#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h0p h GLU 2 N 0.00 -0.08 0.00 0.03 -0.00 -2.03 -3.40 114.58 109.09 2h0p h GLU 2 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.37 2h0p h GLU 2 Cb 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 28.75 28.77 2h0p h GLU 2 CO 0.00 -0.06 -0.63 1.63 -0.00 0.00 0.00 179.01 179.96 2h0p n LYS 3 N -5.45 0.01 -2.19 1.06 5.02 -1.26 -4.90 118.16 110.45 2h0p n LYS 3 Ca 0.07 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.05 2h0p n LYS 3 Cb 0.36 -0.81 -0.04 0.00 -0.02 0.00 0.00 35.03 34.51 2h0p n LYS 3 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2h0p s LEU 4 N -4.25 3.26 0.29 -0.35 1.02 -1.26 -4.86 118.68 112.53 2h0p s LEU 4 Ca 0.00 -0.94 -0.20 0.00 0.02 0.00 0.00 54.13 53.02 2h0p s LEU 4 Cb 0.00 -2.56 0.04 0.00 0.02 0.00 0.00 46.19 43.68 2h0p s LEU 4 CO 0.00 -2.42 0.78 0.00 0.02 0.00 0.00 176.35 174.73 2h0p s ARG 5 N 6.43 1.84 -1.17 1.70 1.70 -1.26 -0.17 118.95 128.03 2h0p s ARG 5 Ca 0.64 -1.08 -0.22 0.00 -0.47 0.00 0.00 55.73 54.60 2h0p s ARG 5 Cb -0.05 0.58 -0.03 0.00 -0.57 0.00 0.00 34.95 34.89 2h0p s ARG 5 CO -0.03 -0.85 1.84 0.42 -1.08 0.00 0.00 175.30 175.61 2h0p s ILE 6 N -3.30 3.72 0.56 4.99 -1.09 -1.26 -4.81 121.20 120.01 2h0p s ILE 6 Ca 0.13 -1.11 0.26 0.00 -2.23 0.00 0.00 60.65 57.71 2h0p s ILE 6 Cb -0.05 -4.71 0.38 0.00 -1.58 0.00 0.00 42.46 36.50 2h0p s ILE 6 CO 0.08 -1.35 2.02 0.11 -1.23 0.00 0.00 174.94 174.57 2h0p h LYS 7 N 9.35 0.00 -0.46 2.79 1.57 -1.94 -0.42 116.57 127.46 2h0p h LYS 7 Ca 0.26 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.13 2h0p h LYS 7 Cb 0.93 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.15 2h0p h LYS 7 CO 1.30 0.00 -0.30 0.78 -0.57 0.00 0.00 179.45 180.66 2h0p h GLY 8 N 0.00 -0.14 0.00 3.86 0.00 -1.90 -3.37 103.07 101.53 2h0p h GLY 8 Ca 0.18 0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.90 2h0p h GLY 8 CO -0.00 -0.21 -0.32 1.15 0.00 0.00 0.00 176.54 177.15 2h0p n MET 9 N -5.42 3.20 -0.01 4.80 0.00 -1.08 -4.79 117.12 113.82 2h0p n MET 9 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 57.70 57.83 2h0p n MET 9 Cb 0.34 -0.57 0.61 0.00 0.00 0.00 0.00 33.22 33.59 2h0p n MET 9 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2h0p n SER 10 N -0.75 0.31 -4.21 3.17 3.41 -0.19 -4.64 113.62 110.73 2h0p n SER 10 Ca 0.00 -1.38 -0.27 0.00 -0.26 0.00 0.00 58.87 56.96 2h0p n SER 10 Cb 0.00 -0.01 -0.16 0.00 -0.26 0.00 0.00 64.21 63.78 2h0p n SER 10 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2h0p s TYR 11 N -1.97 1.83 -0.34 7.33 2.02 -1.26 -4.99 117.35 119.97 2h0p s TYR 11 Ca 0.33 -0.36 -0.00 0.00 -0.37 0.00 0.00 57.07 56.67 2h0p s TYR 11 Cb 0.16 -1.18 0.13 0.00 -0.40 0.00 0.00 41.96 40.67 2h0p s TYR 11 CO 0.26 -0.04 0.21 0.95 -1.57 0.00 0.00 175.55 175.36 2h0p s THR 12 N -0.45 0.03 0.00 -0.71 -4.23 -1.26 -4.87 115.64 104.16 2h0p s THR 12 Ca 0.07 -1.42 0.00 0.00 -1.18 0.00 0.00 61.69 59.16 2h0p s THR 12 Cb -0.08 -1.04 0.00 0.00 1.34 0.00 0.00 72.50 72.72 2h0p s THR 12 CO -0.01 -0.89 0.00 0.23 -0.54 0.00 0.00 174.62 173.42 2h0p n MET 13 N 4.32 0.00 -2.81 3.99 2.00 -1.26 -5.04 117.12 118.32 2h0p n MET 13 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.36 2h0p n MET 13 Cb 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.57 2h0p n MET 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2h0p n SER 15 N 6.90 0.14 -4.61 0.00 3.41 -1.26 -4.50 113.62 113.70 2h0p n SER 15 Ca 0.07 0.54 -0.29 0.00 -0.26 0.00 0.00 58.87 58.93 2h0p n SER 15 Cb 0.48 -0.56 0.18 0.00 -0.26 0.00 0.00 64.21 64.05 2h0p n SER 15 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2h0p s GLY 16 N -3.11 1.56 0.56 5.00 0.00 -1.26 -4.42 107.32 105.64 2h0p s GLY 16 Ca 0.05 -0.46 -0.15 0.00 0.00 0.00 0.00 44.72 44.17 2h0p s GLY 16 CO 0.26 0.19 1.01 1.25 0.00 0.00 0.00 173.10 175.80 2h0p s LYS 17 N -5.04 3.75 0.26 2.90 2.36 -1.26 -4.57 119.74 118.15 2h0p s LYS 17 Ca 0.66 0.93 0.03 0.00 -2.55 0.00 0.00 55.97 55.04 2h0p s LYS 17 Cb -0.17 -2.10 -0.06 0.00 -1.05 0.00 0.00 37.83 34.45 2h0p s LYS 17 CO 0.57 -0.44 0.03 -0.06 1.55 0.00 0.00 175.35 177.00 2h0p s PHE 18 N -2.77 1.68 -0.10 4.03 0.40 -1.26 -0.96 117.98 119.00 2h0p s PHE 18 Ca 0.58 -0.97 -0.02 0.00 -0.60 0.00 0.00 56.93 55.92 2h0p s PHE 18 Cb -0.11 -1.01 -0.03 0.00 0.51 0.00 0.00 43.02 42.38 2h0p s PHE 18 CO 0.39 -0.07 -0.02 -1.12 0.70 0.00 0.00 175.22 175.10 2h0p s SER 19 N -3.36 5.03 -0.89 1.36 0.01 0.73 -4.81 113.70 111.77 2h0p s SER 19 Ca 0.32 0.05 -0.25 0.00 1.31 0.00 0.00 55.95 57.38 2h0p s SER 19 Cb 0.07 -1.50 0.01 0.00 0.21 0.00 0.00 66.02 64.81 2h0p s SER 19 CO 0.11 0.32 1.64 -0.51 0.41 0.00 0.00 173.24 175.21 2h0p s ILE 20 N -0.54 3.66 -0.72 1.44 1.10 -1.26 -1.27 121.20 123.62 2h0p s ILE 20 Ca 0.09 -0.34 0.23 0.00 -0.51 0.00 0.00 60.65 60.11 2h0p s ILE 20 Cb -0.12 -4.55 -0.13 0.00 0.15 0.00 0.00 42.46 37.81 2h0p s ILE 20 CO 0.02 -1.47 1.04 -0.67 -2.11 0.00 0.00 174.94 171.74 2h0p n ASP 21 N 11.12 0.65 -3.76 4.50 -0.08 0.39 -4.71 116.55 124.65 2h0p n ASP 21 Ca 0.29 -0.37 -0.13 0.00 -1.51 0.00 0.00 54.79 53.08 2h0p n ASP 21 Cb 0.49 0.81 -0.10 0.00 2.34 0.00 0.00 41.12 44.66 2h0p n ASP 21 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 2h0p s LYS 22 N -3.14 0.44 1.00 -0.67 2.20 -0.38 -4.93 119.74 114.26 2h0p s LYS 22 Ca 0.05 0.29 -0.16 0.00 -0.36 0.00 0.00 55.97 55.80 2h0p s LYS 22 Cb 0.15 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.68 2h0p s LYS 22 CO 0.80 -0.08 -0.02 -0.85 -0.36 0.00 0.00 175.35 174.85 2h0p n GLU 23 N 2.52 -0.50 -2.43 4.03 -0.00 -1.26 -2.93 120.64 120.06 2h0p n GLU 23 Ca -0.15 -0.12 -0.42 0.00 -0.00 0.00 0.00 57.16 56.47 2h0p n GLU 23 Cb 0.57 -1.62 -0.03 0.00 -0.00 0.00 0.00 31.44 30.36 2h0p n GLU 23 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.13 175.49 2h0p s MET 24 N -3.20 4.48 -0.12 3.44 -1.94 -1.26 -4.59 119.30 116.10 2h0p s MET 24 Ca 0.52 1.78 0.01 0.00 -1.71 0.00 0.00 55.69 56.29 2h0p s MET 24 Cb -0.17 -3.31 0.02 0.00 2.01 0.00 0.00 34.83 33.38 2h0p s MET 24 CO 0.70 -0.15 -0.13 0.00 -0.01 0.00 0.00 175.02 175.43 2h0p s ALA 25 N 0.55 1.66 0.62 3.03 0.00 -1.03 -4.92 121.76 121.66 2h0p s ALA 25 Ca 0.55 -0.75 -0.10 0.00 0.00 0.00 0.00 51.96 51.66 2h0p s ALA 25 Cb -0.30 -0.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 2h0p s ALA 25 CO 0.32 -0.27 1.02 -2.00 0.00 0.00 0.00 175.76 174.83 2h0p s GLU 26 N 1.34 3.45 0.41 0.00 2.12 -1.26 -0.56 118.70 124.20 2h0p s GLU 26 Ca 0.00 0.63 0.07 0.00 0.36 0.00 0.00 54.97 56.04 2h0p s GLU 26 Cb -0.14 -2.10 -0.05 0.00 0.26 0.00 0.00 34.13 32.10 2h0p s GLU 26 CO -0.07 -0.62 0.18 0.95 -0.54 0.00 0.00 175.26 175.16 2h0p s THR 27 N -3.17 2.36 0.42 -1.70 -4.23 0.32 -4.92 115.64 104.73 2h0p s THR 27 Ca 0.55 -1.69 0.17 0.00 -1.18 0.00 0.00 61.69 59.53 2h0p s THR 27 Cb -0.11 -2.99 0.19 0.00 1.34 0.00 0.00 72.50 70.93 2h0p s THR 27 CO 0.53 -0.02 1.97 0.06 -0.54 0.00 0.00 174.62 176.62 2h0p h GLN 28 N 1.43 0.00 0.00 3.99 -0.00 -1.99 -2.39 115.11 116.16 2h0p h GLN 28 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 2h0p h GLN 28 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.73 2h0p h GLN 28 CO 0.69 0.21 0.00 1.58 -0.00 0.00 0.00 178.83 181.31 2h0p n HIS 29 N -4.13 0.20 -0.64 0.06 -0.00 -1.26 -4.90 115.22 104.54 2h0p n HIS 29 Ca -0.02 0.08 0.00 0.00 0.46 0.00 0.00 57.72 58.24 2h0p n HIS 29 Cb 0.28 -0.63 0.00 0.00 -0.12 0.00 0.00 29.99 29.52 2h0p n HIS 29 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2h0p n GLY 30 N -0.19 1.53 3.76 1.57 0.00 -0.90 -5.04 105.19 105.92 2h0p n GLY 30 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2h0p n GLY 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2h0p s THR 31 N -3.57 2.80 0.05 2.61 -4.23 -1.26 -4.70 115.64 107.34 2h0p s THR 31 Ca 0.00 0.26 0.07 0.00 -1.18 0.00 0.00 61.69 60.84 2h0p s THR 31 Cb 0.00 -2.89 -0.03 0.00 1.34 0.00 0.00 72.50 70.92 2h0p s THR 31 CO 0.00 -0.34 -0.19 0.28 -0.54 0.00 0.00 174.62 173.83 2h0p s THR 32 N -3.07 1.55 -0.25 3.99 -1.32 0.88 -0.52 115.64 116.91 2h0p s THR 32 Ca 0.62 -1.23 -0.06 0.00 -1.21 0.00 0.00 61.69 59.81 2h0p s THR 32 Cb -0.16 -1.37 -0.01 0.00 -1.51 0.00 0.00 72.50 69.44 2h0p s THR 32 CO 0.55 0.10 0.03 -0.69 -2.21 0.00 0.00 174.62 172.40 2h0p s VAL 33 N -0.89 3.85 -0.17 5.08 1.01 0.28 -0.49 120.40 129.07 2h0p s VAL 33 Ca 0.06 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 2h0p s VAL 33 Cb -0.09 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.46 2h0p s VAL 33 CO 0.02 0.32 -0.09 -0.69 0.00 0.00 0.00 175.10 174.65 2h0p s VAL 34 N 1.53 3.15 -0.41 2.92 1.01 -0.27 -2.48 120.40 125.86 2h0p s VAL 34 Ca 0.05 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 2h0p s VAL 34 Cb -0.15 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.87 2h0p s VAL 34 CO 0.01 0.48 0.48 -0.75 0.00 0.00 0.00 175.10 175.32 2h0p s LYS 35 N 0.90 3.21 0.42 2.72 2.20 -1.15 -0.32 119.74 127.72 2h0p s LYS 35 Ca -0.02 -0.61 -0.01 0.00 -0.36 0.00 0.00 55.97 54.97 2h0p s LYS 35 Cb -0.15 -3.94 -0.02 0.00 -1.51 0.00 0.00 37.83 32.21 2h0p s LYS 35 CO 0.00 -0.84 0.66 0.14 -0.36 0.00 0.00 175.35 174.95 2h0p s VAL 36 N 2.28 4.66 0.10 4.02 -7.23 0.10 -0.46 120.40 123.87 2h0p s VAL 36 Ca 0.15 -0.29 0.05 0.00 -1.81 0.00 0.00 61.98 60.08 2h0p s VAL 36 Cb -0.16 -3.73 -0.03 0.00 0.56 0.00 0.00 36.38 33.01 2h0p s VAL 36 CO 0.14 -0.56 -0.14 -0.75 -0.31 0.00 0.00 175.10 173.48 2h0p s LYS 37 N -4.53 0.92 0.45 4.82 2.20 -0.39 -1.13 119.74 122.09 2h0p s LYS 37 Ca 0.45 -1.11 -0.05 0.00 -0.36 0.00 0.00 55.97 54.90 2h0p s LYS 37 Cb -0.10 -0.85 -0.04 0.00 -1.51 0.00 0.00 37.83 35.33 2h0p s LYS 37 CO 0.39 0.17 0.75 -0.47 -0.36 0.00 0.00 175.35 175.84 2h0p s TYR 38 N -1.76 3.54 0.06 4.03 5.04 -1.19 -0.19 117.35 126.88 2h0p s TYR 38 Ca 0.04 0.80 0.00 0.00 -2.44 0.00 0.00 57.07 55.47 2h0p s TYR 38 Cb -0.07 -2.28 0.00 0.00 0.35 0.00 0.00 41.96 39.96 2h0p s TYR 38 CO 0.02 -0.20 0.00 0.39 -1.34 0.00 0.00 175.55 174.42 2h0p n GLU 39 N -2.03 0.00 0.04 4.97 1.02 -0.20 -4.53 120.64 119.91 2h0p n GLU 39 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.19 2h0p n GLU 39 Cb 0.55 -0.23 0.24 0.00 -0.02 0.00 0.00 31.44 31.98 2h0p n GLU 39 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2h0p n GLY 40 N 2.24 -0.80 0.00 0.62 0.00 -0.13 -3.75 105.19 103.37 2h0p n GLY 40 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2h0p n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h0p n ALA 41 N -1.57 0.26 0.00 4.61 0.00 -1.26 -4.75 120.51 117.81 2h0p n ALA 41 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2h0p n ALA 41 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.54 2h0p n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h0p n GLY 42 N 0.00 1.44 3.71 0.00 0.00 -1.25 -4.94 105.19 104.16 2h0p n GLY 42 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2h0p n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h0p s ALA 43 N 0.00 1.21 0.98 4.61 0.00 -1.26 -0.36 121.76 126.94 2h0p s ALA 43 Ca 0.00 -0.75 -0.11 0.00 0.00 0.00 0.00 51.96 51.10 2h0p s ALA 43 Cb 0.00 -2.96 0.18 0.00 0.00 0.00 0.00 23.12 20.34 2h0p s ALA 43 CO 0.00 -2.92 1.09 -2.14 0.00 0.00 0.00 175.76 171.79 2h0p s PRO 44 N -5.34 0.56 0.00 0.00 0.02 -1.22 -4.13 135.00 124.89 2h0p s PRO 44 Ca 0.68 1.03 -0.12 0.00 0.02 0.00 0.00 61.00 62.62 2h0p s PRO 44 Cb -0.12 -1.71 0.01 0.00 0.02 0.00 0.00 34.50 32.70 2h0p s PRO 44 CO 0.55 -2.78 0.24 0.00 -0.33 0.00 0.00 177.00 174.68 2h0p s LYS 46 N -1.65 4.33 -0.14 0.00 -2.85 -1.26 -1.23 119.74 116.94 2h0p s LYS 46 Ca -0.12 0.93 -0.06 0.00 -1.00 0.00 0.00 55.97 55.73 2h0p s LYS 46 Cb -0.05 -3.04 -0.04 0.00 -2.06 0.00 0.00 37.83 32.64 2h0p s LYS 46 CO 0.01 0.48 0.05 0.14 0.10 0.00 0.00 175.35 176.14 2h0p s VAL 47 N -1.36 4.74 -0.48 1.79 -7.23 -0.11 -2.80 120.40 114.96 2h0p s VAL 47 Ca 0.39 -0.07 -0.28 0.00 -1.81 0.00 0.00 61.98 60.21 2h0p s VAL 47 Cb -0.19 -3.08 -0.00 0.00 0.56 0.00 0.00 36.38 33.67 2h0p s VAL 47 CO 0.22 0.54 1.59 -2.16 -0.31 0.00 0.00 175.10 174.97 2h0p s PRO 48 N -0.27 3.25 -0.12 4.82 0.05 -1.26 -4.57 135.00 136.89 2h0p s PRO 48 Ca 0.08 0.82 0.01 0.00 0.05 0.00 0.00 61.00 61.96 2h0p s PRO 48 Cb -0.12 -4.17 -0.01 0.00 0.05 0.00 0.00 34.50 30.25 2h0p s PRO 48 CO 0.02 -1.98 -0.15 0.42 0.05 0.00 0.00 177.00 175.36 2h0p s ILE 49 N 6.67 2.88 0.30 0.56 1.01 -1.26 -0.54 121.20 130.81 2h0p s ILE 49 Ca 0.64 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 60.58 2h0p s ILE 49 Cb -0.14 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 2h0p s ILE 49 CO 0.28 0.53 0.13 -1.61 0.00 0.00 0.00 174.94 174.27 2h0p s GLU 50 N 0.27 1.58 -0.10 2.79 2.02 -0.17 -4.97 118.70 120.12 2h0p s GLU 50 Ca -0.11 -1.89 0.02 0.00 0.02 0.00 0.00 54.97 53.01 2h0p s GLU 50 Cb -0.16 -0.27 0.02 0.00 0.10 0.00 0.00 34.13 33.81 2h0p s GLU 50 CO 0.06 -0.38 -0.14 0.42 0.02 0.00 0.00 175.26 175.24 2h0p s ILE 51 N -3.59 1.37 0.30 -1.63 1.01 -1.26 -0.69 121.20 116.72 2h0p s ILE 51 Ca 0.35 -0.57 0.08 0.00 0.00 0.00 0.00 60.65 60.51 2h0p s ILE 51 Cb 0.06 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2h0p s ILE 51 CO 0.16 0.42 0.16 -0.13 0.00 0.00 0.00 174.94 175.55 2h0p s ARG 52 N 1.00 2.58 1.26 2.79 0.52 0.55 -0.31 118.95 127.34 2h0p s ARG 52 Ca -0.07 -1.34 -0.17 0.00 -0.52 0.00 0.00 55.73 53.62 2h0p s ARG 52 Cb -0.15 -2.34 0.29 0.00 0.52 0.00 0.00 34.95 33.27 2h0p s ARG 52 CO -0.01 0.22 0.74 -0.40 0.02 0.00 0.00 175.30 175.87 2h0p n ASP 53 N -1.16 -2.78 -0.13 0.23 5.75 0.35 -1.18 116.55 117.62 2h0p n ASP 53 Ca -0.05 -0.42 0.10 0.00 -0.01 0.00 0.00 54.79 54.42 2h0p n ASP 53 Cb 0.60 -1.08 0.44 0.00 -1.03 0.00 0.00 41.12 40.04 2h0p n ASP 53 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 2h0p h VAL 54 N -2.93 0.93 0.00 2.12 -1.51 -1.92 0.17 116.25 113.12 2h0p h VAL 54 Ca -0.52 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 64.76 2h0p h VAL 54 Cb 1.29 0.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2h0p h VAL 54 CO 0.37 0.10 0.00 0.59 -1.23 0.00 0.00 177.57 177.41 2h0p n ASN 55 N -4.48 0.61 -1.11 4.19 4.13 -1.26 -4.93 115.26 112.40 2h0p n ASN 55 Ca 0.11 0.63 -0.13 0.00 1.68 0.00 0.00 54.58 56.87 2h0p n ASN 55 Cb 0.33 -0.77 -0.04 0.00 -1.54 0.00 0.00 39.78 37.76 2h0p n ASN 55 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2h0p n LYS 56 N -2.15 -0.92 -0.06 3.52 5.02 0.60 -4.91 118.16 119.27 2h0p n LYS 56 Ca 0.03 0.85 -0.07 0.00 -2.02 0.00 0.00 58.31 57.10 2h0p n LYS 56 Cb 0.26 -4.93 -0.08 0.00 -0.02 0.00 0.00 35.03 30.25 2h0p n LYS 56 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2h0p n GLU 57 N -2.51 1.65 -4.76 1.97 0.28 -1.26 -4.87 120.64 111.14 2h0p n GLU 57 Ca -0.13 0.02 -0.25 0.00 -0.16 0.00 0.00 57.16 56.64 2h0p n GLU 57 Cb 0.47 -1.29 -0.16 0.00 1.43 0.00 0.00 31.44 31.89 2h0p n GLU 57 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2h0p s LYS 58 N -2.28 1.60 0.24 3.44 1.02 -1.26 -4.97 119.74 117.54 2h0p s LYS 58 Ca -0.10 -0.56 -0.30 0.00 0.02 0.00 0.00 55.97 55.04 2h0p s LYS 58 Cb 0.04 -1.42 -0.10 0.00 -0.52 0.00 0.00 37.83 35.83 2h0p s LYS 58 CO 0.43 0.23 1.39 0.08 -0.92 0.00 0.00 175.35 176.56 2h0p s VAL 59 N 0.02 2.82 0.00 3.17 1.01 -1.26 -0.50 120.40 125.67 2h0p s VAL 59 Ca -0.03 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.65 2h0p s VAL 59 Cb -0.11 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2h0p s VAL 59 CO 0.02 0.12 0.00 1.33 0.00 0.00 0.00 175.10 176.56 2h0p n VAL 60 N 2.25 0.00 -4.07 2.92 0.24 0.58 -4.85 118.33 115.41 2h0p n VAL 60 Ca 0.06 -0.17 -0.25 0.00 -2.04 0.00 0.00 64.34 61.94 2h0p n VAL 60 Cb 0.41 0.88 -0.06 0.00 -1.47 0.00 0.00 33.84 33.60 2h0p n VAL 60 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2h0p s GLY 61 N -0.46 2.34 -0.05 7.63 0.00 -1.16 -4.21 107.32 111.41 2h0p s GLY 61 Ca 0.00 -1.95 0.01 0.00 0.00 0.00 0.00 44.72 42.78 2h0p s GLY 61 CO 0.00 -1.90 -0.06 0.50 0.00 0.00 0.00 173.10 171.64 2h0p s ARG 62 N -3.96 1.02 -0.13 2.90 0.52 -0.40 -4.75 118.95 114.15 2h0p s ARG 62 Ca 0.40 -0.16 -0.29 0.00 -0.52 0.00 0.00 55.73 55.15 2h0p s ARG 62 Cb 0.02 -0.99 -0.01 0.00 0.52 0.00 0.00 34.95 34.50 2h0p s ARG 62 CO 0.22 -0.08 1.03 0.42 0.02 0.00 0.00 175.30 176.92 2h0p s ILE 63 N 0.94 4.73 -0.19 1.52 1.09 -1.26 -0.14 121.20 127.89 2h0p s ILE 63 Ca -0.11 2.01 0.04 0.00 -1.10 0.00 0.00 60.65 61.50 2h0p s ILE 63 Cb -0.14 -4.30 -0.22 0.00 -1.06 0.00 0.00 42.46 36.74 2h0p s ILE 63 CO 0.00 -0.04 0.07 -0.38 -0.10 0.00 0.00 174.94 174.50 2h0p n ILE 64 N 4.74 1.56 0.09 2.92 2.08 -0.09 -4.43 119.36 126.22 2h0p n ILE 64 Ca 0.10 -0.67 0.00 0.00 0.56 0.00 0.00 62.75 62.73 2h0p n ILE 64 Cb 0.48 -1.27 0.00 0.00 -0.75 0.00 0.00 39.64 38.10 2h0p n ILE 64 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 2h0p n SER 65 N -3.19 1.83 -0.91 4.38 2.88 -0.33 -4.94 113.62 113.34 2h0p n SER 65 Ca -0.37 -1.26 0.01 0.00 -1.33 0.00 0.00 58.87 55.92 2h0p n SER 65 Cb 1.04 -0.36 -0.00 0.00 -0.75 0.00 0.00 64.21 64.14 2h0p n SER 65 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2h0p n SER 66 N 1.31 -5.45 -4.59 -3.46 2.88 -1.26 -4.69 113.62 98.36 2h0p n SER 66 Ca 0.00 0.07 -0.42 0.00 -1.33 0.00 0.00 58.87 57.19 2h0p n SER 66 Cb 0.22 -0.20 -0.03 0.00 -0.75 0.00 0.00 64.21 63.45 2h0p n SER 66 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2h0p s THR 67 N -0.10 3.23 0.44 2.46 -4.23 -1.26 -4.94 115.64 111.23 2h0p s THR 67 Ca 0.00 0.22 -0.24 0.00 -1.18 0.00 0.00 61.69 60.49 2h0p s THR 67 Cb 0.00 -3.33 -0.09 0.00 1.34 0.00 0.00 72.50 70.42 2h0p s THR 67 CO 0.00 -0.23 1.14 -2.65 -0.54 0.00 0.00 174.62 172.34 2h0p n PRO 68 N 8.66 1.59 -3.99 3.99 -0.02 -1.26 -4.88 135.00 139.09 2h0p n PRO 68 Ca 0.27 0.57 -0.10 0.00 -2.02 0.00 0.00 63.50 62.22 2h0p n PRO 68 Cb 0.47 -2.23 -0.07 0.00 -0.02 0.00 0.00 33.50 31.65 2h0p n PRO 68 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 2h0p s LEU 69 N -1.31 0.89 -0.10 2.45 0.05 -1.26 -0.93 118.68 118.47 2h0p s LEU 69 Ca 0.64 -0.92 -0.04 0.00 0.05 0.00 0.00 54.13 53.85 2h0p s LEU 69 Cb -0.52 1.20 0.05 0.00 -2.05 0.00 0.00 46.19 44.87 2h0p s LEU 69 CO 0.56 -0.92 0.20 0.00 -0.55 0.00 0.00 176.35 175.64 2h0p s ALA 70 N -3.99 -0.35 -0.45 1.48 0.00 -0.36 -4.72 121.76 113.36 2h0p s ALA 70 Ca 0.20 0.75 0.26 0.00 0.00 0.00 0.00 51.96 53.16 2h0p s ALA 70 Cb 0.03 -0.84 0.79 0.00 0.00 0.00 0.00 23.12 23.11 2h0p s ALA 70 CO 0.02 -0.52 1.75 0.93 0.00 0.00 0.00 175.76 177.94 2h0p h GLU 71 N 8.12 0.00 -2.55 0.00 4.39 -1.90 0.21 114.58 122.85 2h0p h GLU 71 Ca -0.19 0.00 0.14 0.00 0.34 0.00 0.00 59.36 59.65 2h0p h GLU 71 Cb 1.12 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.70 2h0p h GLU 71 CO 0.19 0.00 0.41 -0.80 -1.16 0.00 0.00 179.01 177.64 2h0p s ASN 72 N -5.21 -0.20 0.18 1.42 0.02 -1.26 -3.44 114.94 106.46 2h0p s ASN 72 Ca 0.07 -0.48 -0.16 0.00 -1.02 0.00 0.00 52.86 51.27 2h0p s ASN 72 Cb 0.09 0.57 0.15 0.00 0.02 0.00 0.00 41.25 42.07 2h0p s ASN 72 CO 0.57 -1.05 1.66 0.74 0.02 0.00 0.00 177.10 179.04 2h0p h THR 73 N 2.00 0.53 0.00 1.60 2.02 -0.85 -1.65 112.91 116.56 2h0p h THR 73 Ca -0.23 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.95 2h0p h THR 73 Cb 1.24 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2h0p h THR 73 CO 0.25 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.73 2h0p n ASN 74 N -5.34 0.00 -4.81 4.18 4.13 -1.26 -3.42 115.26 108.74 2h0p n ASN 74 Ca 0.04 -0.05 -0.36 0.00 1.68 0.00 0.00 54.58 55.89 2h0p n ASN 74 Cb 0.26 -0.18 -0.06 0.00 -1.54 0.00 0.00 39.78 38.26 2h0p n ASN 74 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2h0p s SER 75 N -2.35 7.10 0.12 6.41 0.01 -0.62 -5.01 113.70 119.36 2h0p s SER 75 Ca 0.13 1.46 0.08 0.00 1.31 0.00 0.00 55.95 58.93 2h0p s SER 75 Cb 0.07 -2.43 -0.04 0.00 0.21 0.00 0.00 66.02 63.83 2h0p s SER 75 CO 0.15 0.04 -0.12 0.68 0.41 0.00 0.00 173.24 174.40 2h0p s VAL 76 N -1.50 3.21 -0.12 3.43 -7.23 -1.26 -3.15 120.40 113.78 2h0p s VAL 76 Ca 0.43 -1.41 -0.04 0.00 -1.81 0.00 0.00 61.98 59.15 2h0p s VAL 76 Cb -0.17 -2.51 0.05 0.00 0.56 0.00 0.00 36.38 34.31 2h0p s VAL 76 CO 0.21 0.06 0.12 -0.89 -0.31 0.00 0.00 175.10 174.30 2h0p s THR 77 N -1.31 -0.18 -0.21 5.32 2.01 -0.28 -4.98 115.64 116.01 2h0p s THR 77 Ca 0.21 0.16 -0.21 0.00 0.31 0.00 0.00 61.69 62.16 2h0p s THR 77 Cb -0.10 -0.39 -0.02 0.00 0.01 0.00 0.00 72.50 71.99 2h0p s THR 77 CO 0.13 -0.02 0.64 0.54 -0.69 0.00 0.00 174.62 175.22 2h0p s ASN 78 N 2.22 6.68 -0.21 3.53 6.03 -1.26 -0.72 114.94 131.22 2h0p s ASN 78 Ca 0.04 0.83 -0.00 0.00 -1.03 0.00 0.00 52.86 52.69 2h0p s ASN 78 Cb -0.14 -2.35 0.05 0.00 -3.03 0.00 0.00 41.25 35.79 2h0p s ASN 78 CO -0.07 -0.30 -0.03 -0.63 -2.03 0.00 0.00 177.10 174.04 2h0p s ILE 79 N 2.05 1.17 0.02 0.54 1.01 0.57 -4.92 121.20 121.63 2h0p s ILE 79 Ca 0.29 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.74 2h0p s ILE 79 Cb -0.16 -1.47 -0.07 0.00 0.01 0.00 0.00 42.46 40.78 2h0p s ILE 79 CO 0.10 -0.06 1.52 -0.70 0.00 0.00 0.00 174.94 175.80 2h0p s GLU 80 N 1.57 4.24 -0.00 2.79 2.12 -1.26 -1.11 118.70 127.04 2h0p s GLU 80 Ca -0.03 2.12 -0.01 0.00 0.36 0.00 0.00 54.97 57.41 2h0p s GLU 80 Cb -0.17 -3.62 -0.00 0.00 0.26 0.00 0.00 34.13 30.59 2h0p s GLU 80 CO -0.07 -0.66 0.03 -1.17 -0.54 0.00 0.00 175.26 172.84 2h0p s LEU 81 N 2.65 1.93 -0.37 2.70 2.96 0.36 -0.92 118.68 127.99 2h0p s LEU 81 Ca 0.68 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.55 2h0p s LEU 81 Cb -0.35 0.16 0.10 0.00 0.50 0.00 0.00 46.19 46.60 2h0p s LEU 81 CO 0.29 -0.10 0.09 -0.70 -1.32 0.00 0.00 176.35 174.61 2h0p s GLU 82 N -0.41 1.59 0.79 1.98 -6.30 0.80 -0.08 118.70 117.07 2h0p s GLU 82 Ca -0.05 -1.95 -0.12 0.00 -2.50 0.00 0.00 54.97 50.36 2h0p s GLU 82 Cb -0.03 -3.26 0.07 0.00 0.00 0.00 0.00 34.13 30.90 2h0p s GLU 82 CO -0.00 -0.97 1.16 -1.25 0.02 0.00 0.00 175.26 174.22 2h0p s PRO 83 N 0.81 2.13 0.88 4.30 0.05 -1.26 -1.27 135.00 140.64 2h0p s PRO 83 Ca 0.11 0.20 -0.12 0.00 0.05 0.00 0.00 61.00 61.24 2h0p s PRO 83 Cb -0.20 -1.96 0.12 0.00 0.05 0.00 0.00 34.50 32.51 2h0p s PRO 83 CO -0.07 -1.49 1.09 -1.25 0.05 0.00 0.00 177.00 175.33 2h0p s PRO 84 N -5.52 1.35 -1.03 0.56 0.04 -1.26 -4.94 135.00 124.21 2h0p s PRO 84 Ca 0.61 0.79 -0.21 0.00 0.04 0.00 0.00 61.00 62.23 2h0p s PRO 84 Cb -0.11 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.52 2h0p s PRO 84 CO 0.50 -2.17 1.96 1.19 0.04 0.00 0.00 177.00 178.52 2h0p n PHE 85 N -3.83 2.60 -2.14 0.56 3.72 -1.26 -4.45 117.46 112.66 2h0p n PHE 85 Ca 0.07 -2.00 0.00 0.00 -0.05 0.00 0.00 57.45 55.47 2h0p n PHE 85 Cb 0.55 -2.15 0.00 0.00 -0.94 0.00 0.00 39.48 36.95 2h0p n PHE 85 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2h0p n GLY 86 N 4.85 -1.38 3.72 1.37 0.00 -1.26 -4.93 105.19 107.55 2h0p n GLY 86 Ca 0.49 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 2h0p n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h0p s ASP 87 N -2.62 6.50 0.00 1.61 2.15 -1.26 -2.32 116.67 120.73 2h0p s ASP 87 Ca 0.00 2.72 -0.09 0.00 0.43 0.00 0.00 52.55 55.61 2h0p s ASP 87 Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 2h0p s ASP 87 CO 0.00 -0.89 0.17 -0.44 -0.17 0.00 0.00 175.17 173.83 2h0p s SER 88 N 1.27 0.00 -0.36 -0.34 0.01 0.83 -4.33 113.70 110.78 2h0p s SER 88 Ca 0.73 -0.19 0.02 0.00 1.31 0.00 0.00 55.95 57.82 2h0p s SER 88 Cb -0.46 0.23 0.11 0.00 0.21 0.00 0.00 66.02 66.10 2h0p s SER 88 CO 0.32 -0.40 0.10 -0.31 0.41 0.00 0.00 173.24 173.36 2h0p s TYR 89 N -1.51 2.91 0.00 2.43 1.51 -0.33 -0.53 117.35 121.84 2h0p s TYR 89 Ca -0.14 -2.58 -0.30 0.00 -1.01 0.00 0.00 57.07 53.04 2h0p s TYR 89 Cb -0.07 -2.45 -0.05 0.00 -0.11 0.00 0.00 41.96 39.29 2h0p s TYR 89 CO 0.01 -0.89 1.29 0.42 -1.11 0.00 0.00 175.55 175.28 2h0p s ILE 90 N 0.96 3.92 -0.17 2.71 1.09 0.18 -0.33 121.20 129.57 2h0p s ILE 90 Ca 0.12 1.31 -0.00 0.00 -1.10 0.00 0.00 60.65 60.98 2h0p s ILE 90 Cb -0.20 -3.84 0.00 0.00 -1.06 0.00 0.00 42.46 37.36 2h0p s ILE 90 CO -0.12 0.02 -0.15 0.68 -0.10 0.00 0.00 174.94 175.28 2h0p s VAL 91 N 1.99 2.64 -0.34 2.92 -7.23 0.13 -0.49 120.40 120.03 2h0p s VAL 91 Ca 0.60 -0.77 0.01 0.00 -1.81 0.00 0.00 61.98 60.01 2h0p s VAL 91 Cb -0.29 -2.12 0.10 0.00 0.56 0.00 0.00 36.38 34.63 2h0p s VAL 91 CO 0.26 0.51 0.10 -0.63 -0.31 0.00 0.00 175.10 175.03 2h0p s ILE 92 N 0.97 1.36 -0.23 -0.62 1.01 -0.07 -1.00 121.20 122.61 2h0p s ILE 92 Ca -0.02 -1.84 0.00 0.00 0.00 0.00 0.00 60.65 58.79 2h0p s ILE 92 Cb -0.15 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.31 2h0p s ILE 92 CO -0.03 -0.68 0.00 0.61 0.00 0.00 0.00 174.94 174.84 2h0p n GLY 93 N 4.49 0.54 3.85 6.18 0.00 0.29 -0.79 105.19 119.75 2h0p n GLY 93 Ca 0.01 -2.30 -0.21 0.00 0.00 0.00 0.00 46.02 43.52 2h0p n GLY 93 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2h0p s VAL 94 N -0.51 3.63 0.00 1.61 -7.23 -1.26 -4.48 120.40 112.16 2h0p s VAL 94 Ca 0.00 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 2h0p s VAL 94 Cb 0.00 -3.21 0.00 0.00 0.56 0.00 0.00 36.38 33.73 2h0p s VAL 94 CO 0.00 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 2h0p n GLY 95 N -1.36 0.00 0.11 2.32 0.00 -1.26 -0.09 105.19 104.91 2h0p n GLY 95 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.14 2h0p n GLY 95 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2h0p n ASN 96 N -0.67 0.44 0.00 1.61 4.05 -1.26 -3.94 115.26 115.49 2h0p n ASN 96 Ca 0.00 -0.60 0.00 0.00 0.45 0.00 0.00 54.58 54.43 2h0p n ASN 96 Cb 0.00 -0.08 0.00 0.00 1.23 0.00 0.00 39.78 40.93 2h0p n ASN 96 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2h0p n SER 97 N -0.94 0.12 -4.65 1.20 3.41 0.87 -5.05 113.62 108.58 2h0p n SER 97 Ca 0.15 -0.42 -0.42 0.00 -0.26 0.00 0.00 58.87 57.93 2h0p n SER 97 Cb 0.27 0.85 -0.03 0.00 -0.26 0.00 0.00 64.21 65.04 2h0p n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2h0p s ALA 98 N -0.88 3.46 -0.62 7.33 0.00 0.79 -4.22 121.76 127.62 2h0p s ALA 98 Ca 0.00 1.19 -0.26 0.00 0.00 0.00 0.00 51.96 52.89 2h0p s ALA 98 Cb 0.00 -3.87 -0.11 0.00 0.00 0.00 0.00 23.12 19.14 2h0p s ALA 98 CO 0.00 -1.73 2.45 1.28 0.00 0.00 0.00 175.76 177.76 2h0p n LEU 99 N 8.09 1.84 -4.30 0.00 4.77 0.03 -4.77 117.00 122.66 2h0p n LEU 99 Ca 0.21 -0.58 -0.46 0.00 -0.03 0.00 0.00 56.01 55.15 2h0p n LEU 99 Cb 0.42 -1.48 -0.04 0.00 -2.33 0.00 0.00 43.42 39.99 2h0p n LEU 99 CO 0.67 -1.64 0.24 -0.89 -1.33 0.00 0.00 177.39 174.44 2h0p s THR 100 N 11.89 5.23 0.16 -5.08 2.01 -1.26 -0.89 115.64 127.70 2h0p s THR 100 Ca 1.03 -1.98 0.09 0.00 0.31 0.00 0.00 61.69 61.15 2h0p s THR 100 Cb -0.33 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 67.83 2h0p s THR 100 CO 0.27 -0.93 -0.20 -1.48 -0.69 0.00 0.00 174.62 171.60 2h0p s LEU 101 N 0.93 2.42 0.13 4.42 2.34 0.36 -4.94 118.68 124.34 2h0p s LEU 101 Ca 0.10 -0.84 -0.26 0.00 0.06 0.00 0.00 54.13 53.19 2h0p s LEU 101 Cb -0.21 -0.91 -0.07 0.00 -0.56 0.00 0.00 46.19 44.44 2h0p s LEU 101 CO -0.02 0.01 0.81 -1.38 -1.06 0.00 0.00 176.35 174.71 2h0p s HIS 102 N -1.86 3.86 0.09 3.48 -3.43 -1.26 -0.65 115.29 115.53 2h0p s HIS 102 Ca 0.16 1.64 0.03 0.00 -0.80 0.00 0.00 55.06 56.08 2h0p s HIS 102 Cb -0.07 -2.84 -0.04 0.00 -1.43 0.00 0.00 32.58 28.21 2h0p s HIS 102 CO 0.07 0.41 -0.08 -0.46 -2.00 0.00 0.00 174.74 172.68 2h0p s TRP 103 N -0.72 0.93 -0.20 0.38 -0.11 0.31 -1.49 118.94 118.04 2h0p s TRP 103 Ca 0.38 -0.74 -0.01 0.00 1.22 0.00 0.00 56.10 56.96 2h0p s TRP 103 Cb -0.23 -0.52 0.06 0.00 -1.50 0.00 0.00 33.47 31.28 2h0p s TRP 103 CO 0.26 -0.07 -0.02 0.12 -4.62 0.00 0.00 176.95 172.62 2h0p s PHE 104 N -2.77 1.73 0.27 5.86 2.19 -1.26 -0.12 117.98 123.88 2h0p s PHE 104 Ca 0.06 -1.27 -0.30 0.00 0.33 0.00 0.00 56.93 55.75 2h0p s PHE 104 Cb -0.01 -1.31 -0.11 0.00 -1.31 0.00 0.00 43.02 40.29 2h0p s PHE 104 CO -0.02 -0.68 1.50 0.50 1.83 0.00 0.00 175.22 178.36 2h0p s ARG 105 N 1.62 4.20 -1.40 10.12 3.52 -0.98 -0.36 118.95 135.68 2h0p s ARG 105 Ca -0.03 2.42 -0.01 0.00 -0.13 0.00 0.00 55.73 57.98 2h0p s ARG 105 Cb -0.17 -3.07 0.01 0.00 -1.56 0.00 0.00 34.95 30.15 2h0p s ARG 105 CO -0.07 -0.51 0.09 1.63 -0.81 0.00 0.00 175.30 175.64 2h0p n LYS 106 N 2.18 -2.37 0.00 5.12 4.76 -1.26 -4.48 118.16 122.11 2h0p n LYS 106 Ca 0.07 0.78 0.00 0.00 -2.87 0.00 0.00 58.31 56.29 2h0p n LYS 106 Cb 0.39 -5.44 0.00 0.00 -1.84 0.00 0.00 35.03 28.14 2h0p n LYS 106 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2h0p n GLY 107 N -0.98 0.00 6.39 0.72 0.00 -0.98 -5.11 105.19 105.23 2h0p n GLY 107 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2h0p n GLY 107 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2h0p n SER 108 N -0.29 0.00 0.00 1.61 2.88 0.52 -4.88 113.62 113.46 2h0p n SER 108 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2h0p n SER 108 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2h0p n SER 108 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2h0p n SER 109 N 4.63 0.00 0.31 -3.46 3.41 -1.26 -0.80 113.62 116.45 2h0p n SER 109 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.80 2h0p n SER 109 Cb 0.00 0.00 1.00 0.00 -0.26 0.00 0.00 64.21 64.95 2h0p n SER 109 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2h0p h ILE 110 N 0.00 0.13 -3.64 -1.33 2.10 -1.98 -3.42 117.51 109.37 2h0p h ILE 110 Ca 0.00 -0.20 -0.69 0.00 1.08 0.00 0.00 64.86 65.05 2h0p h ILE 110 Cb 0.00 1.17 -0.21 0.00 -1.09 0.00 0.00 36.82 36.69 2h0p h ILE 110 CO 0.00 0.02 -0.50 -0.83 -1.08 0.00 0.00 178.15 175.76 2h0p s GLY 111 N -4.16 1.94 0.00 8.18 0.00 0.02 -4.86 107.32 108.45 2h0p s GLY 111 Ca -0.03 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.19 2h0p s GLY 111 CO 0.48 0.79 0.14 0.28 0.00 0.00 0.00 173.10 174.79