#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h2c s TRP 3 N 0.00 3.38 0.00 5.58 0.52 -1.26 -5.00 118.94 122.16 3h2c s TRP 3 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 56.10 56.19 3h2c s TRP 3 Cb 0.00 -1.81 0.00 0.00 -1.15 0.00 0.00 33.47 30.51 3h2c s TRP 3 CO 0.00 0.19 0.90 -0.40 0.02 0.00 0.00 176.95 177.67 3h2c n ASP 4 N -1.62 1.69 -4.32 2.95 3.85 -1.26 -4.97 116.55 112.87 3h2c n ASP 4 Ca -0.05 -1.81 -0.23 0.00 -0.71 0.00 0.00 54.79 51.98 3h2c n ASP 4 Cb 0.57 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 40.25 3h2c n ASP 4 CO 0.00 0.00 0.00 -0.72 -1.01 0.00 0.00 177.20 175.47 3h2c s TYR 5 N -0.81 1.85 0.12 2.11 -0.85 -1.26 -5.16 117.35 113.35 3h2c s TYR 5 Ca 0.00 -1.10 0.10 0.00 -0.52 0.00 0.00 57.07 55.55 3h2c s TYR 5 Cb 0.00 -1.21 -0.04 0.00 0.38 0.00 0.00 41.96 41.09 3h2c s TYR 5 CO 0.00 -0.14 -0.24 -0.51 -1.52 0.00 0.00 175.55 173.14 3h2c s ASP 6 N -3.53 3.51 -0.69 -0.18 1.01 -1.26 -4.60 116.67 110.93 3h2c s ASP 6 Ca 0.31 -0.68 -0.23 0.00 0.71 0.00 0.00 52.55 52.66 3h2c s ASP 6 Cb 0.06 -0.33 0.07 0.00 1.01 0.00 0.00 42.92 43.73 3h2c s ASP 6 CO 0.15 0.18 1.03 -0.22 0.21 0.00 0.00 175.17 176.52 3h2c s LEU 7 N -2.07 4.24 0.13 1.23 1.98 -0.76 -4.93 118.68 118.50 3h2c s LEU 7 Ca 0.15 -0.99 -0.26 0.00 -2.89 0.00 0.00 54.13 50.14 3h2c s LEU 7 Cb -0.10 -2.44 -0.07 0.00 0.66 0.00 0.00 46.19 44.24 3h2c s LEU 7 CO 0.07 -1.48 0.82 -0.13 -1.89 0.00 0.00 176.35 173.74 3h2c s ARG 8 N 4.23 4.60 -0.46 1.98 1.81 -1.26 -0.59 118.95 129.27 3h2c s ARG 8 Ca 0.25 1.21 0.06 0.00 -1.72 0.00 0.00 55.73 55.52 3h2c s ARG 8 Cb -0.15 -3.31 0.19 0.00 -0.45 0.00 0.00 34.95 31.23 3h2c s ARG 8 CO 0.09 0.43 0.54 0.00 -0.68 0.00 0.00 175.30 175.68 3h2c n GLY 10 N 2.69 1.86 0.29 0.00 0.00 -1.26 0.27 105.19 109.03 3h2c n GLY 10 Ca 0.23 0.50 0.16 0.00 0.00 0.00 0.00 46.02 46.91 3h2c n GLY 10 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3h2c h GLU 11 N 0.00 0.00 -6.23 1.61 4.11 -2.01 -3.44 114.58 108.62 3h2c h GLU 11 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.86 3h2c h GLU 11 Cb 0.00 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.15 3h2c h GLU 11 CO 0.00 0.05 -0.66 0.71 0.07 0.00 0.00 179.01 179.18 3h2c s TYR 12 N -4.25 2.67 -0.03 2.06 1.51 0.14 -5.13 117.35 114.33 3h2c s TYR 12 Ca -0.03 -0.22 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 3h2c s TYR 12 Cb 0.13 -1.20 0.03 0.00 -0.11 0.00 0.00 41.96 40.81 3h2c s TYR 12 CO 0.54 0.61 0.01 0.99 -1.11 0.00 0.00 175.55 176.59 3h2c s THR 13 N -2.25 0.09 -0.42 -0.71 2.01 -1.26 -0.23 115.64 112.88 3h2c s THR 13 Ca 0.31 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.43 3h2c s THR 13 Cb -0.07 -0.20 0.11 0.00 0.01 0.00 0.00 72.50 72.35 3h2c s THR 13 CO 0.19 0.12 0.19 -0.76 -0.69 0.00 0.00 174.62 173.68 3h2c s LEU 14 N 1.03 5.10 0.46 4.42 1.43 0.25 -4.96 118.68 126.41 3h2c s LEU 14 Ca -0.10 -2.18 -0.23 0.00 -1.03 0.00 0.00 54.13 50.59 3h2c s LEU 14 Cb -0.13 -1.78 -0.09 0.00 0.03 0.00 0.00 46.19 44.22 3h2c s LEU 14 CO -0.02 -0.48 1.04 -3.20 0.23 0.00 0.00 176.35 173.92 3h2c n ASN 15 N 4.35 1.37 -0.39 2.29 2.85 -1.26 -1.82 115.26 122.64 3h2c n ASN 15 Ca 0.01 0.99 0.06 0.00 -0.11 0.00 0.00 54.58 55.53 3h2c n ASN 15 Cb 0.41 -1.39 0.14 0.00 1.24 0.00 0.00 39.78 40.18 3h2c n ASN 15 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 3h2c n LEU 16 N 0.17 2.77 -0.04 1.20 4.77 -1.26 -4.60 117.00 120.01 3h2c n LEU 16 Ca 0.10 -2.53 -0.05 0.00 -0.03 0.00 0.00 56.01 53.50 3h2c n LEU 16 Cb 0.41 -0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 3h2c n LEU 16 CO 0.55 0.65 -0.75 0.59 -1.33 0.00 0.00 177.39 177.10 3h2c n ASN 17 N -0.50 3.39 -0.02 -1.43 3.02 -1.26 -4.73 115.26 113.73 3h2c n ASN 17 Ca 0.12 -0.04 -0.09 0.00 -0.03 0.00 0.00 54.58 54.54 3h2c n ASN 17 Cb 0.55 -0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.67 3h2c n ASN 17 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 3h2c h GLU 18 N 0.00 0.05 -3.21 3.52 4.11 -1.88 -3.46 114.58 113.70 3h2c h GLU 18 Ca -0.18 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.23 3h2c h GLU 18 Cb 1.29 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 30.42 3h2c h GLU 18 CO -0.02 0.03 0.07 -1.59 0.07 0.00 0.00 179.01 177.57 3h2c s LYS 19 N -6.19 1.29 -0.25 1.06 -2.85 -1.26 -4.85 119.74 106.69 3h2c s LYS 19 Ca -0.13 -0.70 -0.29 0.00 -1.00 0.00 0.00 55.97 53.85 3h2c s LYS 19 Cb 0.09 0.53 -0.02 0.00 -2.06 0.00 0.00 37.83 36.37 3h2c s LYS 19 CO 0.68 -0.55 1.63 0.99 0.10 0.00 0.00 175.35 178.21 3h2c s THR 20 N -3.82 3.67 0.13 3.79 2.01 -1.26 -4.88 115.64 115.29 3h2c s THR 20 Ca 0.05 0.75 -0.31 0.00 0.31 0.00 0.00 61.69 62.48 3h2c s THR 20 Cb -0.01 -3.73 -0.10 0.00 0.01 0.00 0.00 72.50 68.67 3h2c s THR 20 CO -0.08 -0.34 1.79 -0.76 -0.69 0.00 0.00 174.62 174.54 3h2c s LEU 21 N 5.47 4.39 -0.13 4.42 1.43 -1.13 -4.93 118.68 128.20 3h2c s LEU 21 Ca 0.72 2.74 -0.05 0.00 -1.03 0.00 0.00 54.13 56.51 3h2c s LEU 21 Cb -0.24 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.37 3h2c s LEU 21 CO 0.30 -0.98 0.05 -0.63 0.23 0.00 0.00 176.35 175.32 3h2c s ILE 22 N 2.42 4.70 -0.26 -0.59 -1.09 -1.26 -2.59 121.20 122.54 3h2c s ILE 22 Ca 0.79 -0.08 -0.06 0.00 -2.23 0.00 0.00 60.65 59.07 3h2c s ILE 22 Cb -0.46 -3.05 -0.00 0.00 -1.58 0.00 0.00 42.46 37.37 3h2c s ILE 22 CO 0.35 0.55 0.03 -0.32 -1.23 0.00 0.00 174.94 174.32 3h2c s MET 23 N -0.35 3.25 -0.20 2.79 1.75 0.31 -1.04 119.30 125.81 3h2c s MET 23 Ca 0.09 -0.73 -0.19 0.00 -1.25 0.00 0.00 55.69 53.60 3h2c s MET 23 Cb -0.12 -3.23 -0.03 0.00 2.84 0.00 0.00 34.83 34.29 3h2c s MET 23 CO 0.02 -0.33 0.56 0.20 -0.65 0.00 0.00 175.02 174.82 3h2c s GLY 24 N 1.50 2.07 0.20 2.11 0.00 -0.32 -0.38 107.32 112.49 3h2c s GLY 24 Ca 0.04 -0.35 -0.30 0.00 0.00 0.00 0.00 44.72 44.11 3h2c s GLY 24 CO 0.01 1.16 1.20 -0.42 0.00 0.00 0.00 173.10 175.05 3h2c s ILE 25 N 1.72 3.53 -0.20 0.90 1.01 -0.41 -1.85 121.20 125.90 3h2c s ILE 25 Ca 0.26 1.31 -0.08 0.00 0.00 0.00 0.00 60.65 62.14 3h2c s ILE 25 Cb -0.16 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 3h2c s ILE 25 CO 0.10 0.22 0.07 -0.22 0.00 0.00 0.00 174.94 175.11 3h2c s LEU 26 N -0.37 3.76 -0.72 2.97 2.96 -0.29 -4.87 118.68 122.12 3h2c s LEU 26 Ca 0.52 0.02 -0.03 0.00 -0.22 0.00 0.00 54.13 54.42 3h2c s LEU 26 Cb -0.33 -1.97 0.17 0.00 0.50 0.00 0.00 46.19 44.57 3h2c s LEU 26 CO 0.37 0.11 2.44 0.59 -1.32 0.00 0.00 176.35 178.55 3h2c n ASN 27 N 3.93 7.04 -2.51 3.68 3.02 -1.26 -4.41 115.26 124.76 3h2c n ASN 27 Ca -0.16 -3.42 -0.33 0.00 -0.03 0.00 0.00 54.58 50.63 3h2c n ASN 27 Cb 0.52 -1.20 0.04 0.00 -0.61 0.00 0.00 39.78 38.54 3h2c n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h2c n GLY 37 N 0.49 5.87 1.01 7.41 0.00 -1.25 -5.07 105.19 113.65 3h2c n GLY 37 Ca 0.52 -2.52 -0.09 0.00 0.00 0.00 0.00 46.02 43.93 3h2c n GLY 37 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h2c n SER 38 N -0.67 -1.67 0.08 1.61 3.41 -1.26 -4.92 113.62 110.19 3h2c n SER 38 Ca 0.52 -0.58 -0.16 0.00 -0.26 0.00 0.00 58.87 58.39 3h2c n SER 38 Cb 0.57 -0.30 -0.14 0.00 -0.26 0.00 0.00 64.21 64.08 3h2c n SER 38 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3h2c h TYR 39 N -2.03 0.44 -0.28 7.33 3.20 -2.05 -3.32 116.97 120.26 3h2c h TYR 39 Ca -0.12 -0.32 -0.06 0.00 3.14 0.00 0.00 58.73 61.37 3h2c h TYR 39 Cb 0.38 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3h2c h TYR 39 CO 0.00 1.32 -0.07 -0.91 -1.64 0.00 0.00 178.16 176.86 3h2c h ASN 40 N 0.07 0.55 -0.14 -2.11 2.35 -1.98 -2.88 115.58 111.43 3h2c h ASN 40 Ca -0.20 -0.37 -0.06 0.00 -0.55 0.00 0.00 56.30 55.13 3h2c h ASN 40 Cb 1.99 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 40.21 3h2c h ASN 40 CO 0.17 0.79 -0.14 1.05 -1.65 0.00 0.00 177.43 177.65 3h2c h GLU 41 N 0.30 0.34 0.00 0.81 4.11 -1.97 -1.40 114.58 116.77 3h2c h GLU 41 Ca 0.07 -0.18 0.00 0.00 0.07 0.00 0.00 59.36 59.32 3h2c h GLU 41 Cb 0.55 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3h2c h GLU 41 CO 0.03 0.73 0.00 0.28 0.07 0.00 0.00 179.01 180.12 3h2c n VAL 42 N -4.57 0.03 -0.02 -1.06 0.31 -1.21 -1.18 118.33 110.62 3h2c n VAL 42 Ca -0.06 0.01 -0.02 0.00 -0.01 0.00 0.00 64.34 64.26 3h2c n VAL 42 Cb 0.36 -0.85 -0.04 0.00 -0.91 0.00 0.00 33.84 32.40 3h2c n VAL 42 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3h2c n ASP 43 N -1.01 3.85 0.13 4.52 2.03 -1.04 -3.24 116.55 121.79 3h2c n ASP 43 Ca 0.07 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.36 3h2c n ASP 43 Cb 0.04 0.68 0.15 0.00 -0.72 0.00 0.00 41.12 41.26 3h2c n ASP 43 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3h2c h ALA 44 N 0.25 0.93 -0.07 -1.67 0.00 -0.62 -2.75 119.26 115.33 3h2c h ALA 44 Ca -0.11 -0.58 -0.22 0.00 0.00 0.00 0.00 54.91 54.00 3h2c h ALA 44 Cb 1.18 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.88 3h2c h ALA 44 CO 0.01 0.80 -0.80 0.00 0.00 0.00 0.00 179.25 179.26 3h2c h ALA 45 N 1.34 0.19 -0.32 0.00 0.00 -1.31 -2.22 119.26 116.94 3h2c h ALA 45 Ca -0.01 -0.61 -0.11 0.00 0.00 0.00 0.00 54.91 54.18 3h2c h ALA 45 Cb 1.14 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h2c h ALA 45 CO 0.08 0.59 -0.25 0.28 0.00 0.00 0.00 179.25 179.95 3h2c h VAL 46 N 0.33 1.27 -0.59 0.00 2.07 -1.64 0.14 116.25 117.84 3h2c h VAL 46 Ca -0.08 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 3h2c h VAL 46 Cb 1.45 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 3h2c h VAL 46 CO 0.16 0.44 0.28 -0.09 0.02 0.00 0.00 177.57 178.37 3h2c h ARG 47 N 0.56 0.83 0.02 1.57 2.43 -1.50 -1.45 114.38 116.85 3h2c h ARG 47 Ca 0.08 -0.11 -0.30 0.00 -0.81 0.00 0.00 59.98 58.84 3h2c h ARG 47 Cb 0.73 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.08 3h2c h ARG 47 CO 0.06 0.65 -1.69 1.25 -1.51 0.00 0.00 179.97 178.72 3h2c h HIS 48 N 0.83 0.09 -0.71 2.20 2.76 -0.95 -2.04 115.15 117.32 3h2c h HIS 48 Ca 0.20 -0.07 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 3h2c h HIS 48 Cb 0.10 -0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.02 3h2c h HIS 48 CO 0.01 1.13 0.16 0.00 -1.30 0.00 0.00 177.93 177.93 3h2c h ALA 49 N 0.85 0.95 -0.19 5.26 0.00 -0.70 -2.39 119.26 123.04 3h2c h ALA 49 Ca -0.28 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 3h2c h ALA 49 Cb 2.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 3h2c h ALA 49 CO 0.09 0.67 -0.14 0.87 0.00 0.00 0.00 179.25 180.73 3h2c h LYS 50 N 1.07 0.31 0.00 0.00 1.57 -1.13 -1.77 116.57 116.63 3h2c h LYS 50 Ca 0.22 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 3h2c h LYS 50 Cb 0.39 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3h2c h LYS 50 CO 0.00 0.46 -0.39 1.49 -0.57 0.00 0.00 179.45 180.44 3h2c h GLU 51 N 0.29 0.00 0.00 3.15 4.81 -0.89 -1.61 114.58 120.33 3h2c h GLU 51 Ca 0.06 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 59.04 3h2c h GLU 51 Cb 0.44 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 3h2c h GLU 51 CO 0.03 0.39 -1.37 0.52 -0.73 0.00 0.00 179.01 177.85 3h2c h MET 52 N 0.00 0.00 -0.53 1.92 2.86 -0.99 -2.93 114.93 115.26 3h2c h MET 52 Ca -0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 3h2c h MET 52 Cb 1.11 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 3h2c h MET 52 CO 0.05 0.71 -0.01 -0.09 1.06 0.00 0.00 176.91 178.63 3h2c h ARG 53 N 0.00 0.94 0.00 1.72 1.12 -1.02 -1.14 114.38 115.99 3h2c h ARG 53 Ca -0.16 -0.30 -0.00 0.00 -1.11 0.00 0.00 59.98 58.41 3h2c h ARG 53 Cb 1.88 -0.08 -0.00 0.00 -0.01 0.00 0.00 29.97 31.76 3h2c h ARG 53 CO 0.10 0.96 -0.02 -0.44 -3.11 0.00 0.00 179.97 177.45 3h2c h ASP 54 N 0.81 0.00 0.00 -3.80 3.32 -1.21 -3.17 116.42 112.37 3h2c h ASP 54 Ca 0.15 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 3h2c h ASP 54 Cb 0.54 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 3h2c h ASP 54 CO 0.03 0.02 -0.29 -1.84 -1.72 0.00 0.00 179.24 175.44 3h2c n GLU 55 N -3.60 0.92 0.00 3.56 0.28 -1.11 -4.99 120.64 115.69 3h2c n GLU 55 Ca -0.03 -2.28 0.00 0.00 -0.16 0.00 0.00 57.16 54.70 3h2c n GLU 55 Cb 0.12 -1.16 0.00 0.00 1.43 0.00 0.00 31.44 31.83 3h2c n GLU 55 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3h2c n GLY 56 N -0.88 0.86 3.77 -1.84 0.00 -1.13 -3.82 105.19 102.15 3h2c n GLY 56 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3h2c n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h2c s ALA 57 N -0.91 2.32 0.00 4.61 0.00 -0.45 -4.70 121.76 122.63 3h2c s ALA 57 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.35 3h2c s ALA 57 Cb 0.00 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3h2c s ALA 57 CO 0.00 -1.60 0.00 0.72 0.00 0.00 0.00 175.76 174.88 3h2c n HIS 58 N -3.10 0.00 -3.61 0.00 8.25 -0.20 -4.79 115.22 111.76 3h2c n HIS 58 Ca 0.10 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.40 3h2c n HIS 58 Cb 0.53 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.56 3h2c n HIS 58 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3h2c s ILE 59 N -1.20 0.00 -0.17 1.59 1.01 -1.10 -4.42 121.20 116.91 3h2c s ILE 59 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.56 3h2c s ILE 59 Cb 0.00 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 3h2c s ILE 59 CO 0.00 -0.02 0.02 -0.63 0.00 0.00 0.00 174.94 174.31 3h2c s ILE 60 N -0.33 4.37 -0.43 2.92 -1.09 -0.83 -1.18 121.20 124.64 3h2c s ILE 60 Ca -0.05 -0.18 -0.13 0.00 -2.23 0.00 0.00 60.65 58.06 3h2c s ILE 60 Cb -0.03 -2.95 0.06 0.00 -1.58 0.00 0.00 42.46 37.96 3h2c s ILE 60 CO 0.04 0.48 0.30 -0.62 -1.23 0.00 0.00 174.94 173.92 3h2c s ASP 61 N 0.33 5.93 -0.32 3.58 3.68 -0.77 -0.15 116.67 128.95 3h2c s ASP 61 Ca -0.00 -1.22 -0.10 0.00 2.13 0.00 0.00 52.55 53.35 3h2c s ASP 61 Cb -0.13 -2.10 -0.01 0.00 -1.45 0.00 0.00 42.92 39.23 3h2c s ASP 61 CO 0.01 -0.53 0.17 -0.63 0.13 0.00 0.00 175.17 174.33 3h2c s ILE 62 N 1.58 4.73 0.00 4.11 1.01 -0.14 -1.14 121.20 131.35 3h2c s ILE 62 Ca 0.03 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.27 3h2c s ILE 62 Cb -0.22 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 38.82 3h2c s ILE 62 CO 0.06 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.64 3h2c n GLY 63 N 5.01 3.09 2.82 6.18 0.00 -1.26 -1.81 105.19 119.21 3h2c n GLY 63 Ca -0.13 -2.00 -0.47 0.00 0.00 0.00 0.00 46.02 43.41 3h2c n GLY 63 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h2c n GLU 65 N 0.00 0.00 0.24 1.61 2.13 -1.26 -4.97 120.64 118.40 3h2c n GLU 65 Ca 0.00 0.00 0.16 0.00 0.66 0.00 0.00 57.16 57.98 3h2c n GLU 65 Cb 0.00 -1.21 0.73 0.00 0.27 0.00 0.00 31.44 31.24 3h2c n GLU 65 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3h2c h SER 66 N 2.41 0.00 -6.71 4.31 0.87 -1.99 -3.46 113.55 108.97 3h2c h SER 66 Ca -0.41 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 59.61 3h2c h SER 66 Cb 1.15 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.02 3h2c h SER 66 CO 0.52 0.00 -0.93 0.41 -0.53 0.00 0.00 176.83 176.30 3h2c n THR 67 N -3.13 -2.59 -0.82 2.23 -1.04 -1.26 -5.27 114.28 102.39 3h2c n THR 67 Ca 0.02 -0.55 0.00 0.00 -2.04 0.00 0.00 64.05 61.48 3h2c n THR 67 Cb 0.53 -2.22 0.00 0.00 -1.82 0.00 0.00 70.33 66.82 3h2c n THR 67 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3h2c n ARG 68 N -4.51 0.00 -1.11 -2.82 3.00 -1.26 -5.22 116.66 104.74 3h2c n ARG 68 Ca -0.28 0.00 -0.35 0.00 -0.01 0.00 0.00 57.85 57.21 3h2c n ARG 68 Cb 0.67 0.00 0.08 0.00 0.00 0.00 0.00 32.46 33.21 3h2c n ARG 68 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3h2c n SER 75 N 0.00 -2.11 -0.03 0.55 2.88 -1.26 -5.29 113.62 108.36 3h2c n SER 75 Ca 0.00 0.48 -0.12 0.00 -1.33 0.00 0.00 58.87 57.90 3h2c n SER 75 Cb 0.21 -1.14 -0.10 0.00 -0.75 0.00 0.00 64.21 62.43 3h2c n SER 75 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3h2c h VAL 76 N -0.74 1.32 -0.43 2.46 2.07 -2.06 -3.27 116.25 115.59 3h2c h VAL 76 Ca -0.44 -1.70 0.13 0.00 0.82 0.00 0.00 66.70 65.50 3h2c h VAL 76 Cb 1.33 2.36 -0.02 0.00 -1.52 0.00 0.00 31.29 33.44 3h2c h VAL 76 CO 0.38 0.40 0.53 -0.33 0.02 0.00 0.00 177.57 178.57 3h2c h GLU 77 N -0.87 0.00 0.08 1.57 5.08 -2.02 -2.19 114.58 116.23 3h2c h GLU 77 Ca -0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3h2c h GLU 77 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3h2c h GLU 77 CO 0.01 0.00 -0.04 0.93 -1.00 0.00 0.00 179.01 178.91 3h2c h GLU 78 N 0.00 -0.10 -0.98 2.33 4.39 -1.99 -3.12 114.58 115.10 3h2c h GLU 78 Ca 0.21 0.01 0.22 0.00 0.34 0.00 0.00 59.36 60.13 3h2c h GLU 78 Cb 1.27 0.02 -0.19 0.00 -0.10 0.00 0.00 28.75 29.75 3h2c h GLU 78 CO -0.00 0.26 -0.18 0.39 -1.16 0.00 0.00 179.01 178.32 3h2c n GLU 79 N -4.81 -0.09 0.06 2.33 1.02 -0.83 0.11 120.64 118.44 3h2c n GLU 79 Ca -0.05 1.52 -0.04 0.00 -0.02 0.00 0.00 57.16 58.57 3h2c n GLU 79 Cb 0.20 -2.31 -0.02 0.00 -0.02 0.00 0.00 31.44 29.29 3h2c n GLU 79 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3h2c h ILE 80 N 0.00 0.00 -0.89 -3.67 1.08 -1.66 0.53 117.51 112.89 3h2c h ILE 80 Ca 0.51 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 65.17 3h2c h ILE 80 Cb 0.86 0.00 -0.17 0.00 -3.07 0.00 0.00 36.82 34.44 3h2c h ILE 80 CO -0.99 0.00 -0.14 0.11 -0.69 0.00 0.00 178.15 176.44 3h2c h LYS 81 N -0.20 0.02 -0.01 2.37 1.57 -0.94 0.39 116.57 119.77 3h2c h LYS 81 Ca -0.01 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 3h2c h LYS 81 Cb 0.18 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 3h2c h LYS 81 CO -0.02 0.01 -0.21 0.00 -0.57 0.00 0.00 179.45 178.66 3h2c h ARG 82 N 0.02 -0.32 0.01 3.15 2.47 0.92 -3.34 114.38 117.28 3h2c h ARG 82 Ca 0.46 0.02 -0.35 0.00 -1.26 0.00 0.00 59.98 58.86 3h2c h ARG 82 Cb 0.79 0.07 -0.06 0.00 -1.65 0.00 0.00 29.97 29.12 3h2c h ARG 82 CO -0.88 -0.22 -2.16 0.28 0.56 0.00 0.00 179.97 177.56 3h2c n VAL 83 N -5.34 1.49 0.18 2.04 0.31 0.16 -4.00 118.33 113.18 3h2c n VAL 83 Ca -0.05 -0.81 -0.15 0.00 -0.01 0.00 0.00 64.34 63.33 3h2c n VAL 83 Cb 0.25 -0.77 -0.07 0.00 -0.91 0.00 0.00 33.84 32.34 3h2c n VAL 83 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3h2c h VAL 84 N 0.00 0.32 -0.73 2.52 2.07 -0.45 -2.49 116.25 117.49 3h2c h VAL 84 Ca -0.46 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.20 3h2c h VAL 84 Cb 2.14 0.32 -0.14 0.00 -1.52 0.00 0.00 31.29 32.09 3h2c h VAL 84 CO 0.04 0.00 -0.21 -0.65 0.02 0.00 0.00 177.57 176.77 3h2c h PRO 85 N -0.65 -0.02 -0.77 1.57 0.11 -1.77 -1.41 132.00 129.06 3h2c h PRO 85 Ca -0.01 0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.28 3h2c h PRO 85 Cb 0.61 0.01 -0.12 0.00 0.11 0.00 0.00 31.00 31.61 3h2c h PRO 85 CO -0.10 -0.01 0.16 0.52 -0.21 0.00 0.00 178.00 178.36 3h2c h MET 86 N -0.02 0.22 0.03 1.05 2.86 -1.62 -2.72 114.93 114.73 3h2c h MET 86 Ca 0.34 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.97 3h2c h MET 86 Cb 0.55 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.16 3h2c h MET 86 CO -0.76 0.15 -0.02 0.82 1.06 0.00 0.00 176.91 178.16 3h2c h ILE 87 N 0.23 1.39 -0.99 -1.22 2.04 -0.85 -2.92 117.51 115.19 3h2c h ILE 87 Ca 0.44 -1.50 0.33 0.00 1.00 0.00 0.00 64.86 65.14 3h2c h ILE 87 Cb 0.79 2.36 -0.18 0.00 -0.74 0.00 0.00 36.82 39.05 3h2c h ILE 87 CO -0.56 0.37 0.26 1.56 0.00 0.00 0.00 178.15 179.78 3h2c h GLN 88 N -0.72 0.02 0.12 2.37 1.08 -1.27 -0.70 115.11 116.01 3h2c h GLN 88 Ca -0.00 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3h2c h GLN 88 Cb 0.64 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.07 3h2c h GLN 88 CO 0.01 0.02 -0.06 0.00 -0.95 0.00 0.00 178.83 177.85 3h2c h ALA 89 N 1.98 -0.17 -0.70 3.87 0.00 -1.45 -3.09 119.26 119.71 3h2c h ALA 89 Ca 0.70 -0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.75 3h2c h ALA 89 Cb 1.65 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.46 3h2c h ALA 89 CO -0.84 -0.15 0.48 0.28 0.00 0.00 0.00 179.25 179.02 3h2c h VAL 90 N -0.96 0.73 0.03 0.00 2.07 -1.43 0.18 116.25 116.87 3h2c h VAL 90 Ca -0.02 -0.07 -0.25 0.00 0.82 0.00 0.00 66.70 67.18 3h2c h VAL 90 Cb 0.12 0.51 0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3h2c h VAL 90 CO 0.03 0.04 -1.05 0.77 0.02 0.00 0.00 177.57 177.38 3h2c h SER 91 N 0.21 0.69 0.73 0.57 4.64 -1.26 0.36 113.55 119.49 3h2c h SER 91 Ca 0.34 -0.58 -0.07 0.00 -0.47 0.00 0.00 61.79 61.02 3h2c h SER 91 Cb 1.04 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 3h2c h SER 91 CO -0.07 1.39 -0.31 0.50 -0.87 0.00 0.00 176.83 177.47 3h2c h LYS 92 N 0.27 0.00 0.00 4.77 3.64 -1.33 -3.39 116.57 120.54 3h2c h LYS 92 Ca -0.12 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.04 3h2c h LYS 92 Cb 1.70 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.48 3h2c h LYS 92 CO 0.19 0.31 -1.85 0.39 -2.27 0.00 0.00 179.45 176.22 3h2c n GLU 93 N -3.59 0.37 -3.58 1.90 1.02 0.58 -4.91 120.64 112.43 3h2c n GLU 93 Ca -0.01 0.09 -0.39 0.00 -0.02 0.00 0.00 57.16 56.83 3h2c n GLU 93 Cb 0.44 -1.30 -0.11 0.00 -0.02 0.00 0.00 31.44 30.45 3h2c n GLU 93 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3h2c s VAL 94 N -2.30 5.06 -1.23 2.62 1.01 0.12 -5.04 120.40 120.64 3h2c s VAL 94 Ca -0.20 -0.20 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 3h2c s VAL 94 Cb 0.05 -3.55 0.09 0.00 0.00 0.00 0.00 36.38 32.97 3h2c s VAL 94 CO 0.34 0.07 1.63 -0.54 0.00 0.00 0.00 175.10 176.60 3h2c s LYS 95 N 1.69 3.94 0.07 2.72 1.02 -1.26 -4.42 119.74 123.50 3h2c s LYS 95 Ca 0.06 -1.97 -0.16 0.00 0.02 0.00 0.00 55.97 53.92 3h2c s LYS 95 Cb -0.17 -5.42 0.03 0.00 -0.52 0.00 0.00 37.83 31.76 3h2c s LYS 95 CO 0.09 -2.16 0.38 -0.51 -0.92 0.00 0.00 175.35 172.24 3h2c s LEU 96 N 3.85 0.51 0.27 3.17 1.43 -1.26 -5.14 118.68 121.51 3h2c s LEU 96 Ca 0.50 -0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 53.14 3h2c s LEU 96 Cb 0.02 1.69 -0.09 0.00 0.03 0.00 0.00 46.19 47.84 3h2c s LEU 96 CO 0.04 -0.73 1.04 -2.16 0.23 0.00 0.00 176.35 174.77 3h2c s PRO 97 N -3.03 4.69 -0.15 1.29 0.04 -1.26 -4.87 135.00 131.71 3h2c s PRO 97 Ca -0.02 1.68 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 3h2c s PRO 97 Cb 0.00 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.33 3h2c s PRO 97 CO -0.06 0.30 -0.01 0.42 0.04 0.00 0.00 177.00 177.69 3h2c s ILE 98 N -1.20 4.13 -0.10 0.56 1.09 -1.26 -1.96 121.20 122.46 3h2c s ILE 98 Ca 0.44 -0.28 -0.03 0.00 -1.10 0.00 0.00 60.65 59.68 3h2c s ILE 98 Cb -0.29 -2.81 -0.03 0.00 -1.06 0.00 0.00 42.46 38.26 3h2c s ILE 98 CO 0.37 0.50 0.03 -0.94 -0.10 0.00 0.00 174.94 174.80 3h2c s SER 99 N 0.24 5.48 -0.19 3.58 1.04 0.79 0.14 113.70 124.77 3h2c s SER 99 Ca -0.01 0.20 -0.08 0.00 0.48 0.00 0.00 55.95 56.54 3h2c s SER 99 Cb -0.13 -1.64 -0.04 0.00 0.10 0.00 0.00 66.02 64.31 3h2c s SER 99 CO 0.02 0.36 0.08 -0.51 0.98 0.00 0.00 173.24 174.17 3h2c s ILE 100 N -0.78 4.88 -0.93 -1.02 1.10 -0.74 -0.97 121.20 122.74 3h2c s ILE 100 Ca 0.12 0.00 -0.10 0.00 -0.51 0.00 0.00 60.65 60.17 3h2c s ILE 100 Cb -0.12 -3.22 0.24 0.00 0.15 0.00 0.00 42.46 39.52 3h2c s ILE 100 CO 0.02 0.44 0.88 -0.62 -2.11 0.00 0.00 174.94 173.56 3h2c s ASP 101 N 0.50 6.78 0.38 4.50 3.68 -0.75 -2.07 116.67 129.70 3h2c s ASP 101 Ca 0.04 -3.18 0.05 0.00 2.13 0.00 0.00 52.55 51.60 3h2c s ASP 101 Cb -0.12 -2.15 -0.02 0.00 -1.45 0.00 0.00 42.92 39.17 3h2c s ASP 101 CO 0.01 -0.40 0.20 0.28 0.13 0.00 0.00 175.17 175.39 3h2c s THR 102 N -0.59 0.30 0.00 1.71 -1.32 -1.07 -4.66 115.64 110.01 3h2c s THR 102 Ca 0.24 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.72 3h2c s THR 102 Cb -0.11 -2.38 0.00 0.00 -1.51 0.00 0.00 72.50 68.51 3h2c s THR 102 CO -0.08 0.00 0.07 0.00 -2.21 0.00 0.00 174.62 172.40 3h2c n TYR 103 N -0.81 0.00 -3.22 9.09 0.18 -1.26 -3.94 117.16 117.19 3h2c n TYR 103 Ca -0.00 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.40 3h2c n TYR 103 Cb 0.64 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.54 3h2c n TYR 103 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 3h2c s LYS 104 N -0.03 4.24 -0.04 -3.48 1.02 -1.26 -4.28 119.74 115.91 3h2c s LYS 104 Ca 0.00 0.79 -0.09 0.00 0.02 0.00 0.00 55.97 56.69 3h2c s LYS 104 Cb 0.00 -3.16 -0.05 0.00 -0.52 0.00 0.00 37.83 34.10 3h2c s LYS 104 CO 0.00 0.58 0.44 0.00 -0.92 0.00 0.00 175.35 175.45 3h2c h ALA 105 N 4.25 -0.39 -0.32 5.17 0.00 -1.92 -2.82 119.26 123.23 3h2c h ALA 105 Ca -0.49 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.44 3h2c h ALA 105 Cb 1.21 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3h2c h ALA 105 CO 0.64 -0.37 0.48 1.49 0.00 0.00 0.00 179.25 181.50 3h2c h GLU 106 N -0.84 0.00 0.21 0.00 4.81 -1.95 0.19 114.58 116.99 3h2c h GLU 106 Ca -0.03 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3h2c h GLU 106 Cb 0.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3h2c h GLU 106 CO 0.05 0.00 -0.10 0.28 -0.73 0.00 0.00 179.01 178.51 3h2c h VAL 107 N 0.00 0.62 -0.67 0.32 2.07 -1.95 -2.65 116.25 113.99 3h2c h VAL 107 Ca 0.15 -1.02 0.10 0.00 0.82 0.00 0.00 66.70 66.75 3h2c h VAL 107 Cb 1.12 1.05 -0.08 0.00 -1.52 0.00 0.00 31.29 31.86 3h2c h VAL 107 CO -0.00 0.16 0.29 0.00 0.02 0.00 0.00 177.57 178.04 3h2c h ALA 108 N -0.53 0.91 -0.01 1.67 0.00 -0.52 -0.80 119.26 119.97 3h2c h ALA 108 Ca -0.03 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3h2c h ALA 108 Cb 0.48 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3h2c h ALA 108 CO 0.05 -0.14 -0.00 -0.22 0.00 0.00 0.00 179.25 178.93 3h2c h LYS 109 N 0.49 -0.00 -0.95 0.00 3.64 -0.80 -1.62 116.57 117.32 3h2c h LYS 109 Ca 0.34 0.00 0.20 0.00 -1.27 0.00 0.00 60.65 59.92 3h2c h LYS 109 Cb 0.42 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.12 3h2c h LYS 109 CO -0.31 -0.00 0.53 1.96 -2.27 0.00 0.00 179.45 179.37 3h2c h GLN 110 N -0.00 0.61 -0.24 1.90 1.08 -0.81 -2.17 115.11 115.48 3h2c h GLN 110 Ca 0.00 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 3h2c h GLN 110 Cb 0.00 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.29 3h2c h GLN 110 CO -0.01 0.40 0.04 0.00 -0.95 0.00 0.00 178.83 178.32 3h2c h ALA 111 N 1.66 0.31 -0.65 3.87 0.00 -0.31 1.52 119.26 125.67 3h2c h ALA 111 Ca 0.57 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 3h2c h ALA 111 Cb 0.96 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 3h2c h ALA 111 CO -0.43 -0.02 0.09 0.82 0.00 0.00 0.00 179.25 179.72 3h2c h ILE 112 N 0.20 1.26 -0.80 0.00 5.03 -1.35 0.44 117.51 122.30 3h2c h ILE 112 Ca 0.07 -1.05 0.08 0.00 -0.12 0.00 0.00 64.86 63.85 3h2c h ILE 112 Cb 0.31 0.66 -0.05 0.00 -3.03 0.00 0.00 36.82 34.71 3h2c h ILE 112 CO 0.00 0.39 0.52 -0.08 -0.68 0.00 0.00 178.15 178.31 3h2c h GLU 113 N 1.01 0.76 0.00 2.37 4.57 -0.89 0.05 114.58 122.46 3h2c h GLU 113 Ca 0.20 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 3h2c h GLU 113 Cb 0.45 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 3h2c h GLU 113 CO 0.01 0.51 -0.47 0.00 -1.18 0.00 0.00 179.01 177.88 3h2c h ALA 114 N 1.59 0.73 0.00 2.92 0.00 0.31 -3.48 119.26 121.33 3h2c h ALA 114 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3h2c h ALA 114 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h2c h ALA 114 CO -0.14 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.52 3h2c n GLY 115 N 1.23 0.05 3.82 0.00 0.00 0.12 -4.28 105.19 106.13 3h2c n GLY 115 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 3h2c n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h2c s ALA 116 N 0.00 3.38 -0.12 4.61 0.00 0.91 -4.81 121.76 125.72 3h2c s ALA 116 Ca 0.00 0.15 0.14 0.00 0.00 0.00 0.00 51.96 52.26 3h2c s ALA 116 Cb 0.00 -2.83 -0.21 0.00 0.00 0.00 0.00 23.12 20.08 3h2c s ALA 116 CO 0.00 0.32 0.36 0.72 0.00 0.00 0.00 175.76 177.16 3h2c n HIS 117 N 0.45 0.00 -4.55 0.00 -0.00 0.38 -4.02 115.22 107.48 3h2c n HIS 117 Ca -0.01 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.50 3h2c n HIS 117 Cb 0.52 -0.28 -0.15 0.00 -0.00 0.00 0.00 29.99 30.08 3h2c n HIS 117 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3h2c s ILE 118 N -2.90 1.10 0.33 1.59 1.01 -1.02 -3.82 121.20 117.49 3h2c s ILE 118 Ca -0.04 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 59.95 3h2c s ILE 118 Cb 0.10 -0.95 -0.01 0.00 0.01 0.00 0.00 42.46 41.61 3h2c s ILE 118 CO 0.60 0.21 0.46 -0.63 0.00 0.00 0.00 174.94 175.59 3h2c s ILE 119 N -0.49 4.28 -0.33 2.92 1.01 0.15 -1.79 121.20 126.95 3h2c s ILE 119 Ca 0.04 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 59.77 3h2c s ILE 119 Cb -0.06 -3.49 0.16 0.00 0.01 0.00 0.00 42.46 39.08 3h2c s ILE 119 CO 0.00 -0.20 0.44 0.21 0.00 0.00 0.00 174.94 175.39 3h2c s ASN 120 N -4.14 0.22 -0.24 3.58 2.47 -0.88 -0.81 114.94 115.13 3h2c s ASN 120 Ca 0.43 -0.73 0.00 0.00 0.42 0.00 0.00 52.86 52.99 3h2c s ASN 120 Cb -0.09 1.13 0.04 0.00 -1.45 0.00 0.00 41.25 40.87 3h2c s ASN 120 CO 0.31 -0.30 -0.10 -0.62 -3.72 0.00 0.00 177.10 172.67 3h2c s ASP 121 N 2.17 4.16 0.17 -4.21 3.68 -0.70 -2.60 116.67 119.35 3h2c s ASP 121 Ca 0.12 -1.04 0.22 0.00 2.13 0.00 0.00 52.55 53.99 3h2c s ASP 121 Cb -0.12 -1.59 0.89 0.00 -1.45 0.00 0.00 42.92 40.65 3h2c s ASP 121 CO -0.20 -0.13 1.68 2.30 0.13 0.00 0.00 175.17 178.95 3h2c n ILE 122 N 4.58 0.78 -0.96 4.11 -5.35 -1.25 -2.17 119.36 119.09 3h2c n ILE 122 Ca -0.16 0.14 0.07 0.00 -0.27 0.00 0.00 62.75 62.53 3h2c n ILE 122 Cb 0.46 -0.99 0.34 0.00 -1.74 0.00 0.00 39.64 37.70 3h2c n ILE 122 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 3h2c n TRP 123 N -2.02 1.61 -3.64 4.28 7.02 -1.26 -4.49 117.44 118.93 3h2c n TRP 123 Ca 0.03 -0.83 -0.20 0.00 -1.02 0.00 0.00 57.50 55.49 3h2c n TRP 123 Cb 0.25 -0.44 -0.06 0.00 -2.42 0.00 0.00 31.31 28.64 3h2c n TRP 123 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3h2c n GLY 124 N 0.08 -0.09 3.99 6.99 0.00 -0.92 0.07 105.19 115.32 3h2c n GLY 124 Ca 0.26 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.39 3h2c n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h2c n ALA 125 N -3.24 0.00 -0.02 4.61 0.00 -1.26 -4.54 120.51 116.06 3h2c n ALA 125 Ca -0.19 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.12 3h2c n ALA 125 Cb 0.43 -0.64 -0.10 0.00 0.00 0.00 0.00 19.45 19.15 3h2c n ALA 125 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h2c h LYS 126 N 0.66 0.03 -0.29 0.00 1.57 -0.77 -2.91 116.57 114.86 3h2c h LYS 126 Ca 0.00 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 3h2c h LYS 126 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3h2c h LYS 126 CO 0.00 0.51 -0.15 0.00 -0.57 0.00 0.00 179.45 179.24 3h2c h ALA 127 N 0.52 1.20 -2.01 3.86 0.00 -1.88 -3.37 119.26 117.58 3h2c h ALA 127 Ca 0.00 -0.29 -0.48 0.00 0.00 0.00 0.00 54.91 54.14 3h2c h ALA 127 Cb 0.50 -0.13 -0.33 0.00 0.00 0.00 0.00 17.79 17.83 3h2c h ALA 127 CO 0.00 0.51 -0.86 -1.91 0.00 0.00 0.00 179.25 176.99 3h2c n GLU 128 N -4.18 0.29 -0.34 0.00 2.13 -1.25 -5.03 120.64 112.24 3h2c n GLU 128 Ca 0.00 -2.89 0.23 0.00 0.66 0.00 0.00 57.16 55.16 3h2c n GLU 128 Cb 0.34 -1.61 0.48 0.00 0.27 0.00 0.00 31.44 30.92 3h2c n GLU 128 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 3h2c h PRO 129 N 5.41 0.41 0.00 5.31 0.11 -1.69 0.78 132.00 142.33 3h2c h PRO 129 Ca 0.21 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3h2c h PRO 129 Cb 0.96 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3h2c h PRO 129 CO 0.29 0.27 0.13 1.63 -0.21 0.00 0.00 178.00 180.11 3h2c n LYS 130 N -4.79 0.08 -0.03 1.05 5.02 -1.26 -1.66 118.16 116.57 3h2c n LYS 130 Ca 0.28 0.54 -0.08 0.00 -2.02 0.00 0.00 58.31 57.02 3h2c n LYS 130 Cb 0.90 -1.88 0.08 0.00 -0.02 0.00 0.00 35.03 34.12 3h2c n LYS 130 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 3h2c h ILE 131 N 0.00 1.29 -0.38 -0.18 2.10 -1.19 -3.05 117.51 116.10 3h2c h ILE 131 Ca 0.00 -1.57 -0.02 0.00 1.08 0.00 0.00 64.86 64.35 3h2c h ILE 131 Cb 0.26 1.52 -0.02 0.00 -1.09 0.00 0.00 36.82 37.49 3h2c h ILE 131 CO 0.00 0.50 0.17 0.00 -1.08 0.00 0.00 178.15 177.74 3h2c h ALA 132 N 1.04 0.49 -0.39 0.18 0.00 -1.53 -1.24 119.26 117.80 3h2c h ALA 132 Ca 0.04 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3h2c h ALA 132 Cb 0.92 -0.15 -0.09 0.00 0.00 0.00 0.00 17.79 18.47 3h2c h ALA 132 CO 0.08 0.07 -0.20 0.93 0.00 0.00 0.00 179.25 180.13 3h2c h GLU 133 N 0.47 -0.13 -0.93 0.00 5.08 -1.68 -1.33 114.58 116.06 3h2c h GLU 133 Ca 0.13 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.65 3h2c h GLU 133 Cb 0.15 0.03 -0.16 0.00 0.50 0.00 0.00 28.75 29.27 3h2c h GLU 133 CO -0.01 -0.08 -0.36 0.28 -1.00 0.00 0.00 179.01 177.83 3h2c h VAL 134 N -0.13 0.03 0.12 3.13 2.07 -1.14 0.73 116.25 121.07 3h2c h VAL 134 Ca 0.19 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.72 3h2c h VAL 134 Cb 0.43 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 3h2c h VAL 134 CO -0.48 0.00 -0.46 0.00 0.02 0.00 0.00 177.57 176.66 3h2c h ALA 135 N 1.39 -0.95 -0.89 1.67 0.00 -0.74 -2.38 119.26 117.37 3h2c h ALA 135 Ca 0.34 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 55.30 3h2c h ALA 135 Cb 0.60 0.83 -0.15 0.00 0.00 0.00 0.00 17.79 19.07 3h2c h ALA 135 CO -0.94 -1.06 -0.35 0.00 0.00 0.00 0.00 179.25 176.90 3h2c h ALA 136 N -0.70 0.18 -0.31 0.00 0.00 -0.56 0.38 119.26 118.25 3h2c h ALA 136 Ca -0.01 0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.24 3h2c h ALA 136 Cb 0.66 0.91 -0.08 0.00 0.00 0.00 0.00 17.79 19.28 3h2c h ALA 136 CO -0.24 -0.60 -0.24 1.25 0.00 0.00 0.00 179.25 179.43 3h2c h HIS 137 N -0.04 -0.62 -0.01 0.00 6.17 -0.75 -2.92 115.15 116.97 3h2c h HIS 137 Ca 0.34 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.46 3h2c h HIS 137 Cb 0.60 0.32 0.00 0.00 2.52 0.00 0.00 27.41 30.85 3h2c h HIS 137 CO -0.79 -0.31 -0.23 0.66 0.71 0.00 0.00 177.93 177.97 3h2c n TYR 138 N -5.38 0.00 -3.42 5.26 4.01 -0.69 -4.98 117.16 111.96 3h2c n TYR 138 Ca 0.00 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.53 3h2c n TYR 138 Cb 0.30 -0.05 0.07 0.00 -0.31 0.00 0.00 39.34 39.34 3h2c n TYR 138 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3h2c n ASP 139 N -0.06 -5.91 -4.74 7.72 9.92 0.13 -4.99 116.55 118.62 3h2c n ASP 139 Ca 0.13 -0.45 -0.36 0.00 -0.53 0.00 0.00 54.79 53.58 3h2c n ASP 139 Cb 0.41 -4.55 -0.08 0.00 -0.64 0.00 0.00 41.12 36.26 3h2c n ASP 139 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 3h2c s VAL 140 N -3.27 4.89 0.35 2.53 -7.23 -1.22 -4.94 120.40 111.52 3h2c s VAL 140 Ca 0.50 -0.02 -0.29 0.00 -1.81 0.00 0.00 61.98 60.36 3h2c s VAL 140 Cb -0.22 -3.13 -0.11 0.00 0.56 0.00 0.00 36.38 33.48 3h2c s VAL 140 CO 0.61 0.57 1.45 -2.84 -0.31 0.00 0.00 175.10 174.58 3h2c s PRO 141 N -0.55 4.18 -0.09 4.82 0.02 -1.25 -4.70 135.00 137.43 3h2c s PRO 141 Ca 0.11 2.47 0.02 0.00 0.02 0.00 0.00 61.00 63.61 3h2c s PRO 141 Cb -0.12 -3.01 -0.02 0.00 0.02 0.00 0.00 34.50 31.38 3h2c s PRO 141 CO 0.02 -0.45 -0.15 -1.50 -0.33 0.00 0.00 177.00 174.59 3h2c s ILE 142 N -0.92 2.88 -0.07 2.83 2.07 0.63 0.30 121.20 128.92 3h2c s ILE 142 Ca 0.53 -0.75 -0.17 0.00 -1.41 0.00 0.00 60.65 58.85 3h2c s ILE 142 Cb -0.45 -2.16 -0.05 0.00 0.13 0.00 0.00 42.46 39.93 3h2c s ILE 142 CO 0.58 0.55 0.47 -0.63 -1.91 0.00 0.00 174.94 174.00 3h2c s ILE 143 N -0.06 5.11 -0.18 2.00 1.01 0.01 -0.56 121.20 128.53 3h2c s ILE 143 Ca -0.03 0.95 0.01 0.00 0.00 0.00 0.00 60.65 61.57 3h2c s ILE 143 Cb -0.14 -3.80 0.03 0.00 0.01 0.00 0.00 42.46 38.56 3h2c s ILE 143 CO 0.04 0.41 -0.16 -0.76 0.00 0.00 0.00 174.94 174.47 3h2c s LEU 144 N 0.07 2.11 -0.08 2.97 1.43 -0.26 -1.72 118.68 123.20 3h2c s LEU 144 Ca 0.26 -0.69 -0.03 0.00 -1.03 0.00 0.00 54.13 52.64 3h2c s LEU 144 Cb -0.16 -1.34 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 3h2c s LEU 144 CO 0.12 -0.06 0.04 -0.32 0.23 0.00 0.00 176.35 176.36 3h2c s MET 145 N 1.36 3.07 0.25 1.70 1.75 -1.11 -1.76 119.30 124.56 3h2c s MET 145 Ca 0.03 -0.36 -0.30 0.00 -1.25 0.00 0.00 55.69 53.81 3h2c s MET 145 Cb -0.14 -2.87 -0.10 0.00 2.84 0.00 0.00 34.83 34.56 3h2c s MET 145 CO -0.11 0.71 1.43 -1.58 -0.65 0.00 0.00 175.02 174.82 3h2c s HIS 146 N -0.94 3.02 0.04 4.11 2.46 -0.91 -2.80 115.29 120.27 3h2c s HIS 146 Ca 0.15 1.06 -0.27 0.00 0.47 0.00 0.00 55.06 56.46 3h2c s HIS 146 Cb -0.12 -3.81 0.09 0.00 -0.13 0.00 0.00 32.58 28.62 3h2c s HIS 146 CO 0.04 -2.61 0.80 1.21 -2.47 0.00 0.00 174.74 171.71 3h2c s ASN 147 N 0.31 -0.43 -0.27 9.88 3.84 -1.26 -4.35 114.94 122.65 3h2c s ASN 147 Ca 0.59 0.01 -0.24 0.00 0.21 0.00 0.00 52.86 53.42 3h2c s ASN 147 Cb -0.42 0.45 0.08 0.00 -0.55 0.00 0.00 41.25 40.82 3h2c s ASN 147 CO 0.44 -0.73 0.78 0.00 -2.79 0.00 0.00 177.10 174.80 3h2c s ARG 148 N -3.28 0.76 0.31 0.43 1.70 -1.26 -5.00 118.95 112.60 3h2c s ARG 148 Ca 0.04 0.94 0.21 0.00 -0.47 0.00 0.00 55.73 56.45 3h2c s ARG 148 Cb -0.01 0.35 1.15 0.00 -0.57 0.00 0.00 34.95 35.87 3h2c s ARG 148 CO -0.10 -0.10 1.65 -0.40 -1.08 0.00 0.00 175.30 175.27 3h2c n ASP 149 N 2.77 0.55 -4.27 -2.89 5.68 -1.26 -4.63 116.55 112.50 3h2c n ASP 149 Ca -0.14 0.76 -0.28 0.00 -0.50 0.00 0.00 54.79 54.63 3h2c n ASP 149 Cb 0.56 -0.83 -0.08 0.00 -1.14 0.00 0.00 41.12 39.63 3h2c n ASP 149 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3h2c s ASN 150 N -4.02 3.14 -0.38 -1.12 2.20 -1.26 -5.12 114.94 108.38 3h2c s ASN 150 Ca -0.02 -1.67 0.12 0.00 -0.94 0.00 0.00 52.86 50.34 3h2c s ASN 150 Cb 0.06 0.51 0.38 0.00 -2.00 0.00 0.00 41.25 40.20 3h2c s ASN 150 CO 0.20 -0.91 0.97 1.15 -2.94 0.00 0.00 177.10 175.57 3h2c n MET 151 N -1.00 1.06 -4.09 3.55 0.00 -1.26 -4.87 117.12 110.51 3h2c n MET 151 Ca -0.09 -2.78 -0.33 0.00 0.00 0.00 0.00 57.70 54.50 3h2c n MET 151 Cb 0.65 -1.17 -0.16 0.00 0.00 0.00 0.00 33.22 32.54 3h2c n MET 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 3h2c s ASN 152 N -2.16 3.36 -0.10 3.17 4.22 -1.26 -4.93 114.94 117.24 3h2c s ASN 152 Ca 0.30 -0.69 -0.02 0.00 -2.14 0.00 0.00 52.86 50.31 3h2c s ASN 152 Cb 0.37 -1.51 -0.03 0.00 1.28 0.00 0.00 41.25 41.36 3h2c s ASN 152 CO -0.04 -0.02 -0.03 -0.31 -2.04 0.00 0.00 177.10 174.65 3h2c s TYR 153 N 1.29 3.04 0.08 1.54 1.51 -1.26 -5.00 117.35 118.56 3h2c s TYR 153 Ca 0.04 -0.01 -0.28 0.00 -1.01 0.00 0.00 57.07 55.80 3h2c s TYR 153 Cb -0.14 -1.82 -0.17 0.00 -0.11 0.00 0.00 41.96 39.73 3h2c s TYR 153 CO -0.11 0.27 1.68 0.07 -1.11 0.00 0.00 175.55 176.34 3h2c h ARG 154 N 5.67 -0.47 -2.42 -0.62 -0.00 -2.01 -3.44 114.38 111.09 3h2c h ARG 154 Ca -0.44 0.03 -0.09 0.00 -0.00 0.00 0.00 59.98 59.48 3h2c h ARG 154 Cb 1.18 0.11 -0.27 0.00 -0.00 0.00 0.00 29.97 30.99 3h2c h ARG 154 CO 0.56 -0.32 -0.37 1.21 -0.00 0.00 0.00 179.97 181.06 3h2c s ASN 155 N -4.76 -0.25 0.05 0.08 3.84 -1.26 -5.07 114.94 107.57 3h2c s ASN 155 Ca -0.16 0.94 -0.18 0.00 0.21 0.00 0.00 52.86 53.67 3h2c s ASN 155 Cb 0.05 1.37 -0.08 0.00 -0.55 0.00 0.00 41.25 42.04 3h2c s ASN 155 CO 0.64 -0.24 1.28 0.25 -2.79 0.00 0.00 177.10 176.24 3h2c h LEU 156 N 8.17 -0.79 -0.79 3.21 5.85 -1.97 0.59 115.31 129.57 3h2c h LEU 156 Ca -0.16 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 3h2c h LEU 156 Cb 1.11 0.29 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 3h2c h LEU 156 CO 0.14 -0.29 0.49 0.24 -0.34 0.00 0.00 178.44 178.67 3h2c h MET 157 N -0.40 1.06 -0.17 1.25 2.86 -1.98 0.54 114.93 118.10 3h2c h MET 157 Ca -0.01 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 3h2c h MET 157 Cb 0.39 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 3h2c h MET 157 CO -0.13 0.74 0.06 0.00 1.06 0.00 0.00 176.91 178.64 3h2c h ALA 158 N 1.26 0.22 -0.66 6.32 0.00 -1.89 -1.38 119.26 123.14 3h2c h ALA 158 Ca 0.28 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3h2c h ALA 158 Cb -0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3h2c h ALA 158 CO -0.06 -0.17 0.35 -0.44 0.00 0.00 0.00 179.25 178.93 3h2c h ASP 159 N 0.10 0.82 1.05 0.00 5.19 0.62 -0.52 116.42 123.67 3h2c h ASP 159 Ca 0.05 -0.07 -0.18 0.00 -0.62 0.00 0.00 57.03 56.22 3h2c h ASP 159 Cb 0.21 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 3h2c h ASP 159 CO -0.00 0.67 -0.86 0.00 -3.12 0.00 0.00 179.24 175.92 3h2c h MET 160 N 0.92 0.00 -0.49 3.56 -0.00 0.33 -2.24 114.93 117.02 3h2c h MET 160 Ca 0.23 0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.85 3h2c h MET 160 Cb 0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.62 3h2c h MET 160 CO -0.04 0.86 -0.03 0.82 -0.00 0.00 0.00 176.91 178.52 3h2c h ILE 161 N 0.00 1.25 0.72 -0.10 2.04 -1.09 -1.08 117.51 119.25 3h2c h ILE 161 Ca -0.01 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.74 3h2c h ILE 161 Cb 1.62 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.62 3h2c h ILE 161 CO 0.11 0.38 -0.36 0.00 0.00 0.00 0.00 178.15 178.28 3h2c h ALA 162 N 1.19 -0.99 -0.85 1.87 0.00 -1.01 -1.46 119.26 118.01 3h2c h ALA 162 Ca 0.14 -0.21 0.17 0.00 0.00 0.00 0.00 54.91 55.01 3h2c h ALA 162 Cb 0.51 0.40 -0.10 0.00 0.00 0.00 0.00 17.79 18.60 3h2c h ALA 162 CO 0.03 -1.06 0.40 -0.44 0.00 0.00 0.00 179.25 178.18 3h2c h ASP 163 N -0.99 0.43 -0.54 0.00 3.32 -1.27 0.40 116.42 117.78 3h2c h ASP 163 Ca -0.10 0.11 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3h2c h ASP 163 Cb 0.77 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.35 3h2c h ASP 163 CO 0.15 0.14 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.71 3h2c h LEU 164 N 0.53 0.98 -0.91 1.55 3.38 -1.07 -2.11 115.31 117.66 3h2c h LEU 164 Ca 0.48 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3h2c h LEU 164 Cb 0.76 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3h2c h LEU 164 CO -0.42 1.05 0.57 0.22 0.09 0.00 0.00 178.44 179.96 3h2c h TYR 165 N 0.91 1.17 -0.27 1.13 3.20 0.87 0.21 116.97 124.20 3h2c h TYR 165 Ca 0.16 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 3h2c h TYR 165 Cb 0.57 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 3h2c h TYR 165 CO 0.04 0.76 0.15 -0.44 -1.64 0.00 0.00 178.16 177.02 3h2c h ASP 166 N 1.24 0.31 0.56 -2.11 3.32 -0.79 0.16 116.42 119.12 3h2c h ASP 166 Ca 0.33 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.34 3h2c h ASP 166 Cb -0.09 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 39.38 3h2c h ASP 166 CO -0.07 0.26 -0.27 0.28 -1.72 0.00 0.00 179.24 177.72 3h2c h SER 167 N 0.36 -0.64 -0.61 6.45 0.02 -0.35 -0.86 113.55 117.91 3h2c h SER 167 Ca 0.10 -0.03 0.12 0.00 -0.84 0.00 0.00 61.79 61.14 3h2c h SER 167 Cb 0.01 0.17 -0.12 0.00 0.14 0.00 0.00 62.40 62.60 3h2c h SER 167 CO -0.02 -0.37 -0.26 0.40 -1.14 0.00 0.00 176.83 175.44 3h2c h ILE 168 N -0.89 0.24 -0.46 3.27 2.04 -1.03 0.16 117.51 120.84 3h2c h ILE 168 Ca -0.08 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.85 3h2c h ILE 168 Cb 0.63 0.24 -0.09 0.00 -0.74 0.00 0.00 36.82 36.85 3h2c h ILE 168 CO 0.13 0.00 -0.47 0.50 0.00 0.00 0.00 178.15 178.30 3h2c h LYS 169 N -0.10 -0.31 -0.55 2.37 1.63 -0.83 0.13 116.57 118.91 3h2c h LYS 169 Ca 0.27 0.02 0.09 0.00 -0.85 0.00 0.00 60.65 60.18 3h2c h LYS 169 Cb 0.53 0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 32.15 3h2c h LYS 169 CO -0.68 -0.21 0.14 0.82 -3.45 0.00 0.00 179.45 176.08 3h2c h ILE 170 N -0.32 0.71 -0.98 2.00 2.04 0.26 0.27 117.51 121.49 3h2c h ILE 170 Ca 0.13 -0.10 0.15 0.00 1.00 0.00 0.00 64.86 66.04 3h2c h ILE 170 Cb 0.58 0.40 -0.09 0.00 -0.74 0.00 0.00 36.82 36.98 3h2c h ILE 170 CO -0.62 0.05 0.62 0.00 0.00 0.00 0.00 178.15 178.20 3h2c h ALA 171 N 1.42 1.64 0.10 1.87 0.00 0.55 -1.83 119.26 123.01 3h2c h ALA 171 Ca 0.28 0.04 -0.23 0.00 0.00 0.00 0.00 54.91 55.00 3h2c h ALA 171 Cb 0.38 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3h2c h ALA 171 CO -0.34 0.08 -1.17 0.87 0.00 0.00 0.00 179.25 178.69 3h2c h LYS 172 N 0.86 0.21 0.00 0.00 1.79 0.10 -0.98 116.57 118.55 3h2c h LYS 172 Ca 0.51 -0.35 -0.00 0.00 -2.18 0.00 0.00 60.65 58.63 3h2c h LYS 172 Cb 0.67 0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.45 3h2c h LYS 172 CO -0.29 1.17 -0.00 -0.44 -1.08 0.00 0.00 179.45 178.81 3h2c h ASP 173 N -0.45 0.00 0.98 0.86 5.19 -1.04 0.14 116.42 122.10 3h2c h ASP 173 Ca -0.25 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 3h2c h ASP 173 Cb 1.63 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.14 3h2c h ASP 173 CO 0.04 0.00 -0.06 0.00 -3.12 0.00 0.00 179.24 176.11 3h2c n ALA 174 N -2.22 2.46 0.00 3.45 0.00 -0.69 -4.93 120.51 118.58 3h2c n ALA 174 Ca -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3h2c n ALA 174 Cb 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.10 3h2c n ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h2c n GLY 175 N 1.48 0.62 3.68 0.00 0.00 0.50 -4.58 105.19 106.89 3h2c n GLY 175 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3h2c n GLY 175 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h2c s VAL 176 N -2.00 3.55 0.56 1.61 1.01 -0.40 -4.78 120.40 119.94 3h2c s VAL 176 Ca 0.00 0.83 -0.20 0.00 0.00 0.00 0.00 61.98 62.61 3h2c s VAL 176 Cb 0.00 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 3h2c s VAL 176 CO 0.00 -0.04 1.24 -0.60 0.00 0.00 0.00 175.10 175.71 3h2c s ARG 177 N 3.17 3.12 0.20 2.72 3.52 -1.26 -4.50 118.95 125.92 3h2c s ARG 177 Ca 0.69 1.93 -0.10 0.00 -0.13 0.00 0.00 55.73 58.12 3h2c s ARG 177 Cb -0.33 -2.08 0.26 0.00 -1.56 0.00 0.00 34.95 31.23 3h2c s ARG 177 CO 0.28 -1.12 1.75 -0.44 -0.81 0.00 0.00 175.30 174.97 3h2c h ASP 178 N 1.20 0.27 0.01 -2.12 3.32 -1.98 -2.03 116.42 115.09 3h2c h ASP 178 Ca -0.50 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.61 3h2c h ASP 178 Cb 1.29 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3h2c h ASP 178 CO 0.56 0.17 0.00 1.05 -1.72 0.00 0.00 179.24 179.30 3h2c h GLU 179 N 0.44 0.00 -0.87 3.56 9.09 -1.99 0.68 114.58 125.49 3h2c h GLU 179 Ca 0.30 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.53 3h2c h GLU 179 Cb 0.33 0.00 -0.11 0.00 -1.65 0.00 0.00 28.75 27.33 3h2c h GLU 179 CO -0.28 0.00 0.23 0.09 0.05 0.00 0.00 179.01 179.10 3h2c n ASN 180 N -2.91 3.78 -4.11 3.06 5.03 -0.76 -4.92 115.26 114.43 3h2c n ASN 180 Ca -0.03 -2.84 -0.31 0.00 0.87 0.00 0.00 54.58 52.27 3h2c n ASN 180 Cb 0.06 -0.68 -0.16 0.00 -1.02 0.00 0.00 39.78 37.99 3h2c n ASN 180 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3h2c s ILE 181 N -2.15 1.86 0.04 2.41 1.01 0.23 -0.27 121.20 124.33 3h2c s ILE 181 Ca 0.36 -0.84 0.09 0.00 0.00 0.00 0.00 60.65 60.26 3h2c s ILE 181 Cb 0.29 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 3h2c s ILE 181 CO 0.09 0.51 -0.26 -0.63 0.00 0.00 0.00 174.94 174.65 3h2c s ILE 182 N 1.02 2.19 0.32 2.92 1.01 0.28 -4.28 121.20 124.65 3h2c s ILE 182 Ca -0.03 -1.36 0.09 0.00 0.00 0.00 0.00 60.65 59.34 3h2c s ILE 182 Cb -0.15 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 3h2c s ILE 182 CO -0.05 0.37 0.07 -0.76 0.00 0.00 0.00 174.94 174.58 3h2c s LEU 183 N -1.23 3.20 -0.09 2.97 1.43 -0.50 -1.10 118.68 123.36 3h2c s LEU 183 Ca 0.12 -0.77 -0.04 0.00 -1.03 0.00 0.00 54.13 52.41 3h2c s LEU 183 Cb -0.10 -1.67 0.04 0.00 0.03 0.00 0.00 46.19 44.50 3h2c s LEU 183 CO 0.02 -0.19 0.20 -0.62 0.23 0.00 0.00 176.35 175.99 3h2c s ASP 184 N -3.77 -0.13 0.00 2.29 3.68 -0.72 0.03 116.67 118.04 3h2c s ASP 184 Ca 0.35 0.43 0.16 0.00 2.13 0.00 0.00 52.55 55.63 3h2c s ASP 184 Cb -0.03 0.33 0.89 0.00 -1.45 0.00 0.00 42.92 42.65 3h2c s ASP 184 CO 0.21 -0.17 1.42 -0.81 0.13 0.00 0.00 175.17 175.96 3h2c n PRO 185 N 4.33 0.36 -3.71 4.34 -0.04 -1.26 -2.14 135.00 136.88 3h2c n PRO 185 Ca -0.24 0.07 -0.23 0.00 -0.04 0.00 0.00 63.50 63.06 3h2c n PRO 185 Cb 0.52 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.51 3h2c n PRO 185 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h2c n GLY 186 N 0.04 -0.41 3.75 0.55 0.00 -1.26 -4.41 105.19 103.45 3h2c n GLY 186 Ca 0.10 0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 3h2c n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h2c s ILE 187 N -3.68 2.38 0.00 -0.61 1.09 -1.26 -2.11 121.20 117.01 3h2c s ILE 187 Ca 0.08 0.33 0.00 0.00 -1.10 0.00 0.00 60.65 59.96 3h2c s ILE 187 Cb -0.02 -3.21 0.00 0.00 -1.06 0.00 0.00 42.46 38.17 3h2c s ILE 187 CO 0.83 0.06 0.00 0.61 -0.10 0.00 0.00 174.94 176.33 3h2c n GLY 188 N 1.87 2.60 3.25 6.18 0.00 -1.26 -4.83 105.19 113.01 3h2c n GLY 188 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 3h2c n GLY 188 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h2c s PHE 189 N -2.62 2.18 -1.38 1.61 0.40 -0.90 -4.67 117.98 112.62 3h2c s PHE 189 Ca 0.00 -0.52 -0.06 0.00 -0.60 0.00 0.00 56.93 55.75 3h2c s PHE 189 Cb 0.00 -1.42 0.00 0.00 0.51 0.00 0.00 43.02 42.11 3h2c s PHE 189 CO 0.00 -0.11 0.42 0.00 0.70 0.00 0.00 175.22 176.23 3h2c n ALA 190 N 2.72 -2.15 -3.66 5.36 0.00 -1.26 -4.86 120.51 116.67 3h2c n ALA 190 Ca -0.17 -0.32 -0.11 0.00 0.00 0.00 0.00 53.44 52.85 3h2c n ALA 190 Cb 0.52 -1.84 -0.11 0.00 0.00 0.00 0.00 19.45 18.02 3h2c n ALA 190 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3h2c s LYS 191 N -6.70 0.41 1.07 0.00 1.02 -1.26 -4.82 119.74 109.46 3h2c s LYS 191 Ca 0.11 0.78 -0.15 0.00 0.02 0.00 0.00 55.97 56.74 3h2c s LYS 191 Cb -0.05 0.00 0.22 0.00 -0.52 0.00 0.00 37.83 37.48 3h2c s LYS 191 CO 0.91 -0.15 1.10 0.95 -0.92 0.00 0.00 175.35 177.25 3h2c s THR 192 N 1.31 1.88 0.05 2.17 -4.23 -1.26 -4.71 115.64 110.84 3h2c s THR 192 Ca -0.09 0.00 -0.23 0.00 -1.18 0.00 0.00 61.69 60.19 3h2c s THR 192 Cb -0.08 -2.51 -0.16 0.00 1.34 0.00 0.00 72.50 71.10 3h2c s THR 192 CO -0.12 0.00 1.55 -0.65 -0.54 0.00 0.00 174.62 174.86 3h2c h PRO 193 N -2.12 0.06 -0.79 3.99 0.11 -2.00 -1.66 132.00 129.59 3h2c h PRO 193 Ca -0.52 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 3h2c h PRO 193 Cb 1.32 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.39 3h2c h PRO 193 CO 0.50 0.25 0.38 0.93 -0.21 0.00 0.00 178.00 179.85 3h2c h GLU 194 N -0.14 1.13 -0.30 1.05 3.07 -1.99 -2.45 114.58 114.96 3h2c h GLU 194 Ca 0.01 -0.17 0.07 0.00 -0.50 0.00 0.00 59.36 58.78 3h2c h GLU 194 Cb 0.21 -0.20 -0.08 0.00 -0.84 0.00 0.00 28.75 27.84 3h2c h GLU 194 CO -0.00 0.88 -0.23 1.96 -1.40 0.00 0.00 179.01 180.21 3h2c h GLN 195 N 1.11 -0.21 -0.57 2.33 4.20 -1.89 -2.11 115.11 117.98 3h2c h GLN 195 Ca 0.27 0.01 0.11 0.00 0.06 0.00 0.00 58.65 59.10 3h2c h GLN 195 Cb 0.12 0.05 -0.11 0.00 0.30 0.00 0.00 27.48 27.83 3h2c h GLN 195 CO -0.03 -0.14 -0.24 -0.91 -0.67 0.00 0.00 178.83 176.84 3h2c h ASN 196 N -0.21 -0.84 -0.69 1.46 2.35 -0.84 -0.79 115.58 116.02 3h2c h ASN 196 Ca 0.16 0.20 0.20 0.00 -0.55 0.00 0.00 56.30 56.30 3h2c h ASN 196 Cb 0.45 0.46 -0.03 0.00 0.05 0.00 0.00 38.32 39.26 3h2c h ASN 196 CO -0.42 -0.26 0.51 -0.07 -1.65 0.00 0.00 177.43 175.53 3h2c h LEU 197 N -0.10 0.00 0.03 1.61 4.07 -1.14 -2.21 115.31 117.57 3h2c h LEU 197 Ca 0.26 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.86 3h2c h LEU 197 Cb 0.50 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.19 3h2c h LEU 197 CO -0.63 0.00 -2.12 -1.84 -1.08 0.00 0.00 178.44 172.76 3h2c n GLU 198 N -4.28 0.68 0.28 1.13 0.28 -0.39 -2.06 120.64 116.29 3h2c n GLU 198 Ca 0.14 0.18 0.12 0.00 -0.16 0.00 0.00 57.16 57.44 3h2c n GLU 198 Cb 0.77 -1.64 0.81 0.00 1.43 0.00 0.00 31.44 32.80 3h2c n GLU 198 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h2c h ALA 199 N 0.52 1.68 -0.07 -1.84 0.00 -1.24 -2.86 119.26 115.45 3h2c h ALA 199 Ca -0.45 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 3h2c h ALA 199 Cb 2.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.84 3h2c h ALA 199 CO 0.03 0.01 -0.23 0.52 0.00 0.00 0.00 179.25 179.58 3h2c h MET 200 N 0.00 0.28 -0.34 0.00 2.86 -0.87 -2.52 114.93 114.34 3h2c h MET 200 Ca -0.00 -0.21 0.10 0.00 -2.06 0.00 0.00 59.70 57.53 3h2c h MET 200 Cb 0.02 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 3h2c h MET 200 CO 0.00 0.84 0.31 -0.09 1.06 0.00 0.00 176.91 179.03 3h2c h ARG 201 N -0.22 0.00 -0.06 1.72 2.43 -1.26 -3.19 114.38 113.81 3h2c h ARG 201 Ca -0.01 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3h2c h ARG 201 Cb 0.86 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.41 3h2c h ARG 201 CO 0.05 0.00 -0.02 0.09 -1.51 0.00 0.00 179.97 178.58 3h2c n ASN 202 N -3.99 2.65 -0.32 -3.80 3.02 -1.09 -4.75 115.26 106.98 3h2c n ASN 202 Ca 0.05 -3.12 0.21 0.00 -0.03 0.00 0.00 54.58 51.70 3h2c n ASN 202 Cb 0.47 -0.46 0.42 0.00 -0.61 0.00 0.00 39.78 39.60 3h2c n ASN 202 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3h2c h LEU 203 N 0.43 0.10 -0.73 3.41 3.38 -1.44 -1.83 115.31 118.63 3h2c h LEU 203 Ca 0.00 0.23 0.16 0.00 0.09 0.00 0.00 57.88 58.37 3h2c h LEU 203 Cb 1.10 0.29 -0.12 0.00 0.09 0.00 0.00 40.66 42.02 3h2c h LEU 203 CO 0.05 -0.28 0.06 1.05 0.09 0.00 0.00 178.44 179.42 3h2c h GLU 204 N 0.13 0.15 -0.95 1.13 9.09 -1.85 -0.69 114.58 121.58 3h2c h GLU 204 Ca 0.69 -0.01 0.36 0.00 0.05 0.00 0.00 59.36 60.45 3h2c h GLU 204 Cb 1.59 -0.03 -0.17 0.00 -1.65 0.00 0.00 28.75 28.49 3h2c h GLU 204 CO -0.74 0.10 0.38 1.04 0.05 0.00 0.00 179.01 179.84 3h2c n GLN 205 N -5.28 -0.06 0.26 1.06 6.02 -0.69 -1.44 117.38 117.25 3h2c n GLN 205 Ca 0.13 1.34 0.12 0.00 -0.01 0.00 0.00 57.00 58.58 3h2c n GLN 205 Cb 0.46 -2.32 0.71 0.00 1.02 0.00 0.00 30.24 30.11 3h2c n GLN 205 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3h2c h LEU 206 N 0.00 0.00 -1.37 1.08 4.07 -1.29 -1.34 115.31 116.46 3h2c h LEU 206 Ca 0.74 0.00 0.36 0.00 0.08 0.00 0.00 57.88 59.07 3h2c h LEU 206 Cb 1.88 0.00 -0.12 0.00 1.08 0.00 0.00 40.66 43.51 3h2c h LEU 206 CO -0.77 0.12 0.76 0.78 -1.08 0.00 0.00 178.44 178.25 3h2c h ASN 207 N 0.00 0.33 0.49 -0.43 2.35 -1.40 -2.13 115.58 114.79 3h2c h ASN 207 Ca -0.00 0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 3h2c h ASN 207 Cb 0.32 0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.77 3h2c h ASN 207 CO 0.02 -0.08 0.00 1.33 -1.65 0.00 0.00 177.43 177.05 3h2c n VAL 208 N -4.69 0.81 1.35 2.81 0.24 -0.51 -0.94 118.33 117.41 3h2c n VAL 208 Ca 0.32 0.20 0.14 0.00 -2.04 0.00 0.00 64.34 62.97 3h2c n VAL 208 Cb 1.19 -0.93 0.64 0.00 -1.47 0.00 0.00 33.84 33.27 3h2c n VAL 208 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3h2c n LEU 209 N -1.45 0.27 -3.02 1.34 4.77 -0.80 -4.97 117.00 113.14 3h2c n LEU 209 Ca 0.05 0.15 -0.20 0.00 -0.03 0.00 0.00 56.01 55.98 3h2c n LEU 209 Cb 0.17 -0.25 0.06 0.00 -2.33 0.00 0.00 43.42 41.07 3h2c n LEU 209 CO 0.14 0.05 0.19 0.61 -1.33 0.00 0.00 177.39 177.05 3h2c n GLY 210 N 1.31 -0.30 3.27 -0.72 0.00 -0.12 -5.04 105.19 103.60 3h2c n GLY 210 Ca 0.13 0.09 -0.15 0.00 0.00 0.00 0.00 46.02 46.09 3h2c n GLY 210 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h2c s TYR 211 N -3.25 1.37 0.32 1.61 1.51 -1.26 -5.11 117.35 112.54 3h2c s TYR 211 Ca 0.47 -0.74 -0.29 0.00 -1.01 0.00 0.00 57.07 55.50 3h2c s TYR 211 Cb -0.21 -0.69 -0.12 0.00 -0.11 0.00 0.00 41.96 40.83 3h2c s TYR 211 CO 0.58 0.12 1.49 -2.30 -1.11 0.00 0.00 175.55 174.33 3h2c n PRO 212 N -0.25 2.51 -4.50 -1.71 -0.02 -1.26 -4.81 135.00 124.96 3h2c n PRO 212 Ca -0.09 0.89 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 3h2c n PRO 212 Cb 0.61 -2.61 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 3h2c n PRO 212 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h2c s VAL 213 N -0.48 3.84 -0.14 -1.45 1.01 -1.26 -1.41 120.40 120.51 3h2c s VAL 213 Ca 0.60 -0.40 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 3h2c s VAL 213 Cb -0.52 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 3h2c s VAL 213 CO 0.55 0.55 0.05 -0.22 0.00 0.00 0.00 175.10 176.03 3h2c s LEU 214 N -0.24 3.82 -0.08 3.92 2.96 0.10 0.68 118.68 129.84 3h2c s LEU 214 Ca 0.04 0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 54.06 3h2c s LEU 214 Cb -0.13 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 3h2c s LEU 214 CO 0.02 0.28 0.13 -0.22 -1.32 0.00 0.00 176.35 175.24 3h2c s LEU 215 N -0.26 4.25 -0.33 -0.68 2.96 -0.59 -4.01 118.68 120.02 3h2c s LEU 215 Ca 0.08 0.38 -0.01 0.00 -0.22 0.00 0.00 54.13 54.35 3h2c s LEU 215 Cb -0.12 -2.17 0.11 0.00 0.50 0.00 0.00 46.19 44.51 3h2c s LEU 215 CO 0.02 0.36 0.14 -0.83 -1.32 0.00 0.00 176.35 174.72 3h2c s GLY 216 N -1.26 0.96 0.00 7.98 0.00 -1.26 -1.21 107.32 112.53 3h2c s GLY 216 Ca 0.18 -1.65 0.00 0.00 0.00 0.00 0.00 44.72 43.25 3h2c s GLY 216 CO 0.08 1.79 0.67 -1.30 0.00 0.00 0.00 173.10 174.34 3h2c n THR 217 N 4.69 0.39 -1.68 0.90 -2.24 -1.26 -4.45 114.28 110.63 3h2c n THR 217 Ca 0.00 -0.41 -0.48 0.00 -2.27 0.00 0.00 64.05 60.88 3h2c n THR 217 Cb 0.40 0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 69.45 3h2c n THR 217 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3h2c n SER 218 N -0.20 3.30 -3.25 3.42 2.88 -1.26 -2.41 113.62 116.11 3h2c n SER 218 Ca 0.00 1.01 -0.21 0.00 -1.33 0.00 0.00 58.87 58.33 3h2c n SER 218 Cb 0.37 -1.37 -0.05 0.00 -0.75 0.00 0.00 64.21 62.41 3h2c n SER 218 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3h2c n ARG 219 N 5.75 -0.88 -1.36 -1.46 1.74 -1.26 -4.91 116.66 114.27 3h2c n ARG 219 Ca 0.21 0.07 -0.30 0.00 -0.77 0.00 0.00 57.85 57.06 3h2c n ARG 219 Cb 0.29 -2.35 0.12 0.00 -1.02 0.00 0.00 32.46 29.50 3h2c n ARG 219 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3h2c s LYS 220 N -4.68 1.50 0.31 5.56 -0.14 -1.01 -4.88 119.74 116.41 3h2c s LYS 220 Ca 0.31 0.69 0.01 0.00 -1.36 0.00 0.00 55.97 55.62 3h2c s LYS 220 Cb -0.18 -1.85 0.56 0.00 -1.68 0.00 0.00 37.83 34.69 3h2c s LYS 220 CO 0.55 -2.04 1.93 1.03 -0.76 0.00 0.00 175.35 176.06 3h2c h SER 221 N -1.39 0.86 1.10 2.83 0.87 -1.92 -2.91 113.55 112.99 3h2c h SER 221 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 3h2c h SER 221 Cb 1.29 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 3h2c h SER 221 CO 0.57 0.56 0.00 2.19 -0.53 0.00 0.00 176.83 179.62 3h2c h PHE 222 N 0.98 0.00 -0.04 2.24 -5.15 -1.94 0.51 116.94 113.54 3h2c h PHE 222 Ca 0.36 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 58.13 3h2c h PHE 222 Cb 0.18 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.34 3h2c h PHE 222 CO -0.00 0.00 0.02 0.82 -2.00 0.00 0.00 178.31 177.15 3h2c h ILE 223 N 0.00 1.11 -0.56 0.88 2.04 -1.89 0.14 117.51 119.23 3h2c h ILE 223 Ca 0.00 -0.31 0.11 0.00 1.00 0.00 0.00 64.86 65.66 3h2c h ILE 223 Cb 0.55 1.25 -0.11 0.00 -0.74 0.00 0.00 36.82 37.78 3h2c h ILE 223 CO 0.00 0.09 -0.19 1.23 0.00 0.00 0.00 178.15 179.28 3h2c h GLY 224 N -0.07 0.28 1.01 5.37 0.00 -0.88 0.22 103.07 109.00 3h2c h GLY 224 Ca 0.01 0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.60 3h2c h GLY 224 CO -0.00 -0.22 0.49 0.84 0.00 0.00 0.00 176.54 177.64 3h2c h HIS 225 N -0.06 0.93 0.04 5.60 -0.00 0.23 0.66 115.15 122.55 3h2c h HIS 225 Ca 0.26 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.65 3h2c h HIS 225 Cb 0.46 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 27.56 3h2c h HIS 225 CO -0.51 0.58 -0.02 0.28 -0.00 0.00 0.00 177.93 178.27 3h2c h VAL 226 N 1.00 1.34 0.00 5.26 2.07 -0.43 -3.33 116.25 122.16 3h2c h VAL 226 Ca 0.27 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.25 3h2c h VAL 226 Cb -0.12 2.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 3h2c h VAL 226 CO -0.06 0.37 -0.52 -0.07 0.02 0.00 0.00 177.57 177.31 3h2c h LEU 227 N -0.77 0.00 -2.30 2.57 3.38 -0.56 -3.49 115.31 114.13 3h2c h LEU 227 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3h2c h LEU 227 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3h2c h LEU 227 CO 0.01 0.00 -0.41 -0.67 0.09 0.00 0.00 178.44 177.46 3h2c n ASP 228 N -2.88 -7.87 -3.64 -0.43 -0.08 0.23 -5.03 116.55 96.84 3h2c n ASP 228 Ca 0.02 0.43 -0.05 0.00 -1.51 0.00 0.00 54.79 53.68 3h2c n ASP 228 Cb 0.54 -5.34 -0.07 0.00 2.34 0.00 0.00 41.12 38.59 3h2c n ASP 228 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3h2c s LEU 229 N -2.82 -0.47 0.71 -2.67 1.43 -1.18 -5.05 118.68 108.63 3h2c s LEU 229 Ca 0.21 0.82 -0.10 0.00 -1.03 0.00 0.00 54.13 54.02 3h2c s LEU 229 Cb -0.06 1.78 0.03 0.00 0.03 0.00 0.00 46.19 47.98 3h2c s LEU 229 CO 0.76 -0.13 1.08 -2.16 0.23 0.00 0.00 176.35 176.13 3h2c s PRO 230 N 0.81 2.60 0.34 1.29 0.04 -1.26 -4.30 135.00 134.52 3h2c s PRO 230 Ca -0.03 0.26 0.12 0.00 0.04 0.00 0.00 61.00 61.39 3h2c s PRO 230 Cb -0.04 -2.05 1.04 0.00 0.04 0.00 0.00 34.50 33.49 3h2c s PRO 230 CO -0.11 -1.14 1.60 -0.24 0.04 0.00 0.00 177.00 177.15 3h2c h VAL 231 N -0.68 0.10 -0.12 -0.36 3.04 -1.97 0.22 116.25 116.48 3h2c h VAL 231 Ca -0.45 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.21 3h2c h VAL 231 Cb 1.28 0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.56 3h2c h VAL 231 CO 0.64 0.02 0.00 -1.84 -1.01 0.00 0.00 177.57 175.37 3h2c n GLU 232 N -5.28 1.69 -0.71 4.17 0.00 -1.26 -2.95 120.64 116.30 3h2c n GLU 232 Ca 0.30 -0.61 0.05 0.00 0.00 0.00 0.00 57.16 56.90 3h2c n GLU 232 Cb 1.00 -1.55 0.09 0.00 0.00 0.00 0.00 31.44 30.98 3h2c n GLU 232 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3h2c n GLU 233 N 0.09 0.72 -1.18 3.44 -0.58 0.78 -4.83 120.64 119.07 3h2c n GLU 233 Ca 0.05 -2.26 -0.05 0.00 -0.42 0.00 0.00 57.16 54.49 3h2c n GLU 233 Cb 0.38 -0.89 0.13 0.00 -0.57 0.00 0.00 31.44 30.49 3h2c n GLU 233 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3h2c n ARG 234 N -0.48 2.25 0.01 3.49 1.74 -1.15 -4.70 116.66 117.82 3h2c n ARG 234 Ca 0.10 -3.57 -0.22 0.00 -0.77 0.00 0.00 57.85 53.40 3h2c n ARG 234 Cb 0.81 -1.79 -0.14 0.00 -1.02 0.00 0.00 32.46 30.32 3h2c n ARG 234 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3h2c h LEU 235 N 1.45 0.41 -0.57 0.55 5.85 -1.88 -2.31 115.31 118.81 3h2c h LEU 235 Ca 0.12 -0.92 -0.04 0.00 0.84 0.00 0.00 57.88 57.88 3h2c h LEU 235 Cb 1.23 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3h2c h LEU 235 CO 0.28 1.82 0.21 -0.33 -0.34 0.00 0.00 178.44 180.07 3h2c h GLU 236 N -0.01 0.86 -0.54 1.25 3.07 -1.99 -1.38 114.58 115.85 3h2c h GLU 236 Ca -0.41 -0.17 -0.03 0.00 -0.50 0.00 0.00 59.36 58.26 3h2c h GLU 236 Cb 1.99 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 29.74 3h2c h GLU 236 CO 0.08 0.76 0.23 0.78 -1.40 0.00 0.00 179.01 179.45 3h2c h GLY 237 N 0.78 0.85 0.53 -3.84 0.00 -1.88 -1.57 103.07 97.95 3h2c h GLY 237 Ca 0.19 -0.45 0.07 0.00 0.00 0.00 0.00 47.33 47.14 3h2c h GLY 237 CO -0.01 0.43 0.24 -0.84 0.00 0.00 0.00 176.54 176.36 3h2c h THR 238 N 0.72 0.85 -0.89 4.70 2.02 -1.25 -1.73 112.91 117.33 3h2c h THR 238 Ca 0.18 -0.15 0.11 0.00 0.77 0.00 0.00 66.41 67.31 3h2c h THR 238 Cb 0.18 0.36 -0.12 0.00 -1.74 0.00 0.00 68.15 66.82 3h2c h THR 238 CO -0.02 0.08 -0.45 0.61 0.37 0.00 0.00 175.52 176.12 3h2c n GLY 239 N -1.28 -2.10 0.13 2.16 0.00 -0.53 -0.39 105.19 103.18 3h2c n GLY 239 Ca 0.07 1.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.99 3h2c n GLY 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h2c h ALA 240 N 0.81 -0.24 -0.53 4.61 0.00 -0.63 -1.69 119.26 121.60 3h2c h ALA 240 Ca 0.22 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.10 3h2c h ALA 240 Cb 0.44 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.24 3h2c h ALA 240 CO -0.86 -0.52 -0.02 1.79 0.00 0.00 0.00 179.25 179.64 3h2c h THR 241 N -0.46 0.57 -0.17 0.00 1.35 -0.85 -1.48 112.91 111.87 3h2c h THR 241 Ca -0.02 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.79 3h2c h THR 241 Cb 0.36 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 67.22 3h2c h THR 241 CO 0.04 0.02 0.05 0.58 -0.25 0.00 0.00 175.52 175.96 3h2c h VAL 242 N 0.10 1.08 0.01 6.82 2.07 -0.45 0.50 116.25 126.37 3h2c h VAL 242 Ca 0.27 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3h2c h VAL 242 Cb 0.41 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3h2c h VAL 242 CO -0.46 0.10 -0.00 0.00 0.02 0.00 0.00 177.57 177.23 3h2c h LEU 244 N -0.97 0.75 0.00 0.00 5.85 -1.28 0.45 115.31 120.11 3h2c h LEU 244 Ca -0.00 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3h2c h LEU 244 Cb 0.79 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.63 3h2c h LEU 244 CO 0.00 0.60 0.00 0.61 -0.34 0.00 0.00 178.44 179.31 3h2c n GLY 245 N -1.26 -3.07 0.30 3.75 0.00 0.17 -1.70 105.19 103.39 3h2c n GLY 245 Ca 0.06 0.51 0.16 0.00 0.00 0.00 0.00 46.02 46.74 3h2c n GLY 245 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h2c h ILE 246 N 0.00 0.49 0.00 -0.61 2.04 0.39 -2.13 117.51 117.68 3h2c h ILE 246 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3h2c h ILE 246 Cb 0.00 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3h2c h ILE 246 CO 0.00 0.00 -0.69 -0.08 0.00 0.00 0.00 178.15 177.38 3h2c h GLU 247 N 0.00 0.00 -0.92 2.37 4.22 0.08 0.19 114.58 120.52 3h2c h GLU 247 Ca 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.37 3h2c h GLU 247 Cb 0.01 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 3h2c h GLU 247 CO -0.00 0.00 0.09 1.63 -2.18 0.00 0.00 179.01 178.55 3h2c n LYS 248 N -2.54 1.96 -3.15 1.92 5.02 -0.69 -4.95 118.16 115.73 3h2c n LYS 248 Ca 0.02 -1.04 -0.15 0.00 -2.02 0.00 0.00 58.31 55.13 3h2c n LYS 248 Cb 0.51 -1.61 0.06 0.00 -0.02 0.00 0.00 35.03 33.96 3h2c n LYS 248 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h2c n GLY 249 N 0.11 -0.09 3.97 0.72 0.00 0.66 -4.33 105.19 106.22 3h2c n GLY 249 Ca 0.14 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 3h2c n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h2c n GLU 251 N -1.56 0.64 -4.27 0.00 4.71 0.21 -4.75 120.64 115.62 3h2c n GLU 251 Ca -0.02 0.18 -0.23 0.00 -0.01 0.00 0.00 57.16 57.08 3h2c n GLU 251 Cb 0.58 -1.52 -0.07 0.00 -1.01 0.00 0.00 31.44 29.42 3h2c n GLU 251 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 3h2c s PHE 252 N -2.52 2.74 -0.01 -0.32 0.40 -0.99 -2.82 117.98 114.47 3h2c s PHE 252 Ca -0.35 -0.21 0.08 0.00 -0.60 0.00 0.00 56.93 55.85 3h2c s PHE 252 Cb 0.10 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.39 3h2c s PHE 252 CO 0.58 0.61 -0.25 0.14 0.70 0.00 0.00 175.22 177.00 3h2c s VAL 253 N -2.30 1.98 -0.29 -0.44 -7.23 -1.07 -1.54 120.40 109.52 3h2c s VAL 253 Ca 0.32 -1.12 -0.08 0.00 -1.81 0.00 0.00 61.98 59.29 3h2c s VAL 253 Cb -0.07 -1.65 -0.00 0.00 0.56 0.00 0.00 36.38 35.22 3h2c s VAL 253 CO 0.20 0.51 0.10 -0.60 -0.31 0.00 0.00 175.10 175.01 3h2c s ARG 254 N -0.71 3.23 0.07 4.82 3.52 -0.35 -0.53 118.95 129.01 3h2c s ARG 254 Ca 0.10 -0.77 -0.05 0.00 -0.13 0.00 0.00 55.73 54.88 3h2c s ARG 254 Cb -0.10 -3.42 -0.02 0.00 -1.56 0.00 0.00 34.95 29.86 3h2c s ARG 254 CO -0.00 -0.40 0.09 0.14 -0.81 0.00 0.00 175.30 174.31 3h2c s VAL 255 N 1.55 0.18 -0.18 7.11 -7.23 0.48 -4.05 120.40 118.26 3h2c s VAL 255 Ca 0.04 -1.47 -0.21 0.00 -1.81 0.00 0.00 61.98 58.52 3h2c s VAL 255 Cb -0.17 -1.42 -0.21 0.00 0.56 0.00 0.00 36.38 35.14 3h2c s VAL 255 CO 0.04 -0.81 0.34 0.45 -0.31 0.00 0.00 175.10 174.80 3h2c h HIS 256 N 2.94 0.08 -2.23 2.82 3.86 -1.89 -1.07 115.15 119.65 3h2c h HIS 256 Ca -0.34 -0.06 -0.76 0.00 -1.16 0.00 0.00 60.37 58.06 3h2c h HIS 256 Cb 1.17 -0.00 -0.19 0.00 1.06 0.00 0.00 27.41 29.44 3h2c h HIS 256 CO 0.47 1.45 1.35 -0.40 0.86 0.00 0.00 177.93 181.67 3h2c n ASP 257 N -4.34 5.33 -0.04 2.45 5.68 -1.26 -4.74 116.55 119.62 3h2c n ASP 257 Ca -0.28 -3.06 -0.11 0.00 -0.50 0.00 0.00 54.79 50.84 3h2c n ASP 257 Cb 0.70 -1.50 -0.06 0.00 -1.14 0.00 0.00 41.12 39.13 3h2c n ASP 257 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 3h2c h VAL 258 N 4.17 1.20 -0.94 2.12 2.07 -1.92 -2.42 116.25 120.53 3h2c h VAL 258 Ca 0.31 -0.64 0.15 0.00 0.82 0.00 0.00 66.70 67.34 3h2c h VAL 258 Cb 0.79 1.34 -0.16 0.00 -1.52 0.00 0.00 31.29 31.74 3h2c h VAL 258 CO 1.32 0.19 -0.37 0.50 0.02 0.00 0.00 177.57 179.23 3h2c h LYS 259 N 0.05 -0.02 0.04 1.57 3.64 -1.90 -2.17 116.57 117.77 3h2c h LYS 259 Ca 0.05 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.21 3h2c h LYS 259 Cb 0.26 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3h2c h LYS 259 CO 0.00 -0.01 -1.01 0.93 -2.27 0.00 0.00 179.45 177.09 3h2c h GLU 260 N -0.02 0.16 0.01 1.90 3.07 -1.80 -3.14 114.58 114.76 3h2c h GLU 260 Ca 0.34 -0.23 -0.21 0.00 -0.50 0.00 0.00 59.36 58.77 3h2c h GLU 260 Cb 0.60 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.56 3h2c h GLU 260 CO -0.95 1.04 -1.00 0.52 -1.40 0.00 0.00 179.01 177.22 3h2c h MET 261 N 0.07 0.03 0.00 2.33 2.86 -1.35 -2.73 114.93 116.13 3h2c h MET 261 Ca -0.06 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 3h2c h MET 261 Cb 1.70 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.37 3h2c h MET 261 CO 0.15 1.00 -0.17 0.77 1.06 0.00 0.00 176.91 179.72 3h2c h SER 262 N 0.01 0.00 0.66 1.22 0.02 -1.34 0.21 113.55 114.33 3h2c h SER 262 Ca -0.02 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.66 3h2c h SER 262 Cb 1.74 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.25 3h2c h SER 262 CO 0.13 0.17 -1.43 0.03 -1.14 0.00 0.00 176.83 174.60 3h2c h ARG 263 N 0.00 0.05 0.06 3.45 3.08 -1.54 -2.22 114.38 117.26 3h2c h ARG 263 Ca -0.00 -0.08 -0.27 0.00 0.07 0.00 0.00 59.98 59.70 3h2c h ARG 263 Cb 0.32 0.03 0.02 0.00 0.08 0.00 0.00 29.97 30.43 3h2c h ARG 263 CO 0.02 0.80 -1.08 0.52 -1.07 0.00 0.00 179.97 179.16 3h2c h MET 264 N 0.01 0.64 -0.15 0.04 2.86 -1.03 -2.59 114.93 114.71 3h2c h MET 264 Ca -0.18 -0.76 0.05 0.00 -2.06 0.00 0.00 59.70 56.75 3h2c h MET 264 Cb 1.93 0.23 -0.06 0.00 0.06 0.00 0.00 31.60 33.75 3h2c h MET 264 CO 0.11 1.33 -0.30 0.00 1.06 0.00 0.00 176.91 179.12 3h2c h ALA 265 N 0.33 -0.31 -0.71 6.32 0.00 -0.67 -0.51 119.26 123.71 3h2c h ALA 265 Ca -0.15 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.81 3h2c h ALA 265 Cb 1.75 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 20.08 3h2c h ALA 265 CO 0.21 -0.76 0.46 0.87 0.00 0.00 0.00 179.25 180.03 3h2c h LYS 266 N -0.36 0.89 0.07 0.00 1.57 -1.43 0.13 116.57 117.45 3h2c h LYS 266 Ca 0.10 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 3h2c h LYS 266 Cb 0.52 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 3h2c h LYS 266 CO -0.36 0.59 -0.30 1.98 -0.57 0.00 0.00 179.45 180.79 3h2c h MET 267 N 0.91 -0.48 0.13 3.15 4.05 -1.02 0.31 114.93 121.98 3h2c h MET 267 Ca 0.27 0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.75 3h2c h MET 267 Cb -0.04 0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 30.83 3h2c h MET 267 CO -0.08 -0.32 -0.31 0.52 0.23 0.00 0.00 176.91 176.95 3h2c h MET 268 N -0.49 -0.52 -0.61 0.39 2.86 -0.40 -0.64 114.93 115.52 3h2c h MET 268 Ca 0.04 0.04 0.06 0.00 -2.06 0.00 0.00 59.70 57.77 3h2c h MET 268 Cb 0.55 0.12 -0.08 0.00 0.06 0.00 0.00 31.60 32.25 3h2c h MET 268 CO -0.21 -0.34 -0.39 -0.44 1.06 0.00 0.00 176.91 176.59 3h2c h ASP 269 N -0.54 -1.41 -0.98 1.22 3.45 -0.40 0.86 116.42 118.61 3h2c h ASP 269 Ca 0.03 0.21 0.15 0.00 0.43 0.00 0.00 57.03 57.85 3h2c h ASP 269 Cb 0.56 0.62 -0.16 0.00 -0.56 0.00 0.00 39.33 39.80 3h2c h ASP 269 CO -0.18 -0.17 -0.39 0.00 -1.57 0.00 0.00 179.24 176.93 3h2c h ALA 270 N -0.07 0.13 -0.09 3.45 0.00 -0.24 0.31 119.26 122.76 3h2c h ALA 270 Ca 0.10 0.27 -0.05 0.00 0.00 0.00 0.00 54.91 55.22 3h2c h ALA 270 Cb 0.29 1.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3h2c h ALA 270 CO -0.59 -0.63 -0.16 0.52 0.00 0.00 0.00 179.25 178.38 3h2c h MET 271 N -0.01 0.26 0.00 0.00 2.86 0.19 -2.17 114.93 116.06 3h2c h MET 271 Ca 0.34 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3h2c h MET 271 Cb 0.59 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.27 3h2c h MET 271 CO -0.98 0.75 0.00 0.44 1.06 0.00 0.00 176.91 178.18 3h2c n ILE 272 N -4.58 0.12 -1.73 -1.22 -5.35 0.20 -4.91 119.36 101.88 3h2c n ILE 272 Ca -0.07 0.03 -0.00 0.00 -0.27 0.00 0.00 62.75 62.43 3h2c n ILE 272 Cb 0.38 -0.59 0.00 0.00 -1.74 0.00 0.00 39.64 37.70 3h2c n ILE 272 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h2c n GLY 273 N 0.93 -0.28 0.00 3.28 0.00 0.10 -5.06 105.19 104.16 3h2c n GLY 273 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3h2c n GLY 273 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49