#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p8p s ILE 2 N 0.00 4.28 -0.03 5.15 1.01 -1.26 -4.37 121.20 125.99 2p8p s ILE 2 Ca 0.00 1.84 -0.02 0.00 0.00 0.00 0.00 60.65 62.47 2p8p s ILE 2 Cb 0.00 -4.17 0.01 0.00 0.01 0.00 0.00 42.46 38.31 2p8p s ILE 2 CO 0.00 0.26 0.07 0.42 0.00 0.00 0.00 174.94 175.68 2p8p s THR 3 N 0.20 -0.01 0.06 2.92 -4.23 -0.71 -4.99 115.64 108.88 2p8p s THR 3 Ca 0.50 0.05 0.07 0.00 -1.18 0.00 0.00 61.69 61.13 2p8p s THR 3 Cb -0.26 -0.11 -0.03 0.00 1.34 0.00 0.00 72.50 73.44 2p8p s THR 3 CO 0.31 0.02 -0.19 -0.76 -0.54 0.00 0.00 174.62 173.46 2p8p s LEU 4 N 0.30 2.21 -0.07 4.79 1.02 -1.26 -1.83 118.68 123.83 2p8p s LEU 4 Ca -0.02 -0.55 -0.03 0.00 0.02 0.00 0.00 54.13 53.54 2p8p s LEU 4 Cb -0.03 -0.83 0.04 0.00 0.02 0.00 0.00 46.19 45.39 2p8p s LEU 4 CO -0.01 0.09 0.15 -0.75 0.02 0.00 0.00 176.35 175.85 2p8p s LYS 5 N -1.39 0.05 0.18 1.70 2.20 0.13 -4.16 119.74 118.46 2p8p s LYS 5 Ca 0.05 0.47 -0.21 0.00 -0.36 0.00 0.00 55.97 55.92 2p8p s LYS 5 Cb -0.09 -0.24 -0.08 0.00 -1.51 0.00 0.00 37.83 35.91 2p8p s LYS 5 CO 0.02 -0.24 0.71 -1.21 -0.36 0.00 0.00 175.35 174.27 2p8p s GLU 6 N 1.78 4.33 -0.03 4.03 8.01 -1.26 -1.70 118.70 133.86 2p8p s GLU 6 Ca -0.02 0.92 -0.09 0.00 0.01 0.00 0.00 54.97 55.79 2p8p s GLU 6 Cb -0.12 -3.04 0.01 0.00 -4.31 0.00 0.00 34.13 26.67 2p8p s GLU 6 CO -0.06 0.48 0.19 -1.54 0.01 0.00 0.00 175.26 174.35 2p8p s SER 7 N -1.43 -0.10 0.00 -0.19 1.04 -0.28 -4.80 113.70 107.93 2p8p s SER 7 Ca 0.39 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.89 2p8p s SER 7 Cb -0.19 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.24 2p8p s SER 7 CO 0.22 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.78 2p8p n GLY 8 N 1.99 -2.11 3.71 7.32 0.00 -1.26 -1.16 105.19 113.67 2p8p n GLY 8 Ca -0.19 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2p8p n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2p8p s PRO 9 N -1.97 4.32 0.17 1.61 0.04 -1.26 -4.91 135.00 132.99 2p8p s PRO 9 Ca 0.00 2.02 0.25 0.00 0.04 0.00 0.00 61.00 63.31 2p8p s PRO 9 Cb 0.00 -3.37 0.91 0.00 0.04 0.00 0.00 34.50 32.08 2p8p s PRO 9 CO 0.00 -0.47 1.77 -0.35 0.04 0.00 0.00 177.00 177.99 2p8p n PRO 10 N 4.43 0.19 -3.73 0.56 -0.04 -1.26 -4.69 135.00 130.45 2p8p n PRO 10 Ca 0.12 0.23 -0.21 0.00 -0.04 0.00 0.00 63.50 63.60 2p8p n PRO 10 Cb 0.43 -1.75 -0.18 0.00 -0.04 0.00 0.00 33.50 31.96 2p8p n PRO 10 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2p8p s LEU 11 N -4.18 0.41 0.10 1.53 2.96 -1.26 -0.92 118.68 117.33 2p8p s LEU 11 Ca 0.10 -0.00 0.07 0.00 -0.22 0.00 0.00 54.13 54.07 2p8p s LEU 11 Cb 0.13 -0.28 -0.03 0.00 0.50 0.00 0.00 46.19 46.50 2p8p s LEU 11 CO 0.52 -0.21 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.48 2p8p s VAL 12 N 2.00 1.44 0.19 1.68 1.01 -0.68 -4.99 120.40 121.04 2p8p s VAL 12 Ca 0.04 -1.52 0.03 0.00 0.00 0.00 0.00 61.98 60.53 2p8p s VAL 12 Cb -0.12 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2p8p s VAL 12 CO -0.04 -0.21 0.33 -0.54 0.00 0.00 0.00 175.10 174.64 2p8p s LYS 13 N -2.06 3.45 0.75 2.72 1.02 -1.26 -2.23 119.74 122.13 2p8p s LYS 13 Ca 0.05 -0.62 -0.15 0.00 0.02 0.00 0.00 55.97 55.26 2p8p s LYS 13 Cb -0.09 -2.92 0.05 0.00 -0.52 0.00 0.00 37.83 34.35 2p8p s LYS 13 CO 0.03 0.47 1.22 -2.30 -0.92 0.00 0.00 175.35 173.85 2p8p n PRO 14 N -0.87 0.53 -0.52 -1.68 -0.02 -1.26 -2.64 135.00 128.53 2p8p n PRO 14 Ca -0.07 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2p8p n PRO 14 Cb 0.55 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2p8p n PRO 14 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2p8p n THR 15 N -2.77 0.00 -2.35 3.45 -2.24 -0.30 -4.90 114.28 105.17 2p8p n THR 15 Ca 0.14 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.67 2p8p n THR 15 Cb 0.49 -0.20 0.11 0.00 -2.10 0.00 0.00 70.33 68.63 2p8p n THR 15 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2p8p s GLN 16 N -0.40 1.65 -0.19 -0.78 -0.21 -1.08 -4.24 119.66 114.41 2p8p s GLN 16 Ca 0.00 -0.71 -0.06 0.00 0.02 0.00 0.00 55.36 54.61 2p8p s GLN 16 Cb 0.00 -2.20 -0.03 0.00 1.00 0.00 0.00 33.01 31.78 2p8p s GLN 16 CO 0.00 -1.54 0.02 0.99 -2.12 0.00 0.00 175.29 172.63 2p8p s THR 17 N -3.30 4.17 -0.25 -0.19 2.01 -1.26 -2.17 115.64 114.65 2p8p s THR 17 Ca 0.66 -0.24 -0.11 0.00 0.31 0.00 0.00 61.69 62.30 2p8p s THR 17 Cb -0.07 -2.88 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 2p8p s THR 17 CO 0.46 0.44 0.18 -0.22 -0.69 0.00 0.00 174.62 174.79 2p8p s LEU 18 N 0.81 4.10 -0.20 4.42 2.96 0.10 -4.98 118.68 125.88 2p8p s LEU 18 Ca 0.01 0.11 0.02 0.00 -0.22 0.00 0.00 54.13 54.05 2p8p s LEU 18 Cb -0.14 -2.14 0.03 0.00 0.50 0.00 0.00 46.19 44.44 2p8p s LEU 18 CO 0.02 0.03 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.02 2p8p s THR 19 N 1.24 2.06 0.03 3.68 2.01 -1.26 -0.28 115.64 123.12 2p8p s THR 19 Ca 0.08 -1.15 0.05 0.00 0.31 0.00 0.00 61.69 60.98 2p8p s THR 19 Cb -0.14 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.36 2p8p s THR 19 CO 0.06 0.35 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.47 2p8p s LEU 20 N 1.24 3.00 0.01 4.42 1.43 -0.05 -4.49 118.68 124.23 2p8p s LEU 20 Ca 0.00 -0.26 0.08 0.00 -1.03 0.00 0.00 54.13 52.92 2p8p s LEU 20 Cb -0.15 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 2p8p s LEU 20 CO -0.10 0.26 -0.23 -0.89 0.23 0.00 0.00 176.35 175.61 2p8p s THR 21 N -1.01 1.86 -0.29 5.49 2.01 -0.31 -1.00 115.64 122.39 2p8p s THR 21 Ca 0.17 -1.11 0.03 0.00 0.31 0.00 0.00 61.69 61.09 2p8p s THR 21 Cb -0.11 -1.57 0.08 0.00 0.01 0.00 0.00 72.50 70.91 2p8p s THR 21 CO 0.08 0.42 -0.02 0.00 -0.69 0.00 0.00 174.62 174.41 2p8p s SER 23 N 1.08 6.44 0.28 0.00 0.01 -0.69 -1.98 113.70 118.86 2p8p s SER 23 Ca 0.01 0.52 0.02 0.00 1.31 0.00 0.00 55.95 57.81 2p8p s SER 23 Cb -0.19 -2.15 -0.05 0.00 0.21 0.00 0.00 66.02 63.83 2p8p s SER 23 CO -0.08 0.22 0.10 0.72 0.41 0.00 0.00 173.24 174.61 2p8p s PHE 24 N -0.11 1.65 -0.03 2.43 -0.71 -0.89 -0.69 117.98 119.63 2p8p s PHE 24 Ca 0.16 -1.15 -0.25 0.00 -1.04 0.00 0.00 56.93 54.65 2p8p s PHE 24 Cb -0.13 -0.99 0.05 0.00 -1.21 0.00 0.00 43.02 40.74 2p8p s PHE 24 CO 0.04 -0.28 0.54 -1.54 -1.34 0.00 0.00 175.22 172.64 2p8p s SER 25 N -3.37 -0.48 0.00 1.98 1.04 -0.76 -4.88 113.70 107.23 2p8p s SER 25 Ca 0.37 0.45 0.00 0.00 0.48 0.00 0.00 55.95 57.25 2p8p s SER 25 Cb 0.08 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2p8p s SER 25 CO 0.14 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2p8p n GLY 26 N 0.99 0.47 3.83 7.32 0.00 -1.26 -1.74 105.19 114.79 2p8p n GLY 26 Ca -0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 2p8p n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2p8p s PHE 27 N -2.00 -0.01 0.08 1.61 -0.71 -1.26 -4.69 117.98 111.00 2p8p s PHE 27 Ca 0.00 -0.56 0.05 0.00 -1.04 0.00 0.00 56.93 55.37 2p8p s PHE 27 Cb 0.00 0.77 -0.03 0.00 -1.21 0.00 0.00 43.02 42.55 2p8p s PHE 27 CO 0.00 -1.42 -0.13 0.45 -1.34 0.00 0.00 175.22 172.79 2p8p s SER 28 N -3.00 1.59 -0.09 1.98 0.15 -1.26 -5.01 113.70 108.05 2p8p s SER 28 Ca 0.14 -0.68 0.04 0.00 0.70 0.00 0.00 55.95 56.14 2p8p s SER 28 Cb -0.05 -0.03 0.25 0.00 -1.71 0.00 0.00 66.02 64.47 2p8p s SER 28 CO 0.09 -0.14 0.97 0.18 1.20 0.00 0.00 173.24 175.55 2p8p n LEU 29 N 1.03 2.84 -0.02 3.45 4.77 -1.26 -2.90 117.00 124.90 2p8p n LEU 29 Ca -0.19 -1.45 0.01 0.00 -0.03 0.00 0.00 56.01 54.35 2p8p n LEU 29 Cb 0.55 -0.57 -0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2p8p n LEU 29 CO 0.23 0.43 0.07 -1.54 -1.33 0.00 0.00 177.39 175.25 2p8p n SER 30 N 0.15 0.35 -4.75 -1.43 3.41 -1.26 -4.29 113.62 105.81 2p8p n SER 30 Ca 0.11 -0.68 -0.41 0.00 -0.26 0.00 0.00 58.87 57.63 2p8p n SER 30 Cb 0.62 0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 65.28 2p8p n SER 30 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2p8p s ASP 31 N -0.90 6.99 -0.23 4.04 1.01 -1.14 -4.88 116.67 121.56 2p8p s ASP 31 Ca 0.01 2.41 -0.39 0.00 0.71 0.00 0.00 52.55 55.29 2p8p s ASP 31 Cb 0.01 -2.62 -0.15 0.00 1.01 0.00 0.00 42.92 41.17 2p8p s ASP 31 CO 0.06 -0.41 1.74 0.33 0.21 0.00 0.00 175.17 177.10 2p8p n PHE 32 N 1.80 2.06 -0.78 4.23 7.35 -1.26 -2.69 117.46 128.16 2p8p n PHE 32 Ca 0.02 0.47 0.00 0.00 -0.76 0.00 0.00 57.45 57.19 2p8p n PHE 32 Cb 0.43 -2.48 0.00 0.00 0.35 0.00 0.00 39.48 37.79 2p8p n PHE 32 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2p8p n GLY 33 N 4.12 0.47 3.74 7.13 0.00 -1.26 -4.26 105.19 115.12 2p8p n GLY 33 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 2p8p n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p8p s VAL 34 N -2.38 2.09 0.03 1.61 1.01 -1.10 -4.22 120.40 117.43 2p8p s VAL 34 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2p8p s VAL 34 Cb 0.00 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.33 2p8p s VAL 34 CO 0.00 -0.01 -0.02 -0.83 0.00 0.00 0.00 175.10 174.24 2p8p s GLY 35 N -1.28 0.28 -0.17 4.51 0.00 -0.81 -1.50 107.32 108.35 2p8p s GLY 35 Ca 0.79 -0.72 0.01 0.00 0.00 0.00 0.00 44.72 44.80 2p8p s GLY 35 CO 0.41 -0.80 -0.12 0.14 0.00 0.00 0.00 173.10 172.73 2p8p s VAL 35 N -2.09 1.61 0.23 1.40 1.01 -0.27 -0.54 120.40 121.73 2p8p s VAL 35 Ca -0.10 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.16 2p8p s VAL 35 Cb -0.05 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2p8p s VAL 35 CO -0.03 0.32 -0.06 -0.83 0.00 0.00 0.00 175.10 174.50 2p8p s GLY 35 N 1.44 1.71 -0.10 4.51 0.00 0.24 -1.78 107.32 113.35 2p8p s GLY 35 Ca 0.02 -1.59 0.02 0.00 0.00 0.00 0.00 44.72 43.17 2p8p s GLY 35 CO -0.10 -1.63 -0.16 -0.98 0.00 0.00 0.00 173.10 170.23 2p8p s TRP 36 N -2.07 2.70 -0.02 1.90 0.52 0.22 -0.33 118.94 121.86 2p8p s TRP 36 Ca 0.28 -0.57 0.01 0.00 0.02 0.00 0.00 56.10 55.85 2p8p s TRP 36 Cb -0.07 -1.74 0.00 0.00 -1.15 0.00 0.00 33.47 30.51 2p8p s TRP 36 CO 0.17 -0.13 -0.05 0.42 0.02 0.00 0.00 176.95 177.39 2p8p s ILE 37 N -0.01 0.43 0.32 2.03 1.09 -0.47 -0.84 121.20 123.76 2p8p s ILE 37 Ca -0.05 -0.18 0.10 0.00 -1.10 0.00 0.00 60.65 59.42 2p8p s ILE 37 Cb -0.14 -0.40 -0.06 0.00 -1.06 0.00 0.00 42.46 40.80 2p8p s ILE 37 CO 0.04 0.15 -0.11 0.00 -0.10 0.00 0.00 174.94 174.92 2p8p s ARG 38 N 0.21 1.84 -0.22 2.79 1.70 -0.09 0.16 118.95 125.33 2p8p s ARG 38 Ca -0.02 -1.82 -0.04 0.00 -0.47 0.00 0.00 55.73 53.38 2p8p s ARG 38 Cb -0.06 -1.79 0.09 0.00 -0.57 0.00 0.00 34.95 32.62 2p8p s ARG 38 CO -0.00 0.22 0.18 -1.14 -1.08 0.00 0.00 175.30 173.48 2p8p s GLN 39 N -3.59 0.17 0.38 3.89 0.74 0.72 -0.40 119.66 121.57 2p8p s GLN 39 Ca 0.32 -0.05 -0.28 0.00 0.05 0.00 0.00 55.36 55.40 2p8p s GLN 39 Cb -0.01 -1.30 -0.10 0.00 1.10 0.00 0.00 33.01 32.70 2p8p s GLN 39 CO 0.17 -0.78 1.43 -2.14 -0.55 0.00 0.00 175.29 173.42 2p8p s PRO 40 N 2.24 4.11 -0.46 1.67 0.02 -1.26 -1.58 135.00 139.74 2p8p s PRO 40 Ca 0.06 2.46 -0.42 0.00 0.02 0.00 0.00 61.00 63.12 2p8p s PRO 40 Cb -0.16 -2.94 -0.17 0.00 0.02 0.00 0.00 34.50 31.25 2p8p s PRO 40 CO -0.18 -0.49 2.08 -2.30 -0.33 0.00 0.00 177.00 175.77 2p8p n PRO 41 N 0.44 0.29 -2.90 5.54 -0.02 -1.26 -1.70 135.00 135.39 2p8p n PRO 41 Ca 0.01 0.08 -0.11 0.00 -2.02 0.00 0.00 63.50 61.46 2p8p n PRO 41 Cb 0.40 -1.73 0.06 0.00 -0.02 0.00 0.00 33.50 32.21 2p8p n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p8p n GLY 42 N 6.81 -0.28 0.00 -1.23 0.00 -1.26 -5.03 105.19 104.20 2p8p n GLY 42 Ca 0.48 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.59 2p8p n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2p8p n LYS 43 N -3.01 0.00 -2.17 1.61 5.02 -0.69 -5.18 118.16 113.74 2p8p n LYS 43 Ca -0.14 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.87 2p8p n LYS 43 Cb 0.61 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.67 2p8p n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2p8p s ALA 44 N -1.46 3.10 0.37 7.82 0.00 -1.26 -4.77 121.76 125.55 2p8p s ALA 44 Ca 0.00 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 50.99 2p8p s ALA 44 Cb 0.00 -2.72 -0.10 0.00 0.00 0.00 0.00 23.12 20.31 2p8p s ALA 44 CO 0.00 -1.17 0.99 -0.51 0.00 0.00 0.00 175.76 175.07 2p8p s LEU 45 N -5.23 4.18 -0.07 0.00 1.43 -1.26 -4.11 118.68 113.62 2p8p s LEU 45 Ca 0.58 1.89 -0.02 0.00 -1.03 0.00 0.00 54.13 55.55 2p8p s LEU 45 Cb -0.11 -4.18 0.03 0.00 0.03 0.00 0.00 46.19 41.96 2p8p s LEU 45 CO 0.47 -0.29 0.02 -0.70 0.23 0.00 0.00 176.35 176.07 2p8p s GLU 46 N -2.44 0.47 0.08 1.70 2.12 0.47 -4.99 118.70 116.11 2p8p s GLU 46 Ca 0.55 0.13 -0.31 0.00 0.36 0.00 0.00 54.97 55.70 2p8p s GLU 46 Cb -0.18 -0.97 -0.07 0.00 0.26 0.00 0.00 34.13 33.17 2p8p s GLU 46 CO 0.23 -0.34 1.32 -0.46 -0.54 0.00 0.00 175.26 175.48 2p8p s TRP 47 N 2.01 3.27 -0.17 5.30 -0.00 -1.26 -0.92 118.94 127.17 2p8p s TRP 47 Ca 0.05 1.06 -0.12 0.00 -0.00 0.00 0.00 56.10 57.09 2p8p s TRP 47 Cb -0.13 -3.59 -0.07 0.00 -0.00 0.00 0.00 33.47 29.68 2p8p s TRP 47 CO -0.05 -2.00 -0.27 1.28 -0.00 0.00 0.00 176.95 175.91 2p8p n LEU 48 N 4.08 1.57 -3.80 5.86 4.77 -0.02 -4.65 117.00 124.82 2p8p n LEU 48 Ca 0.11 0.27 -0.03 0.00 -0.03 0.00 0.00 56.01 56.32 2p8p n LEU 48 Cb 0.44 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2p8p n LEU 48 CO 0.57 0.12 0.76 0.00 -1.33 0.00 0.00 177.39 177.52 2p8p s ALA 49 N -2.49 -1.61 -0.16 -1.18 0.00 -1.14 -0.45 121.76 114.73 2p8p s ALA 49 Ca -0.26 -0.08 -0.24 0.00 0.00 0.00 0.00 51.96 51.37 2p8p s ALA 49 Cb 0.08 0.68 0.06 0.00 0.00 0.00 0.00 23.12 23.94 2p8p s ALA 49 CO 0.35 -1.05 0.62 -1.50 0.00 0.00 0.00 175.76 174.18 2p8p s ILE 50 N -2.76 0.00 0.02 0.00 2.07 -0.77 -0.61 121.20 119.14 2p8p s ILE 50 Ca 0.16 -0.04 0.03 0.00 -1.41 0.00 0.00 60.65 59.39 2p8p s ILE 50 Cb -0.02 -0.89 -0.01 0.00 0.13 0.00 0.00 42.46 41.66 2p8p s ILE 50 CO 0.04 -0.02 -0.10 -0.51 -1.91 0.00 0.00 174.94 172.43 2p8p s ILE 51 N -0.26 0.81 0.54 2.00 2.07 -0.73 -1.56 121.20 124.06 2p8p s ILE 51 Ca -0.04 -0.69 0.04 0.00 -1.41 0.00 0.00 60.65 58.55 2p8p s ILE 51 Cb -0.03 -0.73 0.03 0.00 0.13 0.00 0.00 42.46 41.86 2p8p s ILE 51 CO 0.04 0.05 0.29 -0.31 -1.91 0.00 0.00 174.94 173.09 2p8p s TYR 52 N -0.59 1.64 0.53 3.50 2.02 -0.01 -1.12 117.35 123.33 2p8p s TYR 52 Ca 0.01 -0.89 0.20 0.00 -0.37 0.00 0.00 57.07 56.02 2p8p s TYR 52 Cb -0.06 -1.81 1.37 0.00 -0.40 0.00 0.00 41.96 41.06 2p8p s TYR 52 CO 0.00 -0.29 2.12 0.77 -1.57 0.00 0.00 175.55 176.58 2p8p h SER 53 N 0.90 0.00 -0.49 2.29 0.02 -1.45 -2.17 113.55 112.65 2p8p h SER 53 Ca -0.39 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.49 2p8p h SER 53 Cb 1.31 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.81 2p8p h SER 53 CO 0.62 0.00 0.09 -0.90 -1.14 0.00 0.00 176.83 175.50 2p8p n ASP 54 N -4.39 4.40 -1.58 3.07 5.68 -1.26 -4.81 116.55 117.66 2p8p n ASP 54 Ca 0.00 -2.80 -0.20 0.00 -0.50 0.00 0.00 54.79 51.30 2p8p n ASP 54 Cb 0.23 -0.66 -0.08 0.00 -1.14 0.00 0.00 41.12 39.47 2p8p n ASP 54 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2p8p n ASP 55 N 0.24 -5.16 -4.72 -1.12 2.03 -0.82 -4.96 116.55 102.06 2p8p n ASP 55 Ca 0.26 0.48 -0.41 0.00 0.52 0.00 0.00 54.79 55.63 2p8p n ASP 55 Cb 1.05 -4.58 -0.04 0.00 -0.72 0.00 0.00 41.12 36.83 2p8p n ASP 55 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2p8p s ASP 56 N -2.65 7.27 0.06 1.67 2.15 -1.26 -4.86 116.67 119.05 2p8p s ASP 56 Ca 0.00 1.53 0.04 0.00 0.43 0.00 0.00 52.55 54.55 2p8p s ASP 56 Cb 0.00 -2.52 -0.03 0.00 -0.30 0.00 0.00 42.92 40.07 2p8p s ASP 56 CO 0.00 -0.18 -0.13 -0.54 -0.17 0.00 0.00 175.17 174.15 2p8p s LYS 57 N 0.77 0.75 0.01 4.34 1.02 -1.26 -0.83 119.74 124.54 2p8p s LYS 57 Ca 0.46 -0.90 -0.02 0.00 0.02 0.00 0.00 55.97 55.53 2p8p s LYS 57 Cb -0.20 -0.70 -0.01 0.00 -0.52 0.00 0.00 37.83 36.40 2p8p s LYS 57 CO 0.25 0.15 0.03 1.03 -0.92 0.00 0.00 175.35 175.89 2p8p s ARG 58 N -1.68 0.33 0.13 1.68 1.81 -0.60 -5.02 118.95 115.59 2p8p s ARG 58 Ca -0.04 -0.46 0.05 0.00 -1.72 0.00 0.00 55.73 53.56 2p8p s ARG 58 Cb -0.10 0.13 -0.04 0.00 -0.45 0.00 0.00 34.95 34.49 2p8p s ARG 58 CO 0.02 -0.06 -0.12 0.71 -0.68 0.00 0.00 175.30 175.17 2p8p s TYR 59 N -1.24 1.28 0.10 -0.53 2.02 -1.26 -1.86 117.35 115.86 2p8p s TYR 59 Ca -0.14 -0.65 -0.31 0.00 -0.37 0.00 0.00 57.07 55.61 2p8p s TYR 59 Cb -0.08 -0.66 -0.09 0.00 -0.40 0.00 0.00 41.96 40.73 2p8p s TYR 59 CO -0.00 0.10 1.67 0.45 -1.57 0.00 0.00 175.55 176.20 2p8p s SER 60 N -2.72 6.56 0.63 2.29 0.15 0.41 -4.85 113.70 116.17 2p8p s SER 60 Ca 0.11 2.57 0.32 0.00 0.70 0.00 0.00 55.95 59.64 2p8p s SER 60 Cb -0.02 -2.57 1.75 0.00 -1.71 0.00 0.00 66.02 63.47 2p8p s SER 60 CO 0.02 -0.90 2.06 -0.65 1.20 0.00 0.00 173.24 174.96 2p8p h PRO 61 N 8.07 0.00 0.11 5.44 0.11 -1.94 0.35 132.00 144.14 2p8p h PRO 61 Ca -0.43 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.40 2p8p h PRO 61 Cb 1.20 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.33 2p8p h PRO 61 CO 0.93 0.00 -1.19 0.77 -0.21 0.00 0.00 178.00 178.30 2p8p h SER 62 N 0.00 0.63 -0.29 -2.05 0.02 -1.99 -3.34 113.55 106.52 2p8p h SER 62 Ca 0.06 -0.60 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 2p8p h SER 62 Cb 0.57 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2p8p h SER 62 CO -0.00 1.43 0.00 0.18 -1.14 0.00 0.00 176.83 177.30 2p8p n LEU 63 N -3.68 3.09 -0.31 5.07 4.32 -0.60 -4.69 117.00 120.20 2p8p n LEU 63 Ca -0.10 -1.46 0.06 0.00 -0.02 0.00 0.00 56.01 54.49 2p8p n LEU 63 Cb 0.97 -0.19 0.13 0.00 -1.62 0.00 0.00 43.42 42.72 2p8p n LEU 63 CO 0.55 0.66 0.58 -3.20 -1.22 0.00 0.00 177.39 174.77 2p8p n ASN 64 N 1.19 -0.30 0.15 -1.43 4.05 0.01 -1.38 115.26 117.56 2p8p n ASN 64 Ca 0.16 1.49 0.05 0.00 0.45 0.00 0.00 54.58 56.73 2p8p n ASN 64 Cb 0.52 -0.46 0.50 0.00 1.23 0.00 0.00 39.78 41.58 2p8p n ASN 64 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 2p8p h THR 65 N 0.00 1.09 0.00 -0.44 1.35 -1.88 -3.29 112.91 109.74 2p8p h THR 65 Ca 0.42 -0.33 -0.27 0.00 -0.55 0.00 0.00 66.41 65.68 2p8p h THR 65 Cb 0.66 0.97 -0.05 0.00 -1.73 0.00 0.00 68.15 68.00 2p8p h THR 65 CO -0.89 0.11 -2.05 0.54 -0.25 0.00 0.00 175.52 172.98 2p8p n ARG 66 N -4.43 1.44 -2.86 4.72 1.74 -0.48 -4.98 116.66 111.82 2p8p n ARG 66 Ca -0.01 -0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.66 2p8p n ARG 66 Cb 0.15 -1.40 -0.06 0.00 -1.02 0.00 0.00 32.46 30.13 2p8p n ARG 66 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2p8p s LEU 67 N -5.10 4.62 -0.06 0.55 1.43 -0.64 -2.22 118.68 117.26 2p8p s LEU 67 Ca -0.08 1.81 -0.03 0.00 -1.03 0.00 0.00 54.13 54.81 2p8p s LEU 67 Cb 0.05 -3.46 0.04 0.00 0.03 0.00 0.00 46.19 42.84 2p8p s LEU 67 CO 0.64 0.18 0.11 -0.89 0.23 0.00 0.00 176.35 176.62 2p8p s THR 68 N -1.15 -0.17 -0.09 5.49 2.01 -0.48 -4.91 115.64 116.34 2p8p s THR 68 Ca 0.39 0.35 0.03 0.00 0.31 0.00 0.00 61.69 62.77 2p8p s THR 68 Cb -0.25 -0.22 -0.02 0.00 0.01 0.00 0.00 72.50 72.03 2p8p s THR 68 CO 0.29 0.15 -0.17 -0.51 -0.69 0.00 0.00 174.62 173.69 2p8p s ILE 69 N 2.05 2.71 0.30 1.82 2.07 -1.26 -0.81 121.20 128.08 2p8p s ILE 69 Ca 0.02 -0.82 0.03 0.00 -1.41 0.00 0.00 60.65 58.47 2p8p s ILE 69 Cb -0.12 -2.07 -0.05 0.00 0.13 0.00 0.00 42.46 40.35 2p8p s ILE 69 CO -0.05 0.56 0.10 0.42 -1.91 0.00 0.00 174.94 174.06 2p8p s THR 70 N -0.09 0.72 -0.06 4.00 -4.23 -0.53 -5.00 115.64 110.45 2p8p s THR 70 Ca -0.03 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.34 2p8p s THR 70 Cb -0.14 -2.64 0.03 0.00 1.34 0.00 0.00 72.50 71.09 2p8p s THR 70 CO 0.04 0.00 0.33 -1.59 -0.54 0.00 0.00 174.62 172.86 2p8p s LYS 71 N -3.93 0.58 -0.38 3.99 -2.85 -1.26 -1.94 119.74 113.95 2p8p s LYS 71 Ca 0.36 0.06 0.02 0.00 -1.00 0.00 0.00 55.97 55.40 2p8p s LYS 71 Cb 0.07 0.27 0.11 0.00 -2.06 0.00 0.00 37.83 36.22 2p8p s LYS 71 CO 0.15 -0.14 0.14 0.34 0.10 0.00 0.00 175.35 175.94 2p8p s ASP 72 N -0.78 4.15 0.54 0.03 -1.08 -0.45 -5.00 116.67 114.08 2p8p s ASP 72 Ca -0.09 -2.20 0.25 0.00 -0.52 0.00 0.00 52.55 50.00 2p8p s ASP 72 Cb -0.04 -1.19 1.43 0.00 -1.46 0.00 0.00 42.92 41.66 2p8p s ASP 72 CO 0.03 -0.35 2.03 0.74 0.52 0.00 0.00 175.17 178.14 2p8p h THR 73 N 6.07 0.70 0.18 1.71 2.02 -1.92 -2.19 112.91 119.49 2p8p h THR 73 Ca -0.07 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.84 2p8p h THR 73 Cb 0.98 0.78 0.03 0.00 -1.74 0.00 0.00 68.15 68.20 2p8p h THR 73 CO 0.51 0.00 -1.17 -1.28 0.37 0.00 0.00 175.52 173.96 2p8p h SER 74 N 0.00 0.72 -0.07 4.18 0.87 -1.94 -3.32 113.55 113.99 2p8p h SER 74 Ca 0.19 -0.90 0.00 0.00 -1.23 0.00 0.00 61.79 59.84 2p8p h SER 74 Cb 0.79 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 2p8p h SER 74 CO -0.00 1.56 0.00 0.29 -0.53 0.00 0.00 176.83 178.15 2p8p n LYS 75 N -3.90 1.55 -3.80 2.24 5.02 -0.97 -4.94 118.16 113.36 2p8p n LYS 75 Ca -0.15 -0.82 -0.27 0.00 -2.02 0.00 0.00 58.31 55.05 2p8p n LYS 75 Cb 0.96 -1.43 0.04 0.00 -0.02 0.00 0.00 35.03 34.59 2p8p n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2p8p n ASN 76 N 0.01 -4.77 -4.20 4.39 5.03 -0.86 -4.88 115.26 109.99 2p8p n ASN 76 Ca 0.18 -0.72 -0.18 0.00 0.87 0.00 0.00 54.58 54.74 2p8p n ASN 76 Cb 0.29 -4.24 -0.11 0.00 -1.02 0.00 0.00 39.78 34.70 2p8p n ASN 76 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2p8p s GLN 77 N -6.44 0.89 -0.02 3.52 -0.21 -1.12 -2.10 119.66 114.18 2p8p s GLN 77 Ca 0.56 -1.08 0.02 0.00 0.02 0.00 0.00 55.36 54.88 2p8p s GLN 77 Cb -0.27 -0.82 0.00 0.00 1.00 0.00 0.00 33.01 32.93 2p8p s GLN 77 CO 0.80 0.17 -0.08 0.08 -2.12 0.00 0.00 175.29 174.14 2p8p s VAL 78 N -1.73 0.68 0.04 1.09 1.01 -0.84 -1.34 120.40 119.31 2p8p s VAL 78 Ca 0.03 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 61.78 2p8p s VAL 78 Cb -0.07 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 2p8p s VAL 78 CO 0.02 0.22 -0.21 -0.69 0.00 0.00 0.00 175.10 174.44 2p8p s VAL 79 N 0.24 2.53 -0.12 2.92 1.01 -0.82 -0.38 120.40 125.78 2p8p s VAL 79 Ca -0.03 -1.24 0.01 0.00 0.00 0.00 0.00 61.98 60.72 2p8p s VAL 79 Cb -0.08 -2.03 0.02 0.00 0.00 0.00 0.00 36.38 34.29 2p8p s VAL 79 CO 0.00 0.37 -0.15 -0.22 0.00 0.00 0.00 175.10 175.11 2p8p s LEU 80 N -1.30 1.69 -0.24 3.92 2.96 -0.17 -1.45 118.68 124.09 2p8p s LEU 80 Ca 0.13 -0.45 -0.03 0.00 -0.22 0.00 0.00 54.13 53.57 2p8p s LEU 80 Cb -0.10 -1.12 0.01 0.00 0.50 0.00 0.00 46.19 45.48 2p8p s LEU 80 CO 0.04 -0.02 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.31 2p8p s VAL 81 N 1.20 3.05 -0.26 1.68 1.01 0.01 -0.88 120.40 126.22 2p8p s VAL 81 Ca -0.02 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 2p8p s VAL 81 Cb -0.14 -2.48 -0.00 0.00 0.00 0.00 0.00 36.38 33.75 2p8p s VAL 81 CO -0.05 0.28 0.04 -0.32 0.00 0.00 0.00 175.10 175.05 2p8p s MET 82 N 1.38 3.29 0.45 2.72 1.75 0.61 -1.39 119.30 128.12 2p8p s MET 82 Ca 0.02 -0.71 -0.01 0.00 -1.25 0.00 0.00 55.69 53.74 2p8p s MET 82 Cb -0.16 -3.26 -0.01 0.00 2.84 0.00 0.00 34.83 34.24 2p8p s MET 82 CO -0.04 -0.32 0.69 0.95 -0.65 0.00 0.00 175.02 175.64 2p8p s THR 82 N 1.52 4.31 -0.40 10.11 -4.23 -0.94 0.00 115.64 126.01 2p8p s THR 82 Ca 0.04 -0.35 -0.03 0.00 -1.18 0.00 0.00 61.69 60.18 2p8p s THR 82 Cb -0.16 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.08 2p8p s THR 82 CO 0.01 -0.46 0.31 -2.11 -0.54 0.00 0.00 174.62 171.83 2p8p n ARG 82 N -2.10 -0.83 -2.30 3.99 1.85 -0.92 -4.85 116.66 111.50 2p8p n ARG 82 Ca 0.00 0.43 -0.33 0.00 -1.00 0.00 0.00 57.85 56.96 2p8p n ARG 82 Cb 0.57 -1.12 -0.02 0.00 -1.05 0.00 0.00 32.46 30.84 2p8p n ARG 82 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2p8p s VAL 82 N -2.25 4.18 0.16 8.89 -7.23 -1.07 -4.67 120.40 118.41 2p8p s VAL 82 Ca 0.03 1.09 0.01 0.00 -1.81 0.00 0.00 61.98 61.30 2p8p s VAL 82 Cb -0.00 -3.56 -0.04 0.00 0.56 0.00 0.00 36.38 33.33 2p8p s VAL 82 CO 0.46 -0.55 0.02 -0.94 -0.31 0.00 0.00 175.10 173.78 2p8p s SER 83 N -2.80 0.95 0.24 4.85 1.04 -1.26 -1.15 113.70 115.57 2p8p s SER 83 Ca 0.62 -1.18 0.10 0.00 0.48 0.00 0.00 55.95 55.96 2p8p s SER 83 Cb -0.13 0.17 0.53 0.00 0.10 0.00 0.00 66.02 66.69 2p8p s SER 83 CO 0.31 -0.62 1.17 -2.65 0.98 0.00 0.00 173.24 172.44 2p8p n PRO 84 N -0.20 0.07 0.21 4.02 -0.02 -1.26 -0.49 135.00 137.33 2p8p n PRO 84 Ca -0.06 0.50 0.11 0.00 -2.02 0.00 0.00 63.50 62.02 2p8p n PRO 84 Cb 0.63 -1.99 0.28 0.00 -0.02 0.00 0.00 33.50 32.41 2p8p n PRO 84 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2p8p h VAL 85 N 0.00 0.26 -0.06 -1.45 -1.51 -1.96 -3.03 116.25 108.50 2p8p h VAL 85 Ca 0.00 -1.18 0.00 0.00 -1.23 0.00 0.00 66.70 64.29 2p8p h VAL 85 Cb 0.54 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 2p8p h VAL 85 CO 0.00 0.13 0.00 0.47 -1.23 0.00 0.00 177.57 176.94 2p8p n ASP 86 N -3.17 0.60 -4.66 4.19 8.00 0.35 -4.81 116.55 117.06 2p8p n ASP 86 Ca 0.02 -1.52 -0.42 0.00 0.71 0.00 0.00 54.79 53.58 2p8p n ASP 86 Cb 0.52 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 2p8p n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2p8p s THR 87 N -1.93 3.77 0.05 -3.53 2.01 -1.15 -4.89 115.64 109.97 2p8p s THR 87 Ca 0.30 0.93 -0.27 0.00 0.31 0.00 0.00 61.69 62.96 2p8p s THR 87 Cb 0.15 -3.60 0.09 0.00 0.01 0.00 0.00 72.50 69.15 2p8p s THR 87 CO 0.23 -0.08 1.20 0.00 -0.69 0.00 0.00 174.62 175.28 2p8p s ALA 88 N 3.89 -2.12 -0.27 7.40 0.00 -0.59 -4.48 121.76 125.61 2p8p s ALA 88 Ca 0.68 0.13 -0.11 0.00 0.00 0.00 0.00 51.96 52.66 2p8p s ALA 88 Cb -0.30 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.46 2p8p s ALA 88 CO 0.26 -1.09 0.21 0.99 0.00 0.00 0.00 175.76 176.12 2p8p s THR 89 N -2.27 5.30 -0.24 0.00 2.01 -0.61 -0.73 115.64 119.10 2p8p s THR 89 Ca 0.22 0.23 -0.10 0.00 0.31 0.00 0.00 61.69 62.35 2p8p s THR 89 Cb 0.00 -3.55 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 2p8p s THR 89 CO 0.00 0.26 0.14 -0.31 -0.69 0.00 0.00 174.62 174.02 2p8p s TYR 90 N 1.63 3.27 0.13 4.92 2.02 0.81 -0.20 117.35 129.93 2p8p s TYR 90 Ca 0.08 0.11 0.07 0.00 -0.37 0.00 0.00 57.07 56.96 2p8p s TYR 90 Cb -0.15 -2.25 -0.04 0.00 -0.40 0.00 0.00 41.96 39.12 2p8p s TYR 90 CO 0.09 0.00 -0.03 -0.06 -1.57 0.00 0.00 175.55 173.98 2p8p s PHE 91 N 1.11 2.85 -0.03 2.71 0.08 0.12 -1.33 117.98 123.49 2p8p s PHE 91 Ca 0.07 -0.11 0.05 0.00 0.12 0.00 0.00 56.93 57.06 2p8p s PHE 91 Cb -0.14 -1.44 -0.01 0.00 -0.57 0.00 0.00 43.02 40.87 2p8p s PHE 91 CO 0.05 0.48 -0.20 0.00 -0.10 0.00 0.00 175.22 175.45 2p8p s ALA 93 N -0.22 0.75 -0.02 0.00 0.00 0.55 -1.89 121.76 120.92 2p8p s ALA 93 Ca 0.01 -1.01 -0.16 0.00 0.00 0.00 0.00 51.96 50.80 2p8p s ALA 93 Cb -0.10 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.05 2p8p s ALA 93 CO 0.01 -0.11 0.45 -1.58 0.00 0.00 0.00 175.76 174.53 2p8p s HIS 94 N -2.31 3.68 -0.07 0.00 5.65 0.44 -0.59 115.29 122.09 2p8p s HIS 94 Ca -0.01 1.00 0.05 0.00 0.25 0.00 0.00 55.06 56.35 2p8p s HIS 94 Cb -0.04 -2.39 -0.01 0.00 -1.18 0.00 0.00 32.58 28.96 2p8p s HIS 94 CO -0.02 0.50 -0.22 0.50 -0.65 0.00 0.00 174.74 174.85 2p8p s ARG 95 N -0.60 2.71 0.59 2.88 3.52 0.29 -2.29 118.95 126.05 2p8p s ARG 95 Ca 0.25 -0.85 -0.15 0.00 -0.13 0.00 0.00 55.73 54.85 2p8p s ARG 95 Cb -0.17 -2.26 -0.04 0.00 -1.56 0.00 0.00 34.95 30.92 2p8p s ARG 95 CO 0.13 0.37 1.04 1.03 -0.81 0.00 0.00 175.30 177.06 2p8p s ARG 96 N -0.11 3.38 0.77 5.12 0.52 -1.26 -1.93 118.95 125.45 2p8p s ARG 96 Ca -0.04 1.11 -0.04 0.00 -0.52 0.00 0.00 55.73 56.24 2p8p s ARG 96 Cb -0.14 -2.05 0.14 0.00 0.52 0.00 0.00 34.95 33.43 2p8p s ARG 96 CO 0.04 -0.75 1.06 0.20 0.02 0.00 0.00 175.30 175.88 2p8p s GLY 97 N -3.02 1.76 0.79 -3.53 0.00 -1.26 -4.40 107.32 97.66 2p8p s GLY 97 Ca 0.62 -1.63 -0.12 0.00 0.00 0.00 0.00 44.72 43.59 2p8p s GLY 97 CO 0.39 -1.02 1.10 -4.14 0.00 0.00 0.00 173.10 169.43 2p8p s PRO 98 N -5.30 2.14 -0.23 2.90 0.02 -1.26 -4.29 135.00 128.98 2p8p s PRO 98 Ca 0.68 0.57 -0.29 0.00 0.02 0.00 0.00 61.00 61.98 2p8p s PRO 98 Cb -0.05 -1.93 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 2p8p s PRO 98 CO 0.46 -1.57 1.69 0.99 -0.33 0.00 0.00 177.00 178.25 2p8p s THR 99 N -3.21 3.59 -0.16 0.99 2.01 -0.11 -4.92 115.64 113.84 2p8p s THR 99 Ca 0.61 0.66 -0.04 0.00 0.31 0.00 0.00 61.69 63.22 2p8p s THR 99 Cb -0.14 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.71 2p8p s THR 99 CO 0.54 -0.29 -0.01 0.42 -0.69 0.00 0.00 174.62 174.58 2p8p s THR 100 N 5.60 4.15 -0.19 -0.82 -4.23 -1.26 -0.40 115.64 118.49 2p8p s THR 100 Ca 0.75 -0.27 -0.00 0.00 -1.18 0.00 0.00 61.69 60.99 2p8p s THR 100 Cb -0.26 -2.83 0.01 0.00 1.34 0.00 0.00 72.50 70.77 2p8p s THR 100 CO 0.31 0.49 -0.16 -0.22 -0.54 0.00 0.00 174.62 174.50 2p8p s LEU 100 N 0.27 2.34 -1.03 4.79 0.20 -0.66 -4.56 118.68 120.03 2p8p s LEU 100 Ca -0.01 -0.57 0.00 0.00 0.69 0.00 0.00 54.13 54.24 2p8p s LEU 100 Cb -0.13 -1.55 0.00 0.00 -0.43 0.00 0.00 46.19 44.08 2p8p s LEU 100 CO 0.02 0.01 0.00 0.49 -0.29 0.00 0.00 176.35 176.58 2p8p n PHE 100 N 4.59 -0.10 -0.48 5.38 3.72 -1.26 -2.70 117.46 126.61 2p8p n PHE 100 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 2p8p n PHE 100 Cb 0.50 -2.05 0.00 0.00 -0.94 0.00 0.00 39.48 36.99 2p8p n PHE 100 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2p8p n GLY 100 N -1.59 1.55 3.43 1.37 0.00 -1.26 -5.02 105.19 103.67 2p8p n GLY 100 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 2p8p n GLY 100 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2p8p s VAL 100 N -3.29 3.35 0.29 1.61 -7.23 -1.10 -5.01 120.40 109.01 2p8p s VAL 100 Ca 0.00 -0.56 -0.30 0.00 -1.81 0.00 0.00 61.98 59.31 2p8p s VAL 100 Cb 0.00 -2.42 -0.12 0.00 0.56 0.00 0.00 36.38 34.40 2p8p s VAL 100 CO 0.00 0.52 1.60 -2.65 -0.31 0.00 0.00 175.10 174.26 2p8p n PRO 100 N 3.39 2.67 -0.00 4.82 -0.02 -1.26 -1.66 135.00 142.95 2p8p n PRO 100 Ca -0.18 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2p8p n PRO 100 Cb 0.53 -2.73 -0.00 0.00 -0.02 0.00 0.00 33.50 31.27 2p8p n PRO 100 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2p8p n ILE 100 N 2.24 0.00 -3.68 4.25 -5.35 0.47 -4.88 119.36 112.41 2p8p n ILE 100 Ca 0.09 -0.33 -0.09 0.00 -0.27 0.00 0.00 62.75 62.15 2p8p n ILE 100 Cb 0.36 0.83 -0.10 0.00 -1.74 0.00 0.00 39.64 38.99 2p8p n ILE 100 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2p8p s ALA 100 N -1.37 -1.21 0.11 -1.28 0.00 -1.12 -4.99 121.76 111.89 2p8p s ALA 100 Ca 0.00 1.67 -0.02 0.00 0.00 0.00 0.00 51.96 53.61 2p8p s ALA 100 Cb 0.00 -1.12 -0.17 0.00 0.00 0.00 0.00 23.12 21.83 2p8p s ALA 100 CO 0.02 -0.42 1.24 -0.09 0.00 0.00 0.00 175.76 176.51 2p8p h ARG 100 N 7.40 0.26 0.00 0.00 2.43 -1.96 -0.27 114.38 122.24 2p8p h ARG 100 Ca -0.30 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 58.51 2p8p h ARG 100 Cb 1.17 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2p8p h ARG 100 CO 0.23 1.12 0.00 0.41 -1.51 0.00 0.00 179.97 180.21 2p8p n GLY 100 N 1.24 0.00 0.34 2.80 0.00 -1.26 -1.92 105.19 106.39 2p8p n GLY 100 Ca -0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 2p8p n GLY 100 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2p8p h PRO 100 N 0.00 0.00 0.00 1.61 0.11 -1.86 -2.59 132.00 129.27 2p8p h PRO 100 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2p8p h PRO 100 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 2p8p h PRO 100 CO 0.00 0.00 -0.08 -0.39 -0.21 0.00 0.00 178.00 177.32 2p8p h VAL 100 N 0.00 0.13 0.00 3.15 -1.51 -1.57 -3.40 116.25 113.05 2p8p h VAL 100 Ca 0.03 -1.16 -0.52 0.00 -1.23 0.00 0.00 66.70 63.82 2p8p h VAL 100 Cb 0.80 2.04 0.01 0.00 -2.13 0.00 0.00 31.29 32.01 2p8p h VAL 100 CO -0.00 0.07 2.91 0.59 -1.23 0.00 0.00 177.57 179.92 2p8p n ASN 100 N -3.12 7.23 0.00 4.19 3.02 -0.98 -4.69 115.26 120.90 2p8p n ASN 100 Ca 0.04 -2.48 0.00 0.00 -0.03 0.00 0.00 54.58 52.11 2p8p n ASN 100 Cb 0.55 -1.40 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 2p8p n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p8p n ALA 100 N 3.56 0.00 -3.42 5.41 0.00 -1.26 -5.08 120.51 119.72 2p8p n ALA 100 Ca 0.64 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.65 2p8p n ALA 100 Cb 0.30 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.69 2p8p n ALA 100 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2p8p s MET 100 N -2.00 2.82 0.23 0.00 -1.94 -1.26 -4.40 119.30 112.75 2p8p s MET 100 Ca 0.00 -1.83 -0.00 0.00 -1.71 0.00 0.00 55.69 52.15 2p8p s MET 100 Cb 0.00 -4.14 0.26 0.00 2.01 0.00 0.00 34.83 32.95 2p8p s MET 100 CO 0.00 -1.27 1.62 0.38 -0.01 0.00 0.00 175.02 175.74 2p8p h ASP 101 N 8.55 0.56 -3.51 3.03 2.03 -1.83 -3.45 116.42 121.80 2p8p h ASP 101 Ca -0.22 -0.24 -0.44 0.00 -0.73 0.00 0.00 57.03 55.40 2p8p h ASP 101 Cb 1.08 -0.16 -0.33 0.00 -0.83 0.00 0.00 39.33 39.09 2p8p h ASP 101 CO 0.93 0.89 -0.79 -0.69 -1.03 0.00 0.00 179.24 178.55 2p8p s VAL 102 N -4.28 0.74 0.30 4.15 1.01 -1.24 -5.02 120.40 116.06 2p8p s VAL 102 Ca -0.07 -0.26 0.11 0.00 0.00 0.00 0.00 61.98 61.75 2p8p s VAL 102 Cb 0.13 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.74 2p8p s VAL 102 CO 0.82 0.26 -0.15 0.26 0.00 0.00 0.00 175.10 176.29 2p8p s TRP 103 N 0.70 2.35 0.65 5.22 0.52 -1.26 -0.42 118.94 126.69 2p8p s TRP 103 Ca -0.11 -0.38 -0.02 0.00 0.02 0.00 0.00 56.10 55.61 2p8p s TRP 103 Cb -0.14 -1.14 0.07 0.00 -1.15 0.00 0.00 33.47 31.12 2p8p s TRP 103 CO 0.01 0.67 0.91 0.20 0.02 0.00 0.00 176.95 178.76 2p8p s GLY 104 N -3.55 1.78 0.48 0.98 0.00 -0.79 -4.57 107.32 101.64 2p8p s GLY 104 Ca 0.31 -1.37 0.13 0.00 0.00 0.00 0.00 44.72 43.79 2p8p s GLY 104 CO 0.16 -0.95 2.12 0.06 0.00 0.00 0.00 173.10 174.48 2p8p h GLN 105 N -0.31 0.17 0.00 2.90 3.07 -1.92 -3.45 115.11 115.56 2p8p h GLN 105 Ca -0.41 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.32 2p8p h GLN 105 Cb 1.29 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 28.81 2p8p h GLN 105 CO 0.50 0.11 0.00 0.41 0.09 0.00 0.00 178.83 179.94 2p8p n GLY 106 N -1.51 2.32 3.03 0.06 0.00 -1.26 -5.04 105.19 102.79 2p8p n GLY 106 Ca -0.01 -1.78 -0.27 0.00 0.00 0.00 0.00 46.02 43.96 2p8p n GLY 106 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2p8p s ILE 107 N -2.25 1.29 -0.11 -0.61 2.07 -0.44 -4.85 121.20 116.30 2p8p s ILE 107 Ca 0.00 -0.53 -0.24 0.00 -1.41 0.00 0.00 60.65 58.46 2p8p s ILE 107 Cb 0.00 -1.19 -0.03 0.00 0.13 0.00 0.00 42.46 41.37 2p8p s ILE 107 CO 0.00 0.40 0.77 -0.89 -1.91 0.00 0.00 174.94 173.30 2p8p s THR 108 N 0.93 4.97 -0.11 4.00 2.01 -1.26 -0.13 115.64 126.04 2p8p s THR 108 Ca -0.09 1.54 0.02 0.00 0.31 0.00 0.00 61.69 63.48 2p8p s THR 108 Cb -0.15 -4.09 0.01 0.00 0.01 0.00 0.00 72.50 68.28 2p8p s THR 108 CO 0.00 0.15 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.20 2p8p s VAL 109 N 1.43 1.74 -0.09 3.82 1.01 0.09 -4.54 120.40 123.86 2p8p s VAL 109 Ca 0.38 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.58 2p8p s VAL 109 Cb -0.17 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 2p8p s VAL 109 CO 0.16 0.49 -0.15 -0.89 0.00 0.00 0.00 175.10 174.71 2p8p s THR 110 N 0.81 2.92 -0.19 3.92 2.01 -0.10 -1.53 115.64 123.48 2p8p s THR 110 Ca -0.09 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.15 2p8p s THR 110 Cb -0.16 -2.17 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 2p8p s THR 110 CO 0.00 0.56 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.77 2p8p s ILE 111 N -0.14 3.08 -0.11 1.82 1.01 -1.26 -1.68 121.20 123.93 2p8p s ILE 111 Ca -0.02 -0.61 -0.27 0.00 0.00 0.00 0.00 60.65 59.75 2p8p s ILE 111 Cb -0.14 -2.36 0.07 0.00 0.01 0.00 0.00 42.46 40.04 2p8p s ILE 111 CO 0.04 0.47 0.65 -0.55 0.00 0.00 0.00 174.94 175.55 2p8p s SER 112 N 1.12 -0.64 0.00 3.58 0.15 -0.94 -4.50 113.70 112.47 2p8p s SER 112 Ca 0.01 0.87 0.27 0.00 0.70 0.00 0.00 55.95 57.80 2p8p s SER 112 Cb -0.14 0.78 0.85 0.00 -1.71 0.00 0.00 66.02 65.80 2p8p s SER 112 CO -0.02 -0.48 1.65 -1.20 1.20 0.00 0.00 173.24 174.38 2p8p n SER 113 N 1.49 0.35 -4.75 5.45 7.64 -1.26 -4.23 113.62 118.31 2p8p n SER 113 Ca -0.18 -0.06 -0.41 0.00 1.01 0.00 0.00 58.87 59.24 2p8p n SER 113 Cb 0.56 -0.05 -0.04 0.00 -1.01 0.00 0.00 64.21 63.68 2p8p n SER 113 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2p8p s THR 114 N -2.92 3.32 0.21 0.44 2.01 -1.26 -5.07 115.64 112.37 2p8p s THR 114 Ca 0.15 1.25 -0.13 0.00 0.31 0.00 0.00 61.69 63.27 2p8p s THR 114 Cb 0.18 -3.80 -0.07 0.00 0.01 0.00 0.00 72.50 68.82 2p8p s THR 114 CO 0.61 0.27 0.59 -0.44 -0.69 0.00 0.00 174.62 174.96 2p8p s SER 115 N -0.47 6.76 0.25 3.53 0.01 -1.26 -5.02 113.70 117.50 2p8p s SER 115 Ca 0.48 1.07 -0.31 0.00 1.31 0.00 0.00 55.95 58.50 2p8p s SER 115 Cb -0.34 -2.29 -0.13 0.00 0.21 0.00 0.00 66.02 63.48 2p8p s SER 115 CO 0.42 -0.02 1.55 0.41 0.41 0.00 0.00 173.24 176.01 2p8p n THR 116 N 0.25 0.76 -3.59 1.44 -1.04 -1.26 -4.78 114.28 106.07 2p8p n THR 116 Ca -0.01 -0.19 -0.11 0.00 -2.04 0.00 0.00 64.05 61.69 2p8p n THR 116 Cb 0.52 -1.75 -0.06 0.00 -1.82 0.00 0.00 70.33 67.22 2p8p n THR 116 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2p8p s LYS 117 N -0.12 0.64 0.62 -2.82 0.00 0.47 -4.97 119.74 113.55 2p8p s LYS 117 Ca 0.68 0.30 -0.16 0.00 0.00 0.00 0.00 55.97 56.79 2p8p s LYS 117 Cb -0.57 0.30 -0.02 0.00 0.00 0.00 0.00 37.83 37.54 2p8p s LYS 117 CO 0.46 -0.17 1.09 0.20 0.00 0.00 0.00 175.35 176.92 2p8p s GLY 118 N -0.75 2.19 0.42 0.59 0.00 -1.26 -1.68 107.32 106.83 2p8p s GLY 118 Ca -0.02 0.51 -0.17 0.00 0.00 0.00 0.00 44.72 45.04 2p8p s GLY 118 CO 0.01 0.85 0.88 2.56 0.00 0.00 0.00 173.10 177.39 2p8p s PRO 119 N -3.99 4.05 -0.16 2.90 0.04 -1.26 -4.49 135.00 132.08 2p8p s PRO 119 Ca 0.66 0.89 -0.06 0.00 0.04 0.00 0.00 61.00 62.53 2p8p s PRO 119 Cb -0.19 -2.26 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 2p8p s PRO 119 CO 0.38 -0.04 0.04 -1.12 0.04 0.00 0.00 177.00 176.30 2p8p s SER 120 N -2.53 5.50 -0.20 6.66 0.01 0.16 -4.92 113.70 118.39 2p8p s SER 120 Ca 0.58 0.08 -0.06 0.00 1.31 0.00 0.00 55.95 57.86 2p8p s SER 120 Cb -0.10 -1.88 -0.03 0.00 0.21 0.00 0.00 66.02 64.22 2p8p s SER 120 CO 0.20 0.21 0.03 -0.69 0.41 0.00 0.00 173.24 173.41 2p8p s VAL 121 N 0.13 4.33 0.09 3.43 1.01 -1.26 -1.29 120.40 126.85 2p8p s VAL 121 Ca 0.04 -0.19 0.10 0.00 0.00 0.00 0.00 61.98 61.93 2p8p s VAL 121 Cb -0.12 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 2p8p s VAL 121 CO 0.01 0.43 -0.24 -0.36 0.00 0.00 0.00 175.10 174.93 2p8p s PHE 122 N 0.84 2.38 0.46 5.22 0.08 -0.73 -4.96 117.98 121.27 2p8p s PHE 122 Ca 0.02 -0.36 -0.10 0.00 0.12 0.00 0.00 56.93 56.61 2p8p s PHE 122 Cb -0.14 -1.34 -0.06 0.00 -0.57 0.00 0.00 43.02 40.92 2p8p s PHE 122 CO 0.02 0.27 0.83 -1.25 -0.10 0.00 0.00 175.22 174.99 2p8p s PRO 123 N -1.74 3.72 -0.59 0.24 0.04 -1.26 -0.56 135.00 134.86 2p8p s PRO 123 Ca 0.14 0.50 0.04 0.00 0.04 0.00 0.00 61.00 61.72 2p8p s PRO 123 Cb -0.10 -2.32 0.16 0.00 0.04 0.00 0.00 34.50 32.28 2p8p s PRO 123 CO 0.05 -0.17 0.40 -0.51 0.04 0.00 0.00 177.00 176.81 2p8p s LEU 124 N -4.24 3.78 0.05 -3.56 1.43 0.17 -4.77 118.68 111.54 2p8p s LEU 124 Ca 0.52 -3.42 0.02 0.00 -1.03 0.00 0.00 54.13 50.22 2p8p s LEU 124 Cb -0.10 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.76 2p8p s LEU 124 CO 0.37 -0.14 0.06 0.00 0.23 0.00 0.00 176.35 176.87 2p8p s ALA 125 N -0.76 3.51 0.21 4.21 0.00 -1.26 -0.67 121.76 127.01 2p8p s ALA 125 Ca 0.24 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.22 2p8p s ALA 125 Cb -0.08 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.60 2p8p s ALA 125 CO -0.13 0.72 0.00 -2.30 0.00 0.00 0.00 175.76 174.05 2p8p n PRO 126 N 0.74 3.48 0.00 0.00 -0.02 -1.26 -4.99 135.00 132.95 2p8p n PRO 126 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 2p8p n PRO 126 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2p8p n PRO 126 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2p8p n THR 136 N -0.02 0.00 -4.32 3.45 5.66 -1.26 -5.13 114.28 112.65 2p8p n THR 136 Ca 0.00 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.71 2p8p n THR 136 Cb 0.00 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.66 2p8p n THR 136 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2p8p s ALA 137 N 0.00 2.61 0.01 1.79 0.00 0.18 -4.77 121.76 121.58 2p8p s ALA 137 Ca 0.00 -1.38 0.06 0.00 0.00 0.00 0.00 51.96 50.63 2p8p s ALA 137 Cb 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 2p8p s ALA 137 CO 0.00 0.58 -0.17 0.00 0.00 0.00 0.00 175.76 176.16 2p8p s ALA 138 N -1.13 1.46 0.21 0.00 0.00 -1.26 -0.61 121.76 120.43 2p8p s ALA 138 Ca 0.17 -0.82 -0.14 0.00 0.00 0.00 0.00 51.96 51.17 2p8p s ALA 138 Cb -0.10 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.69 2p8p s ALA 138 CO 0.09 0.34 0.46 -0.48 0.00 0.00 0.00 175.76 176.17 2p8p s LEU 139 N -0.67 0.36 0.00 0.00 2.34 -1.01 -4.28 118.68 115.41 2p8p s LEU 139 Ca 0.06 -0.72 -0.07 0.00 0.06 0.00 0.00 54.13 53.46 2p8p s LEU 139 Cb -0.07 1.81 0.02 0.00 -0.56 0.00 0.00 46.19 47.39 2p8p s LEU 139 CO 0.00 -1.05 0.30 0.61 -1.06 0.00 0.00 176.35 175.15 2p8p n GLY 140 N -0.33 0.42 3.10 -3.48 0.00 0.16 -0.90 105.19 104.17 2p8p n GLY 140 Ca -0.07 -0.86 -0.24 0.00 0.00 0.00 0.00 46.02 44.85 2p8p n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p8p s LEU 142 N 0.02 5.42 -0.69 0.00 2.96 0.28 -1.01 118.68 125.66 2p8p s LEU 142 Ca -0.02 -1.35 -0.21 0.00 -0.22 0.00 0.00 54.13 52.33 2p8p s LEU 142 Cb -0.10 -2.12 0.09 0.00 0.50 0.00 0.00 46.19 44.56 2p8p s LEU 142 CO 0.01 -0.59 0.92 -0.69 -1.32 0.00 0.00 176.35 174.68 2p8p s VAL 143 N 1.57 4.52 0.19 1.68 1.01 0.14 -1.77 120.40 127.75 2p8p s VAL 143 Ca 0.04 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.35 2p8p s VAL 143 Cb -0.23 -4.65 -0.04 0.00 0.00 0.00 0.00 36.38 31.46 2p8p s VAL 143 CO 0.05 -1.38 0.08 -0.75 0.00 0.00 0.00 175.10 173.10 2p8p s LYS 144 N 3.46 2.65 -1.24 2.72 2.20 -0.41 -0.23 119.74 128.89 2p8p s LYS 144 Ca 0.21 -1.04 -0.06 0.00 -0.36 0.00 0.00 55.97 54.72 2p8p s LYS 144 Cb -0.17 -2.48 -0.01 0.00 -1.51 0.00 0.00 37.83 33.67 2p8p s LYS 144 CO 0.06 0.45 0.72 -0.25 -0.36 0.00 0.00 175.35 175.96 2p8p n ASP 145 N -0.43 -2.74 -4.53 1.43 8.00 -0.67 -0.66 116.55 116.94 2p8p n ASP 145 Ca -0.09 -0.88 -0.24 0.00 0.71 0.00 0.00 54.79 54.29 2p8p n ASP 145 Cb 0.56 -3.90 -0.09 0.00 -0.02 0.00 0.00 41.12 37.67 2p8p n ASP 145 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2p8p s TYR 146 N -3.62 2.45 -0.28 1.24 1.13 -0.81 -4.26 117.35 113.20 2p8p s TYR 146 Ca 0.18 -0.29 -0.17 0.00 -1.41 0.00 0.00 57.07 55.38 2p8p s TYR 146 Cb -0.05 -1.09 0.10 0.00 -1.10 0.00 0.00 41.96 39.82 2p8p s TYR 146 CO 0.83 0.65 0.80 0.12 -2.51 0.00 0.00 175.55 175.44 2p8p s PHE 147 N -2.31 -0.87 0.09 -3.49 5.36 -0.67 0.22 117.98 116.32 2p8p s PHE 147 Ca 0.29 1.76 0.00 0.00 -0.96 0.00 0.00 56.93 58.02 2p8p s PHE 147 Cb -0.06 0.51 0.02 0.00 -0.34 0.00 0.00 43.02 43.15 2p8p s PHE 147 CO 0.16 -0.43 0.13 -0.35 -1.46 0.00 0.00 175.22 173.27 2p8p n PRO 148 N 3.98 0.66 -2.31 10.12 -0.04 -1.26 -0.40 135.00 145.75 2p8p n PRO 148 Ca -0.19 -0.39 -0.33 0.00 -0.04 0.00 0.00 63.50 62.55 2p8p n PRO 148 Cb 0.58 -0.07 -0.02 0.00 -0.04 0.00 0.00 33.50 33.95 2p8p n PRO 148 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2p8p s GLU 149 N -2.63 3.72 0.25 0.54 2.02 -1.26 -4.80 118.70 116.54 2p8p s GLU 149 Ca 0.09 1.10 0.03 0.00 0.02 0.00 0.00 54.97 56.21 2p8p s GLU 149 Cb -0.01 -2.10 0.03 0.00 0.10 0.00 0.00 34.13 32.16 2p8p s GLU 149 CO 0.06 -0.47 0.29 -0.35 0.02 0.00 0.00 175.26 174.80 2p8p n PRO 150 N -1.62 0.94 -3.73 0.39 -0.04 -1.26 -5.00 135.00 124.69 2p8p n PRO 150 Ca 0.08 -1.40 -0.14 0.00 -0.04 0.00 0.00 63.50 61.99 2p8p n PRO 150 Cb 0.53 -0.01 -0.14 0.00 -0.04 0.00 0.00 33.50 33.84 2p8p n PRO 150 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2p8p s VAL 151 N -0.79 -0.10 -0.10 0.52 1.01 -1.26 -4.55 120.40 115.13 2p8p s VAL 151 Ca 0.22 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.32 2p8p s VAL 151 Cb -0.02 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 2p8p s VAL 151 CO 0.14 0.09 0.21 0.42 0.00 0.00 0.00 175.10 175.96 2p8p s THR 152 N 1.44 5.38 -0.10 3.92 -4.23 -0.54 -4.96 115.64 116.55 2p8p s THR 152 Ca -0.07 0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 60.81 2p8p s THR 152 Cb -0.12 -3.49 0.03 0.00 1.34 0.00 0.00 72.50 70.26 2p8p s THR 152 CO -0.06 0.58 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.86 2p8p s VAL 153 N -0.81 0.77 0.21 2.29 1.01 -1.26 -1.70 120.40 120.91 2p8p s VAL 153 Ca 0.16 -0.13 0.10 0.00 0.00 0.00 0.00 61.98 62.11 2p8p s VAL 153 Cb -0.13 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 2p8p s VAL 153 CO 0.06 0.33 -0.19 -0.94 0.00 0.00 0.00 175.10 174.35 2p8p s SER 154 N 1.79 3.06 -0.06 3.32 1.04 -0.68 -4.94 113.70 117.23 2p8p s SER 154 Ca 0.05 -0.94 0.03 0.00 0.48 0.00 0.00 55.95 55.56 2p8p s SER 154 Cb -0.12 -0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.76 2p8p s SER 154 CO -0.07 -0.01 -0.12 0.26 0.98 0.00 0.00 173.24 174.28 2p8p s TRP 155 N -2.29 2.78 -1.70 5.02 0.52 -1.26 0.66 118.94 122.68 2p8p s TRP 155 Ca 0.22 -0.13 -0.17 0.00 0.02 0.00 0.00 56.10 56.04 2p8p s TRP 155 Cb -0.05 -1.67 0.15 0.00 -1.15 0.00 0.00 33.47 30.75 2p8p s TRP 155 CO 0.10 0.21 0.69 0.09 0.02 0.00 0.00 176.95 178.05 2p8p n ASN 156 N 2.36 -2.59 -1.88 2.95 3.02 0.42 -0.54 115.26 119.00 2p8p n ASN 156 Ca -0.17 -1.06 -0.18 0.00 -0.03 0.00 0.00 54.58 53.13 2p8p n ASN 156 Cb 0.52 -2.55 -0.03 0.00 -0.61 0.00 0.00 39.78 37.12 2p8p n ASN 156 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2p8p n SER 157 N -2.67 -5.22 0.00 6.41 7.64 -1.26 -2.42 113.62 116.10 2p8p n SER 157 Ca 0.03 0.10 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2p8p n SER 157 Cb 0.51 -4.30 0.00 0.00 -1.01 0.00 0.00 64.21 59.41 2p8p n SER 157 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2p8p n GLY 158 N -0.95 2.78 0.35 0.23 0.00 0.30 -4.97 105.19 102.92 2p8p n GLY 158 Ca -0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.80 2p8p n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p8p h ALA 159 N 0.00 1.22 -2.82 4.61 0.00 -1.33 -3.40 119.26 117.54 2p8p h ALA 159 Ca 0.00 -0.05 -0.66 0.00 0.00 0.00 0.00 54.91 54.21 2p8p h ALA 159 Cb 0.00 -0.34 -0.18 0.00 0.00 0.00 0.00 17.79 17.27 2p8p h ALA 159 CO 0.00 0.50 -0.50 -1.17 0.00 0.00 0.00 179.25 178.07 2p8p s LEU 160 N -10.15 4.24 0.00 0.00 2.96 -1.08 -4.85 118.68 109.79 2p8p s LEU 160 Ca -0.13 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 2p8p s LEU 160 Cb 0.18 -2.12 0.00 0.00 0.50 0.00 0.00 46.19 44.75 2p8p s LEU 160 CO 0.81 -0.13 0.00 0.35 -1.32 0.00 0.00 176.35 176.05 2p8p n THR 161 N 5.08 0.00 -2.50 3.68 -2.24 -1.26 -3.98 114.28 113.05 2p8p n THR 161 Ca -0.13 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.22 2p8p n THR 161 Cb 0.51 -0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.57 2p8p n THR 161 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2p8p s SER 162 N -1.26 7.04 0.00 3.42 1.04 -1.26 -3.12 113.70 119.55 2p8p s SER 162 Ca 0.00 1.68 0.00 0.00 0.48 0.00 0.00 55.95 58.11 2p8p s SER 162 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2p8p s SER 162 CO 0.00 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.19 2p8p n GLY 163 N 3.41 0.86 3.74 7.32 0.00 -1.26 -4.76 105.19 114.50 2p8p n GLY 163 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2p8p n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p8p s VAL 164 N -3.00 4.29 -0.27 1.61 1.01 -1.18 -2.30 120.40 120.56 2p8p s VAL 164 Ca 0.00 2.07 -0.03 0.00 0.00 0.00 0.00 61.98 64.03 2p8p s VAL 164 Cb 0.00 -4.32 0.09 0.00 0.00 0.00 0.00 36.38 32.15 2p8p s VAL 164 CO 0.00 0.40 0.10 -1.00 0.00 0.00 0.00 175.10 174.60 2p8p s HIS 165 N -0.55 0.97 -0.38 5.22 3.76 0.09 -4.98 115.29 119.42 2p8p s HIS 165 Ca 0.44 -1.17 -0.16 0.00 -0.15 0.00 0.00 55.06 54.02 2p8p s HIS 165 Cb -0.25 -1.22 0.01 0.00 1.11 0.00 0.00 32.58 32.22 2p8p s HIS 165 CO 0.31 -0.79 0.40 0.99 -0.85 0.00 0.00 174.74 174.80 2p8p s THR 166 N 1.87 5.13 0.56 1.30 2.01 -1.26 -0.87 115.64 124.38 2p8p s THR 166 Ca 0.07 -0.15 -0.15 0.00 0.31 0.00 0.00 61.69 61.77 2p8p s THR 166 Cb -0.17 -3.93 -0.06 0.00 0.01 0.00 0.00 72.50 68.35 2p8p s THR 166 CO -0.26 -0.26 1.02 -0.36 -0.69 0.00 0.00 174.62 174.07 2p8p s PHE 167 N 2.08 3.30 0.41 4.92 0.08 -0.73 -5.02 117.98 123.02 2p8p s PHE 167 Ca 0.12 1.46 -0.25 0.00 0.12 0.00 0.00 56.93 58.38 2p8p s PHE 167 Cb -0.17 -2.86 -0.08 0.00 -0.57 0.00 0.00 43.02 39.34 2p8p s PHE 167 CO 0.13 -0.69 1.21 -2.14 -0.10 0.00 0.00 175.22 173.62 2p8p s PRO 168 N -4.23 3.96 0.57 0.24 0.02 -1.26 -4.64 135.00 129.66 2p8p s PRO 168 Ca 0.60 1.92 -0.19 0.00 0.02 0.00 0.00 61.00 63.36 2p8p s PRO 168 Cb -0.12 -2.64 -0.05 0.00 0.02 0.00 0.00 34.50 31.71 2p8p s PRO 168 CO 0.36 -0.43 1.14 0.00 -0.33 0.00 0.00 177.00 177.75 2p8p s ALA 169 N -1.39 2.64 -0.08 -1.55 0.00 -1.26 -4.81 121.76 115.31 2p8p s ALA 169 Ca 0.58 0.82 0.03 0.00 0.00 0.00 0.00 51.96 53.40 2p8p s ALA 169 Cb -0.33 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.41 2p8p s ALA 169 CO 0.41 -0.90 -0.17 0.14 0.00 0.00 0.00 175.76 175.25 2p8p s VAL 170 N -1.81 2.79 -0.27 0.00 -7.23 0.21 -4.95 120.40 109.14 2p8p s VAL 170 Ca 0.73 -0.79 -0.26 0.00 -1.81 0.00 0.00 61.98 59.85 2p8p s VAL 170 Cb -0.25 -2.11 0.00 0.00 0.56 0.00 0.00 36.38 34.59 2p8p s VAL 170 CO 0.30 0.56 0.89 -0.22 -0.31 0.00 0.00 175.10 176.32 2p8p s LEU 171 N -0.15 4.06 0.74 1.32 2.96 -1.26 -1.62 118.68 124.73 2p8p s LEU 171 Ca -0.02 0.97 -0.10 0.00 -0.22 0.00 0.00 54.13 54.77 2p8p s LEU 171 Cb -0.14 -3.27 0.06 0.00 0.50 0.00 0.00 46.19 43.34 2p8p s LEU 171 CO 0.04 -0.64 1.09 -1.10 -1.32 0.00 0.00 176.35 174.42 2p8p s GLN 172 N 3.08 2.25 0.58 1.98 -0.21 -0.23 -4.96 119.66 122.15 2p8p s GLN 172 Ca 0.37 0.03 0.27 0.00 0.02 0.00 0.00 55.36 56.06 2p8p s GLN 172 Cb -0.14 -2.06 1.72 0.00 1.00 0.00 0.00 33.01 33.52 2p8p s GLN 172 CO 0.10 -1.32 2.22 0.66 -2.12 0.00 0.00 175.29 174.83 2p8p h SER 173 N -0.77 0.00 0.33 5.90 4.64 -1.96 -1.26 113.55 120.43 2p8p h SER 173 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2p8p h SER 173 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2p8p h SER 173 CO 0.63 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.05 2p8p n SER 174 N -3.95 0.00 0.00 4.97 3.41 -1.26 -4.88 113.62 111.90 2p8p n SER 174 Ca -0.02 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 2p8p n SER 174 Cb 0.12 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 2p8p n SER 174 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2p8p n GLY 175 N 1.08 0.85 3.90 5.00 0.00 -0.48 -4.98 105.19 110.56 2p8p n GLY 175 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2p8p n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p8p s LEU 176 N 0.00 4.24 0.41 0.99 1.43 -1.26 -4.86 118.68 119.62 2p8p s LEU 176 Ca 0.00 0.16 -0.01 0.00 -1.03 0.00 0.00 54.13 53.25 2p8p s LEU 176 Cb 0.00 -2.83 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 2p8p s LEU 176 CO 0.00 0.11 0.64 -0.31 0.23 0.00 0.00 176.35 177.02 2p8p s TYR 177 N -1.61 3.46 -0.06 0.29 2.02 0.13 -1.07 117.35 120.51 2p8p s TYR 177 Ca 0.34 0.45 -0.06 0.00 -0.37 0.00 0.00 57.07 57.43 2p8p s TYR 177 Cb -0.12 -2.10 0.02 0.00 -0.40 0.00 0.00 41.96 39.36 2p8p s TYR 177 CO 0.27 -0.10 0.16 0.45 -1.57 0.00 0.00 175.55 174.77 2p8p s SER 178 N -4.10 -0.17 0.05 2.29 0.15 -0.64 -1.67 113.70 109.63 2p8p s SER 178 Ca 0.44 0.32 -0.07 0.00 0.70 0.00 0.00 55.95 57.34 2p8p s SER 178 Cb -0.10 0.33 -0.01 0.00 -1.71 0.00 0.00 66.02 64.54 2p8p s SER 178 CO 0.39 -0.06 0.14 -0.22 1.20 0.00 0.00 173.24 174.69 2p8p s LEU 179 N 0.06 1.61 -0.01 3.45 0.20 0.68 -0.62 118.68 124.05 2p8p s LEU 179 Ca -0.00 -0.55 0.01 0.00 0.69 0.00 0.00 54.13 54.27 2p8p s LEU 179 Cb -0.01 0.80 0.01 0.00 -0.43 0.00 0.00 46.19 46.56 2p8p s LEU 179 CO 0.00 -0.60 -0.01 -0.94 -0.29 0.00 0.00 176.35 174.52 2p8p s SER 180 N -2.39 0.24 -0.08 3.68 1.04 -1.26 0.25 113.70 115.18 2p8p s SER 180 Ca -0.01 -0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.44 2p8p s SER 180 Cb 0.01 -0.06 -0.00 0.00 0.10 0.00 0.00 66.02 66.07 2p8p s SER 180 CO -0.07 -0.01 -0.22 -0.55 0.98 0.00 0.00 173.24 173.38 2p8p s SER 181 N 0.24 2.77 0.33 7.02 0.15 -0.18 -1.77 113.70 122.25 2p8p s SER 181 Ca -0.02 -0.48 0.04 0.00 0.70 0.00 0.00 55.95 56.19 2p8p s SER 181 Cb -0.04 -1.07 -0.06 0.00 -1.71 0.00 0.00 66.02 63.13 2p8p s SER 181 CO -0.01 0.16 0.04 0.68 1.20 0.00 0.00 173.24 175.32 2p8p s VAL 182 N 0.22 1.31 -0.21 4.45 -7.23 -0.05 -0.64 120.40 118.25 2p8p s VAL 182 Ca -0.12 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 57.91 2p8p s VAL 182 Cb -0.16 -2.77 0.07 0.00 0.56 0.00 0.00 36.38 34.07 2p8p s VAL 182 CO 0.06 -0.04 0.51 0.54 -0.31 0.00 0.00 175.10 175.87 2p8p s VAL 183 N -3.22 -0.02 -0.16 1.32 0.11 -0.08 -0.73 120.40 117.64 2p8p s VAL 183 Ca 0.36 0.06 -0.14 0.00 -2.93 0.00 0.00 61.98 59.32 2p8p s VAL 183 Cb 0.08 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 34.14 2p8p s VAL 183 CO 0.15 0.02 0.30 0.42 -3.33 0.00 0.00 175.10 172.67 2p8p s THR 184 N 1.41 5.30 0.06 5.04 -4.23 -0.97 -2.42 115.64 119.82 2p8p s THR 184 Ca -0.09 0.57 0.00 0.00 -1.18 0.00 0.00 61.69 61.00 2p8p s THR 184 Cb -0.07 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 2p8p s THR 184 CO -0.14 0.39 -0.04 0.68 -0.54 0.00 0.00 174.62 174.96 2p8p s VAL 185 N 0.46 0.34 0.20 2.29 -7.23 0.22 -4.68 120.40 112.01 2p8p s VAL 185 Ca 0.17 -1.60 -0.32 0.00 -1.81 0.00 0.00 61.98 58.42 2p8p s VAL 185 Cb -0.13 -1.24 -0.12 0.00 0.56 0.00 0.00 36.38 35.45 2p8p s VAL 185 CO 0.04 -0.82 1.72 -2.84 -0.31 0.00 0.00 175.10 172.89 2p8p s PRO 186 N -3.22 4.13 0.00 4.82 0.02 -1.26 0.50 135.00 139.99 2p8p s PRO 186 Ca 0.02 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.64 2p8p s PRO 186 Cb 0.02 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.45 2p8p s PRO 186 CO -0.06 -0.75 0.17 -1.13 -0.33 0.00 0.00 177.00 174.90 2p8p n SER 187 N 4.03 0.38 -0.03 2.53 3.41 -1.26 -2.88 113.62 119.79 2p8p n SER 187 Ca 0.16 -0.56 -0.02 0.00 -0.26 0.00 0.00 58.87 58.18 2p8p n SER 187 Cb 0.35 -0.14 -0.01 0.00 -0.26 0.00 0.00 64.21 64.16 2p8p n SER 187 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2p8p n SER 188 N 0.45 0.81 -2.71 4.04 7.64 -1.26 -5.03 113.62 117.56 2p8p n SER 188 Ca 0.00 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.24 2p8p n SER 188 Cb 0.08 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 2p8p n SER 188 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2p8p n SER 189 N -3.31 0.00 0.00 6.43 3.41 -1.14 -5.23 113.62 113.78 2p8p n SER 189 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2p8p n SER 189 Cb 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2p8p n SER 189 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2p8p n GLN 193 N 0.00 3.38 -3.95 4.33 7.27 -1.26 -5.13 117.38 122.03 2p8p n GLN 193 Ca 0.00 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.76 2p8p n GLN 193 Cb 0.00 -0.57 -0.05 0.00 2.41 0.00 0.00 30.24 32.04 2p8p n GLN 193 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2p8p s THR 194 N -0.69 5.22 -0.13 1.69 -4.23 -1.26 -5.10 115.64 111.14 2p8p s THR 194 Ca 0.00 -0.44 0.01 0.00 -1.18 0.00 0.00 61.69 60.09 2p8p s THR 194 Cb 0.00 -3.52 0.02 0.00 1.34 0.00 0.00 72.50 70.33 2p8p s THR 194 CO 0.00 0.16 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.77 2p8p s TYR 195 N -1.46 2.18 -0.05 3.99 2.02 -1.26 -5.66 117.35 117.10 2p8p s TYR 195 Ca 0.33 -1.13 0.01 0.00 -0.37 0.00 0.00 57.07 55.91 2p8p s TYR 195 Cb -0.13 -1.56 0.02 0.00 -0.40 0.00 0.00 41.96 39.89 2p8p s TYR 195 CO 0.26 -0.58 -0.06 0.99 -1.57 0.00 0.00 175.55 174.58 2p8p s THR 196 N 1.16 0.68 -0.21 -0.71 2.01 -1.26 -0.86 115.64 116.45 2p8p s THR 196 Ca -0.02 -0.19 -0.15 0.00 0.31 0.00 0.00 61.69 61.65 2p8p s THR 196 Cb -0.14 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 2p8p s THR 196 CO -0.06 0.26 0.35 0.00 -0.69 0.00 0.00 174.62 174.49 2p8p s ASN 198 N 1.07 6.18 -0.17 0.00 -0.87 0.21 -1.73 114.94 119.64 2p8p s ASN 198 Ca 0.17 -1.60 -0.12 0.00 -1.57 0.00 0.00 52.86 49.74 2p8p s ASN 198 Cb -0.15 -2.21 -0.05 0.00 -0.02 0.00 0.00 41.25 38.82 2p8p s ASN 198 CO 0.07 -0.82 0.21 -0.69 -2.57 0.00 0.00 177.10 173.31 2p8p s VAL 199 N 1.73 5.36 -0.05 1.60 1.01 0.73 -1.68 120.40 129.10 2p8p s VAL 199 Ca 0.04 0.38 -0.00 0.00 0.00 0.00 0.00 61.98 62.40 2p8p s VAL 199 Cb -0.27 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.58 2p8p s VAL 199 CO 0.05 0.43 -0.01 0.21 0.00 0.00 0.00 175.10 175.78 2p8p s ASN 200 N 0.29 1.14 -0.53 3.32 3.04 -0.69 -0.33 114.94 121.18 2p8p s ASN 200 Ca 0.13 -0.08 0.04 0.00 0.04 0.00 0.00 52.86 52.99 2p8p s ASN 200 Cb -0.12 -0.39 0.15 0.00 -1.54 0.00 0.00 41.25 39.35 2p8p s ASN 200 CO 0.01 -0.14 0.33 -2.28 -3.04 0.00 0.00 177.10 171.99 2p8p s HIS 201 N 1.47 2.64 0.48 0.43 5.65 -0.68 -1.47 115.29 123.81 2p8p s HIS 201 Ca -0.03 -2.87 0.23 0.00 0.25 0.00 0.00 55.06 52.64 2p8p s HIS 201 Cb -0.13 -2.25 1.26 0.00 -1.18 0.00 0.00 32.58 30.28 2p8p s HIS 201 CO -0.03 -0.71 1.91 0.87 -0.65 0.00 0.00 174.74 176.14 2p8p h LYS 202 N 6.17 0.19 -0.39 2.88 1.57 -1.83 -2.16 116.57 123.01 2p8p h LYS 202 Ca 0.05 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.78 2p8p h LYS 202 Cb 0.87 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.11 2p8p h LYS 202 CO 0.59 0.13 0.09 -1.35 -0.57 0.00 0.00 179.45 178.34 2p8p h PRO 203 N 0.20 0.58 -0.00 3.15 0.11 -1.91 -2.98 132.00 131.14 2p8p h PRO 203 Ca 0.38 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 66.39 2p8p h PRO 203 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2p8p h PRO 203 CO -0.07 0.54 -0.90 -1.13 -0.21 0.00 0.00 178.00 176.22 2p8p n SER 204 N -4.32 1.17 -3.25 -2.05 3.41 -1.09 -4.95 113.62 102.54 2p8p n SER 204 Ca 0.02 -1.08 -0.15 0.00 -0.26 0.00 0.00 58.87 57.40 2p8p n SER 204 Cb 0.20 0.90 0.07 0.00 -0.26 0.00 0.00 64.21 65.12 2p8p n SER 204 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2p8p n ASN 205 N -1.24 -6.57 -3.98 4.04 3.02 -0.84 -4.88 115.26 104.82 2p8p n ASN 205 Ca 0.05 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.58 2p8p n ASN 205 Cb 0.35 -5.20 -0.15 0.00 -0.61 0.00 0.00 39.78 34.17 2p8p n ASN 205 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2p8p s THR 206 N -3.39 1.78 -0.17 3.41 2.01 -1.07 -5.03 115.64 113.18 2p8p s THR 206 Ca 0.45 -1.48 -0.02 0.00 0.31 0.00 0.00 61.69 60.95 2p8p s THR 206 Cb -0.06 -2.04 -0.01 0.00 0.01 0.00 0.00 72.50 70.40 2p8p s THR 206 CO 0.74 -0.16 -0.08 -0.75 -0.69 0.00 0.00 174.62 173.68 2p8p s LYS 207 N 1.26 3.43 0.03 4.92 2.20 -1.26 -1.69 119.74 128.62 2p8p s LYS 207 Ca -0.04 -0.63 0.03 0.00 -0.36 0.00 0.00 55.97 54.96 2p8p s LYS 207 Cb -0.19 -2.82 -0.02 0.00 -1.51 0.00 0.00 37.83 33.29 2p8p s LYS 207 CO -0.07 0.06 -0.09 0.08 -0.36 0.00 0.00 175.35 174.97 2p8p s VAL 208 N 0.78 0.72 -0.27 4.02 1.01 0.55 -5.01 120.40 122.20 2p8p s VAL 208 Ca -0.03 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2p8p s VAL 208 Cb -0.15 -0.68 0.07 0.00 0.00 0.00 0.00 36.38 35.62 2p8p s VAL 208 CO 0.01 -0.07 -0.02 -1.81 0.00 0.00 0.00 175.10 173.21 2p8p s ASP 209 N -0.95 4.11 -0.26 3.32 1.01 -1.26 -0.19 116.67 122.45 2p8p s ASP 209 Ca -0.02 -1.45 -0.07 0.00 0.71 0.00 0.00 52.55 51.72 2p8p s ASP 209 Cb -0.07 -1.25 -0.01 0.00 1.01 0.00 0.00 42.92 42.60 2p8p s ASP 209 CO 0.00 -0.28 0.06 -0.75 0.21 0.00 0.00 175.17 174.41 2p8p s LYS 210 N 1.30 3.44 0.08 8.23 2.47 -0.70 -4.94 119.74 129.62 2p8p s LYS 210 Ca -0.01 -0.62 -0.25 0.00 -1.56 0.00 0.00 55.97 53.53 2p8p s LYS 210 Cb -0.19 -3.29 -0.06 0.00 -1.46 0.00 0.00 37.83 32.83 2p8p s LYS 210 CO -0.09 -0.27 0.78 0.50 0.16 0.00 0.00 175.35 176.43 2p8p s ARG 211 N 1.56 4.53 0.00 4.03 3.52 -1.26 -1.19 118.95 130.14 2p8p s ARG 211 Ca 0.05 1.11 0.07 0.00 -0.13 0.00 0.00 55.73 56.84 2p8p s ARG 211 Cb -0.16 -3.34 -0.02 0.00 -1.56 0.00 0.00 34.95 29.88 2p8p s ARG 211 CO 0.02 0.36 -0.23 0.08 -0.81 0.00 0.00 175.30 174.72 2p8p s VAL 212 N -0.35 1.83 -0.13 7.11 1.01 -0.04 -4.92 120.40 124.90 2p8p s VAL 212 Ca 0.38 -1.08 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 2p8p s VAL 212 Cb -0.21 -1.53 0.12 0.00 0.00 0.00 0.00 36.38 34.75 2p8p s VAL 212 CO 0.24 0.43 0.94 -1.83 0.00 0.00 0.00 175.10 174.88 2p8p s GLU 213 N -0.76 0.69 0.00 2.72 -1.05 -1.26 -4.25 118.70 114.79 2p8p s GLU 213 Ca 0.09 0.12 0.00 0.00 -0.15 0.00 0.00 54.97 55.03 2p8p s GLU 213 Cb -0.09 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.92 2p8p s GLU 213 CO 0.00 -0.22 0.28 -2.30 0.95 0.00 0.00 175.26 173.97