#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hpg s ALA 22 N 0.00 3.35 0.14 4.61 0.00 -1.26 -4.87 121.76 123.74 2hpg s ALA 22 Ca 0.00 0.79 -0.08 0.00 0.00 0.00 0.00 51.96 52.67 2hpg s ALA 22 Cb 0.00 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2hpg s ALA 22 CO 0.00 -0.31 1.41 -0.22 0.00 0.00 0.00 175.76 176.64 2hpg h LYS 23 N 6.03 0.71 -5.75 0.00 3.64 -1.56 -3.43 116.57 116.21 2hpg h LYS 23 Ca -0.43 -0.50 -0.67 0.00 -1.27 0.00 0.00 60.65 57.78 2hpg h LYS 23 Cb 1.21 0.08 -0.25 0.00 -0.41 0.00 0.00 32.23 32.86 2hpg h LYS 23 CO 0.76 1.12 -0.77 0.71 -2.27 0.00 0.00 179.45 179.00 2hpg s TYR 24 N -3.93 2.76 -0.09 1.91 2.02 0.49 -5.04 117.35 115.48 2hpg s TYR 24 Ca -0.09 -0.43 0.02 0.00 -0.37 0.00 0.00 57.07 56.20 2hpg s TYR 24 Cb 0.10 -1.75 0.01 0.00 -0.40 0.00 0.00 41.96 39.92 2hpg s TYR 24 CO 0.87 -0.04 -0.14 0.99 -1.57 0.00 0.00 175.55 175.67 2hpg s THR 25 N -0.12 1.31 -0.15 -0.71 2.01 -1.26 -0.88 115.64 115.84 2hpg s THR 25 Ca -0.01 -0.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.42 2hpg s THR 25 Cb -0.14 -1.20 -0.01 0.00 0.01 0.00 0.00 72.50 71.16 2hpg s THR 25 CO 0.03 0.40 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.03 2hpg s LEU 26 N 0.85 2.74 -0.34 4.42 2.96 -0.25 -4.81 118.68 124.26 2hpg s LEU 26 Ca -0.10 -0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 2hpg s LEU 26 Cb -0.15 -1.64 0.00 0.00 0.50 0.00 0.00 46.19 44.90 2hpg s LEU 26 CO 0.01 0.12 0.18 -0.13 -1.32 0.00 0.00 176.35 175.22 2hpg s ARG 27 N 0.62 3.20 -0.15 1.98 0.52 -0.97 -0.82 118.95 123.33 2hpg s ARG 27 Ca -0.07 -0.82 -0.06 0.00 -0.52 0.00 0.00 55.73 54.26 2hpg s ARG 27 Cb -0.15 -3.66 -0.04 0.00 0.52 0.00 0.00 34.95 31.62 2hpg s ARG 27 CO 0.03 -0.51 0.04 0.12 0.02 0.00 0.00 175.30 175.00 2hpg s PHE 28 N 1.61 3.23 0.45 -0.53 5.36 0.06 -1.27 117.98 126.89 2hpg s PHE 28 Ca 0.04 0.09 0.03 0.00 -0.96 0.00 0.00 56.93 56.12 2hpg s PHE 28 Cb -0.18 -1.98 -0.02 0.00 -0.34 0.00 0.00 43.02 40.50 2hpg s PHE 28 CO 0.07 0.25 0.07 0.20 -1.46 0.00 0.00 175.22 174.35 2hpg s GLY 29 N -0.04 2.77 -1.34 13.12 0.00 0.36 -1.09 107.32 121.09 2hpg s GLY 29 Ca 0.05 -0.93 -0.08 0.00 0.00 0.00 0.00 44.72 43.76 2hpg s GLY 29 CO 0.01 -2.00 1.15 1.42 0.00 0.00 0.00 173.10 173.69 2hpg n HIS 30 N -1.06 -2.77 0.03 1.90 8.25 -1.11 -2.01 115.22 118.45 2hpg n HIS 30 Ca -0.11 1.00 -0.01 0.00 -0.26 0.00 0.00 57.72 58.34 2hpg n HIS 30 Cb 0.66 -5.01 0.17 0.00 1.12 0.00 0.00 29.99 26.93 2hpg n HIS 30 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2hpg n VAL 31 N -4.88 1.55 -4.50 1.59 0.24 -1.16 -4.38 118.33 106.79 2hpg n VAL 31 Ca -0.03 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.52 2hpg n VAL 31 Cb 0.57 -0.49 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 2hpg n VAL 31 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2hpg n LEU 32 N 0.14 0.00 -4.78 1.34 4.77 -1.26 -3.57 117.00 113.63 2hpg n LEU 32 Ca 0.18 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.80 2hpg n LEU 32 Cb 0.81 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.86 2hpg n LEU 32 CO 0.20 -0.22 0.73 0.00 -1.33 0.00 0.00 177.39 176.76 2hpg s ALA 33 N -1.50 3.05 0.26 -1.18 0.00 -1.26 -0.19 121.76 120.95 2hpg s ALA 33 Ca 0.00 0.68 -0.30 0.00 0.00 0.00 0.00 51.96 52.34 2hpg s ALA 33 Cb 0.00 -3.27 -0.11 0.00 0.00 0.00 0.00 23.12 19.74 2hpg s ALA 33 CO 0.00 -0.22 1.55 -2.14 0.00 0.00 0.00 175.76 174.95 2hpg s PRO 34 N -2.62 4.18 0.00 0.00 0.02 -1.26 -2.46 135.00 132.85 2hpg s PRO 34 Ca 0.59 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.09 2hpg s PRO 34 Cb -0.21 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.25 2hpg s PRO 34 CO 0.26 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.77 2hpg n GLY 35 N 2.45 1.49 3.94 0.52 0.00 -1.26 -5.03 105.19 107.30 2hpg n GLY 35 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 2hpg n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hpg s GLU 36 N -0.04 2.18 0.29 1.61 0.41 -1.03 -4.76 118.70 117.37 2hpg s GLU 36 Ca 0.00 -0.44 0.03 0.00 -0.41 0.00 0.00 54.97 54.14 2hpg s GLU 36 Cb 0.00 -2.24 0.63 0.00 -1.78 0.00 0.00 34.13 30.73 2hpg s GLU 36 CO 0.00 -1.17 1.79 -1.35 -0.49 0.00 0.00 175.26 174.04 2hpg h PRO 37 N -0.48 0.80 -0.06 0.39 0.11 -1.96 -1.29 132.00 129.51 2hpg h PRO 37 Ca -0.43 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2hpg h PRO 37 Cb 1.31 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2hpg h PRO 37 CO 0.56 0.53 0.04 1.88 -0.21 0.00 0.00 178.00 180.79 2hpg h TYR 38 N 0.82 0.08 -0.43 0.65 -1.99 -1.91 -0.83 116.97 113.37 2hpg h TYR 38 Ca 0.53 -0.00 0.06 0.00 2.00 0.00 0.00 58.73 61.32 2hpg h TYR 38 Cb 0.70 -0.03 -0.05 0.00 2.00 0.00 0.00 36.73 39.35 2hpg h TYR 38 CO -0.02 0.11 0.12 1.25 -0.00 0.00 0.00 178.16 179.62 2hpg h HIS 39 N 0.03 0.21 -0.78 4.88 2.76 -1.37 0.48 115.15 121.36 2hpg h HIS 39 Ca 0.02 0.02 0.08 0.00 -2.20 0.00 0.00 60.37 58.30 2hpg h HIS 39 Cb 0.05 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 28.92 2hpg h HIS 39 CO -0.05 0.06 0.45 1.96 -1.30 0.00 0.00 177.93 179.04 2hpg h GLN 40 N 0.27 0.75 -0.30 5.26 4.20 -1.06 -1.11 115.11 123.12 2hpg h GLN 40 Ca 0.20 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.71 2hpg h GLN 40 Cb 0.22 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2hpg h GLN 40 CO -0.23 0.50 -0.45 0.00 -0.67 0.00 0.00 178.83 177.98 2hpg h ALA 41 N 1.42 0.64 -0.59 3.87 0.00 -0.08 -2.12 119.26 122.40 2hpg h ALA 41 Ca 0.36 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2hpg h ALA 41 Cb 0.29 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2hpg h ALA 41 CO -0.22 0.67 0.12 0.74 0.00 0.00 0.00 179.25 180.57 2hpg h PHE 42 N 0.62 0.97 -0.71 0.00 0.04 -0.49 -1.07 116.94 116.29 2hpg h PHE 42 Ca 0.04 -0.10 -0.07 0.00 2.80 0.00 0.00 57.97 60.64 2hpg h PHE 42 Cb 1.01 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.86 2hpg h PHE 42 CO 0.06 0.81 0.19 -0.07 -0.60 0.00 0.00 178.31 178.69 2hpg h LEU 43 N 0.88 1.05 -0.13 1.54 3.38 -1.04 0.13 115.31 121.12 2hpg h LEU 43 Ca 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2hpg h LEU 43 Cb 0.35 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2hpg h LEU 43 CO 0.00 1.00 0.06 0.11 0.09 0.00 0.00 178.44 179.70 2hpg h LYS 44 N 1.06 0.19 -0.17 1.13 1.57 -1.20 -1.45 116.57 117.69 2hpg h LYS 44 Ca 0.22 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 59.01 2hpg h LYS 44 Cb 0.35 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 2hpg h LYS 44 CO -0.00 0.26 -0.07 2.35 -0.57 0.00 0.00 179.45 181.41 2hpg h TRP 45 N 0.07 -0.17 -0.89 -1.35 7.01 -1.03 -0.01 115.95 119.57 2hpg h TRP 45 Ca 0.04 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.13 2hpg h TRP 45 Cb 0.14 0.10 -0.07 0.00 -2.10 0.00 0.00 29.16 27.23 2hpg h TRP 45 CO -0.02 -0.12 0.56 0.00 -2.79 0.00 0.00 178.44 176.06 2hpg h ALA 46 N 1.10 1.24 -0.17 2.65 0.00 -0.66 -0.92 119.26 122.51 2hpg h ALA 46 Ca 0.09 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 2hpg h ALA 46 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2hpg h ALA 46 CO -0.21 0.29 -0.57 -0.22 0.00 0.00 0.00 179.25 178.54 2hpg h LYS 47 N 1.00 0.54 -0.23 0.00 3.64 -0.91 -2.05 116.57 118.57 2hpg h LYS 47 Ca 0.40 -0.35 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2hpg h LYS 47 Cb 0.21 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2hpg h LYS 47 CO -0.19 0.97 0.05 0.00 -2.27 0.00 0.00 179.45 178.01 2hpg h ALA 48 N 0.96 0.30 -0.39 5.00 0.00 -0.35 -2.07 119.26 122.70 2hpg h ALA 48 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2hpg h ALA 48 Cb 1.12 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2hpg h ALA 48 CO 0.11 -0.05 0.26 0.28 0.00 0.00 0.00 179.25 179.84 2hpg h VAL 49 N 0.18 1.11 -0.84 0.00 2.07 -1.19 -1.21 116.25 116.36 2hpg h VAL 49 Ca 0.07 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.41 2hpg h VAL 49 Cb 0.28 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 2hpg h VAL 49 CO 0.00 0.10 0.56 -0.33 0.02 0.00 0.00 177.57 177.92 2hpg h GLU 50 N 0.53 1.06 -0.18 1.57 5.08 -1.31 -0.65 114.58 120.68 2hpg h GLU 50 Ca 0.14 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 2hpg h GLU 50 Cb -0.05 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 28.96 2hpg h GLU 50 CO -0.03 0.70 -0.10 1.49 -1.00 0.00 0.00 179.01 180.07 2hpg h GLU 51 N 1.09 0.38 0.00 2.33 4.81 -1.04 0.72 114.58 122.86 2hpg h GLU 51 Ca 0.32 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2hpg h GLU 51 Cb -0.04 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 2hpg h GLU 51 CO -0.08 0.69 -0.05 0.87 -0.73 0.00 0.00 179.01 179.71 2hpg h LYS 52 N 0.05 0.00 -0.71 1.92 1.79 -0.93 -2.87 116.57 115.82 2hpg h LYS 52 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2hpg h LYS 52 Cb 0.59 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 2hpg h LYS 52 CO 0.03 0.05 0.00 0.25 -1.08 0.00 0.00 179.45 178.70 2hpg n THR 53 N -3.13 1.30 -4.14 -0.16 -2.24 -0.28 -4.96 114.28 100.67 2hpg n THR 53 Ca 0.02 -1.06 -0.33 0.00 -2.27 0.00 0.00 64.05 60.42 2hpg n THR 53 Cb 0.46 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 2hpg n THR 53 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2hpg n ASN 54 N 1.47 -2.31 0.00 3.42 4.13 -1.09 -1.44 115.26 119.44 2hpg n ASN 54 Ca 0.25 -1.02 0.00 0.00 1.68 0.00 0.00 54.58 55.50 2hpg n ASN 54 Cb 0.72 -2.82 0.00 0.00 -1.54 0.00 0.00 39.78 36.14 2hpg n ASN 54 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2hpg n GLY 55 N -1.63 0.96 0.18 7.41 0.00 0.23 -4.91 105.19 107.43 2hpg n GLY 55 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.98 2hpg n GLY 55 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2hpg h ASP 56 N 0.00 0.03 -3.79 1.61 3.32 -1.50 -3.35 116.42 112.74 2hpg h ASP 56 Ca 0.00 -0.01 -0.68 0.00 0.02 0.00 0.00 57.03 56.36 2hpg h ASP 56 Cb 0.00 -0.01 -0.35 0.00 0.22 0.00 0.00 39.33 39.19 2hpg h ASP 56 CO 0.00 0.46 -0.74 -0.69 -1.72 0.00 0.00 179.24 176.56 2hpg s VAL 57 N -4.06 2.61 -0.23 -1.35 1.01 -1.26 -0.38 120.40 116.75 2hpg s VAL 57 Ca -0.03 -1.58 -0.10 0.00 0.00 0.00 0.00 61.98 60.27 2hpg s VAL 57 Cb 0.14 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 2hpg s VAL 57 CO 0.74 -0.13 0.14 -0.60 0.00 0.00 0.00 175.10 175.25 2hpg s ARG 58 N 1.16 4.02 -0.21 2.72 3.52 -0.06 -3.96 118.95 126.15 2hpg s ARG 58 Ca -0.05 -0.30 -0.04 0.00 -0.13 0.00 0.00 55.73 55.22 2hpg s ARG 58 Cb -0.20 -3.48 -0.01 0.00 -1.56 0.00 0.00 34.95 29.70 2hpg s ARG 58 CO -0.03 0.06 -0.04 0.42 -0.81 0.00 0.00 175.30 174.90 2hpg s ILE 59 N 1.02 3.42 -0.19 4.11 1.01 -1.26 -1.09 121.20 128.23 2hpg s ILE 59 Ca 0.07 -0.48 -0.04 0.00 0.00 0.00 0.00 60.65 60.19 2hpg s ILE 59 Cb -0.14 -2.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.77 2hpg s ILE 59 CO 0.04 0.43 -0.02 -0.70 0.00 0.00 0.00 174.94 174.70 2hpg s GLU 60 N 1.31 3.61 -0.17 2.79 2.12 0.00 -4.90 118.70 123.45 2hpg s GLU 60 Ca 0.04 -0.53 -0.05 0.00 0.36 0.00 0.00 54.97 54.78 2hpg s GLU 60 Cb -0.14 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.20 2hpg s GLU 60 CO -0.02 0.06 0.00 0.08 -0.54 0.00 0.00 175.26 174.84 2hpg s VAL 61 N 0.85 4.19 -0.24 3.70 1.01 -1.26 -0.76 120.40 127.88 2hpg s VAL 61 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 2hpg s VAL 61 Cb -0.14 -2.86 0.03 0.00 0.00 0.00 0.00 36.38 33.40 2hpg s VAL 61 CO 0.02 0.47 -0.08 -0.36 0.00 0.00 0.00 175.10 175.15 2hpg s PHE 62 N 0.47 3.06 0.97 5.22 0.08 -0.25 -4.98 117.98 122.54 2hpg s PHE 62 Ca -0.01 -1.64 -0.12 0.00 0.12 0.00 0.00 56.93 55.28 2hpg s PHE 62 Cb -0.14 -2.03 0.13 0.00 -0.57 0.00 0.00 43.02 40.41 2hpg s PHE 62 CO 0.02 -0.75 0.83 -2.30 -0.10 0.00 0.00 175.22 172.92 2hpg n PRO 63 N 4.64 -0.70 -2.30 0.24 -0.02 -1.26 -2.77 135.00 132.83 2hpg n PRO 63 Ca -0.17 -0.15 -0.39 0.00 -2.02 0.00 0.00 63.50 60.77 2hpg n PRO 63 Cb 0.47 -2.15 -0.02 0.00 -0.02 0.00 0.00 33.50 31.78 2hpg n PRO 63 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2hpg s SER 64 N -2.37 6.70 0.50 2.55 0.01 0.73 -4.45 113.70 117.38 2hpg s SER 64 Ca 0.63 2.39 -0.20 0.00 1.31 0.00 0.00 55.95 60.08 2hpg s SER 64 Cb -0.22 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.31 2hpg s SER 64 CO 0.62 -0.56 1.08 -0.55 0.41 0.00 0.00 173.24 174.25 2hpg s SER 65 N -0.98 6.11 0.00 2.44 0.15 -1.26 -4.76 113.70 115.40 2hpg s SER 65 Ca 0.53 2.05 0.13 0.00 0.70 0.00 0.00 55.95 59.36 2hpg s SER 65 Cb -0.32 -2.57 0.59 0.00 -1.71 0.00 0.00 66.02 62.01 2hpg s SER 65 CO 0.41 -0.95 1.40 0.00 1.20 0.00 0.00 173.24 175.31 2hpg n GLN 66 N -1.04 0.05 0.00 5.44 0.00 -1.26 -4.59 117.38 115.99 2hpg n GLN 66 Ca 0.10 0.24 0.00 0.00 0.00 0.00 0.00 57.00 57.34 2hpg n GLN 66 Cb 0.52 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.26 2hpg n GLN 66 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.06 178.53 2hpg n LEU 67 N -1.44 0.00 -4.62 2.61 -0.00 -1.26 -4.69 117.00 107.60 2hpg n LEU 67 Ca 0.04 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.63 2hpg n LEU 67 Cb 0.14 0.18 0.00 0.00 -0.00 0.00 0.00 43.42 43.74 2hpg n LEU 67 CO 0.12 -0.18 0.62 0.61 -0.00 0.00 0.00 177.39 178.56 2hpg n GLY 68 N -1.32 -0.12 3.64 1.47 0.00 -1.26 -4.95 105.19 102.65 2hpg n GLY 68 Ca 0.00 0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 2hpg n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hpg s VAL 69 N -1.20 4.99 0.00 1.61 0.11 -1.26 -4.91 120.40 119.74 2hpg s VAL 69 Ca 0.61 1.18 0.00 0.00 -2.93 0.00 0.00 61.98 60.84 2hpg s VAL 69 Cb -0.59 -3.95 0.00 0.00 -1.53 0.00 0.00 36.38 30.31 2hpg s VAL 69 CO 0.58 0.05 0.00 -0.62 -3.33 0.00 0.00 175.10 171.79 2hpg n GLU 70 N 5.48 0.00 -1.12 1.54 4.71 -1.26 -5.10 120.64 124.90 2hpg n GLU 70 Ca -0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.26 2hpg n GLU 70 Cb 0.49 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.85 2hpg n GLU 70 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2hpg n GLU 71 N 0.00 -2.63 -0.93 3.49 1.02 -1.26 -5.10 120.64 115.24 2hpg n GLU 71 Ca 0.00 2.14 0.00 0.00 -0.02 0.00 0.00 57.16 59.28 2hpg n GLU 71 Cb 0.00 -3.00 0.00 0.00 -0.02 0.00 0.00 31.44 28.42 2hpg n GLU 71 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2hpg n ASP 72 N -3.64 0.57 -2.77 1.62 -0.08 -1.26 -4.99 116.55 106.00 2hpg n ASP 72 Ca -0.07 -0.72 -0.15 0.00 -1.51 0.00 0.00 54.79 52.35 2hpg n ASP 72 Cb 0.51 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.92 2hpg n ASP 72 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 2hpg n ILE 73 N -0.51 1.99 -2.73 5.18 2.08 -1.26 -4.24 119.36 119.86 2hpg n ILE 73 Ca 0.00 -1.12 -0.09 0.00 0.56 0.00 0.00 62.75 62.10 2hpg n ILE 73 Cb 0.00 -1.95 0.08 0.00 -0.75 0.00 0.00 39.64 37.02 2hpg n ILE 73 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 2hpg n ILE 74 N 3.62 0.00 -0.90 1.39 -5.35 -1.26 -4.78 119.36 112.08 2hpg n ILE 74 Ca 0.34 -1.50 -0.16 0.00 -0.27 0.00 0.00 62.75 61.16 2hpg n ILE 74 Cb 0.27 1.50 0.03 0.00 -1.74 0.00 0.00 39.64 39.70 2hpg n ILE 74 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2hpg n GLU 75 N 0.59 1.78 -3.23 6.28 4.71 -1.26 -5.06 120.64 124.46 2hpg n GLU 75 Ca 0.07 -1.49 -0.01 0.00 -0.01 0.00 0.00 57.16 55.71 2hpg n GLU 75 Cb 0.69 -1.60 -0.04 0.00 -1.01 0.00 0.00 31.44 29.48 2hpg n GLU 75 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2hpg s GLN 76 N -1.67 0.48 -0.77 3.49 -0.21 -1.26 -1.47 119.66 118.25 2hpg s GLN 76 Ca 0.31 0.73 0.03 0.00 0.02 0.00 0.00 55.36 56.44 2hpg s GLN 76 Cb 0.23 0.11 0.30 0.00 1.00 0.00 0.00 33.01 34.66 2hpg s GLN 76 CO -0.01 -0.71 1.15 0.41 -2.12 0.00 0.00 175.29 174.00 2hpg n GLY 80 N 5.40 5.41 3.80 3.09 0.00 -1.26 -5.13 105.19 116.49 2hpg n GLY 80 Ca -0.01 -2.73 -0.34 0.00 0.00 0.00 0.00 46.02 42.95 2hpg n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpg s ALA 81 N -3.23 2.81 -1.46 4.61 0.00 -0.54 -4.31 121.76 119.63 2hpg s ALA 81 Ca 0.41 0.55 -0.11 0.00 0.00 0.00 0.00 51.96 52.81 2hpg s ALA 81 Cb 0.19 -3.26 0.04 0.00 0.00 0.00 0.00 23.12 20.09 2hpg s ALA 81 CO -0.06 -0.54 2.37 -0.35 0.00 0.00 0.00 175.76 177.18 2hpg n PRO 82 N -1.39 3.37 -4.35 0.00 -0.04 -1.26 -4.47 135.00 126.86 2hpg n PRO 82 Ca 0.09 -2.75 -0.20 0.00 -0.04 0.00 0.00 63.50 60.60 2hpg n PRO 82 Cb 0.52 -3.04 -0.13 0.00 -0.04 0.00 0.00 33.50 30.82 2hpg n PRO 82 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2hpg s VAL 83 N 2.01 1.12 0.17 0.52 1.01 -1.26 -2.28 120.40 121.69 2hpg s VAL 83 Ca 0.52 -1.01 0.07 0.00 0.00 0.00 0.00 61.98 61.56 2hpg s VAL 83 Cb 0.15 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 2hpg s VAL 83 CO -0.07 -0.00 -0.14 -0.83 0.00 0.00 0.00 175.10 174.06 2hpg s GLY 84 N -1.16 1.29 -0.06 4.51 0.00 -0.40 -3.54 107.32 107.96 2hpg s GLY 84 Ca 0.01 -1.53 -0.05 0.00 0.00 0.00 0.00 44.72 43.16 2hpg s GLY 84 CO 0.01 -1.61 0.15 -0.98 0.00 0.00 0.00 173.10 170.68 2hpg s TRP 85 N -2.71 -0.17 -0.51 1.90 0.52 -0.45 -0.49 118.94 117.03 2hpg s TRP 85 Ca 0.18 0.42 -0.23 0.00 0.02 0.00 0.00 56.10 56.48 2hpg s TRP 85 Cb -0.02 0.04 0.04 0.00 -1.15 0.00 0.00 33.47 32.38 2hpg s TRP 85 CO 0.05 -0.09 0.85 1.21 0.02 0.00 0.00 176.95 178.98 2hpg s ASN 86 N 0.25 6.35 0.00 2.95 2.47 -0.85 -1.32 114.94 124.79 2hpg s ASN 86 Ca -0.01 -0.34 0.00 0.00 0.42 0.00 0.00 52.86 52.93 2hpg s ASN 86 Cb -0.03 -2.40 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 2hpg s ASN 86 CO -0.01 -1.08 0.00 1.07 -3.72 0.00 0.00 177.10 173.36 2hpg n THR 87 N 6.11 0.00 -4.13 -5.21 5.66 0.11 -4.86 114.28 111.96 2hpg n THR 87 Ca 0.01 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.87 2hpg n THR 87 Cb 0.47 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.19 2hpg n THR 87 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 2hpg s ASP 88 N 0.87 0.78 0.24 1.09 1.47 -1.26 -0.21 116.67 119.65 2hpg s ASP 88 Ca 0.00 -1.44 0.26 0.00 1.18 0.00 0.00 52.55 52.55 2hpg s ASP 88 Cb 0.00 0.58 0.80 0.00 -0.34 0.00 0.00 42.92 43.95 2hpg s ASP 88 CO 0.00 -1.14 1.76 0.77 0.68 0.00 0.00 175.17 177.23 2hpg h SER 89 N 2.23 0.00 -0.20 2.11 4.64 -1.88 -2.51 113.55 117.94 2hpg h SER 89 Ca -0.29 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.01 2hpg h SER 89 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 2hpg h SER 89 CO 0.40 0.00 0.06 0.00 -0.87 0.00 0.00 176.83 176.42 2hpg h ALA 90 N 2.44 1.58 0.13 5.18 0.00 -1.89 0.24 119.26 126.94 2hpg h ALA 90 Ca 0.00 -0.12 -0.22 0.00 0.00 0.00 0.00 54.91 54.57 2hpg h ALA 90 Cb 0.72 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.40 2hpg h ALA 90 CO 0.00 0.31 -1.02 -0.09 0.00 0.00 0.00 179.25 178.45 2hpg h ARG 91 N 0.39 0.27 -0.02 0.00 9.65 -1.93 -3.34 114.38 119.39 2hpg h ARG 91 Ca 0.09 -0.46 -0.09 0.00 -1.10 0.00 0.00 59.98 58.43 2hpg h ARG 91 Cb 0.18 0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.91 2hpg h ARG 91 CO -0.00 1.22 -0.40 -0.07 2.80 0.00 0.00 179.97 183.52 2hpg h LEU 92 N -0.37 0.05 -5.05 3.80 3.38 -1.37 -3.36 115.31 112.39 2hpg h LEU 92 Ca -0.20 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 2hpg h LEU 92 Cb 1.67 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.40 2hpg h LEU 92 CO 0.11 0.45 0.54 0.61 0.09 0.00 0.00 178.44 180.23 2hpg n GLY 93 N -0.34 1.29 0.00 0.83 0.00 0.84 -1.65 105.19 106.16 2hpg n GLY 93 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2hpg n GLY 93 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2hpg n TYR 95 N 3.22 0.00 -3.56 1.61 4.01 -1.26 -3.34 117.16 117.85 2hpg n TYR 95 Ca 0.05 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.38 2hpg n TYR 95 Cb 0.08 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.03 2hpg n TYR 95 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2hpg s VAL 96 N 0.00 4.28 0.27 -0.72 1.01 -0.66 -4.99 120.40 119.60 2hpg s VAL 96 Ca 0.00 -2.05 -0.03 0.00 0.00 0.00 0.00 61.98 59.90 2hpg s VAL 96 Cb 0.00 -3.79 0.34 0.00 0.00 0.00 0.00 36.38 32.93 2hpg s VAL 96 CO 0.00 -0.82 1.61 0.50 0.00 0.00 0.00 175.10 176.39 2hpg h LYS 97 N 8.15 0.07 -0.10 2.72 3.64 -1.81 -2.52 116.57 126.72 2hpg h LYS 97 Ca -0.14 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 2hpg h LYS 97 Cb 1.05 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 2hpg h LYS 97 CO 0.82 0.05 -0.25 -0.44 -2.27 0.00 0.00 179.45 177.36 2hpg h ASP 98 N 0.07 0.18 0.64 4.20 3.32 -1.93 -2.54 116.42 120.36 2hpg h ASP 98 Ca 0.50 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.50 2hpg h ASP 98 Cb 0.95 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.45 2hpg h ASP 98 CO -0.78 0.44 0.00 -0.29 -1.72 0.00 0.00 179.24 176.89 2hpg h ILE 99 N 0.16 0.00 0.00 0.35 2.10 -1.80 -2.37 117.51 115.95 2hpg h ILE 99 Ca 0.03 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.68 2hpg h ILE 99 Cb 0.55 1.14 0.00 0.00 -1.09 0.00 0.00 36.82 37.41 2hpg h ILE 99 CO 0.04 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.72 2hpg n GLY 100 N -0.32 -1.09 2.25 8.18 0.00 -0.96 -4.60 105.19 108.65 2hpg n GLY 100 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2hpg n GLY 100 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2hpg n VAL 101 N -1.49 0.00 0.00 1.61 3.14 -0.90 -3.70 118.33 117.00 2hpg n VAL 101 Ca 0.05 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 2hpg n VAL 101 Cb 0.20 -0.94 0.00 0.00 -1.06 0.00 0.00 33.84 32.04 2hpg n VAL 101 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2hpg n ASN 103 N 2.19 0.00 -4.91 6.55 4.05 -1.26 -4.80 115.26 117.07 2hpg n ASN 103 Ca 0.00 0.00 -0.28 0.00 0.45 0.00 0.00 54.58 54.75 2hpg n ASN 103 Cb 0.00 0.00 -0.02 0.00 1.23 0.00 0.00 39.78 40.99 2hpg n ASN 103 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2hpg s LEU 104 N 0.00 3.87 0.26 1.20 1.02 -1.24 -4.53 118.68 119.25 2hpg s LEU 104 Ca 0.00 0.82 -0.31 0.00 0.02 0.00 0.00 54.13 54.66 2hpg s LEU 104 Cb 0.00 -3.70 -0.13 0.00 0.02 0.00 0.00 46.19 42.39 2hpg s LEU 104 CO 0.00 -0.37 1.50 0.00 0.02 0.00 0.00 176.35 177.50 2hpg n ALA 105 N -1.57 1.80 -1.24 4.21 0.00 -1.26 -2.54 120.51 119.91 2hpg n ALA 105 Ca -0.01 0.39 -0.08 0.00 0.00 0.00 0.00 53.44 53.74 2hpg n ALA 105 Cb 0.55 -2.37 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 2hpg n ALA 105 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2hpg n TYR 106 N 2.09 0.00 -0.18 0.00 4.02 0.73 -4.91 117.16 118.92 2hpg n TYR 106 Ca 0.10 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.95 2hpg n TYR 106 Cb 0.34 -2.21 0.02 0.00 -0.02 0.00 0.00 39.34 37.46 2hpg n TYR 106 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 2hpg h PHE 107 N 0.00 -0.75 0.00 -0.72 3.57 -1.76 0.31 116.94 117.59 2hpg h PHE 107 Ca -0.17 0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.30 2hpg h PHE 107 Cb 0.93 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 2hpg h PHE 107 CO 0.48 -0.35 -0.43 0.97 -2.23 0.00 0.00 178.31 176.74 2hpg h ILE 108 N -0.15 1.19 -0.38 1.41 6.09 -1.91 -1.88 117.51 121.89 2hpg h ILE 108 Ca 0.23 -1.55 -0.16 0.00 -1.37 0.00 0.00 64.86 62.02 2hpg h ILE 108 Cb 0.52 1.86 -0.01 0.00 0.47 0.00 0.00 36.82 39.67 2hpg h ILE 108 CO -0.63 0.42 -0.39 0.44 -3.07 0.00 0.00 178.15 174.93 2hpg h ASP 109 N 0.00 1.01 0.00 2.19 3.32 -1.44 -2.22 116.42 119.28 2hpg h ASP 109 Ca -0.00 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2hpg h ASP 109 Cb 0.83 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2hpg h ASP 109 CO 0.06 1.27 0.00 0.49 -1.72 0.00 0.00 179.24 179.33 2hpg n PHE 110 N -4.06 0.00 -1.53 4.55 3.72 -0.02 -4.31 117.46 115.81 2hpg n PHE 110 Ca -0.02 -0.26 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 2hpg n PHE 110 Cb 0.55 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 2hpg n PHE 110 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2hpg n GLY 112 N 1.84 -0.38 3.71 1.37 0.00 -1.00 -4.99 105.19 105.74 2hpg n GLY 112 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2hpg n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpg s ALA 113 N 0.00 3.19 0.00 4.61 0.00 -0.87 -4.92 121.76 123.77 2hpg s ALA 113 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2hpg s ALA 113 Cb 0.00 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.83 2hpg s ALA 113 CO 0.00 -0.20 0.22 1.63 0.00 0.00 0.00 175.76 177.41 2hpg n LYS 114 N 3.82 3.20 -4.24 0.00 4.76 -1.26 -4.38 118.16 120.06 2hpg n LYS 114 Ca 0.05 -0.22 -0.14 0.00 -2.87 0.00 0.00 58.31 55.13 2hpg n LYS 114 Cb 0.51 -0.71 -0.10 0.00 -1.84 0.00 0.00 35.03 32.89 2hpg n LYS 114 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2hpg s THR 115 N -0.52 0.76 0.26 -0.18 -4.23 -1.26 -5.04 115.64 105.44 2hpg s THR 115 Ca 0.00 -1.99 -0.01 0.00 -1.18 0.00 0.00 61.69 58.51 2hpg s THR 115 Cb 0.00 -2.07 0.25 0.00 1.34 0.00 0.00 72.50 72.02 2hpg s THR 115 CO 0.00 -0.52 1.82 -0.65 -0.54 0.00 0.00 174.62 174.73 2hpg h PRO 116 N 2.71 0.86 -0.58 3.99 0.11 -1.99 0.21 132.00 137.31 2hpg h PRO 116 Ca -0.37 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.60 2hpg h PRO 116 Cb 1.20 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 2hpg h PRO 116 CO 0.63 0.57 -0.01 0.93 -0.21 0.00 0.00 178.00 179.91 2hpg h GLU 117 N 0.89 1.03 -0.63 1.05 3.07 -1.99 -2.09 114.58 115.90 2hpg h GLU 117 Ca 0.45 -0.33 -0.04 0.00 -0.50 0.00 0.00 59.36 58.94 2hpg h GLU 117 Cb 0.43 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.23 2hpg h GLU 117 CO -0.26 1.02 0.26 0.93 -1.40 0.00 0.00 179.01 179.56 2hpg h GLU 118 N 0.92 0.94 -0.16 2.33 5.08 -1.87 -1.36 114.58 120.47 2hpg h GLU 118 Ca 0.16 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2hpg h GLU 118 Cb 0.56 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 2hpg h GLU 118 CO 0.03 0.79 -0.12 0.00 -1.00 0.00 0.00 179.01 178.71 2hpg h ALA 119 N 1.11 -0.00 -0.65 3.43 0.00 -0.80 0.96 119.26 123.30 2hpg h ALA 119 Ca 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2hpg h ALA 119 Cb 0.20 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2hpg h ALA 119 CO -0.02 -0.56 0.35 0.82 0.00 0.00 0.00 179.25 179.84 2hpg h ILE 120 N -0.13 1.20 -0.34 0.00 1.08 -1.23 -1.79 117.51 116.30 2hpg h ILE 120 Ca 0.10 -0.50 -0.15 0.00 -0.39 0.00 0.00 64.86 63.92 2hpg h ILE 120 Cb 0.28 0.33 -0.01 0.00 -3.07 0.00 0.00 36.82 34.35 2hpg h ILE 120 CO -0.24 0.22 -0.39 -0.08 -0.69 0.00 0.00 178.15 176.97 2hpg h GLU 121 N 0.90 0.81 -0.59 2.37 4.57 -0.77 -1.87 114.58 120.01 2hpg h GLU 121 Ca 0.23 -0.43 0.04 0.00 -1.18 0.00 0.00 59.36 58.02 2hpg h GLU 121 Cb 0.03 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 2hpg h GLU 121 CO -0.04 1.06 0.34 0.28 -1.18 0.00 0.00 179.01 179.47 2hpg h VAL 122 N 0.67 1.01 -0.40 0.32 2.07 -0.35 -2.06 116.25 117.51 2hpg h VAL 122 Ca 0.05 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.28 2hpg h VAL 122 Cb 0.96 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2hpg h VAL 122 CO 0.09 0.12 -0.06 -0.07 0.02 0.00 0.00 177.57 177.67 2hpg h LEU 123 N 0.65 0.64 -0.44 2.57 3.38 -1.07 0.10 115.31 121.14 2hpg h LEU 123 Ca 0.25 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 2hpg h LEU 123 Cb 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2hpg h LEU 123 CO -0.14 0.75 -0.29 0.11 0.09 0.00 0.00 178.44 178.96 2hpg h LYS 124 N 0.62 0.98 -0.36 1.13 1.57 -1.11 -1.19 116.57 118.20 2hpg h LYS 124 Ca 0.12 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.34 2hpg h LYS 124 Cb 0.48 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 2hpg h LYS 124 CO 0.02 1.13 -0.17 0.87 -0.57 0.00 0.00 179.45 180.74 2hpg h LYS 125 N 0.82 0.67 -0.59 3.15 1.57 -1.12 -2.71 116.57 118.36 2hpg h LYS 125 Ca 0.09 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.55 2hpg h LYS 125 Cb 0.88 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2hpg h LYS 125 CO 0.08 0.81 0.06 0.82 -0.57 0.00 0.00 179.45 180.65 2hpg h ILE 126 N 0.60 1.26 -0.13 1.86 2.04 -0.64 -2.52 117.51 119.99 2hpg h ILE 126 Ca 0.10 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.91 2hpg h ILE 126 Cb 0.63 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2hpg h ILE 126 CO 0.04 0.38 0.08 0.50 0.00 0.00 0.00 178.15 179.16 2hpg h LYS 127 N 0.90 0.17 -0.00 2.37 3.64 -1.07 -2.18 116.57 120.39 2hpg h LYS 127 Ca 0.18 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2hpg h LYS 127 Cb 0.47 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2hpg h LYS 127 CO 0.02 0.11 -0.26 1.04 -2.27 0.00 0.00 179.45 178.09 2hpg n GLN 128 N -4.52 0.58 -2.56 1.90 1.13 -1.03 -4.67 117.38 108.22 2hpg n GLN 128 Ca -0.01 -0.31 -0.40 0.00 -1.94 0.00 0.00 57.00 54.34 2hpg n GLN 128 Cb 0.08 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 28.89 2hpg n GLN 128 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2hpg s SER 129 N -2.63 7.37 0.43 1.08 1.04 -0.82 -4.94 113.70 115.23 2hpg s SER 129 Ca 0.22 2.15 0.13 0.00 0.48 0.00 0.00 55.95 58.93 2hpg s SER 129 Cb 0.19 -2.62 0.93 0.00 0.10 0.00 0.00 66.02 64.62 2hpg s SER 129 CO 0.55 -0.07 1.97 1.55 0.98 0.00 0.00 173.24 178.21 2hpg h PRO 130 N 4.13 0.07 -0.34 4.02 0.13 -1.91 -2.20 132.00 135.90 2hpg h PRO 130 Ca -0.46 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2hpg h PRO 130 Cb 1.21 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2hpg h PRO 130 CO 0.68 0.24 0.00 2.41 -0.23 0.00 0.00 178.00 181.10 2hpg n THR 131 N -4.30 0.02 0.00 1.56 -1.04 -1.26 -1.09 114.28 108.16 2hpg n THR 131 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2hpg n THR 131 Cb 0.25 -0.13 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 2hpg n THR 131 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hpg n GLN 133 N 0.47 0.00 -0.02 -2.82 1.13 -0.83 -1.74 117.38 113.57 2hpg n GLN 133 Ca 0.00 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.95 2hpg n GLN 133 Cb 0.05 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.35 2hpg n GLN 133 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2hpg h LYS 134 N 0.00 0.19 -0.74 -1.09 3.64 -1.38 -1.63 116.57 115.55 2hpg h LYS 134 Ca 0.00 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2hpg h LYS 134 Cb 0.00 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2hpg h LYS 134 CO 0.00 0.18 0.40 -1.49 -2.27 0.00 0.00 179.45 176.27 2hpg h TRP 135 N 0.14 1.02 -0.46 1.91 6.55 -1.62 -1.32 115.95 122.18 2hpg h TRP 135 Ca 0.05 -0.03 -0.11 0.00 0.95 0.00 0.00 58.89 59.75 2hpg h TRP 135 Cb 0.04 -0.33 -0.02 0.00 -0.86 0.00 0.00 29.16 28.00 2hpg h TRP 135 CO -0.05 0.72 -0.14 -0.07 -1.05 0.00 0.00 178.44 177.85 2hpg h LEU 136 N 1.02 0.88 -0.52 -4.49 3.38 -1.82 -1.18 115.31 112.58 2hpg h LEU 136 Ca 0.26 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2hpg h LEU 136 Cb 0.04 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2hpg h LEU 136 CO -0.04 1.02 0.22 0.50 0.09 0.00 0.00 178.44 180.22 2hpg h LYS 137 N 0.78 0.77 0.06 1.13 3.64 -1.11 -1.51 116.57 120.33 2hpg h LYS 137 Ca 0.12 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2hpg h LYS 137 Cb 0.67 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.33 2hpg h LYS 137 CO 0.05 0.67 -0.23 0.93 -2.27 0.00 0.00 179.45 178.60 2hpg h GLU 138 N 0.70 -0.38 -0.97 1.90 5.08 -0.97 0.21 114.58 120.15 2hpg h GLU 138 Ca 0.17 0.03 0.21 0.00 -1.00 0.00 0.00 59.36 58.77 2hpg h GLU 138 Cb 0.18 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.41 2hpg h GLU 138 CO -0.02 -0.26 0.55 -0.07 -1.00 0.00 0.00 179.01 178.21 2hpg h LEU 139 N -0.40 0.64 0.11 1.33 3.38 -1.05 0.29 115.31 119.60 2hpg h LEU 139 Ca 0.04 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2hpg h LEU 139 Cb 0.45 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2hpg h LEU 139 CO -0.16 0.16 -0.05 -0.33 0.09 0.00 0.00 178.44 178.14 2hpg h GLU 140 N 0.61 -0.14 0.14 1.13 5.08 -0.47 0.19 114.58 121.12 2hpg h GLU 140 Ca 0.59 0.01 -0.19 0.00 -1.00 0.00 0.00 59.36 58.77 2hpg h GLU 140 Cb 1.02 0.03 0.02 0.00 0.50 0.00 0.00 28.75 30.33 2hpg h GLU 140 CO -0.44 0.25 -0.83 1.96 -1.00 0.00 0.00 179.01 178.95 2hpg h GLN 141 N -0.57 0.31 0.00 2.33 4.20 -0.12 -0.88 115.11 120.39 2hpg h GLN 141 Ca -0.01 -0.53 -0.00 0.00 0.06 0.00 0.00 58.65 58.17 2hpg h GLN 141 Cb 0.46 0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 2hpg h GLN 141 CO 0.02 1.25 -0.74 0.00 -0.67 0.00 0.00 178.83 178.69 2hpg h ARG 142 N -0.34 0.00 0.00 1.46 3.08 -0.63 -3.39 114.38 114.56 2hpg h ARG 142 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 2hpg h ARG 142 Cb 1.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.70 2hpg h ARG 142 CO 0.16 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.25 2hpg n PHE 143 N -2.79 0.00 -1.89 3.04 3.72 -1.05 -5.04 117.46 113.45 2hpg n PHE 143 Ca 0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.26 2hpg n PHE 143 Cb 0.55 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 2hpg n PHE 143 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2hpg n GLY 144 N 0.08 0.55 3.38 1.37 0.00 -0.33 -4.94 105.19 105.30 2hpg n GLY 144 Ca 0.00 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 2hpg n GLY 144 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hpg s ILE 145 N -2.65 3.66 -0.26 -0.61 1.01 -0.06 -1.30 121.20 120.99 2hpg s ILE 145 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 60.65 60.16 2hpg s ILE 145 Cb 0.00 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 2hpg s ILE 145 CO 0.00 0.42 0.12 -0.75 0.00 0.00 0.00 174.94 174.73 2hpg s LYS 146 N 1.26 3.80 -0.32 2.79 2.47 -0.06 -2.38 119.74 127.30 2hpg s LYS 146 Ca 0.03 -0.40 -0.24 0.00 -1.56 0.00 0.00 55.97 53.80 2hpg s LYS 146 Cb -0.14 -3.45 0.00 0.00 -1.46 0.00 0.00 37.83 32.78 2hpg s LYS 146 CO -0.00 -0.15 0.82 0.08 0.16 0.00 0.00 175.35 176.26 2hpg s VAL 147 N 1.58 4.75 0.02 4.02 1.01 -1.26 -0.92 120.40 129.60 2hpg s VAL 147 Ca 0.06 1.18 0.10 0.00 0.00 0.00 0.00 61.98 63.33 2hpg s VAL 147 Cb -0.15 -4.19 -0.15 0.00 0.00 0.00 0.00 36.38 31.89 2hpg s VAL 147 CO 0.06 -0.31 1.19 -0.07 0.00 0.00 0.00 175.10 175.97 2hpg h LEU 148 N 9.59 0.00 -7.00 3.92 3.38 -0.66 -3.48 115.31 121.05 2hpg h LEU 148 Ca -0.24 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.82 2hpg h LEU 148 Cb 1.09 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.61 2hpg h LEU 148 CO 0.91 0.87 0.56 -0.55 0.09 0.00 0.00 178.44 180.31 2hpg s SER 149 N -6.50 -0.36 -0.10 -0.43 0.15 -1.20 -4.73 113.70 100.53 2hpg s SER 149 Ca 0.01 0.43 0.16 0.00 0.70 0.00 0.00 55.95 57.25 2hpg s SER 149 Cb 0.09 0.35 0.35 0.00 -1.71 0.00 0.00 66.02 65.10 2hpg s SER 149 CO 0.80 -0.31 1.16 2.22 1.20 0.00 0.00 173.24 178.32 2hpg n PHE 150 N 0.88 0.00 -0.62 3.44 1.16 -1.26 -0.80 117.46 120.25 2hpg n PHE 150 Ca -0.10 -0.89 -0.16 0.00 -1.87 0.00 0.00 57.45 54.43 2hpg n PHE 150 Cb 0.58 -0.17 0.14 0.00 -1.61 0.00 0.00 39.48 38.41 2hpg n PHE 150 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 2hpg n TYR 151 N -0.47 2.22 -3.71 2.97 4.01 -1.26 -4.67 117.16 116.25 2hpg n TYR 151 Ca 0.12 -1.44 -0.38 0.00 -0.16 0.00 0.00 57.90 56.04 2hpg n TYR 151 Cb 0.84 -0.74 -0.11 0.00 -0.31 0.00 0.00 39.34 39.01 2hpg n TYR 151 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2hpg s TRP 152 N -2.41 3.36 -0.12 -0.72 0.52 -1.26 -2.98 118.94 115.33 2hpg s TRP 152 Ca 0.42 -1.73 0.03 0.00 0.02 0.00 0.00 56.10 54.83 2hpg s TRP 152 Cb 0.35 -2.76 0.00 0.00 -1.15 0.00 0.00 33.47 29.92 2hpg s TRP 152 CO 0.08 -0.84 -0.22 0.08 0.02 0.00 0.00 176.95 176.07 2hpg s VAL 153 N 1.34 2.16 -1.93 4.03 1.01 -1.26 0.57 120.40 126.31 2hpg s VAL 153 Ca 0.02 -0.96 0.26 0.00 0.00 0.00 0.00 61.98 61.30 2hpg s VAL 153 Cb -0.22 -1.85 0.27 0.00 0.00 0.00 0.00 36.38 34.58 2hpg s VAL 153 CO 0.01 0.55 1.52 0.00 0.00 0.00 0.00 175.10 177.17 2hpg n GLN 154 N 3.80 1.05 0.00 2.72 6.02 -0.55 -4.41 117.38 126.01 2hpg n GLN 154 Ca -0.19 -0.67 0.00 0.00 -0.01 0.00 0.00 57.00 56.13 2hpg n GLN 154 Cb 0.52 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.30 2hpg n GLN 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2hpg n GLY 155 N 1.33 -3.33 3.76 1.08 0.00 -1.26 -4.93 105.19 101.84 2hpg n GLY 155 Ca 0.13 -2.01 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 2hpg n GLY 155 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hpg s TYR 156 N -0.68 3.77 0.01 1.61 2.02 -1.26 -1.92 117.35 120.90 2hpg s TYR 156 Ca 0.00 1.82 0.01 0.00 -0.37 0.00 0.00 57.07 58.53 2hpg s TYR 156 Cb 0.00 -3.05 -0.04 0.00 -0.40 0.00 0.00 41.96 38.47 2hpg s TYR 156 CO 0.00 0.08 0.04 1.03 -1.57 0.00 0.00 175.55 175.13 2hpg s ARG 157 N -1.54 2.89 0.19 -0.62 0.52 -0.23 -4.43 118.95 115.73 2hpg s ARG 157 Ca 0.45 -0.58 0.02 0.00 -0.52 0.00 0.00 55.73 55.10 2hpg s ARG 157 Cb -0.25 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.43 2hpg s ARG 157 CO 0.32 0.63 0.02 -1.01 0.02 0.00 0.00 175.30 175.27 2hpg s HIS 158 N -1.16 1.26 0.16 -0.53 3.76 -0.25 -2.36 115.29 116.17 2hpg s HIS 158 Ca 0.22 -1.05 -0.30 0.00 -0.15 0.00 0.00 55.06 53.77 2hpg s HIS 158 Cb -0.12 -0.72 -0.07 0.00 1.11 0.00 0.00 32.58 32.78 2hpg s HIS 158 CO 0.13 -0.24 1.12 -0.06 -0.85 0.00 0.00 174.74 174.83 2hpg s PHE 159 N -3.69 3.56 -0.21 1.40 0.08 -1.05 -0.77 117.98 117.31 2hpg s PHE 159 Ca 0.26 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.87 2hpg s PHE 159 Cb 0.06 -3.30 0.03 0.00 -0.57 0.00 0.00 43.02 39.24 2hpg s PHE 159 CO 0.06 -0.72 -0.14 0.08 -0.10 0.00 0.00 175.22 174.40 2hpg s VAL 160 N -0.04 2.36 0.35 -0.44 1.01 0.36 -1.40 120.40 122.59 2hpg s VAL 160 Ca 0.51 -1.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 2hpg s VAL 160 Cb -0.29 -2.11 0.02 0.00 0.00 0.00 0.00 36.38 34.00 2hpg s VAL 160 CO 0.34 0.37 0.59 0.42 0.00 0.00 0.00 175.10 176.81 2hpg s THR 161 N 1.28 0.00 -0.60 3.92 -4.23 -0.81 -0.25 115.64 114.96 2hpg s THR 161 Ca 0.02 -1.36 0.15 0.00 -1.18 0.00 0.00 61.69 59.32 2hpg s THR 161 Cb -0.15 -2.66 0.55 0.00 1.34 0.00 0.00 72.50 71.58 2hpg s THR 161 CO -0.09 0.00 1.46 0.59 -0.54 0.00 0.00 174.62 176.04 2hpg n ASN 162 N -1.28 4.03 -3.75 3.99 3.02 -1.26 -1.52 115.26 118.50 2hpg n ASN 162 Ca -0.03 -2.62 -0.15 0.00 -0.03 0.00 0.00 54.58 51.76 2hpg n ASN 162 Cb 0.61 -0.49 -0.15 0.00 -0.61 0.00 0.00 39.78 39.14 2hpg n ASN 162 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2hpg s LYS 163 N -2.13 0.03 0.26 3.52 2.20 -1.26 -4.92 119.74 117.44 2hpg s LYS 163 Ca 0.41 0.31 -0.31 0.00 -0.36 0.00 0.00 55.97 56.02 2hpg s LYS 163 Cb 0.29 -0.23 -0.13 0.00 -1.51 0.00 0.00 37.83 36.25 2hpg s LYS 163 CO 0.15 -0.18 1.48 -2.30 -0.36 0.00 0.00 175.35 174.14 2hpg n PRO 164 N 4.32 2.31 -3.80 4.03 -0.02 -1.26 -4.94 135.00 135.64 2hpg n PRO 164 Ca -0.25 0.82 -0.36 0.00 -2.02 0.00 0.00 63.50 61.69 2hpg n PRO 164 Cb 0.51 -2.53 -0.12 0.00 -0.02 0.00 0.00 33.50 31.34 2hpg n PRO 164 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2hpg s ILE 165 N -0.05 3.27 -0.11 4.25 -1.09 -1.26 -4.92 121.20 121.29 2hpg s ILE 165 Ca 0.66 -1.88 0.08 0.00 -2.23 0.00 0.00 60.65 57.28 2hpg s ILE 165 Cb -0.58 -3.16 -0.11 0.00 -1.58 0.00 0.00 42.46 37.03 2hpg s ILE 165 CO 0.49 -0.56 0.21 0.54 -1.23 0.00 0.00 174.94 174.39 2hpg n ARG 166 N 4.61 1.46 -3.74 2.79 1.74 -1.26 -4.79 116.66 117.47 2hpg n ARG 166 Ca -0.05 -0.05 -0.10 0.00 -0.77 0.00 0.00 57.85 56.88 2hpg n ARG 166 Cb 0.42 -1.09 -0.05 0.00 -1.02 0.00 0.00 32.46 30.72 2hpg n ARG 166 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2hpg s LYS 167 N -2.29 1.08 0.28 5.56 -2.85 -1.26 -1.25 119.74 119.00 2hpg s LYS 167 Ca -0.01 -0.84 0.01 0.00 -1.00 0.00 0.00 55.97 54.12 2hpg s LYS 167 Cb 0.05 0.44 0.65 0.00 -2.06 0.00 0.00 37.83 36.91 2hpg s LYS 167 CO 0.31 -0.41 1.67 -1.35 0.10 0.00 0.00 175.35 175.67 2hpg h PRO 168 N 2.44 0.27 -0.75 1.78 0.11 -1.90 -1.55 132.00 132.40 2hpg h PRO 168 Ca -0.33 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 65.95 2hpg h PRO 168 Cb 1.24 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2hpg h PRO 168 CO 0.47 0.18 0.51 1.49 -0.21 0.00 0.00 178.00 180.45 2hpg h GLU 169 N 0.28 0.21 0.00 1.05 4.22 -1.95 -0.91 114.58 117.48 2hpg h GLU 169 Ca 0.52 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.94 2hpg h GLU 169 Cb 0.99 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2hpg h GLU 169 CO -0.58 0.14 -0.01 -0.44 -2.18 0.00 0.00 179.01 175.94 2hpg h ASP 170 N 0.22 0.00 1.39 1.04 3.32 -1.65 -2.16 116.42 118.59 2hpg h ASP 170 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 2hpg h ASP 170 Cb 1.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.67 2hpg h ASP 170 CO -0.08 0.01 -0.22 -0.07 -1.72 0.00 0.00 179.24 177.17 2hpg h LEU 171 N 0.00 0.00 -9.39 1.55 3.38 -1.30 -3.46 115.31 106.09 2hpg h LEU 171 Ca -0.00 -0.05 -0.60 0.00 0.09 0.00 0.00 57.88 57.32 2hpg h LEU 171 Cb 0.04 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.83 2hpg h LEU 171 CO 0.00 0.03 0.96 0.59 0.09 0.00 0.00 178.44 180.10 2hpg n ASN 172 N -2.41 3.29 0.00 -0.43 5.03 -0.81 -0.77 115.26 119.17 2hpg n ASN 172 Ca 0.04 1.02 0.00 0.00 0.87 0.00 0.00 54.58 56.52 2hpg n ASN 172 Cb 0.46 -1.40 0.00 0.00 -1.02 0.00 0.00 39.78 37.82 2hpg n ASN 172 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2hpg n GLY 173 N 3.92 2.83 3.71 7.41 0.00 -1.26 -5.02 105.19 116.78 2hpg n GLY 173 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2hpg n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hpg s LEU 174 N 0.00 4.36 -0.46 0.99 1.43 0.05 -4.82 118.68 120.23 2hpg s LEU 174 Ca 0.00 1.87 -0.25 0.00 -1.03 0.00 0.00 54.13 54.72 2hpg s LEU 174 Cb 0.00 -3.57 0.03 0.00 0.03 0.00 0.00 46.19 42.67 2hpg s LEU 174 CO 0.00 -0.41 0.91 -0.13 0.23 0.00 0.00 176.35 176.95 2hpg s ARG 175 N 1.16 3.52 -0.20 1.70 3.00 -1.26 -0.99 118.95 125.89 2hpg s ARG 175 Ca 0.56 0.14 -0.03 0.00 0.00 0.00 0.00 55.73 56.40 2hpg s ARG 175 Cb -0.26 -3.93 -0.01 0.00 0.00 0.00 0.00 34.95 30.76 2hpg s ARG 175 CO 0.28 -1.21 -0.08 0.42 0.00 0.00 0.00 175.30 174.71 2hpg s ILE 176 N 3.70 3.17 0.22 1.52 -1.09 -0.26 0.04 121.20 128.51 2hpg s ILE 176 Ca 0.36 -0.57 -0.30 0.00 -2.23 0.00 0.00 60.65 57.91 2hpg s ILE 176 Cb -0.10 -2.41 -0.09 0.00 -1.58 0.00 0.00 42.46 38.28 2hpg s ILE 176 CO 0.26 0.46 1.27 -0.60 -1.23 0.00 0.00 174.94 175.10 2hpg s ARG 177 N 1.22 4.43 -0.00 2.79 6.06 -0.52 -1.45 118.95 131.48 2hpg s ARG 177 Ca 0.02 2.02 -0.17 0.00 -2.50 0.00 0.00 55.73 55.11 2hpg s ARG 177 Cb -0.14 -3.19 0.03 0.00 0.06 0.00 0.00 34.95 31.71 2hpg s ARG 177 CO -0.03 -0.17 0.36 -0.08 -2.50 0.00 0.00 175.30 172.88 2hpg s THR 178 N -0.18 0.05 0.99 4.11 -1.32 -0.52 -3.38 115.64 115.38 2hpg s THR 178 Ca 0.54 -0.45 -0.12 0.00 -1.21 0.00 0.00 61.69 60.45 2hpg s THR 178 Cb -0.36 -0.73 0.12 0.00 -1.51 0.00 0.00 72.50 70.02 2hpg s THR 178 CO 0.40 -0.25 0.74 -2.65 -2.21 0.00 0.00 174.62 170.65 2hpg n PRO 179 N 1.07 -0.80 0.12 7.08 -0.02 -1.26 -4.13 135.00 137.06 2hpg n PRO 179 Ca -0.21 -0.19 -0.02 0.00 -2.02 0.00 0.00 63.50 61.07 2hpg n PRO 179 Cb 0.57 -2.09 0.20 0.00 -0.02 0.00 0.00 33.50 32.16 2hpg n PRO 179 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2hpg h GLY 180 N -1.91 0.15 -2.21 -1.23 0.00 -1.94 -3.37 103.07 92.56 2hpg h GLY 180 Ca -0.47 -0.17 -0.54 0.00 0.00 0.00 0.00 47.33 46.16 2hpg h GLY 180 CO 0.39 0.15 0.50 0.00 0.00 0.00 0.00 176.54 177.59 2hpg s ALA 181 N -3.90 2.55 0.36 3.60 0.00 -1.26 -4.74 121.76 118.37 2hpg s ALA 181 Ca -0.03 1.11 0.14 0.00 0.00 0.00 0.00 51.96 53.17 2hpg s ALA 181 Cb 0.13 -3.49 0.98 0.00 0.00 0.00 0.00 23.12 20.74 2hpg s ALA 181 CO 0.77 -1.30 1.75 -1.35 0.00 0.00 0.00 175.76 175.64 2hpg h PRO 182 N 0.91 0.49 -0.98 0.00 0.11 -1.89 -2.20 132.00 128.45 2hpg h PRO 182 Ca -0.51 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.61 2hpg h PRO 182 Cb 1.31 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.25 2hpg h PRO 182 CO 0.55 0.32 0.64 0.00 -0.21 0.00 0.00 178.00 179.31 2hpg h ALA 183 N 1.67 1.37 0.07 -0.75 0.00 -1.90 0.02 119.26 119.74 2hpg h ALA 183 Ca 0.61 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.47 2hpg h ALA 183 Cb 1.33 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2hpg h ALA 183 CO -0.38 0.53 -0.03 -1.49 0.00 0.00 0.00 179.25 177.88 2hpg h TRP 184 N 1.23 -0.08 -0.17 0.00 4.06 -1.64 -2.83 115.95 116.51 2hpg h TRP 184 Ca 0.39 -0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.33 2hpg h TRP 184 Cb 0.01 0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.19 2hpg h TRP 184 CO -0.00 0.48 0.08 1.96 -3.56 0.00 0.00 178.44 177.40 2hpg h GLN 185 N -0.75 0.25 -0.17 0.49 1.08 -1.30 -1.19 115.11 113.52 2hpg h GLN 185 Ca -0.01 -0.04 -0.15 0.00 -1.45 0.00 0.00 58.65 57.01 2hpg h GLN 185 Cb 0.60 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.98 2hpg h GLN 185 CO 0.02 0.29 -0.51 1.49 -0.95 0.00 0.00 178.83 179.16 2hpg h GLU 186 N 0.15 0.47 0.01 1.46 4.57 -1.15 -1.48 114.58 118.61 2hpg h GLU 186 Ca 0.06 -0.28 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 2hpg h GLU 186 Cb 0.12 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 2hpg h GLU 186 CO -0.01 0.87 -0.02 0.77 -1.18 0.00 0.00 179.01 179.44 2hpg h SER 187 N 0.37 -0.06 -0.53 1.04 0.02 -1.30 0.40 113.55 113.48 2hpg h SER 187 Ca 0.01 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.87 2hpg h SER 187 Cb 1.02 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 2hpg h SER 187 CO 0.09 -0.03 -0.04 0.40 -1.14 0.00 0.00 176.83 176.10 2hpg h ILE 188 N -0.04 1.26 -0.40 3.27 1.08 -1.18 -2.32 117.51 119.18 2hpg h ILE 188 Ca 0.01 -1.18 0.00 0.00 -0.39 0.00 0.00 64.86 63.30 2hpg h ILE 188 Cb 0.05 0.88 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 2hpg h ILE 188 CO -0.02 0.42 0.26 -0.09 -0.69 0.00 0.00 178.15 178.04 2hpg h ARG 189 N 0.91 0.52 -0.37 2.37 2.43 -1.18 -2.64 114.38 116.42 2hpg h ARG 189 Ca 0.16 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2hpg h ARG 189 Cb 0.59 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 2hpg h ARG 189 CO 0.04 0.35 0.23 0.77 -1.51 0.00 0.00 179.97 179.84 2hpg h SER 190 N 0.54 0.44 1.28 -3.80 0.02 -0.60 -2.44 113.55 108.98 2hpg h SER 190 Ca 0.15 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2hpg h SER 190 Cb -0.06 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.37 2hpg h SER 190 CO -0.03 0.34 -0.08 -0.07 -1.14 0.00 0.00 176.83 175.84 2hpg h LEU 191 N 0.51 0.00 0.00 5.07 3.38 -1.08 -3.42 115.31 119.77 2hpg h LEU 191 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2hpg h LEU 191 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2hpg h LEU 191 CO -0.03 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.19 2hpg n GLY 192 N 0.40 0.38 3.98 0.83 0.00 -0.92 -4.57 105.19 105.30 2hpg n GLY 192 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 2hpg n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpg s ALA 193 N -0.34 4.10 -0.42 4.61 0.00 -1.06 -3.23 121.76 125.43 2hpg s ALA 193 Ca 0.00 -1.42 -0.19 0.00 0.00 0.00 0.00 51.96 50.35 2hpg s ALA 193 Cb 0.00 -1.92 0.02 0.00 0.00 0.00 0.00 23.12 21.22 2hpg s ALA 193 CO 0.00 -0.51 0.54 0.42 0.00 0.00 0.00 175.76 176.21 2hpg s ILE 194 N -2.57 4.96 0.40 0.00 1.01 -0.16 -4.11 121.20 120.74 2hpg s ILE 194 Ca 0.55 -0.05 -0.25 0.00 0.00 0.00 0.00 60.65 60.90 2hpg s ILE 194 Cb -0.10 -4.11 -0.08 0.00 0.01 0.00 0.00 42.46 38.18 2hpg s ILE 194 CO 0.36 -0.48 1.12 -2.16 0.00 0.00 0.00 174.94 173.78 2hpg s PRO 195 N 2.48 4.07 -0.03 2.79 0.04 -1.26 -1.10 135.00 141.99 2hpg s PRO 195 Ca 0.18 1.70 -0.00 0.00 0.04 0.00 0.00 61.00 62.92 2hpg s PRO 195 Cb -0.15 -2.60 0.03 0.00 0.04 0.00 0.00 34.50 31.81 2hpg s PRO 195 CO 0.16 -0.27 0.03 0.08 0.04 0.00 0.00 177.00 177.04 2hpg s VAL 196 N -1.51 -0.01 -0.15 -0.36 1.01 -0.53 -4.86 120.40 113.99 2hpg s VAL 196 Ca 0.58 0.22 -0.25 0.00 0.00 0.00 0.00 61.98 62.53 2hpg s VAL 196 Cb -0.27 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.95 2hpg s VAL 196 CO 0.34 0.12 0.81 0.00 0.00 0.00 0.00 175.10 176.37 2hpg s ALA 197 N 1.26 3.48 -0.02 5.51 0.00 -1.26 -1.44 121.76 129.29 2hpg s ALA 197 Ca -0.07 0.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.93 2hpg s ALA 197 Cb -0.13 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.81 2hpg s ALA 197 CO -0.03 -0.56 0.05 0.08 0.00 0.00 0.00 175.76 175.30 2hpg s VAL 198 N 1.93 -0.01 0.31 0.00 1.01 -1.26 -5.01 120.40 117.37 2hpg s VAL 198 Ca 0.38 0.04 -0.28 0.00 0.00 0.00 0.00 61.98 62.12 2hpg s VAL 198 Cb -0.17 -0.08 -0.13 0.00 0.00 0.00 0.00 36.38 35.99 2hpg s VAL 198 CO 0.14 0.02 1.10 0.59 0.00 0.00 0.00 175.10 176.95 2hpg n ASN 199 N 3.28 1.79 -0.27 3.32 4.13 -1.26 -4.85 115.26 121.40 2hpg n ASN 199 Ca -0.15 1.18 0.06 0.00 1.68 0.00 0.00 54.58 57.35 2hpg n ASN 199 Cb 0.58 -1.36 0.20 0.00 -1.54 0.00 0.00 39.78 37.66 2hpg n ASN 199 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2hpg h PHE 200 N 2.15 0.59 0.00 3.10 3.57 -1.98 -0.01 116.94 124.35 2hpg h PHE 200 Ca -0.42 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.12 2hpg h PHE 200 Cb 1.32 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.92 2hpg h PHE 200 CO 0.48 0.09 0.00 0.41 -2.23 0.00 0.00 178.31 177.07 2hpg n GLY 201 N -1.32 -1.00 0.87 2.40 0.00 -1.26 -2.36 105.19 102.52 2hpg n GLY 201 Ca 0.15 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.25 2hpg n GLY 201 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hpg n GLU 202 N -1.65 2.14 0.02 1.61 -0.58 -0.03 -4.63 120.64 117.52 2hpg n GLU 202 Ca 0.03 -1.98 -0.11 0.00 -0.42 0.00 0.00 57.16 54.68 2hpg n GLU 202 Cb 0.16 -1.39 -0.06 0.00 -0.57 0.00 0.00 31.44 29.58 2hpg n GLU 202 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2hpg h ILE 203 N 3.40 1.00 -0.33 -3.67 2.04 -1.38 0.06 117.51 118.63 2hpg h ILE 203 Ca 0.00 -0.02 0.07 0.00 1.00 0.00 0.00 64.86 65.91 2hpg h ILE 203 Cb 0.81 0.94 -0.08 0.00 -0.74 0.00 0.00 36.82 37.75 2hpg h ILE 203 CO 0.00 0.01 -0.22 0.22 0.00 0.00 0.00 178.15 178.16 2hpg h TYR 204 N 0.06 -0.57 -0.37 1.37 3.20 -1.82 -1.05 116.97 117.78 2hpg h TYR 204 Ca 0.02 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.98 2hpg h TYR 204 Cb 0.00 0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 2hpg h TYR 204 CO -0.09 -0.30 0.12 1.15 -1.64 0.00 0.00 178.16 177.41 2hpg h THR 205 N -0.18 0.88 -0.95 1.81 2.02 -1.79 -0.16 112.91 114.53 2hpg h THR 205 Ca 0.17 -0.09 0.05 0.00 0.77 0.00 0.00 66.41 67.31 2hpg h THR 205 Cb 0.44 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 67.38 2hpg h THR 205 CO -0.44 0.05 0.62 0.00 0.37 0.00 0.00 175.52 176.12 2hpg h ALA 206 N 1.25 1.43 -0.08 6.16 0.00 -0.44 0.87 119.26 128.45 2hpg h ALA 206 Ca 0.17 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 2hpg h ALA 206 Cb 0.16 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.65 2hpg h ALA 206 CO -0.19 0.44 -0.50 0.28 0.00 0.00 0.00 179.25 179.29 2hpg h VAL 207 N 1.14 1.38 -0.43 0.00 2.07 -0.80 0.13 116.25 119.74 2hpg h VAL 207 Ca 0.40 -1.86 -0.07 0.00 0.82 0.00 0.00 66.70 65.99 2hpg h VAL 207 Cb 0.11 2.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2hpg h VAL 207 CO -0.14 0.55 -0.00 -0.61 0.02 0.00 0.00 177.57 177.39 2hpg h GLN 208 N 0.05 0.76 0.00 1.57 4.15 -0.51 -2.02 115.11 119.12 2hpg h GLN 208 Ca -0.04 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.14 2hpg h GLN 208 Cb 1.16 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.78 2hpg h GLN 208 CO 0.10 0.84 0.00 0.25 -1.93 0.00 0.00 178.83 178.09 2hpg n THR 209 N -4.40 0.09 -1.76 2.39 -2.24 0.25 -4.93 114.28 103.68 2hpg n THR 209 Ca -0.00 0.02 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 2hpg n THR 209 Cb 0.30 -0.61 -0.02 0.00 -2.10 0.00 0.00 70.33 67.90 2hpg n THR 209 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2hpg n ARG 210 N -1.13 -0.60 0.13 -0.78 1.74 -0.76 -4.91 116.66 110.35 2hpg n ARG 210 Ca 0.16 0.56 0.01 0.00 -0.77 0.00 0.00 57.85 57.80 2hpg n ARG 210 Cb 0.14 -4.45 0.08 0.00 -1.02 0.00 0.00 32.46 27.21 2hpg n ARG 210 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2hpg h ALA 211 N 0.22 0.70 -2.26 7.54 0.00 -1.00 -3.45 119.26 121.00 2hpg h ALA 211 Ca -0.18 -0.54 -0.34 0.00 0.00 0.00 0.00 54.91 53.85 2hpg h ALA 211 Cb 0.88 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.43 2hpg h ALA 211 CO 0.23 0.75 -0.65 0.14 0.00 0.00 0.00 179.25 179.72 2hpg s VAL 212 N -3.12 0.79 -0.57 0.00 -7.23 -0.97 -4.99 120.40 104.31 2hpg s VAL 212 Ca 0.02 -2.00 0.19 0.00 -1.81 0.00 0.00 61.98 58.38 2hpg s VAL 212 Cb 0.09 -2.32 -0.25 0.00 0.56 0.00 0.00 36.38 34.47 2hpg s VAL 212 CO 0.75 -0.32 0.67 0.47 -0.31 0.00 0.00 175.10 176.36 2hpg n ASP 213 N -0.36 0.74 0.00 4.85 8.00 0.11 -4.50 116.55 125.39 2hpg n ASP 213 Ca -0.05 -0.59 0.00 0.00 0.71 0.00 0.00 54.79 54.87 2hpg n ASP 213 Cb 0.64 1.35 0.00 0.00 -0.02 0.00 0.00 41.12 43.09 2hpg n ASP 213 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hpg n GLY 214 N 1.42 -1.21 2.34 0.44 0.00 -1.08 -4.14 105.19 102.95 2hpg n GLY 214 Ca 0.01 -0.89 -0.11 0.00 0.00 0.00 0.00 46.02 45.03 2hpg n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpg n ALA 215 N 0.00 -0.11 -3.67 4.61 0.00 0.66 -1.44 120.51 120.56 2hpg n ALA 215 Ca 0.00 -1.17 -0.14 0.00 0.00 0.00 0.00 53.44 52.12 2hpg n ALA 215 Cb 0.00 0.95 -0.14 0.00 0.00 0.00 0.00 19.45 20.25 2hpg n ALA 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2hpg s GLU 216 N -2.62 0.11 0.29 0.00 4.04 -1.22 -0.49 118.70 118.81 2hpg s GLU 216 Ca 0.22 0.65 -0.19 0.00 0.04 0.00 0.00 54.97 55.69 2hpg s GLU 216 Cb -0.00 -0.13 0.02 0.00 0.02 0.00 0.00 34.13 34.04 2hpg s GLU 216 CO 0.15 -0.28 0.69 -0.51 -1.84 0.00 0.00 175.26 173.47 2hpg s LEU 217 N 2.23 -0.12 0.66 1.83 1.43 0.05 -4.83 118.68 119.93 2hpg s LEU 217 Ca 0.01 -0.74 -0.10 0.00 -1.03 0.00 0.00 54.13 52.27 2hpg s LEU 217 Cb -0.12 2.57 0.01 0.00 0.03 0.00 0.00 46.19 48.68 2hpg s LEU 217 CO -0.07 -1.36 1.03 0.42 0.23 0.00 0.00 176.35 176.60 2hpg s THR 218 N -3.74 3.71 0.35 5.49 -4.23 -1.26 -1.09 115.64 114.87 2hpg s THR 218 Ca 0.14 0.40 0.07 0.00 -1.18 0.00 0.00 61.69 61.12 2hpg s THR 218 Cb -0.05 -3.53 0.12 0.00 1.34 0.00 0.00 72.50 70.39 2hpg s THR 218 CO 0.08 -0.66 1.84 1.88 -0.54 0.00 0.00 174.62 177.23 2hpg h TYR 219 N -0.47 0.35 -0.18 3.99 0.05 -1.88 -2.35 116.97 116.46 2hpg h TYR 219 Ca -0.45 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.30 2hpg h TYR 219 Cb 1.25 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 38.87 2hpg h TYR 219 CO 0.51 0.49 0.03 0.00 -1.05 0.00 0.00 178.16 178.15 2hpg h ALA 220 N 1.52 0.18 -0.14 3.88 0.00 -1.91 -0.54 119.26 122.26 2hpg h ALA 220 Ca 0.06 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2hpg h ALA 220 Cb 0.48 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2hpg h ALA 220 CO 0.03 -0.40 -0.12 -0.91 0.00 0.00 0.00 179.25 177.85 2hpg h ASN 221 N 0.11 -0.38 -0.44 0.00 2.35 -1.91 0.33 115.58 115.63 2hpg h ASN 221 Ca 0.08 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2hpg h ASN 221 Cb 0.08 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 2hpg h ASN 221 CO -0.11 -0.16 0.28 0.58 -1.65 0.00 0.00 177.43 176.36 2hpg h VAL 222 N -0.14 1.13 0.13 2.81 2.07 -1.26 -1.80 116.25 119.19 2hpg h VAL 222 Ca 0.09 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2hpg h VAL 222 Cb 0.27 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2hpg h VAL 222 CO -0.23 0.13 -0.06 0.22 0.02 0.00 0.00 177.57 177.65 2hpg h TYR 223 N 0.59 -0.16 0.00 1.57 3.20 -0.95 -1.56 116.97 119.67 2hpg h TYR 223 Ca 0.16 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2hpg h TYR 223 Cb -0.03 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 2hpg h TYR 223 CO -0.04 0.30 -0.11 -0.91 -1.64 0.00 0.00 178.16 175.76 2hpg h ASN 224 N -0.71 0.00 0.26 -2.11 2.35 -0.97 -2.19 115.58 112.20 2hpg h ASN 224 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2hpg h ASN 224 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2hpg h ASN 224 CO 0.03 0.11 -0.21 0.61 -1.65 0.00 0.00 177.43 176.31 2hpg n GLY 225 N -1.03 -0.67 2.23 2.83 0.00 -0.68 -4.95 105.19 102.93 2hpg n GLY 225 Ca -0.02 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.54 2hpg n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hpg n GLY 226 N 1.32 0.85 0.15 -0.02 0.00 -0.83 -4.90 105.19 101.76 2hpg n GLY 226 Ca 0.13 -0.64 0.13 0.00 0.00 0.00 0.00 46.02 45.64 2hpg n GLY 226 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2hpg h LEU 227 N 0.00 0.00 -1.84 0.99 3.38 -1.55 -1.92 115.31 114.37 2hpg h LEU 227 Ca -0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2hpg h LEU 227 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2hpg h LEU 227 CO 0.25 0.00 0.00 0.10 0.09 0.00 0.00 178.44 178.88 2hpg h TYR 228 N 0.00 0.00 0.00 1.13 -0.00 -1.75 -1.36 116.97 114.98 2hpg h TYR 228 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 58.68 2hpg h TYR 228 Cb 0.56 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.28 2hpg h TYR 228 CO 0.00 0.00 -0.24 0.93 -0.00 0.00 0.00 178.16 178.85 2hpg h GLU 229 N 0.00 0.00 0.00 0.10 4.39 -1.73 -3.33 114.58 114.01 2hpg h GLU 229 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2hpg h GLU 229 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2hpg h GLU 229 CO 0.00 0.24 0.00 1.33 -1.16 0.00 0.00 179.01 179.42 2hpg n VAL 230 N -3.53 0.00 -4.05 3.13 0.24 -0.89 -5.02 118.33 108.21 2hpg n VAL 230 Ca -0.01 -0.44 -0.25 0.00 -2.04 0.00 0.00 64.34 61.60 2hpg n VAL 230 Cb 0.40 1.01 -0.17 0.00 -1.47 0.00 0.00 33.84 33.61 2hpg n VAL 230 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2hpg s LEU 231 N -1.59 1.20 0.01 1.34 1.43 -0.57 -4.91 118.68 115.59 2hpg s LEU 231 Ca 0.00 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.89 2hpg s LEU 231 Cb 0.00 -0.73 -0.25 0.00 0.03 0.00 0.00 46.19 45.25 2hpg s LEU 231 CO 0.00 -0.09 0.87 0.50 0.23 0.00 0.00 176.35 177.86 2hpg h LYS 232 N 7.84 0.12 0.00 1.70 1.63 -1.72 -3.38 116.57 122.77 2hpg h LYS 232 Ca -0.29 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 2hpg h LYS 232 Cb 1.14 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.85 2hpg h LYS 232 CO 0.40 0.92 0.00 0.66 -3.45 0.00 0.00 179.45 177.98 2hpg n TYR 233 N -3.32 -0.00 -3.32 1.91 4.01 -0.58 -1.41 117.16 114.46 2hpg n TYR 233 Ca -0.14 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.63 2hpg n TYR 233 Cb 1.02 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.02 2hpg n TYR 233 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2hpg s SER 235 N 0.86 -0.43 -1.45 7.72 0.01 -0.49 -1.92 113.70 117.99 2hpg s SER 235 Ca 0.00 0.56 -0.11 0.00 1.31 0.00 0.00 55.95 57.70 2hpg s SER 235 Cb 0.00 1.48 0.04 0.00 0.21 0.00 0.00 66.02 67.75 2hpg s SER 235 CO 0.00 -0.08 2.34 -0.62 0.41 0.00 0.00 173.24 175.29 2hpg n GLU 236 N 4.91 3.37 0.21 12.44 1.02 0.14 -2.53 120.64 140.21 2hpg n GLU 236 Ca -0.08 -2.78 0.06 0.00 -0.02 0.00 0.00 57.16 54.34 2hpg n GLU 236 Cb 0.53 -3.04 0.46 0.00 -0.02 0.00 0.00 31.44 29.37 2hpg n GLU 236 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2hpg h THR 237 N 3.59 0.98 -6.41 2.62 1.35 -1.87 -3.37 112.91 109.81 2hpg h THR 237 Ca 0.62 -1.10 -0.49 0.00 -0.55 0.00 0.00 66.41 64.89 2hpg h THR 237 Cb 0.52 1.63 -0.07 0.00 -1.73 0.00 0.00 68.15 68.51 2hpg h THR 237 CO 1.78 0.29 -0.80 0.61 -0.25 0.00 0.00 175.52 177.14 2hpg n GLY 238 N -0.39 -0.42 0.21 5.82 0.00 -1.19 -4.87 105.19 104.36 2hpg n GLY 238 Ca -0.01 0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.28 2hpg n GLY 238 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2hpg h HIS 239 N -1.89 0.00 -4.16 1.61 2.07 -1.83 -3.43 115.15 107.53 2hpg h HIS 239 Ca -0.59 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 56.40 2hpg h HIS 239 Cb 1.38 0.00 -0.26 0.00 2.57 0.00 0.00 27.41 31.09 2hpg h HIS 239 CO 0.56 0.05 -0.82 -0.06 -3.07 0.00 0.00 177.93 174.59 2hpg s PHE 240 N -3.19 1.54 -0.26 6.12 0.08 -1.25 -0.19 117.98 120.82 2hpg s PHE 240 Ca 0.07 -0.34 -0.05 0.00 0.12 0.00 0.00 56.93 56.73 2hpg s PHE 240 Cb 0.05 -0.93 0.01 0.00 -0.57 0.00 0.00 43.02 41.58 2hpg s PHE 240 CO 0.68 0.04 0.02 -1.17 -0.10 0.00 0.00 175.22 174.69 2hpg s LEU 241 N -0.96 3.45 -0.43 -0.37 2.96 -1.26 -1.07 118.68 120.99 2hpg s LEU 241 Ca 0.05 -0.65 -0.27 0.00 -0.22 0.00 0.00 54.13 53.05 2hpg s LEU 241 Cb -0.08 -1.80 0.02 0.00 0.50 0.00 0.00 46.19 44.84 2hpg s LEU 241 CO 0.01 -0.13 0.98 -0.22 -1.32 0.00 0.00 176.35 175.68 2hpg s LEU 242 N 1.46 3.91 -0.31 -0.68 2.96 -0.81 -4.95 118.68 120.26 2hpg s LEU 242 Ca 0.03 0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 54.23 2hpg s LEU 242 Cb -0.16 -3.31 0.01 0.00 0.50 0.00 0.00 46.19 43.22 2hpg s LEU 242 CO -0.00 -1.04 0.11 -0.63 -1.32 0.00 0.00 176.35 173.47 2hpg s ILE 243 N 3.85 4.16 0.25 6.68 1.01 -1.26 -1.48 121.20 134.40 2hpg s ILE 243 Ca 0.40 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 60.22 2hpg s ILE 243 Cb -0.10 -3.18 -0.08 0.00 0.01 0.00 0.00 42.46 39.11 2hpg s ILE 243 CO 0.25 0.02 0.65 0.20 0.00 0.00 0.00 174.94 176.06 2hpg s ASN 244 N 1.52 6.80 -0.13 3.58 -0.87 0.19 -4.32 114.94 121.71 2hpg s ASN 244 Ca 0.03 1.17 -0.01 0.00 -1.57 0.00 0.00 52.86 52.48 2hpg s ASN 244 Cb -0.18 -2.33 -0.02 0.00 -0.02 0.00 0.00 41.25 38.71 2hpg s ASN 244 CO 0.04 -0.07 -0.09 -0.36 -2.57 0.00 0.00 177.10 174.04 2hpg s PHE 245 N -1.76 2.89 -0.29 2.20 0.08 0.71 -4.04 117.98 117.77 2hpg s PHE 245 Ca 0.47 -0.41 -0.09 0.00 0.12 0.00 0.00 56.93 57.02 2hpg s PHE 245 Cb -0.12 -1.85 -0.01 0.00 -0.57 0.00 0.00 43.02 40.46 2hpg s PHE 245 CO 0.19 -0.06 0.12 -1.21 -0.10 0.00 0.00 175.22 174.17 2hpg s GLU 246 N 0.14 3.39 0.17 0.44 0.41 0.02 -0.71 118.70 122.56 2hpg s GLU 246 Ca -0.04 -0.67 0.10 0.00 -0.41 0.00 0.00 54.97 53.95 2hpg s GLU 246 Cb -0.14 -3.48 -0.04 0.00 -1.78 0.00 0.00 34.13 28.68 2hpg s GLU 246 CO 0.04 -0.36 -0.21 0.96 -0.49 0.00 0.00 175.26 175.20 2hpg s ILE 247 N 1.60 2.08 0.24 -1.63 -4.36 -0.44 0.14 121.20 118.83 2hpg s ILE 247 Ca 0.05 -1.94 -0.04 0.00 -0.26 0.00 0.00 60.65 58.46 2hpg s ILE 247 Cb -0.17 -1.96 -0.02 0.00 1.25 0.00 0.00 42.46 41.56 2hpg s ILE 247 CO 0.05 -0.19 0.28 0.68 0.24 0.00 0.00 174.94 176.00 2hpg s VAL 248 N -1.78 0.00 0.16 8.37 -7.23 -0.10 -1.35 120.40 118.48 2hpg s VAL 248 Ca 0.17 -1.78 -0.32 0.00 -1.81 0.00 0.00 61.98 58.25 2hpg s VAL 248 Cb -0.07 -2.43 -0.11 0.00 0.56 0.00 0.00 36.38 34.33 2hpg s VAL 248 CO 0.08 0.00 1.79 -0.24 -0.31 0.00 0.00 175.10 176.42 2hpg n SER 249 N -0.54 4.05 0.16 4.85 2.88 -1.23 -0.88 113.62 122.91 2hpg n SER 249 Ca 0.01 1.02 0.02 0.00 -1.33 0.00 0.00 58.87 58.59 2hpg n SER 249 Cb 0.64 -1.56 0.33 0.00 -0.75 0.00 0.00 64.21 62.87 2hpg n SER 249 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hpg h ALA 250 N 7.81 1.34 0.55 -1.46 0.00 -1.50 -1.55 119.26 124.45 2hpg h ALA 250 Ca -0.45 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.10 2hpg h ALA 250 Cb 1.21 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.94 2hpg h ALA 250 CO 0.95 0.48 -0.26 -0.44 0.00 0.00 0.00 179.25 179.98 2hpg h ASP 251 N 0.07 -0.62 -0.36 0.00 3.32 -1.91 -2.18 116.42 114.73 2hpg h ASP 251 Ca 0.01 -0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.10 2hpg h ASP 251 Cb 0.66 0.16 -0.08 0.00 0.22 0.00 0.00 39.33 40.29 2hpg h ASP 251 CO 0.05 -0.34 -0.16 -0.25 -1.72 0.00 0.00 179.24 176.82 2hpg h TRP 252 N -0.89 -0.39 -0.65 4.55 7.01 -1.72 -1.97 115.95 121.89 2hpg h TRP 252 Ca -0.08 0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.01 2hpg h TRP 252 Cb 0.62 0.23 -0.05 0.00 -2.10 0.00 0.00 29.16 27.86 2hpg h TRP 252 CO -0.01 -0.24 0.38 0.35 -2.79 0.00 0.00 178.44 176.13 2hpg h PHE 253 N -0.09 0.70 0.00 2.65 3.57 -1.32 -1.71 116.94 120.75 2hpg h PHE 253 Ca 0.18 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2hpg h PHE 253 Cb 0.37 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.89 2hpg h PHE 253 CO -0.39 0.37 -0.07 -0.91 -2.23 0.00 0.00 178.31 175.08 2hpg h ASN 254 N 0.72 0.00 0.87 0.41 2.35 -0.90 -2.22 115.58 116.81 2hpg h ASN 254 Ca 0.28 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 2hpg h ASN 254 Cb 0.10 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 2hpg h ASN 254 CO -0.14 0.07 -0.04 0.77 -1.65 0.00 0.00 177.43 176.44 2hpg h SER 255 N 0.00 0.00 -4.06 5.81 4.64 -0.57 -3.45 113.55 115.91 2hpg h SER 255 Ca -0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 2hpg h SER 255 Cb 0.44 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2hpg h SER 255 CO 0.01 0.04 0.36 -0.76 -0.87 0.00 0.00 176.83 175.60 2hpg s LEU 256 N -6.34 3.91 0.40 5.97 1.43 -0.84 -5.03 118.68 118.18 2hpg s LEU 256 Ca 0.00 1.78 -0.25 0.00 -1.03 0.00 0.00 54.13 54.63 2hpg s LEU 256 Cb 0.10 -4.54 -0.11 0.00 0.03 0.00 0.00 46.19 41.66 2hpg s LEU 256 CO 0.55 -0.51 0.93 -2.65 0.23 0.00 0.00 176.35 174.90 2hpg n PRO 257 N -0.74 1.21 0.25 1.29 -0.02 -1.26 -4.79 135.00 130.94 2hpg n PRO 257 Ca 0.08 0.43 0.08 0.00 -2.02 0.00 0.00 63.50 62.07 2hpg n PRO 257 Cb 0.53 -1.91 0.64 0.00 -0.02 0.00 0.00 33.50 32.74 2hpg n PRO 257 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2hpg h LYS 258 N 1.48 0.01 -0.53 -0.52 1.79 -1.95 -1.17 116.57 115.67 2hpg h LYS 258 Ca -0.43 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.02 2hpg h LYS 258 Cb 1.35 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.97 2hpg h LYS 258 CO 0.57 0.00 0.23 1.49 -1.08 0.00 0.00 179.45 180.66 2hpg h GLU 259 N 0.01 0.79 -0.14 3.15 4.81 -2.00 -2.38 114.58 118.81 2hpg h GLU 259 Ca 0.01 -0.13 -0.18 0.00 -0.13 0.00 0.00 59.36 58.93 2hpg h GLU 259 Cb 0.02 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 2hpg h GLU 259 CO -0.00 0.68 -0.64 1.88 -0.73 0.00 0.00 179.01 180.19 2hpg h TYR 260 N 0.72 0.68 -0.11 0.92 0.05 -1.61 -2.58 116.97 115.04 2hpg h TYR 260 Ca 0.18 -0.27 0.04 0.00 0.05 0.00 0.00 58.73 58.73 2hpg h TYR 260 Cb 0.17 -0.12 -0.05 0.00 1.01 0.00 0.00 36.73 37.75 2hpg h TYR 260 CO 0.00 1.02 -0.16 1.96 -1.05 0.00 0.00 178.16 179.93 2hpg h GLN 261 N 0.38 -0.20 -0.63 4.88 4.20 -1.18 -0.71 115.11 121.84 2hpg h GLN 261 Ca -0.01 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.72 2hpg h GLN 261 Cb 1.21 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 29.00 2hpg h GLN 261 CO 0.12 -0.14 0.42 -0.22 -0.67 0.00 0.00 178.83 178.34 2hpg h LYS 262 N -0.21 0.83 0.31 1.46 3.64 -1.39 -2.00 116.57 119.21 2hpg h LYS 262 Ca 0.09 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2hpg h LYS 262 Cb 0.34 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2hpg h LYS 262 CO -0.24 0.55 -0.15 0.82 -2.27 0.00 0.00 179.45 178.17 2hpg h ILE 263 N 0.86 0.70 -0.38 2.00 2.04 -1.22 0.04 117.51 121.54 2hpg h ILE 263 Ca 0.23 -0.01 0.07 0.00 1.00 0.00 0.00 64.86 66.16 2hpg h ILE 263 Cb -0.10 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 36.62 2hpg h ILE 263 CO -0.05 0.00 -0.04 0.40 0.00 0.00 0.00 178.15 178.47 2hpg h ILE 264 N -0.42 0.67 -0.06 -0.67 2.04 -0.94 0.25 117.51 118.39 2hpg h ILE 264 Ca -0.04 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2hpg h ILE 264 Cb 0.32 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 2hpg h ILE 264 CO 0.07 0.01 -0.02 -0.33 0.00 0.00 0.00 178.15 177.88 2hpg h GLU 265 N 0.06 0.11 -0.65 2.37 5.08 -1.32 -3.25 114.58 116.98 2hpg h GLU 265 Ca 0.19 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.52 2hpg h GLU 265 Cb 0.28 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 2hpg h GLU 265 CO -0.35 0.46 0.42 0.93 -1.00 0.00 0.00 179.01 179.48 2hpg h GLU 266 N -0.24 0.83 -1.50 2.33 5.08 -0.79 -1.56 114.58 118.72 2hpg h GLU 266 Ca 0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2hpg h GLU 266 Cb 0.42 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2hpg h GLU 266 CO 0.01 0.55 0.00 0.39 -1.00 0.00 0.00 179.01 178.95 2hpg n GLU 267 N -4.66 0.39 0.00 2.33 -0.58 0.06 -2.02 120.64 116.16 2hpg n GLU 267 Ca 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 2hpg n GLU 267 Cb 0.04 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 29.62 2hpg n GLU 267 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2hpg n ASP 269 N 0.76 0.00 0.05 1.62 8.00 -0.59 -1.15 116.55 125.24 2hpg n ASP 269 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 2hpg n ASP 269 Cb 0.18 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.20 2hpg n ASP 269 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2hpg h LYS 270 N 0.00 -0.09 -0.82 -1.24 3.64 -1.67 -0.53 116.57 115.86 2hpg h LYS 270 Ca 0.00 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2hpg h LYS 270 Cb 0.00 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2hpg h LYS 270 CO 0.00 0.12 0.48 0.00 -2.27 0.00 0.00 179.45 177.78 2hpg h ALA 271 N 0.62 1.05 0.19 5.00 0.00 -1.41 -2.44 119.26 122.27 2hpg h ALA 271 Ca -0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2hpg h ALA 271 Cb 0.25 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2hpg h ALA 271 CO 0.02 0.53 -0.09 0.78 0.00 0.00 0.00 179.25 180.49 2hpg h GLY 272 N 1.13 -0.27 0.57 0.00 0.00 -1.78 -2.01 103.07 100.71 2hpg h GLY 272 Ca 0.29 0.10 0.10 0.00 0.00 0.00 0.00 47.33 47.82 2hpg h GLY 272 CO -0.05 -0.10 0.61 -2.22 0.00 0.00 0.00 176.54 174.78 2hpg h ILE 273 N -0.41 0.97 0.19 2.60 2.04 -0.98 0.46 117.51 122.38 2hpg h ILE 273 Ca -0.03 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2hpg h ILE 273 Cb 0.31 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 2hpg h ILE 273 CO 0.04 0.19 -0.09 -0.08 0.00 0.00 0.00 178.15 178.21 2hpg h GLU 274 N 1.02 -0.25 -0.28 2.37 4.81 -1.37 -1.92 114.58 118.95 2hpg h GLU 274 Ca 0.46 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.59 2hpg h GLU 274 Cb 0.36 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2hpg h GLU 274 CO -0.23 -0.05 -0.30 -0.24 -0.73 0.00 0.00 179.01 177.46 2hpg h VAL 275 N -0.41 1.28 -0.35 0.32 3.04 -1.20 -1.73 116.25 117.19 2hpg h VAL 275 Ca -0.03 -1.41 0.04 0.00 -1.01 0.00 0.00 66.70 64.30 2hpg h VAL 275 Cb 0.32 1.40 -0.04 0.00 -2.01 0.00 0.00 31.29 30.95 2hpg h VAL 275 CO 0.04 0.45 0.12 0.28 -1.01 0.00 0.00 177.57 177.45 2hpg h SER 276 N 0.50 0.13 -0.43 3.17 0.02 -0.85 0.07 113.55 116.16 2hpg h SER 276 Ca 0.06 0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 60.95 2hpg h SER 276 Cb 0.78 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 2hpg h SER 276 CO 0.06 0.11 -0.13 -0.07 -1.14 0.00 0.00 176.83 175.66 2hpg h LEU 277 N 0.27 0.87 -0.54 5.07 3.38 -1.25 -3.00 115.31 120.10 2hpg h LEU 277 Ca 0.16 -0.37 0.07 0.00 0.09 0.00 0.00 57.88 57.82 2hpg h LEU 277 Cb 0.14 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 2hpg h LEU 277 CO -0.17 1.04 0.23 0.50 0.09 0.00 0.00 178.44 180.14 2hpg h LYS 278 N 0.68 0.42 -0.19 1.13 3.64 -1.02 0.40 116.57 121.64 2hpg h LYS 278 Ca 0.11 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2hpg h LYS 278 Cb 0.68 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2hpg h LYS 278 CO 0.05 0.28 0.00 -0.89 -2.27 0.00 0.00 179.45 176.62 2hpg n ILE 279 N -4.95 0.00 0.00 2.00 5.41 -0.01 -0.48 119.36 121.32 2hpg n ILE 279 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.81 2hpg n ILE 279 Cb 0.20 -0.25 0.00 0.00 -0.71 0.00 0.00 39.64 38.88 2hpg n ILE 279 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2hpg n LYS 281 N -0.06 0.00 0.02 0.38 5.02 0.13 -1.66 118.16 121.98 2hpg n LYS 281 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 2hpg n LYS 281 Cb 0.05 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.05 2hpg n LYS 281 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2hpg n GLU 282 N -0.25 0.08 -0.10 1.97 1.02 0.36 -4.80 120.64 118.93 2hpg n GLU 282 Ca 0.00 0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 2hpg n GLU 282 Cb 0.00 -0.63 -0.04 0.00 -0.02 0.00 0.00 31.44 30.75 2hpg n GLU 282 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2hpg h LEU 283 N -0.14 0.85 -0.96 -4.62 3.38 -0.93 -2.39 115.31 110.51 2hpg h LEU 283 Ca -0.03 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 2hpg h LEU 283 Cb 0.38 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2hpg h LEU 283 CO -0.02 1.16 0.26 -0.33 0.09 0.00 0.00 178.44 179.60 2hpg h GLU 284 N 0.56 1.02 -0.76 1.13 4.39 -1.57 -1.14 114.58 118.21 2hpg h GLU 284 Ca 0.05 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2hpg h GLU 284 Cb 0.93 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.37 2hpg h GLU 284 CO 0.08 0.84 0.45 1.49 -1.16 0.00 0.00 179.01 180.71 2hpg h GLU 285 N 1.00 1.03 0.43 2.33 4.57 -1.79 -0.72 114.58 121.44 2hpg h GLU 285 Ca 0.23 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.29 2hpg h GLU 285 Cb 0.21 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2hpg h GLU 285 CO -0.02 0.74 -0.21 0.93 -1.18 0.00 0.00 179.01 179.27 2hpg h GLU 286 N 1.04 -0.57 -0.81 1.92 5.08 -0.88 -1.57 114.58 118.80 2hpg h GLU 286 Ca 0.27 0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.80 2hpg h GLU 286 Cb -0.02 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.27 2hpg h GLU 286 CO -0.05 -0.38 0.41 1.88 -1.00 0.00 0.00 179.01 179.87 2hpg h TYR 287 N -0.59 0.72 -0.66 4.33 0.05 -1.13 -0.52 116.97 119.17 2hpg h TYR 287 Ca -0.06 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.80 2hpg h TYR 287 Cb 0.46 -0.20 -0.05 0.00 1.01 0.00 0.00 36.73 37.95 2hpg h TYR 287 CO -0.05 0.20 0.39 -0.22 -1.05 0.00 0.00 178.16 177.43 2hpg h LYS 288 N 0.62 0.73 -0.47 4.88 3.64 -0.93 0.29 116.57 125.34 2hpg h LYS 288 Ca 0.43 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.66 2hpg h LYS 288 Cb 0.55 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 2hpg h LYS 288 CO -0.33 0.48 -0.11 1.96 -2.27 0.00 0.00 179.45 179.18 2hpg h GLN 289 N 0.75 0.86 -0.37 1.90 4.20 -0.53 -1.35 115.11 120.56 2hpg h GLN 289 Ca 0.28 -0.30 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2hpg h GLN 289 Cb 0.08 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2hpg h GLN 289 CO -0.13 0.93 -0.08 0.87 -0.67 0.00 0.00 178.83 179.74 2hpg h LYS 290 N 0.77 0.64 -0.34 1.46 1.57 -0.71 -1.81 116.57 118.15 2hpg h LYS 290 Ca 0.13 -0.18 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 2hpg h LYS 290 Cb 0.62 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 2hpg h LYS 290 CO 0.04 0.71 -0.02 0.00 -0.57 0.00 0.00 179.45 179.61 2hpg h ILE 292 N 0.42 1.14 -0.28 0.00 2.04 -1.12 -1.98 117.51 117.72 2hpg h ILE 292 Ca 0.09 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 2hpg h ILE 292 Cb 0.49 -0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 2hpg h ILE 292 CO 0.02 0.21 0.05 -0.33 0.00 0.00 0.00 178.15 178.11 2hpg h GLU 293 N 1.17 0.40 0.00 2.37 5.08 -1.15 -1.69 114.58 120.76 2hpg h GLU 293 Ca 0.38 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2hpg h GLU 293 Cb 0.05 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2hpg h GLU 293 CO -0.13 0.39 0.00 1.63 -1.00 0.00 0.00 179.01 179.91 2hpg n LYS 294 N -4.36 0.81 0.00 2.33 4.76 -0.77 -5.11 118.16 115.82 2hpg n LYS 294 Ca 0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 2hpg n LYS 294 Cb 0.18 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 2hpg n LYS 294 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hpg n GLY 295 N 0.98 0.54 3.05 0.72 0.00 -0.64 -5.00 105.19 104.85 2hpg n GLY 295 Ca 0.20 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.43 2hpg n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpg s ALA 297 N 0.00 -0.44 -0.17 4.61 0.00 -0.50 -5.00 121.76 120.26 2hpg s ALA 297 Ca 0.00 0.52 -0.02 0.00 0.00 0.00 0.00 51.96 52.46 2hpg s ALA 297 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2hpg s ALA 297 CO 0.00 -0.09 -0.09 0.08 0.00 0.00 0.00 175.76 175.66 2hpg s VAL 298 N 0.17 3.21 -0.43 0.00 1.01 -1.26 -4.26 120.40 118.84 2hpg s VAL 298 Ca -0.01 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.18 2hpg s VAL 298 Cb -0.02 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 33.98 2hpg s VAL 298 CO -0.00 0.48 0.70 -0.63 0.00 0.00 0.00 175.10 175.65 2hpg s ILE 299 N 0.84 4.77 0.56 2.22 -1.09 -1.26 -5.01 121.20 122.24 2hpg s ILE 299 Ca -0.03 0.33 -0.16 0.00 -2.23 0.00 0.00 60.65 58.56 2hpg s ILE 299 Cb -0.15 -4.22 -0.05 0.00 -1.58 0.00 0.00 42.46 36.46 2hpg s ILE 299 CO 0.01 -0.58 1.04 -2.16 -1.23 0.00 0.00 174.94 172.01 2hpg s PRO 300 N 2.97 3.52 0.43 2.79 0.04 -1.26 -0.68 135.00 142.82 2hpg s PRO 300 Ca 0.26 1.16 0.23 0.00 0.04 0.00 0.00 61.00 62.69 2hpg s PRO 300 Cb -0.13 -2.06 1.23 0.00 0.04 0.00 0.00 34.50 33.57 2hpg s PRO 300 CO 0.19 -0.64 1.75 0.00 0.04 0.00 0.00 177.00 178.35 2hpg h ALA 301 N 0.67 2.47 0.00 8.56 0.00 -1.95 -1.19 119.26 127.81 2hpg h ALA 301 Ca -0.47 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 2hpg h ALA 301 Cb 1.21 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2hpg h ALA 301 CO 0.59 -0.90 -0.15 0.66 0.00 0.00 0.00 179.25 179.45 2hpg h SER 302 N 0.28 0.00 -0.02 0.00 4.64 -1.91 -2.13 113.55 114.40 2hpg h SER 302 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 2hpg h SER 302 Cb 1.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 2hpg h SER 302 CO -0.27 0.15 0.00 -0.62 -0.87 0.00 0.00 176.83 175.23 2hpg n GLU 303 N -3.60 1.76 -4.57 4.77 1.02 -0.45 -4.93 120.64 114.64 2hpg n GLU 303 Ca -0.01 -1.10 -0.34 0.00 -0.02 0.00 0.00 57.16 55.69 2hpg n GLU 303 Cb 0.29 -1.48 -0.12 0.00 -0.02 0.00 0.00 31.44 30.11 2hpg n GLU 303 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2hpg s ILE 304 N -1.99 3.65 -1.39 -3.67 1.01 -0.80 -4.86 121.20 113.14 2hpg s ILE 304 Ca 0.37 -0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.39 2hpg s ILE 304 Cb 0.21 -2.55 0.05 0.00 0.01 0.00 0.00 42.46 40.18 2hpg s ILE 304 CO 0.33 0.54 2.04 -0.67 0.00 0.00 0.00 174.94 177.18 2hpg n ASP 305 N 3.01 4.28 0.14 3.58 -0.08 -0.38 -4.78 116.55 122.32 2hpg n ASP 305 Ca -0.18 -2.87 0.04 0.00 -1.51 0.00 0.00 54.79 50.27 2hpg n ASP 305 Cb 0.53 -1.69 0.45 0.00 2.34 0.00 0.00 41.12 42.74 2hpg n ASP 305 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2hpg h LYS 306 N 6.63 0.21 -0.53 -0.67 1.57 -1.88 -2.04 116.57 119.86 2hpg h LYS 306 Ca 0.52 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 59.24 2hpg h LYS 306 Cb 0.73 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 2hpg h LYS 306 CO 1.72 0.29 0.23 1.49 -0.57 0.00 0.00 179.45 182.61 2hpg h GLU 307 N 0.21 0.79 -0.69 3.15 4.57 -2.00 -2.28 114.58 118.33 2hpg h GLU 307 Ca 0.05 -0.14 0.09 0.00 -1.18 0.00 0.00 59.36 58.18 2hpg h GLU 307 Cb 0.25 -0.13 -0.07 0.00 -0.16 0.00 0.00 28.75 28.63 2hpg h GLU 307 CO 0.01 0.68 0.33 0.00 -1.18 0.00 0.00 179.01 178.85 2hpg h ALA 308 N 1.07 0.93 0.00 2.92 0.00 -1.79 -0.93 119.26 121.46 2hpg h ALA 308 Ca 0.18 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2hpg h ALA 308 Cb 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2hpg h ALA 308 CO -0.02 -0.07 0.00 1.19 0.00 0.00 0.00 179.25 180.35 2hpg n PHE 309 N -4.89 0.00 0.00 0.00 3.72 -0.86 -2.06 117.46 113.37 2hpg n PHE 309 Ca 0.10 -0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2hpg n PHE 309 Cb 0.27 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2hpg n PHE 309 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2hpg n GLU 311 N 0.83 0.00 -0.31 -1.08 1.02 -0.36 -1.05 120.64 119.69 2hpg n GLU 311 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 2hpg n GLU 311 Cb 0.12 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.62 2hpg n GLU 311 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2hpg h LYS 312 N 0.00 1.15 -0.20 3.49 1.79 -1.69 -2.78 116.57 118.33 2hpg h LYS 312 Ca 0.00 -0.10 0.05 0.00 -2.18 0.00 0.00 60.65 58.42 2hpg h LYS 312 Cb 0.00 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.40 2hpg h LYS 312 CO 0.00 0.80 0.14 0.00 -1.08 0.00 0.00 179.45 179.31 2hpg h ALA 313 N 1.29 2.13 -0.82 3.86 0.00 -1.34 -2.41 119.26 121.96 2hpg h ALA 313 Ca 0.31 -0.01 0.20 0.00 0.00 0.00 0.00 54.91 55.41 2hpg h ALA 313 Cb -0.07 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2hpg h ALA 313 CO -0.06 -0.18 0.56 0.87 0.00 0.00 0.00 179.25 180.45 2hpg h LYS 314 N 0.05 0.21 0.00 0.00 1.57 -1.77 -1.63 116.57 115.00 2hpg h LYS 314 Ca 0.09 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 2hpg h LYS 314 Cb 0.31 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2hpg h LYS 314 CO -0.01 0.14 -0.31 0.37 -0.57 0.00 0.00 179.45 179.07 2hpg h GLN 315 N 0.22 0.00 -0.30 3.15 5.75 -1.62 -2.16 115.11 120.15 2hpg h GLN 315 Ca 0.41 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.78 2hpg h GLN 315 Cb 1.26 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.80 2hpg h GLN 315 CO -0.09 0.31 -0.33 0.00 -2.65 0.00 0.00 178.83 176.07 2hpg h ALA 316 N 1.69 0.87 -0.02 3.38 0.00 -1.47 -0.10 119.26 123.61 2hpg h ALA 316 Ca -0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2hpg h ALA 316 Cb 0.62 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2hpg h ALA 316 CO 0.04 0.63 0.00 1.88 0.00 0.00 0.00 179.25 181.81 2hpg h TYR 317 N 0.54 0.04 -0.25 0.00 0.05 -1.45 -2.17 116.97 113.74 2hpg h TYR 317 Ca 0.06 -0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.88 2hpg h TYR 317 Cb 0.83 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 38.51 2hpg h TYR 317 CO 0.04 0.28 -0.03 0.87 -1.05 0.00 0.00 178.16 178.26 2hpg h LYS 318 N -0.20 0.03 -0.14 4.88 1.79 -1.37 0.25 116.57 121.80 2hpg h LYS 318 Ca 0.01 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 2hpg h LYS 318 Cb 0.26 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 2hpg h LYS 318 CO 0.00 0.02 0.01 -0.91 -1.08 0.00 0.00 179.45 177.49 2hpg h ASN 319 N 0.03 0.18 -0.03 0.86 2.35 -0.94 -2.46 115.58 115.57 2hpg h ASN 319 Ca 0.12 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2hpg h ASN 319 Cb 0.17 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2hpg h ASN 319 CO -0.23 0.21 -0.13 0.18 -1.65 0.00 0.00 177.43 175.81 2hpg n LEU 320 N -4.43 2.70 -1.40 1.61 4.77 -0.82 -4.98 117.00 114.45 2hpg n LEU 320 Ca -0.01 -0.93 -0.06 0.00 -0.03 0.00 0.00 56.01 54.98 2hpg n LEU 320 Cb 0.15 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 2hpg n LEU 320 CO 0.36 0.46 0.06 0.61 -1.33 0.00 0.00 177.39 177.55 2hpg n GLY 321 N 1.35 0.48 0.00 -0.72 0.00 -0.42 -4.98 105.19 100.90 2hpg n GLY 321 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2hpg n GLY 321 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hpg n LEU 322 N -1.73 1.10 0.11 0.99 4.77 0.73 -4.71 117.00 118.26 2hpg n LEU 322 Ca -0.02 -1.10 -0.04 0.00 -0.03 0.00 0.00 56.01 54.83 2hpg n LEU 322 Cb 0.52 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.71 2hpg n LEU 322 CO 0.17 0.27 0.42 -0.08 -1.33 0.00 0.00 177.39 176.84 2hpg h GLU 323 N 0.00 0.07 -0.33 3.23 4.57 -1.91 -2.27 114.58 117.93 2hpg h GLU 323 Ca 0.00 -0.06 -0.16 0.00 -1.18 0.00 0.00 59.36 57.96 2hpg h GLU 323 Cb 0.49 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 2hpg h GLU 323 CO 0.00 0.74 -0.43 -0.91 -1.18 0.00 0.00 179.01 177.23 2hpg h ASN 324 N 0.05 0.91 -0.13 1.04 4.21 -1.93 -1.60 115.58 118.14 2hpg h ASN 324 Ca -0.01 -0.43 0.02 0.00 1.21 0.00 0.00 56.30 57.08 2hpg h ASN 324 Cb 1.24 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 38.16 2hpg h ASN 324 CO 0.10 1.21 0.02 0.00 -1.29 0.00 0.00 177.43 177.46 2hpg h ALA 325 N 0.83 0.12 0.03 -0.83 0.00 -1.84 -0.71 119.26 116.86 2hpg h ALA 325 Ca 0.05 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2hpg h ALA 325 Cb 1.01 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 2hpg h ALA 325 CO 0.10 -0.43 -0.23 1.25 0.00 0.00 0.00 179.25 179.93 2hpg h LEU 326 N 0.07 -0.67 -1.36 0.00 5.85 -1.36 -2.02 115.31 115.82 2hpg h LEU 326 Ca 0.06 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 2hpg h LEU 326 Cb 0.05 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2hpg h LEU 326 CO -0.08 -0.30 0.12 0.78 -0.34 0.00 0.00 178.44 178.61 2hpg h ASN 327 N -0.38 0.50 -0.32 1.25 2.35 -1.16 -0.88 115.58 116.94 2hpg h ASN 327 Ca 0.05 -0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.60 2hpg h ASN 327 Cb 0.45 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2hpg h ASN 327 CO -0.19 0.49 -0.34 -0.61 -1.65 0.00 0.00 177.43 175.13 2hpg h GLN 328 N 0.55 0.85 -0.43 0.81 5.75 -0.92 -1.49 115.11 120.23 2hpg h GLN 328 Ca 0.13 -0.42 -0.09 0.00 -0.15 0.00 0.00 58.65 58.13 2hpg h GLN 328 Cb 0.17 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 2hpg h GLN 328 CO -0.01 1.06 -0.07 -0.07 -2.65 0.00 0.00 178.83 177.09 2hpg h LEU 329 N 0.71 0.81 -0.07 -2.39 3.38 -0.70 -2.25 115.31 114.81 2hpg h LEU 329 Ca 0.07 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.71 2hpg h LEU 329 Cb 0.90 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2hpg h LEU 329 CO 0.08 0.97 -0.03 0.40 0.09 0.00 0.00 178.44 179.95 2hpg h ILE 330 N 0.64 0.89 -0.21 1.22 2.04 -1.09 -0.52 117.51 120.48 2hpg h ILE 330 Ca 0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.03 2hpg h ILE 330 Cb 0.59 0.89 -0.07 0.00 -0.74 0.00 0.00 36.82 37.50 2hpg h ILE 330 CO 0.04 0.00 -0.23 0.50 0.00 0.00 0.00 178.15 178.45 2hpg h LYS 331 N -0.03 -0.24 -0.04 2.37 3.64 -1.24 -1.57 116.57 119.46 2hpg h LYS 331 Ca 0.04 0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.32 2hpg h LYS 331 Cb 0.09 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2hpg h LYS 331 CO -0.09 -0.16 -0.53 0.93 -2.27 0.00 0.00 179.45 177.33 2hpg h GLU 332 N -0.25 0.10 -0.19 1.90 5.08 -1.16 -2.26 114.58 117.79 2hpg h GLU 332 Ca 0.13 -0.06 -0.20 0.00 -1.00 0.00 0.00 59.36 58.23 2hpg h GLU 332 Cb 0.45 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2hpg h GLU 332 CO -0.36 0.61 -0.67 0.28 -1.00 0.00 0.00 179.01 177.87 2hpg h VAL 333 N 0.08 1.29 -0.98 3.13 2.07 -0.89 -2.88 116.25 118.07 2hpg h VAL 333 Ca -0.00 -1.90 0.03 0.00 0.82 0.00 0.00 66.70 65.66 2hpg h VAL 333 Cb 0.96 1.86 -0.06 0.00 -1.52 0.00 0.00 31.29 32.54 2hpg h VAL 333 CO 0.07 0.60 0.64 0.11 0.02 0.00 0.00 177.57 179.02 2hpg h LYS 334 N 0.54 1.22 0.00 1.57 1.57 -1.14 -2.67 116.57 117.65 2hpg h LYS 334 Ca -0.02 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2hpg h LYS 334 Cb 1.28 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 2hpg h LYS 334 CO 0.14 0.80 -0.05 0.78 -0.57 0.00 0.00 179.45 180.55 2hpg h GLY 335 N 1.25 0.00 -0.14 3.86 0.00 -1.20 -3.52 103.07 103.33 2hpg h GLY 335 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 2hpg h GLY 335 CO -0.11 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.61