.26 -5.11 120.64 124.35 1xe7 n GLU 14 Ca 0.06 -4.02 -0.48 0.00 -0.02 0.00 0.00 57.16 52.71 1xe7 n GLU 14 Cb 0.46 -1.84 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 1xe7 n GLU 14 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1xe7 n PRO 15 N 1.31 1.49 -1.36 3.49 -0.02 -1.26 -4.97 135.00 133.68 1xe7 n PRO 15 Ca 0.26 0.53 -0.29 0.00 -2.02 0.00 0.00 63.50 61.98 1xe7 n PRO 15 Cb 0.45 -2.10 0.17 0.00 -0.02 0.00 0.00 33.50 32.00 1xe7 n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xe7 s ALA 16 N -0.06 1.30 0.16 3.55 0.00 -1.26 -4.79 121.76 120.66 1xe7 s ALA 16 Ca 0.72 -0.60 -0.19 0.00 0.00 0.00 0.00 51.96 51.90 1xe7 s ALA 16 Cb -0.78 -3.02 0.07 0.00 0.00 0.00 0.00 23.12 19.39 1xe7 s ALA 16 CO 0.50 -2.73 1.65 0.66 0.00 0.00 0.00 175.76 175.85 1xe7 h SER 17 N -1.84 -0.55 0.04 0.00 4.64 -1.95 -1.28 113.55 112.61 1xe7 h SER 17 Ca -0.51 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1xe7 h SER 17 Cb 1.32 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 1xe7 h SER 17 CO 0.54 -0.20 0.00 2.22 -0.87 0.00 0.00 176.83 178.53 1xe7 n PHE 18 N -5.34 0.00 -0.05 4.77 -0.00 -1.26 -1.32 117.46 114.26 1xe7 n PHE 18 Ca 0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.24 1xe7 n PHE 18 Cb 0.25 -0.03 -0.13 0.00 -0.00 0.00 0.00 39.48 39.57 1xe7 n PHE 18 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1xe7 n VAL 19 N -1.03 1.67 0.04 1.97 0.31 -0.51 -2.97 118.33 117.80 1xe7 n VAL 19 Ca 0.15 -0.43 -0.05 0.00 -0.01 0.00 0.00 64.34 64.00 1xe7 n VAL 19 Cb 0.08 -1.82 0.14 0.00 -0.91 0.00 0.00 33.84 31.33 1xe7 n VAL 19 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1xe7 h LYS 20 N -0.35 0.42 -2.87 5.55 1.57 -1.23 -3.37 116.57 116.30 1xe7 h LYS 20 Ca -0.43 -0.22 -0.61 0.00 -1.87 0.00 0.00 60.65 57.53 1xe7 h LYS 20 Cb 1.76 0.01 -0.40 0.00 0.08 0.00 0.00 32.23 33.68 1xe7 h LYS 20 CO -0.05 0.78 -0.77 0.08 -0.57 0.00 0.00 179.45 178.92 1xe7 s VAL 21 N -4.14 1.26 0.37 0.50 1.01 -0.43 -5.12 120.40 113.85 1xe7 s VAL 21 Ca -0.06 -2.64 -0.25 0.00 0.00 0.00 0.00 61.98 59.03 1xe7 s VAL 21 Cb 0.13 -1.88 -0.12 0.00 0.00 0.00 0.00 36.38 34.51 1xe7 s VAL 21 CO 0.81 -0.96 0.92 -2.65 0.00 0.00 0.00 175.10 173.22 1xe7 n PRO 22 N 3.35 1.20 -2.85 2.72 -0.02 -1.16 -4.29 135.00 133.96 1xe7 n PRO 22 Ca 0.13 0.43 -0.32 0.00 -2.02 0.00 0.00 63.50 61.71 1xe7 n PRO 22 Cb 0.37 -1.87 -0.06 0.00 -0.02 0.00 0.00 33.50 31.92 1xe7 n PRO 22 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1xe7 s MET 23 N -1.78 4.06 0.42 -0.52 -1.94 -0.43 -4.96 119.30 114.16 1xe7 s MET 23 Ca 0.62 0.88 0.12 0.00 -1.71 0.00 0.00 55.69 55.60 1xe7 s MET 23 Cb -0.62 -2.27 0.89 0.00 2.01 0.00 0.00 34.83 34.84 1xe7 s MET 23 CO 0.58 -0.01 1.95 -1.00 -0.01 0.00 0.00 175.02 176.53 1xe7 h PRO 24 N 1.78 0.09 -4.34 2.03 0.13 -1.91 -3.33 132.00 126.45 1xe7 h PRO 24 Ca -0.48 -0.02 -0.23 0.00 -0.87 0.00 0.00 66.00 64.40 1xe7 h PRO 24 Cb 1.18 -0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 1xe7 h PRO 24 CO 0.63 0.27 -0.72 -1.21 -0.23 0.00 0.00 178.00 176.74 1xe7 s GLU 25 N -4.63 0.45 0.56 0.86 0.41 -1.26 -4.92 118.70 110.17 1xe7 s GLU 25 Ca -0.04 -0.72 -0.01 0.00 -0.41 0.00 0.00 54.97 53.78 1xe7 s GLU 25 Cb 0.15 -0.13 0.03 0.00 -1.78 0.00 0.00 34.13 32.40 1xe7 s GLU 25 CO 0.71 0.01 0.81 -1.25 -0.49 0.00 0.00 175.26 175.05 1xe7 s PRO 26 N -1.63 2.65 0.55 0.39 0.04 -1.26 -4.51 135.00 131.22 1xe7 s PRO 26 Ca -0.11 -0.53 -0.21 0.00 0.04 0.00 0.00 61.00 60.18 1xe7 s PRO 26 Cb -0.09 -2.42 -0.06 0.00 0.04 0.00 0.00 34.50 31.97 1xe7 s PRO 26 CO -0.00 -0.70 1.17 -2.30 0.04 0.00 0.00 177.00 175.20 1xe7 n PRO 27 N -2.41 1.35 -0.01 0.56 -0.02 -1.26 -4.72 135.00 128.48 1xe7 n PRO 27 Ca 0.06 0.50 0.14 0.00 -2.02 0.00 0.00 63.50 62.18 1xe7 n PRO 27 Cb 0.59 -2.35 0.57 0.00 -0.02 0.00 0.00 33.50 32.29 1xe7 n PRO 27 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xe7 h SER 28 N 1.11 0.22 -0.88 2.55 4.64 -1.98 -1.72 113.55 117.49 1xe7 h SER 28 Ca -0.49 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 1xe7 h SER 28 Cb 1.33 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 63.34 1xe7 h SER 28 CO 0.55 0.13 0.52 0.77 -0.87 0.00 0.00 176.83 177.93 1xe7 h SER 29 N 0.25 1.07 0.32 4.97 4.64 -1.97 0.30 113.55 123.12 1xe7 h SER 29 Ca 0.23 -0.08 -0.20 0.00 -0.47 0.00 0.00 61.79 61.27 1xe7 h SER 29 Cb 0.59 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1xe7 h SER 29 CO -0.05 0.83 -0.84 -0.07 -0.87 0.00 0.00 176.83 175.84 1xe7 h LEU 30 N 1.21 0.49 -0.83 5.97 3.38 -1.69 -2.21 115.31 121.64 1xe7 h LEU 30 Ca 0.31 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1xe7 h LEU 30 Cb -0.03 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1xe7 h LEU 30 CO -0.06 1.13 0.34 -0.61 0.09 0.00 0.00 178.44 179.34 1xe7 h GLN 31 N 0.24 1.20 -0.67 1.13 5.75 -0.94 0.45 115.11 122.28 1xe7 h GLN 31 Ca -0.05 -0.21 -0.04 0.00 -0.15 0.00 0.00 58.65 58.20 1xe7 h GLN 31 Cb 1.45 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 29.77 1xe7 h GLN 31 CO 0.14 0.96 0.25 0.37 -2.65 0.00 0.00 178.83 177.91 1xe7 h GLN 32 N 1.18 1.01 -0.45 1.69 5.75 -0.84 0.48 115.11 123.93 1xe7 h GLN 32 Ca 0.27 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.57 1xe7 h GLN 32 Cb 0.19 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 1xe7 h GLN 32 CO -0.03 0.85 0.22 1.25 -2.65 0.00 0.00 178.83 178.47 1xe7 h LEU 33 N 0.95 0.58 -0.43 -2.39 5.85 -0.83 0.89 115.31 119.94 1xe7 h LEU 33 Ca 0.22 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1xe7 h LEU 33 Cb 0.23 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1xe7 h LEU 33 CO -0.02 0.54 0.28 0.40 -0.34 0.00 0.00 178.44 179.31 1xe7 h ILE 34 N 0.58 1.11 -0.10 4.05 2.04 -0.47 -1.56 117.51 123.15 1xe7 h ILE 34 Ca 0.15 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1xe7 h ILE 34 Cb 0.11 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1xe7 h ILE 34 CO -0.02 0.11 -0.04 0.78 0.00 0.00 0.00 178.15 178.98 1xe7 h ASN 35 N 0.58 0.21 -0.63 1.72 2.35 -0.64 0.30 115.58 119.48 1xe7 h ASN 35 Ca 0.16 -0.40 -0.04 0.00 -0.55 0.00 0.00 56.30 55.47 1xe7 h ASN 35 Cb -0.07 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 1xe7 h ASN 35 CO -0.04 0.56 0.23 0.44 -1.65 0.00 0.00 177.43 176.98 1xe7 h ASP 36 N -0.14 0.88 0.32 5.81 3.32 -0.80 -2.68 116.42 123.13 1xe7 h ASP 36 Ca 0.02 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1xe7 h ASP 36 Cb 0.48 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1xe7 h ASP 36 CO 0.01 0.82 -0.15 0.79 -1.72 0.00 0.00 179.24 178.99 1xe7 n TRP 37 N -4.42 0.00 -3.69 4.55 7.02 -0.59 -4.95 117.44 115.36 1xe7 n TRP 37 Ca 0.04 0.00 -0.22 0.00 -1.02 0.00 0.00 57.50 56.29 1xe7 n TRP 37 Cb 0.18 -0.16 0.04 0.00 -2.42 0.00 0.00 31.31 28.95 1xe7 n TRP 37 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1xe7 n GLN 38 N -0.85 -5.52 -2.55 -0.99 6.02 -0.06 -4.95 117.38 108.47 1xe7 n GLN 38 Ca 0.14 0.67 -0.36 0.00 -0.01 0.00 0.00 57.00 57.44 1xe7 n GLN 38 Cb 0.30 -5.40 -0.04 0.00 1.02 0.00 0.00 30.24 26.12 1xe7 n GLN 38 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1xe7 s LEU 39 N -6.79 4.06 0.24 1.08 1.43 -0.28 -4.92 118.68 113.50 1xe7 s LEU 39 Ca 0.17 2.00 0.12 0.00 -1.03 0.00 0.00 54.13 55.39 1xe7 s LEU 39 Cb -0.08 -4.29 -0.05 0.00 0.03 0.00 0.00 46.19 41.80 1xe7 s LEU 39 CO 0.80 -0.57 -0.22 0.27 0.23 0.00 0.00 176.35 176.86 1xe7 s ILE 40 N -1.76 2.42 0.08 -0.59 -4.36 -0.39 -4.82 121.20 111.78 1xe7 s ILE 40 Ca 0.60 -2.24 -0.31 0.00 -0.26 0.00 0.00 60.65 58.45 1xe7 s ILE 40 Cb -0.20 -2.22 -0.07 0.00 1.25 0.00 0.00 42.46 41.22 1xe7 s ILE 40 CO 0.25 -0.27 1.40 -0.54 0.24 0.00 0.00 174.94 176.02 1xe7 s LYS 41 N -3.13 4.31 0.41 0.37 1.02 -1.26 -0.59 119.74 120.87 1xe7 s LYS 41 Ca 0.26 2.05 -0.17 0.00 0.02 0.00 0.00 55.97 58.12 1xe7 s LYS 41 Cb -0.06 -3.35 -0.09 0.00 -0.52 0.00 0.00 37.83 33.81 1xe7 s LYS 41 CO 0.13 -0.48 0.88 -1.58 -0.92 0.00 0.00 175.35 173.37 1xe7 s HIS 42 N 1.49 3.37 0.55 3.18 5.65 -0.07 -4.90 115.29 124.55 1xe7 s HIS 42 Ca 0.65 1.41 0.21 0.00 0.25 0.00 0.00 55.06 57.58 1xe7 s HIS 42 Cb -0.35 -2.70 1.48 0.00 -1.18 0.00 0.00 32.58 29.82 1xe7 s HIS 42 CO 0.29 -0.10 2.19 0.00 -0.65 0.00 0.00 174.74 176.47 1xe7 h ARG 43 N 1.74 0.00 -0.10 2.88 3.08 -1.95 -1.49 114.38 118.54 1xe7 h ARG 43 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1xe7 h ARG 43 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1xe7 h ARG 43 CO 0.63 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.92 1xe7 n GLU 44 N -4.28 1.91 0.00 0.04 4.71 -1.26 -4.99 120.64 116.78 1xe7 n GLU 44 Ca -0.03 -1.34 0.00 0.00 -0.01 0.00 0.00 57.16 55.78 1xe7 n GLU 44 Cb 0.09 -1.46 0.00 0.00 -1.01 0.00 0.00 31.44 29.06 1xe7 n GLU 44 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xe7 n GLY 45 N 1.24 2.68 0.00 0.62 0.00 -0.56 0.60 105.19 109.76 1xe7 n GLY 45 Ca 0.17 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1xe7 n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xe7 n GLY 46 N 0.73 -0.97 3.52 -0.02 0.00 -1.24 -4.39 105.19 102.82 1xe7 n GLY 46 Ca 0.00 -1.66 -0.30 0.00 0.00 0.00 0.00 46.02 44.06 1xe7 n GLY 46 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xe7 s TYR 47 N -1.45 2.63 0.29 1.61 1.51 0.70 -0.89 117.35 121.75 1xe7 s TYR 47 Ca 0.00 -0.21 -0.18 0.00 -1.01 0.00 0.00 57.07 55.67 1xe7 s TYR 47 Cb 0.00 -1.42 0.02 0.00 -0.11 0.00 0.00 41.96 40.45 1xe7 s TYR 47 CO 0.00 0.37 0.67 -0.59 -1.11 0.00 0.00 175.55 174.89 1xe7 s PHE 48 N -1.11 0.00 -0.28 2.71 -0.12 0.24 -0.05 117.98 119.38 1xe7 s PHE 48 Ca 0.18 -0.47 -0.19 0.00 -0.05 0.00 0.00 56.93 56.40 1xe7 s PHE 48 Cb -0.11 0.59 0.10 0.00 -0.63 0.00 0.00 43.02 42.98 1xe7 s PHE 48 CO 0.10 -1.23 0.81 0.21 -0.05 0.00 0.00 175.22 175.06 1xe7 s LYS 49 N -3.70 0.63 -0.25 1.99 2.20 -1.04 -1.26 119.74 118.30 1xe7 s LYS 49 Ca 0.15 0.96 -0.26 0.00 -0.36 0.00 0.00 55.97 56.45 1xe7 s LYS 49 Cb -0.05 0.20 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 1xe7 s LYS 49 CO 0.08 -0.11 0.89 -2.00 -0.36 0.00 0.00 175.35 173.85 1xe7 s GLU 50 N 1.09 4.16 -0.00 4.03 2.12 -1.26 -1.63 118.70 127.20 1xe7 s GLU 50 Ca -0.06 0.99 0.17 0.00 0.36 0.00 0.00 54.97 56.43 1xe7 s GLU 50 Cb -0.05 -3.66 -0.19 0.00 0.26 0.00 0.00 34.13 30.49 1xe7 s GLU 50 CO -0.12 -0.60 0.66 0.25 -0.54 0.00 0.00 175.26 174.91 1xe7 n THR 51 N 5.36 0.00 -3.68 -1.70 -2.24 -0.12 -4.98 114.28 106.91 1xe7 n THR 51 Ca 0.07 -0.15 -0.14 0.00 -2.27 0.00 0.00 64.05 61.56 1xe7 n THR 51 Cb 0.47 0.87 -0.09 0.00 -2.10 0.00 0.00 70.33 69.48 1xe7 n THR 51 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xe7 s ASP 52 N -2.79 -0.55 -0.19 3.42 -1.08 -1.16 -4.98 116.67 109.35 1xe7 s ASP 52 Ca 0.04 1.00 -0.04 0.00 -0.52 0.00 0.00 52.55 53.04 1xe7 s ASP 52 Cb 0.12 1.02 0.09 0.00 -1.46 0.00 0.00 42.92 42.69 1xe7 s ASP 52 CO 0.69 -0.23 0.27 -0.60 0.52 0.00 0.00 175.17 175.82 1xe7 s ARG 53 N 0.08 0.21 0.36 4.34 3.52 -1.26 -0.68 118.95 125.53 1xe7 s ARG 53 Ca -0.02 0.44 -0.26 0.00 -0.13 0.00 0.00 55.73 55.77 1xe7 s ARG 53 Cb -0.04 -0.70 -0.12 0.00 -1.56 0.00 0.00 34.95 32.53 1xe7 s ARG 53 CO 0.02 -0.54 0.94 0.45 -0.81 0.00 0.00 175.30 175.35 1xe7 n SER 54 N 5.34 0.94 0.13 -2.12 2.88 -0.22 -4.87 113.62 115.69 1xe7 n SER 54 Ca -0.05 1.08 0.13 0.00 -1.33 0.00 0.00 58.87 58.69 1xe7 n SER 54 Cb 0.50 -1.29 0.41 0.00 -0.75 0.00 0.00 64.21 63.08 1xe7 n SER 54 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1xe7 h PRO 55 N 1.61 0.00 -6.22 -1.46 0.11 -2.00 -3.42 132.00 120.62 1xe7 h PRO 55 Ca -0.42 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.12 1xe7 h PRO 55 Cb 1.35 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.42 1xe7 h PRO 55 CO 0.58 0.00 -0.11 0.71 -0.21 0.00 0.00 178.00 178.97 1xe7 s TYR 56 N -3.17 3.68 0.36 0.65 2.02 -1.26 -5.01 117.35 114.62 1xe7 s TYR 56 Ca 0.09 1.09 0.09 0.00 -0.37 0.00 0.00 57.07 57.96 1xe7 s TYR 56 Cb 0.11 -2.37 -0.06 0.00 -0.40 0.00 0.00 41.96 39.24 1xe7 s TYR 56 CO 0.56 0.52 0.03 0.95 -1.57 0.00 0.00 175.55 176.05 1xe7 s THR 57 N -1.29 2.52 -0.02 -0.71 -4.23 -1.26 -0.51 115.64 110.13 1xe7 s THR 57 Ca 0.32 -1.95 -0.12 0.00 -1.18 0.00 0.00 61.69 58.77 1xe7 s THR 57 Cb -0.16 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 70.86 1xe7 s THR 57 CO 0.18 -0.16 0.25 0.00 -0.54 0.00 0.00 174.62 174.36 1xe7 s MET 58 N -3.74 0.57 -0.15 3.99 0.23 0.57 -4.75 119.30 116.02 1xe7 s MET 58 Ca 0.36 -0.18 -0.07 0.00 -1.03 0.00 0.00 55.69 54.76 1xe7 s MET 58 Cb 0.01 0.25 -0.04 0.00 -1.53 0.00 0.00 34.83 33.52 1xe7 s MET 58 CO 0.20 -0.14 0.11 -1.21 -2.03 0.00 0.00 175.02 171.94 1xe7 s GLU 59 N -1.16 3.71 0.02 3.16 2.02 -1.26 -1.18 118.70 124.02 1xe7 s GLU 59 Ca -0.12 -0.22 0.02 0.00 0.02 0.00 0.00 54.97 54.67 1xe7 s GLU 59 Cb -0.06 -3.23 -0.02 0.00 0.10 0.00 0.00 34.13 30.93 1xe7 s GLU 59 CO 0.03 0.54 -0.07 0.14 0.02 0.00 0.00 175.26 175.93 1xe7 s VAL 60 N -0.37 0.50 -0.05 2.63 -7.23 -0.43 -4.96 120.40 110.49 1xe7 s VAL 60 Ca 0.11 -0.75 -0.29 0.00 -1.81 0.00 0.00 61.98 59.24 1xe7 s VAL 60 Cb -0.12 -0.51 -0.02 0.00 0.56 0.00 0.00 36.38 36.29 1xe7 s VAL 60 CO 0.01 -0.18 0.94 -0.70 -0.31 0.00 0.00 175.10 174.86 1xe7 s GLU 61 N -1.01 4.48 -0.03 4.82 2.12 -1.26 -1.55 118.70 126.28 1xe7 s GLU 61 Ca -0.05 1.31 0.05 0.00 0.36 0.00 0.00 54.97 56.64 1xe7 s GLU 61 Cb -0.07 -3.49 -0.01 0.00 0.26 0.00 0.00 34.13 30.82 1xe7 s GLU 61 CO 0.00 -0.14 -0.18 0.21 -0.54 0.00 0.00 175.26 174.62 1xe7 s LYS 62 N 1.38 1.62 0.01 4.30 2.20 -1.26 -4.99 119.74 123.01 1xe7 s LYS 62 Ca 0.48 -0.63 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 1xe7 s LYS 62 Cb -0.19 -1.48 -0.05 0.00 -1.51 0.00 0.00 37.83 34.59 1xe7 s LYS 62 CO 0.22 0.31 1.35 -1.25 -0.36 0.00 0.00 175.35 175.63 1xe7 s PRO 63 N -0.19 4.31 0.00 4.03 0.04 -1.26 -4.74 135.00 137.19 1xe7 s PRO 63 Ca 0.01 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1xe7 s PRO 63 Cb -0.09 -3.50 0.00 0.00 0.04 0.00 0.00 34.50 30.94 1xe7 s PRO 63 CO 0.01 -0.50 0.00 0.28 0.04 0.00 0.00 177.00 176.82 1xe7 n VAL 64 N 4.48 0.00 -1.98 -0.36 0.31 -1.26 -5.21 118.33 114.31 1xe7 n VAL 64 Ca 0.12 0.16 -0.42 0.00 -0.01 0.00 0.00 64.34 64.19 1xe7 n VAL 64 Cb 0.44 -1.10 -0.03 0.00 -0.91 0.00 0.00 33.84 32.24 1xe7 n VAL 64 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1xe7 s MET 73 N -0.39 4.22 0.20 5.55 1.00 -1.26 -5.36 119.30 123.27 1xe7 s MET 73 Ca 0.00 2.28 0.06 0.00 0.00 0.00 0.00 55.69 58.03 1xe7 s MET 73 Cb 0.00 -3.48 -0.05 0.00 0.00 0.00 0.00 34.83 31.30 1xe7 s MET 73 CO 0.00 -0.67 -0.09 0.14 0.00 0.00 0.00 175.02 174.40 1xe7 s VAL 74 N 2.20 1.42 -0.07 -6.03 -7.23 -0.59 -4.95 120.40 105.15 1xe7 s VAL 74 Ca 0.71 -2.12 -0.01 0.00 -1.81 0.00 0.00 61.98 58.75 1xe7 s VAL 74 Cb -0.39 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.41 1xe7 s VAL 74 CO 0.31 -0.55 -0.01 -0.89 -0.31 0.00 0.00 175.10 173.66 1xe7 s THR 75 N -3.17 4.21 0.04 5.32 2.01 -1.26 -1.32 115.64 121.47 1xe7 s THR 75 Ca 0.23 -0.34 -0.04 0.00 0.31 0.00 0.00 61.69 61.85 1xe7 s THR 75 Cb 0.02 -2.78 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 1xe7 s THR 75 CO 0.06 0.56 0.05 -0.13 -0.69 0.00 0.00 174.62 174.48 1xe7 s ARG 76 N -1.00 0.57 0.55 4.92 1.81 -0.32 -4.97 118.95 120.51 1xe7 s ARG 76 Ca 0.14 -0.86 -0.18 0.00 -1.72 0.00 0.00 55.73 53.11 1xe7 s ARG 76 Cb -0.11 0.22 -0.06 0.00 -0.45 0.00 0.00 34.95 34.55 1xe7 s ARG 76 CO 0.04 -0.13 1.06 -0.80 -0.68 0.00 0.00 175.30 174.78 1xe7 s ASN 77 N -2.29 5.97 0.41 0.23 -0.87 -1.26 -0.32 114.94 116.82 1xe7 s ASN 77 Ca -0.03 1.89 0.07 0.00 -1.57 0.00 0.00 52.86 53.23 1xe7 s ASN 77 Cb 0.00 -2.55 0.87 0.00 -0.02 0.00 0.00 41.25 39.55 1xe7 s ASN 77 CO -0.06 -1.04 2.05 1.56 -2.57 0.00 0.00 177.10 177.05 1xe7 h GLN 78 N 0.91 0.54 -2.95 -0.60 4.20 -1.05 0.21 115.11 116.38 1xe7 h GLN 78 Ca -0.48 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.19 1xe7 h GLN 78 Cb 1.22 -0.12 -0.12 0.00 0.30 0.00 0.00 27.48 28.77 1xe7 h GLN 78 CO 0.58 0.35 0.23 -1.54 -0.67 0.00 0.00 178.83 177.79 1xe7 s SER 79 N -6.65 -0.53 0.03 1.46 1.04 -1.26 -3.00 113.70 104.79 1xe7 s SER 79 Ca -0.08 -0.05 0.01 0.00 0.48 0.00 0.00 55.95 56.30 1xe7 s SER 79 Cb 0.18 0.60 -0.02 0.00 0.10 0.00 0.00 66.02 66.87 1xe7 s SER 79 CO 0.73 -0.98 -0.05 0.42 0.98 0.00 0.00 173.24 174.35 1xe7 s THR 80 N -3.72 0.26 -0.03 2.02 -4.23 -0.98 -1.05 115.64 107.92 1xe7 s THR 80 Ca 0.02 -1.04 0.02 0.00 -1.18 0.00 0.00 61.69 59.51 1xe7 s THR 80 Cb -0.01 -0.48 0.00 0.00 1.34 0.00 0.00 72.50 73.35 1xe7 s THR 80 CO -0.11 -0.50 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.16 1xe7 s LEU 81 N -1.63 1.75 0.10 4.79 2.96 0.14 -1.96 118.68 124.84 1xe7 s LEU 81 Ca -0.12 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 1xe7 s LEU 81 Cb -0.09 -0.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.99 1xe7 s LEU 81 CO -0.01 0.06 -0.07 0.27 -1.32 0.00 0.00 176.35 175.28 1xe7 s ILE 82 N 0.26 0.74 -0.08 6.68 -4.36 -0.56 -0.95 121.20 122.94 1xe7 s ILE 82 Ca -0.04 -1.91 -0.05 0.00 -0.26 0.00 0.00 60.65 58.39 1xe7 s ILE 82 Cb -0.09 -1.65 -0.04 0.00 1.25 0.00 0.00 42.46 41.93 1xe7 s ILE 82 CO 0.01 -0.84 0.13 -0.31 0.24 0.00 0.00 174.94 174.17 1xe7 s TYR 83 N -3.48 3.52 -0.04 1.37 4.12 -0.65 -1.34 117.35 120.84 1xe7 s TYR 83 Ca 0.11 0.43 -0.01 0.00 0.02 0.00 0.00 57.07 57.62 1xe7 s TYR 83 Cb 0.04 -1.88 0.03 0.00 -1.52 0.00 0.00 41.96 38.63 1xe7 s TYR 83 CO -0.04 0.67 0.03 -0.47 0.02 0.00 0.00 175.55 175.76 1xe7 s TYR 84 N -1.10 0.27 -0.06 2.71 5.04 0.09 -2.50 117.35 121.79 1xe7 s TYR 84 Ca 0.19 0.07 0.03 0.00 -2.44 0.00 0.00 57.07 54.92 1xe7 s TYR 84 Cb -0.12 -0.51 0.01 0.00 0.35 0.00 0.00 41.96 41.69 1xe7 s TYR 84 CO 0.08 -0.19 -0.16 -1.17 -1.34 0.00 0.00 175.55 172.77 1xe7 s LEU 85 N 1.66 1.82 -0.02 6.97 2.96 0.93 -1.14 118.68 131.86 1xe7 s LEU 85 Ca -0.01 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1xe7 s LEU 85 Cb -0.13 -0.99 -0.03 0.00 0.50 0.00 0.00 46.19 45.54 1xe7 s LEU 85 CO -0.03 0.10 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.32 1xe7 s LEU 86 N 0.40 3.45 0.21 -0.68 1.43 -0.25 -0.21 118.68 123.02 1xe7 s LEU 86 Ca -0.12 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1xe7 s LEU 86 Cb -0.15 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 1xe7 s LEU 86 CO 0.04 0.31 0.08 0.42 0.23 0.00 0.00 176.35 177.44 1xe7 s THR 87 N -1.01 0.35 0.61 5.49 -4.23 -0.55 -1.89 115.64 114.42 1xe7 s THR 87 Ca 0.17 -1.98 0.33 0.00 -1.18 0.00 0.00 61.69 59.03 1xe7 s THR 87 Cb -0.11 -2.43 0.38 0.00 1.34 0.00 0.00 72.50 71.67 1xe7 s THR 87 CO 0.07 -0.14 2.27 -0.65 -0.54 0.00 0.00 174.62 175.63 1xe7 h PRO 88 N 2.57 0.00 0.00 3.99 0.11 -1.91 0.31 132.00 137.08 1xe7 h PRO 88 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1xe7 h PRO 88 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1xe7 h PRO 88 CO 0.59 0.00 -0.94 0.38 -0.21 0.00 0.00 178.00 177.81 1xe7 h ASP 89 N 0.00 0.00 -1.74 -2.05 2.03 -1.79 -1.13 116.42 111.74 1xe7 h ASP 89 Ca 0.00 -0.05 -0.48 0.00 -0.73 0.00 0.00 57.03 55.77 1xe7 h ASP 89 Cb 0.03 0.00 -0.33 0.00 -0.83 0.00 0.00 39.33 38.20 1xe7 h ASP 89 CO -0.00 0.03 -0.92 -0.24 -1.03 0.00 0.00 179.24 177.07 1xe7 n SER 90 N -2.56 -0.81 -0.31 4.15 2.88 -0.51 -4.61 113.62 111.84 1xe7 n SER 90 Ca 0.01 -2.70 0.11 0.00 -1.33 0.00 0.00 58.87 54.96 1xe7 n SER 90 Cb 0.53 -0.04 0.53 0.00 -0.75 0.00 0.00 64.21 64.48 1xe7 n SER 90 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1xe7 n PRO 91 N 2.03 1.41 -4.48 -1.46 -0.04 0.98 -1.47 135.00 131.97 1xe7 n PRO 91 Ca 0.22 -0.61 -0.20 0.00 -0.04 0.00 0.00 63.50 62.86 1xe7 n PRO 91 Cb 0.53 -1.39 -0.15 0.00 -0.04 0.00 0.00 33.50 32.45 1xe7 n PRO 91 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1xe7 s ILE 92 N -1.92 0.88 -0.35 0.52 1.01 -1.26 -1.05 121.20 119.03 1xe7 s ILE 92 Ca 0.34 -0.45 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 1xe7 s ILE 92 Cb 0.17 -0.75 0.05 0.00 0.01 0.00 0.00 42.46 41.95 1xe7 s ILE 92 CO 0.28 0.26 0.12 -0.83 0.00 0.00 0.00 174.94 174.76 1xe7 s GLY 93 N -0.12 1.86 0.65 6.18 0.00 0.68 -3.69 107.32 112.88 1xe7 s GLY 93 Ca 0.02 -1.89 -0.17 0.00 0.00 0.00 0.00 44.72 42.68 1xe7 s GLY 93 CO -0.00 0.81 1.19 0.54 0.00 0.00 0.00 173.10 175.64 1xe7 s LYS 94 N 1.35 2.64 0.12 2.90 -0.14 0.20 -1.28 119.74 125.53 1xe7 s LYS 94 Ca -0.01 1.74 -0.35 0.00 -1.36 0.00 0.00 55.97 55.99 1xe7 s LYS 94 Cb -0.20 -1.90 -0.15 0.00 -1.68 0.00 0.00 37.83 33.90 1xe7 s LYS 94 CO 0.01 -1.44 1.47 1.19 -0.76 0.00 0.00 175.35 175.82 1xe7 n PHE 95 N -2.13 1.93 -3.50 3.18 0.99 0.11 -4.63 117.46 113.41 1xe7 n PHE 95 Ca 0.13 0.44 -0.10 0.00 -0.00 0.00 0.00 57.45 57.92 1xe7 n PHE 95 Cb 0.50 -2.45 -0.02 0.00 -1.00 0.00 0.00 39.48 36.51 1xe7 n PHE 95 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.76 173.38 1xe7 s HIS 96 N 0.77 -0.41 0.12 1.38 -3.43 -0.96 -1.64 115.29 111.12 1xe7 s HIS 96 Ca 0.82 0.21 0.01 0.00 -0.80 0.00 0.00 55.06 55.29 1xe7 s HIS 96 Cb -0.81 0.57 -0.04 0.00 -1.43 0.00 0.00 32.58 30.87 1xe7 s HIS 96 CO 0.42 -0.76 -0.01 -1.59 -2.00 0.00 0.00 174.74 170.81 1xe7 s LYS 97 N -3.49 0.92 0.05 -0.38 -2.85 0.64 -1.00 119.74 113.64 1xe7 s LYS 97 Ca 0.04 -1.41 0.04 0.00 -1.00 0.00 0.00 55.97 53.64 1xe7 s LYS 97 Cb -0.01 -0.06 -0.03 0.00 -2.06 0.00 0.00 37.83 35.67 1xe7 s LYS 97 CO -0.09 -0.13 -0.12 1.21 0.10 0.00 0.00 175.35 176.32 1xe7 s ASN 98 N -3.07 1.43 0.47 0.03 3.84 -1.26 -1.01 114.94 115.37 1xe7 s ASN 98 Ca 0.18 -0.54 0.16 0.00 0.21 0.00 0.00 52.86 52.87 1xe7 s ASN 98 Cb 0.06 -0.04 1.12 0.00 -0.55 0.00 0.00 41.25 41.84 1xe7 s ASN 98 CO -0.01 -0.08 2.04 0.40 -2.79 0.00 0.00 177.10 176.66 1xe7 h ILE 99 N 4.42 1.04 -2.71 -5.21 2.04 -1.71 0.95 117.51 116.33 1xe7 h ILE 99 Ca -0.38 -0.49 -0.54 0.00 1.00 0.00 0.00 64.86 64.45 1xe7 h ILE 99 Cb 1.19 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 1xe7 h ILE 99 CO 0.41 0.14 -0.40 0.20 0.00 0.00 0.00 178.15 178.51 1xe7 s ASN 100 N -6.91 6.36 0.48 1.72 0.01 -1.26 -4.22 114.94 111.12 1xe7 s ASN 100 Ca -0.04 0.29 -0.21 0.00 -0.71 0.00 0.00 52.86 52.19 1xe7 s ASN 100 Cb 0.16 -1.96 -0.08 0.00 0.41 0.00 0.00 41.25 39.78 1xe7 s ASN 100 CO 0.68 0.00 1.08 0.00 -1.51 0.00 0.00 177.10 177.34 1xe7 s ARG 101 N -3.28 3.75 -0.08 -0.60 1.70 -1.26 -3.89 118.95 115.28 1xe7 s ARG 101 Ca 0.37 1.50 0.03 0.00 -0.47 0.00 0.00 55.73 57.15 1xe7 s ARG 101 Cb -0.11 -2.19 0.01 0.00 -0.57 0.00 0.00 34.95 32.09 1xe7 s ARG 101 CO 0.29 -0.50 -0.16 0.42 -1.08 0.00 0.00 175.30 174.28 1xe7 s ILE 102 N -1.82 1.43 -0.14 4.99 1.01 -0.43 -4.16 121.20 122.08 1xe7 s ILE 102 Ca 0.67 -0.65 -0.21 0.00 0.00 0.00 0.00 60.65 60.46 1xe7 s ILE 102 Cb -0.21 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 1xe7 s ILE 102 CO 0.25 0.42 0.62 -0.63 0.00 0.00 0.00 174.94 175.60 1xe7 s ILE 103 N 0.62 5.07 -0.06 2.92 1.01 -0.40 -1.61 121.20 128.75 1xe7 s ILE 103 Ca -0.15 1.22 0.05 0.00 0.00 0.00 0.00 60.65 61.78 1xe7 s ILE 103 Cb -0.16 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1xe7 s ILE 103 CO 0.04 0.20 -0.21 -1.00 0.00 0.00 0.00 174.94 173.98 1xe7 s HIS 104 N 1.26 2.53 -0.11 3.97 3.76 0.20 -0.87 115.29 126.03 1xe7 s HIS 104 Ca 0.31 -0.50 -0.01 0.00 -0.15 0.00 0.00 55.06 54.71 1xe7 s HIS 104 Cb -0.16 -1.61 0.03 0.00 1.11 0.00 0.00 32.58 31.95 1xe7 s HIS 104 CO 0.13 -0.07 -0.04 0.42 -0.85 0.00 0.00 174.74 174.33 1xe7 s ILE 105 N -0.35 0.79 0.29 0.60 1.01 0.12 -1.93 121.20 121.72 1xe7 s ILE 105 Ca 0.03 -0.23 -0.29 0.00 0.00 0.00 0.00 60.65 60.16 1xe7 s ILE 105 Cb -0.12 -0.91 -0.10 0.00 0.01 0.00 0.00 42.46 41.34 1xe7 s ILE 105 CO 0.02 0.25 1.20 -0.22 0.00 0.00 0.00 174.94 176.19 1xe7 s LEU 106 N 1.80 4.49 0.00 2.97 2.96 -0.31 -0.98 118.68 129.60 1xe7 s LEU 106 Ca 0.04 2.45 0.00 0.00 -0.22 0.00 0.00 54.13 56.39 1xe7 s LEU 106 Cb -0.13 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.92 1xe7 s LEU 106 CO -0.07 -0.34 0.00 0.00 -1.32 0.00 0.00 176.35 174.62 1xe7 n GLN 107 N 1.21 0.00 -3.83 1.98 6.02 -0.67 -4.91 117.38 117.18 1xe7 n GLN 107 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 1xe7 n GLN 107 Cb 0.43 -0.52 -0.12 0.00 1.02 0.00 0.00 30.24 31.06 1xe7 n GLN 107 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1xe7 s ARG 108 N -1.99 0.29 1.44 -1.09 1.81 -0.75 -5.01 118.95 113.65 1xe7 s ARG 108 Ca 0.00 0.03 0.00 0.00 -1.72 0.00 0.00 55.73 54.04 1xe7 s ARG 108 Cb 0.00 0.13 0.00 0.00 -0.45 0.00 0.00 34.95 34.63 1xe7 s ARG 108 CO 0.00 -0.05 0.00 0.41 -0.68 0.00 0.00 175.30 174.98 1xe7 n GLY 109 N 2.48 -1.54 3.06 -3.53 0.00 -1.26 -0.57 105.19 103.83 1xe7 n GLY 109 Ca -0.16 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 1xe7 n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xe7 s LYS 110 N 0.00 0.37 0.39 1.61 1.02 -1.22 -4.58 119.74 117.32 1xe7 s LYS 110 Ca 0.00 -0.29 -0.12 0.00 0.02 0.00 0.00 55.97 55.57 1xe7 s LYS 110 Cb 0.00 0.15 0.05 0.00 -0.52 0.00 0.00 37.83 37.51 1xe7 s LYS 110 CO 0.00 -0.08 0.73 0.41 -0.92 0.00 0.00 175.35 175.50 1xe7 n GLY 111 N 1.88 1.19 2.88 -3.33 0.00 -0.75 -2.28 105.19 104.77 1xe7 n GLY 111 Ca -0.20 -1.32 -0.13 0.00 0.00 0.00 0.00 46.02 44.37 1xe7 n GLY 111 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xe7 s GLN 112 N -2.22 0.06 0.08 1.61 0.74 -0.14 0.10 119.66 119.88 1xe7 s GLN 112 Ca 0.18 -0.02 0.06 0.00 0.05 0.00 0.00 55.36 55.63 1xe7 s GLN 112 Cb -0.04 -0.07 -0.04 0.00 1.10 0.00 0.00 33.01 33.96 1xe7 s GLN 112 CO 0.13 0.01 -0.07 0.71 -0.55 0.00 0.00 175.29 175.53 1xe7 s TYR 113 N 0.02 2.83 -0.09 1.67 1.51 -0.30 -1.12 117.35 121.88 1xe7 s TYR 113 Ca -0.00 -0.10 0.01 0.00 -1.01 0.00 0.00 57.07 55.97 1xe7 s TYR 113 Cb -0.01 -1.50 0.02 0.00 -0.11 0.00 0.00 41.96 40.36 1xe7 s TYR 113 CO -0.00 0.42 -0.08 0.08 -1.11 0.00 0.00 175.55 174.86 1xe7 s VAL 114 N -1.18 0.99 -0.04 0.71 1.01 -0.33 -2.05 120.40 119.51 1xe7 s VAL 114 Ca 0.21 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 61.93 1xe7 s VAL 114 Cb -0.11 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.27 1xe7 s VAL 114 CO 0.13 0.35 -0.18 -0.76 0.00 0.00 0.00 175.10 174.64 1xe7 s LEU 115 N 1.31 2.55 -0.22 3.92 1.43 0.21 -1.44 118.68 126.44 1xe7 s LEU 115 Ca -0.03 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 1xe7 s LEU 115 Cb -0.14 -1.49 0.05 0.00 0.03 0.00 0.00 46.19 44.64 1xe7 s LEU 115 CO -0.03 0.34 -0.07 -0.69 0.23 0.00 0.00 176.35 176.12 1xe7 s VAL 116 N -0.70 1.54 0.57 -1.59 1.01 0.03 -0.42 120.40 120.84 1xe7 s VAL 116 Ca 0.11 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 1xe7 s VAL 116 Cb -0.10 -1.73 -0.06 0.00 0.00 0.00 0.00 36.38 34.49 1xe7 s VAL 116 CO 0.00 0.02 1.01 -0.31 0.00 0.00 0.00 175.10 175.82 1xe7 s TYR 117 N 1.41 3.44 0.54 5.22 1.51 0.00 -1.97 117.35 127.50 1xe7 s TYR 117 Ca -0.04 1.42 0.27 0.00 -1.01 0.00 0.00 57.07 57.70 1xe7 s TYR 117 Cb -0.18 -2.80 1.43 0.00 -0.11 0.00 0.00 41.96 40.31 1xe7 s TYR 117 CO -0.07 -0.60 1.98 -1.00 -1.11 0.00 0.00 175.55 174.76 1xe7 h PRO 118 N 0.39 0.00 0.00 -1.71 0.13 -1.90 0.28 132.00 129.19 1xe7 h PRO 118 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1xe7 h PRO 118 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1xe7 h PRO 118 CO 0.61 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.98 1xe7 n ASP 119 N -4.26 0.00 0.00 1.44 5.68 -1.26 -4.91 116.55 113.24 1xe7 n ASP 119 Ca 0.10 0.24 0.00 0.00 -0.50 0.00 0.00 54.79 54.63 1xe7 n ASP 119 Cb 0.63 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 1xe7 n ASP 119 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xe7 n GLY 120 N 1.27 1.74 3.76 6.12 0.00 0.97 -5.02 105.19 114.02 1xe7 n GLY 120 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1xe7 n GLY 120 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xe7 s GLN 121 N -0.62 4.18 -0.12 1.61 0.74 -1.26 -4.61 119.66 119.59 1xe7 s GLN 121 Ca 0.00 2.46 -0.01 0.00 0.05 0.00 0.00 55.36 57.86 1xe7 s GLN 121 Cb 0.00 -3.04 -0.02 0.00 1.10 0.00 0.00 33.01 31.05 1xe7 s GLN 121 CO 0.00 -0.49 -0.08 0.08 -0.55 0.00 0.00 175.29 174.24 1xe7 s VAL 122 N -0.46 3.51 0.02 1.34 1.01 -1.26 -0.82 120.40 123.75 1xe7 s VAL 122 Ca 0.58 -0.51 0.05 0.00 0.00 0.00 0.00 61.98 62.09 1xe7 s VAL 122 Cb -0.45 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 1xe7 s VAL 122 CO 0.52 0.53 -0.15 -0.75 0.00 0.00 0.00 175.10 175.25 1xe7 s LYS 123 N 0.02 1.10 -0.06 2.72 2.20 0.44 -4.97 119.74 121.19 1xe7 s LYS 123 Ca -0.02 -0.69 -0.04 0.00 -0.36 0.00 0.00 55.97 54.86 1xe7 s LYS 123 Cb -0.14 -1.10 0.02 0.00 -1.51 0.00 0.00 37.83 35.10 1xe7 s LYS 123 CO 0.03 0.29 0.14 0.45 -0.36 0.00 0.00 175.35 175.90 1xe7 s SER 124 N -0.83 -0.14 0.06 1.43 0.15 -1.26 0.65 113.70 113.77 1xe7 s SER 124 Ca 0.04 0.29 -0.09 0.00 0.70 0.00 0.00 55.95 56.89 1xe7 s SER 124 Cb -0.07 0.26 -0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1xe7 s SER 124 CO 0.01 -0.08 0.19 0.72 1.20 0.00 0.00 173.24 175.27 1xe7 s PHE 125 N 0.42 0.12 -0.00 3.44 -0.12 -0.87 -1.02 117.98 119.94 1xe7 s PHE 125 Ca -0.03 -0.45 -0.03 0.00 -0.05 0.00 0.00 56.93 56.37 1xe7 s PHE 125 Cb -0.04 -0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 1xe7 s PHE 125 CO -0.02 -0.49 0.20 0.15 -0.05 0.00 0.00 175.22 175.02 1xe7 s LYS 126 N -3.25 3.47 -0.13 1.99 1.02 -1.26 -1.15 119.74 120.43 1xe7 s LYS 126 Ca 0.00 -0.27 -0.01 0.00 0.02 0.00 0.00 55.97 55.72 1xe7 s LYS 126 Cb 0.02 -3.09 -0.02 0.00 -0.52 0.00 0.00 37.83 34.22 1xe7 s LYS 126 CO -0.08 0.66 -0.10 0.08 -0.92 0.00 0.00 175.35 175.00 1xe7 s VAL 127 N -1.33 3.36 0.00 3.17 1.01 0.11 -2.20 120.40 124.52 1xe7 s VAL 127 Ca 0.28 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1xe7 s VAL 127 Cb -0.13 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.83 1xe7 s VAL 127 CO 0.18 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.42 1xe7 n GLY 128 N 3.31 -0.49 0.72 4.51 0.00 -0.74 -1.80 105.19 110.70 1xe7 n GLY 128 Ca -0.18 -1.03 0.10 0.00 0.00 0.00 0.00 46.02 44.92 1xe7 n GLY 128 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xe7 n PHE 129 N -0.25 0.32 -2.85 1.61 3.01 -1.26 -3.74 117.46 114.29 1xe7 n PHE 129 Ca 0.00 -0.16 -0.43 0.00 1.01 0.00 0.00 57.45 57.87 1xe7 n PHE 129 Cb 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.48 1xe7 n PHE 129 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1xe7 n ASP 130 N 0.65 5.76 0.27 4.37 2.03 -1.26 -4.80 116.55 123.57 1xe7 n ASP 130 Ca 0.17 -3.22 0.13 0.00 0.52 0.00 0.00 54.79 52.39 1xe7 n ASP 130 Cb 0.40 -1.38 0.76 0.00 -0.72 0.00 0.00 41.12 40.17 1xe7 n ASP 130 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1xe7 h TYR 131 N 5.90 0.00 0.00 -0.67 -0.00 -1.81 -1.07 116.97 119.32 1xe7 h TYR 131 Ca 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.99 1xe7 h TYR 131 Cb 0.69 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.41 1xe7 h TYR 131 CO 1.06 0.10 -0.06 0.87 -0.00 0.00 0.00 178.16 180.12 1xe7 h LYS 132 N 0.00 0.00 -0.58 0.10 1.57 -1.87 -1.81 116.57 113.98 1xe7 h LYS 132 Ca -0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1xe7 h LYS 132 Cb 0.26 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.45 1xe7 h LYS 132 CO 0.01 0.06 0.18 0.09 -0.57 0.00 0.00 179.45 179.22 1xe7 n ASN 133 N -3.37 3.96 0.00 0.86 3.02 -0.42 -4.94 115.26 114.36 1xe7 n ASN 133 Ca -0.02 -3.36 0.00 0.00 -0.03 0.00 0.00 54.58 51.17 1xe7 n ASN 133 Cb 0.21 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 1xe7 n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xe7 n GLY 134 N -0.58 1.71 3.78 7.41 0.00 -0.68 -5.04 105.19 111.78 1xe7 n GLY 134 Ca 0.37 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.02 1xe7 n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xe7 s GLU 135 N -0.37 3.98 0.20 1.61 2.02 -1.12 -4.16 118.70 120.87 1xe7 s GLU 135 Ca 0.00 1.68 0.10 0.00 0.02 0.00 0.00 54.97 56.77 1xe7 s GLU 135 Cb 0.00 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.67 1xe7 s GLU 135 CO 0.00 -0.34 -0.17 0.14 0.02 0.00 0.00 175.26 174.92 1xe7 s VAL 136 N -1.57 2.74 -0.06 2.63 -7.23 -0.93 -3.85 120.40 112.13 1xe7 s VAL 136 Ca 0.60 -1.91 0.01 0.00 -1.81 0.00 0.00 61.98 58.86 1xe7 s VAL 136 Cb -0.26 -2.35 0.01 0.00 0.56 0.00 0.00 36.38 34.33 1xe7 s VAL 136 CO 0.32 -0.15 0.70 -1.54 -0.31 0.00 0.00 175.10 174.13 1xe7 n SER 137 N 0.05 1.42 -3.76 4.85 3.41 -1.26 -1.80 113.62 116.54 1xe7 n SER 137 Ca -0.11 -1.39 -0.12 0.00 -0.26 0.00 0.00 58.87 56.99 1xe7 n SER 137 Cb 0.56 -0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.39 1xe7 n SER 137 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1xe7 s GLN 138 N -0.40 0.29 -0.19 4.33 -0.21 -1.26 -1.16 119.66 121.06 1xe7 s GLN 138 Ca 0.01 0.46 -0.27 0.00 0.02 0.00 0.00 55.36 55.57 1xe7 s GLN 138 Cb 0.01 0.06 0.08 0.00 1.00 0.00 0.00 33.01 34.15 1xe7 s GLN 138 CO 0.01 -0.08 0.74 1.67 -2.12 0.00 0.00 175.29 175.50 1xe7 s TRP 139 N 0.57 -0.71 -0.11 0.91 -2.14 -0.81 -5.01 118.94 111.65 1xe7 s TRP 139 Ca -0.04 1.54 0.02 0.00 2.66 0.00 0.00 56.10 60.28 1xe7 s TRP 139 Cb -0.05 0.33 -0.01 0.00 -3.10 0.00 0.00 33.47 30.64 1xe7 s TRP 139 CO -0.03 -0.45 -0.17 0.08 -2.66 0.00 0.00 176.95 173.72 1xe7 s VAL 140 N -0.25 2.73 -0.28 -0.66 1.01 -1.26 -0.62 120.40 121.06 1xe7 s VAL 140 Ca -0.04 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 1xe7 s VAL 140 Cb -0.03 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 1xe7 s VAL 140 CO 0.04 0.54 0.10 -0.69 0.00 0.00 0.00 175.10 175.09 1xe7 s VAL 141 N 0.26 4.35 0.64 2.92 1.01 -0.63 -4.95 120.40 123.99 1xe7 s VAL 141 Ca -0.12 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.30 1xe7 s VAL 141 Cb -0.16 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 1xe7 s VAL 141 CO 0.06 0.18 1.31 -2.84 0.00 0.00 0.00 175.10 173.81 1xe7 s PRO 142 N 1.59 2.61 0.64 2.72 0.02 -1.26 -1.31 135.00 140.00 1xe7 s PRO 142 Ca 0.05 2.10 -0.18 0.00 0.02 0.00 0.00 61.00 62.98 1xe7 s PRO 142 Cb -0.16 -1.89 -0.02 0.00 0.02 0.00 0.00 34.50 32.45 1xe7 s PRO 142 CO 0.04 -1.57 1.28 0.20 -0.33 0.00 0.00 177.00 176.63 1xe7 s GLY 143 N -1.33 2.84 0.00 0.52 0.00 -1.25 -2.64 107.32 105.46 1xe7 s GLY 143 Ca 0.82 1.19 0.00 0.00 0.00 0.00 0.00 44.72 46.72 1xe7 s GLY 143 CO 0.41 1.61 0.00 0.61 0.00 0.00 0.00 173.10 175.73 1xe7 n GLY 144 N 0.83 1.90 3.66 0.20 0.00 0.33 -4.93 105.19 107.19 1xe7 n GLY 144 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1xe7 n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xe7 s VAL 145 N -2.84 5.28 0.17 1.61 1.01 -1.08 -4.54 120.40 120.00 1xe7 s VAL 145 Ca 0.00 0.45 -0.30 0.00 0.00 0.00 0.00 61.98 62.12 1xe7 s VAL 145 Cb 0.00 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.68 1xe7 s VAL 145 CO 0.00 0.29 1.28 -0.36 0.00 0.00 0.00 175.10 176.32 1xe7 s PHE 146 N 1.22 3.31 0.01 5.22 0.40 -0.83 -4.53 117.98 122.78 1xe7 s PHE 146 Ca 0.13 1.24 0.02 0.00 -0.60 0.00 0.00 56.93 57.72 1xe7 s PHE 146 Cb -0.14 -3.56 -0.01 0.00 0.51 0.00 0.00 43.02 39.82 1xe7 s PHE 146 CO 0.06 -1.74 -0.07 -1.59 0.70 0.00 0.00 175.22 172.58 1xe7 s LYS 147 N 0.13 0.55 0.09 0.44 -2.85 -0.17 -0.79 119.74 117.14 1xe7 s LYS 147 Ca 0.57 -0.43 -0.01 0.00 -1.00 0.00 0.00 55.97 55.10 1xe7 s LYS 147 Cb -0.35 -0.47 -0.04 0.00 -2.06 0.00 0.00 37.83 34.91 1xe7 s LYS 147 CO 0.36 0.12 0.00 0.00 0.10 0.00 0.00 175.35 175.93 1xe7 s ALA 148 N -0.59 0.74 0.06 0.59 0.00 -0.52 -2.27 121.76 119.77 1xe7 s ALA 148 Ca -0.01 -1.35 -0.15 0.00 0.00 0.00 0.00 51.96 50.45 1xe7 s ALA 148 Cb -0.05 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.59 1xe7 s ALA 148 CO 0.00 -0.40 0.33 -1.54 0.00 0.00 0.00 175.76 174.16 1xe7 s SER 149 N -3.00 -0.16 0.03 0.00 1.04 -0.40 -1.19 113.70 110.03 1xe7 s SER 149 Ca 0.15 -0.19 -0.07 0.00 0.48 0.00 0.00 55.95 56.32 1xe7 s SER 149 Cb 0.07 0.39 -0.01 0.00 0.10 0.00 0.00 66.02 66.57 1xe7 s SER 149 CO -0.04 -0.66 0.13 0.72 0.98 0.00 0.00 173.24 174.36 1xe7 s PHE 150 N -2.78 0.14 0.38 5.02 -0.71 -0.27 -0.23 117.98 119.53 1xe7 s PHE 150 Ca -0.03 -0.39 -0.26 0.00 -1.04 0.00 0.00 56.93 55.20 1xe7 s PHE 150 Cb -0.00 -0.10 -0.09 0.00 -1.21 0.00 0.00 43.02 41.62 1xe7 s PHE 150 CO -0.05 -0.37 1.23 -1.17 -1.34 0.00 0.00 175.22 173.53 1xe7 s LEU 151 N -2.00 4.27 -0.11 -1.99 0.20 -0.22 -0.97 118.68 117.87 1xe7 s LEU 151 Ca -0.07 2.51 0.01 0.00 0.69 0.00 0.00 54.13 57.28 1xe7 s LEU 151 Cb -0.02 -3.88 -0.01 0.00 -0.43 0.00 0.00 46.19 41.85 1xe7 s LEU 151 CO -0.03 -0.67 -0.16 -0.76 -0.29 0.00 0.00 176.35 174.44 1xe7 s LEU 152 N -2.26 2.57 0.28 -0.68 1.43 -0.97 -4.74 118.68 114.31 1xe7 s LEU 152 Ca 0.54 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 52.98 1xe7 s LEU 152 Cb -0.35 -1.56 -0.13 0.00 0.03 0.00 0.00 46.19 44.18 1xe7 s LEU 152 CO 0.45 0.18 1.33 -2.65 0.23 0.00 0.00 176.35 175.90 1xe7 n PRO 153 N 3.38 2.00 -3.63 1.29 -0.02 -1.26 -4.52 135.00 132.24 1xe7 n PRO 153 Ca -0.18 0.71 -0.11 0.00 -2.02 0.00 0.00 63.50 61.89 1xe7 n PRO 153 Cb 0.53 -2.32 -0.07 0.00 -0.02 0.00 0.00 33.50 31.62 1xe7 n PRO 153 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1xe7 s ASN 154 N 0.02 -0.79 0.14 2.55 2.20 -1.26 -4.95 114.94 112.85 1xe7 s ASN 154 Ca 0.63 1.43 0.11 0.00 -0.94 0.00 0.00 52.86 54.09 1xe7 s ASN 154 Cb -0.63 1.41 -0.13 0.00 -2.00 0.00 0.00 41.25 39.90 1xe7 s ASN 154 CO 0.55 -0.24 1.19 -0.08 -2.94 0.00 0.00 177.10 175.58 1xe7 h GLU 155 N 5.56 0.00 -0.12 3.55 4.81 -1.96 0.13 114.58 126.55 1xe7 h GLU 155 Ca -0.29 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1xe7 h GLU 155 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1xe7 h GLU 155 CO 0.09 0.71 0.08 1.05 -0.73 0.00 0.00 179.01 180.21 1xe7 h GLU 156 N 0.00 0.12 -0.68 1.92 4.11 -1.98 -3.03 114.58 115.03 1xe7 h GLU 156 Ca -0.06 -0.01 -0.44 0.00 0.07 0.00 0.00 59.36 58.92 1xe7 h GLU 156 Cb 1.67 -0.03 -0.42 0.00 0.50 0.00 0.00 28.75 30.48 1xe7 h GLU 156 CO 0.10 0.08 -0.93 0.34 0.07 0.00 0.00 179.01 178.66 1xe7 n PHE 157 N -4.52 2.21 -4.05 2.06 7.35 -1.26 -4.89 117.46 114.38 1xe7 n PHE 157 Ca -0.01 -2.25 -0.28 0.00 -0.76 0.00 0.00 57.45 54.14 1xe7 n PHE 157 Cb 0.11 -0.29 -0.03 0.00 0.35 0.00 0.00 39.48 39.63 1xe7 n PHE 157 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1xe7 n ASP 158 N -0.64 -0.99 -3.63 -2.13 8.00 -1.15 -1.09 116.55 114.93 1xe7 n ASP 158 Ca 0.30 -1.03 -0.26 0.00 0.71 0.00 0.00 54.79 54.51 1xe7 n ASP 158 Cb 0.89 -2.88 0.06 0.00 -0.02 0.00 0.00 41.12 39.17 1xe7 n ASP 158 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xe7 n ASN 159 N -2.90 -5.85 -4.60 -2.24 3.02 0.45 -4.79 115.26 98.35 1xe7 n ASN 159 Ca -0.22 -0.58 -0.28 0.00 -0.03 0.00 0.00 54.58 53.48 1xe7 n ASN 159 Cb 0.64 -4.63 -0.10 0.00 -0.61 0.00 0.00 39.78 35.07 1xe7 n ASN 159 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1xe7 s GLY 160 N -3.23 2.51 -0.27 7.41 0.00 -0.25 -4.07 107.32 109.42 1xe7 s GLY 160 Ca 0.58 -2.03 -0.01 0.00 0.00 0.00 0.00 44.72 43.26 1xe7 s GLY 160 CO 0.72 -2.07 0.29 -0.12 0.00 0.00 0.00 173.10 171.91 1xe7 s PHE 161 N -2.82 -0.45 -0.17 1.90 5.36 -0.79 -3.46 117.98 117.55 1xe7 s PHE 161 Ca 0.32 0.01 -0.02 0.00 -0.96 0.00 0.00 56.93 56.27 1xe7 s PHE 161 Cb 0.09 -0.39 -0.02 0.00 -0.34 0.00 0.00 43.02 42.36 1xe7 s PHE 161 CO 0.16 -0.83 -0.08 -1.17 -1.46 0.00 0.00 175.22 171.84 1xe7 s LEU 162 N 2.37 2.92 0.23 6.12 0.20 0.26 -1.09 118.68 129.69 1xe7 s LEU 162 Ca 0.09 -0.29 0.00 0.00 0.69 0.00 0.00 54.13 54.62 1xe7 s LEU 162 Cb -0.14 -1.70 -0.05 0.00 -0.43 0.00 0.00 46.19 43.87 1xe7 s LEU 162 CO -0.27 0.10 0.11 0.27 -0.29 0.00 0.00 176.35 176.27 1xe7 s ILE 163 N 0.73 0.30 0.02 6.68 -4.36 -0.29 -1.67 121.20 122.62 1xe7 s ILE 163 Ca -0.03 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.44 1xe7 s ILE 163 Cb -0.15 -2.54 -0.03 0.00 1.25 0.00 0.00 42.46 40.99 1xe7 s ILE 163 CO 0.02 -0.03 -0.25 -0.44 0.24 0.00 0.00 174.94 174.48 1xe7 s SER 164 N -3.23 3.24 -0.01 4.36 0.01 -0.16 -0.73 113.70 117.17 1xe7 s SER 164 Ca 0.37 -0.51 0.05 0.00 1.31 0.00 0.00 55.95 57.17 1xe7 s SER 164 Cb 0.07 -0.37 -0.01 0.00 0.21 0.00 0.00 66.02 65.92 1xe7 s SER 164 CO 0.12 0.28 -0.16 -1.61 0.41 0.00 0.00 173.24 172.29 1xe7 s GLU 165 N -1.02 1.31 -0.09 12.44 2.02 -0.45 -0.71 118.70 132.21 1xe7 s GLU 165 Ca 0.11 -0.56 0.02 0.00 0.02 0.00 0.00 54.97 54.56 1xe7 s GLU 165 Cb -0.10 -1.25 0.01 0.00 0.10 0.00 0.00 34.13 32.89 1xe7 s GLU 165 CO 0.01 0.33 -0.13 0.08 0.02 0.00 0.00 175.26 175.57 1xe7 s VAL 166 N -0.34 1.28 -0.04 2.63 1.01 -0.04 -1.49 120.40 123.40 1xe7 s VAL 166 Ca 0.05 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.56 1xe7 s VAL 166 Cb -0.06 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 1xe7 s VAL 166 CO -0.00 0.39 -0.24 0.54 0.00 0.00 0.00 175.10 175.79 1xe7 s VAL 167 N 0.86 1.95 -0.07 2.92 0.11 -0.83 -1.28 120.40 124.07 1xe7 s VAL 167 Ca -0.10 -1.02 -0.01 0.00 -2.93 0.00 0.00 61.98 57.91 1xe7 s VAL 167 Cb -0.15 -1.64 0.03 0.00 -1.53 0.00 0.00 36.38 33.09 1xe7 s VAL 167 CO 0.01 0.55 0.01 -0.69 -3.33 0.00 0.00 175.10 171.64 1xe7 s VAL 168 N -0.27 0.32 1.02 2.04 1.01 -1.26 -2.31 120.40 120.96 1xe7 s VAL 168 Ca 0.00 0.15 -0.12 0.00 0.00 0.00 0.00 61.98 62.02 1xe7 s VAL 168 Cb -0.12 -0.49 0.20 0.00 0.00 0.00 0.00 36.38 35.97 1xe7 s VAL 168 CO 0.02 0.25 1.08 -2.84 0.00 0.00 0.00 175.10 173.61 1xe7 s PRO 169 N 1.97 0.21 0.64 2.72 0.02 -1.26 -4.54 135.00 134.76 1xe7 s PRO 169 Ca 0.05 1.04 -0.18 0.00 0.02 0.00 0.00 61.00 61.93 1xe7 s PRO 169 Cb -0.12 -1.67 -0.02 0.00 0.02 0.00 0.00 34.50 32.71 1xe7 s PRO 169 CO -0.05 -3.02 1.17 0.41 -0.33 0.00 0.00 177.00 175.18 1xe7 n GLY 170 N 0.11 0.21 3.67 0.52 0.00 0.75 -4.78 105.19 105.66 1xe7 n GLY 170 Ca 0.07 -0.17 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 1xe7 n GLY 170 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1xe7 n PHE 171 N -1.93 2.05 -3.74 1.61 7.35 -1.26 -4.65 117.46 116.88 1xe7 n PHE 171 Ca 0.15 0.53 -0.12 0.00 -0.76 0.00 0.00 57.45 57.25 1xe7 n PHE 171 Cb 0.48 -2.41 -0.12 0.00 0.35 0.00 0.00 39.48 37.79 1xe7 n PHE 171 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1xe7 s ASP 172 N -0.07 -0.32 0.58 -2.13 -1.08 -1.26 -4.94 116.67 107.45 1xe7 s ASP 172 Ca 0.62 0.61 0.28 0.00 -0.52 0.00 0.00 52.55 53.54 1xe7 s ASP 172 Cb -0.63 0.55 1.69 0.00 -1.46 0.00 0.00 42.92 43.06 1xe7 s ASP 172 CO 0.56 -0.14 2.17 0.15 0.52 0.00 0.00 175.17 178.43 1xe7 h PHE 173 N 6.48 0.00 0.00 -5.34 -0.00 -1.95 -0.81 116.94 115.32 1xe7 h PHE 173 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.64 1xe7 h PHE 173 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.13 1xe7 h PHE 173 CO 0.36 0.00 0.00 0.93 -0.00 0.00 0.00 178.31 179.60 1xe7 h GLU 174 N 0.00 0.00 -0.06 1.11 4.39 -2.01 -1.55 114.58 116.46 1xe7 h GLU 174 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1xe7 h GLU 174 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1xe7 h GLU 174 CO -0.00 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.60 1xe7 n ASP 175 N -2.76 2.86 -4.83 1.42 8.00 -0.31 -4.95 116.55 115.97 1xe7 n ASP 175 Ca -0.01 -1.91 -0.37 0.00 0.71 0.00 0.00 54.79 53.22 1xe7 n ASP 175 Cb 0.16 -0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1xe7 n ASP 175 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1xe7 s HIS 176 N -1.76 3.55 -0.11 1.24 2.46 -0.59 -1.74 115.29 118.35 1xe7 s HIS 176 Ca 0.26 0.53 -0.04 0.00 0.47 0.00 0.00 55.06 56.28 1xe7 s HIS 176 Cb 0.18 -2.06 0.05 0.00 -0.13 0.00 0.00 32.58 30.62 1xe7 s HIS 176 CO 0.27 0.58 0.09 0.99 -2.47 0.00 0.00 174.74 174.20 1xe7 s THR 177 N -0.56 -0.13 0.12 0.89 2.01 -0.18 -5.00 115.64 112.79 1xe7 s THR 177 Ca 0.14 0.12 -0.14 0.00 0.31 0.00 0.00 61.69 62.12 1xe7 s THR 177 Cb -0.12 -0.39 -0.07 0.00 0.01 0.00 0.00 72.50 71.93 1xe7 s THR 177 CO 0.03 -0.06 0.52 0.72 -0.69 0.00 0.00 174.62 175.15 1xe7 s PHE 178 N 2.18 3.63 0.19 4.92 -0.71 -1.26 -0.26 117.98 126.66 1xe7 s PHE 178 Ca 0.04 1.04 -0.30 0.00 -1.04 0.00 0.00 56.93 56.67 1xe7 s PHE 178 Cb -0.14 -2.35 -0.08 0.00 -1.21 0.00 0.00 43.02 39.24 1xe7 s PHE 178 CO -0.07 0.47 1.27 -1.17 -1.34 0.00 0.00 175.22 174.39 1xe7 s LEU 179 N -1.80 4.42 -0.62 -1.99 0.20 -0.65 -4.95 118.68 113.29 1xe7 s LEU 179 Ca 0.35 2.33 -0.18 0.00 0.69 0.00 0.00 54.13 57.32 1xe7 s LEU 179 Cb -0.15 -3.61 0.12 0.00 -0.43 0.00 0.00 46.19 42.12 1xe7 s LEU 179 CO 0.19 -0.48 0.69 -0.54 -0.29 0.00 0.00 176.35 175.92 1xe7 s LYS 180 N -0.08 3.10 0.30 1.98 1.02 -1.26 -4.17 119.74 120.64 1xe7 s LYS 180 Ca 0.56 -1.50 0.00 0.00 0.02 0.00 0.00 55.97 55.05 1xe7 s LYS 180 Cb -0.35 -4.32 0.00 0.00 -0.52 0.00 0.00 37.83 32.64 1xe7 s LYS 180 CO 0.37 -1.50 0.00 0.41 -0.92 0.00 0.00 175.35 173.71 1xe7 n GLY 181 N 5.19 -1.66 0.27 -3.33 0.00 -1.03 -2.98 105.19 101.65 1xe7 n GLY 181 Ca -0.07 -0.90 0.14 0.00 0.00 0.00 0.00 46.02 45.19 1xe7 n GLY 181 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1xe7 h GLU 182 N -1.14 0.00 0.01 1.61 4.81 -1.92 -2.98 114.58 114.96 1xe7 h GLU 182 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1xe7 h GLU 182 Cb 1.28 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 1xe7 h GLU 182 CO 0.02 0.11 -0.06 -0.44 -0.73 0.00 0.00 179.01 177.91 1xe7 h ASP 183 N 0.00 -0.16 0.29 1.04 3.32 -1.96 0.53 116.42 119.48 1xe7 h ASP 183 Ca -0.00 0.02 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 1xe7 h ASP 183 Cb 0.38 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1xe7 h ASP 183 CO 0.01 -0.09 -0.50 -0.08 -1.72 0.00 0.00 179.24 176.87 1xe7 h GLU 184 N -0.11 0.25 -0.53 3.56 4.81 -1.43 -2.75 114.58 118.38 1xe7 h GLU 184 Ca 0.02 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.02 1xe7 h GLU 184 Cb 0.13 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1xe7 h GLU 184 CO -0.05 0.69 -0.03 1.25 -0.73 0.00 0.00 179.01 180.15 1xe7 h LEU 185 N 0.20 0.90 -1.04 1.64 6.46 -1.30 -2.81 115.31 119.35 1xe7 h LEU 185 Ca 0.01 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.51 1xe7 h LEU 185 Cb 0.95 -0.24 -0.04 0.00 -0.73 0.00 0.00 40.66 40.60 1xe7 h LEU 185 CO 0.08 0.98 0.48 0.50 -0.62 0.00 0.00 178.44 179.85 1xe7 h LYS 186 N 0.85 1.14 -0.56 1.25 3.64 0.35 -1.10 116.57 122.13 1xe7 h LYS 186 Ca 0.15 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 1xe7 h LYS 186 Cb 0.54 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1xe7 h LYS 186 CO 0.03 0.82 0.09 0.45 -2.27 0.00 0.00 179.45 178.56 1xe7 h HIS 187 N 1.15 0.94 0.09 1.91 3.86 -1.32 0.11 115.15 121.90 1xe7 h HIS 187 Ca 0.30 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1xe7 h HIS 187 Cb -0.01 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.20 1xe7 h HIS 187 CO 0.01 0.81 -0.04 -0.07 0.86 0.00 0.00 177.93 179.49 1xe7 h LEU 188 N 0.85 -0.10 -1.11 2.43 3.38 -1.28 -3.40 115.31 116.08 1xe7 h LEU 188 Ca 0.18 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1xe7 h LEU 188 Cb 0.38 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xe7 h LEU 188 CO 0.01 0.55 -0.19 1.33 0.09 0.00 0.00 178.44 180.23 1xe7 n VAL 189 N -4.82 0.00 0.00 1.22 0.24 -0.47 -4.24 118.33 110.26 1xe7 n VAL 189 Ca -0.07 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 1xe7 n VAL 189 Cb 0.28 1.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.87 1xe7 n VAL 189 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xe7 n GLY 190 N 0.99 0.57 0.21 7.63 0.00 0.40 -4.40 105.19 110.58 1xe7 n GLY 190 Ca 0.07 -1.84 -0.15 0.00 0.00 0.00 0.00 46.02 44.10 1xe7 n GLY 190 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xe7 h PRO 191 N 0.00 -0.45 -0.25 1.61 0.13 -1.92 -1.60 132.00 129.51 1xe7 h PRO 191 Ca 0.00 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.18 1xe7 h PRO 191 Cb 0.00 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.21 1xe7 h PRO 191 CO 0.00 -0.26 0.11 1.05 -0.23 0.00 0.00 178.00 178.67 1xe7 h GLU 192 N -0.53 0.23 -0.36 0.86 9.09 -1.96 -0.84 114.58 121.07 1xe7 h GLU 192 Ca -0.05 -0.01 -0.11 0.00 0.05 0.00 0.00 59.36 59.23 1xe7 h GLU 192 Cb 0.40 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 27.43 1xe7 h GLU 192 CO 0.08 0.15 -0.24 -0.22 0.05 0.00 0.00 179.01 178.83 1xe7 h LYS 193 N 0.24 0.72 -0.99 1.06 1.63 -1.77 -2.66 116.57 114.81 1xe7 h LYS 193 Ca 0.11 -0.30 0.01 0.00 -0.85 0.00 0.00 60.65 59.62 1xe7 h LYS 193 Cb 0.05 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.60 1xe7 h LYS 193 CO -0.09 0.90 0.65 0.00 -3.45 0.00 0.00 179.45 177.46 1xe7 h ALA 194 N 1.10 1.29 -0.63 5.00 0.00 -0.89 -1.59 119.26 123.54 1xe7 h ALA 194 Ca 0.09 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1xe7 h ALA 194 Cb 0.74 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1xe7 h ALA 194 CO 0.06 0.66 0.11 0.00 0.00 0.00 0.00 179.25 180.07 1xe7 h ALA 195 N 1.38 0.83 -0.01 0.00 0.00 -0.89 -1.17 119.26 119.39 1xe7 h ALA 195 Ca 0.36 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1xe7 h ALA 195 Cb -0.15 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1xe7 h ALA 195 CO -0.08 0.59 -0.37 1.49 0.00 0.00 0.00 179.25 180.87 1xe7 h GLU 196 N 0.94 0.03 -0.54 0.00 4.81 -1.08 -3.07 114.58 115.66 1xe7 h GLU 196 Ca 0.19 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1xe7 h GLU 196 Cb 0.42 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1xe7 h GLU 196 CO 0.01 0.40 0.00 1.28 -0.73 0.00 0.00 179.01 179.97 1xe7 n LEU 197 N -4.09 3.52 -0.29 1.64 4.77 -0.65 -4.60 117.00 117.30 1xe7 n LEU 197 Ca -0.02 -1.87 0.08 0.00 -0.03 0.00 0.00 56.01 54.17 1xe7 n LEU 197 Cb 0.41 -0.36 0.31 0.00 -2.33 0.00 0.00 43.42 41.46 1xe7 n LEU 197 CO 0.39 0.85 1.23 0.00 -1.33 0.00 0.00 177.39 178.53 1xe7 h ALA 198 N 3.64 1.67 0.00 -1.18 0.00 -1.12 -1.04 119.26 121.23 1xe7 h ALA 198 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xe7 h ALA 198 Cb 0.90 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1xe7 h ALA 198 CO 0.00 0.13 0.00 1.97 0.00 0.00 0.00 179.25 181.35 1xe7 n PHE 199 N -4.55 0.07 0.48 0.00 1.16 -1.26 -1.44 117.46 111.92 1xe7 n PHE 199 Ca 0.16 0.03 0.09 0.00 -1.87 0.00 0.00 57.45 55.86 1xe7 n PHE 199 Cb 0.35 -0.55 0.12 0.00 -1.61 0.00 0.00 39.48 37.79 1xe7 n PHE 199 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1xe7 n LEU 200 N -1.57 2.78 -4.62 5.98 4.77 -0.39 -4.98 117.00 118.97 1xe7 n LEU 200 Ca 0.01 -1.26 -0.27 0.00 -0.03 0.00 0.00 56.01 54.46 1xe7 n LEU 200 Cb 0.05 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 40.96 1xe7 n LEU 200 CO 0.05 0.55 -0.37 0.00 -1.33 0.00 0.00 177.39 176.30 1xe7 s ALA 201 N -1.38 3.09 -2.00 -1.18 0.00 -0.52 -0.71 121.76 119.06 1xe7 s ALA 201 Ca 0.26 -1.42 0.10 0.00 0.00 0.00 0.00 51.96 50.90 1xe7 s ALA 201 Cb 0.16 -0.88 0.57 0.00 0.00 0.00 0.00 23.12 22.97 1xe7 s ALA 201 CO 0.24 0.47 1.02 0.72 0.00 0.00 0.00 175.76 178.20