#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yed s VAL 2 N 0.00 5.14 -0.01 0.00 1.01 -1.26 -3.60 120.40 121.68 1yed s VAL 2 Ca 0.00 1.10 0.01 0.00 0.00 0.00 0.00 61.98 63.09 1yed s VAL 2 Cb 0.00 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1yed s VAL 2 CO 0.00 0.29 -0.03 -0.54 0.00 0.00 0.00 175.10 174.82 1yed s LYS 3 N 0.80 0.32 -0.16 2.72 -0.14 0.12 -4.99 119.74 118.41 1yed s LYS 3 Ca 0.29 -0.09 0.00 0.00 -1.36 0.00 0.00 55.97 54.82 1yed s LYS 3 Cb -0.16 -0.35 0.02 0.00 -1.68 0.00 0.00 37.83 35.66 1yed s LYS 3 CO 0.12 0.03 -0.14 -0.51 -0.76 0.00 0.00 175.35 174.09 1yed s LEU 4 N 0.17 1.78 -0.12 3.17 1.02 -1.26 -1.84 118.68 121.59 1yed s LEU 4 Ca -0.01 -0.54 0.01 0.00 0.02 0.00 0.00 54.13 53.60 1yed s LEU 4 Cb -0.04 -1.21 -0.01 0.00 0.02 0.00 0.00 46.19 44.95 1yed s LEU 4 CO -0.00 -0.06 -0.17 -1.10 0.02 0.00 0.00 176.35 175.04 1yed s GLN 5 N 1.46 3.26 0.32 1.70 -0.21 -0.70 -4.14 119.66 121.36 1yed s GLN 5 Ca 0.04 -0.75 0.08 0.00 0.02 0.00 0.00 55.36 54.75 1yed s GLN 5 Cb -0.13 -2.53 -0.03 0.00 1.00 0.00 0.00 33.01 31.32 1yed s GLN 5 CO -0.11 0.18 0.25 -0.65 -2.12 0.00 0.00 175.29 172.84 1yed s GLN 6 N 0.40 2.69 1.13 2.91 -0.21 -1.26 -0.23 119.66 125.09 1yed s GLN 6 Ca -0.13 -1.30 -0.12 0.00 0.02 0.00 0.00 55.36 53.83 1yed s GLN 6 Cb -0.16 -2.44 0.27 0.00 1.00 0.00 0.00 33.01 31.67 1yed s GLN 6 CO 0.06 0.15 1.05 0.45 -2.12 0.00 0.00 175.29 174.88 1yed s SER 7 N -3.94 1.20 0.78 5.90 0.15 -0.90 -4.98 113.70 111.92 1yed s SER 7 Ca 0.39 1.68 -0.08 0.00 0.70 0.00 0.00 55.95 58.64 1yed s SER 7 Cb -0.06 -2.39 0.11 0.00 -1.71 0.00 0.00 66.02 61.98 1yed s SER 7 CO 0.26 -4.09 1.10 -0.83 1.20 0.00 0.00 173.24 170.88 1yed s GLY 8 N -2.48 1.73 -0.15 9.45 0.00 -1.26 -4.66 107.32 109.95 1yed s GLY 8 Ca 0.68 -1.16 -0.30 0.00 0.00 0.00 0.00 44.72 43.94 1yed s GLY 8 CO 0.64 -0.62 2.11 -1.05 0.00 0.00 0.00 173.10 174.18 1yed n PRO 9 N -3.15 2.12 -3.60 2.90 -0.02 -1.26 -4.78 135.00 127.21 1yed n PRO 9 Ca 0.11 0.67 -0.36 0.00 -2.02 0.00 0.00 63.50 61.91 1yed n PRO 9 Cb 0.60 -3.01 -0.06 0.00 -0.02 0.00 0.00 33.50 31.02 1yed n PRO 9 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1yed s GLU 10 N 5.55 3.77 -0.16 -0.52 0.41 -0.67 -4.70 118.70 122.39 1yed s GLU 10 Ca 0.98 0.22 0.00 0.00 -0.41 0.00 0.00 54.97 55.76 1yed s GLU 10 Cb -0.47 -3.13 0.03 0.00 -1.78 0.00 0.00 34.13 28.78 1yed s GLU 10 CO 0.41 0.66 -0.09 -1.17 -0.49 0.00 0.00 175.26 174.57 1yed s LEU 11 N -1.41 1.70 0.07 1.80 0.20 -1.26 -1.12 118.68 118.65 1yed s LEU 11 Ca 0.26 -0.60 0.06 0.00 0.69 0.00 0.00 54.13 54.55 1yed s LEU 11 Cb -0.15 -1.04 -0.03 0.00 -0.43 0.00 0.00 46.19 44.54 1yed s LEU 11 CO 0.14 -0.13 -0.17 0.68 -0.29 0.00 0.00 176.35 176.58 1yed s VAL 12 N 1.56 1.39 0.28 1.68 -7.23 -0.32 -4.97 120.40 112.78 1yed s VAL 12 Ca 0.02 -1.27 -0.27 0.00 -1.81 0.00 0.00 61.98 58.66 1yed s VAL 12 Cb -0.14 -1.26 -0.09 0.00 0.56 0.00 0.00 36.38 35.44 1yed s VAL 12 CO -0.09 -0.03 0.91 -0.13 -0.31 0.00 0.00 175.10 175.45 1yed s ARG 13 N -1.52 4.63 0.76 4.82 1.81 -1.24 -0.26 118.95 127.95 1yed s ARG 13 Ca 0.03 1.32 -0.16 0.00 -1.72 0.00 0.00 55.73 55.20 1yed s ARG 13 Cb -0.09 -2.99 -0.03 0.00 -0.45 0.00 0.00 34.95 31.39 1yed s ARG 13 CO 0.02 0.39 0.48 -2.30 -0.68 0.00 0.00 175.30 173.22 1yed n PRO 14 N 0.94 0.20 0.00 3.54 -0.02 -1.26 -2.59 135.00 135.81 1yed n PRO 14 Ca -0.00 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1yed n PRO 14 Cb 0.49 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1yed n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yed n GLY 15 N 1.66 2.18 0.00 -1.23 0.00 0.66 -4.87 105.19 103.59 1yed n GLY 15 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1yed n GLY 15 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1yed n THR 16 N -1.77 0.00 -3.69 2.61 -2.24 -1.07 -4.14 114.28 103.98 1yed n THR 16 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 1yed n THR 16 Cb 0.00 -0.67 -0.06 0.00 -2.10 0.00 0.00 70.33 67.50 1yed n THR 16 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1yed s SER 17 N -1.00 -0.21 0.08 3.42 0.15 -1.26 -1.92 113.70 112.95 1yed s SER 17 Ca 0.00 -0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.50 1yed s SER 17 Cb 0.00 0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 64.69 1yed s SER 17 CO 0.00 -0.70 -0.06 0.68 1.20 0.00 0.00 173.24 174.36 1yed s VAL 18 N -2.89 0.52 -0.15 4.45 -7.23 -0.98 -5.02 120.40 109.10 1yed s VAL 18 Ca -0.03 -1.77 -0.01 0.00 -1.81 0.00 0.00 61.98 58.36 1yed s VAL 18 Cb 0.00 -1.47 0.04 0.00 0.56 0.00 0.00 36.38 35.51 1yed s VAL 18 CO -0.05 -0.84 -0.03 -0.75 -0.31 0.00 0.00 175.10 173.11 1yed s LYS 19 N -3.53 1.16 0.50 4.82 2.20 -1.26 -1.42 119.74 122.22 1yed s LYS 19 Ca 0.07 -0.37 -0.02 0.00 -0.36 0.00 0.00 55.97 55.29 1yed s LYS 19 Cb 0.04 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.54 1yed s LYS 19 CO -0.06 -0.44 0.76 -0.51 -0.36 0.00 0.00 175.35 174.75 1yed s LEU 20 N 1.74 3.49 0.00 5.43 1.43 0.65 -4.92 118.68 126.49 1yed s LEU 20 Ca 0.01 0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 53.54 1yed s LEU 20 Cb -0.15 -3.32 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 1yed s LEU 20 CO -0.07 -0.84 0.05 -0.94 0.23 0.00 0.00 176.35 174.78 1yed s SER 21 N -4.25 0.09 -0.24 2.29 1.04 -1.26 -2.08 113.70 109.28 1yed s SER 21 Ca 0.50 -0.25 -0.01 0.00 0.48 0.00 0.00 55.95 56.67 1yed s SER 21 Cb -0.10 0.15 0.07 0.00 0.10 0.00 0.00 66.02 66.24 1yed s SER 21 CO 0.41 -0.27 0.03 0.00 0.98 0.00 0.00 173.24 174.40 1yed s LYS 23 N 1.65 3.63 0.40 0.00 2.20 0.68 -0.21 119.74 128.08 1yed s LYS 23 Ca 0.01 -0.31 -0.02 0.00 -0.36 0.00 0.00 55.97 55.30 1yed s LYS 23 Cb -0.18 -3.79 -0.03 0.00 -1.51 0.00 0.00 37.83 32.32 1yed s LYS 23 CO -0.13 -0.52 0.64 0.95 -0.36 0.00 0.00 175.35 175.93 1yed s THR 24 N 2.10 4.96 -0.24 3.43 -4.23 0.52 -1.72 115.64 120.46 1yed s THR 24 Ca 0.13 -0.23 -0.27 0.00 -1.18 0.00 0.00 61.69 60.14 1yed s THR 24 Cb -0.16 -3.84 0.14 0.00 1.34 0.00 0.00 72.50 69.98 1yed s THR 24 CO 0.12 -0.65 1.09 -0.94 -0.54 0.00 0.00 174.62 173.70 1yed s SER 25 N -4.07 -0.35 0.00 3.99 1.04 -0.77 -4.83 113.70 108.71 1yed s SER 25 Ca 0.43 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.42 1yed s SER 25 Cb -0.10 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1yed s SER 25 CO 0.39 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 175.03 1yed n GLY 26 N 1.50 2.92 3.29 7.32 0.00 -1.24 -0.71 105.19 118.28 1yed n GLY 26 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 1yed n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yed s TYR 27 N -2.71 1.48 -0.97 1.61 -0.85 -1.26 -4.44 117.35 110.20 1yed s TYR 27 Ca 0.00 -1.34 -0.20 0.00 -0.52 0.00 0.00 57.07 55.01 1yed s TYR 27 Cb 0.00 -0.78 0.11 0.00 0.38 0.00 0.00 41.96 41.66 1yed s TYR 27 CO 0.00 -0.52 1.25 -1.50 -1.52 0.00 0.00 175.55 173.25 1yed s ILE 28 N -3.78 4.47 0.05 -3.49 2.07 -1.26 -4.94 121.20 114.32 1yed s ILE 28 Ca 0.37 -1.35 -0.10 0.00 -1.41 0.00 0.00 60.65 58.17 1yed s ILE 28 Cb 0.06 -4.88 -0.02 0.00 0.13 0.00 0.00 42.46 37.75 1yed s ILE 28 CO 0.16 -1.66 0.52 0.33 -1.91 0.00 0.00 174.94 172.38 1yed n PHE 29 N 7.30 -0.14 0.63 3.50 7.35 -1.26 -1.06 117.46 133.78 1yed n PHE 29 Ca 0.28 0.40 0.07 0.00 -0.76 0.00 0.00 57.45 57.43 1yed n PHE 29 Cb 0.50 -0.50 0.34 0.00 0.35 0.00 0.00 39.48 40.16 1yed n PHE 29 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1yed n THR 30 N -4.27 0.64 0.45 -2.13 -2.24 -1.26 -3.24 114.28 102.23 1yed n THR 30 Ca 0.01 0.16 0.10 0.00 -2.27 0.00 0.00 64.05 62.05 1yed n THR 30 Cb 0.08 -0.94 0.27 0.00 -2.10 0.00 0.00 70.33 67.64 1yed n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1yed n SER 31 N -1.29 2.90 -3.89 3.42 7.64 -0.22 -2.36 113.62 119.83 1yed n SER 31 Ca 0.06 -1.94 -0.11 0.00 1.01 0.00 0.00 58.87 57.90 1yed n SER 31 Cb 0.11 -0.28 -0.10 0.00 -1.01 0.00 0.00 64.21 62.93 1yed n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1yed s TYR 32 N -1.45 0.07 0.27 1.43 1.51 -1.20 -5.07 117.35 112.91 1yed s TYR 32 Ca 0.37 -0.18 -0.29 0.00 -1.01 0.00 0.00 57.07 55.96 1yed s TYR 32 Cb 0.20 -0.07 -0.09 0.00 -0.11 0.00 0.00 41.96 41.89 1yed s TYR 32 CO 0.28 -0.27 0.96 -1.58 -1.11 0.00 0.00 175.55 173.83 1yed s TRP 33 N -1.38 3.84 -0.18 2.71 0.52 -1.26 -4.22 118.94 118.98 1yed s TRP 33 Ca -0.15 1.85 -0.00 0.00 0.02 0.00 0.00 56.10 57.82 1yed s TRP 33 Cb -0.08 -2.99 0.00 0.00 -1.15 0.00 0.00 33.47 29.25 1yed s TRP 33 CO 0.01 0.27 -0.14 0.42 0.02 0.00 0.00 176.95 177.53 1yed s ILE 34 N -1.33 2.64 -0.02 2.03 1.01 0.22 -4.19 121.20 121.56 1yed s ILE 34 Ca 0.45 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 60.32 1yed s ILE 34 Cb -0.24 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 1yed s ILE 34 CO 0.30 0.50 0.12 -1.00 0.00 0.00 0.00 174.94 174.87 1yed s HIS 35 N 1.08 3.42 -0.09 3.97 3.76 -0.04 -0.99 115.29 126.40 1yed s HIS 35 Ca -0.00 0.30 0.04 0.00 -0.15 0.00 0.00 55.06 55.25 1yed s HIS 35 Cb -0.14 -1.80 -0.01 0.00 1.11 0.00 0.00 32.58 31.74 1yed s HIS 35 CO -0.04 0.61 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.66 1yed s TRP 36 N -1.22 2.58 0.19 1.40 0.52 -0.48 -0.11 118.94 121.82 1yed s TRP 36 Ca 0.23 -0.79 0.10 0.00 0.02 0.00 0.00 56.10 55.67 1yed s TRP 36 Cb -0.12 -1.69 -0.04 0.00 -1.15 0.00 0.00 33.47 30.46 1yed s TRP 36 CO 0.14 -0.26 -0.20 -0.51 0.02 0.00 0.00 176.95 176.14 1yed s LEU 37 N 0.09 2.46 -0.15 2.99 1.02 0.61 -1.72 118.68 123.98 1yed s LEU 37 Ca -0.10 -0.89 0.00 0.00 0.02 0.00 0.00 54.13 53.17 1yed s LEU 37 Cb -0.16 -0.97 -0.00 0.00 0.02 0.00 0.00 46.19 45.08 1yed s LEU 37 CO 0.06 0.02 -0.16 -0.75 0.02 0.00 0.00 176.35 175.54 1yed s LYS 38 N -2.87 3.19 -0.46 1.70 2.20 -0.68 -0.49 119.74 122.34 1yed s LYS 38 Ca 0.19 -0.76 0.03 0.00 -0.36 0.00 0.00 55.97 55.07 1yed s LYS 38 Cb -0.06 -2.61 0.12 0.00 -1.51 0.00 0.00 37.83 33.77 1yed s LYS 38 CO 0.09 0.01 0.20 -1.14 -0.36 0.00 0.00 175.35 174.15 1yed s GLN 39 N 0.82 1.87 0.43 4.03 0.74 0.67 -1.18 119.66 127.05 1yed s GLN 39 Ca -0.05 -2.31 0.08 0.00 0.05 0.00 0.00 55.36 53.13 1yed s GLN 39 Cb -0.15 -3.35 0.01 0.00 1.10 0.00 0.00 33.01 30.62 1yed s GLN 39 CO -0.00 -1.06 0.52 0.45 -0.55 0.00 0.00 175.29 174.65 1yed s SER 40 N 0.37 5.43 0.26 6.67 0.15 -1.26 -2.10 113.70 123.22 1yed s SER 40 Ca 0.14 -0.55 -0.16 0.00 0.70 0.00 0.00 55.95 56.08 1yed s SER 40 Cb -0.23 -0.56 -0.08 0.00 -1.71 0.00 0.00 66.02 63.44 1yed s SER 40 CO -0.03 -0.77 0.70 -0.55 1.20 0.00 0.00 173.24 173.79 1yed s SER 41 N -4.30 6.88 0.00 5.45 0.15 -1.26 -1.62 113.70 118.99 1yed s SER 41 Ca 0.53 1.29 0.00 0.00 0.70 0.00 0.00 55.95 58.47 1yed s SER 41 Cb -0.08 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 1yed s SER 41 CO 0.32 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.29 1yed n GLY 42 N 0.17 1.54 0.23 9.45 0.00 -1.26 -4.23 105.19 111.09 1yed n GLY 42 Ca 0.00 0.10 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 1yed n GLY 42 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1yed h GLN 43 N 0.00 -0.27 -4.50 1.61 4.20 -2.01 -3.48 115.11 110.66 1yed h GLN 43 Ca 0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1yed h GLN 43 Cb 0.00 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 1yed h GLN 43 CO 0.00 -0.18 -1.06 0.41 -0.67 0.00 0.00 178.83 177.33 1yed n GLY 44 N -1.21 -5.31 2.88 3.46 0.00 -0.64 -4.92 105.19 99.45 1yed n GLY 44 Ca -0.03 0.58 -0.02 0.00 0.00 0.00 0.00 46.02 46.55 1yed n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yed n LEU 45 N 1.56 -5.52 -4.19 0.99 4.77 -1.09 -4.87 117.00 108.64 1yed n LEU 45 Ca -0.14 1.44 -0.23 0.00 -0.03 0.00 0.00 56.01 57.05 1yed n LEU 45 Cb 0.22 -2.43 -0.14 0.00 -2.33 0.00 0.00 43.42 38.74 1yed n LEU 45 CO 0.13 -3.13 -0.50 -1.61 -1.33 0.00 0.00 177.39 170.96 1yed s GLU 46 N -0.62 1.21 -0.16 3.23 2.02 -0.32 -4.98 118.70 119.07 1yed s GLU 46 Ca -0.11 -0.81 -0.21 0.00 0.02 0.00 0.00 54.97 53.86 1yed s GLU 46 Cb 0.01 -1.26 -0.03 0.00 0.10 0.00 0.00 34.13 32.95 1yed s GLU 46 CO 0.40 0.32 0.63 -0.46 0.02 0.00 0.00 175.26 176.17 1yed s TRP 47 N -0.75 3.43 -0.17 1.61 -0.00 -1.26 -1.68 118.94 120.12 1yed s TRP 47 Ca 0.05 0.99 -0.14 0.00 -0.00 0.00 0.00 56.10 57.01 1yed s TRP 47 Cb -0.08 -2.77 -0.07 0.00 -0.00 0.00 0.00 33.47 30.55 1yed s TRP 47 CO 0.01 -0.08 -0.18 -0.89 -0.00 0.00 0.00 176.95 175.82 1yed n ILE 48 N 4.38 1.46 -3.84 5.86 5.41 -0.70 -4.69 119.36 127.25 1yed n ILE 48 Ca -0.02 0.12 -0.02 0.00 1.00 0.00 0.00 62.75 63.83 1yed n ILE 48 Cb 0.50 -2.29 0.01 0.00 -0.71 0.00 0.00 39.64 37.15 1yed n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1yed s ALA 49 N -2.70 -1.84 0.06 -1.39 0.00 -1.23 -1.39 121.76 113.26 1yed s ALA 49 Ca -0.22 -0.05 -0.12 0.00 0.00 0.00 0.00 51.96 51.57 1yed s ALA 49 Cb 0.04 0.71 0.01 0.00 0.00 0.00 0.00 23.12 23.88 1yed s ALA 49 CO 0.35 -1.07 0.26 -0.98 0.00 0.00 0.00 175.76 174.31 1yed s ARG 50 N -2.38 0.82 -0.02 0.00 1.70 -0.72 -1.38 118.95 116.97 1yed s ARG 50 Ca 0.20 -0.67 -0.04 0.00 -0.47 0.00 0.00 55.73 54.75 1yed s ARG 50 Cb -0.01 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.72 1yed s ARG 50 CO 0.02 -0.26 0.10 -1.50 -1.08 0.00 0.00 175.30 172.58 1yed s ILE 51 N -3.02 0.03 -0.42 4.99 2.07 -0.16 -2.04 121.20 122.65 1yed s ILE 51 Ca -0.02 -0.27 -0.07 0.00 -1.41 0.00 0.00 60.65 58.88 1yed s ILE 51 Cb 0.01 -0.23 0.10 0.00 0.13 0.00 0.00 42.46 42.46 1yed s ILE 51 CO -0.06 -0.15 0.25 -0.47 -1.91 0.00 0.00 174.94 172.59 1yed s TYR 52 N -0.46 3.43 0.53 3.50 5.04 -0.63 -0.61 117.35 128.15 1yed s TYR 52 Ca -0.05 -1.90 0.26 0.00 -2.44 0.00 0.00 57.07 52.93 1yed s TYR 52 Cb -0.03 -3.11 1.39 0.00 0.35 0.00 0.00 41.96 40.55 1yed s TYR 52 CO 0.00 -0.92 1.98 -1.35 -1.34 0.00 0.00 175.55 173.93 1yed h PRO 52 N 8.29 0.02 0.30 4.97 0.11 -1.81 0.83 132.00 144.70 1yed h PRO 52 Ca -0.19 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 1yed h PRO 52 Cb 1.07 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1yed h PRO 52 CO 0.75 0.01 -0.14 0.78 -0.21 0.00 0.00 178.00 179.19 1yed h GLY 53 N 0.02 -0.42 -0.13 -0.55 0.00 -1.76 -3.31 103.07 96.92 1yed h GLY 53 Ca 0.27 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1yed h GLY 53 CO -0.01 -0.15 -0.91 -1.30 0.00 0.00 0.00 176.54 174.17 1yed n THR 54 N -5.21 0.00 -1.06 4.70 -2.24 -1.09 -4.97 114.28 104.41 1yed n THR 54 Ca -0.10 -0.05 -0.02 0.00 -2.27 0.00 0.00 64.05 61.61 1yed n THR 54 Cb 0.22 1.03 -0.01 0.00 -2.10 0.00 0.00 70.33 69.47 1yed n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yed n GLY 55 N 1.48 0.50 3.72 3.38 0.00 0.29 -4.99 105.19 109.56 1yed n GLY 55 Ca 0.05 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1yed n GLY 55 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yed s GLY 56 N -2.25 2.83 0.47 -0.02 0.00 -1.17 -4.83 107.32 102.35 1yed s GLY 56 Ca 0.00 0.41 0.06 0.00 0.00 0.00 0.00 44.72 45.19 1yed s GLY 56 CO 0.00 1.48 0.28 -0.51 0.00 0.00 0.00 173.10 174.35 1yed s THR 57 N 0.80 2.04 -0.15 0.90 -4.23 -1.26 -1.61 115.64 112.14 1yed s THR 57 Ca 0.47 -1.59 -0.09 0.00 -1.18 0.00 0.00 61.69 59.29 1yed s THR 57 Cb -0.20 -2.63 0.05 0.00 1.34 0.00 0.00 72.50 71.06 1yed s THR 57 CO 0.25 0.00 0.38 -0.31 -0.54 0.00 0.00 174.62 174.40 1yed s TYR 58 N -2.66 -0.53 -0.03 3.99 1.51 -0.87 -5.00 117.35 113.77 1yed s TYR 58 Ca 0.37 1.16 0.06 0.00 -1.01 0.00 0.00 57.07 57.64 1yed s TYR 58 Cb 0.00 0.21 -0.01 0.00 -0.11 0.00 0.00 41.96 42.05 1yed s TYR 58 CO 0.21 -0.30 -0.20 0.71 -1.11 0.00 0.00 175.55 174.86 1yed s TYR 59 N 1.19 1.93 0.11 2.71 1.51 -1.26 -1.76 117.35 121.78 1yed s TYR 59 Ca -0.08 -0.48 -0.31 0.00 -1.01 0.00 0.00 57.07 55.19 1yed s TYR 59 Cb -0.08 -1.26 -0.08 0.00 -0.11 0.00 0.00 41.96 40.42 1yed s TYR 59 CO -0.10 -0.12 1.47 1.21 -1.11 0.00 0.00 175.55 176.90 1yed s ASN 60 N -0.23 6.74 0.45 2.29 3.84 -0.49 -4.86 114.94 122.68 1yed s ASN 60 Ca 0.01 2.40 0.27 0.00 0.21 0.00 0.00 52.86 55.76 1yed s ASN 60 Cb -0.10 -2.58 1.31 0.00 -0.55 0.00 0.00 41.25 39.32 1yed s ASN 60 CO 0.01 -0.73 1.74 1.05 -2.79 0.00 0.00 177.10 176.38 1yed h GLU 61 N 7.04 0.21 0.00 0.43 4.11 -1.94 -0.75 114.58 123.67 1yed h GLU 61 Ca -0.42 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 58.98 1yed h GLU 61 Cb 1.20 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1yed h GLU 61 CO 0.89 0.14 -0.10 -0.22 0.07 0.00 0.00 179.01 179.79 1yed h LYS 62 N 0.21 0.00 -0.18 1.06 3.64 -1.94 -2.87 116.57 116.49 1yed h LYS 62 Ca 0.64 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.02 1yed h LYS 62 Cb 2.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1yed h LYS 62 CO -0.23 0.10 0.00 1.19 -2.27 0.00 0.00 179.45 178.23 1yed n PHE 63 N -3.46 0.35 -2.17 1.91 3.01 -0.30 -4.97 117.46 111.83 1yed n PHE 63 Ca -0.01 -0.64 -0.43 0.00 1.01 0.00 0.00 57.45 57.38 1yed n PHE 63 Cb 0.25 -0.10 -0.02 0.00 -0.01 0.00 0.00 39.48 39.59 1yed n PHE 63 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1yed s LYS 64 N -1.58 3.69 0.00 -1.08 2.20 -1.08 -1.96 119.74 119.91 1yed s LYS 64 Ca 0.21 1.44 0.00 0.00 -0.36 0.00 0.00 55.97 57.26 1yed s LYS 64 Cb 0.15 -4.04 0.00 0.00 -1.51 0.00 0.00 37.83 32.42 1yed s LYS 64 CO 0.08 -1.42 0.00 0.41 -0.36 0.00 0.00 175.35 174.06 1yed n GLY 65 N 4.83 0.58 0.72 5.54 0.00 -1.26 -4.91 105.19 110.68 1yed n GLY 65 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 1yed n GLY 65 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1yed n LYS 66 N -1.51 0.19 -4.04 1.61 3.00 -0.83 -5.00 118.16 111.57 1yed n LYS 66 Ca 0.00 0.08 -0.30 0.00 -0.00 0.00 0.00 58.31 58.09 1yed n LYS 66 Cb 0.00 -0.82 -0.06 0.00 0.00 0.00 0.00 35.03 34.15 1yed n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1yed s ALA 67 N -2.17 3.60 -0.06 3.14 0.00 -0.98 -4.01 121.76 121.28 1yed s ALA 67 Ca -0.13 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 50.80 1yed s ALA 67 Cb 0.05 -1.46 0.04 0.00 0.00 0.00 0.00 23.12 21.74 1yed s ALA 67 CO 0.16 0.75 0.13 0.99 0.00 0.00 0.00 175.76 177.79 1yed s THR 68 N -1.41 -0.08 0.10 0.00 2.01 -0.71 -4.85 115.64 110.70 1yed s THR 68 Ca 0.30 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.55 1yed s THR 68 Cb -0.12 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 1yed s THR 68 CO 0.23 0.09 0.09 -0.76 -0.69 0.00 0.00 174.62 173.58 1yed s LEU 69 N 1.35 3.80 0.30 4.42 1.43 -1.26 -1.11 118.68 127.60 1yed s LEU 69 Ca -0.07 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 52.87 1yed s LEU 69 Cb -0.12 -2.46 0.01 0.00 0.03 0.00 0.00 46.19 43.65 1yed s LEU 69 CO -0.05 0.14 0.55 0.42 0.23 0.00 0.00 176.35 177.63 1yed s THR 70 N -1.49 0.00 -0.03 5.49 -4.23 -0.82 -5.00 115.64 109.56 1yed s THR 70 Ca 0.30 -1.36 -0.20 0.00 -1.18 0.00 0.00 61.69 59.24 1yed s THR 70 Cb -0.12 -2.42 0.04 0.00 1.34 0.00 0.00 72.50 71.34 1yed s THR 70 CO 0.22 0.00 0.43 0.00 -0.54 0.00 0.00 174.62 174.73 1yed s ALA 71 N -3.46 -1.11 -0.30 3.99 0.00 -1.26 -1.52 121.76 118.10 1yed s ALA 71 Ca 0.23 0.66 0.03 0.00 0.00 0.00 0.00 51.96 52.87 1yed s ALA 71 Cb -0.02 0.04 0.08 0.00 0.00 0.00 0.00 23.12 23.22 1yed s ALA 71 CO 0.12 -0.30 -0.03 0.34 0.00 0.00 0.00 175.76 175.89 1yed s ASP 72 N -1.27 4.62 0.15 0.00 -1.08 0.96 -4.98 116.67 115.06 1yed s ASP 72 Ca -0.13 -1.70 -0.17 0.00 -0.52 0.00 0.00 52.55 50.04 1yed s ASP 72 Cb -0.04 -1.60 0.04 0.00 -1.46 0.00 0.00 42.92 39.87 1yed s ASP 72 CO 0.06 -0.28 1.76 0.11 0.52 0.00 0.00 175.17 177.34 1yed h LYS 73 N 7.73 0.29 -0.55 4.34 1.57 -1.93 0.32 116.57 128.34 1yed h LYS 73 Ca -0.13 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1yed h LYS 73 Cb 1.03 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.23 1yed h LYS 73 CO 0.49 0.19 0.27 0.77 -0.57 0.00 0.00 179.45 180.60 1yed h SER 74 N 0.30 0.37 0.56 0.86 0.02 -1.97 -2.88 113.55 110.81 1yed h SER 74 Ca 0.15 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1yed h SER 74 Cb 0.10 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1yed h SER 74 CO -0.14 0.25 -0.86 -1.54 -1.14 0.00 0.00 176.83 173.40 1yed n SER 75 N -4.89 0.63 -3.09 3.07 3.41 -1.15 -4.98 113.62 106.63 1yed n SER 75 Ca 0.06 -0.13 -0.17 0.00 -0.26 0.00 0.00 58.87 58.37 1yed n SER 75 Cb 0.16 0.56 0.07 0.00 -0.26 0.00 0.00 64.21 64.75 1yed n SER 75 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1yed n SER 76 N -1.96 -3.79 -4.08 4.04 7.64 0.11 -4.71 113.62 110.87 1yed n SER 76 Ca 0.03 -0.49 -0.28 0.00 1.01 0.00 0.00 58.87 59.14 1yed n SER 76 Cb 0.43 -4.38 -0.17 0.00 -1.01 0.00 0.00 64.21 59.08 1yed n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1yed s THR 77 N -3.29 1.48 -0.02 0.44 2.01 -0.94 -0.35 115.64 114.97 1yed s THR 77 Ca 0.24 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.56 1yed s THR 77 Cb -0.10 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 1yed s THR 77 CO 0.62 0.43 0.11 0.00 -0.69 0.00 0.00 174.62 175.10 1yed s ALA 78 N 0.74 3.71 0.16 7.40 0.00 0.70 -0.03 121.76 134.45 1yed s ALA 78 Ca -0.12 -0.81 0.09 0.00 0.00 0.00 0.00 51.96 51.12 1yed s ALA 78 Cb -0.16 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 1yed s ALA 78 CO 0.02 0.70 -0.21 0.71 0.00 0.00 0.00 175.76 176.98 1yed s TYR 79 N -1.20 1.98 -0.03 0.00 1.51 -0.58 0.16 117.35 119.19 1yed s TYR 79 Ca 0.23 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.88 1yed s TYR 79 Cb -0.12 -1.01 0.02 0.00 -0.11 0.00 0.00 41.96 40.74 1yed s TYR 79 CO 0.14 0.35 -0.04 1.41 -1.11 0.00 0.00 175.55 176.30 1yed s MET 80 N -2.53 0.63 -0.09 -0.62 1.75 -0.89 -1.94 119.30 115.61 1yed s MET 80 Ca 0.15 -0.09 0.03 0.00 -1.25 0.00 0.00 55.69 54.52 1yed s MET 80 Cb -0.07 -0.66 -0.01 0.00 2.84 0.00 0.00 34.83 36.92 1yed s MET 80 CO 0.07 -0.04 -0.19 -1.14 -0.65 0.00 0.00 175.02 173.07 1yed s GLN 81 N 0.66 2.99 0.37 4.11 0.74 -0.27 -0.25 119.66 128.00 1yed s GLN 81 Ca -0.08 -0.79 0.08 0.00 0.05 0.00 0.00 55.36 54.62 1yed s GLN 81 Cb -0.11 -2.40 -0.04 0.00 1.10 0.00 0.00 33.01 31.55 1yed s GLN 81 CO -0.00 0.30 0.18 -0.51 -0.55 0.00 0.00 175.29 174.70 1yed s LEU 82 N 0.08 3.22 0.00 3.68 1.43 -0.50 -1.74 118.68 124.85 1yed s LEU 82 Ca -0.08 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.14 1yed s LEU 82 Cb -0.15 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1yed s LEU 82 CO 0.05 -0.41 0.00 -1.20 0.23 0.00 0.00 176.35 175.02 1yed n SER 82 N -1.22 0.00 -4.76 2.29 7.64 -0.81 -2.32 113.62 114.45 1yed n SER 82 Ca -0.02 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.49 1yed n SER 82 Cb 0.62 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.85 1yed n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1yed s LEU 82 N -0.18 3.82 0.21 -3.43 1.43 -1.02 -4.65 118.68 114.86 1yed s LEU 82 Ca 0.00 2.46 -0.00 0.00 -1.03 0.00 0.00 54.13 55.56 1yed s LEU 82 Cb 0.00 -4.41 -0.04 0.00 0.03 0.00 0.00 46.19 41.77 1yed s LEU 82 CO 0.00 -1.39 0.13 -0.54 0.23 0.00 0.00 176.35 174.79 1yed s LYS 83 N -3.04 1.25 0.40 1.70 1.02 -1.26 -0.24 119.74 119.57 1yed s LYS 83 Ca 0.72 -1.66 0.12 0.00 0.02 0.00 0.00 55.97 55.17 1yed s LYS 83 Cb -0.32 0.23 0.95 0.00 -0.52 0.00 0.00 37.83 38.16 1yed s LYS 83 CO 0.37 -0.40 1.93 0.77 -0.92 0.00 0.00 175.35 177.10 1yed h SER 84 N 2.57 0.49 0.29 2.83 0.02 -1.97 0.24 113.55 118.01 1yed h SER 84 Ca -0.36 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1yed h SER 84 Cb 1.25 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1yed h SER 84 CO 0.53 0.27 0.00 -0.33 -1.14 0.00 0.00 176.83 176.16 1yed h GLU 85 N 0.53 0.00 -0.00 3.45 3.07 -1.95 -2.45 114.58 117.22 1yed h GLU 85 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1yed h GLU 85 Cb 0.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 1yed h GLU 85 CO -0.12 0.00 -0.28 -0.25 -1.40 0.00 0.00 179.01 176.96 1yed n ASP 86 N -2.70 0.66 -4.64 1.42 8.00 0.83 -4.87 116.55 115.24 1yed n ASP 86 Ca -0.01 -0.51 -0.43 0.00 0.71 0.00 0.00 54.79 54.55 1yed n ASP 86 Cb 0.13 0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.27 1yed n ASP 86 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1yed s SER 87 N -2.69 6.66 0.01 -2.24 0.01 -0.93 -4.89 113.70 109.65 1yed s SER 87 Ca 0.20 1.64 -0.11 0.00 1.31 0.00 0.00 55.95 58.99 1yed s SER 87 Cb 0.19 -2.54 0.04 0.00 0.21 0.00 0.00 66.02 63.92 1yed s SER 87 CO 0.56 -1.01 0.52 0.00 0.41 0.00 0.00 173.24 173.72 1yed n ALA 88 N 7.49 -1.44 -2.96 1.44 0.00 -0.88 -4.77 120.51 119.38 1yed n ALA 88 Ca 0.16 -0.37 -0.35 0.00 0.00 0.00 0.00 53.44 52.88 1yed n ALA 88 Cb 0.45 0.11 -0.12 0.00 0.00 0.00 0.00 19.45 19.90 1yed n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yed s VAL 89 N -2.16 4.35 -0.10 0.00 1.01 -0.89 -1.14 120.40 121.45 1yed s VAL 89 Ca 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 61.98 61.90 1yed s VAL 89 Cb -0.01 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1yed s VAL 89 CO 0.00 0.41 0.01 -0.31 0.00 0.00 0.00 175.10 175.22 1yed s TYR 90 N 0.93 3.18 0.30 5.22 1.51 -0.84 -0.24 117.35 127.41 1yed s TYR 90 Ca 0.03 0.15 0.11 0.00 -1.01 0.00 0.00 57.07 56.35 1yed s TYR 90 Cb -0.14 -1.84 -0.05 0.00 -0.11 0.00 0.00 41.96 39.82 1yed s TYR 90 CO 0.02 0.40 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.67 1yed s PHE 91 N -0.64 2.39 -0.00 2.71 0.08 0.36 -1.72 117.98 121.15 1yed s PHE 91 Ca 0.11 -0.36 0.02 0.00 0.12 0.00 0.00 56.93 56.81 1yed s PHE 91 Cb -0.12 -1.14 -0.01 0.00 -0.57 0.00 0.00 43.02 41.18 1yed s PHE 91 CO 0.02 0.66 -0.05 0.00 -0.10 0.00 0.00 175.22 175.75 1yed s THR 93 N -0.20 0.06 -1.14 0.00 -1.32 0.84 -0.74 115.64 113.13 1yed s THR 93 Ca 0.01 -0.51 -0.09 0.00 -1.21 0.00 0.00 61.69 59.90 1yed s THR 93 Cb -0.02 -0.67 0.26 0.00 -1.51 0.00 0.00 72.50 70.55 1yed s THR 93 CO -0.00 -0.28 1.34 -1.14 -2.21 0.00 0.00 174.62 172.33 1yed n ARG 94 N 1.15 3.75 -0.32 7.08 0.63 0.40 -0.86 116.66 128.49 1yed n ARG 94 Ca -0.21 -4.29 0.18 0.00 -0.92 0.00 0.00 57.85 52.61 1yed n ARG 94 Cb 0.57 -2.66 0.36 0.00 0.45 0.00 0.00 32.46 31.17 1yed n ARG 94 CO 0.00 0.00 0.00 2.35 -2.51 0.00 0.00 177.63 177.47 1yed h TRP 95 N 6.35 0.41 0.00 -0.14 -0.00 -1.81 -2.81 115.95 117.95 1yed h TRP 95 Ca 0.23 0.05 0.00 0.00 -0.00 0.00 0.00 58.89 59.17 1yed h TRP 95 Cb 0.78 -0.03 0.00 0.00 -0.00 0.00 0.00 29.16 29.92 1yed h TRP 95 CO 0.93 -0.29 0.00 0.41 -0.00 0.00 0.00 178.44 179.48 1yed n GLY 96 N -1.37 0.65 3.77 2.65 0.00 -1.25 -3.86 105.19 105.77 1yed n GLY 96 Ca 0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 1yed n GLY 96 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1yed s PHE 97 N -2.50 3.59 0.00 1.61 5.36 -1.26 0.15 117.98 124.92 1yed s PHE 97 Ca 0.00 1.74 0.00 0.00 -0.96 0.00 0.00 56.93 57.71 1yed s PHE 97 Cb 0.00 -3.09 0.00 0.00 -0.34 0.00 0.00 43.02 39.59 1yed s PHE 97 CO 0.00 -0.20 0.00 0.25 -1.46 0.00 0.00 175.22 173.81 1yed n THR 98 N 0.72 0.00 -4.13 0.12 -2.24 -1.26 -4.86 114.28 102.63 1yed n THR 98 Ca 0.01 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.70 1yed n THR 98 Cb 0.48 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.61 1yed n THR 98 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1yed s THR 99 N 0.69 0.20 0.58 4.28 -4.23 -1.26 -4.99 115.64 110.92 1yed s THR 99 Ca 0.00 -1.87 0.28 0.00 -1.18 0.00 0.00 61.69 58.92 1yed s THR 99 Cb 0.00 -1.82 0.37 0.00 1.34 0.00 0.00 72.50 72.40 1yed s THR 99 CO 0.00 -0.70 1.97 0.58 -0.54 0.00 0.00 174.62 175.93 1yed h VAL 100 N 2.98 0.43 0.10 2.29 2.07 -1.99 0.25 116.25 122.37 1yed h VAL 100 Ca -0.35 0.00 -0.31 0.00 0.82 0.00 0.00 66.70 66.86 1yed h VAL 100 Cb 1.17 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1yed h VAL 100 CO 0.62 0.00 -1.65 0.03 0.02 0.00 0.00 177.57 176.59 1yed h ARG 100 N 0.00 0.21 -0.35 1.57 3.08 -2.06 -3.35 114.38 113.48 1yed h ARG 100 Ca 0.17 -0.35 -0.17 0.00 0.07 0.00 0.00 59.98 59.70 1yed h ARG 100 Cb 0.92 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.10 1yed h ARG 100 CO -0.00 1.17 -0.45 1.49 -1.07 0.00 0.00 179.97 181.11 1yed h GLU 100 N -0.28 0.91 -5.68 0.04 4.81 -1.83 -3.54 114.58 109.01 1yed h GLU 100 Ca -0.37 -0.51 0.00 0.00 -0.13 0.00 0.00 59.36 58.35 1yed h GLU 100 Cb 1.79 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 31.21 1yed h GLU 100 CO 0.02 1.16 -0.99 0.09 -0.73 0.00 0.00 179.01 178.55 1yed n ASN 100 N -4.04 -7.14 -3.15 1.04 3.02 0.82 -4.94 115.26 100.87 1yed n ASN 100 Ca -0.03 0.99 0.05 0.00 -0.03 0.00 0.00 54.58 55.56 1yed n ASN 100 Cb 0.58 -3.66 -0.01 0.00 -0.61 0.00 0.00 39.78 36.08 1yed n ASN 100 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1yed s TYR 100 N -1.29 -0.86 0.30 3.10 2.02 -1.26 -5.01 117.35 114.35 1yed s TYR 100 Ca -0.01 0.78 -0.27 0.00 -0.37 0.00 0.00 57.07 57.19 1yed s TYR 100 Cb 0.00 0.25 -0.10 0.00 -0.40 0.00 0.00 41.96 41.72 1yed s TYR 100 CO 0.44 -0.48 0.95 0.00 -1.57 0.00 0.00 175.55 174.88 1yed s ALA 100 N 2.92 3.25 0.01 3.71 0.00 0.12 -4.96 121.76 126.82 1yed s ALA 100 Ca 0.10 0.56 -0.36 0.00 0.00 0.00 0.00 51.96 52.26 1yed s ALA 100 Cb -0.09 -3.20 -0.15 0.00 0.00 0.00 0.00 23.12 19.68 1yed s ALA 100 CO -0.17 0.18 1.59 -0.12 0.00 0.00 0.00 175.76 177.24 1yed n MET 100 N 0.87 1.66 -2.48 0.00 1.56 -1.26 -3.97 117.12 113.50 1yed n MET 100 Ca 0.01 0.60 -0.37 0.00 -0.27 0.00 0.00 57.70 57.67 1yed n MET 100 Cb 0.49 -2.33 -0.03 0.00 2.15 0.00 0.00 33.22 33.50 1yed n MET 100 CO 0.00 0.00 0.00 0.16 -0.73 0.00 0.00 175.97 175.40 1yed s ASP 101 N 1.84 6.65 -0.03 6.12 -4.77 -1.25 -4.71 116.67 120.52 1yed s ASP 101 Ca 0.87 2.11 0.01 0.00 -3.30 0.00 0.00 52.55 52.24 1yed s ASP 101 Cb -0.84 -2.59 0.02 0.00 -1.09 0.00 0.00 42.92 38.42 1yed s ASP 101 CO 0.48 -0.57 -0.05 -0.31 0.70 0.00 0.00 175.17 175.42 1yed s TYR 102 N -1.62 0.74 0.09 2.11 2.02 -1.06 -4.97 117.35 114.66 1yed s TYR 102 Ca 0.58 -0.19 0.08 0.00 -0.37 0.00 0.00 57.07 57.17 1yed s TYR 102 Cb -0.24 -0.61 -0.04 0.00 -0.40 0.00 0.00 41.96 40.67 1yed s TYR 102 CO 0.30 -0.15 -0.16 -1.58 -1.57 0.00 0.00 175.55 172.39 1yed s TRP 103 N 0.64 2.60 0.75 2.71 0.52 -1.26 -0.46 118.94 124.45 1yed s TRP 103 Ca -0.09 -0.23 -0.11 0.00 0.02 0.00 0.00 56.10 55.70 1yed s TRP 103 Cb -0.12 -1.41 0.05 0.00 -1.15 0.00 0.00 33.47 30.84 1yed s TRP 103 CO 0.00 0.35 1.12 0.20 0.02 0.00 0.00 176.95 178.64 1yed s GLY 104 N -1.91 1.61 0.27 0.98 0.00 0.08 -4.62 107.32 103.73 1yed s GLY 104 Ca 0.18 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.32 1yed s GLY 104 CO 0.09 -0.17 1.68 0.06 0.00 0.00 0.00 173.10 174.77 1yed h GLN 105 N -0.82 0.46 0.00 2.90 -0.00 -1.90 -3.43 115.11 112.32 1yed h GLN 105 Ca -0.45 -0.20 0.00 0.00 -0.00 0.00 0.00 58.65 58.00 1yed h GLN 105 Cb 1.30 -0.02 0.00 0.00 -0.00 0.00 0.00 27.48 28.77 1yed h GLN 105 CO 0.64 0.73 0.00 0.41 -0.00 0.00 0.00 178.83 180.62 1yed n GLY 106 N -0.24 3.22 2.66 0.06 0.00 -1.26 -5.04 105.19 104.59 1yed n GLY 106 Ca -0.01 -1.92 -0.25 0.00 0.00 0.00 0.00 46.02 43.85 1yed n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yed s THR 107 N -2.76 0.04 -0.01 2.61 2.01 -0.70 -4.82 115.64 112.01 1yed s THR 107 Ca 0.00 -0.05 -0.30 0.00 0.31 0.00 0.00 61.69 61.65 1yed s THR 107 Cb 0.00 -0.53 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 1yed s THR 107 CO 0.00 -0.11 1.26 -0.76 -0.69 0.00 0.00 174.62 174.32 1yed s LEU 108 N 2.09 4.31 -0.18 4.42 1.43 -1.26 -1.98 118.68 127.51 1yed s LEU 108 Ca 0.03 1.96 0.01 0.00 -1.03 0.00 0.00 54.13 55.09 1yed s LEU 108 Cb -0.15 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.54 1yed s LEU 108 CO -0.07 -0.60 -0.15 -0.69 0.23 0.00 0.00 176.35 175.06 1yed s VAL 109 N 2.02 1.83 -0.35 -1.59 1.01 -0.30 -1.67 120.40 121.35 1yed s VAL 109 Ca 0.59 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 1yed s VAL 109 Cb -0.28 -1.74 0.07 0.00 0.00 0.00 0.00 36.38 34.43 1yed s VAL 109 CO 0.25 0.39 0.10 -0.89 0.00 0.00 0.00 175.10 174.95 1yed s THR 110 N 1.36 3.30 -0.50 3.92 2.01 -0.28 -2.08 115.64 123.37 1yed s THR 110 Ca 0.03 -1.55 -0.27 0.00 0.31 0.00 0.00 61.69 60.20 1yed s THR 110 Cb -0.14 -3.02 0.03 0.00 0.01 0.00 0.00 72.50 69.38 1yed s THR 110 CO -0.11 -0.33 1.05 -0.69 -0.69 0.00 0.00 174.62 173.85 1yed s VAL 111 N 1.25 4.28 0.16 3.82 1.01 -1.26 -1.17 120.40 128.50 1yed s VAL 111 Ca 0.00 0.86 -0.20 0.00 0.00 0.00 0.00 61.98 62.64 1yed s VAL 111 Cb -0.21 -4.56 0.05 0.00 0.00 0.00 0.00 36.38 31.66 1yed s VAL 111 CO -0.01 -1.03 0.52 -0.55 0.00 0.00 0.00 175.10 174.02 1yed s SER 112 N 2.55 -0.39 -0.03 3.32 0.15 0.64 -4.62 113.70 115.32 1yed s SER 112 Ca 0.41 -0.21 0.14 0.00 0.70 0.00 0.00 55.95 56.98 1yed s SER 112 Cb -0.09 0.56 -0.21 0.00 -1.71 0.00 0.00 66.02 64.57 1yed s SER 112 CO 0.27 -0.95 0.28 -1.54 1.20 0.00 0.00 173.24 172.50 1yed n SER 113 N -0.32 1.84 -4.54 5.45 3.41 -1.26 -3.70 113.62 114.50 1yed n SER 113 Ca -0.15 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.08 1yed n SER 113 Cb 0.64 1.57 0.04 0.00 -0.26 0.00 0.00 64.21 66.20 1yed n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yed n ALA 116 N -2.02 -0.47 -1.78 7.33 0.00 -1.26 -4.94 120.51 117.37 1yed n ALA 116 Ca -0.04 0.02 -0.36 0.00 0.00 0.00 0.00 53.44 53.06 1yed n ALA 116 Cb 0.40 -1.97 -0.03 0.00 0.00 0.00 0.00 19.45 17.85 1yed n ALA 116 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1yed s LYS 117 N -2.35 3.97 0.29 0.00 2.20 -1.26 -5.02 119.74 117.57 1yed s LYS 117 Ca 0.71 1.55 -0.29 0.00 -0.36 0.00 0.00 55.97 57.59 1yed s LYS 117 Cb -0.45 -2.41 -0.09 0.00 -1.51 0.00 0.00 37.83 33.37 1yed s LYS 117 CO 0.51 -0.32 1.05 0.99 -0.36 0.00 0.00 175.35 177.22 1yed s THR 118 N -1.69 3.69 -0.07 3.43 2.01 -1.26 -4.85 115.64 116.90 1yed s THR 118 Ca 0.61 1.64 -0.01 0.00 0.31 0.00 0.00 61.69 64.25 1yed s THR 118 Cb -0.23 -4.02 0.03 0.00 0.01 0.00 0.00 72.50 68.29 1yed s THR 118 CO 0.28 0.34 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.65 1yed s THR 119 N -1.24 0.46 0.57 -0.82 2.01 -0.07 -4.97 115.64 111.58 1yed s THR 119 Ca 0.45 0.03 -0.18 0.00 0.31 0.00 0.00 61.69 62.31 1yed s THR 119 Cb -0.29 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.61 1yed s THR 119 CO 0.37 0.26 1.10 -2.84 -0.69 0.00 0.00 174.62 172.81 1yed s PRO 120 N 1.65 3.27 0.78 4.92 0.02 -1.26 -1.71 135.00 142.67 1yed s PRO 120 Ca 0.00 1.44 -0.12 0.00 0.02 0.00 0.00 61.00 62.34 1yed s PRO 120 Cb -0.13 -2.01 0.06 0.00 0.02 0.00 0.00 34.50 32.44 1yed s PRO 120 CO -0.04 -0.88 1.12 -1.25 -0.33 0.00 0.00 177.00 175.62 1yed s PRO 121 N -3.64 2.26 -0.23 5.54 0.04 -1.26 -4.56 135.00 133.14 1yed s PRO 121 Ca 0.69 0.44 -0.02 0.00 0.04 0.00 0.00 61.00 62.15 1yed s PRO 121 Cb -0.20 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.40 1yed s PRO 121 CO 0.31 -1.46 -0.08 -1.12 0.04 0.00 0.00 177.00 174.69 1yed s SER 122 N -4.21 4.10 -0.14 6.66 0.01 -0.00 -4.93 113.70 115.19 1yed s SER 122 Ca 0.60 -0.74 -0.13 0.00 1.31 0.00 0.00 55.95 56.99 1yed s SER 122 Cb -0.13 -1.64 -0.05 0.00 0.21 0.00 0.00 66.02 64.41 1yed s SER 122 CO 0.52 -0.08 0.29 -0.69 0.41 0.00 0.00 173.24 173.69 1yed s VAL 123 N 1.35 5.29 -0.10 3.43 1.01 -1.26 -0.25 120.40 129.87 1yed s VAL 123 Ca 0.02 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.57 1yed s VAL 123 Cb -0.16 -3.63 0.02 0.00 0.00 0.00 0.00 36.38 32.62 1yed s VAL 123 CO -0.06 0.42 -0.12 -0.31 0.00 0.00 0.00 175.10 175.04 1yed s TYR 124 N 0.21 1.71 -0.36 5.22 2.02 -0.73 -4.99 117.35 120.44 1yed s TYR 124 Ca 0.17 -0.80 -0.27 0.00 -0.37 0.00 0.00 57.07 55.80 1yed s TYR 124 Cb -0.13 -1.29 0.01 0.00 -0.40 0.00 0.00 41.96 40.15 1yed s TYR 124 CO 0.05 -0.46 0.96 -1.25 -1.57 0.00 0.00 175.55 173.28 1yed s PRO 125 N 1.19 3.90 -0.39 -1.71 0.04 -1.26 -1.55 135.00 135.22 1yed s PRO 125 Ca -0.04 0.70 -0.15 0.00 0.04 0.00 0.00 61.00 61.56 1yed s PRO 125 Cb -0.14 -3.78 0.01 0.00 0.04 0.00 0.00 34.50 30.62 1yed s PRO 125 CO -0.03 -0.93 0.31 -0.51 0.04 0.00 0.00 177.00 175.88 1yed s LEU 126 N 3.52 4.90 0.14 -3.56 1.43 -1.10 -4.90 118.68 119.10 1yed s LEU 126 Ca 0.40 -0.72 0.06 0.00 -1.03 0.00 0.00 54.13 52.84 1yed s LEU 126 Cb -0.12 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 1yed s LEU 126 CO 0.18 -0.42 0.02 0.00 0.23 0.00 0.00 176.35 176.36 1yed s ALA 127 N 1.78 3.29 1.00 4.21 0.00 -1.26 -3.06 121.76 127.73 1yed s ALA 127 Ca 0.07 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.78 1yed s ALA 127 Cb -0.18 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.81 1yed s ALA 127 CO 0.11 0.57 0.00 -0.35 0.00 0.00 0.00 175.76 176.09 1yed n PRO 128 N 0.12 1.48 -1.70 0.00 -0.04 -1.26 -4.98 135.00 128.62 1yed n PRO 128 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1yed n PRO 128 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 1yed n PRO 128 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yed n GLY 129 N 3.40 -0.58 7.00 0.55 0.00 -1.26 -4.59 105.19 109.72 1yed n GLY 129 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1yed n GLY 129 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yed n SER 130 N 0.00 0.00 -1.41 1.61 7.64 -1.26 -1.80 113.62 118.40 1yed n SER 130 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1yed n SER 130 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1yed n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yed n ALA 131 N 11.17 3.72 -0.75 -0.43 0.00 -1.26 -4.88 120.51 128.08 1yed n ALA 131 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1yed n ALA 131 Cb 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1yed n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yed n ALA 132 N 1.10 -1.54 -2.57 0.00 0.00 -0.74 -5.04 120.51 111.72 1yed n ALA 132 Ca 0.03 0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.47 1yed n ALA 132 Cb 0.52 -0.94 -0.14 0.00 0.00 0.00 0.00 19.45 18.89 1yed n ALA 132 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1yed s GLN 133 N -4.84 1.14 -0.28 0.00 0.74 -1.24 -4.89 119.66 110.29 1yed s GLN 133 Ca 0.00 -0.71 -0.08 0.00 0.05 0.00 0.00 55.36 54.62 1yed s GLN 133 Cb 0.00 -1.15 0.01 0.00 1.10 0.00 0.00 33.01 32.97 1yed s GLN 133 CO 0.00 0.30 0.31 2.41 -0.55 0.00 0.00 175.29 177.76 1yed n THR 134 N 2.22 -8.53 -3.23 -0.34 -1.04 -1.26 -4.69 114.28 97.41 1yed n THR 134 Ca -0.16 0.80 -0.46 0.00 -2.04 0.00 0.00 64.05 62.19 1yed n THR 134 Cb 0.54 -6.25 -0.04 0.00 -1.82 0.00 0.00 70.33 62.76 1yed n THR 134 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1yed s ASN 135 N -1.87 6.25 0.00 8.00 4.22 -1.26 -3.64 114.94 126.63 1yed s ASN 135 Ca 0.13 -1.74 0.00 0.00 -2.14 0.00 0.00 52.86 49.11 1yed s ASN 135 Cb -0.04 -2.25 0.00 0.00 1.28 0.00 0.00 41.25 40.25 1yed s ASN 135 CO 0.54 -0.94 0.00 -0.24 -2.04 0.00 0.00 177.10 174.42 1yed n SER 136 N 5.57 0.00 -4.47 3.54 2.88 -1.26 -5.02 113.62 114.87 1yed n SER 136 Ca -0.09 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.13 1yed n SER 136 Cb 0.42 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.75 1yed n SER 136 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1yed s MET 137 N 0.00 2.38 -0.03 -1.46 -1.94 -1.26 -3.00 119.30 113.99 1yed s MET 137 Ca 0.00 -0.78 0.04 0.00 -1.71 0.00 0.00 55.69 53.24 1yed s MET 137 Cb 0.00 -2.32 -0.03 0.00 2.01 0.00 0.00 34.83 34.49 1yed s MET 137 CO 0.00 0.60 -0.15 0.14 -0.01 0.00 0.00 175.02 175.60 1yed s VAL 138 N -0.80 3.03 -0.10 -6.03 -7.23 0.02 -4.50 120.40 104.79 1yed s VAL 138 Ca 0.13 -0.81 -0.03 0.00 -1.81 0.00 0.00 61.98 59.46 1yed s VAL 138 Cb -0.11 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.59 1yed s VAL 138 CO 0.02 0.54 0.02 -0.89 -0.31 0.00 0.00 175.10 174.48 1yed s THR 139 N -0.78 4.48 0.53 5.32 2.01 -1.26 -0.78 115.64 125.17 1yed s THR 139 Ca 0.12 -0.18 0.03 0.00 0.31 0.00 0.00 61.69 61.98 1yed s THR 139 Cb -0.11 -2.90 0.02 0.00 0.01 0.00 0.00 72.50 69.52 1yed s THR 139 CO 0.02 0.59 0.22 -0.76 -0.69 0.00 0.00 174.62 174.00 1yed s LEU 140 N -0.78 2.50 0.25 4.42 1.43 0.12 -4.80 118.68 121.82 1yed s LEU 140 Ca 0.12 -1.44 -0.21 0.00 -1.03 0.00 0.00 54.13 51.57 1yed s LEU 140 Cb -0.12 -0.97 0.03 0.00 0.03 0.00 0.00 46.19 45.16 1yed s LEU 140 CO 0.02 -1.00 0.68 -0.83 0.23 0.00 0.00 176.35 175.45 1yed s GLY 141 N -4.10 -0.17 -0.12 -3.19 0.00 -1.17 -2.29 107.32 96.28 1yed s GLY 141 Ca 0.20 -0.18 -0.06 0.00 0.00 0.00 0.00 44.72 44.68 1yed s GLY 141 CO 0.13 -0.07 0.28 0.00 0.00 0.00 0.00 173.10 173.44 1yed s LEU 143 N 1.21 4.06 -0.70 0.00 0.20 -0.59 -2.00 118.68 120.85 1yed s LEU 143 Ca -0.09 -1.24 -0.18 0.00 0.69 0.00 0.00 54.13 53.31 1yed s LEU 143 Cb -0.09 -1.77 0.13 0.00 -0.43 0.00 0.00 46.19 44.03 1yed s LEU 143 CO -0.09 -0.29 0.82 -0.69 -0.29 0.00 0.00 176.35 175.81 1yed s VAL 144 N 1.30 4.90 0.03 1.68 1.01 -0.22 -1.77 120.40 127.33 1yed s VAL 144 Ca -0.04 -1.32 0.00 0.00 0.00 0.00 0.00 61.98 60.63 1yed s VAL 144 Cb -0.20 -4.56 -0.04 0.00 0.00 0.00 0.00 36.38 31.58 1yed s VAL 144 CO 0.00 -1.21 0.13 -0.75 0.00 0.00 0.00 175.10 173.27 1yed s LYS 145 N 2.36 3.17 -1.17 2.72 2.20 0.66 -1.57 119.74 128.10 1yed s LYS 145 Ca 0.17 -0.50 -0.14 0.00 -0.36 0.00 0.00 55.97 55.15 1yed s LYS 145 Cb -0.18 -2.91 -0.02 0.00 -1.51 0.00 0.00 37.83 33.22 1yed s LYS 145 CO 0.01 0.62 0.77 0.41 -0.36 0.00 0.00 175.35 176.80 1yed n GLY 146 N 0.75 -0.86 3.60 5.54 0.00 -0.24 -0.82 105.19 113.16 1yed n GLY 146 Ca -0.10 0.40 -0.27 0.00 0.00 0.00 0.00 46.02 46.06 1yed n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yed s TYR 147 N -3.52 2.49 -0.28 1.61 -0.85 -0.78 -4.64 117.35 111.37 1yed s TYR 147 Ca 0.36 -0.60 -0.20 0.00 -0.52 0.00 0.00 57.07 56.12 1yed s TYR 147 Cb -0.11 -1.65 0.11 0.00 0.38 0.00 0.00 41.96 40.68 1yed s TYR 147 CO 0.84 0.48 0.85 0.12 -1.52 0.00 0.00 175.55 176.32 1yed s PHE 148 N -2.66 -0.75 0.00 -3.49 2.19 -0.69 -0.67 117.98 111.91 1yed s PHE 148 Ca 0.35 1.61 0.00 0.00 0.33 0.00 0.00 56.93 59.21 1yed s PHE 148 Cb 0.07 0.43 0.00 0.00 -1.31 0.00 0.00 43.02 42.21 1yed s PHE 148 CO 0.18 -0.37 0.00 -0.35 1.83 0.00 0.00 175.22 176.51 1yed n PRO 149 N 3.38 1.05 -2.13 10.12 -0.04 -1.26 -0.89 135.00 145.24 1yed n PRO 149 Ca -0.17 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.00 1yed n PRO 149 Cb 0.57 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.04 1yed n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1yed s GLU 150 N -1.75 3.46 0.33 0.54 0.41 -1.26 -4.76 118.70 115.67 1yed s GLU 150 Ca 0.00 0.51 0.08 0.00 -0.41 0.00 0.00 54.97 55.15 1yed s GLU 150 Cb 0.00 -2.17 -0.03 0.00 -1.78 0.00 0.00 34.13 30.15 1yed s GLU 150 CO 0.00 -0.52 0.27 -1.25 -0.49 0.00 0.00 175.26 173.27 1yed s PRO 151 N -5.06 2.69 0.19 0.39 0.04 -1.26 -4.95 135.00 127.04 1yed s PRO 151 Ca 0.53 -1.32 0.08 0.00 0.04 0.00 0.00 61.00 60.34 1yed s PRO 151 Cb -0.11 -2.44 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 1yed s PRO 151 CO 0.51 0.11 -0.04 0.14 0.04 0.00 0.00 177.00 177.76 1yed s VAL 152 N -2.31 3.46 -0.50 -0.36 -7.23 -1.26 -4.29 120.40 107.90 1yed s VAL 152 Ca 0.40 -1.61 0.03 0.00 -1.81 0.00 0.00 61.98 58.99 1yed s VAL 152 Cb -0.05 -2.75 0.13 0.00 0.56 0.00 0.00 36.38 34.26 1yed s VAL 152 CO 0.26 -0.16 0.24 -0.89 -0.31 0.00 0.00 175.10 174.24 1yed s THR 153 N -1.84 2.67 0.26 5.32 2.01 -0.48 -4.95 115.64 118.64 1yed s THR 153 Ca 0.27 -3.09 -0.29 0.00 0.31 0.00 0.00 61.69 58.89 1yed s THR 153 Cb -0.08 -2.86 -0.09 0.00 0.01 0.00 0.00 72.50 69.48 1yed s THR 153 CO 0.17 -0.77 0.94 -0.69 -0.69 0.00 0.00 174.62 173.58 1yed s VAL 154 N -0.03 4.12 0.01 3.82 1.01 -1.26 -2.86 120.40 125.20 1yed s VAL 154 Ca 0.16 2.01 -0.25 0.00 0.00 0.00 0.00 61.98 63.89 1yed s VAL 154 Cb -0.24 -4.24 0.06 0.00 0.00 0.00 0.00 36.38 31.96 1yed s VAL 154 CO -0.02 0.40 0.57 0.28 0.00 0.00 0.00 175.10 176.34 1yed s THR 155 N -1.30 0.02 -0.12 3.92 -1.32 -0.71 -5.01 115.64 111.12 1yed s THR 155 Ca 0.43 -0.15 -0.00 0.00 -1.21 0.00 0.00 61.69 60.77 1yed s THR 155 Cb -0.24 -0.95 -0.02 0.00 -1.51 0.00 0.00 72.50 69.78 1yed s THR 155 CO 0.30 -0.08 -0.12 0.26 -2.21 0.00 0.00 174.62 172.77 1yed s TRP 156 N -1.93 2.83 -1.59 9.09 0.52 -1.26 -0.84 118.94 125.76 1yed s TRP 156 Ca -0.08 -0.51 -0.14 0.00 0.02 0.00 0.00 56.10 55.39 1yed s TRP 156 Cb -0.01 -1.83 0.11 0.00 -1.15 0.00 0.00 33.47 30.59 1yed s TRP 156 CO 0.03 -0.12 0.84 0.09 0.02 0.00 0.00 176.95 177.81 1yed n ASN 157 N 3.32 -3.62 -3.89 2.95 3.02 -0.57 -1.35 115.26 115.12 1yed n ASN 157 Ca -0.18 -0.91 -0.29 0.00 -0.03 0.00 0.00 54.58 53.18 1yed n ASN 157 Cb 0.53 -3.31 0.02 0.00 -0.61 0.00 0.00 39.78 36.41 1yed n ASN 157 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1yed n SER 158 N -2.77 -4.01 0.00 6.41 7.64 -1.26 -0.72 113.62 118.91 1yed n SER 158 Ca 0.01 -0.80 0.00 0.00 1.01 0.00 0.00 58.87 59.09 1yed n SER 158 Cb 0.53 -3.85 0.00 0.00 -1.01 0.00 0.00 64.21 59.88 1yed n SER 158 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yed n GLY 159 N -1.67 2.22 0.21 0.23 0.00 -0.46 -4.86 105.19 100.85 1yed n GLY 159 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1yed n GLY 159 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yed n SER 160 N 0.00 0.39 -3.38 1.61 3.41 0.10 -3.84 113.62 111.92 1yed n SER 160 Ca 0.00 -1.82 -0.19 0.00 -0.26 0.00 0.00 58.87 56.60 1yed n SER 160 Cb 0.00 -0.19 -0.08 0.00 -0.26 0.00 0.00 64.21 63.67 1yed n SER 160 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1yed s LEU 161 N -0.58 0.07 -0.12 1.04 2.96 -1.17 -4.96 118.68 115.92 1yed s LEU 161 Ca 0.00 -1.62 0.06 0.00 -0.22 0.00 0.00 54.13 52.35 1yed s LEU 161 Cb 0.00 0.43 -0.12 0.00 0.50 0.00 0.00 46.19 47.00 1yed s LEU 161 CO 0.00 -0.27 -0.03 -1.54 -1.32 0.00 0.00 176.35 173.19 1yed n SER 162 N 4.27 2.51 -4.70 3.68 3.41 -1.25 -4.38 113.62 117.16 1yed n SER 162 Ca 0.11 -0.03 -0.42 0.00 -0.26 0.00 0.00 58.87 58.26 1yed n SER 162 Cb 0.44 0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 64.71 1yed n SER 162 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1yed s SER 163 N -4.81 7.27 0.00 4.04 0.15 -1.26 -3.69 113.70 115.40 1yed s SER 163 Ca -0.11 1.55 0.00 0.00 0.70 0.00 0.00 55.95 58.08 1yed s SER 163 Cb 0.04 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 1yed s SER 163 CO 0.41 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 175.13 1yed n GLY 164 N 3.02 0.34 3.77 9.45 0.00 -1.26 -4.81 105.19 115.70 1yed n GLY 164 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1yed n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yed s VAL 165 N -2.09 3.68 -0.05 1.61 1.01 -1.24 -3.62 120.40 119.71 1yed s VAL 165 Ca 0.00 1.40 0.02 0.00 0.00 0.00 0.00 61.98 63.40 1yed s VAL 165 Cb 0.00 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1yed s VAL 165 CO 0.00 0.12 -0.09 -1.00 0.00 0.00 0.00 175.10 174.13 1yed s HIS 166 N -1.51 1.14 -0.10 5.22 3.76 0.01 -4.97 115.29 118.84 1yed s HIS 166 Ca 0.53 -0.36 0.01 0.00 -0.15 0.00 0.00 55.06 55.09 1yed s HIS 166 Cb -0.25 -0.86 0.02 0.00 1.11 0.00 0.00 32.58 32.61 1yed s HIS 166 CO 0.31 -0.20 -0.10 0.99 -0.85 0.00 0.00 174.74 174.89 1yed s THR 167 N 0.57 1.15 -0.02 1.30 2.01 -1.26 -0.66 115.64 118.73 1yed s THR 167 Ca -0.10 -0.41 -0.06 0.00 0.31 0.00 0.00 61.69 61.42 1yed s THR 167 Cb -0.13 -1.10 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 1yed s THR 167 CO 0.02 0.38 0.24 -0.36 -0.69 0.00 0.00 174.62 174.20 1yed s PHE 168 N 1.26 3.58 0.32 4.92 0.40 -0.76 -5.03 117.98 122.67 1yed s PHE 168 Ca -0.03 0.54 -0.28 0.00 -0.60 0.00 0.00 56.93 56.56 1yed s PHE 168 Cb -0.14 -1.96 -0.13 0.00 0.51 0.00 0.00 43.02 41.30 1yed s PHE 168 CO -0.04 0.64 1.20 -2.30 0.70 0.00 0.00 175.22 175.43 1yed n PRO 169 N 1.26 1.88 -2.50 0.24 -0.02 -1.26 -4.17 135.00 130.43 1yed n PRO 169 Ca -0.13 0.66 -0.38 0.00 -2.02 0.00 0.00 63.50 61.63 1yed n PRO 169 Cb 0.53 -2.17 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 1yed n PRO 169 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yed s ALA 170 N -1.05 3.25 -0.18 3.55 0.00 -1.26 -4.80 121.76 121.27 1yed s ALA 170 Ca 0.57 0.81 0.01 0.00 0.00 0.00 0.00 51.96 53.35 1yed s ALA 170 Cb -0.61 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.22 1yed s ALA 170 CO 0.61 -0.20 -0.19 0.54 0.00 0.00 0.00 175.76 176.52 1yed s VAL 171 N -1.39 2.14 -0.33 0.00 0.11 -1.01 -4.91 120.40 115.01 1yed s VAL 171 Ca 0.51 -0.92 -0.28 0.00 -2.93 0.00 0.00 61.98 58.36 1yed s VAL 171 Cb -0.27 -1.90 -0.02 0.00 -1.53 0.00 0.00 36.38 32.66 1yed s VAL 171 CO 0.35 0.53 1.75 -0.22 -3.33 0.00 0.00 175.10 174.18 1yed s LEU 172 N 1.22 3.53 0.00 2.54 2.96 -1.26 -3.52 118.68 124.16 1yed s LEU 172 Ca 0.03 1.28 0.00 0.00 -0.22 0.00 0.00 54.13 55.22 1yed s LEU 172 Cb -0.13 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.03 1yed s LEU 172 CO -0.11 -1.65 0.00 0.00 -1.32 0.00 0.00 176.35 173.27 1yed n GLN 173 N 8.35 0.00 -1.90 1.98 6.02 -0.65 -4.82 117.38 126.36 1yed n GLN 173 Ca 0.22 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.79 1yed n GLN 173 Cb 0.47 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.73 1yed n GLN 173 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1yed n SER 174 N 0.00 4.10 -2.08 1.08 3.41 -1.26 -4.24 113.62 114.64 1yed n SER 174 Ca 0.00 -2.86 -0.15 0.00 -0.26 0.00 0.00 58.87 55.60 1yed n SER 174 Cb 0.00 -1.67 -0.03 0.00 -0.26 0.00 0.00 64.21 62.26 1yed n SER 174 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1yed n ASP 175 N 6.39 -4.25 -3.71 4.04 8.00 -1.26 -4.89 116.55 120.87 1yed n ASP 175 Ca 0.51 0.22 -0.11 0.00 0.71 0.00 0.00 54.79 56.11 1yed n ASP 175 Cb 0.40 -3.69 -0.11 0.00 -0.02 0.00 0.00 41.12 37.70 1yed n ASP 175 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1yed s LEU 176 N -5.10 0.09 0.65 0.64 2.96 -1.26 -4.92 118.68 111.74 1yed s LEU 176 Ca 0.00 0.81 -0.09 0.00 -0.22 0.00 0.00 54.13 54.63 1yed s LEU 176 Cb 0.00 1.23 0.01 0.00 0.50 0.00 0.00 46.19 47.94 1yed s LEU 176 CO 0.00 -0.18 1.00 -0.31 -1.32 0.00 0.00 176.35 175.54 1yed s TYR 177 N 1.20 3.27 -0.23 5.38 2.02 0.15 -1.63 117.35 127.52 1yed s TYR 177 Ca -0.08 0.83 -0.12 0.00 -0.37 0.00 0.00 57.07 57.33 1yed s TYR 177 Cb -0.08 -2.92 0.08 0.00 -0.40 0.00 0.00 41.96 38.64 1yed s TYR 177 CO -0.10 -1.02 0.54 0.99 -1.57 0.00 0.00 175.55 174.39 1yed s THR 178 N -3.18 -0.18 0.21 -0.71 2.01 -1.23 -1.08 115.64 111.47 1yed s THR 178 Ca 0.56 0.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.60 1yed s THR 178 Cb -0.11 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.56 1yed s THR 178 CO 0.48 0.02 0.17 -1.48 -0.69 0.00 0.00 174.62 173.13 1yed s LEU 179 N 1.78 1.07 0.20 4.42 0.05 -0.61 -2.41 118.68 123.18 1yed s LEU 179 Ca -0.08 -1.35 -0.13 0.00 0.05 0.00 0.00 54.13 52.61 1yed s LEU 179 Cb -0.08 0.53 0.01 0.00 -2.05 0.00 0.00 46.19 44.60 1yed s LEU 179 CO -0.16 -0.88 0.42 -0.94 -0.55 0.00 0.00 176.35 174.25 1yed s SER 180 N -3.15 -0.11 -0.00 1.48 1.04 -1.26 -1.06 113.70 110.65 1yed s SER 180 Ca 0.37 -0.74 -0.13 0.00 0.48 0.00 0.00 55.95 55.94 1yed s SER 180 Cb 0.06 0.53 0.02 0.00 0.10 0.00 0.00 66.02 66.73 1yed s SER 180 CO 0.12 -1.02 0.27 -0.94 0.98 0.00 0.00 173.24 172.65 1yed s SER 181 N -2.94 -0.13 0.22 7.02 1.04 -0.84 -1.84 113.70 116.22 1yed s SER 181 Ca 0.15 -0.02 0.10 0.00 0.48 0.00 0.00 55.95 56.66 1yed s SER 181 Cb 0.01 0.29 -0.05 0.00 0.10 0.00 0.00 66.02 66.37 1yed s SER 181 CO 0.01 -0.45 -0.19 -0.94 0.98 0.00 0.00 173.24 172.65 1yed s SER 182 N -1.44 3.10 -0.13 7.02 1.04 0.17 -1.06 113.70 122.41 1yed s SER 182 Ca -0.13 -0.95 -0.05 0.00 0.48 0.00 0.00 55.95 55.30 1yed s SER 182 Cb -0.05 -0.22 0.06 0.00 0.10 0.00 0.00 66.02 65.91 1yed s SER 182 CO 0.03 -0.01 0.26 0.54 0.98 0.00 0.00 173.24 175.04 1yed s VAL 183 N -2.33 -0.40 -0.35 5.02 0.11 -0.97 -0.81 120.40 120.68 1yed s VAL 183 Ca 0.23 0.28 -0.13 0.00 -2.93 0.00 0.00 61.98 59.43 1yed s VAL 183 Cb -0.05 -0.44 -0.01 0.00 -1.53 0.00 0.00 36.38 34.35 1yed s VAL 183 CO 0.10 0.12 0.24 -0.89 -3.33 0.00 0.00 175.10 171.33 1yed s THR 184 N 2.37 5.21 0.08 5.04 2.01 -1.24 0.12 115.64 129.23 1yed s THR 184 Ca 0.01 -0.29 0.10 0.00 0.31 0.00 0.00 61.69 61.81 1yed s THR 184 Cb -0.12 -3.70 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 1yed s THR 184 CO -0.08 -0.04 -0.26 0.68 -0.69 0.00 0.00 174.62 174.23 1yed s VAL 185 N 1.71 2.13 0.90 3.82 -7.23 0.04 -4.83 120.40 116.94 1yed s VAL 185 Ca 0.06 -1.53 -0.10 0.00 -1.81 0.00 0.00 61.98 58.60 1yed s VAL 185 Cb -0.18 -1.86 0.14 0.00 0.56 0.00 0.00 36.38 35.05 1yed s VAL 185 CO 0.10 0.23 1.14 -2.16 -0.31 0.00 0.00 175.10 174.10 1yed s PRO 186 N -1.58 1.11 0.26 4.82 0.04 -1.26 -0.80 135.00 137.59 1yed s PRO 186 Ca 0.12 1.51 0.24 0.00 0.04 0.00 0.00 61.00 62.91 1yed s PRO 186 Cb -0.10 -1.74 0.99 0.00 0.04 0.00 0.00 34.50 33.69 1yed s PRO 186 CO 0.04 -2.56 1.71 -1.13 0.04 0.00 0.00 177.00 175.10 1yed n SER 187 N -4.18 0.67 -0.03 6.66 3.41 -1.16 -3.19 113.62 115.80 1yed n SER 187 Ca 0.12 0.67 -0.09 0.00 -0.26 0.00 0.00 58.87 59.30 1yed n SER 187 Cb 0.52 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.63 1yed n SER 187 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1yed h SER 188 N 0.00 -0.13 -0.47 4.04 0.02 -1.90 -2.98 113.55 112.13 1yed h SER 188 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1yed h SER 188 Cb 0.36 0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1yed h SER 188 CO 0.00 -0.04 0.00 -0.81 -1.14 0.00 0.00 176.83 174.84 1yed n PRO 189 N -5.17 2.22 0.02 3.45 -0.04 -1.19 -4.60 135.00 129.69 1yed n PRO 189 Ca -0.03 -1.89 -0.01 0.00 -0.04 0.00 0.00 63.50 61.53 1yed n PRO 189 Cb 0.11 -1.43 -0.01 0.00 -0.04 0.00 0.00 33.50 32.13 1yed n PRO 189 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1yed h ARG 190 N 3.25 -0.09 -0.04 0.54 9.65 -1.58 -3.36 114.38 122.76 1yed h ARG 190 Ca 0.00 0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.92 1yed h ARG 190 Cb 0.74 0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.29 1yed h ARG 190 CO 0.00 -0.06 -0.26 -1.35 2.80 0.00 0.00 179.97 181.10 1yed h PRO 191 N -0.48 -0.37 -6.00 0.20 0.11 -1.83 -3.40 132.00 120.23 1yed h PRO 191 Ca -0.01 0.02 -0.68 0.00 0.11 0.00 0.00 66.00 65.45 1yed h PRO 191 Cb 0.07 0.08 -0.16 0.00 0.11 0.00 0.00 31.00 31.10 1yed h PRO 191 CO 0.02 -0.24 -0.64 -1.54 -0.21 0.00 0.00 178.00 175.38 1yed s SER 192 N -4.91 5.05 0.00 -2.05 1.04 -1.26 -4.92 113.70 106.64 1yed s SER 192 Ca -0.15 0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1yed s SER 192 Cb 0.10 -1.40 0.00 0.00 0.10 0.00 0.00 66.02 64.82 1yed s SER 192 CO 0.66 0.37 0.00 -0.62 0.98 0.00 0.00 173.24 174.63 1yed n GLU 193 N 2.22 0.00 -1.87 4.02 1.02 -1.26 -4.35 120.64 120.43 1yed n GLU 193 Ca -0.18 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.58 1yed n GLU 193 Cb 0.53 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.99 1yed n GLU 193 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1yed s THR 194 N 0.00 2.28 -0.06 2.62 2.01 -1.26 -4.59 115.64 116.64 1yed s THR 194 Ca 0.00 0.20 -0.00 0.00 0.31 0.00 0.00 61.69 62.20 1yed s THR 194 Cb 0.00 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.44 1yed s THR 194 CO 0.00 -0.01 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.22 1yed s VAL 195 N -1.36 0.37 -0.07 3.82 1.01 -1.26 -5.03 120.40 117.88 1yed s VAL 195 Ca 0.71 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.76 1yed s VAL 195 Cb -0.38 -0.49 0.02 0.00 0.00 0.00 0.00 36.38 35.53 1yed s VAL 195 CO 0.44 0.23 -0.10 -0.89 0.00 0.00 0.00 175.10 174.78 1yed s THR 196 N 1.51 1.00 -0.33 3.92 2.01 -1.26 -1.05 115.64 121.45 1yed s THR 196 Ca -0.02 -0.37 -0.20 0.00 0.31 0.00 0.00 61.69 61.41 1yed s THR 196 Cb -0.13 -0.96 -0.00 0.00 0.01 0.00 0.00 72.50 71.42 1yed s THR 196 CO -0.03 0.34 0.63 0.00 -0.69 0.00 0.00 174.62 174.87 1yed s ASN 198 N 1.71 4.88 -0.10 0.00 0.02 -0.02 -1.25 114.94 120.19 1yed s ASN 198 Ca 0.25 -0.91 0.00 0.00 -1.02 0.00 0.00 52.86 51.18 1yed s ASN 198 Cb -0.15 -1.79 -0.02 0.00 0.02 0.00 0.00 41.25 39.31 1yed s ASN 198 CO 0.13 -0.20 -0.09 0.68 0.02 0.00 0.00 177.10 177.64 1yed s VAL 199 N 1.39 3.46 -0.08 1.60 -7.23 -0.75 -1.74 120.40 117.05 1yed s VAL 199 Ca -0.00 -0.55 0.04 0.00 -1.81 0.00 0.00 61.98 59.67 1yed s VAL 199 Cb -0.18 -2.43 -0.00 0.00 0.56 0.00 0.00 36.38 34.33 1yed s VAL 199 CO -0.00 0.56 -0.21 0.00 -0.31 0.00 0.00 175.10 175.14 1yed s ALA 200 N -0.28 1.92 -0.57 1.32 0.00 -1.14 -1.08 121.76 121.93 1yed s ALA 200 Ca 0.03 -0.85 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 1yed s ALA 200 Cb -0.13 -0.70 0.15 0.00 0.00 0.00 0.00 23.12 22.44 1yed s ALA 200 CO 0.03 0.28 0.39 -1.58 0.00 0.00 0.00 175.76 174.88 1yed s HIS 201 N 0.26 3.48 0.15 0.00 2.46 0.35 -1.38 115.29 120.61 1yed s HIS 201 Ca -0.13 -2.50 -0.28 0.00 0.47 0.00 0.00 55.06 52.61 1yed s HIS 201 Cb -0.16 -3.28 -0.01 0.00 -0.13 0.00 0.00 32.58 29.00 1yed s HIS 201 CO 0.06 -0.90 1.56 -1.35 -2.47 0.00 0.00 174.74 171.64 1yed h PRO 202 N 7.49 -0.29 0.00 2.88 0.11 -1.83 -1.53 132.00 138.84 1yed h PRO 202 Ca -0.06 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1yed h PRO 202 Cb 0.99 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1yed h PRO 202 CO 0.73 -0.19 0.22 0.00 -0.21 0.00 0.00 178.00 178.55 1yed n ALA 203 N -3.11 0.69 -1.36 -0.75 0.00 -1.26 -1.57 120.51 113.14 1yed n ALA 203 Ca -0.00 0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.56 1yed n ALA 203 Cb 0.35 -0.82 0.04 0.00 0.00 0.00 0.00 19.45 19.01 1yed n ALA 203 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yed n SER 204 N -1.85 0.84 -4.20 0.00 3.41 -0.65 -4.97 113.62 106.20 1yed n SER 204 Ca -0.01 -2.12 -0.34 0.00 -0.26 0.00 0.00 58.87 56.15 1yed n SER 204 Cb 0.23 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 63.94 1yed n SER 204 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1yed n SER 205 N -0.44 -1.84 -4.49 4.04 7.64 -0.61 -4.94 113.62 112.97 1yed n SER 205 Ca 0.04 -1.07 -0.31 0.00 1.01 0.00 0.00 58.87 58.55 1yed n SER 205 Cb 0.60 -2.57 -0.12 0.00 -1.01 0.00 0.00 64.21 61.11 1yed n SER 205 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1yed s THR 206 N -3.60 3.00 -0.02 0.44 2.01 -1.07 -5.00 115.64 111.41 1yed s THR 206 Ca 0.47 -1.12 -0.00 0.00 0.31 0.00 0.00 61.69 61.34 1yed s THR 206 Cb -0.26 -2.29 0.03 0.00 0.01 0.00 0.00 72.50 69.99 1yed s THR 206 CO 0.94 0.32 0.04 -0.75 -0.69 0.00 0.00 174.62 174.48 1yed s LYS 207 N -1.52 -0.04 -0.08 4.92 2.47 -1.26 -0.50 119.74 123.72 1yed s LYS 207 Ca 0.16 0.23 0.02 0.00 -1.56 0.00 0.00 55.97 54.82 1yed s LYS 207 Cb -0.11 -0.30 0.01 0.00 -1.46 0.00 0.00 37.83 35.98 1yed s LYS 207 CO 0.07 -0.20 -0.12 0.08 0.16 0.00 0.00 175.35 175.33 1yed s VAL 208 N 1.29 1.22 -0.29 4.02 1.01 -0.24 -5.01 120.40 122.39 1yed s VAL 208 Ca -0.06 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 1yed s VAL 208 Cb -0.13 -1.13 0.04 0.00 0.00 0.00 0.00 36.38 35.17 1yed s VAL 208 CO -0.03 0.38 -0.01 -1.81 0.00 0.00 0.00 175.10 173.63 1yed s ASP 209 N 0.87 4.79 -0.38 3.32 1.01 -1.26 -1.82 116.67 123.20 1yed s ASP 209 Ca -0.10 -1.18 -0.06 0.00 0.71 0.00 0.00 52.55 51.93 1yed s ASP 209 Cb -0.15 -1.71 0.07 0.00 1.01 0.00 0.00 42.92 42.14 1yed s ASP 209 CO 0.01 -0.23 0.17 -0.54 0.21 0.00 0.00 175.17 174.79 1yed s LYS 210 N 1.27 2.41 -0.26 8.23 3.01 -0.38 -4.94 119.74 129.08 1yed s LYS 210 Ca -0.04 -1.47 -0.29 0.00 -1.01 0.00 0.00 55.97 53.16 1yed s LYS 210 Cb -0.19 -3.56 -0.02 0.00 -1.01 0.00 0.00 37.83 33.05 1yed s LYS 210 CO -0.02 -0.87 1.72 0.15 0.51 0.00 0.00 175.35 176.85 1yed s LYS 211 N 1.31 3.58 -0.34 1.68 1.02 -1.26 -1.84 119.74 123.89 1yed s LYS 211 Ca 0.02 1.59 -0.28 0.00 0.02 0.00 0.00 55.97 57.32 1yed s LYS 211 Cb -0.22 -4.12 -0.02 0.00 -0.52 0.00 0.00 37.83 32.96 1yed s LYS 211 CO -0.00 -1.56 1.77 0.42 -0.92 0.00 0.00 175.35 175.06 1yed s ILE 212 N 6.02 3.50 0.09 2.17 1.01 -0.21 -4.98 121.20 128.79 1yed s ILE 212 Ca 0.76 0.51 0.05 0.00 0.00 0.00 0.00 60.65 61.97 1yed s ILE 212 Cb -0.24 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 1yed s ILE 212 CO 0.32 -0.44 -0.01 -0.69 0.00 0.00 0.00 174.94 174.12 1yed s VAL 213 N 6.81 3.97 0.88 2.92 1.01 -1.26 -4.73 120.40 130.00 1yed s VAL 213 Ca 0.78 -0.98 -0.15 0.00 0.00 0.00 0.00 61.98 61.63 1yed s VAL 213 Cb -0.22 -2.88 0.22 0.00 0.00 0.00 0.00 36.38 33.50 1yed s VAL 213 CO 0.33 0.14 0.70 -0.81 0.00 0.00 0.00 175.10 175.46 1yed n PRO 214 N 0.64 -2.91 -3.70 2.72 -0.04 -1.26 -4.53 135.00 125.91 1yed n PRO 214 Ca -0.11 -1.13 -0.37 0.00 -0.04 0.00 0.00 63.50 61.85 1yed n PRO 214 Cb 0.52 -1.16 -0.11 0.00 -0.04 0.00 0.00 33.50 32.70 1yed n PRO 214 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1yed s ARG 215 N -4.60 3.86 -0.59 0.54 0.52 -1.26 -5.03 118.95 112.39 1yed s ARG 215 Ca 0.47 -0.37 -0.03 0.00 -0.52 0.00 0.00 55.73 55.28 1yed s ARG 215 Cb -0.06 -3.48 0.15 0.00 0.52 0.00 0.00 34.95 32.08 1yed s ARG 215 CO 0.37 -0.11 0.40 -0.51 0.02 0.00 0.00 175.30 175.48 1yed s ASP 216 N 1.48 5.28 0.00 0.23 1.01 -1.26 -5.12 116.67 118.30 1yed s ASP 216 Ca 0.06 -2.69 0.00 0.00 0.71 0.00 0.00 52.55 50.63 1yed s ASP 216 Cb -0.15 -1.86 0.00 0.00 1.01 0.00 0.00 42.92 41.92 1yed s ASP 216 CO 0.07 -0.41 0.00 0.00 0.21 0.00 0.00 175.17 175.04