#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r8r s ARG 1 N 0.00 3.95 0.30 0.00 0.52 -1.26 -4.52 118.95 117.94 2r8r s ARG 1 Ca 0.00 1.94 -0.29 0.00 -0.52 0.00 0.00 55.73 56.85 2r8r s ARG 1 Cb 0.00 -2.65 -0.11 0.00 0.52 0.00 0.00 34.95 32.71 2r8r s ARG 1 CO 0.00 -0.43 1.50 0.20 0.02 0.00 0.00 175.30 176.58 2r8r s GLY 2 N -1.04 2.44 -0.16 -3.53 0.00 -0.90 -4.91 107.32 99.21 2r8r s GLY 2 Ca 0.58 1.47 -0.03 0.00 0.00 0.00 0.00 44.72 46.74 2r8r s GLY 2 CO 0.41 2.34 -0.05 0.50 0.00 0.00 0.00 173.10 176.31 2r8r s ARG 3 N -0.92 3.60 -0.18 2.90 0.52 -1.26 -4.92 118.95 118.69 2r8r s ARG 3 Ca 0.58 -0.55 -0.15 0.00 -0.52 0.00 0.00 55.73 55.09 2r8r s ARG 3 Cb -0.45 -2.90 -0.04 0.00 0.52 0.00 0.00 34.95 32.08 2r8r s ARG 3 CO 0.50 0.18 0.35 -1.17 0.02 0.00 0.00 175.30 175.18 2r8r s LEU 4 N 0.52 4.20 -0.19 2.53 2.96 -1.26 -1.33 118.68 126.12 2r8r s LEU 4 Ca -0.04 0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 54.37 2r8r s LEU 4 Cb -0.14 -2.45 -0.00 0.00 0.50 0.00 0.00 46.19 44.09 2r8r s LEU 4 CO 0.03 0.01 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.21 2r8r s LYS 5 N 0.88 3.27 -0.23 1.98 2.20 -0.18 -1.51 119.74 126.16 2r8r s LYS 5 Ca 0.18 -0.70 -0.08 0.00 -0.36 0.00 0.00 55.97 55.02 2r8r s LYS 5 Cb -0.14 -2.81 -0.04 0.00 -1.51 0.00 0.00 37.83 33.34 2r8r s LYS 5 CO 0.06 -0.11 0.08 0.08 -0.36 0.00 0.00 175.35 175.10 2r8r s VAL 6 N 1.18 4.56 -0.53 4.02 1.01 -0.59 -0.92 120.40 129.14 2r8r s VAL 6 Ca 0.02 -0.10 -0.21 0.00 0.00 0.00 0.00 61.98 61.69 2r8r s VAL 6 Cb -0.14 -3.11 0.05 0.00 0.00 0.00 0.00 36.38 33.18 2r8r s VAL 6 CO -0.04 0.38 0.76 -0.36 0.00 0.00 0.00 175.10 175.84 2r8r s PHE 7 N 1.16 2.94 -0.04 5.22 0.08 0.55 -0.73 117.98 127.16 2r8r s PHE 7 Ca 0.05 -0.31 -0.14 0.00 0.12 0.00 0.00 56.93 56.64 2r8r s PHE 7 Cb -0.14 -3.77 -0.05 0.00 -0.57 0.00 0.00 43.02 38.48 2r8r s PHE 7 CO 0.04 -1.17 0.37 -1.17 -0.10 0.00 0.00 175.22 173.18 2r8r s LEU 8 N 3.21 4.43 0.09 -0.37 2.96 0.66 -2.10 118.68 127.56 2r8r s LEU 8 Ca 0.22 0.85 -0.01 0.00 -0.22 0.00 0.00 54.13 54.96 2r8r s LEU 8 Cb -0.16 -2.51 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 2r8r s LEU 8 CO 0.15 0.29 0.01 -0.83 -1.32 0.00 0.00 176.35 174.65 2r8r s GLY 9 N -0.78 0.70 0.28 7.98 0.00 -0.72 -0.38 107.32 114.40 2r8r s GLY 9 Ca 0.22 -1.32 0.15 0.00 0.00 0.00 0.00 44.72 43.77 2r8r s GLY 9 CO 0.11 -1.33 1.51 0.00 0.00 0.00 0.00 173.10 173.39 2r8r h ALA 10 N 3.02 0.72 -2.02 3.20 0.00 -1.84 0.69 119.26 123.03 2r8r h ALA 10 Ca -0.34 -0.50 0.20 0.00 0.00 0.00 0.00 54.91 54.26 2r8r h ALA 10 Cb 1.17 -0.09 -0.13 0.00 0.00 0.00 0.00 17.79 18.74 2r8r h ALA 10 CO 0.63 0.69 0.60 0.00 0.00 0.00 0.00 179.25 181.17 2r8r s ALA 11 N -3.13 -1.88 0.28 0.00 0.00 -1.26 -4.45 121.76 111.31 2r8r s ALA 11 Ca 0.02 0.75 -0.30 0.00 0.00 0.00 0.00 51.96 52.43 2r8r s ALA 11 Cb 0.09 0.39 -0.13 0.00 0.00 0.00 0.00 23.12 23.48 2r8r s ALA 11 CO 0.74 -0.86 1.45 -2.30 0.00 0.00 0.00 175.76 174.79 2r8r n PRO 12 N -0.34 2.28 -0.10 0.00 -0.02 -1.26 -3.43 135.00 132.13 2r8r n PRO 12 Ca -0.06 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2r8r n PRO 12 Cb 0.61 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2r8r n PRO 12 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r8r n GLY 13 N 1.88 0.63 0.01 -1.23 0.00 -1.26 -4.97 105.19 100.25 2r8r n GLY 13 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 2r8r n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2r8r n VAL 14 N -2.02 0.05 0.00 1.61 0.24 -1.22 -4.93 118.33 112.06 2r8r n VAL 14 Ca 0.00 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2r8r n VAL 14 Cb 0.00 -0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.11 2r8r n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2r8r n GLY 15 N 1.48 1.32 0.11 7.63 0.00 -1.26 -4.68 105.19 109.79 2r8r n GLY 15 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 2r8r n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2r8r h LYS 16 N 0.00 -0.17 -0.35 1.61 1.57 -1.92 -1.80 116.57 115.51 2r8r h LYS 16 Ca 0.00 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2r8r h LYS 16 Cb 0.00 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2r8r h LYS 16 CO 0.00 -0.11 0.09 1.15 -0.57 0.00 0.00 179.45 180.01 2r8r h THR 17 N -0.18 1.22 -0.45 -0.16 2.02 -1.94 -2.83 112.91 110.59 2r8r h THR 17 Ca -0.01 -0.73 0.06 0.00 0.77 0.00 0.00 66.41 66.49 2r8r h THR 17 Cb 0.15 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 67.55 2r8r h THR 17 CO 0.01 0.25 0.16 0.22 0.37 0.00 0.00 175.52 176.53 2r8r h TYR 18 N 0.41 0.28 0.00 3.16 3.20 -1.94 -0.40 116.97 121.68 2r8r h TYR 18 Ca 0.11 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2r8r h TYR 18 Cb 0.29 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.50 2r8r h TYR 18 CO 0.01 0.10 0.00 0.00 -1.64 0.00 0.00 178.16 176.63 2r8r n ALA 19 N -2.39 1.16 0.00 1.82 0.00 -0.68 -1.14 120.51 119.28 2r8r n ALA 19 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2r8r n ALA 19 Cb 0.17 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2r8r n ALA 19 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2r8r n LEU 21 N 0.73 0.00 -0.19 0.00 4.77 -0.16 -1.28 117.00 120.87 2r8r n LEU 21 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 2r8r n LEU 21 Cb 0.00 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2r8r n LEU 21 CO 0.00 0.00 0.86 1.56 -1.33 0.00 0.00 177.39 178.48 2r8r h GLN 22 N 0.00 1.00 -0.74 3.23 1.08 -1.39 -1.38 115.11 116.90 2r8r h GLN 22 Ca 0.00 -0.29 -0.04 0.00 -1.45 0.00 0.00 58.65 56.88 2r8r h GLN 22 Cb 0.00 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.29 2r8r h GLN 22 CO 0.00 0.96 0.31 0.00 -0.95 0.00 0.00 178.83 179.15 2r8r h ALA 23 N 1.10 1.15 -0.31 3.87 0.00 -1.44 -2.46 119.26 121.17 2r8r h ALA 23 Ca 0.17 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2r8r h ALA 23 Cb 0.49 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2r8r h ALA 23 CO 0.02 0.62 -0.28 0.00 0.00 0.00 0.00 179.25 179.61 2r8r h ALA 24 N 1.27 0.94 -0.54 0.00 0.00 -1.74 -2.42 119.26 116.78 2r8r h ALA 24 Ca 0.25 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 2r8r h ALA 24 Cb 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2r8r h ALA 24 CO -0.02 0.61 -0.09 0.45 0.00 0.00 0.00 179.25 180.20 2r8r h HIS 25 N 0.55 1.09 -0.29 0.00 -0.00 -1.11 0.04 115.15 115.43 2r8r h HIS 25 Ca 0.07 -0.21 0.01 0.00 -0.00 0.00 0.00 60.37 60.24 2r8r h HIS 25 Cb 0.76 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.87 2r8r h HIS 25 CO 0.03 1.01 0.16 0.00 -0.00 0.00 0.00 177.93 179.14 2r8r h ALA 26 N 1.00 0.36 -0.84 2.45 0.00 -1.20 -0.49 119.26 120.54 2r8r h ALA 26 Ca 0.14 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2r8r h ALA 26 Cb 0.64 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2r8r h ALA 26 CO 0.04 -0.21 0.56 1.96 0.00 0.00 0.00 179.25 181.60 2r8r h GLN 27 N 0.34 1.09 -0.50 0.00 1.08 -1.22 -2.45 115.11 113.46 2r8r h GLN 27 Ca 0.11 -0.07 0.01 0.00 -1.45 0.00 0.00 58.65 57.26 2r8r h GLN 27 Cb 0.01 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 27.16 2r8r h GLN 27 CO -0.06 0.72 0.32 1.25 -0.95 0.00 0.00 178.83 180.12 2r8r h LEU 28 N 1.12 0.55 -1.60 1.46 5.85 -0.48 -1.63 115.31 120.59 2r8r h LEU 28 Ca 0.31 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 2r8r h LEU 28 Cb -0.11 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 2r8r h LEU 28 CO -0.08 0.40 0.23 0.03 -0.34 0.00 0.00 178.44 178.68 2r8r h ARG 29 N 0.66 0.49 -0.23 1.25 3.08 -0.81 -0.77 114.38 118.05 2r8r h ARG 29 Ca 0.19 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2r8r h ARG 29 Cb -0.05 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2r8r h ARG 29 CO -0.05 0.34 0.00 1.04 -1.07 0.00 0.00 179.97 180.23 2r8r n GLN 30 N -4.46 1.40 -0.44 0.04 6.02 -0.86 -4.90 117.38 114.18 2r8r n GLN 30 Ca 0.02 -0.56 0.00 0.00 -0.01 0.00 0.00 57.00 56.46 2r8r n GLN 30 Cb 0.07 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 30.16 2r8r n GLN 30 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2r8r n GLY 31 N 0.68 0.75 3.74 1.08 0.00 -0.29 -5.05 105.19 106.09 2r8r n GLY 31 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2r8r n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r8r s VAL 32 N -2.41 3.40 -0.86 1.61 1.01 -0.67 -4.94 120.40 117.54 2r8r s VAL 32 Ca 0.00 1.15 -0.25 0.00 0.00 0.00 0.00 61.98 62.88 2r8r s VAL 32 Cb 0.00 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.65 2r8r s VAL 32 CO 0.00 0.17 1.61 -0.13 0.00 0.00 0.00 175.10 176.75 2r8r s ARG 33 N -0.07 3.08 0.61 2.72 0.52 -1.26 -4.41 118.95 120.13 2r8r s ARG 33 Ca 0.55 -0.43 0.05 0.00 -0.52 0.00 0.00 55.73 55.37 2r8r s ARG 33 Cb -0.35 -4.87 0.11 0.00 0.52 0.00 0.00 34.95 30.37 2r8r s ARG 33 CO 0.37 -2.59 0.84 0.28 0.02 0.00 0.00 175.30 174.22 2r8r n VAL 34 N 7.09 0.00 -3.86 3.52 0.31 -1.26 -1.02 118.33 123.10 2r8r n VAL 34 Ca 0.26 -1.65 -0.26 0.00 -0.01 0.00 0.00 64.34 62.69 2r8r n VAL 34 Cb 0.50 -0.73 -0.17 0.00 -0.91 0.00 0.00 33.84 32.53 2r8r n VAL 34 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2r8r s ALA 36 N -2.90 1.16 -0.18 3.52 0.00 -0.13 -4.25 121.76 118.98 2r8r s ALA 36 Ca 0.60 -0.47 -0.16 0.00 0.00 0.00 0.00 51.96 51.93 2r8r s ALA 36 Cb -0.04 -0.91 -0.11 0.00 0.00 0.00 0.00 23.12 22.06 2r8r s ALA 36 CO 0.39 -0.51 0.02 0.41 0.00 0.00 0.00 175.76 176.06 2r8r n GLY 37 N 5.00 -0.89 2.98 0.00 0.00 0.47 -0.79 105.19 111.95 2r8r n GLY 37 Ca -0.11 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 2r8r n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r8r s VAL 38 N -2.31 -0.18 -0.04 1.61 0.11 -0.75 -4.59 120.40 114.24 2r8r s VAL 38 Ca -0.22 0.23 -0.01 0.00 -2.93 0.00 0.00 61.98 59.05 2r8r s VAL 38 Cb 0.04 -0.35 0.03 0.00 -1.53 0.00 0.00 36.38 34.57 2r8r s VAL 38 CO 0.41 0.10 0.02 -0.69 -3.33 0.00 0.00 175.10 171.61 2r8r s VAL 39 N 1.75 0.14 -0.48 2.04 1.01 -1.26 -0.37 120.40 123.23 2r8r s VAL 39 Ca -0.04 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 2r8r s VAL 39 Cb -0.11 -0.29 0.07 0.00 0.00 0.00 0.00 36.38 36.04 2r8r s VAL 39 CO -0.08 0.18 0.47 -1.61 0.00 0.00 0.00 175.10 174.06 2r8r s GLU 40 N 1.52 3.03 0.28 2.72 0.41 -1.26 -4.93 118.70 120.48 2r8r s GLU 40 Ca -0.03 -1.18 0.23 0.00 -0.41 0.00 0.00 54.97 53.58 2r8r s GLU 40 Cb -0.13 -4.12 0.16 0.00 -1.78 0.00 0.00 34.13 28.26 2r8r s GLU 40 CO -0.03 -1.09 1.28 1.79 -0.49 0.00 0.00 175.26 176.72 2r8r h THR 41 N 5.79 0.00 -5.79 3.63 1.35 -1.94 -3.48 112.91 112.47 2r8r h THR 41 Ca -0.28 -0.96 -0.44 0.00 -0.55 0.00 0.00 66.41 64.18 2r8r h THR 41 Cb 1.11 1.65 0.01 0.00 -1.73 0.00 0.00 68.15 69.19 2r8r h THR 41 CO 0.91 0.00 -0.69 1.41 -0.25 0.00 0.00 175.52 176.90 2r8r n HIS 42 N -2.79 -2.29 -0.92 4.73 8.25 -1.26 -1.97 115.22 118.97 2r8r n HIS 42 Ca 0.02 0.80 0.00 0.00 -0.26 0.00 0.00 57.72 58.28 2r8r n HIS 42 Cb 0.53 -4.12 0.00 0.00 1.12 0.00 0.00 29.99 27.52 2r8r n HIS 42 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2r8r n GLY 43 N -1.65 0.74 3.66 -1.41 0.00 -1.26 -4.67 105.19 100.60 2r8r n GLY 43 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2r8r n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2r8r s ARG 44 N -0.22 4.27 0.47 1.61 1.81 -0.83 -4.92 118.95 121.14 2r8r s ARG 44 Ca 0.00 1.34 0.18 0.00 -1.72 0.00 0.00 55.73 55.53 2r8r s ARG 44 Cb 0.00 -3.63 1.13 0.00 -0.45 0.00 0.00 34.95 32.00 2r8r s ARG 44 CO 0.00 -0.60 2.02 0.00 -0.68 0.00 0.00 175.30 176.05 2r8r h ALA 45 N 7.43 1.62 0.01 2.13 0.00 -1.94 -0.25 119.26 128.26 2r8r h ALA 45 Ca -0.20 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 2r8r h ALA 45 Cb 1.07 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2r8r h ALA 45 CO 0.96 0.20 -0.90 1.05 0.00 0.00 0.00 179.25 180.56 2r8r h GLU 46 N 0.00 0.10 0.23 0.00 4.11 -1.97 -0.69 114.58 116.36 2r8r h GLU 46 Ca -0.00 -0.12 -0.31 0.00 0.07 0.00 0.00 59.36 59.00 2r8r h GLU 46 Cb 0.30 0.04 0.04 0.00 0.50 0.00 0.00 28.75 29.62 2r8r h GLU 46 CO 0.02 0.93 -1.35 1.15 0.07 0.00 0.00 179.01 179.83 2r8r h THR 47 N 0.05 1.32 -0.95 -1.06 2.02 -1.84 -2.44 112.91 110.01 2r8r h THR 47 Ca -0.03 -2.65 0.06 0.00 0.77 0.00 0.00 66.41 64.55 2r8r h THR 47 Cb 1.55 3.05 -0.06 0.00 -1.74 0.00 0.00 68.15 70.95 2r8r h THR 47 CO 0.13 0.79 0.62 -0.08 0.37 0.00 0.00 175.52 177.35 2r8r h GLU 48 N 0.06 1.10 -0.18 6.66 4.57 -1.04 -1.04 114.58 124.70 2r8r h GLU 48 Ca -0.23 -0.07 -0.12 0.00 -1.18 0.00 0.00 59.36 57.77 2r8r h GLU 48 Cb 2.06 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 30.39 2r8r h GLU 48 CO 0.25 0.73 -0.39 0.00 -1.18 0.00 0.00 179.01 178.42 2r8r h ALA 49 N 1.47 1.00 -0.39 2.92 0.00 -1.06 -1.62 119.26 121.58 2r8r h ALA 49 Ca 0.40 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2r8r h ALA 49 Cb 0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2r8r h ALA 49 CO -0.15 0.61 -0.08 -0.07 0.00 0.00 0.00 179.25 179.56 2r8r h LEU 50 N 0.34 0.74 -1.11 0.00 3.38 -1.07 -3.21 115.31 114.37 2r8r h LEU 50 Ca 0.03 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 2r8r h LEU 50 Cb 0.83 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2r8r h LEU 50 CO 0.07 0.93 0.33 0.25 0.09 0.00 0.00 178.44 180.10 2r8r h LEU 51 N 0.55 0.86 -0.32 1.67 5.85 -0.99 -2.48 115.31 120.45 2r8r h LEU 51 Ca 0.10 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2r8r h LEU 51 Cb 0.59 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2r8r h LEU 51 CO 0.04 0.72 0.00 0.59 -0.34 0.00 0.00 178.44 179.45 2r8r n ASN 52 N -4.34 0.38 -0.44 1.25 5.03 -0.63 -1.79 115.26 114.71 2r8r n ASN 52 Ca 0.06 0.58 0.12 0.00 0.87 0.00 0.00 54.58 56.22 2r8r n ASN 52 Cb 0.13 -0.67 0.48 0.00 -1.02 0.00 0.00 39.78 38.71 2r8r n ASN 52 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2r8r n GLY 53 N 0.23 -0.01 3.43 7.41 0.00 -0.94 -4.92 105.19 110.38 2r8r n GLY 53 Ca 0.03 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 2r8r n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r8r s LEU 54 N -1.76 2.49 0.52 0.99 1.43 -0.74 -5.10 118.68 116.52 2r8r s LEU 54 Ca 0.35 -0.45 -0.22 0.00 -1.03 0.00 0.00 54.13 52.78 2r8r s LEU 54 Cb 0.19 -1.46 -0.06 0.00 0.03 0.00 0.00 46.19 44.89 2r8r s LEU 54 CO 0.29 0.26 1.30 -2.65 0.23 0.00 0.00 176.35 175.78 2r8r n PRO 55 N 1.69 1.68 -4.34 1.29 -0.02 -1.26 -4.88 135.00 129.15 2r8r n PRO 55 Ca -0.16 0.61 -0.20 0.00 -2.02 0.00 0.00 63.50 61.73 2r8r n PRO 55 Cb 0.52 -2.49 -0.16 0.00 -0.02 0.00 0.00 33.50 31.36 2r8r n PRO 55 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2r8r s GLN 56 N -2.70 0.90 -0.35 -0.52 -0.21 -1.26 -0.95 119.66 114.56 2r8r s GLN 56 Ca 0.69 -0.27 -0.17 0.00 0.02 0.00 0.00 55.36 55.64 2r8r s GLN 56 Cb -0.44 -0.85 -0.01 0.00 1.00 0.00 0.00 33.01 32.72 2r8r s GLN 56 CO 0.51 0.08 0.44 -1.14 -2.12 0.00 0.00 175.29 173.07 2r8r s GLN 57 N 0.28 3.55 0.21 2.91 2.00 0.03 -4.92 119.66 123.71 2r8r s GLN 57 Ca -0.04 -0.33 -0.31 0.00 -2.00 0.00 0.00 55.36 52.68 2r8r s GLN 57 Cb -0.09 -3.82 -0.15 0.00 0.80 0.00 0.00 33.01 29.75 2r8r s GLN 57 CO 0.00 -0.61 1.03 -2.30 -0.50 0.00 0.00 175.29 172.92 2r8r n PRO 58 N 5.57 1.04 -1.48 1.67 -0.02 -1.26 -4.80 135.00 135.72 2r8r n PRO 58 Ca -0.07 0.37 -0.32 0.00 -2.02 0.00 0.00 63.50 61.46 2r8r n PRO 58 Cb 0.49 -1.77 0.07 0.00 -0.02 0.00 0.00 33.50 32.27 2r8r n PRO 58 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2r8r s LEU 59 N 0.85 3.16 -0.18 2.45 1.43 -1.26 -4.26 118.68 120.87 2r8r s LEU 59 Ca 0.68 1.82 -0.21 0.00 -1.03 0.00 0.00 54.13 55.39 2r8r s LEU 59 Cb -0.83 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 40.84 2r8r s LEU 59 CO 0.55 -1.78 0.64 -0.76 0.23 0.00 0.00 176.35 175.23 2r8r s LEU 60 N -5.53 4.17 -0.20 1.79 1.43 0.13 -4.90 118.68 115.57 2r8r s LEU 60 Ca 0.62 0.89 -0.14 0.00 -1.03 0.00 0.00 54.13 54.47 2r8r s LEU 60 Cb -0.17 -2.92 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 2r8r s LEU 60 CO 0.51 -0.25 0.30 -0.13 0.23 0.00 0.00 176.35 177.02 2r8r s ARG 61 N 1.73 4.18 0.37 1.70 0.52 -1.26 -0.80 118.95 125.39 2r8r s ARG 61 Ca 0.30 0.05 0.08 0.00 -0.52 0.00 0.00 55.73 55.64 2r8r s ARG 61 Cb -0.16 -3.50 -0.06 0.00 0.52 0.00 0.00 34.95 31.75 2r8r s ARG 61 CO 0.11 0.08 0.04 0.95 0.02 0.00 0.00 175.30 176.50 2r8r s THR 62 N 0.96 2.40 -0.13 0.02 -4.23 0.02 -4.97 115.64 109.71 2r8r s THR 62 Ca 0.15 -1.93 -0.02 0.00 -1.18 0.00 0.00 61.69 58.71 2r8r s THR 62 Cb -0.14 -2.87 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 2r8r s THR 62 CO 0.06 -0.11 -0.05 -1.61 -0.54 0.00 0.00 174.62 172.36 2r8r s GLU 63 N -3.75 3.39 -0.25 3.99 0.41 -1.26 -0.99 118.70 120.24 2r8r s GLU 63 Ca 0.36 -0.54 -0.03 0.00 -0.41 0.00 0.00 54.97 54.36 2r8r s GLU 63 Cb 0.03 -2.80 0.13 0.00 -1.78 0.00 0.00 34.13 29.72 2r8r s GLU 63 CO 0.20 0.36 0.38 -0.47 -0.49 0.00 0.00 175.26 175.24 2r8r s TYR 64 N 0.02 -0.83 -1.30 1.61 5.04 -1.26 -4.94 117.35 115.69 2r8r s TYR 64 Ca -0.00 0.80 -0.04 0.00 -2.44 0.00 0.00 57.07 55.39 2r8r s TYR 64 Cb -0.13 0.01 0.01 0.00 0.35 0.00 0.00 41.96 42.19 2r8r s TYR 64 CO 0.03 -0.73 0.97 0.54 -1.34 0.00 0.00 175.55 175.02 2r8r n ARG 65 N 5.36 -6.43 -2.16 4.97 1.74 -1.26 -4.74 116.66 114.15 2r8r n ARG 65 Ca -0.03 0.77 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 2r8r n ARG 65 Cb 0.50 -5.67 0.00 0.00 -1.02 0.00 0.00 32.46 26.27 2r8r n ARG 65 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2r8r n GLY 66 N -1.50 0.93 2.62 -0.13 0.00 -1.26 -5.19 105.19 100.67 2r8r n GLY 66 Ca -0.19 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 44.99 2r8r n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r8r s THR 68 N -2.87 -0.05 -0.00 2.61 2.01 -1.26 -5.08 115.64 111.00 2r8r s THR 68 Ca 0.00 -0.14 -0.11 0.00 0.31 0.00 0.00 61.69 61.74 2r8r s THR 68 Cb 0.00 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.89 2r8r s THR 68 CO 0.00 -0.24 0.34 -0.76 -0.69 0.00 0.00 174.62 173.27 2r8r s LEU 69 N 2.12 4.42 -0.07 4.42 1.43 -0.17 -4.95 118.68 125.89 2r8r s LEU 69 Ca 0.02 0.78 0.05 0.00 -1.03 0.00 0.00 54.13 53.95 2r8r s LEU 69 Cb -0.16 -2.59 -0.01 0.00 0.03 0.00 0.00 46.19 43.46 2r8r s LEU 69 CO -0.09 0.30 -0.24 -1.61 0.23 0.00 0.00 176.35 174.94 2r8r s GLU 70 N -1.35 2.64 0.00 1.70 2.02 -1.26 -0.80 118.70 121.65 2r8r s GLU 70 Ca 0.25 -0.87 0.00 0.00 0.02 0.00 0.00 54.97 54.37 2r8r s GLU 70 Cb -0.15 -2.15 0.00 0.00 0.10 0.00 0.00 34.13 31.93 2r8r s GLU 70 CO 0.13 0.30 0.00 0.39 0.02 0.00 0.00 175.26 176.11 2r8r n GLU 71 N 3.15 0.00 -3.51 1.61 -0.58 0.02 -4.88 120.64 116.45 2r8r n GLU 71 Ca -0.18 0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.29 2r8r n GLU 71 Cb 0.52 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.29 2r8r n GLU 71 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2r8r n ASP 73 N 0.00 0.41 -0.15 1.62 -0.08 -1.26 0.20 116.55 117.29 2r8r n ASP 73 Ca 0.00 -2.59 -0.05 0.00 -1.51 0.00 0.00 54.79 50.64 2r8r n ASP 73 Cb 0.00 -0.60 0.04 0.00 2.34 0.00 0.00 41.12 42.90 2r8r n ASP 73 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2r8r h LEU 74 N 5.53 0.26 -0.52 -2.67 5.85 -1.97 -1.75 115.31 120.04 2r8r h LEU 74 Ca 0.24 0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.03 2r8r h LEU 74 Cb 0.87 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 2r8r h LEU 74 CO 0.46 0.19 0.30 0.44 -0.34 0.00 0.00 178.44 179.49 2r8r h ASP 75 N 0.40 0.47 -0.23 1.25 5.19 -2.02 -0.23 116.42 121.25 2r8r h ASP 75 Ca 0.21 0.01 -0.09 0.00 -0.62 0.00 0.00 57.03 56.54 2r8r h ASP 75 Cb 0.15 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.56 2r8r h ASP 75 CO -0.17 0.33 -0.15 0.00 -3.12 0.00 0.00 179.24 176.12 2r8r h ALA 76 N 1.25 1.06 -0.43 3.45 0.00 -1.88 -2.47 119.26 120.24 2r8r h ALA 76 Ca 0.22 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 2r8r h ALA 76 Cb 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2r8r h ALA 76 CO -0.12 0.57 -0.18 -0.07 0.00 0.00 0.00 179.25 179.46 2r8r h LEU 77 N 0.59 0.83 -0.66 0.00 3.38 -0.65 -0.78 115.31 118.02 2r8r h LEU 77 Ca 0.10 -0.28 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 2r8r h LEU 77 Cb 0.60 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2r8r h LEU 77 CO 0.04 1.00 -0.45 -0.07 0.09 0.00 0.00 178.44 179.05 2r8r h LEU 78 N 0.73 0.55 -0.12 1.67 3.38 -0.96 -1.05 115.31 119.50 2r8r h LEU 78 Ca 0.11 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2r8r h LEU 78 Cb 0.69 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 2r8r h LEU 78 CO 0.05 0.93 -0.11 0.11 0.09 0.00 0.00 178.44 179.50 2r8r h LYS 79 N 0.41 0.29 0.00 1.13 1.57 -1.20 -3.17 116.57 115.60 2r8r h LYS 79 Ca 0.03 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 2r8r h LYS 79 Cb 0.96 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 2r8r h LYS 79 CO 0.08 0.69 -0.27 0.00 -0.57 0.00 0.00 179.45 179.39 2r8r h ALA 80 N 0.60 1.11 -6.58 3.86 0.00 -1.11 -3.48 119.26 113.65 2r8r h ALA 80 Ca 0.02 -0.24 -0.47 0.00 0.00 0.00 0.00 54.91 54.21 2r8r h ALA 80 Cb 0.63 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.40 2r8r h ALA 80 CO 0.03 0.33 -0.94 0.00 0.00 0.00 0.00 179.25 178.67 2r8r n ALA 81 N -2.29 -2.66 -0.95 0.00 0.00 -0.40 -4.97 120.51 109.24 2r8r n ALA 81 Ca -0.01 -0.35 -0.29 0.00 0.00 0.00 0.00 53.44 52.79 2r8r n ALA 81 Cb 0.41 -2.25 0.20 0.00 0.00 0.00 0.00 19.45 17.81 2r8r n ALA 81 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2r8r s PRO 82 N -5.89 -0.04 0.06 0.00 0.02 -1.26 -4.97 135.00 122.92 2r8r s PRO 82 Ca 0.28 0.64 -0.09 0.00 0.02 0.00 0.00 61.00 61.85 2r8r s PRO 82 Cb -0.14 -1.67 -0.32 0.00 0.02 0.00 0.00 34.50 32.40 2r8r s PRO 82 CO 0.90 -3.08 1.08 1.03 -0.33 0.00 0.00 177.00 176.60 2r8r h SER 83 N -2.15 0.61 -3.42 2.53 0.87 -1.45 -3.43 113.55 107.11 2r8r h SER 83 Ca -0.57 -0.65 -0.40 0.00 -1.23 0.00 0.00 61.79 58.94 2r8r h SER 83 Cb 1.33 -0.20 -0.35 0.00 -0.44 0.00 0.00 62.40 62.74 2r8r h SER 83 CO 0.55 1.51 -0.76 -0.22 -0.53 0.00 0.00 176.83 177.37 2r8r s LEU 84 N -7.34 1.09 -0.12 2.23 2.96 -0.95 -1.06 118.68 115.49 2r8r s LEU 84 Ca -0.06 -0.09 -0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2r8r s LEU 84 Cb 0.06 -0.39 -0.02 0.00 0.50 0.00 0.00 46.19 46.34 2r8r s LEU 84 CO 0.91 -0.10 -0.11 -0.69 -1.32 0.00 0.00 176.35 175.04 2r8r s VAL 85 N 1.22 3.27 -0.21 1.68 1.01 0.84 -4.39 120.40 123.82 2r8r s VAL 85 Ca -0.07 -0.59 -0.16 0.00 0.00 0.00 0.00 61.98 61.16 2r8r s VAL 85 Cb -0.14 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 2r8r s VAL 85 CO -0.02 0.53 0.42 -0.76 0.00 0.00 0.00 175.10 175.27 2r8r s LEU 86 N 0.15 4.14 -0.31 3.92 1.43 -1.26 -1.51 118.68 125.25 2r8r s LEU 86 Ca -0.06 0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 53.55 2r8r s LEU 86 Cb -0.15 -2.54 0.11 0.00 0.03 0.00 0.00 46.19 43.64 2r8r s LEU 86 CO 0.04 -0.11 0.13 -0.69 0.23 0.00 0.00 176.35 175.96 2r8r s VAL 87 N 1.45 0.37 0.52 -1.59 1.01 -0.18 -0.39 120.40 121.58 2r8r s VAL 87 Ca 0.20 -1.18 -0.22 0.00 0.00 0.00 0.00 61.98 60.77 2r8r s VAL 87 Cb -0.15 -1.30 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 2r8r s VAL 87 CO 0.08 -0.75 1.28 -1.81 0.00 0.00 0.00 175.10 173.91 2r8r s ASP 88 N 1.73 5.60 -0.32 3.32 1.01 0.51 -3.38 116.67 125.13 2r8r s ASP 88 Ca 0.11 2.59 -0.03 0.00 0.71 0.00 0.00 52.55 55.92 2r8r s ASP 88 Cb -0.18 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.14 2r8r s ASP 88 CO -0.27 -1.33 0.34 -0.62 0.21 0.00 0.00 175.17 173.50 2r8r n GLU 89 N -0.84 -0.88 0.05 8.23 1.02 -1.02 -4.81 120.64 122.38 2r8r n GLU 89 Ca 0.09 1.13 0.03 0.00 -0.02 0.00 0.00 57.16 58.39 2r8r n GLU 89 Cb 0.46 -3.66 0.40 0.00 -0.02 0.00 0.00 31.44 28.62 2r8r n GLU 89 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2r8r h LEU 90 N 0.54 0.38 -0.10 -4.62 5.85 -1.37 -2.14 115.31 113.85 2r8r h LEU 90 Ca 0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2r8r h LEU 90 Cb 0.81 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2r8r h LEU 90 CO 0.13 0.38 -0.02 0.00 -0.34 0.00 0.00 178.44 178.60 2r8r n ALA 91 N -2.48 2.62 -1.62 1.25 0.00 -1.26 -3.15 120.51 115.86 2r8r n ALA 91 Ca 0.01 -0.21 -0.48 0.00 0.00 0.00 0.00 53.44 52.77 2r8r n ALA 91 Cb 0.16 -1.45 -0.04 0.00 0.00 0.00 0.00 19.45 18.12 2r8r n ALA 91 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2r8r n HIS 92 N -1.04 1.76 -3.32 0.00 -0.00 -0.81 -4.32 115.22 107.50 2r8r n HIS 92 Ca 0.18 0.53 -0.39 0.00 -0.00 0.00 0.00 57.72 58.04 2r8r n HIS 92 Cb 0.21 -2.39 -0.08 0.00 -0.00 0.00 0.00 29.99 27.73 2r8r n HIS 92 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 2r8r s THR 93 N 0.14 5.13 0.74 3.57 2.01 -1.26 -0.82 115.64 125.16 2r8r s THR 93 Ca 0.74 0.74 -0.12 0.00 0.31 0.00 0.00 61.69 63.37 2r8r s THR 93 Cb -0.78 -3.77 0.04 0.00 0.01 0.00 0.00 72.50 68.01 2r8r s THR 93 CO 0.48 0.14 1.11 0.20 -0.69 0.00 0.00 174.62 175.86 2r8r s ASN 94 N 1.49 4.58 0.45 3.53 0.01 -0.18 -4.91 114.94 119.91 2r8r s ASN 94 Ca 0.19 1.93 -0.25 0.00 -0.71 0.00 0.00 52.86 54.01 2r8r s ASN 94 Cb -0.16 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 38.89 2r8r s ASN 94 CO 0.09 -1.98 1.44 0.00 -1.51 0.00 0.00 177.10 175.14 2r8r s ALA 95 N -2.67 3.25 0.38 0.60 0.00 -1.26 -4.90 121.76 117.16 2r8r s ALA 95 Ca 0.64 1.49 -0.25 0.00 0.00 0.00 0.00 51.96 53.84 2r8r s ALA 95 Cb -0.19 -3.60 -0.12 0.00 0.00 0.00 0.00 23.12 19.21 2r8r s ALA 95 CO 0.51 -1.23 1.02 -2.30 0.00 0.00 0.00 175.76 173.76 2r8r n PRO 96 N -0.21 1.40 -0.49 0.00 -0.02 -1.26 -2.37 135.00 132.04 2r8r n PRO 96 Ca 0.05 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2r8r n PRO 96 Cb 0.42 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 2r8r n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r8r n GLY 97 N 1.17 0.75 3.80 -1.23 0.00 -1.26 -5.05 105.19 103.36 2r8r n GLY 97 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 2r8r n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r8r s SER 98 N -2.87 7.08 0.27 1.61 0.01 -1.00 -4.95 113.70 113.85 2r8r s SER 98 Ca 0.00 1.81 -0.01 0.00 1.31 0.00 0.00 55.95 59.06 2r8r s SER 98 Cb 0.00 -2.56 0.52 0.00 0.21 0.00 0.00 66.02 64.19 2r8r s SER 98 CO 0.00 -0.26 1.80 -0.09 0.41 0.00 0.00 173.24 175.10 2r8r h ARG 99 N 2.55 0.76 -6.44 12.44 2.43 -1.97 -3.42 114.38 120.74 2r8r h ARG 99 Ca -0.48 -0.05 -0.65 0.00 -0.81 0.00 0.00 59.98 58.00 2r8r h ARG 99 Cb 1.19 -0.17 -0.13 0.00 -0.42 0.00 0.00 29.97 30.43 2r8r h ARG 99 CO 0.63 0.51 -0.70 -1.01 -1.51 0.00 0.00 179.97 177.89 2r8r s HIS 100 N -5.97 2.84 0.17 2.20 3.76 -1.26 -5.04 115.29 111.99 2r8r s HIS 100 Ca -0.12 -0.11 -0.13 0.00 -0.15 0.00 0.00 55.06 54.55 2r8r s HIS 100 Cb 0.22 -1.45 0.06 0.00 1.11 0.00 0.00 32.58 32.51 2r8r s HIS 100 CO 0.79 0.46 1.75 1.15 -0.85 0.00 0.00 174.74 178.05 2r8r h THR 101 N 2.96 1.20 -4.18 1.30 2.02 -1.95 -3.43 112.91 110.84 2r8r h THR 101 Ca -0.48 -0.57 -0.63 0.00 0.77 0.00 0.00 66.41 65.50 2r8r h THR 101 Cb 1.17 0.56 -0.25 0.00 -1.74 0.00 0.00 68.15 67.89 2r8r h THR 101 CO 0.56 0.23 -0.86 -0.54 0.37 0.00 0.00 175.52 175.28 2r8r s LYS 102 N -5.71 1.53 0.43 6.66 -0.14 -1.26 -1.01 119.74 120.23 2r8r s LYS 102 Ca -0.13 -1.06 0.14 0.00 -1.36 0.00 0.00 55.97 53.56 2r8r s LYS 102 Cb 0.12 -1.71 0.94 0.00 -1.68 0.00 0.00 37.83 35.50 2r8r s LYS 102 CO 0.77 0.43 1.95 -0.09 -0.76 0.00 0.00 175.35 177.66 2r8r h ARG 103 N 4.68 0.00 -0.61 1.68 2.43 -1.24 -2.44 114.38 118.89 2r8r h ARG 103 Ca -0.45 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 58.78 2r8r h ARG 103 Cb 1.16 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.67 2r8r h ARG 103 CO 0.43 0.23 0.41 0.11 -1.51 0.00 0.00 179.97 179.63 2r8r h TRP 104 N 0.00 0.59 -0.50 2.20 5.08 -1.77 -1.48 115.95 120.07 2r8r h TRP 104 Ca -0.00 0.02 -0.11 0.00 1.08 0.00 0.00 58.89 59.87 2r8r h TRP 104 Cb 0.41 -0.19 -0.02 0.00 -3.00 0.00 0.00 29.16 26.36 2r8r h TRP 104 CO 0.00 0.31 -0.13 1.96 -1.28 0.00 0.00 178.44 179.30 2r8r h GLN 105 N 0.58 0.95 -0.47 0.12 4.20 -1.79 -0.21 115.11 118.50 2r8r h GLN 105 Ca 0.27 -0.35 0.08 0.00 0.06 0.00 0.00 58.65 58.70 2r8r h GLN 105 Cb 0.30 -0.06 -0.07 0.00 0.30 0.00 0.00 27.48 27.95 2r8r h GLN 105 CO -0.08 1.02 0.09 -0.44 -0.67 0.00 0.00 178.83 178.74 2r8r h ASP 106 N 0.84 -0.01 -0.46 1.46 3.32 -1.29 -1.95 116.42 118.33 2r8r h ASP 106 Ca 0.13 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 2r8r h ASP 106 Cb 0.68 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.33 2r8r h ASP 106 CO 0.05 0.02 0.29 0.40 -1.72 0.00 0.00 179.24 178.28 2r8r h ILE 107 N 0.22 1.14 -0.82 0.35 2.04 -0.99 -2.20 117.51 117.24 2r8r h ILE 107 Ca 0.23 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 2r8r h ILE 107 Cb 0.31 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2r8r h ILE 107 CO -0.31 0.14 0.51 1.56 0.00 0.00 0.00 178.15 180.05 2r8r h GLN 108 N 0.62 1.10 -0.65 2.37 1.08 -0.75 -0.88 115.11 118.01 2r8r h GLN 108 Ca 0.17 -0.09 -0.05 0.00 -1.45 0.00 0.00 58.65 57.23 2r8r h GLN 108 Cb -0.03 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.14 2r8r h GLN 108 CO -0.03 0.76 0.21 1.49 -0.95 0.00 0.00 178.83 180.30 2r8r h GLU 109 N 1.13 1.00 -0.42 1.46 4.81 -1.06 -0.23 114.58 121.27 2r8r h GLU 109 Ca 0.30 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2r8r h GLU 109 Cb -0.07 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.14 2r8r h GLU 109 CO -0.06 0.87 0.22 -0.07 -0.73 0.00 0.00 179.01 179.25 2r8r h LEU 110 N 0.93 0.53 -0.99 1.64 3.38 -0.99 -2.55 115.31 117.26 2r8r h LEU 110 Ca 0.21 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2r8r h LEU 110 Cb 0.29 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2r8r h LEU 110 CO -0.01 0.48 0.15 -0.07 0.09 0.00 0.00 178.44 179.08 2r8r h LEU 111 N 0.54 0.82 -1.44 1.67 3.38 -0.81 -1.59 115.31 117.88 2r8r h LEU 111 Ca 0.15 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2r8r h LEU 111 Cb 0.07 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2r8r h LEU 111 CO -0.02 0.79 -0.24 0.00 0.09 0.00 0.00 178.44 179.06 2r8r h ALA 112 N 1.32 1.20 -0.03 1.53 0.00 -0.95 -1.87 119.26 120.47 2r8r h ALA 112 Ca 0.19 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2r8r h ALA 112 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2r8r h ALA 112 CO -0.00 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.55 2r8r n ALA 113 N -2.31 2.62 -0.68 0.00 0.00 -0.83 -4.90 120.51 114.40 2r8r n ALA 113 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2r8r n ALA 113 Cb 0.36 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2r8r n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r8r n GLY 114 N 0.97 0.65 3.70 0.00 0.00 -0.75 -4.97 105.19 104.79 2r8r n GLY 114 Ca 0.19 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2r8r n GLY 114 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r8r s ILE 115 N -2.00 5.07 0.47 -0.61 1.01 -0.66 -4.27 121.20 120.20 2r8r s ILE 115 Ca 0.00 1.27 -0.22 0.00 0.00 0.00 0.00 60.65 61.69 2r8r s ILE 115 Cb 0.00 -3.97 -0.07 0.00 0.01 0.00 0.00 42.46 38.43 2r8r s ILE 115 CO 0.00 0.23 1.13 -1.81 0.00 0.00 0.00 174.94 174.49 2r8r s ASP 116 N 0.86 6.21 -0.04 3.58 1.01 -0.22 -3.67 116.67 124.40 2r8r s ASP 116 Ca 0.33 2.21 0.02 0.00 0.71 0.00 0.00 52.55 55.82 2r8r s ASP 116 Cb -0.17 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.18 2r8r s ASP 116 CO 0.14 -0.88 -0.09 -0.69 0.21 0.00 0.00 175.17 173.86 2r8r s VAL 117 N -1.64 0.85 -0.11 -1.27 1.01 -0.44 -0.11 120.40 118.70 2r8r s VAL 117 Ca 0.64 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 2r8r s VAL 117 Cb -0.26 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 2r8r s VAL 117 CO 0.31 0.28 0.03 -0.31 0.00 0.00 0.00 175.10 175.41 2r8r s TYR 118 N 0.50 3.26 0.12 5.22 1.51 -0.57 -1.01 117.35 126.38 2r8r s TYR 118 Ca -0.09 0.23 -0.07 0.00 -1.01 0.00 0.00 57.07 56.14 2r8r s TYR 118 Cb -0.12 -1.86 -0.02 0.00 -0.11 0.00 0.00 41.96 39.86 2r8r s TYR 118 CO 0.01 0.47 0.18 -0.08 -1.11 0.00 0.00 175.55 175.03 2r8r s THR 119 N -0.74 0.11 0.08 -0.71 -1.32 -0.10 -1.01 115.64 111.95 2r8r s THR 119 Ca 0.12 -1.47 0.08 0.00 -1.21 0.00 0.00 61.69 59.21 2r8r s THR 119 Cb -0.12 -1.71 -0.03 0.00 -1.51 0.00 0.00 72.50 69.13 2r8r s THR 119 CO 0.02 -0.50 -0.22 0.42 -2.21 0.00 0.00 174.62 172.13 2r8r s THR 120 N -3.95 1.84 -0.14 5.08 -4.23 -1.22 -0.33 115.64 112.70 2r8r s THR 120 Ca 0.14 -1.45 -0.19 0.00 -1.18 0.00 0.00 61.69 59.02 2r8r s THR 120 Cb 0.05 -1.63 0.05 0.00 1.34 0.00 0.00 72.50 72.31 2r8r s THR 120 CO -0.04 0.10 0.49 0.54 -0.54 0.00 0.00 174.62 175.17 2r8r s VAL 121 N -0.98 0.01 0.23 2.29 0.11 -0.89 -1.12 120.40 120.05 2r8r s VAL 121 Ca 0.09 -0.09 -0.19 0.00 -2.93 0.00 0.00 61.98 58.86 2r8r s VAL 121 Cb -0.10 -0.72 -0.08 0.00 -1.53 0.00 0.00 36.38 33.95 2r8r s VAL 121 CO 0.03 -0.05 0.72 0.20 -3.33 0.00 0.00 175.10 172.67 2r8r s ASN 122 N -0.21 7.01 0.54 3.54 0.02 -1.26 -1.76 114.94 122.83 2r8r s ASN 122 Ca -0.04 1.38 0.24 0.00 -1.02 0.00 0.00 52.86 53.43 2r8r s ASN 122 Cb -0.03 -2.41 1.51 0.00 0.02 0.00 0.00 41.25 40.34 2r8r s ASN 122 CO 0.03 0.01 2.15 1.62 0.02 0.00 0.00 177.10 180.93 2r8r h VAL 123 N 2.67 0.72 -0.03 1.60 3.04 -1.07 -2.86 116.25 120.31 2r8r h VAL 123 Ca -0.48 -0.22 0.01 0.00 -1.01 0.00 0.00 66.70 65.00 2r8r h VAL 123 Cb 1.19 1.13 -0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2r8r h VAL 123 CO 0.65 0.06 0.05 0.06 -1.01 0.00 0.00 177.57 177.38 2r8r h GLN 124 N 0.00 0.00 0.00 4.17 3.07 -1.85 -2.72 115.11 117.78 2r8r h GLN 124 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2r8r h GLN 124 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.69 2r8r h GLN 124 CO 0.01 0.00 0.00 0.45 0.09 0.00 0.00 178.83 179.38 2r8r h HIS 125 N 0.00 0.00 -2.64 0.06 3.86 -1.77 -3.41 115.15 111.25 2r8r h HIS 125 Ca 0.02 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.70 2r8r h HIS 125 Cb 0.11 0.00 0.05 0.00 1.06 0.00 0.00 27.41 28.64 2r8r h HIS 125 CO 0.00 0.00 1.03 -0.51 0.86 0.00 0.00 177.93 179.31 2r8r s LEU 126 N -5.63 4.38 0.18 2.43 1.43 -1.03 -0.76 118.68 119.67 2r8r s LEU 126 Ca 0.07 2.84 -0.19 0.00 -1.03 0.00 0.00 54.13 55.82 2r8r s LEU 126 Cb 0.08 -3.59 0.12 0.00 0.03 0.00 0.00 46.19 42.82 2r8r s LEU 126 CO 0.61 -0.98 1.63 -0.33 0.23 0.00 0.00 176.35 177.51 2r8r h GLU 127 N 7.16 -0.11 -0.25 1.70 5.08 -1.51 -1.49 114.58 125.16 2r8r h GLU 127 Ca -0.44 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.01 2r8r h GLU 127 Cb 1.20 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2r8r h GLU 127 CO 0.95 -0.08 0.37 0.66 -1.00 0.00 0.00 179.01 179.92 2r8r h SER 128 N -0.12 0.00 -0.08 1.42 4.64 -1.91 -2.17 113.55 115.33 2r8r h SER 128 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2r8r h SER 128 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2r8r h SER 128 CO -0.52 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.62 2r8r n LEU 129 N -3.48 2.68 0.01 5.97 4.77 -0.57 -4.73 117.00 121.64 2r8r n LEU 129 Ca 0.04 -1.10 -0.10 0.00 -0.03 0.00 0.00 56.01 54.82 2r8r n LEU 129 Cb 0.50 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.51 2r8r n LEU 129 CO 0.23 0.49 0.82 -1.13 -1.33 0.00 0.00 177.39 176.48 2r8r h ASN 130 N 3.69 -0.19 -0.42 -1.43 -0.73 -1.25 0.14 115.58 115.39 2r8r h ASN 130 Ca 0.00 0.04 -0.10 0.00 1.87 0.00 0.00 56.30 58.11 2r8r h ASN 130 Cb 0.80 0.10 -0.01 0.00 0.27 0.00 0.00 38.32 39.48 2r8r h ASN 130 CO 0.00 -0.09 -0.12 0.44 -0.37 0.00 0.00 177.43 177.29 2r8r h ASP 131 N -0.07 0.83 -0.17 1.15 3.32 -1.85 -0.91 116.42 118.73 2r8r h ASP 131 Ca 0.05 -0.37 0.02 0.00 0.02 0.00 0.00 57.03 56.75 2r8r h ASP 131 Cb 0.15 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2r8r h ASP 131 CO -0.12 1.01 0.03 -0.61 -1.72 0.00 0.00 179.24 177.83 2r8r h GLN 132 N 0.65 0.09 -0.47 3.56 4.15 -1.82 0.14 115.11 121.41 2r8r h GLN 132 Ca 0.10 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.53 2r8r h GLN 132 Cb 0.66 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.31 2r8r h GLN 132 CO 0.05 0.06 0.31 0.28 -1.93 0.00 0.00 178.83 177.59 2r8r h VAL 133 N 0.09 1.11 -0.67 2.39 2.07 -0.87 -1.76 116.25 118.61 2r8r h VAL 133 Ca 0.08 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 2r8r h VAL 133 Cb 0.07 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2r8r h VAL 133 CO -0.11 0.11 0.18 -0.09 0.02 0.00 0.00 177.57 177.69 2r8r h ARG 134 N 0.62 1.04 -0.04 1.57 2.43 -1.04 0.68 114.38 119.65 2r8r h ARG 134 Ca 0.17 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 2r8r h ARG 134 Cb -0.06 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 2r8r h ARG 134 CO -0.05 0.91 -0.20 0.78 -1.51 0.00 0.00 179.97 179.90 2r8r h GLY 135 N 1.06 0.07 0.00 2.80 0.00 -0.67 0.77 103.07 107.11 2r8r h GLY 135 Ca 0.21 -0.04 -0.10 0.00 0.00 0.00 0.00 47.33 47.40 2r8r h GLY 135 CO -0.00 0.04 -0.68 -2.22 0.00 0.00 0.00 176.54 173.68 2r8r h ILE 136 N 0.06 0.66 0.00 2.60 2.04 -0.96 -3.40 117.51 118.51 2r8r h ILE 136 Ca 0.01 -1.70 0.00 0.00 1.00 0.00 0.00 64.86 64.17 2r8r h ILE 136 Cb 0.39 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 2r8r h ILE 136 CO 0.03 0.22 -0.79 0.71 0.00 0.00 0.00 178.15 178.32 2r8r h THR 137 N -1.00 0.00 0.00 -0.27 1.35 -0.92 -3.48 112.91 108.60 2r8r h THR 137 Ca -0.15 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 2r8r h THR 137 Cb 0.85 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 2r8r h THR 137 CO -0.09 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.79 2r8r n GLY 138 N 1.22 0.36 3.66 5.82 0.00 0.26 -4.60 105.19 111.91 2r8r n GLY 138 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2r8r n GLY 138 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r8r s VAL 139 N -2.01 4.79 0.08 1.61 1.01 -1.26 -5.03 120.40 119.59 2r8r s VAL 139 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 61.98 61.63 2r8r s VAL 139 Cb 0.00 -3.14 -0.08 0.00 0.00 0.00 0.00 36.38 33.16 2r8r s VAL 139 CO 0.00 0.49 1.50 -1.58 0.00 0.00 0.00 175.10 175.51 2r8r s GLN 140 N 0.13 4.26 -0.47 2.72 2.00 -1.26 -4.11 119.66 122.92 2r8r s GLN 140 Ca 0.05 2.17 -0.20 0.00 -2.00 0.00 0.00 55.36 55.38 2r8r s GLN 140 Cb -0.12 -3.43 0.04 0.00 0.80 0.00 0.00 33.01 30.30 2r8r s GLN 140 CO 0.01 -0.59 0.62 0.08 -0.50 0.00 0.00 175.29 174.91 2r8r s VAL 141 N 1.93 4.86 -0.03 1.34 1.01 -1.26 -4.92 120.40 123.32 2r8r s VAL 141 Ca 0.68 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.53 2r8r s VAL 141 Cb -0.37 -4.24 -0.24 0.00 0.00 0.00 0.00 36.38 31.53 2r8r s VAL 141 CO 0.30 -0.70 0.72 0.03 0.00 0.00 0.00 175.10 175.45 2r8r h ARG 142 N 8.93 0.05 -5.00 2.72 3.08 -1.97 -3.43 114.38 118.77 2r8r h ARG 142 Ca -0.26 -0.09 -0.68 0.00 0.07 0.00 0.00 59.98 59.01 2r8r h ARG 142 Cb 1.10 0.03 -0.18 0.00 0.08 0.00 0.00 29.97 31.00 2r8r h ARG 142 CO 0.92 0.69 -0.11 -1.21 -1.07 0.00 0.00 179.97 179.20 2r8r s GLU 143 N -2.61 3.14 0.32 0.04 2.02 -1.26 -5.06 118.70 115.29 2r8r s GLU 143 Ca -0.06 -0.67 0.09 0.00 0.02 0.00 0.00 54.97 54.34 2r8r s GLU 143 Cb 0.08 -3.97 -0.05 0.00 0.10 0.00 0.00 34.13 30.29 2r8r s GLU 143 CO 0.82 -0.92 0.06 0.95 0.02 0.00 0.00 175.26 176.19 2r8r s THR 144 N 2.33 3.02 -0.06 3.63 -4.23 -1.26 -4.65 115.64 114.41 2r8r s THR 144 Ca 0.15 -1.85 0.01 0.00 -1.18 0.00 0.00 61.69 58.83 2r8r s THR 144 Cb -0.16 -2.88 0.02 0.00 1.34 0.00 0.00 72.50 70.81 2r8r s THR 144 CO 0.15 -0.24 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.69 2r8r s LEU 145 N -3.76 1.41 0.29 4.79 2.96 0.06 -4.84 118.68 119.59 2r8r s LEU 145 Ca 0.35 -0.22 -0.29 0.00 -0.22 0.00 0.00 54.13 53.75 2r8r s LEU 145 Cb -0.03 -0.66 -0.10 0.00 0.50 0.00 0.00 46.19 45.90 2r8r s LEU 145 CO 0.21 -0.03 1.43 -2.84 -1.32 0.00 0.00 176.35 173.79 2r8r s PRO 146 N 0.97 4.26 0.35 0.98 0.02 -1.26 -1.27 135.00 139.04 2r8r s PRO 146 Ca -0.10 2.34 0.08 0.00 0.02 0.00 0.00 61.00 63.34 2r8r s PRO 146 Cb -0.15 -3.08 0.78 0.00 0.02 0.00 0.00 34.50 32.08 2r8r s PRO 146 CO 0.00 -0.40 1.87 -0.44 -0.33 0.00 0.00 177.00 177.70 2r8r h ASP 147 N 4.37 0.69 0.05 2.53 5.19 -1.95 -1.89 116.42 125.42 2r8r h ASP 147 Ca -0.47 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 55.97 2r8r h ASP 147 Cb 1.22 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.63 2r8r h ASP 147 CO 0.73 0.36 -0.03 4.11 -3.12 0.00 0.00 179.24 181.29 2r8r h TRP 148 N 0.74 0.00 -0.63 4.55 5.08 -1.98 -0.53 115.95 123.18 2r8r h TRP 148 Ca 0.45 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.40 2r8r h TRP 148 Cb 0.66 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.79 2r8r h TRP 148 CO -0.00 0.03 0.34 0.28 -1.28 0.00 0.00 178.44 177.81 2r8r h VAL 149 N 0.00 1.21 0.02 0.12 2.07 -1.72 -1.33 116.25 116.62 2r8r h VAL 149 Ca -0.00 -0.53 -0.27 0.00 0.82 0.00 0.00 66.70 66.72 2r8r h VAL 149 Cb 0.06 0.40 0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2r8r h VAL 149 CO 0.00 0.23 -1.07 0.25 0.02 0.00 0.00 177.57 177.00 2r8r h LEU 150 N 0.86 0.86 -1.33 2.57 6.46 -1.42 -3.22 115.31 120.09 2r8r h LEU 150 Ca 0.22 -0.71 -0.02 0.00 -0.12 0.00 0.00 57.88 57.25 2r8r h LEU 150 Cb 0.06 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.70 2r8r h LEU 150 CO -0.03 1.51 0.24 1.56 -0.62 0.00 0.00 178.44 181.10 2r8r h GLN 151 N 0.35 0.70 -0.29 1.25 4.20 -0.96 -2.23 115.11 118.13 2r8r h GLN 151 Ca -0.14 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.49 2r8r h GLN 151 Cb 1.73 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 29.37 2r8r h GLN 151 CO 0.21 0.55 0.00 0.39 -0.67 0.00 0.00 178.83 179.30 2r8r n GLU 152 N -4.38 1.85 -1.92 1.46 1.02 -0.52 -4.90 120.64 113.26 2r8r n GLU 152 Ca 0.04 -1.30 -0.41 0.00 -0.02 0.00 0.00 57.16 55.47 2r8r n GLU 152 Cb 0.12 -1.35 -0.01 0.00 -0.02 0.00 0.00 31.44 30.18 2r8r n GLU 152 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2r8r s ALA 153 N -1.61 3.60 0.18 0.62 0.00 -0.84 -4.93 121.76 118.78 2r8r s ALA 153 Ca 0.29 1.45 -0.13 0.00 0.00 0.00 0.00 51.96 53.57 2r8r s ALA 153 Cb 0.16 -3.58 0.12 0.00 0.00 0.00 0.00 23.12 19.82 2r8r s ALA 153 CO 0.22 -0.88 1.81 0.35 0.00 0.00 0.00 175.76 177.26 2r8r h PHE 154 N 3.87 0.56 -3.94 0.00 3.57 -1.61 -3.44 116.94 115.95 2r8r h PHE 154 Ca -0.49 0.02 -0.33 0.00 3.53 0.00 0.00 57.97 60.70 2r8r h PHE 154 Cb 1.23 -0.18 -0.27 0.00 2.79 0.00 0.00 35.95 39.52 2r8r h PHE 154 CO 0.56 0.30 -0.75 -0.51 -2.23 0.00 0.00 178.31 175.68 2r8r s ASP 155 N -5.57 0.76 -0.05 0.41 1.01 -0.67 -5.03 116.67 107.54 2r8r s ASP 155 Ca -0.13 -0.21 0.01 0.00 0.71 0.00 0.00 52.55 52.93 2r8r s ASP 155 Cb 0.13 -0.06 0.02 0.00 1.01 0.00 0.00 42.92 44.03 2r8r s ASP 155 CO 0.74 0.01 -0.06 -0.22 0.21 0.00 0.00 175.17 175.85 2r8r s LEU 156 N -0.47 1.41 -0.10 1.23 2.96 -1.26 -1.54 118.68 120.91 2r8r s LEU 156 Ca -0.00 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 53.77 2r8r s LEU 156 Cb -0.04 -0.54 0.01 0.00 0.50 0.00 0.00 46.19 46.12 2r8r s LEU 156 CO -0.00 -0.03 -0.21 0.54 -1.32 0.00 0.00 176.35 175.33 2r8r s VAL 157 N 0.85 1.85 -0.19 1.68 0.11 0.09 -4.97 120.40 119.82 2r8r s VAL 157 Ca -0.12 -0.88 -0.28 0.00 -2.93 0.00 0.00 61.98 57.76 2r8r s VAL 157 Cb -0.15 -1.62 -0.00 0.00 -1.53 0.00 0.00 36.38 33.08 2r8r s VAL 157 CO 0.01 0.51 0.99 -0.22 -3.33 0.00 0.00 175.10 173.07 2r8r s LEU 158 N 0.56 4.15 -0.35 2.54 2.96 -1.26 -0.24 118.68 127.04 2r8r s LEU 158 Ca -0.15 1.38 -0.11 0.00 -0.22 0.00 0.00 54.13 55.03 2r8r s LEU 158 Cb -0.17 -3.49 0.01 0.00 0.50 0.00 0.00 46.19 43.04 2r8r s LEU 158 CO 0.05 -0.56 0.21 -0.63 -1.32 0.00 0.00 176.35 174.09 2r8r s ILE 159 N 2.70 4.83 0.09 6.68 -1.09 0.49 -4.94 121.20 129.96 2r8r s ILE 159 Ca 0.44 -0.55 0.06 0.00 -2.23 0.00 0.00 60.65 58.37 2r8r s ILE 159 Cb -0.16 -3.57 -0.04 0.00 -1.58 0.00 0.00 42.46 37.11 2r8r s ILE 159 CO 0.10 -0.10 -0.09 -0.62 -1.23 0.00 0.00 174.94 173.01 2r8r s ASP 160 N 1.63 4.49 -0.22 3.58 2.15 -1.26 -4.41 116.67 122.62 2r8r s ASP 160 Ca 0.04 -0.34 -0.14 0.00 0.43 0.00 0.00 52.55 52.54 2r8r s ASP 160 Cb -0.18 -0.90 0.07 0.00 -0.30 0.00 0.00 42.92 41.60 2r8r s ASP 160 CO 0.08 0.19 0.55 -0.22 -0.17 0.00 0.00 175.17 175.60 2r8r s LEU 161 N -2.13 -0.42 0.25 -1.34 2.96 -1.26 -4.98 118.68 111.76 2r8r s LEU 161 Ca 0.21 1.18 -0.31 0.00 -0.22 0.00 0.00 54.13 55.00 2r8r s LEU 161 Cb -0.11 1.88 -0.13 0.00 0.50 0.00 0.00 46.19 48.33 2r8r s LEU 161 CO 0.14 -0.21 1.50 -2.65 -1.32 0.00 0.00 176.35 173.80 2r8r n PRO 162 N 3.89 2.31 -0.27 0.98 -0.02 -1.26 -4.85 135.00 135.79 2r8r n PRO 162 Ca -0.20 0.82 0.08 0.00 -2.02 0.00 0.00 63.50 62.19 2r8r n PRO 162 Cb 0.57 -2.54 0.22 0.00 -0.02 0.00 0.00 33.50 31.73 2r8r n PRO 162 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2r8r h PRO 163 N 4.59 0.35 -0.80 0.52 0.11 -1.95 -0.49 132.00 134.34 2r8r h PRO 163 Ca -0.46 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.69 2r8r h PRO 163 Cb 1.25 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 2r8r h PRO 163 CO 0.78 0.23 0.49 -0.09 -0.21 0.00 0.00 178.00 179.20 2r8r h ARG 164 N 0.36 0.87 -0.46 1.05 2.43 -1.94 -0.21 114.38 116.49 2r8r h ARG 164 Ca 0.46 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.46 2r8r h ARG 164 Cb 0.80 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2r8r h ARG 164 CO -0.49 0.58 -0.20 1.49 -1.51 0.00 0.00 179.97 179.84 2r8r h GLU 165 N 0.90 0.94 -0.88 0.20 4.81 -1.70 -2.17 114.58 116.68 2r8r h GLU 165 Ca 0.35 -0.40 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2r8r h GLU 165 Cb 0.15 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2r8r h GLU 165 CO -0.16 1.06 0.58 1.25 -0.73 0.00 0.00 179.01 181.01 2r8r h LEU 166 N 0.78 0.99 -1.20 1.64 5.85 -0.32 -1.61 115.31 121.44 2r8r h LEU 166 Ca 0.11 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.82 2r8r h LEU 166 Cb 0.77 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 2r8r h LEU 166 CO 0.06 0.71 0.54 -0.07 -0.34 0.00 0.00 178.44 179.34 2r8r h LEU 167 N 1.17 0.92 -0.49 2.25 3.38 -0.94 -1.05 115.31 120.54 2r8r h LEU 167 Ca 0.33 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.22 2r8r h LEU 167 Cb -0.10 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 2r8r h LEU 167 CO -0.08 0.65 0.07 -0.33 0.09 0.00 0.00 178.44 178.84 2r8r h GLU 168 N 1.08 0.83 -0.62 1.13 5.08 -0.90 -1.31 114.58 119.86 2r8r h GLU 168 Ca 0.31 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.47 2r8r h GLU 168 Cb -0.07 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 2r8r h GLU 168 CO -0.08 0.83 0.38 0.00 -1.00 0.00 0.00 179.01 179.14 2r8r h ARG 169 N 0.70 0.73 0.04 2.33 3.08 -0.90 0.25 114.38 120.61 2r8r h ARG 169 Ca 0.15 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 2r8r h ARG 169 Cb 0.41 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2r8r h ARG 169 CO 0.01 0.48 -0.02 1.25 -1.07 0.00 0.00 179.97 180.62 2r8r h LEU 170 N 0.75 -0.05 -0.85 3.04 5.85 -1.07 0.14 115.31 123.12 2r8r h LEU 170 Ca 0.25 -0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.05 2r8r h LEU 170 Cb 0.03 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 2r8r h LEU 170 CO -0.11 -0.03 0.51 -0.09 -0.34 0.00 0.00 178.44 178.38 2r8r h ARG 171 N -0.06 0.87 -0.06 1.25 2.43 -1.08 -2.37 114.38 115.36 2r8r h ARG 171 Ca -0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2r8r h ARG 171 Cb 0.05 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2r8r h ARG 171 CO 0.01 0.58 0.00 -0.25 -1.51 0.00 0.00 179.97 178.80 2r8r n ASP 172 N -4.67 0.37 -0.43 -3.80 8.00 0.06 -4.88 116.55 111.21 2r8r n ASP 172 Ca 0.13 -1.76 -0.04 0.00 0.71 0.00 0.00 54.79 53.83 2r8r n ASP 172 Cb 0.22 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.27 2r8r n ASP 172 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r8r n GLY 173 N 0.73 0.40 0.15 0.44 0.00 -0.89 -4.95 105.19 101.06 2r8r n GLY 173 Ca 0.08 -0.77 0.09 0.00 0.00 0.00 0.00 46.02 45.41 2r8r n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2r8r n LYS 174 N -2.00 1.30 -4.00 1.61 5.02 0.47 -4.88 118.16 115.68 2r8r n LYS 174 Ca -0.05 -0.31 -0.34 0.00 -2.02 0.00 0.00 58.31 55.59 2r8r n LYS 174 Cb 0.38 -1.34 -0.15 0.00 -0.02 0.00 0.00 35.03 33.90 2r8r n LYS 174 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2r8r s VAL 175 N -2.47 2.76 -0.13 -0.18 1.01 -1.23 -4.94 120.40 115.22 2r8r s VAL 175 Ca 0.10 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2r8r s VAL 175 Cb 0.14 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 2r8r s VAL 175 CO 0.63 0.47 -0.14 -0.31 0.00 0.00 0.00 175.10 175.75 2r8r s TYR 176 N 1.39 2.78 -0.46 5.22 2.02 -1.26 -4.89 117.35 122.15 2r8r s TYR 176 Ca 0.05 -0.77 0.03 0.00 -0.37 0.00 0.00 57.07 56.01 2r8r s TYR 176 Cb -0.14 -1.85 0.13 0.00 -0.40 0.00 0.00 41.96 39.71 2r8r s TYR 176 CO -0.08 -0.29 0.24 0.08 -1.57 0.00 0.00 175.55 173.93 2r8r s VAL 177 N 0.47 1.80 0.14 0.71 1.01 -1.26 -4.92 120.40 118.35 2r8r s VAL 177 Ca -0.10 -2.78 -0.18 0.00 0.00 0.00 0.00 61.98 58.92 2r8r s VAL 177 Cb -0.16 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2r8r s VAL 177 CO 0.05 -0.85 1.74 1.55 0.00 0.00 0.00 175.10 177.59 2r8r h PRO 178 N 6.70 0.19 -0.79 2.72 0.13 -2.03 -3.04 132.00 135.88 2r8r h PRO 178 Ca -0.04 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 64.94 2r8r h PRO 178 Cb 0.92 -0.04 -0.08 0.00 0.13 0.00 0.00 31.00 31.92 2r8r h PRO 178 CO 0.55 0.13 0.18 -0.85 -0.23 0.00 0.00 178.00 177.77 2r8r n GLU 179 N -5.05 3.27 -3.96 0.86 0.28 -1.26 -4.80 120.64 109.98 2r8r n GLU 179 Ca -0.01 -2.36 -0.29 0.00 -0.16 0.00 0.00 57.16 54.34 2r8r n GLU 179 Cb 0.11 -2.02 -0.16 0.00 1.43 0.00 0.00 31.44 30.80 2r8r n GLU 179 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2r8r s GLN 180 N -2.40 1.87 0.73 3.44 -1.52 -1.15 -5.13 119.66 115.49 2r8r s GLN 180 Ca 0.42 -0.63 -0.11 0.00 -1.95 0.00 0.00 55.36 53.09 2r8r s GLN 180 Cb 0.33 -2.15 0.03 0.00 -0.22 0.00 0.00 33.01 31.01 2r8r s GLN 180 CO 0.11 -0.37 1.08 0.00 -0.25 0.00 0.00 175.29 175.86 2r8r s ALA 181 N 1.52 2.42 0.21 6.09 0.00 -1.26 -4.71 121.76 126.02 2r8r s ALA 181 Ca 0.01 0.26 -0.15 0.00 0.00 0.00 0.00 51.96 52.08 2r8r s ALA 181 Cb -0.15 -3.25 0.22 0.00 0.00 0.00 0.00 23.12 19.94 2r8r s ALA 181 CO -0.09 -1.52 1.61 -0.09 0.00 0.00 0.00 175.76 175.67 2r8r h ARG 182 N -0.80 -0.05 -0.97 0.00 2.43 -1.99 0.14 114.38 113.15 2r8r h ARG 182 Ca -0.44 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 58.87 2r8r h ARG 182 Cb 1.23 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.71 2r8r h ARG 182 CO 0.53 -0.03 0.61 0.00 -1.51 0.00 0.00 179.97 179.57 2r8r h ALA 183 N 1.47 1.65 -0.12 2.80 0.00 -1.99 -0.49 119.26 122.57 2r8r h ALA 183 Ca 0.30 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.04 2r8r h ALA 183 Cb 0.52 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.15 2r8r h ALA 183 CO -0.69 0.09 -0.67 0.00 0.00 0.00 0.00 179.25 177.98 2r8r h ALA 184 N 1.57 0.24 -0.37 0.00 0.00 -1.15 -2.31 119.26 117.24 2r8r h ALA 184 Ca 0.49 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2r8r h ALA 184 Cb 0.61 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2r8r h ALA 184 CO -0.26 0.54 0.22 0.82 0.00 0.00 0.00 179.25 180.57 2r8r h ILE 185 N 0.33 1.13 -0.65 0.00 2.04 -0.88 -1.52 117.51 117.96 2r8r h ILE 185 Ca -0.05 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 2r8r h ILE 185 Cb 1.31 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 2r8r h ILE 185 CO 0.14 0.13 0.38 0.44 0.00 0.00 0.00 178.15 179.23 2r8r h ASP 186 N 0.48 0.77 0.80 1.72 5.19 -1.09 -0.87 116.42 123.42 2r8r h ASP 186 Ca 0.13 -0.04 -0.09 0.00 -0.62 0.00 0.00 57.03 56.41 2r8r h ASP 186 Cb 0.02 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 2r8r h ASP 186 CO -0.02 0.60 -0.42 0.00 -3.12 0.00 0.00 179.24 176.28 2r8r h ALA 187 N 1.53 1.00 0.00 3.45 0.00 -1.08 -3.35 119.26 120.80 2r8r h ALA 187 Ca 0.23 -0.38 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 2r8r h ALA 187 Cb -0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2r8r h ALA 187 CO -0.04 0.52 -0.84 0.35 0.00 0.00 0.00 179.25 179.24 2r8r h PHE 188 N 0.00 0.00 -1.67 0.00 3.57 -0.66 -3.42 116.94 114.76 2r8r h PHE 188 Ca -0.00 0.00 -0.70 0.00 3.53 0.00 0.00 57.97 60.79 2r8r h PHE 188 Cb 0.93 0.00 -0.14 0.00 2.79 0.00 0.00 35.95 39.53 2r8r h PHE 188 CO 0.00 1.01 1.61 -0.06 -2.23 0.00 0.00 178.31 178.63 2r8r s PHE 189 N -2.27 3.14 0.29 0.41 0.08 -0.39 -4.45 117.98 114.80 2r8r s PHE 189 Ca -0.23 -1.79 0.08 0.00 0.12 0.00 0.00 56.93 55.11 2r8r s PHE 189 Cb 0.03 -4.49 -0.06 0.00 -0.57 0.00 0.00 43.02 37.93 2r8r s PHE 189 CO 0.49 -1.59 -0.10 0.95 -0.10 0.00 0.00 175.22 174.87 2r8r s THR 190 N 2.85 1.95 0.13 0.64 -4.23 -1.26 -4.86 115.64 110.85 2r8r s THR 190 Ca 0.46 -2.20 -0.20 0.00 -1.18 0.00 0.00 61.69 58.57 2r8r s THR 190 Cb -0.00 -2.43 -0.05 0.00 1.34 0.00 0.00 72.50 71.35 2r8r s THR 190 CO 0.01 -0.32 1.74 -0.61 -0.54 0.00 0.00 174.62 174.90 2r8r h GLN 191 N 2.24 0.13 0.02 3.99 5.75 -1.93 -1.08 115.11 124.23 2r8r h GLN 191 Ca -0.40 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.09 2r8r h GLN 191 Cb 1.24 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.76 2r8r h GLN 191 CO 0.66 0.08 -0.01 1.15 -2.65 0.00 0.00 178.83 178.07 2r8r h THR 192 N 0.13 1.00 -0.47 2.39 2.02 -1.97 -1.72 112.91 114.29 2r8r h THR 192 Ca 0.09 -0.07 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 2r8r h THR 192 Cb 0.07 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 2r8r h THR 192 CO -0.11 0.02 0.03 0.78 0.37 0.00 0.00 175.52 176.61 2r8r h ASN 193 N -0.06 0.79 0.24 4.18 2.35 -1.81 -2.39 115.58 118.89 2r8r h ASN 193 Ca -0.00 -0.29 -0.10 0.00 -0.55 0.00 0.00 56.30 55.36 2r8r h ASN 193 Cb 0.05 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 2r8r h ASN 193 CO 0.01 0.89 -0.39 -0.07 -1.65 0.00 0.00 177.43 176.22 2r8r h LEU 194 N 0.67 0.22 -0.39 1.61 3.38 -1.18 -0.46 115.31 119.16 2r8r h LEU 194 Ca 0.14 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2r8r h LEU 194 Cb 0.47 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2r8r h LEU 194 CO 0.02 0.59 0.10 0.74 0.09 0.00 0.00 178.44 179.98 2r8r h THR 195 N 0.18 1.22 -0.31 0.22 2.02 -1.25 -1.12 112.91 113.87 2r8r h THR 195 Ca 0.02 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.43 2r8r h THR 195 Cb 0.77 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 2r8r h THR 195 CO 0.06 0.26 0.18 0.00 0.37 0.00 0.00 175.52 176.40 2r8r h ALA 196 N 0.95 0.39 -0.32 6.16 0.00 -0.99 -2.16 119.26 123.29 2r8r h ALA 196 Ca 0.12 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2r8r h ALA 196 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2r8r h ALA 196 CO 0.00 -0.10 -0.25 -0.07 0.00 0.00 0.00 179.25 178.83 2r8r h LEU 197 N 0.39 0.65 -0.71 0.00 3.38 -1.04 -2.93 115.31 115.06 2r8r h LEU 197 Ca 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2r8r h LEU 197 Cb 0.02 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2r8r h LEU 197 CO -0.02 0.88 0.40 -0.09 0.09 0.00 0.00 178.44 179.70 2r8r h ARG 198 N 0.55 0.97 -1.47 1.13 2.43 -1.07 -0.00 114.38 116.92 2r8r h ARG 198 Ca 0.08 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2r8r h ARG 198 Cb 0.72 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2r8r h ARG 198 CO 0.06 0.71 0.00 -1.91 -1.51 0.00 0.00 179.97 177.32 2r8r n GLU 199 N -4.51 0.17 -0.31 0.20 2.13 -0.83 -4.65 120.64 112.85 2r8r n GLU 199 Ca 0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.88 2r8r n GLU 199 Cb 0.08 -1.34 0.00 0.00 0.27 0.00 0.00 31.44 30.44 2r8r n GLU 199 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2r8r n ALA 201 N 0.81 -0.01 0.00 4.31 0.00 -0.02 -4.52 120.51 121.07 2r8r n ALA 201 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2r8r n ALA 201 Cb 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.46 2r8r n ALA 201 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2r8r n GLN 203 N -0.29 0.00 -0.08 0.00 6.02 -1.26 -0.58 117.38 121.19 2r8r n GLN 203 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 2r8r n GLN 203 Cb 0.01 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.26 2r8r n GLN 203 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2r8r h THR 204 N 0.00 0.80 -0.26 5.09 2.02 -1.96 -2.05 112.91 116.55 2r8r h THR 204 Ca 0.00 -0.03 -0.06 0.00 0.77 0.00 0.00 66.41 67.09 2r8r h THR 204 Cb 0.00 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 2r8r h THR 204 CO 0.00 0.02 -0.10 0.00 0.37 0.00 0.00 175.52 175.80 2r8r h ALA 205 N 1.25 1.33 -0.04 6.16 0.00 -1.23 -2.93 119.26 123.80 2r8r h ALA 205 Ca 0.14 -0.24 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 2r8r h ALA 205 Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2r8r h ALA 205 CO -0.23 0.45 -0.80 0.00 0.00 0.00 0.00 179.25 178.67 2r8r h ALA 206 N 1.49 0.55 0.00 0.00 0.00 -1.78 -3.08 119.26 116.44 2r8r h ALA 206 Ca 0.08 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2r8r h ALA 206 Cb 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2r8r h ALA 206 CO 0.02 0.81 0.00 0.00 0.00 0.00 0.00 179.25 180.08 2r8r n ALA 207 N -2.50 1.78 1.88 0.00 0.00 -0.78 -5.10 120.51 115.78 2r8r n ALA 207 Ca -0.04 -0.05 0.15 0.00 0.00 0.00 0.00 53.44 53.50 2r8r n ALA 207 Cb 0.75 -1.29 0.89 0.00 0.00 0.00 0.00 19.45 19.80 2r8r n ALA 207 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44