#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p8m s ILE 2 N 0.00 4.78 -0.08 5.15 1.01 -1.26 -4.05 121.20 126.75 2p8m s ILE 2 Ca 0.00 1.69 -0.06 0.00 0.00 0.00 0.00 60.65 62.28 2p8m s ILE 2 Cb 0.00 -4.14 0.03 0.00 0.01 0.00 0.00 42.46 38.36 2p8m s ILE 2 CO 0.00 0.32 0.20 0.42 0.00 0.00 0.00 174.94 175.88 2p8m s THR 3 N 0.20 -0.02 0.17 2.92 -4.23 -0.68 -4.99 115.64 109.01 2p8m s THR 3 Ca 0.41 0.07 0.08 0.00 -1.18 0.00 0.00 61.69 61.07 2p8m s THR 3 Cb -0.20 -0.30 -0.04 0.00 1.34 0.00 0.00 72.50 73.29 2p8m s THR 3 CO 0.23 0.03 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.41 2p8m s LEU 4 N 0.60 2.45 -0.15 4.79 1.02 -1.26 -2.07 118.68 124.06 2p8m s LEU 4 Ca -0.04 -0.88 -0.07 0.00 0.02 0.00 0.00 54.13 53.17 2p8m s LEU 4 Cb -0.06 -0.77 0.06 0.00 0.02 0.00 0.00 46.19 45.44 2p8m s LEU 4 CO -0.03 -0.07 0.33 -0.75 0.02 0.00 0.00 176.35 175.85 2p8m s LYS 5 N -2.90 0.26 0.19 1.70 2.20 0.95 -4.28 119.74 117.86 2p8m s LYS 5 Ca 0.16 0.75 -0.13 0.00 -0.36 0.00 0.00 55.97 56.38 2p8m s LYS 5 Cb -0.05 0.01 -0.07 0.00 -1.51 0.00 0.00 37.83 36.20 2p8m s LYS 5 CO 0.06 -0.21 0.57 -1.21 -0.36 0.00 0.00 175.35 174.21 2p8m s GLU 6 N 1.82 3.94 0.14 4.03 8.01 -1.26 -0.96 118.70 134.43 2p8m s GLU 6 Ca -0.06 0.46 -0.10 0.00 0.01 0.00 0.00 54.97 55.29 2p8m s GLU 6 Cb -0.10 -2.81 -0.00 0.00 -4.31 0.00 0.00 34.13 26.91 2p8m s GLU 6 CO -0.10 0.40 0.28 -1.54 0.01 0.00 0.00 175.26 174.31 2p8m s SER 7 N -1.95 0.02 0.00 -0.19 1.04 -0.20 -4.82 113.70 107.60 2p8m s SER 7 Ca 0.42 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2p8m s SER 7 Cb -0.14 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2p8m s SER 7 CO 0.20 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2p8m n GLY 8 N -0.19 0.53 3.67 7.32 0.00 -1.26 -1.45 105.19 113.81 2p8m n GLY 8 Ca -0.10 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 2p8m n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2p8m s PRO 9 N -2.00 4.28 0.46 1.61 0.04 -1.26 -4.95 135.00 133.18 2p8m s PRO 9 Ca 0.00 0.83 0.28 0.00 0.04 0.00 0.00 61.00 62.16 2p8m s PRO 9 Cb 0.00 -3.56 0.89 0.00 0.04 0.00 0.00 34.50 31.88 2p8m s PRO 9 CO 0.00 -0.23 1.80 -1.00 0.04 0.00 0.00 177.00 177.61 2p8m h PRO 10 N 7.30 0.00 -4.79 0.56 0.13 -1.95 -3.43 132.00 129.83 2p8m h PRO 10 Ca -0.32 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.21 2p8m h PRO 10 Cb 1.15 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.93 2p8m h PRO 10 CO 0.80 0.00 -0.84 -0.51 -0.23 0.00 0.00 178.00 177.22 2p8m s LEU 11 N -5.92 1.77 0.02 1.56 1.02 -1.26 0.78 118.68 116.65 2p8m s LEU 11 Ca 0.04 -0.47 0.02 0.00 0.02 0.00 0.00 54.13 53.74 2p8m s LEU 11 Cb 0.08 -1.17 -0.01 0.00 0.02 0.00 0.00 46.19 45.10 2p8m s LEU 11 CO 0.58 0.01 -0.06 -0.69 0.02 0.00 0.00 176.35 176.21 2p8m s VAL 12 N 1.10 0.42 0.11 -1.59 1.01 -0.41 -4.94 120.40 116.09 2p8m s VAL 12 Ca -0.03 -0.67 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 2p8m s VAL 12 Cb -0.14 -0.44 -0.07 0.00 0.00 0.00 0.00 36.38 35.73 2p8m s VAL 12 CO -0.04 -0.18 0.61 -0.54 0.00 0.00 0.00 175.10 174.95 2p8m s LYS 13 N -0.91 4.23 0.20 2.72 3.01 -1.25 -1.61 119.74 126.13 2p8m s LYS 13 Ca -0.05 0.78 -0.32 0.00 -1.01 0.00 0.00 55.97 55.37 2p8m s LYS 13 Cb -0.06 -3.18 -0.15 0.00 -1.01 0.00 0.00 37.83 33.43 2p8m s LYS 13 CO 0.00 0.59 1.16 -2.30 0.51 0.00 0.00 175.35 175.32 2p8m n PRO 14 N 1.52 1.27 0.00 -1.68 -0.02 -1.26 -1.19 135.00 133.64 2p8m n PRO 14 Ca -0.08 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2p8m n PRO 14 Cb 0.51 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 2p8m n PRO 14 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2p8m n THR 15 N 1.36 0.00 -0.55 3.45 -1.04 0.14 -4.91 114.28 112.72 2p8m n THR 15 Ca 0.14 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.89 2p8m n THR 15 Cb 0.26 0.00 0.18 0.00 -1.82 0.00 0.00 70.33 68.96 2p8m n THR 15 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2p8m n GLN 16 N 0.00 -2.34 -4.35 -2.82 6.02 -0.34 -2.72 117.38 110.83 2p8m n GLN 16 Ca 0.00 -0.68 -0.33 0.00 -0.01 0.00 0.00 57.00 55.97 2p8m n GLN 16 Cb 0.00 -1.66 -0.09 0.00 1.02 0.00 0.00 30.24 29.51 2p8m n GLN 16 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2p8m s THR 17 N -2.16 4.14 -0.24 5.09 2.01 -1.26 -2.91 115.64 120.31 2p8m s THR 17 Ca 0.50 -0.49 -0.09 0.00 0.31 0.00 0.00 61.69 61.93 2p8m s THR 17 Cb -0.10 -2.80 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 2p8m s THR 17 CO 0.52 0.47 0.11 -0.22 -0.69 0.00 0.00 174.62 174.82 2p8m s LEU 18 N -1.28 3.77 -0.17 4.42 2.96 0.23 -4.97 118.68 123.65 2p8m s LEU 18 Ca 0.17 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 2p8m s LEU 18 Cb -0.11 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.57 2p8m s LEU 18 CO 0.07 0.02 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.06 2p8m s THR 19 N 1.32 2.41 0.10 3.68 2.01 -1.26 -0.34 115.64 123.56 2p8m s THR 19 Ca 0.06 -0.84 0.10 0.00 0.31 0.00 0.00 61.69 61.31 2p8m s THR 19 Cb -0.15 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 2p8m s THR 19 CO 0.05 0.52 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.49 2p8m s LEU 20 N 1.03 2.27 -0.01 4.42 1.43 -0.01 -4.44 118.68 123.36 2p8m s LEU 20 Ca -0.01 -0.68 0.06 0.00 -1.03 0.00 0.00 54.13 52.47 2p8m s LEU 20 Cb -0.15 -1.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.93 2p8m s LEU 20 CO -0.05 0.17 -0.20 -0.89 0.23 0.00 0.00 176.35 175.61 2p8m s THR 21 N -1.00 1.56 -0.29 5.49 2.01 -0.53 -1.31 115.64 121.56 2p8m s THR 21 Ca 0.11 -0.85 -0.02 0.00 0.31 0.00 0.00 61.69 61.24 2p8m s THR 21 Cb -0.10 -1.30 0.04 0.00 0.01 0.00 0.00 72.50 71.16 2p8m s THR 21 CO 0.04 0.44 -0.01 0.00 -0.69 0.00 0.00 174.62 174.40 2p8m s SER 23 N 1.27 5.64 0.42 0.00 0.01 -0.14 -0.82 113.70 120.09 2p8m s SER 23 Ca -0.04 0.07 0.04 0.00 1.31 0.00 0.00 55.95 57.32 2p8m s SER 23 Cb -0.19 -1.97 -0.02 0.00 0.21 0.00 0.00 66.02 64.05 2p8m s SER 23 CO -0.01 0.16 0.13 0.72 0.41 0.00 0.00 173.24 174.65 2p8m s PHE 24 N 0.48 1.78 -0.11 2.43 -0.12 -1.15 -0.03 117.98 121.26 2p8m s PHE 24 Ca 0.04 -1.31 -0.30 0.00 -0.05 0.00 0.00 56.93 55.31 2p8m s PHE 24 Cb -0.13 -1.16 0.12 0.00 -0.63 0.00 0.00 43.02 41.22 2p8m s PHE 24 CO 0.01 -0.31 0.99 -1.54 -0.05 0.00 0.00 175.22 174.31 2p8m s SER 25 N -3.63 -0.34 0.00 1.98 1.04 -0.88 -4.94 113.70 106.93 2p8m s SER 25 Ca 0.22 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.88 2p8m s SER 25 Cb 0.02 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2p8m s SER 25 CO 0.14 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2p8m n GLY 26 N 0.33 0.22 3.66 7.32 0.00 -1.26 -1.69 105.19 113.77 2p8m n GLY 26 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 2p8m n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2p8m s PHE 27 N -2.00 -0.29 0.01 1.61 -0.12 -1.26 -4.61 117.98 111.32 2p8m s PHE 27 Ca 0.00 -0.01 0.03 0.00 -0.05 0.00 0.00 56.93 56.90 2p8m s PHE 27 Cb 0.00 0.62 -0.01 0.00 -0.63 0.00 0.00 43.02 43.00 2p8m s PHE 27 CO 0.00 -0.90 -0.09 -1.54 -0.05 0.00 0.00 175.22 172.64 2p8m s SER 28 N -2.80 1.07 0.00 1.98 1.04 -1.26 -4.99 113.70 108.74 2p8m s SER 28 Ca 0.08 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2p8m s SER 28 Cb -0.03 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.02 2p8m s SER 28 CO -0.02 0.03 0.52 -0.11 0.98 0.00 0.00 173.24 174.64 2p8m n LEU 29 N 2.41 1.55 -0.02 2.42 7.94 -1.26 -1.69 117.00 128.34 2p8m n LEU 29 Ca -0.16 -0.77 0.00 0.00 -1.11 0.00 0.00 56.01 53.97 2p8m n LEU 29 Cb 0.56 -0.28 0.00 0.00 0.53 0.00 0.00 43.42 44.24 2p8m n LEU 29 CO 0.24 0.26 0.15 -0.24 -1.11 0.00 0.00 177.39 176.69 2p8m n SER 30 N 0.68 0.62 -1.25 1.96 2.88 -1.26 -4.37 113.62 112.87 2p8m n SER 30 Ca 0.00 -0.81 -0.05 0.00 -1.33 0.00 0.00 58.87 56.68 2p8m n SER 30 Cb 0.26 0.45 0.07 0.00 -0.75 0.00 0.00 64.21 64.24 2p8m n SER 30 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2p8m n ASP 31 N -0.43 3.02 -2.29 -3.46 8.00 -0.68 -4.98 116.55 115.73 2p8m n ASP 31 Ca 0.00 -2.43 0.00 0.00 0.71 0.00 0.00 54.79 53.08 2p8m n ASP 31 Cb 0.02 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.53 2p8m n ASP 31 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2p8m n PHE 32 N 0.06 -4.80 0.00 1.24 7.35 -1.26 -4.44 117.46 115.60 2p8m n PHE 32 Ca 0.15 2.87 0.00 0.00 -0.76 0.00 0.00 57.45 59.71 2p8m n PHE 32 Cb 0.77 -3.73 0.00 0.00 0.35 0.00 0.00 39.48 36.87 2p8m n PHE 32 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2p8m n GLY 33 N 1.90 3.00 3.71 7.13 0.00 -1.26 -4.49 105.19 115.18 2p8m n GLY 33 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2p8m n GLY 33 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2p8m n VAL 34 N -2.00 1.61 -4.35 1.61 0.31 -1.26 -4.30 118.33 109.96 2p8m n VAL 34 Ca 0.00 -0.40 -0.18 0.00 -0.01 0.00 0.00 64.34 63.75 2p8m n VAL 34 Cb 0.00 -1.69 -0.10 0.00 -0.91 0.00 0.00 33.84 31.14 2p8m n VAL 34 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2p8m s GLY 35 N -0.02 1.49 -0.10 2.92 0.00 -0.55 -2.09 107.32 108.97 2p8m s GLY 35 Ca 0.59 -1.71 -0.03 0.00 0.00 0.00 0.00 44.72 43.57 2p8m s GLY 35 CO 0.58 -1.73 0.11 0.14 0.00 0.00 0.00 173.10 172.19 2p8m s VAL 35 N -3.12 -0.17 0.41 1.40 1.01 -0.67 -1.04 120.40 118.22 2p8m s VAL 35 Ca 0.24 0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.51 2p8m s VAL 35 Cb 0.02 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 2p8m s VAL 35 CO 0.07 0.02 0.25 -0.83 0.00 0.00 0.00 175.10 174.61 2p8m s GLY 35 N 2.21 2.27 -0.06 4.51 0.00 -0.35 -2.56 107.32 113.34 2p8m s GLY 35 Ca 0.04 -2.04 0.05 0.00 0.00 0.00 0.00 44.72 42.78 2p8m s GLY 35 CO -0.06 -1.84 -0.23 -0.98 0.00 0.00 0.00 173.10 169.99 2p8m s TRP 36 N -2.56 2.30 -0.00 1.90 0.52 -0.10 -0.55 118.94 120.45 2p8m s TRP 36 Ca 0.43 -0.72 0.01 0.00 0.02 0.00 0.00 56.10 55.85 2p8m s TRP 36 Cb 0.01 -1.52 -0.00 0.00 -1.15 0.00 0.00 33.47 30.81 2p8m s TRP 36 CO 0.24 -0.23 -0.03 0.42 0.02 0.00 0.00 176.95 177.37 2p8m s ILE 37 N -0.06 0.26 0.20 2.03 1.09 0.68 -0.93 121.20 124.48 2p8m s ILE 37 Ca -0.06 -0.16 0.09 0.00 -1.10 0.00 0.00 60.65 59.42 2p8m s ILE 37 Cb -0.14 -0.23 -0.05 0.00 -1.06 0.00 0.00 42.46 40.98 2p8m s ILE 37 CO 0.04 0.06 -0.17 0.00 -0.10 0.00 0.00 174.94 174.77 2p8m s ARG 38 N -0.11 1.36 -0.16 2.79 1.70 -0.04 0.78 118.95 125.27 2p8m s ARG 38 Ca 0.01 -1.54 -0.05 0.00 -0.47 0.00 0.00 55.73 53.68 2p8m s ARG 38 Cb -0.01 -1.31 0.06 0.00 -0.57 0.00 0.00 34.95 33.11 2p8m s ARG 38 CO -0.00 0.24 0.09 -1.14 -1.08 0.00 0.00 175.30 173.41 2p8m s GLN 39 N -3.28 0.06 0.41 3.89 0.74 0.13 -0.66 119.66 120.94 2p8m s GLN 39 Ca 0.21 -0.04 -0.25 0.00 0.05 0.00 0.00 55.36 55.33 2p8m s GLN 39 Cb -0.03 -1.70 -0.08 0.00 1.10 0.00 0.00 33.01 32.29 2p8m s GLN 39 CO 0.08 -0.63 1.18 -2.14 -0.55 0.00 0.00 175.29 173.22 2p8m s PRO 40 N 2.14 4.00 -0.32 1.67 0.02 -1.26 -0.88 135.00 140.37 2p8m s PRO 40 Ca 0.02 1.85 -0.39 0.00 0.02 0.00 0.00 61.00 62.50 2p8m s PRO 40 Cb -0.16 -2.64 -0.15 0.00 0.02 0.00 0.00 34.50 31.58 2p8m s PRO 40 CO -0.08 -0.37 1.91 -0.35 -0.33 0.00 0.00 177.00 177.78 2p8m n PRO 41 N -0.01 1.05 -0.81 5.54 -0.04 -1.26 0.32 135.00 139.78 2p8m n PRO 41 Ca 0.05 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 2p8m n PRO 41 Cb 0.46 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 2p8m n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2p8m n GLY 42 N 5.18 0.89 3.37 0.55 0.00 -1.26 -5.03 105.19 108.89 2p8m n GLY 42 Ca 0.33 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.15 2p8m n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2p8m n LYS 43 N -2.05 0.73 -2.37 1.61 4.76 0.15 -5.14 118.16 115.86 2p8m n LYS 43 Ca 0.00 -2.91 -0.25 0.00 -2.87 0.00 0.00 58.31 52.28 2p8m n LYS 43 Cb 0.00 0.13 0.10 0.00 -1.84 0.00 0.00 35.03 33.41 2p8m n LYS 43 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2p8m s ALA 44 N -2.66 3.34 0.37 7.82 0.00 -1.26 -4.65 121.76 124.71 2p8m s ALA 44 Ca 0.37 -1.33 -0.26 0.00 0.00 0.00 0.00 51.96 50.73 2p8m s ALA 44 Cb -0.03 -2.32 -0.09 0.00 0.00 0.00 0.00 23.12 20.68 2p8m s ALA 44 CO 0.23 -1.45 1.14 -0.51 0.00 0.00 0.00 175.76 175.18 2p8m s LEU 45 N -5.23 4.27 -0.07 0.00 1.43 -1.26 -4.26 118.68 113.55 2p8m s LEU 45 Ca 0.64 2.30 0.02 0.00 -1.03 0.00 0.00 54.13 56.06 2p8m s LEU 45 Cb -0.08 -3.94 0.01 0.00 0.03 0.00 0.00 46.19 42.21 2p8m s LEU 45 CO 0.45 -0.52 -0.13 -0.70 0.23 0.00 0.00 176.35 175.68 2p8m s GLU 46 N -2.12 1.83 0.13 1.70 2.12 0.16 -4.98 118.70 117.53 2p8m s GLU 46 Ca 0.54 -0.45 -0.30 0.00 0.36 0.00 0.00 54.97 55.12 2p8m s GLU 46 Cb -0.30 -1.51 -0.06 0.00 0.26 0.00 0.00 34.13 32.51 2p8m s GLU 46 CO 0.38 0.02 1.04 -0.46 -0.54 0.00 0.00 175.26 175.70 2p8m s TRP 47 N 0.72 3.68 -0.08 5.30 -0.00 -1.26 -0.86 118.94 126.43 2p8m s TRP 47 Ca -0.13 1.66 -0.10 0.00 -0.00 0.00 0.00 56.10 57.53 2p8m s TRP 47 Cb -0.16 -3.18 -0.04 0.00 -0.00 0.00 0.00 33.47 30.09 2p8m s TRP 47 CO 0.03 -0.28 -0.21 1.28 -0.00 0.00 0.00 176.95 177.77 2p8m n LEU 48 N 2.81 1.52 -3.60 5.86 4.77 -0.11 -4.71 117.00 123.54 2p8m n LEU 48 Ca 0.03 0.24 -0.06 0.00 -0.03 0.00 0.00 56.01 56.20 2p8m n LEU 48 Cb 0.48 -0.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2p8m n LEU 48 CO 0.53 -0.32 0.75 0.00 -1.33 0.00 0.00 177.39 177.02 2p8m s ALA 49 N -2.49 -1.82 -0.00 -1.18 0.00 -1.16 -1.13 121.76 113.97 2p8m s ALA 49 Ca -0.18 0.76 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 2p8m s ALA 49 Cb 0.04 0.44 -0.00 0.00 0.00 0.00 0.00 23.12 23.59 2p8m s ALA 49 CO 0.26 -0.82 0.04 -1.50 0.00 0.00 0.00 175.76 173.74 2p8m s ILE 50 N -3.06 0.04 -0.01 0.00 2.07 -0.22 -0.93 121.20 119.09 2p8m s ILE 50 Ca 0.08 -0.37 0.01 0.00 -1.41 0.00 0.00 60.65 58.97 2p8m s ILE 50 Cb -0.01 -0.18 0.00 0.00 0.13 0.00 0.00 42.46 42.41 2p8m s ILE 50 CO -0.05 -0.20 -0.04 -0.51 -1.91 0.00 0.00 174.94 172.24 2p8m s ILE 51 N -0.61 0.33 0.17 2.00 2.07 -1.06 -1.58 121.20 122.52 2p8m s ILE 51 Ca -0.07 -0.13 0.01 0.00 -1.41 0.00 0.00 60.65 59.05 2p8m s ILE 51 Cb -0.04 -0.32 0.01 0.00 0.13 0.00 0.00 42.46 42.24 2p8m s ILE 51 CO -0.00 0.12 0.10 -1.22 -1.91 0.00 0.00 174.94 172.03 2p8m n TYR 52 N 3.30 -0.87 -0.07 3.50 4.02 -0.56 -1.68 117.16 124.80 2p8m n TYR 52 Ca -0.17 -0.74 0.08 0.00 -0.01 0.00 0.00 57.90 57.07 2p8m n TYR 52 Cb 0.56 -0.13 0.45 0.00 -0.02 0.00 0.00 39.34 40.20 2p8m n TYR 52 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2p8m h SER 53 N 0.24 0.45 0.04 7.72 0.02 -1.62 -2.17 113.55 118.23 2p8m h SER 53 Ca -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2p8m h SER 53 Cb 0.40 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2p8m h SER 53 CO 0.18 0.30 -0.01 -0.90 -1.14 0.00 0.00 176.83 175.25 2p8m n ASP 54 N -4.47 0.71 0.00 3.07 3.85 -1.26 -4.83 116.55 113.61 2p8m n ASP 54 Ca 0.08 -1.17 0.00 0.00 -0.71 0.00 0.00 54.79 52.99 2p8m n ASP 54 Cb 0.24 -0.01 0.00 0.00 -1.35 0.00 0.00 41.12 40.00 2p8m n ASP 54 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 2p8m n ASP 55 N -0.48 -1.96 -4.75 -1.12 2.03 -0.82 -5.01 116.55 104.44 2p8m n ASP 55 Ca 0.21 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 55.10 2p8m n ASP 55 Cb 0.24 -0.33 -0.02 0.00 -0.72 0.00 0.00 41.12 40.29 2p8m n ASP 55 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2p8m s ASP 56 N -2.39 6.60 0.06 1.67 2.15 -1.26 -4.81 116.67 118.68 2p8m s ASP 56 Ca 0.00 2.75 0.04 0.00 0.43 0.00 0.00 52.55 55.77 2p8m s ASP 56 Cb 0.00 -2.63 -0.03 0.00 -0.30 0.00 0.00 42.92 39.96 2p8m s ASP 56 CO 0.00 -0.72 -0.11 -0.54 -0.17 0.00 0.00 175.17 173.63 2p8m s LYS 57 N -0.86 0.68 -0.19 4.34 1.02 -1.26 -1.50 119.74 121.97 2p8m s LYS 57 Ca 0.57 -0.86 -0.15 0.00 0.02 0.00 0.00 55.97 55.54 2p8m s LYS 57 Cb -0.43 -0.57 0.05 0.00 -0.52 0.00 0.00 37.83 36.36 2p8m s LYS 57 CO 0.48 0.12 0.48 1.03 -0.92 0.00 0.00 175.35 176.54 2p8m s ARG 58 N -1.67 0.54 0.42 1.68 3.00 -0.62 -4.99 118.95 117.31 2p8m s ARG 58 Ca -0.06 0.73 0.03 0.00 0.00 0.00 0.00 55.73 56.43 2p8m s ARG 58 Cb -0.10 0.21 -0.03 0.00 0.00 0.00 0.00 34.95 35.03 2p8m s ARG 58 CO 0.01 -0.09 0.09 0.71 0.00 0.00 0.00 175.30 176.02 2p8m s TYR 59 N 0.54 1.86 -0.30 -0.53 1.51 -1.26 -1.06 117.35 118.11 2p8m s TYR 59 Ca -0.02 -1.14 -0.28 0.00 -1.01 0.00 0.00 57.07 54.62 2p8m s TYR 59 Cb -0.04 -1.30 0.01 0.00 -0.11 0.00 0.00 41.96 40.52 2p8m s TYR 59 CO -0.03 -0.11 1.03 0.45 -1.11 0.00 0.00 175.55 175.78 2p8m s SER 60 N -3.65 6.93 0.31 2.29 0.15 -0.28 -4.91 113.70 114.54 2p8m s SER 60 Ca 0.22 1.06 0.07 0.00 0.70 0.00 0.00 55.95 58.00 2p8m s SER 60 Cb 0.04 -2.52 0.88 0.00 -1.71 0.00 0.00 66.02 62.70 2p8m s SER 60 CO 0.12 -0.80 1.62 -0.65 1.20 0.00 0.00 173.24 174.74 2p8m h PRO 61 N 7.97 0.15 0.00 5.44 0.11 -1.96 0.84 132.00 144.55 2p8m h PRO 61 Ca -0.21 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.83 2p8m h PRO 61 Cb 1.07 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2p8m h PRO 61 CO 1.00 0.10 -0.30 1.03 -0.21 0.00 0.00 178.00 179.63 2p8m h SER 62 N 0.16 0.00 -0.09 -2.05 0.87 -1.99 -3.03 113.55 107.42 2p8m h SER 62 Ca 0.64 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.20 2p8m h SER 62 Cb 1.40 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.36 2p8m h SER 62 CO -0.72 0.30 0.00 0.18 -0.53 0.00 0.00 176.83 176.06 2p8m n LEU 63 N -4.13 2.22 -0.37 2.23 7.99 0.11 -4.83 117.00 120.22 2p8m n LEU 63 Ca -0.02 -1.21 0.28 0.00 -0.01 0.00 0.00 56.01 55.05 2p8m n LEU 63 Cb 0.35 -0.05 0.55 0.00 -0.11 0.00 0.00 43.42 44.15 2p8m n LEU 63 CO 0.37 0.46 1.17 -1.13 -1.51 0.00 0.00 177.39 176.75 2p8m h ASN 64 N 2.33 0.40 -0.04 -1.43 -0.73 0.59 -0.15 115.58 116.56 2p8m h ASN 64 Ca 0.00 0.15 0.00 0.00 1.87 0.00 0.00 56.30 58.32 2p8m h ASN 64 Cb 0.56 0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.26 2p8m h ASN 64 CO 0.00 -0.12 0.00 0.35 -0.37 0.00 0.00 177.43 177.29 2p8m n THR 65 N -4.86 0.04 0.45 -3.57 -2.24 -1.26 -3.87 114.28 98.96 2p8m n THR 65 Ca 0.33 -0.25 0.04 0.00 -2.27 0.00 0.00 64.05 61.90 2p8m n THR 65 Cb 1.13 0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 69.73 2p8m n THR 65 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2p8m n ARG 66 N 0.14 3.75 -4.68 -0.78 1.74 -0.10 -4.95 116.66 111.78 2p8m n ARG 66 Ca 0.19 -0.05 -0.30 0.00 -0.77 0.00 0.00 57.85 56.92 2p8m n ARG 66 Cb 0.34 -0.96 -0.13 0.00 -1.02 0.00 0.00 32.46 30.69 2p8m n ARG 66 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2p8m s LEU 67 N -2.38 2.47 -0.07 0.55 1.43 -1.02 -0.89 118.68 118.76 2p8m s LEU 67 Ca 0.04 -0.51 -0.03 0.00 -1.03 0.00 0.00 54.13 52.60 2p8m s LEU 67 Cb 0.07 -1.43 0.04 0.00 0.03 0.00 0.00 46.19 44.90 2p8m s LEU 67 CO 0.38 0.24 0.14 -0.89 0.23 0.00 0.00 176.35 176.45 2p8m s THR 68 N -0.92 -0.21 -0.07 5.49 2.01 -0.74 -4.94 115.64 116.25 2p8m s THR 68 Ca 0.14 0.35 0.03 0.00 0.31 0.00 0.00 61.69 62.53 2p8m s THR 68 Cb -0.10 -0.26 -0.02 0.00 0.01 0.00 0.00 72.50 72.13 2p8m s THR 68 CO 0.05 0.15 -0.17 -0.51 -0.69 0.00 0.00 174.62 173.44 2p8m s ILE 69 N 2.13 2.74 0.32 1.82 2.07 -1.26 -1.31 121.20 127.71 2p8m s ILE 69 Ca 0.02 -0.82 0.06 0.00 -1.41 0.00 0.00 60.65 58.50 2p8m s ILE 69 Cb -0.12 -2.07 -0.03 0.00 0.13 0.00 0.00 42.46 40.37 2p8m s ILE 69 CO -0.05 0.57 0.24 0.42 -1.91 0.00 0.00 174.94 174.21 2p8m s THR 70 N -0.27 0.06 -0.05 4.00 -4.23 -0.69 -4.98 115.64 109.48 2p8m s THR 70 Ca 0.01 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.42 2p8m s THR 70 Cb -0.13 -2.48 0.02 0.00 1.34 0.00 0.00 72.50 71.25 2p8m s THR 70 CO 0.03 0.00 0.25 -1.59 -0.54 0.00 0.00 174.62 172.76 2p8m s LYS 71 N -3.57 0.44 -0.23 3.99 -2.85 -1.26 -1.23 119.74 115.03 2p8m s LYS 71 Ca 0.39 0.05 0.01 0.00 -1.00 0.00 0.00 55.97 55.42 2p8m s LYS 71 Cb 0.03 0.20 0.06 0.00 -2.06 0.00 0.00 37.83 36.06 2p8m s LYS 71 CO 0.24 -0.09 -0.07 0.34 0.10 0.00 0.00 175.35 175.87 2p8m s ASP 72 N -0.58 3.84 0.12 0.03 -1.08 -0.13 -4.99 116.67 113.88 2p8m s ASP 72 Ca -0.07 -1.15 0.26 0.00 -0.52 0.00 0.00 52.55 51.07 2p8m s ASP 72 Cb -0.04 -1.23 0.98 0.00 -1.46 0.00 0.00 42.92 41.17 2p8m s ASP 72 CO 0.02 -0.22 1.80 0.35 0.52 0.00 0.00 175.17 177.64 2p8m n THR 73 N 4.65 0.42 0.06 1.71 -2.24 -1.26 -0.95 114.28 116.66 2p8m n THR 73 Ca -0.13 -0.08 -0.20 0.00 -2.27 0.00 0.00 64.05 61.37 2p8m n THR 73 Cb 0.44 -0.64 -0.14 0.00 -2.10 0.00 0.00 70.33 67.89 2p8m n THR 73 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2p8m h SER 74 N 0.00 0.60 0.27 3.42 0.02 -1.95 -3.29 113.55 112.62 2p8m h SER 74 Ca 0.00 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 2p8m h SER 74 Cb 0.57 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2p8m h SER 74 CO 0.00 1.43 -0.40 0.29 -1.14 0.00 0.00 176.83 177.01 2p8m n LYS 75 N -4.04 0.58 -3.54 3.45 5.02 -1.20 -4.97 118.16 113.46 2p8m n LYS 75 Ca -0.13 -0.37 -0.22 0.00 -2.02 0.00 0.00 58.31 55.57 2p8m n LYS 75 Cb 0.85 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 34.42 2p8m n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2p8m n ASN 76 N -0.89 -4.14 -3.99 4.39 3.02 -0.13 -4.86 115.26 108.65 2p8m n ASN 76 Ca 0.09 -0.83 -0.10 0.00 -0.03 0.00 0.00 54.58 53.71 2p8m n ASN 76 Cb 0.35 -4.28 -0.11 0.00 -0.61 0.00 0.00 39.78 35.13 2p8m n ASN 76 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2p8m s GLN 77 N -5.45 0.35 0.08 3.52 -0.21 -0.71 -2.93 119.66 114.30 2p8m s GLN 77 Ca 0.28 -0.63 0.10 0.00 0.02 0.00 0.00 55.36 55.14 2p8m s GLN 77 Cb -0.07 0.03 -0.03 0.00 1.00 0.00 0.00 33.01 33.94 2p8m s GLN 77 CO 0.80 -0.03 -0.27 0.08 -2.12 0.00 0.00 175.29 173.75 2p8m s VAL 78 N -1.42 2.20 0.02 1.09 1.01 0.00 -0.96 120.40 122.34 2p8m s VAL 78 Ca -0.15 -1.56 0.05 0.00 0.00 0.00 0.00 61.98 60.32 2p8m s VAL 78 Cb -0.10 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 2p8m s VAL 78 CO -0.01 0.24 -0.15 -0.69 0.00 0.00 0.00 175.10 174.49 2p8m s VAL 79 N -0.93 1.15 -0.09 2.92 1.01 -0.37 -0.09 120.40 124.01 2p8m s VAL 79 Ca 0.13 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2p8m s VAL 79 Cb -0.10 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.29 2p8m s VAL 79 CO 0.04 0.16 -0.13 -0.22 0.00 0.00 0.00 175.10 174.96 2p8m s LEU 80 N -0.77 1.60 -0.17 3.92 2.96 -0.43 -1.70 118.68 124.10 2p8m s LEU 80 Ca 0.04 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 2p8m s LEU 80 Cb -0.07 -0.95 -0.01 0.00 0.50 0.00 0.00 46.19 45.67 2p8m s LEU 80 CO 0.00 -0.00 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.22 2p8m s VAL 81 N 0.98 2.91 -0.20 1.68 1.01 -0.43 -0.83 120.40 125.53 2p8m s VAL 81 Ca -0.08 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.24 2p8m s VAL 81 Cb -0.15 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.01 2p8m s VAL 81 CO -0.01 0.50 -0.16 -0.32 0.00 0.00 0.00 175.10 175.12 2p8m s MET 82 N 0.89 2.57 0.39 2.72 1.75 0.54 -1.79 119.30 126.37 2p8m s MET 82 Ca -0.03 -0.93 -0.02 0.00 -1.25 0.00 0.00 55.69 53.46 2p8m s MET 82 Cb -0.15 -2.57 -0.04 0.00 2.84 0.00 0.00 34.83 34.91 2p8m s MET 82 CO -0.00 -0.34 0.64 0.95 -0.65 0.00 0.00 175.02 175.62 2p8m s THR 82 N 1.28 5.02 -0.77 10.11 -4.23 -0.06 -0.61 115.64 126.38 2p8m s THR 82 Ca 0.01 -0.13 -0.05 0.00 -1.18 0.00 0.00 61.69 60.34 2p8m s THR 82 Cb -0.15 -3.85 0.01 0.00 1.34 0.00 0.00 72.50 69.85 2p8m s THR 82 CO -0.10 -0.64 0.53 -2.11 -0.54 0.00 0.00 174.62 171.76 2p8m n ARG 82 N -1.85 -1.19 -2.59 3.99 1.85 -1.10 -4.91 116.66 110.86 2p8m n ARG 82 Ca -0.02 0.54 -0.32 0.00 -1.00 0.00 0.00 57.85 57.04 2p8m n ARG 82 Cb 0.55 -1.92 -0.05 0.00 -1.05 0.00 0.00 32.46 29.99 2p8m n ARG 82 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2p8m s VAL 82 N -2.99 4.48 0.35 8.89 -7.23 -1.15 -4.65 120.40 118.11 2p8m s VAL 82 Ca 0.06 1.31 0.04 0.00 -1.81 0.00 0.00 61.98 61.58 2p8m s VAL 82 Cb -0.04 -3.67 -0.05 0.00 0.56 0.00 0.00 36.38 33.18 2p8m s VAL 82 CO 0.79 -0.53 0.07 -0.94 -0.31 0.00 0.00 175.10 174.19 2p8m s SER 83 N -2.70 2.53 0.65 4.85 1.04 -1.26 0.25 113.70 119.07 2p8m s SER 83 Ca 0.60 -1.46 0.33 0.00 0.48 0.00 0.00 55.95 55.89 2p8m s SER 83 Cb -0.10 0.10 1.79 0.00 0.10 0.00 0.00 66.02 67.91 2p8m s SER 83 CO 0.24 -0.70 2.03 -0.65 0.98 0.00 0.00 173.24 175.14 2p8m h PRO 84 N 2.00 0.00 0.00 4.02 0.11 -1.98 -0.35 132.00 135.80 2p8m h PRO 84 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2p8m h PRO 84 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2p8m h PRO 84 CO 0.66 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 179.78 2p8m n VAL 85 N -3.10 0.18 1.09 3.15 0.24 -1.26 -2.32 118.33 116.32 2p8m n VAL 85 Ca -0.01 0.05 0.12 0.00 -2.04 0.00 0.00 64.34 62.46 2p8m n VAL 85 Cb 0.33 -0.64 0.30 0.00 -1.47 0.00 0.00 33.84 32.36 2p8m n VAL 85 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2p8m n ASP 86 N -1.24 0.68 -4.68 -1.34 8.00 -0.14 -4.85 116.55 112.98 2p8m n ASP 86 Ca 0.13 -0.47 -0.44 0.00 0.71 0.00 0.00 54.79 54.72 2p8m n ASP 86 Cb 0.18 0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 41.45 2p8m n ASP 86 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2p8m n THR 87 N -1.20 0.50 -3.97 -3.53 -1.04 -0.98 -4.85 114.28 99.22 2p8m n THR 87 Ca 0.08 -0.09 0.02 0.00 -2.04 0.00 0.00 64.05 62.02 2p8m n THR 87 Cb 0.34 -2.08 0.01 0.00 -1.82 0.00 0.00 70.33 66.78 2p8m n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2p8m n ALA 88 N 6.23 -3.08 -2.94 2.41 0.00 -0.96 -4.45 120.51 117.72 2p8m n ALA 88 Ca 0.19 -0.75 -0.34 0.00 0.00 0.00 0.00 53.44 52.54 2p8m n ALA 88 Cb 0.36 0.20 -0.11 0.00 0.00 0.00 0.00 19.45 19.89 2p8m n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2p8m s THR 89 N -2.04 4.18 -0.19 0.00 2.01 -0.06 -1.54 115.64 118.00 2p8m s THR 89 Ca 0.26 -0.25 -0.07 0.00 0.31 0.00 0.00 61.69 61.94 2p8m s THR 89 Cb -0.01 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.60 2p8m s THR 89 CO 0.00 0.47 0.06 -0.31 -0.69 0.00 0.00 174.62 174.15 2p8m s TYR 90 N 0.51 3.22 0.01 4.92 1.51 0.38 0.17 117.35 128.07 2p8m s TYR 90 Ca -0.01 0.01 0.06 0.00 -1.01 0.00 0.00 57.07 56.12 2p8m s TYR 90 Cb -0.14 -2.09 -0.03 0.00 -0.11 0.00 0.00 41.96 39.59 2p8m s TYR 90 CO 0.02 0.09 -0.17 -0.06 -1.11 0.00 0.00 175.55 174.32 2p8m s PHE 91 N 0.51 2.60 0.16 2.71 0.08 0.23 -1.01 117.98 123.27 2p8m s PHE 91 Ca 0.03 -0.23 0.09 0.00 0.12 0.00 0.00 56.93 56.94 2p8m s PHE 91 Cb -0.13 -1.52 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 2p8m s PHE 91 CO 0.01 0.22 -0.11 0.00 -0.10 0.00 0.00 175.22 175.24 2p8m s ALA 93 N -1.56 0.31 -0.13 0.00 0.00 0.28 -1.54 121.76 119.12 2p8m s ALA 93 Ca 0.23 -1.11 -0.04 0.00 0.00 0.00 0.00 51.96 51.04 2p8m s ALA 93 Cb -0.09 0.93 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 2p8m s ALA 93 CO 0.14 -0.62 0.03 -1.58 0.00 0.00 0.00 175.76 173.73 2p8m s HIS 94 N -4.01 3.22 -0.15 0.00 5.65 0.71 -1.21 115.29 119.49 2p8m s HIS 94 Ca 0.21 0.12 0.01 0.00 0.25 0.00 0.00 55.06 55.66 2p8m s HIS 94 Cb 0.04 -1.92 0.01 0.00 -1.18 0.00 0.00 32.58 29.53 2p8m s HIS 94 CO 0.02 0.33 -0.19 0.50 -0.65 0.00 0.00 174.74 174.75 2p8m s ARG 95 N -0.34 3.09 0.81 2.88 3.52 -0.21 -1.51 118.95 127.19 2p8m s ARG 95 Ca 0.08 -0.81 -0.11 0.00 -0.13 0.00 0.00 55.73 54.76 2p8m s ARG 95 Cb -0.12 -2.53 0.08 0.00 -1.56 0.00 0.00 34.95 30.82 2p8m s ARG 95 CO 0.02 -0.03 1.11 1.03 -0.81 0.00 0.00 175.30 176.63 2p8m s ARG 96 N 0.87 1.90 0.41 5.12 0.52 -1.26 -1.48 118.95 125.04 2p8m s ARG 96 Ca -0.05 1.32 0.08 0.00 -0.52 0.00 0.00 55.73 56.56 2p8m s ARG 96 Cb -0.15 -1.85 -0.03 0.00 0.52 0.00 0.00 34.95 33.44 2p8m s ARG 96 CO -0.02 -1.93 0.29 0.20 0.02 0.00 0.00 175.30 173.86 2p8m s GLY 97 N -3.07 2.19 -0.17 -3.53 0.00 -1.26 -4.51 107.32 96.97 2p8m s GLY 97 Ca 0.64 -1.96 -0.38 0.00 0.00 0.00 0.00 44.72 43.01 2p8m s GLY 97 CO 0.55 -1.77 1.69 -1.05 0.00 0.00 0.00 173.10 172.52 2p8m n PRO 98 N -1.41 1.34 0.00 2.90 -0.02 -1.26 -4.80 135.00 131.75 2p8m n PRO 98 Ca 0.01 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2p8m n PRO 98 Cb 0.63 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 2p8m n PRO 98 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2p8m n THR 99 N 4.26 0.00 0.00 3.45 5.66 -1.26 -5.02 114.28 121.38 2p8m n THR 99 Ca 0.24 1.17 0.00 0.00 -3.05 0.00 0.00 64.05 62.41 2p8m n THR 99 Cb 0.17 -1.57 0.00 0.00 -1.55 0.00 0.00 70.33 67.38 2p8m n THR 99 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2p8m n GLY 100 N -0.99 1.05 0.00 1.09 0.00 -1.26 -5.24 105.19 99.84 2p8m n GLY 100 Ca 0.00 0.13 0.06 0.00 0.00 0.00 0.00 46.02 46.21 2p8m n GLY 100 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2p8m n PRO 100 N 0.00 0.51 0.02 1.61 -0.04 -1.26 -1.99 135.00 133.85 2p8m n PRO 100 Ca 0.00 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 2p8m n PRO 100 Cb 0.00 -1.36 0.10 0.00 -0.04 0.00 0.00 33.50 32.20 2p8m n PRO 100 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2p8m n VAL 100 N -0.86 0.13 -1.55 0.52 0.24 -1.26 -4.33 118.33 111.21 2p8m n VAL 100 Ca 0.09 -0.15 -0.40 0.00 -2.04 0.00 0.00 64.34 61.84 2p8m n VAL 100 Cb 0.04 0.26 -0.02 0.00 -1.47 0.00 0.00 33.84 32.65 2p8m n VAL 100 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2p8m n ASN 100 N -1.79 7.35 0.00 -1.34 3.02 -0.84 -4.72 115.26 116.94 2p8m n ASN 100 Ca 0.03 -2.73 0.00 0.00 -0.03 0.00 0.00 54.58 51.85 2p8m n ASN 100 Cb 0.39 -1.55 0.00 0.00 -0.61 0.00 0.00 39.78 38.01 2p8m n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p8m n ALA 100 N 3.95 0.00 -2.68 5.41 0.00 -1.26 -5.07 120.51 120.86 2p8m n ALA 100 Ca 0.69 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.71 2p8m n ALA 100 Cb 0.28 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.62 2p8m n ALA 100 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2p8m s MET 100 N -2.00 2.88 0.26 0.00 -1.94 -1.26 -4.46 119.30 112.77 2p8m s MET 100 Ca 0.00 -1.06 0.21 0.00 -1.71 0.00 0.00 55.69 53.13 2p8m s MET 100 Cb 0.00 -3.83 0.08 0.00 2.01 0.00 0.00 34.83 33.09 2p8m s MET 100 CO 0.00 -0.72 1.20 0.38 -0.01 0.00 0.00 175.02 175.87 2p8m h ASP 101 N 8.51 0.00 -3.40 3.03 2.03 -1.64 -3.46 116.42 121.50 2p8m h ASP 101 Ca -0.26 0.00 -0.30 0.00 -0.73 0.00 0.00 57.03 55.74 2p8m h ASP 101 Cb 1.11 0.00 -0.35 0.00 -0.83 0.00 0.00 39.33 39.26 2p8m h ASP 101 CO 0.69 0.11 -0.69 -0.69 -1.03 0.00 0.00 179.24 177.63 2p8m s VAL 102 N -3.24 -0.09 0.17 4.15 1.01 -1.25 -4.99 120.40 116.16 2p8m s VAL 102 Ca 0.02 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.35 2p8m s VAL 102 Cb 0.08 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.26 2p8m s VAL 102 CO 0.76 0.11 -0.08 0.26 0.00 0.00 0.00 175.10 176.15 2p8m s TRP 103 N 1.49 2.69 0.93 5.22 0.52 -1.26 -0.21 118.94 128.31 2p8m s TRP 103 Ca -0.05 -0.20 -0.16 0.00 0.02 0.00 0.00 56.10 55.72 2p8m s TRP 103 Cb -0.12 -1.32 0.21 0.00 -1.15 0.00 0.00 33.47 31.09 2p8m s TRP 103 CO -0.04 0.50 1.26 0.41 0.02 0.00 0.00 176.95 179.10 2p8m n GLY 104 N 0.07 -1.47 0.22 0.98 0.00 -0.59 -4.56 105.19 99.84 2p8m n GLY 104 Ca -0.11 -1.71 0.14 0.00 0.00 0.00 0.00 46.02 44.34 2p8m n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2p8m n GLN 105 N -3.67 0.92 0.00 1.61 1.13 -1.26 -4.83 117.38 111.29 2p8m n GLN 105 Ca 0.16 -0.45 0.00 0.00 -1.94 0.00 0.00 57.00 54.77 2p8m n GLN 105 Cb 0.55 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.41 2p8m n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2p8m n GLY 106 N 1.27 -1.91 3.03 1.08 0.00 -1.26 -5.00 105.19 102.40 2p8m n GLY 106 Ca 0.15 -1.50 -0.22 0.00 0.00 0.00 0.00 46.02 44.44 2p8m n GLY 106 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2p8m s ILE 107 N -3.07 0.96 -0.30 -0.61 2.07 -0.18 -4.88 121.20 115.20 2p8m s ILE 107 Ca 0.00 -0.44 -0.22 0.00 -1.41 0.00 0.00 60.65 58.58 2p8m s ILE 107 Cb 0.00 -0.86 -0.01 0.00 0.13 0.00 0.00 42.46 41.73 2p8m s ILE 107 CO 0.00 0.30 0.72 -0.89 -1.91 0.00 0.00 174.94 173.15 2p8m s THR 108 N 0.29 4.87 -0.11 4.00 2.01 -1.26 -0.47 115.64 124.97 2p8m s THR 108 Ca -0.06 1.08 -0.01 0.00 0.31 0.00 0.00 61.69 63.01 2p8m s THR 108 Cb -0.11 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.31 2p8m s THR 108 CO 0.01 -0.17 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.00 2p8m s VAL 109 N 2.78 3.58 -0.07 3.82 1.01 -0.59 -4.38 120.40 126.55 2p8m s VAL 109 Ca 0.29 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.81 2p8m s VAL 109 Cb -0.15 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.73 2p8m s VAL 109 CO 0.12 0.55 -0.19 -0.89 0.00 0.00 0.00 175.10 174.68 2p8m s THR 110 N -0.19 1.66 -0.41 3.92 2.01 0.23 -2.27 115.64 120.60 2p8m s THR 110 Ca 0.02 -0.81 -0.14 0.00 0.31 0.00 0.00 61.69 61.08 2p8m s THR 110 Cb -0.13 -1.45 0.03 0.00 0.01 0.00 0.00 72.50 70.97 2p8m s THR 110 CO 0.03 0.47 0.28 -0.63 -0.69 0.00 0.00 174.62 174.08 2p8m s ILE 111 N 0.32 5.01 -0.03 1.82 1.09 -1.26 -1.29 121.20 126.86 2p8m s ILE 111 Ca -0.13 -0.81 -0.07 0.00 -1.10 0.00 0.00 60.65 58.54 2p8m s ILE 111 Cb -0.16 -3.83 0.01 0.00 -1.06 0.00 0.00 42.46 37.42 2p8m s ILE 111 CO 0.05 -0.34 0.16 -0.55 -0.10 0.00 0.00 174.94 174.16 2p8m s SER 112 N 1.79 -0.07 -0.14 3.58 0.15 -0.63 -4.42 113.70 113.94 2p8m s SER 112 Ca 0.04 0.06 0.11 0.00 0.70 0.00 0.00 55.95 56.86 2p8m s SER 112 Cb -0.20 0.28 0.57 0.00 -1.71 0.00 0.00 66.02 64.95 2p8m s SER 112 CO 0.08 -0.22 1.39 -1.54 1.20 0.00 0.00 173.24 174.15 2p8m n SER 113 N 2.19 4.13 -4.94 5.45 3.41 -1.26 -3.95 113.62 118.64 2p8m n SER 113 Ca -0.18 -2.56 -0.25 0.00 -0.26 0.00 0.00 58.87 55.63 2p8m n SER 113 Cb 0.57 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 2p8m n SER 113 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2p8m s THR 114 N -2.10 5.17 0.28 6.66 2.01 -1.26 -5.05 115.64 121.34 2p8m s THR 114 Ca 0.38 -0.51 0.09 0.00 0.31 0.00 0.00 61.69 61.96 2p8m s THR 114 Cb 0.28 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.94 2p8m s THR 114 CO 0.13 -0.37 0.05 -0.44 -0.69 0.00 0.00 174.62 173.30 2p8m s SER 115 N -3.68 4.67 0.26 3.53 0.01 -1.26 -5.06 113.70 112.18 2p8m s SER 115 Ca 0.38 -0.64 -0.30 0.00 1.31 0.00 0.00 55.95 56.71 2p8m s SER 115 Cb -0.10 -0.88 -0.14 0.00 0.21 0.00 0.00 66.02 65.11 2p8m s SER 115 CO 0.32 -0.07 1.16 0.41 0.41 0.00 0.00 173.24 175.47 2p8m n THR 116 N -0.98 1.57 -3.68 1.44 -1.04 -1.26 -4.67 114.28 105.66 2p8m n THR 116 Ca -0.06 -0.39 -0.14 0.00 -2.04 0.00 0.00 64.05 61.42 2p8m n THR 116 Cb 0.59 -1.15 -0.08 0.00 -1.82 0.00 0.00 70.33 67.87 2p8m n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2p8m s LYS 117 N -1.14 0.68 0.60 -2.82 2.20 0.23 -4.92 119.74 114.57 2p8m s LYS 117 Ca 0.63 0.76 -0.09 0.00 -0.36 0.00 0.00 55.97 56.91 2p8m s LYS 117 Cb -0.70 0.33 -0.02 0.00 -1.51 0.00 0.00 37.83 35.93 2p8m s LYS 117 CO 0.57 -0.09 0.97 0.20 -0.36 0.00 0.00 175.35 176.64 2p8m s GLY 118 N 0.23 1.61 0.36 5.54 0.00 -1.26 -1.53 107.32 112.27 2p8m s GLY 118 Ca -0.01 -0.30 -0.08 0.00 0.00 0.00 0.00 44.72 44.34 2p8m s GLY 118 CO 0.01 -0.04 0.68 2.56 0.00 0.00 0.00 173.10 176.31 2p8m s PRO 119 N -5.08 3.71 -0.19 2.90 0.04 -1.26 -4.38 135.00 130.74 2p8m s PRO 119 Ca 0.54 0.26 -0.09 0.00 0.04 0.00 0.00 61.00 61.74 2p8m s PRO 119 Cb -0.11 -2.50 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 2p8m s PRO 119 CO 0.50 0.07 0.11 -1.12 0.04 0.00 0.00 177.00 176.61 2p8m s SER 120 N -3.19 6.07 -0.30 6.66 0.01 0.09 -4.92 113.70 118.12 2p8m s SER 120 Ca 0.48 0.22 -0.07 0.00 1.31 0.00 0.00 55.95 57.88 2p8m s SER 120 Cb -0.10 -2.05 0.01 0.00 0.21 0.00 0.00 66.02 64.09 2p8m s SER 120 CO 0.31 0.20 0.09 -0.69 0.41 0.00 0.00 173.24 173.56 2p8m s VAL 121 N 0.21 3.98 0.14 3.43 1.01 -1.26 -0.89 120.40 127.03 2p8m s VAL 121 Ca 0.08 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.40 2p8m s VAL 121 Cb -0.11 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2p8m s VAL 121 CO -0.01 0.06 0.04 -0.36 0.00 0.00 0.00 175.10 174.83 2p8m s PHE 122 N 1.50 2.99 0.29 5.22 0.08 0.51 -4.93 117.98 123.64 2p8m s PHE 122 Ca 0.02 -0.06 -0.17 0.00 0.12 0.00 0.00 56.93 56.84 2p8m s PHE 122 Cb -0.17 -1.47 -0.09 0.00 -0.57 0.00 0.00 43.02 40.72 2p8m s PHE 122 CO 0.03 0.51 0.74 -1.25 -0.10 0.00 0.00 175.22 175.14 2p8m s PRO 123 N -2.79 4.11 -0.49 0.24 0.04 -1.26 -0.09 135.00 134.76 2p8m s PRO 123 Ca 0.28 0.77 0.01 0.00 0.04 0.00 0.00 61.00 62.09 2p8m s PRO 123 Cb -0.10 -2.61 0.13 0.00 0.04 0.00 0.00 34.50 31.96 2p8m s PRO 123 CO 0.20 0.25 0.25 -0.51 0.04 0.00 0.00 177.00 177.23 2p8m s LEU 124 N -2.58 4.87 0.20 -3.56 1.43 -0.21 -4.80 118.68 114.02 2p8m s LEU 124 Ca 0.50 -2.58 -0.30 0.00 -1.03 0.00 0.00 54.13 50.72 2p8m s LEU 124 Cb -0.13 -1.74 -0.08 0.00 0.03 0.00 0.00 46.19 44.28 2p8m s LEU 124 CO 0.19 -0.37 1.05 0.00 0.23 0.00 0.00 176.35 177.45 2p8m s ALA 125 N 0.33 3.35 0.75 4.21 0.00 -1.26 -1.59 121.76 127.55 2p8m s ALA 125 Ca 0.14 0.76 -0.05 0.00 0.00 0.00 0.00 51.96 52.81 2p8m s ALA 125 Cb -0.22 -3.31 0.12 0.00 0.00 0.00 0.00 23.12 19.70 2p8m s ALA 125 CO -0.04 -0.10 1.04 -1.25 0.00 0.00 0.00 175.76 175.41 2p8m s PRO 126 N -0.64 1.66 -0.50 0.00 0.04 -1.24 -4.93 135.00 129.39 2p8m s PRO 126 Ca 0.47 -0.76 0.06 0.00 0.04 0.00 0.00 61.00 60.81 2p8m s PRO 126 Cb -0.28 -2.21 0.21 0.00 0.04 0.00 0.00 34.50 32.26 2p8m s PRO 126 CO 0.35 -1.53 0.82 0.45 0.04 0.00 0.00 177.00 177.12 2p8m n SER 127 N -2.99 -3.15 -0.90 6.66 2.88 -1.26 -4.39 113.62 110.46 2p8m n SER 127 Ca 0.13 -3.03 0.08 0.00 -1.33 0.00 0.00 58.87 54.72 2p8m n SER 127 Cb 0.60 1.76 -0.04 0.00 -0.75 0.00 0.00 64.21 65.78 2p8m n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2p8m n GLY 134 N 2.35 -3.24 3.79 0.46 0.00 -1.26 -4.94 105.19 102.34 2p8m n GLY 134 Ca 0.14 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.62 2p8m n GLY 134 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2p8m s THR 135 N -4.10 5.07 0.20 2.61 -1.32 -1.26 -1.40 115.64 115.44 2p8m s THR 135 Ca 0.00 0.90 0.11 0.00 -1.21 0.00 0.00 61.69 61.49 2p8m s THR 135 Cb 0.00 -3.76 -0.04 0.00 -1.51 0.00 0.00 72.50 67.18 2p8m s THR 135 CO 0.00 0.48 -0.18 0.00 -2.21 0.00 0.00 174.62 172.71 2p8m s ALA 136 N -0.39 2.72 0.12 11.08 0.00 0.95 -4.84 121.76 131.40 2p8m s ALA 136 Ca 0.25 -1.61 0.08 0.00 0.00 0.00 0.00 51.96 50.67 2p8m s ALA 136 Cb -0.16 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 2p8m s ALA 136 CO 0.12 0.42 -0.18 0.00 0.00 0.00 0.00 175.76 176.12 2p8m s ALA 137 N -1.80 1.75 0.27 0.00 0.00 -1.26 -0.47 121.76 120.26 2p8m s ALA 137 Ca 0.23 -1.31 -0.19 0.00 0.00 0.00 0.00 51.96 50.70 2p8m s ALA 137 Cb -0.08 -0.18 0.01 0.00 0.00 0.00 0.00 23.12 22.88 2p8m s ALA 137 CO 0.12 0.25 0.66 -0.48 0.00 0.00 0.00 175.76 176.31 2p8m s LEU 138 N -2.25 -0.09 0.00 0.00 0.05 -1.05 -3.72 118.68 111.61 2p8m s LEU 138 Ca 0.09 -0.71 0.00 0.00 0.05 0.00 0.00 54.13 53.56 2p8m s LEU 138 Cb -0.08 2.47 0.00 0.00 -2.05 0.00 0.00 46.19 46.54 2p8m s LEU 138 CO 0.05 -1.30 0.00 0.61 -0.55 0.00 0.00 176.35 175.15 2p8m n GLY 139 N -0.44 -0.92 2.96 -3.48 0.00 -0.62 -1.40 105.19 101.28 2p8m n GLY 139 Ca -0.03 -0.70 -0.17 0.00 0.00 0.00 0.00 46.02 45.11 2p8m n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p8m s LEU 141 N -0.02 3.90 -0.70 0.00 2.96 0.87 -1.17 118.68 124.52 2p8m s LEU 141 Ca 0.01 -0.54 -0.14 0.00 -0.22 0.00 0.00 54.13 53.24 2p8m s LEU 141 Cb -0.04 -1.94 0.18 0.00 0.50 0.00 0.00 46.19 44.89 2p8m s LEU 141 CO -0.00 -0.17 0.64 -0.69 -1.32 0.00 0.00 176.35 174.81 2p8m s VAL 142 N 1.57 5.30 0.03 1.68 1.01 0.49 -0.36 120.40 130.12 2p8m s VAL 142 Ca 0.04 -2.13 0.01 0.00 0.00 0.00 0.00 61.98 59.90 2p8m s VAL 142 Cb -0.17 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 2p8m s VAL 142 CO 0.04 -0.95 0.09 -0.75 0.00 0.00 0.00 175.10 173.53 2p8m s LYS 143 N 0.71 3.02 -1.01 2.72 2.20 -0.07 -1.25 119.74 126.06 2p8m s LYS 143 Ca 0.12 -0.56 -0.09 0.00 -0.36 0.00 0.00 55.97 55.08 2p8m s LYS 143 Cb -0.18 -2.82 -0.04 0.00 -1.51 0.00 0.00 37.83 33.28 2p8m s LYS 143 CO -0.04 0.62 0.83 -0.25 -0.36 0.00 0.00 175.35 176.14 2p8m n ASP 144 N 0.87 -6.39 -4.48 1.43 8.00 -0.22 -0.73 116.55 115.03 2p8m n ASP 144 Ca -0.11 -0.70 -0.24 0.00 0.71 0.00 0.00 54.79 54.45 2p8m n ASP 144 Cb 0.52 -4.50 -0.10 0.00 -0.02 0.00 0.00 41.12 37.02 2p8m n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2p8m s TYR 145 N -3.32 2.25 -0.28 1.24 1.13 -1.09 -4.32 117.35 112.95 2p8m s TYR 145 Ca 0.36 -0.45 -0.20 0.00 -1.41 0.00 0.00 57.07 55.37 2p8m s TYR 145 Cb -0.08 -1.13 0.11 0.00 -1.10 0.00 0.00 41.96 39.76 2p8m s TYR 145 CO 0.79 0.59 0.85 0.12 -2.51 0.00 0.00 175.55 175.39 2p8m s PHE 146 N -2.64 -0.75 0.00 -3.49 2.19 -0.58 -1.33 117.98 111.38 2p8m s PHE 146 Ca 0.30 1.61 0.00 0.00 0.33 0.00 0.00 56.93 59.18 2p8m s PHE 146 Cb -0.01 0.43 0.00 0.00 -1.31 0.00 0.00 43.02 42.13 2p8m s PHE 146 CO 0.14 -0.37 0.00 -0.35 1.83 0.00 0.00 175.22 176.48 2p8m n PRO 147 N 3.38 1.79 -1.14 10.12 -0.04 -1.26 0.78 135.00 148.63 2p8m n PRO 147 Ca -0.17 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.98 2p8m n PRO 147 Cb 0.57 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 34.14 2p8m n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2p8m s GLU 148 N -0.65 1.88 0.44 0.54 0.41 -1.26 -4.78 118.70 115.28 2p8m s GLU 148 Ca 0.00 1.40 0.03 0.00 -0.41 0.00 0.00 54.97 55.99 2p8m s GLU 148 Cb 0.00 -1.84 0.03 0.00 -1.78 0.00 0.00 34.13 30.55 2p8m s GLU 148 CO 0.00 -1.96 0.27 -0.35 -0.49 0.00 0.00 175.26 172.73 2p8m n PRO 149 N -3.54 0.86 -4.13 0.39 -0.04 -1.26 -4.94 135.00 122.35 2p8m n PRO 149 Ca 0.11 -2.81 -0.15 0.00 -0.04 0.00 0.00 63.50 60.60 2p8m n PRO 149 Cb 0.52 0.38 -0.12 0.00 -0.04 0.00 0.00 33.50 34.25 2p8m n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2p8m s VAL 150 N -2.25 0.74 0.02 0.52 0.11 -1.26 -4.42 120.40 113.86 2p8m s VAL 150 Ca 0.21 -1.06 0.08 0.00 -2.93 0.00 0.00 61.98 58.27 2p8m s VAL 150 Cb -0.02 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 34.06 2p8m s VAL 150 CO 0.13 -0.26 -0.22 0.42 -3.33 0.00 0.00 175.10 171.84 2p8m s THR 151 N -1.20 2.48 -0.02 5.04 -4.23 -0.05 -4.96 115.64 112.69 2p8m s THR 151 Ca -0.06 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.28 2p8m s THR 151 Cb -0.09 -1.98 0.01 0.00 1.34 0.00 0.00 72.50 71.78 2p8m s THR 151 CO 0.01 0.42 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.79 2p8m s VAL 152 N -0.80 0.35 0.10 2.29 1.01 -1.26 -0.93 120.40 121.17 2p8m s VAL 152 Ca 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.02 2p8m s VAL 152 Cb -0.10 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2p8m s VAL 152 CO 0.02 0.15 -0.02 -0.94 0.00 0.00 0.00 175.10 174.31 2p8m s SER 153 N 0.54 0.81 -0.06 3.32 1.04 -0.69 -4.94 113.70 113.71 2p8m s SER 153 Ca -0.06 -1.06 0.03 0.00 0.48 0.00 0.00 55.95 55.34 2p8m s SER 153 Cb -0.09 0.16 -0.02 0.00 0.10 0.00 0.00 66.02 66.17 2p8m s SER 153 CO -0.01 -0.57 -0.15 0.26 0.98 0.00 0.00 173.24 173.76 2p8m s TRP 154 N -3.79 2.70 -1.56 5.02 0.52 -1.26 0.76 118.94 121.34 2p8m s TRP 154 Ca 0.14 -0.26 -0.11 0.00 0.02 0.00 0.00 56.10 55.89 2p8m s TRP 154 Cb 0.07 -1.66 0.09 0.00 -1.15 0.00 0.00 33.47 30.81 2p8m s TRP 154 CO -0.04 0.11 0.73 0.09 0.02 0.00 0.00 176.95 177.85 2p8m n ASN 155 N 2.52 -2.72 -3.69 2.95 4.13 0.11 -1.19 115.26 117.38 2p8m n ASN 155 Ca -0.17 -0.94 -0.26 0.00 1.68 0.00 0.00 54.58 54.88 2p8m n ASN 155 Cb 0.52 -3.19 0.06 0.00 -1.54 0.00 0.00 39.78 35.64 2p8m n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2p8m n SER 156 N -2.81 -5.92 0.00 6.41 7.64 -1.26 -1.78 113.62 115.90 2p8m n SER 156 Ca -0.06 -0.61 0.00 0.00 1.01 0.00 0.00 58.87 59.21 2p8m n SER 156 Cb 0.56 -4.67 0.00 0.00 -1.01 0.00 0.00 64.21 59.09 2p8m n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2p8m n GLY 157 N -1.91 3.09 0.11 0.23 0.00 -0.33 -4.85 105.19 101.53 2p8m n GLY 157 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2p8m n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p8m n ALA 158 N -0.60 1.25 -4.08 4.61 0.00 -0.74 -4.38 120.51 116.57 2p8m n ALA 158 Ca 0.00 0.11 -0.32 0.00 0.00 0.00 0.00 53.44 53.23 2p8m n ALA 158 Cb 0.00 -1.27 -0.16 0.00 0.00 0.00 0.00 19.45 18.03 2p8m n ALA 158 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2p8m s LEU 159 N -4.07 2.58 0.00 0.00 0.20 -1.05 -4.94 118.68 111.39 2p8m s LEU 159 Ca 0.01 -0.93 0.00 0.00 0.69 0.00 0.00 54.13 53.89 2p8m s LEU 159 Cb 0.06 -1.46 0.00 0.00 -0.43 0.00 0.00 46.19 44.37 2p8m s LEU 159 CO 0.22 -0.09 0.00 0.35 -0.29 0.00 0.00 176.35 176.54 2p8m n THR 160 N 4.57 0.00 -2.61 3.68 -2.24 -1.26 -4.05 114.28 112.37 2p8m n THR 160 Ca -0.18 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 2p8m n THR 160 Cb 0.47 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.45 2p8m n THR 160 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2p8m s SER 161 N -1.54 7.24 0.00 3.42 0.15 -1.26 -3.01 113.70 118.69 2p8m s SER 161 Ca 0.00 1.73 0.00 0.00 0.70 0.00 0.00 55.95 58.38 2p8m s SER 161 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2p8m s SER 161 CO 0.00 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.66 2p8m n GLY 162 N 3.08 1.03 3.76 9.45 0.00 -1.26 -4.71 105.19 116.53 2p8m n GLY 162 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2p8m n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p8m s VAL 163 N -2.67 4.05 -0.28 1.61 1.01 -1.17 -1.98 120.40 120.98 2p8m s VAL 163 Ca 0.00 1.95 -0.03 0.00 0.00 0.00 0.00 61.98 63.90 2p8m s VAL 163 Cb 0.00 -4.19 0.11 0.00 0.00 0.00 0.00 36.38 32.30 2p8m s VAL 163 CO 0.00 0.38 0.18 -1.00 0.00 0.00 0.00 175.10 174.65 2p8m s HIS 164 N -1.31 0.08 -0.30 5.22 3.76 0.56 -4.99 115.29 118.31 2p8m s HIS 164 Ca 0.44 -0.64 -0.13 0.00 -0.15 0.00 0.00 55.06 54.58 2p8m s HIS 164 Cb -0.24 -0.76 -0.03 0.00 1.11 0.00 0.00 32.58 32.65 2p8m s HIS 164 CO 0.30 -0.84 0.28 0.99 -0.85 0.00 0.00 174.74 174.62 2p8m s THR 165 N 2.18 5.24 0.57 1.30 2.01 -1.26 -1.76 115.64 123.93 2p8m s THR 165 Ca 0.09 0.16 -0.08 0.00 0.31 0.00 0.00 61.69 62.16 2p8m s THR 165 Cb -0.15 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 2p8m s THR 165 CO -0.35 0.10 0.93 -0.36 -0.69 0.00 0.00 174.62 174.26 2p8m s PHE 166 N 1.88 3.52 0.38 4.92 0.40 -0.14 -5.01 117.98 123.92 2p8m s PHE 166 Ca 0.10 0.99 -0.26 0.00 -0.60 0.00 0.00 56.93 57.16 2p8m s PHE 166 Cb -0.16 -2.61 -0.09 0.00 0.51 0.00 0.00 43.02 40.67 2p8m s PHE 166 CO 0.11 -0.61 1.20 -2.14 0.70 0.00 0.00 175.22 174.48 2p8m s PRO 167 N -5.01 4.12 0.63 0.24 0.02 -1.26 -4.45 135.00 129.29 2p8m s PRO 167 Ca 0.52 1.94 -0.13 0.00 0.02 0.00 0.00 61.00 63.35 2p8m s PRO 167 Cb -0.11 -2.78 -0.03 0.00 0.02 0.00 0.00 34.50 31.61 2p8m s PRO 167 CO 0.49 -0.29 1.04 0.00 -0.33 0.00 0.00 177.00 177.91 2p8m s ALA 168 N -1.33 2.85 0.08 -1.55 0.00 -1.26 -4.73 121.76 115.81 2p8m s ALA 168 Ca 0.55 0.14 0.08 0.00 0.00 0.00 0.00 51.96 52.72 2p8m s ALA 168 Cb -0.33 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2p8m s ALA 168 CO 0.42 -0.86 -0.16 0.14 0.00 0.00 0.00 175.76 175.31 2p8m s VAL 169 N -2.87 2.98 -0.46 0.00 -7.23 -0.30 -4.93 120.40 107.59 2p8m s VAL 169 Ca 0.59 -1.29 -0.20 0.00 -1.81 0.00 0.00 61.98 59.27 2p8m s VAL 169 Cb -0.13 -2.33 0.03 0.00 0.56 0.00 0.00 36.38 34.51 2p8m s VAL 169 CO 0.47 0.21 0.61 -0.22 -0.31 0.00 0.00 175.10 175.86 2p8m s LEU 170 N -1.85 4.68 0.85 1.32 2.96 -1.26 -1.97 118.68 123.40 2p8m s LEU 170 Ca 0.17 -0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 53.41 2p8m s LEU 170 Cb -0.11 -2.59 0.10 0.00 0.50 0.00 0.00 46.19 44.09 2p8m s LEU 170 CO 0.09 -0.79 1.09 -1.10 -1.32 0.00 0.00 176.35 174.32 2p8m s GLN 171 N 2.69 1.66 0.15 1.98 -0.21 0.72 -4.88 119.66 121.77 2p8m s GLN 171 Ca 0.19 0.90 0.16 0.00 0.02 0.00 0.00 55.36 56.63 2p8m s GLN 171 Cb -0.16 -1.85 0.73 0.00 1.00 0.00 0.00 33.01 32.73 2p8m s GLN 171 CO 0.16 -1.99 1.49 -1.13 -2.12 0.00 0.00 175.29 171.71 2p8m n SER 172 N -3.72 0.33 0.16 5.90 3.41 -1.26 -1.56 113.62 116.87 2p8m n SER 172 Ca 0.08 0.61 0.13 0.00 -0.26 0.00 0.00 58.87 59.42 2p8m n SER 172 Cb 0.55 -0.67 0.30 0.00 -0.26 0.00 0.00 64.21 64.13 2p8m n SER 172 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2p8m h SER 173 N 0.00 0.00 0.00 4.04 4.64 -2.02 -3.47 113.55 116.75 2p8m h SER 173 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2p8m h SER 173 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2p8m h SER 173 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2p8m n GLY 174 N 1.21 0.51 3.89 -0.77 0.00 -0.60 -4.89 105.19 104.53 2p8m n GLY 174 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 2p8m n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p8m s LEU 175 N 0.00 4.14 0.52 0.99 1.43 -1.26 -4.77 118.68 119.74 2p8m s LEU 175 Ca 0.00 0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 53.13 2p8m s LEU 175 Cb 0.00 -2.73 -0.01 0.00 0.03 0.00 0.00 46.19 43.48 2p8m s LEU 175 CO 0.00 0.07 0.81 -0.31 0.23 0.00 0.00 176.35 177.15 2p8m s TYR 176 N -1.72 3.32 -0.20 0.29 2.02 -0.44 -0.20 117.35 120.42 2p8m s TYR 176 Ca 0.33 0.56 -0.09 0.00 -0.37 0.00 0.00 57.07 57.50 2p8m s TYR 176 Cb -0.11 -2.51 0.08 0.00 -0.40 0.00 0.00 41.96 39.02 2p8m s TYR 176 CO 0.27 -0.56 0.45 0.45 -1.57 0.00 0.00 175.55 174.58 2p8m s SER 177 N -4.23 -0.47 0.16 2.29 0.15 -0.83 -1.05 113.70 109.70 2p8m s SER 177 Ca 0.51 1.02 0.04 0.00 0.70 0.00 0.00 55.95 58.21 2p8m s SER 177 Cb -0.10 1.12 -0.05 0.00 -1.71 0.00 0.00 66.02 65.29 2p8m s SER 177 CO 0.43 -0.21 -0.08 -1.48 1.20 0.00 0.00 173.24 173.09 2p8m s LEU 178 N 1.98 2.47 -0.01 3.45 0.05 -0.38 -1.15 118.68 125.09 2p8m s LEU 178 Ca -0.06 -1.04 0.05 0.00 0.05 0.00 0.00 54.13 53.12 2p8m s LEU 178 Cb -0.10 -0.31 -0.01 0.00 -2.05 0.00 0.00 46.19 43.72 2p8m s LEU 178 CO -0.14 -0.37 -0.16 -0.55 -0.55 0.00 0.00 176.35 174.58 2p8m s SER 179 N -3.18 1.91 -0.05 1.48 0.15 -1.26 -0.38 113.70 112.38 2p8m s SER 179 Ca 0.18 -0.32 -0.00 0.00 0.70 0.00 0.00 55.95 56.52 2p8m s SER 179 Cb 0.03 -0.20 0.03 0.00 -1.71 0.00 0.00 66.02 64.16 2p8m s SER 179 CO 0.01 0.19 -0.01 -0.55 1.20 0.00 0.00 173.24 174.08 2p8m s SER 180 N -0.47 1.06 0.08 5.45 0.15 -0.32 -0.97 113.70 118.68 2p8m s SER 180 Ca 0.06 -0.08 0.04 0.00 0.70 0.00 0.00 55.95 56.67 2p8m s SER 180 Cb -0.06 -0.38 -0.03 0.00 -1.71 0.00 0.00 66.02 63.83 2p8m s SER 180 CO -0.00 -0.12 -0.12 0.68 1.20 0.00 0.00 173.24 174.87 2p8m s VAL 181 N 1.36 1.00 -0.02 4.45 -7.23 -0.72 -0.05 120.40 119.19 2p8m s VAL 181 Ca -0.04 -1.40 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 2p8m s VAL 181 Cb -0.13 -1.12 0.00 0.00 0.56 0.00 0.00 36.38 35.69 2p8m s VAL 181 CO -0.02 -0.36 -0.08 0.54 -0.31 0.00 0.00 175.10 174.86 2p8m s VAL 182 N -1.69 0.71 -0.17 1.32 0.11 -0.50 -0.32 120.40 119.86 2p8m s VAL 182 Ca -0.00 -0.34 -0.07 0.00 -2.93 0.00 0.00 61.98 58.63 2p8m s VAL 182 Cb -0.08 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 2p8m s VAL 182 CO 0.01 0.22 0.08 0.28 -3.33 0.00 0.00 175.10 172.36 2p8m s THR 183 N 0.06 4.93 0.15 5.04 -1.32 -0.84 -2.53 115.64 121.14 2p8m s THR 183 Ca -0.01 0.01 0.03 0.00 -1.21 0.00 0.00 61.69 60.51 2p8m s THR 183 Cb -0.07 -3.21 -0.01 0.00 -1.51 0.00 0.00 72.50 67.71 2p8m s THR 183 CO 0.00 0.49 0.10 1.33 -2.21 0.00 0.00 174.62 174.33 2p8m n VAL 184 N 3.22 0.00 -3.25 5.08 0.24 0.38 -4.68 118.33 119.32 2p8m n VAL 184 Ca -0.17 -1.02 -0.39 0.00 -2.04 0.00 0.00 64.34 60.71 2p8m n VAL 184 Cb 0.53 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 33.28 2p8m n VAL 184 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 2p8m s PRO 185 N -2.61 4.19 0.32 7.34 0.02 -1.26 -0.03 135.00 142.96 2p8m s PRO 185 Ca 0.14 0.40 0.10 0.00 0.02 0.00 0.00 61.00 61.66 2p8m s PRO 185 Cb 0.01 -3.56 0.92 0.00 0.02 0.00 0.00 34.50 31.88 2p8m s PRO 185 CO 0.10 -0.15 1.68 0.77 -0.33 0.00 0.00 177.00 179.07 2p8m h SER 186 N 7.46 0.44 0.21 2.53 0.02 -1.56 0.34 113.55 122.99 2p8m h SER 186 Ca -0.34 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2p8m h SER 186 Cb 1.15 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2p8m h SER 186 CO 0.74 -0.06 0.00 0.77 -1.14 0.00 0.00 176.83 177.14 2p8m h SER 187 N 0.38 0.00 0.52 3.07 4.64 -1.94 -0.87 113.55 119.35 2p8m h SER 187 Ca 0.65 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 2p8m h SER 187 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2p8m h SER 187 CO -0.57 0.00 -0.45 -1.54 -0.87 0.00 0.00 176.83 173.40 2p8m n SER 188 N -3.08 0.49 -0.27 4.97 3.41 0.12 -4.28 113.62 114.99 2p8m n SER 188 Ca -0.02 -0.23 0.03 0.00 -0.26 0.00 0.00 58.87 58.39 2p8m n SER 188 Cb 0.12 0.19 0.17 0.00 -0.26 0.00 0.00 64.21 64.43 2p8m n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2p8m h LEU 189 N 0.05 0.49 0.00 1.04 3.38 -1.15 -0.25 115.31 118.87 2p8m h LEU 189 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2p8m h LEU 189 Cb 0.50 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2p8m h LEU 189 CO 0.00 0.26 -0.45 0.61 0.09 0.00 0.00 178.44 178.95 2p8m n GLY 190 N -1.31 -1.41 0.05 0.83 0.00 -1.26 -4.33 105.19 97.75 2p8m n GLY 190 Ca 0.13 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.87 2p8m n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2p8m n THR 191 N -1.89 0.62 -3.32 2.61 -2.24 -1.12 -5.00 114.28 103.95 2p8m n THR 191 Ca 0.05 -0.35 -0.30 0.00 -2.27 0.00 0.00 64.05 61.18 2p8m n THR 191 Cb 0.40 -0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 67.79 2p8m n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2p8m s GLN 192 N -2.22 3.69 -0.04 -0.78 2.00 -0.12 -5.09 119.66 117.10 2p8m s GLN 192 Ca -0.07 0.12 0.06 0.00 -2.00 0.00 0.00 55.36 53.47 2p8m s GLN 192 Cb 0.03 -2.63 -0.02 0.00 0.80 0.00 0.00 33.01 31.20 2p8m s GLN 192 CO 0.34 0.22 -0.24 0.95 -0.50 0.00 0.00 175.29 176.06 2p8m s THR 193 N -2.03 2.17 -0.18 -0.34 -4.23 -1.26 -4.75 115.64 105.02 2p8m s THR 193 Ca 0.45 -1.04 -0.00 0.00 -1.18 0.00 0.00 61.69 59.92 2p8m s THR 193 Cb -0.11 -1.78 0.01 0.00 1.34 0.00 0.00 72.50 71.96 2p8m s THR 193 CO 0.28 0.57 -0.15 -0.31 -0.54 0.00 0.00 174.62 174.47 2p8m s TYR 194 N -0.38 2.81 -0.07 3.99 2.02 -1.26 -4.93 117.35 119.53 2p8m s TYR 194 Ca 0.03 -1.26 0.00 0.00 -0.37 0.00 0.00 57.07 55.48 2p8m s TYR 194 Cb -0.12 -1.95 0.02 0.00 -0.40 0.00 0.00 41.96 39.52 2p8m s TYR 194 CO 0.02 -0.62 -0.06 0.99 -1.57 0.00 0.00 175.55 174.30 2p8m s THR 195 N 1.14 0.75 0.04 -0.71 2.01 -1.26 0.87 115.64 118.48 2p8m s THR 195 Ca 0.01 -0.19 -0.17 0.00 0.31 0.00 0.00 61.69 61.66 2p8m s THR 195 Cb -0.14 -0.78 -0.06 0.00 0.01 0.00 0.00 72.50 71.53 2p8m s THR 195 CO -0.06 0.30 0.48 0.00 -0.69 0.00 0.00 174.62 174.65 2p8m s ASN 197 N -1.12 5.56 -0.14 0.00 -0.87 0.23 -1.39 114.94 117.21 2p8m s ASN 197 Ca 0.26 -1.41 -0.07 0.00 -1.57 0.00 0.00 52.86 50.08 2p8m s ASN 197 Cb -0.18 -1.96 -0.04 0.00 -0.02 0.00 0.00 41.25 39.05 2p8m s ASN 197 CO 0.16 -0.48 0.09 -0.69 -2.57 0.00 0.00 177.10 173.61 2p8m s VAL 198 N 1.42 5.09 -0.15 1.60 1.01 0.50 -1.71 120.40 128.16 2p8m s VAL 198 Ca 0.02 0.06 -0.05 0.00 0.00 0.00 0.00 61.98 62.01 2p8m s VAL 198 Cb -0.22 -3.24 0.06 0.00 0.00 0.00 0.00 36.38 32.98 2p8m s VAL 198 CO 0.02 0.55 0.08 0.21 0.00 0.00 0.00 175.10 175.97 2p8m s ASN 199 N -0.45 2.19 -0.72 3.32 3.04 -0.10 -1.22 114.94 121.01 2p8m s ASN 199 Ca 0.11 -0.52 -0.05 0.00 0.04 0.00 0.00 52.86 52.44 2p8m s ASN 199 Cb -0.12 -0.24 0.18 0.00 -1.54 0.00 0.00 41.25 39.54 2p8m s ASN 199 CO 0.02 -0.33 0.57 -2.28 -3.04 0.00 0.00 177.10 172.03 2p8m s HIS 200 N 2.14 3.56 0.25 0.43 5.65 -0.34 -0.87 115.29 126.10 2p8m s HIS 200 Ca 0.02 -2.64 -0.03 0.00 0.25 0.00 0.00 55.06 52.66 2p8m s HIS 200 Cb -0.15 -3.33 0.43 0.00 -1.18 0.00 0.00 32.58 28.34 2p8m s HIS 200 CO -0.08 -0.85 1.82 0.87 -0.65 0.00 0.00 174.74 175.85 2p8m h LYS 201 N 6.97 0.83 -0.64 2.88 1.79 -1.82 -1.75 116.57 124.84 2p8m h LYS 201 Ca 0.04 -0.05 0.18 0.00 -2.18 0.00 0.00 60.65 58.65 2p8m h LYS 201 Cb 0.94 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 31.38 2p8m h LYS 201 CO 0.75 0.55 0.60 -1.35 -1.08 0.00 0.00 179.45 178.92 2p8m h PRO 202 N 0.86 0.00 -0.03 3.15 0.11 -1.89 0.19 132.00 134.39 2p8m h PRO 202 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 2p8m h PRO 202 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 2p8m h PRO 202 CO -0.24 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.42 2p8m n SER 203 N -3.80 2.05 -3.70 -2.05 3.41 -0.93 -4.90 113.62 103.70 2p8m n SER 203 Ca 0.13 -1.97 -0.22 0.00 -0.26 0.00 0.00 58.87 56.55 2p8m n SER 203 Cb 0.84 -0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.80 2p8m n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2p8m n ASN 204 N -0.39 -1.34 -4.08 4.04 5.03 0.66 -4.88 115.26 114.30 2p8m n ASN 204 Ca 0.01 -0.81 -0.32 0.00 0.87 0.00 0.00 54.58 54.33 2p8m n ASN 204 Cb 0.26 -4.09 -0.16 0.00 -1.02 0.00 0.00 39.78 34.78 2p8m n ASN 204 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2p8m s THR 205 N -3.65 2.01 -0.08 3.41 2.01 -0.72 -5.01 115.64 113.60 2p8m s THR 205 Ca 0.03 -1.12 0.04 0.00 0.31 0.00 0.00 61.69 60.95 2p8m s THR 205 Cb -0.02 -1.93 -0.01 0.00 0.01 0.00 0.00 72.50 70.55 2p8m s THR 205 CO 0.81 0.33 -0.21 -0.54 -0.69 0.00 0.00 174.62 174.33 2p8m s LYS 206 N 1.26 2.87 -0.01 4.92 1.02 -1.26 -1.20 119.74 127.35 2p8m s LYS 206 Ca 0.00 -0.82 0.01 0.00 0.02 0.00 0.00 55.97 55.18 2p8m s LYS 206 Cb -0.15 -2.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 2p8m s LYS 206 CO -0.10 0.32 -0.03 0.08 -0.92 0.00 0.00 175.35 174.69 2p8m s VAL 207 N 0.02 0.28 -0.25 3.17 1.01 -0.35 -5.01 120.40 119.27 2p8m s VAL 207 Ca -0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 2p8m s VAL 207 Cb -0.15 -0.26 0.03 0.00 0.00 0.00 0.00 36.38 36.00 2p8m s VAL 207 CO 0.05 0.09 -0.08 -1.81 0.00 0.00 0.00 175.10 173.35 2p8m s ASP 208 N 0.07 4.25 -0.25 3.32 1.01 -1.26 -0.37 116.67 123.44 2p8m s ASP 208 Ca -0.00 -0.97 -0.01 0.00 0.71 0.00 0.00 52.55 52.28 2p8m s ASP 208 Cb -0.03 -1.63 0.04 0.00 1.01 0.00 0.00 42.92 42.31 2p8m s ASP 208 CO -0.00 -0.14 -0.07 -0.75 0.21 0.00 0.00 175.17 174.42 2p8m s LYS 209 N 1.28 2.68 0.24 8.23 2.47 -0.49 -4.95 119.74 129.19 2p8m s LYS 209 Ca -0.01 -1.08 -0.30 0.00 -1.56 0.00 0.00 55.97 53.02 2p8m s LYS 209 Cb -0.17 -2.96 -0.09 0.00 -1.46 0.00 0.00 37.83 33.15 2p8m s LYS 209 CO -0.05 -0.45 0.97 0.50 0.16 0.00 0.00 175.35 176.48 2p8m s ARG 210 N 1.27 4.82 -0.10 4.03 6.06 -1.26 -0.72 118.95 133.05 2p8m s ARG 210 Ca -0.02 1.54 0.02 0.00 -2.50 0.00 0.00 55.73 54.77 2p8m s ARG 210 Cb -0.17 -3.27 0.01 0.00 0.06 0.00 0.00 34.95 31.58 2p8m s ARG 210 CO -0.05 0.46 -0.15 0.08 -2.50 0.00 0.00 175.30 173.14 2p8m s VAL 211 N -1.11 1.43 0.19 7.11 1.01 0.25 -4.95 120.40 124.33 2p8m s VAL 211 Ca 0.42 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 2p8m s VAL 211 Cb -0.27 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 2p8m s VAL 211 CO 0.33 0.43 0.21 -1.83 0.00 0.00 0.00 175.10 174.24 2p8m s GLU 212 N 0.88 1.22 0.00 2.72 -1.05 -1.26 -4.25 118.70 116.96 2p8m s GLU 212 Ca -0.09 -1.46 0.00 0.00 -0.15 0.00 0.00 54.97 53.27 2p8m s GLU 212 Cb -0.15 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.86 2p8m s GLU 212 CO 0.00 -0.43 0.05 -2.30 0.95 0.00 0.00 175.26 173.53