#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ie2 h VAL 3 N 0.00 1.31 -3.50 -3.33 2.07 -1.99 -3.40 116.25 107.41 2ie2 h VAL 3 Ca 0.00 -1.28 -0.61 0.00 0.82 0.00 0.00 66.70 65.63 2ie2 h VAL 3 Cb 0.00 1.59 -0.11 0.00 -1.52 0.00 0.00 31.29 31.25 2ie2 h VAL 3 CO 0.00 0.40 0.34 -0.63 0.02 0.00 0.00 177.57 177.70 2ie2 s ILE 4 N -4.50 4.79 0.32 4.57 -1.09 -1.26 -4.99 121.20 119.03 2ie2 s ILE 4 Ca -0.13 0.95 -0.01 0.00 -2.23 0.00 0.00 60.65 59.24 2ie2 s ILE 4 Cb 0.08 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 2ie2 s ILE 4 CO 0.79 -0.33 0.53 -0.54 -1.23 0.00 0.00 174.94 174.16 2ie2 s LYS 5 N 2.97 3.52 0.34 2.79 -0.14 -1.26 -5.02 119.74 122.94 2ie2 s LYS 5 Ca 0.30 -0.27 0.02 0.00 -1.36 0.00 0.00 55.97 54.67 2ie2 s LYS 5 Cb -0.14 -2.68 0.62 0.00 -1.68 0.00 0.00 37.83 33.95 2ie2 s LYS 5 CO 0.15 0.19 1.99 -1.35 -0.76 0.00 0.00 175.35 175.56 2ie2 h PRO 6 N 1.08 0.86 -4.94 -1.68 0.11 -1.97 -3.41 132.00 122.06 2ie2 h PRO 6 Ca -0.49 -0.05 -0.61 0.00 0.11 0.00 0.00 66.00 64.96 2ie2 h PRO 6 Cb 1.21 -0.19 -0.34 0.00 0.11 0.00 0.00 31.00 31.79 2ie2 h PRO 6 CO 0.63 0.57 -0.85 -0.51 -0.21 0.00 0.00 178.00 177.63 2ie2 s ASP 7 N -6.35 2.57 0.00 -2.05 1.01 -1.26 -4.03 116.67 106.56 2ie2 s ASP 7 Ca -0.10 -0.46 0.00 0.00 0.71 0.00 0.00 52.55 52.70 2ie2 s ASP 7 Cb 0.18 -1.17 -0.00 0.00 1.01 0.00 0.00 42.92 42.94 2ie2 s ASP 7 CO 0.77 0.07 -0.02 -0.04 0.21 0.00 0.00 175.17 176.17 2ie2 s MET 8 N 0.70 0.14 0.54 8.23 -1.94 -0.24 -4.99 119.30 121.74 2ie2 s MET 8 Ca -0.12 -0.11 -0.14 0.00 -1.71 0.00 0.00 55.69 53.61 2ie2 s MET 8 Cb -0.16 -0.10 -0.06 0.00 2.01 0.00 0.00 34.83 36.52 2ie2 s MET 8 CO 0.03 0.02 0.98 0.21 -0.01 0.00 0.00 175.02 176.25 2ie2 s LYS 9 N -0.17 3.81 -0.07 2.03 2.20 -1.12 -0.60 119.74 125.82 2ie2 s LYS 9 Ca -0.01 0.83 0.02 0.00 -0.36 0.00 0.00 55.97 56.45 2ie2 s LYS 9 Cb -0.01 -2.14 0.02 0.00 -1.51 0.00 0.00 37.83 34.18 2ie2 s LYS 9 CO -0.00 -0.35 -0.11 0.42 -0.36 0.00 0.00 175.35 174.95 2ie2 s ILE 10 N -2.79 1.04 -0.08 5.43 1.01 0.61 -0.46 121.20 125.95 2ie2 s ILE 10 Ca 0.57 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.81 2ie2 s ILE 10 Cb -0.10 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.42 2ie2 s ILE 10 CO 0.39 0.34 -0.07 -0.54 0.00 0.00 0.00 174.94 175.06 2ie2 s LYS 11 N 0.82 1.32 0.06 2.79 1.02 0.50 -0.20 119.74 126.05 2ie2 s LYS 11 Ca -0.12 -0.22 0.02 0.00 0.02 0.00 0.00 55.97 55.68 2ie2 s LYS 11 Cb -0.15 -1.33 -0.03 0.00 -0.52 0.00 0.00 37.83 35.80 2ie2 s LYS 11 CO 0.02 -0.17 -0.08 -0.48 -0.92 0.00 0.00 175.35 173.72 2ie2 s LEU 12 N 1.35 2.34 -0.06 3.17 0.05 -0.29 -1.26 118.68 123.98 2ie2 s LEU 12 Ca -0.03 -0.70 0.01 0.00 0.05 0.00 0.00 54.13 53.47 2ie2 s LEU 12 Cb -0.14 -0.17 0.02 0.00 -2.05 0.00 0.00 46.19 43.85 2ie2 s LEU 12 CO -0.03 -0.27 -0.06 -0.60 -0.55 0.00 0.00 176.35 174.84 2ie2 s ARG 13 N -2.29 1.04 -0.17 1.48 3.52 -1.04 -1.34 118.95 120.15 2ie2 s ARG 13 Ca -0.02 -0.16 -0.05 0.00 -0.13 0.00 0.00 55.73 55.37 2ie2 s ARG 13 Cb -0.05 -1.03 -0.03 0.00 -1.56 0.00 0.00 34.95 32.28 2ie2 s ARG 13 CO -0.01 -0.10 0.00 1.41 -0.81 0.00 0.00 175.30 175.79 2ie2 s MET 14 N 1.04 3.75 -0.11 5.12 -2.45 0.42 -1.39 119.30 125.69 2ie2 s MET 14 Ca -0.09 -0.47 0.02 0.00 -1.25 0.00 0.00 55.69 53.90 2ie2 s MET 14 Cb -0.14 -3.04 -0.01 0.00 1.25 0.00 0.00 34.83 32.88 2ie2 s MET 14 CO -0.00 0.20 -0.16 -1.21 1.05 0.00 0.00 175.02 174.90 2ie2 s GLU 15 N 0.51 3.12 0.12 4.11 2.02 -0.56 -0.94 118.70 127.07 2ie2 s GLU 15 Ca -0.01 -0.73 -0.09 0.00 0.02 0.00 0.00 54.97 54.16 2ie2 s GLU 15 Cb -0.14 -2.50 0.03 0.00 0.10 0.00 0.00 34.13 31.62 2ie2 s GLU 15 CO 0.02 0.29 0.43 0.41 0.02 0.00 0.00 175.26 176.44 2ie2 n GLY 16 N 3.26 1.17 3.43 -1.39 0.00 -0.57 -1.71 105.19 109.38 2ie2 n GLY 16 Ca -0.18 -1.06 -0.15 0.00 0.00 0.00 0.00 46.02 44.64 2ie2 n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ie2 s ALA 17 N -1.48 -1.36 -0.11 4.61 0.00 -0.18 -0.93 121.76 122.32 2ie2 s ALA 17 Ca 0.09 1.24 0.01 0.00 0.00 0.00 0.00 51.96 53.30 2ie2 s ALA 17 Cb -0.02 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.67 2ie2 s ALA 17 CO 0.03 -0.29 -0.11 0.08 0.00 0.00 0.00 175.76 175.47 2ie2 s VAL 18 N -0.45 1.22 -1.49 0.00 1.01 -0.75 -1.01 120.40 118.93 2ie2 s VAL 18 Ca -0.06 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.34 2ie2 s VAL 18 Cb -0.03 -1.17 0.10 0.00 0.00 0.00 0.00 36.38 35.28 2ie2 s VAL 18 CO 0.04 0.39 0.75 0.59 0.00 0.00 0.00 175.10 176.87 2ie2 n ASN 19 N 4.52 -4.12 0.00 3.32 4.13 0.68 -1.14 115.26 122.65 2ie2 n ASN 19 Ca -0.17 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.41 2ie2 n ASN 19 Cb 0.51 -3.35 0.00 0.00 -1.54 0.00 0.00 39.78 35.40 2ie2 n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ie2 n GLY 20 N -1.42 1.63 3.55 7.41 0.00 -1.26 -5.02 105.19 110.07 2ie2 n GLY 20 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 2ie2 n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2ie2 s HIS 21 N -2.99 3.05 0.37 1.61 5.04 -0.29 -5.04 115.29 117.04 2ie2 s HIS 21 Ca 0.00 0.19 -0.24 0.00 -1.54 0.00 0.00 55.06 53.47 2ie2 s HIS 21 Cb 0.00 -3.47 -0.10 0.00 0.04 0.00 0.00 32.58 29.05 2ie2 s HIS 21 CO 0.00 -0.87 0.97 -1.25 -2.34 0.00 0.00 174.74 171.25 2ie2 s PRO 22 N 3.06 4.38 0.17 2.88 0.04 -1.26 -1.81 135.00 142.47 2ie2 s PRO 22 Ca 0.27 1.31 -0.19 0.00 0.04 0.00 0.00 61.00 62.44 2ie2 s PRO 22 Cb -0.13 -2.55 0.04 0.00 0.04 0.00 0.00 34.50 31.89 2ie2 s PRO 22 CO 0.20 0.09 0.52 -0.59 0.04 0.00 0.00 177.00 177.26 2ie2 s PHE 23 N -1.79 -0.25 -0.00 0.56 -0.12 -0.11 -4.24 117.98 112.03 2ie2 s PHE 23 Ca 0.55 -0.06 -0.00 0.00 -0.05 0.00 0.00 56.93 57.37 2ie2 s PHE 23 Cb -0.17 0.42 0.00 0.00 -0.63 0.00 0.00 43.02 42.64 2ie2 s PHE 23 CO 0.21 -0.86 0.01 0.00 -0.05 0.00 0.00 175.22 174.53 2ie2 s ALA 24 N -3.83 -0.03 -0.03 1.99 0.00 -0.83 -1.51 121.76 117.52 2ie2 s ALA 24 Ca 0.06 0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.07 2ie2 s ALA 24 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2ie2 s ALA 24 CO -0.07 -0.01 -0.11 0.42 0.00 0.00 0.00 175.76 175.99 2ie2 s ILE 25 N -0.01 0.98 0.05 0.00 1.01 -0.12 -0.60 121.20 122.51 2ie2 s ILE 25 Ca -0.00 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.21 2ie2 s ILE 25 Cb -0.00 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 2ie2 s ILE 25 CO 0.00 0.30 0.06 -1.61 0.00 0.00 0.00 174.94 173.69 2ie2 s GLU 26 N 0.20 2.89 -0.06 2.79 0.41 -0.38 -0.43 118.70 124.11 2ie2 s GLU 26 Ca -0.04 -0.64 -0.08 0.00 -0.41 0.00 0.00 54.97 53.80 2ie2 s GLU 26 Cb -0.10 -2.74 0.02 0.00 -1.78 0.00 0.00 34.13 29.53 2ie2 s GLU 26 CO 0.01 0.59 0.21 0.20 -0.49 0.00 0.00 175.26 175.79 2ie2 s GLY 27 N -2.08 -0.13 -0.04 -1.39 0.00 -0.45 -0.44 107.32 102.80 2ie2 s GLY 27 Ca 0.26 0.46 0.02 0.00 0.00 0.00 0.00 44.72 45.46 2ie2 s GLY 27 CO 0.18 0.36 -0.08 0.14 0.00 0.00 0.00 173.10 173.70 2ie2 s VAL 28 N -0.27 0.74 0.35 1.40 1.01 -0.72 -1.14 120.40 121.77 2ie2 s VAL 28 Ca -0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 2ie2 s VAL 28 Cb -0.03 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.67 2ie2 s VAL 28 CO 0.01 0.25 0.50 -0.83 0.00 0.00 0.00 175.10 175.03 2ie2 s GLY 29 N 0.48 1.44 -0.01 4.51 0.00 0.71 -0.73 107.32 113.73 2ie2 s GLY 29 Ca -0.08 -1.48 0.01 0.00 0.00 0.00 0.00 44.72 43.18 2ie2 s GLY 29 CO 0.01 -0.95 -0.03 -2.27 0.00 0.00 0.00 173.10 169.85 2ie2 s LEU 30 N -3.23 1.88 0.10 0.66 2.96 -0.31 -0.28 118.68 120.45 2ie2 s LEU 30 Ca 0.29 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 2ie2 s LEU 30 Cb -0.01 -0.21 -0.04 0.00 0.50 0.00 0.00 46.19 46.43 2ie2 s LEU 30 CO 0.20 0.03 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.39 2ie2 s GLY 31 N 0.08 0.79 -0.47 7.98 0.00 0.23 -1.39 107.32 114.54 2ie2 s GLY 31 Ca -0.00 -1.37 0.04 0.00 0.00 0.00 0.00 44.72 43.39 2ie2 s GLY 31 CO -0.00 -1.43 0.21 0.54 0.00 0.00 0.00 173.10 172.42 2ie2 s LYS 32 N -3.88 1.75 0.34 2.90 1.02 0.22 -1.08 119.74 121.02 2ie2 s LYS 32 Ca 0.14 -2.35 0.03 0.00 0.02 0.00 0.00 55.97 53.80 2ie2 s LYS 32 Cb 0.06 -3.13 0.64 0.00 -0.52 0.00 0.00 37.83 34.88 2ie2 s LYS 32 CO -0.04 -1.08 1.97 -1.35 -0.92 0.00 0.00 175.35 173.93 2ie2 h PRO 33 N 6.79 0.85 -0.08 -1.68 0.11 -1.78 0.49 132.00 136.70 2ie2 h PRO 33 Ca -0.06 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 65.80 2ie2 h PRO 33 Cb 0.92 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 2ie2 h PRO 33 CO 0.62 0.56 -0.77 0.74 -0.21 0.00 0.00 178.00 178.94 2ie2 h PHE 34 N 0.87 0.64 0.00 0.65 -1.00 -1.84 -3.14 116.94 113.12 2ie2 h PHE 34 Ca 0.29 -0.29 -0.03 0.00 2.81 0.00 0.00 57.97 60.74 2ie2 h PHE 34 Cb 0.07 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.53 2ie2 h PHE 34 CO -0.00 1.07 -0.16 0.93 -1.61 0.00 0.00 178.31 178.54 2ie2 h GLU 35 N 0.31 0.00 -0.55 1.51 5.08 -1.74 -3.37 114.58 115.83 2ie2 h GLU 35 Ca -0.04 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2ie2 h GLU 35 Cb 1.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 2ie2 h GLU 35 CO 0.14 0.16 -0.11 0.41 -1.00 0.00 0.00 179.01 178.62 2ie2 n GLY 36 N 0.92 0.28 3.31 -3.84 0.00 0.11 -4.33 105.19 101.65 2ie2 n GLY 36 Ca 0.03 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 2ie2 n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ie2 s LYS 37 N -3.89 1.76 -0.04 1.61 1.02 -1.05 -0.50 119.74 118.65 2ie2 s LYS 37 Ca 0.00 -1.02 -0.22 0.00 0.02 0.00 0.00 55.97 54.75 2ie2 s LYS 37 Cb 0.00 -1.86 0.04 0.00 -0.52 0.00 0.00 37.83 35.49 2ie2 s LYS 37 CO 0.00 0.49 0.48 1.14 -0.92 0.00 0.00 175.35 176.54 2ie2 s GLN 38 N -1.06 0.84 0.05 1.68 -2.07 -0.68 0.73 119.66 119.15 2ie2 s GLN 38 Ca 0.10 0.05 0.02 0.00 -1.82 0.00 0.00 55.36 53.71 2ie2 s GLN 38 Cb -0.10 0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 32.18 2ie2 s GLN 38 CO 0.01 -0.24 -0.07 -1.54 -1.32 0.00 0.00 175.29 172.14 2ie2 s SER 39 N -1.19 0.78 0.05 12.60 1.04 -0.49 -1.52 113.70 124.98 2ie2 s SER 39 Ca -0.12 -0.65 -0.16 0.00 0.48 0.00 0.00 55.95 55.50 2ie2 s SER 39 Cb -0.03 0.07 0.03 0.00 0.10 0.00 0.00 66.02 66.19 2ie2 s SER 39 CO 0.07 -0.29 0.37 0.00 0.98 0.00 0.00 173.24 174.37 2ie2 s MET 40 N -2.11 0.89 -0.15 4.02 0.23 0.24 -1.16 119.30 121.26 2ie2 s MET 40 Ca -0.06 -0.44 -0.02 0.00 -1.03 0.00 0.00 55.69 54.14 2ie2 s MET 40 Cb -0.06 0.39 -0.02 0.00 -1.53 0.00 0.00 34.83 33.61 2ie2 s MET 40 CO -0.01 -0.30 -0.07 -0.51 -2.03 0.00 0.00 175.02 172.09 2ie2 s ASP 41 N -2.08 4.50 -0.02 -1.18 1.01 0.10 -0.58 116.67 118.41 2ie2 s ASP 41 Ca -0.05 -0.21 0.08 0.00 0.71 0.00 0.00 52.55 53.08 2ie2 s ASP 41 Cb -0.01 -1.72 -0.02 0.00 1.01 0.00 0.00 42.92 42.18 2ie2 s ASP 41 CO -0.03 0.16 -0.25 -0.76 0.21 0.00 0.00 175.17 174.49 2ie2 s LEU 42 N 0.41 2.05 -0.09 1.23 1.43 0.33 -1.76 118.68 122.28 2ie2 s LEU 42 Ca -0.06 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.58 2ie2 s LEU 42 Cb -0.15 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.77 2ie2 s LEU 42 CO 0.04 0.30 -0.09 -0.54 0.23 0.00 0.00 176.35 176.29 2ie2 s LYS 43 N -0.54 1.56 -0.50 1.70 1.02 0.42 -1.73 119.74 121.66 2ie2 s LYS 43 Ca 0.08 -0.32 -0.28 0.00 0.02 0.00 0.00 55.97 55.48 2ie2 s LYS 43 Cb -0.10 -1.45 0.00 0.00 -0.52 0.00 0.00 37.83 35.76 2ie2 s LYS 43 CO -0.00 -0.12 1.55 0.08 -0.92 0.00 0.00 175.35 175.94 2ie2 s VAL 44 N 1.18 3.69 -0.05 3.17 1.01 -0.78 -1.25 120.40 127.36 2ie2 s VAL 44 Ca -0.05 0.61 -0.20 0.00 0.00 0.00 0.00 61.98 62.34 2ie2 s VAL 44 Cb -0.14 -4.18 -0.31 0.00 0.00 0.00 0.00 36.38 31.74 2ie2 s VAL 44 CO -0.02 -0.93 0.84 0.07 0.00 0.00 0.00 175.10 175.06 2ie2 h LYS 45 N 11.93 0.32 -4.42 2.72 -0.00 -1.21 -3.46 116.57 122.44 2ie2 h LYS 45 Ca -0.28 -0.56 -0.23 0.00 -0.00 0.00 0.00 60.65 59.58 2ie2 h LYS 45 Cb 1.12 0.21 -0.20 0.00 -0.00 0.00 0.00 32.23 33.36 2ie2 h LYS 45 CO 1.14 1.27 -0.72 -1.21 -0.00 0.00 0.00 179.45 179.93 2ie2 s GLU 46 N -2.46 0.52 -0.03 0.07 2.02 -0.86 -4.88 118.70 113.08 2ie2 s GLU 46 Ca -0.14 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.02 2ie2 s GLU 46 Cb 0.02 -0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.09 2ie2 s GLU 46 CO 0.84 0.01 0.00 0.41 0.02 0.00 0.00 175.26 176.53 2ie2 n GLY 47 N 1.21 0.43 3.92 -1.39 0.00 -1.26 -1.97 105.19 106.13 2ie2 n GLY 47 Ca -0.21 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 44.76 2ie2 n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ie2 s GLY 48 N -2.71 1.69 0.35 -0.02 0.00 -1.26 -4.03 107.32 101.33 2ie2 s GLY 48 Ca 0.00 -0.73 -0.27 0.00 0.00 0.00 0.00 44.72 43.73 2ie2 s GLY 48 CO 0.00 -0.65 1.08 2.56 0.00 0.00 0.00 173.10 176.10 2ie2 s PRO 49 N -3.73 4.36 0.11 2.90 0.04 -1.26 -5.09 135.00 132.33 2ie2 s PRO 49 Ca 0.41 1.68 -0.31 0.00 0.04 0.00 0.00 61.00 62.82 2ie2 s PRO 49 Cb -0.10 -2.85 -0.09 0.00 0.04 0.00 0.00 34.50 31.50 2ie2 s PRO 49 CO 0.32 -0.00 1.56 -0.51 0.04 0.00 0.00 177.00 178.40 2ie2 s LEU 50 N -2.09 4.36 -0.16 -3.56 1.43 -1.26 -4.90 118.68 112.52 2ie2 s LEU 50 Ca 0.52 2.48 0.02 0.00 -1.03 0.00 0.00 54.13 56.11 2ie2 s LEU 50 Cb -0.27 -3.58 0.24 0.00 0.03 0.00 0.00 46.19 42.61 2ie2 s LEU 50 CO 0.35 -0.81 1.31 -0.81 0.23 0.00 0.00 176.35 176.61 2ie2 n PRO 51 N 4.69 1.49 -3.83 1.29 -0.04 -1.26 -4.85 135.00 132.48 2ie2 n PRO 51 Ca 0.14 -1.07 -0.10 0.00 -0.04 0.00 0.00 63.50 62.44 2ie2 n PRO 51 Cb 0.40 -1.44 -0.05 0.00 -0.04 0.00 0.00 33.50 32.37 2ie2 n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2ie2 s PHE 52 N -1.19 0.10 0.06 0.54 -0.12 -1.26 -4.70 117.98 111.40 2ie2 s PHE 52 Ca 0.20 -0.45 -0.30 0.00 -0.05 0.00 0.00 56.93 56.33 2ie2 s PHE 52 Cb 0.17 0.21 -0.09 0.00 -0.63 0.00 0.00 43.02 42.68 2ie2 s PHE 52 CO 0.04 -0.84 1.84 0.00 -0.05 0.00 0.00 175.22 176.21 2ie2 s ALA 53 N -3.91 3.66 0.48 1.99 0.00 0.73 -4.88 121.76 119.83 2ie2 s ALA 53 Ca 0.12 1.30 0.16 0.00 0.00 0.00 0.00 51.96 53.54 2ie2 s ALA 53 Cb 0.01 -3.79 1.17 0.00 0.00 0.00 0.00 23.12 20.51 2ie2 s ALA 53 CO -0.02 -1.38 2.06 -0.92 0.00 0.00 0.00 175.76 175.51 2ie2 h TYR 54 N 9.52 0.20 -0.59 0.00 3.20 -1.94 -2.98 116.97 124.37 2ie2 h TYR 54 Ca -0.46 0.00 0.17 0.00 3.14 0.00 0.00 58.73 61.58 2ie2 h TYR 54 Cb 1.22 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 39.40 2ie2 h TYR 54 CO 0.87 0.11 0.45 -0.44 -1.64 0.00 0.00 178.16 177.51 2ie2 h ASP 55 N 0.20 0.00 0.59 -2.11 3.32 -1.97 -0.58 116.42 115.88 2ie2 h ASP 55 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2ie2 h ASP 55 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2ie2 h ASP 55 CO -0.03 0.00 0.00 0.16 -1.72 0.00 0.00 179.24 177.65 2ie2 h ILE 56 N 0.00 0.00 0.00 0.35 3.07 -1.93 -2.94 117.51 116.06 2ie2 h ILE 56 Ca 0.28 -0.27 -0.16 0.00 1.55 0.00 0.00 64.86 66.26 2ie2 h ILE 56 Cb 1.18 1.15 -0.03 0.00 -0.27 0.00 0.00 36.82 38.85 2ie2 h ILE 56 CO -0.00 0.00 -1.54 0.18 -1.05 0.00 0.00 178.15 175.74 2ie2 n LEU 57 N -2.81 0.70 -0.21 0.16 4.77 -0.22 -4.63 117.00 114.76 2ie2 n LEU 57 Ca -0.00 0.31 -0.05 0.00 -0.03 0.00 0.00 56.01 56.23 2ie2 n LEU 57 Cb 0.20 0.10 0.11 0.00 -2.33 0.00 0.00 43.42 41.50 2ie2 n LEU 57 CO 0.22 0.15 0.97 0.71 -1.33 0.00 0.00 177.39 178.10 2ie2 h THR 58 N 0.00 1.25 0.00 -5.08 1.35 -1.57 -1.39 112.91 107.47 2ie2 h THR 58 Ca -0.18 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 2ie2 h THR 58 Cb 1.57 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2ie2 h THR 58 CO 0.04 0.35 0.00 0.35 -0.25 0.00 0.00 175.52 176.00 2ie2 n THR 59 N -4.25 0.18 0.00 6.82 -2.24 -1.26 -2.34 114.28 111.20 2ie2 n THR 59 Ca 0.05 0.05 -0.16 0.00 -2.27 0.00 0.00 64.05 61.72 2ie2 n THR 59 Cb 0.24 -0.64 -0.14 0.00 -2.10 0.00 0.00 70.33 67.69 2ie2 n THR 59 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2ie2 h VAL 60 N 0.00 0.77 0.00 2.28 2.07 -1.55 -3.45 116.25 116.37 2ie2 h VAL 60 Ca 0.00 -2.53 -0.28 0.00 0.82 0.00 0.00 66.70 64.71 2ie2 h VAL 60 Cb 0.20 2.50 0.01 0.00 -1.52 0.00 0.00 31.29 32.48 2ie2 h VAL 60 CO 0.00 0.73 2.15 0.49 0.02 0.00 0.00 177.57 180.95 2ie2 n PHE 61 N -3.30 0.99 0.00 1.57 0.99 -0.99 -5.01 117.46 111.71 2ie2 n PHE 61 Ca -0.24 -1.57 0.00 0.00 -0.00 0.00 0.00 57.45 55.64 2ie2 n PHE 61 Cb 1.05 -1.39 0.00 0.00 -1.00 0.00 0.00 39.48 38.14 2ie2 n PHE 61 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2ie2 n ASN 65 N 4.35 0.00 0.00 4.37 5.15 -1.26 -5.13 115.26 122.74 2ie2 n ASN 65 Ca 0.33 0.00 0.11 0.00 -0.60 0.00 0.00 54.58 54.42 2ie2 n ASN 65 Cb 0.11 0.00 0.65 0.00 -0.53 0.00 0.00 39.78 40.01 2ie2 n ASN 65 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2ie2 n ARG 66 N 0.00 0.86 0.25 1.20 3.00 -1.26 -1.89 116.66 118.82 2ie2 n ARG 66 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 57.96 2ie2 n ARG 66 Cb 0.00 -1.40 0.68 0.00 0.00 0.00 0.00 32.46 31.74 2ie2 n ARG 66 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 2ie2 h VAL 67 N 0.00 0.67 -1.36 5.15 3.04 -1.94 -3.23 116.25 118.58 2ie2 h VAL 67 Ca 0.00 -0.58 -0.75 0.00 -1.01 0.00 0.00 66.70 64.36 2ie2 h VAL 67 Cb 0.00 1.36 -0.15 0.00 -2.01 0.00 0.00 31.29 30.49 2ie2 h VAL 67 CO 0.00 0.14 2.11 0.49 -1.01 0.00 0.00 177.57 179.30 2ie2 n PHE 68 N -3.75 2.78 -3.69 3.17 3.01 -0.79 -4.59 117.46 113.59 2ie2 n PHE 68 Ca -0.02 -2.79 -0.10 0.00 1.01 0.00 0.00 57.45 55.55 2ie2 n PHE 68 Cb 0.25 -1.88 -0.10 0.00 -0.01 0.00 0.00 39.48 37.73 2ie2 n PHE 68 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ie2 s ALA 69 N -0.24 -1.12 0.02 4.37 0.00 -1.22 -4.31 121.76 119.26 2ie2 s ALA 69 Ca 0.44 1.57 -0.30 0.00 0.00 0.00 0.00 51.96 53.67 2ie2 s ALA 69 Cb 0.12 -0.95 -0.06 0.00 0.00 0.00 0.00 23.12 22.23 2ie2 s ALA 69 CO -0.02 -0.27 1.48 0.21 0.00 0.00 0.00 175.76 177.16 2ie2 s LYS 70 N 1.28 4.26 -0.11 0.00 2.36 -0.64 -4.57 119.74 122.33 2ie2 s LYS 70 Ca -0.08 2.09 0.01 0.00 -2.55 0.00 0.00 55.97 55.43 2ie2 s LYS 70 Cb -0.07 -3.57 -0.02 0.00 -1.05 0.00 0.00 37.83 33.11 2ie2 s LYS 70 CO -0.12 -0.62 -0.12 0.71 1.55 0.00 0.00 175.35 176.75 2ie2 s TYR 71 N 2.45 2.81 0.80 4.03 1.51 -1.26 0.17 117.35 127.85 2ie2 s TYR 71 Ca 0.67 -0.43 -0.10 0.00 -1.01 0.00 0.00 57.07 56.19 2ie2 s TYR 71 Cb -0.34 -1.79 0.07 0.00 -0.11 0.00 0.00 41.96 39.79 2ie2 s TYR 71 CO 0.28 -0.05 1.10 -2.14 -1.11 0.00 0.00 175.55 173.63 2ie2 s PRO 72 N -0.03 2.06 0.47 -1.71 0.02 -1.26 -4.95 135.00 129.60 2ie2 s PRO 72 Ca -0.03 1.20 0.21 0.00 0.02 0.00 0.00 61.00 62.41 2ie2 s PRO 72 Cb -0.14 -1.87 1.17 0.00 0.02 0.00 0.00 34.50 33.68 2ie2 s PRO 72 CO 0.04 -1.80 1.99 1.05 -0.33 0.00 0.00 177.00 177.95 2ie2 h GLU 73 N -1.24 0.00 -0.13 5.54 9.09 -2.00 -3.00 114.58 122.83 2ie2 h GLU 73 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.97 2ie2 h GLU 73 Cb 1.24 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.34 2ie2 h GLU 73 CO 0.50 0.19 0.00 0.27 0.05 0.00 0.00 179.01 180.02 2ie2 n ASN 74 N -3.87 1.87 -4.30 3.06 6.94 -1.26 -4.77 115.26 112.93 2ie2 n ASN 74 Ca -0.02 -1.69 -0.33 0.00 -0.02 0.00 0.00 54.58 52.52 2ie2 n ASN 74 Cb 0.28 -0.08 -0.15 0.00 -2.36 0.00 0.00 39.78 37.47 2ie2 n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2ie2 s ILE 75 N -1.84 2.64 0.10 1.53 1.01 -1.14 -5.05 121.20 118.46 2ie2 s ILE 75 Ca 0.34 -0.81 -0.31 0.00 0.00 0.00 0.00 60.65 59.88 2ie2 s ILE 75 Cb 0.19 -2.08 -0.10 0.00 0.01 0.00 0.00 42.46 40.49 2ie2 s ILE 75 CO 0.29 0.53 1.76 -0.69 0.00 0.00 0.00 174.94 176.83 2ie2 s VAL 76 N 0.44 2.74 -0.80 2.92 1.01 -1.26 -4.68 120.40 120.75 2ie2 s VAL 76 Ca -0.13 0.23 -0.18 0.00 0.00 0.00 0.00 61.98 61.90 2ie2 s VAL 76 Cb -0.16 -3.15 0.13 0.00 0.00 0.00 0.00 36.38 33.20 2ie2 s VAL 76 CO 0.06 -0.00 0.95 -0.62 0.00 0.00 0.00 175.10 175.48 2ie2 s ASP 77 N 2.57 6.50 0.41 3.32 -1.08 -1.26 -4.63 116.67 122.50 2ie2 s ASP 77 Ca 0.78 -1.89 0.10 0.00 -0.52 0.00 0.00 52.55 51.02 2ie2 s ASP 77 Cb -0.43 -2.35 0.92 0.00 -1.46 0.00 0.00 42.92 39.60 2ie2 s ASP 77 CO 0.35 -1.03 1.99 0.22 0.52 0.00 0.00 175.17 177.21 2ie2 h TYR 78 N 8.82 0.53 0.04 -5.34 3.20 -1.92 -2.54 116.97 119.75 2ie2 h TYR 78 Ca -0.01 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 2ie2 h TYR 78 Cb 1.05 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.14 2ie2 h TYR 78 CO 1.04 0.28 -0.56 0.74 -1.64 0.00 0.00 178.16 178.02 2ie2 h PHE 79 N 0.52 0.13 -0.00 -3.82 -1.00 -1.90 -2.98 116.94 107.89 2ie2 h PHE 79 Ca 0.26 -0.10 -0.07 0.00 2.81 0.00 0.00 57.97 60.88 2ie2 h PHE 79 Cb 0.36 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 2ie2 h PHE 79 CO -0.00 1.22 -0.33 0.87 -1.61 0.00 0.00 178.31 178.46 2ie2 h LYS 80 N -0.82 0.00 -0.42 1.51 1.57 -1.90 -2.39 116.57 114.12 2ie2 h LYS 80 Ca -0.13 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2ie2 h LYS 80 Cb 1.25 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 2ie2 h LYS 80 CO -0.02 0.33 0.24 1.96 -0.57 0.00 0.00 179.45 181.39 2ie2 h GLN 81 N 0.00 0.57 0.00 3.15 4.20 -1.52 -3.17 115.11 118.34 2ie2 h GLN 81 Ca -0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2ie2 h GLN 81 Cb 0.58 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.24 2ie2 h GLN 81 CO 0.04 0.42 0.00 0.66 -0.67 0.00 0.00 178.83 179.28 2ie2 h SER 82 N 0.58 0.00 -3.43 1.46 4.64 -1.26 -3.45 113.55 112.09 2ie2 h SER 82 Ca 0.15 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.97 2ie2 h SER 82 Cb 0.01 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 2ie2 h SER 82 CO -0.03 0.00 0.01 -0.36 -0.87 0.00 0.00 176.83 175.59 2ie2 s PHE 83 N -3.46 3.50 -0.57 4.77 0.40 -1.20 -0.46 117.98 120.96 2ie2 s PHE 83 Ca 0.04 0.79 0.24 0.00 -0.60 0.00 0.00 56.93 57.40 2ie2 s PHE 83 Cb 0.08 -2.25 0.92 0.00 0.51 0.00 0.00 43.02 42.29 2ie2 s PHE 83 CO 0.55 -0.06 1.74 -0.35 0.70 0.00 0.00 175.22 177.79 2ie2 n PRO 84 N -1.55 0.22 -0.19 0.24 -0.04 -1.26 -4.83 135.00 127.58 2ie2 n PRO 84 Ca -0.00 0.35 -0.07 0.00 -0.04 0.00 0.00 63.50 63.73 2ie2 n PRO 84 Cb 0.55 -1.84 0.02 0.00 -0.04 0.00 0.00 33.50 32.18 2ie2 n PRO 84 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2ie2 h GLU 85 N 0.00 0.75 0.00 0.54 3.07 -1.91 -3.36 114.58 113.67 2ie2 h GLU 85 Ca 0.00 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 58.77 2ie2 h GLU 85 Cb 0.49 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 2ie2 h GLU 85 CO 0.00 0.58 0.00 0.41 -1.40 0.00 0.00 179.01 178.60 2ie2 n GLY 86 N -1.03 -1.69 3.75 -3.84 0.00 0.39 -4.66 105.19 98.10 2ie2 n GLY 86 Ca 0.03 -2.05 -0.08 0.00 0.00 0.00 0.00 46.02 43.92 2ie2 n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ie2 s TYR 87 N 0.00 -0.06 0.16 1.61 -0.85 -1.02 -1.89 117.35 115.29 2ie2 s TYR 87 Ca 0.00 -0.36 0.07 0.00 -0.52 0.00 0.00 57.07 56.25 2ie2 s TYR 87 Cb 0.00 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.84 2ie2 s TYR 87 CO 0.00 -1.14 -0.14 -1.54 -1.52 0.00 0.00 175.55 171.21 2ie2 s SER 88 N -2.94 2.22 0.08 -0.18 1.04 -0.23 -1.08 113.70 112.62 2ie2 s SER 88 Ca 0.13 -0.91 0.02 0.00 0.48 0.00 0.00 55.95 55.68 2ie2 s SER 88 Cb -0.04 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 2ie2 s SER 88 CO 0.06 -0.17 -0.08 -1.66 0.98 0.00 0.00 173.24 172.37 2ie2 s TRP 89 N -2.57 0.87 0.07 5.02 1.48 -0.38 -0.30 118.94 123.13 2ie2 s TRP 89 Ca 0.15 -0.70 0.07 0.00 -1.06 0.00 0.00 56.10 54.56 2ie2 s TRP 89 Cb -0.02 -0.50 -0.03 0.00 -1.16 0.00 0.00 33.47 31.75 2ie2 s TRP 89 CO 0.04 -0.08 -0.19 -1.21 -4.06 0.00 0.00 176.95 171.44 2ie2 s GLU 90 N -2.77 1.16 -0.14 3.25 2.02 -0.54 -1.57 118.70 120.11 2ie2 s GLU 90 Ca 0.03 -1.03 -0.10 0.00 0.02 0.00 0.00 54.97 53.89 2ie2 s GLU 90 Cb -0.02 -1.33 0.04 0.00 0.10 0.00 0.00 34.13 32.92 2ie2 s GLU 90 CO -0.02 0.32 0.35 0.50 0.02 0.00 0.00 175.26 176.43 2ie2 s ARG 91 N -1.57 0.37 -0.13 1.61 3.52 0.18 -0.54 118.95 122.40 2ie2 s ARG 91 Ca 0.05 0.56 -0.05 0.00 -0.13 0.00 0.00 55.73 56.17 2ie2 s ARG 91 Cb -0.09 0.10 -0.04 0.00 -1.56 0.00 0.00 34.95 33.36 2ie2 s ARG 91 CO 0.03 -0.09 0.03 0.45 -0.81 0.00 0.00 175.30 174.91 2ie2 s SER 92 N 0.62 5.46 -0.30 -2.12 0.15 -0.62 -1.11 113.70 115.78 2ie2 s SER 92 Ca -0.04 0.13 0.03 0.00 0.70 0.00 0.00 55.95 56.78 2ie2 s SER 92 Cb -0.05 -1.75 0.08 0.00 -1.71 0.00 0.00 66.02 62.59 2ie2 s SER 92 CO -0.04 0.29 -0.01 -0.04 1.20 0.00 0.00 173.24 174.64 2ie2 s MET 93 N -0.35 1.68 -0.46 5.44 -1.94 0.11 -1.16 119.30 122.62 2ie2 s MET 93 Ca 0.08 -1.53 -0.12 0.00 -1.71 0.00 0.00 55.69 52.41 2ie2 s MET 93 Cb -0.12 -2.93 0.09 0.00 2.01 0.00 0.00 34.83 33.88 2ie2 s MET 93 CO 0.02 -0.78 0.34 1.21 -0.01 0.00 0.00 175.02 175.80 2ie2 s ASN 94 N 1.09 5.88 0.43 3.03 3.84 -0.26 -1.22 114.94 127.72 2ie2 s ASN 94 Ca 0.02 -1.52 -0.17 0.00 0.21 0.00 0.00 52.86 51.40 2ie2 s ASN 94 Cb -0.19 -2.08 -0.09 0.00 -0.55 0.00 0.00 41.25 38.33 2ie2 s ASN 94 CO -0.08 -0.63 0.89 -0.31 -2.79 0.00 0.00 177.10 174.18 2ie2 s TYR 95 N 1.51 3.39 0.42 0.43 1.51 0.04 -1.16 117.35 123.49 2ie2 s TYR 95 Ca 0.04 1.41 0.32 0.00 -1.01 0.00 0.00 57.07 57.82 2ie2 s TYR 95 Cb -0.25 -2.71 1.65 0.00 -0.11 0.00 0.00 41.96 40.54 2ie2 s TYR 95 CO 0.03 -0.14 2.13 1.05 -1.11 0.00 0.00 175.55 177.51 2ie2 h GLU 96 N 1.61 0.00 -0.61 -0.62 4.11 -1.43 -1.46 114.58 116.18 2ie2 h GLU 96 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2ie2 h GLU 96 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2ie2 h GLU 96 CO 0.62 0.07 0.00 -0.40 0.07 0.00 0.00 179.01 179.37 2ie2 n ASP 97 N -3.45 3.50 0.00 3.06 5.75 -1.26 -4.94 116.55 119.21 2ie2 n ASP 97 Ca -0.02 -2.16 0.00 0.00 -0.01 0.00 0.00 54.79 52.61 2ie2 n ASP 97 Cb 0.21 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 2ie2 n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ie2 n GLY 98 N 1.24 0.60 3.73 6.12 0.00 -0.55 -4.69 105.19 111.64 2ie2 n GLY 98 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2ie2 n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ie2 s GLY 99 N -1.61 1.88 -0.08 -0.02 0.00 -1.21 -4.70 107.32 101.57 2ie2 s GLY 99 Ca 0.00 1.30 0.01 0.00 0.00 0.00 0.00 44.72 46.03 2ie2 s GLY 99 CO 0.00 2.46 -0.08 -0.42 0.00 0.00 0.00 173.10 175.06 2ie2 s ILE 100 N 0.79 0.93 -0.18 0.90 1.01 -0.56 -0.78 121.20 123.30 2ie2 s ILE 100 Ca 0.66 -0.29 -0.03 0.00 0.00 0.00 0.00 60.65 60.98 2ie2 s ILE 100 Cb -0.42 -0.92 -0.02 0.00 0.01 0.00 0.00 42.46 41.12 2ie2 s ILE 100 CO 0.35 0.33 -0.06 0.00 0.00 0.00 0.00 174.94 175.55 2ie2 s ASN 102 N 0.89 5.62 0.03 0.00 0.01 0.35 0.04 114.94 121.87 2ie2 s ASN 102 Ca -0.01 0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.27 2ie2 s ASN 102 Cb -0.15 -1.91 -0.02 0.00 0.41 0.00 0.00 41.25 39.58 2ie2 s ASN 102 CO 0.01 0.22 -0.06 0.00 -1.51 0.00 0.00 177.10 175.76 2ie2 s ALA 103 N 0.09 0.43 0.07 0.60 0.00 -0.26 -0.46 121.76 122.22 2ie2 s ALA 103 Ca 0.05 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.37 2ie2 s ALA 103 Cb -0.12 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 2ie2 s ALA 103 CO 0.01 -0.05 -0.11 0.95 0.00 0.00 0.00 175.76 176.55 2ie2 s THR 104 N -1.33 0.91 -0.03 0.00 -4.23 -0.39 -0.64 115.64 109.93 2ie2 s THR 104 Ca -0.11 -1.32 -0.01 0.00 -1.18 0.00 0.00 61.69 59.07 2ie2 s THR 104 Cb -0.10 -1.01 0.03 0.00 1.34 0.00 0.00 72.50 72.77 2ie2 s THR 104 CO -0.00 -0.35 0.03 0.21 -0.54 0.00 0.00 174.62 173.98 2ie2 s ASN 105 N -1.86 0.55 -0.36 3.99 2.47 -0.61 -1.78 114.94 117.34 2ie2 s ASN 105 Ca -0.03 0.04 -0.11 0.00 0.42 0.00 0.00 52.86 53.18 2ie2 s ASN 105 Cb -0.08 -0.14 0.01 0.00 -1.45 0.00 0.00 41.25 39.59 2ie2 s ASN 105 CO 0.01 -0.17 0.20 -0.62 -3.72 0.00 0.00 177.10 172.80 2ie2 s ASP 106 N 1.47 5.72 -0.26 -4.21 -1.08 -0.61 -1.25 116.67 116.45 2ie2 s ASP 106 Ca -0.04 -0.81 -0.07 0.00 -0.52 0.00 0.00 52.55 51.11 2ie2 s ASP 106 Cb -0.13 -2.03 -0.02 0.00 -1.46 0.00 0.00 42.92 39.28 2ie2 s ASP 106 CO -0.03 -0.32 0.07 -0.63 0.52 0.00 0.00 175.17 174.78 2ie2 s ILE 107 N 1.59 4.23 0.47 4.11 1.01 -0.24 -1.86 121.20 130.51 2ie2 s ILE 107 Ca 0.03 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 60.42 2ie2 s ILE 107 Cb -0.18 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 2ie2 s ILE 107 CO 0.07 0.28 0.02 0.42 0.00 0.00 0.00 174.94 175.73 2ie2 s THR 108 N 1.59 1.27 -0.10 2.92 -4.23 -0.44 -2.45 115.64 114.20 2ie2 s THR 108 Ca 0.06 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.59 2ie2 s THR 108 Cb -0.16 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.30 2ie2 s THR 108 CO 0.03 0.00 -0.15 -0.22 -0.54 0.00 0.00 174.62 173.75 2ie2 s LEU 109 N -3.79 1.70 -0.44 4.79 2.96 -1.26 -0.97 118.68 121.68 2ie2 s LEU 109 Ca 0.16 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.65 2ie2 s LEU 109 Cb 0.04 -1.03 0.12 0.00 0.50 0.00 0.00 46.19 45.82 2ie2 s LEU 109 CO 0.08 0.02 0.23 -0.62 -1.32 0.00 0.00 176.35 174.75 2ie2 s ASP 110 N 0.89 5.16 1.63 3.68 -1.08 0.54 -4.96 116.67 122.52 2ie2 s ASP 110 Ca -0.09 -2.23 0.00 0.00 -0.52 0.00 0.00 52.55 49.71 2ie2 s ASP 110 Cb -0.15 -1.80 0.00 0.00 -1.46 0.00 0.00 42.92 39.50 2ie2 s ASP 110 CO 0.00 -0.48 0.00 0.61 0.52 0.00 0.00 175.17 175.82 2ie2 n GLY 111 N 4.31 3.12 1.23 2.66 0.00 -1.26 -1.75 105.19 113.50 2ie2 n GLY 111 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2ie2 n GLY 111 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ie2 n ASP 112 N 9.51 4.35 -4.32 1.61 8.00 -1.26 -4.95 116.55 129.50 2ie2 n ASP 112 Ca 0.00 -2.74 -0.34 0.00 0.71 0.00 0.00 54.79 52.42 2ie2 n ASP 112 Cb 0.00 -0.54 -0.14 0.00 -0.02 0.00 0.00 41.12 40.42 2ie2 n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ie2 s TYR 114 N 1.10 3.42 -0.16 0.00 1.51 0.39 -0.34 117.35 123.27 2ie2 s TYR 114 Ca 0.01 1.56 0.02 0.00 -1.01 0.00 0.00 57.07 57.65 2ie2 s TYR 114 Cb -0.15 -3.41 0.01 0.00 -0.11 0.00 0.00 41.96 38.30 2ie2 s TYR 114 CO -0.01 -1.03 -0.20 0.42 -1.11 0.00 0.00 175.55 173.62 2ie2 s ILE 115 N -0.88 2.12 -0.13 2.71 -1.09 -0.14 -0.37 121.20 123.42 2ie2 s ILE 115 Ca 0.48 -0.94 -0.03 0.00 -2.23 0.00 0.00 60.65 57.93 2ie2 s ILE 115 Cb -0.34 -1.87 -0.03 0.00 -1.58 0.00 0.00 42.46 38.64 2ie2 s ILE 115 CO 0.43 0.54 -0.03 -0.31 -1.23 0.00 0.00 174.94 174.34 2ie2 s TYR 116 N 1.03 3.04 -0.36 3.97 2.02 -0.39 -1.33 117.35 125.33 2ie2 s TYR 116 Ca -0.01 -0.15 -0.05 0.00 -0.37 0.00 0.00 57.07 56.49 2ie2 s TYR 116 Cb -0.14 -1.89 0.06 0.00 -0.40 0.00 0.00 41.96 39.59 2ie2 s TYR 116 CO -0.07 0.12 0.13 -2.00 -1.57 0.00 0.00 175.55 172.17 2ie2 s GLU 117 N -0.04 2.45 -0.10 -0.62 2.12 -0.78 -2.51 118.70 119.23 2ie2 s GLU 117 Ca 0.02 -1.39 -0.00 0.00 0.36 0.00 0.00 54.97 53.96 2ie2 s GLU 117 Cb -0.13 -3.49 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 2ie2 s GLU 117 CO 0.02 -0.80 -0.07 0.42 -0.54 0.00 0.00 175.26 174.29 2ie2 s ILE 118 N 1.32 3.66 -0.06 -3.70 1.01 -0.49 -1.57 121.20 121.37 2ie2 s ILE 118 Ca 0.01 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.23 2ie2 s ILE 118 Cb -0.21 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.72 2ie2 s ILE 118 CO 0.00 0.56 -0.23 -0.60 0.00 0.00 0.00 174.94 174.67 2ie2 s ARG 119 N -0.36 2.61 -0.06 2.79 6.06 -0.74 -1.50 118.95 127.76 2ie2 s ARG 119 Ca 0.05 -0.88 -0.00 0.00 -2.50 0.00 0.00 55.73 52.40 2ie2 s ARG 119 Cb -0.12 -2.21 0.03 0.00 0.06 0.00 0.00 34.95 32.70 2ie2 s ARG 119 CO 0.02 0.38 -0.02 0.12 -2.50 0.00 0.00 175.30 173.31 2ie2 s PHE 120 N -0.16 0.68 -0.19 5.12 2.19 -0.69 -1.26 117.98 123.67 2ie2 s PHE 120 Ca -0.03 -0.18 -0.05 0.00 0.33 0.00 0.00 56.93 57.00 2ie2 s PHE 120 Cb -0.14 -0.72 0.07 0.00 -1.31 0.00 0.00 43.02 40.92 2ie2 s PHE 120 CO 0.04 -0.26 0.10 -0.51 1.83 0.00 0.00 175.22 176.42 2ie2 s ASP 121 N 1.47 2.44 -0.10 6.13 1.01 0.39 -1.01 116.67 127.00 2ie2 s ASP 121 Ca -0.03 -0.68 -0.00 0.00 0.71 0.00 0.00 52.55 52.56 2ie2 s ASP 121 Cb -0.13 -0.22 -0.03 0.00 1.01 0.00 0.00 42.92 43.55 2ie2 s ASP 121 CO -0.03 -0.36 -0.08 -0.83 0.21 0.00 0.00 175.17 174.08 2ie2 s GLY 122 N 2.15 1.66 0.14 0.21 0.00 -0.18 -0.50 107.32 110.80 2ie2 s GLY 122 Ca 0.03 -0.88 0.02 0.00 0.00 0.00 0.00 44.72 43.89 2ie2 s GLY 122 CO -0.13 -0.46 -0.04 -1.34 0.00 0.00 0.00 173.10 171.13 2ie2 s VAL 123 N -0.34 0.78 -1.92 1.40 -7.23 -0.19 -0.23 120.40 112.68 2ie2 s VAL 123 Ca 0.05 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 2ie2 s VAL 123 Cb -0.12 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.89 2ie2 s VAL 123 CO 0.02 -0.66 0.00 0.59 -0.31 0.00 0.00 175.10 174.75 2ie2 n ASN 124 N -0.17 -5.44 -4.67 4.85 3.02 -1.26 -1.50 115.26 110.08 2ie2 n ASN 124 Ca -0.09 0.30 -0.42 0.00 -0.03 0.00 0.00 54.58 54.33 2ie2 n ASN 124 Cb 0.62 -4.59 -0.03 0.00 -0.61 0.00 0.00 39.78 35.17 2ie2 n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2ie2 s PHE 125 N -2.82 2.36 0.45 3.10 0.08 -1.26 -3.31 117.98 116.58 2ie2 s PHE 125 Ca 0.00 0.49 -0.25 0.00 0.12 0.00 0.00 56.93 57.28 2ie2 s PHE 125 Cb 0.00 -3.79 -0.09 0.00 -0.57 0.00 0.00 43.02 38.57 2ie2 s PHE 125 CO 0.00 -3.16 1.38 -2.30 -0.10 0.00 0.00 175.22 171.04 2ie2 n PRO 126 N 6.51 2.12 0.25 0.24 -0.02 -1.26 -4.88 135.00 137.96 2ie2 n PRO 126 Ca 0.16 0.76 0.15 0.00 -2.02 0.00 0.00 63.50 62.54 2ie2 n PRO 126 Cb 0.43 -2.55 0.84 0.00 -0.02 0.00 0.00 33.50 32.20 2ie2 n PRO 126 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ie2 h ALA 127 N 2.18 1.72 -0.12 3.55 0.00 -2.00 -0.85 119.26 123.75 2ie2 h ALA 127 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2ie2 h ALA 127 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2ie2 h ALA 127 CO 0.60 -0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.83 2ie2 n ASN 128 N -3.96 3.10 -4.80 0.00 3.02 -1.26 -4.66 115.26 106.71 2ie2 n ASN 128 Ca -0.01 -1.99 -0.32 0.00 -0.03 0.00 0.00 54.58 52.23 2ie2 n ASN 128 Cb 0.18 -0.06 0.04 0.00 -0.61 0.00 0.00 39.78 39.33 2ie2 n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2ie2 s GLY 129 N -1.88 1.88 0.52 7.41 0.00 -0.32 -4.91 107.32 110.01 2ie2 s GLY 129 Ca 0.31 0.27 0.35 0.00 0.00 0.00 0.00 44.72 45.65 2ie2 s GLY 129 CO 0.30 0.60 2.05 -0.56 0.00 0.00 0.00 173.10 175.49 2ie2 h PRO 130 N -0.32 0.00 0.23 2.90 0.13 -1.94 -2.42 132.00 130.58 2ie2 h PRO 130 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 2ie2 h PRO 130 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2ie2 h PRO 130 CO 0.56 0.00 -0.11 0.28 -0.23 0.00 0.00 178.00 178.49 2ie2 h VAL 131 N 0.00 0.00 0.00 1.56 2.07 -1.92 0.61 116.25 118.57 2ie2 h VAL 131 Ca 0.00 -0.73 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 2ie2 h VAL 131 Cb 0.18 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 2ie2 h VAL 131 CO 0.00 0.00 -0.19 0.24 0.02 0.00 0.00 177.57 177.64 2ie2 h MET 132 N -1.05 0.00 -0.25 1.57 2.86 -1.79 0.22 114.93 116.49 2ie2 h MET 132 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2ie2 h MET 132 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 2ie2 h MET 132 CO 0.05 0.19 0.00 1.04 1.06 0.00 0.00 176.91 179.25 2ie2 n GLN 133 N -3.85 2.18 -3.67 1.72 1.13 -0.92 -4.49 117.38 109.48 2ie2 n GLN 133 Ca -0.02 -1.77 -0.22 0.00 -1.94 0.00 0.00 57.00 53.05 2ie2 n GLN 133 Cb 0.29 -1.46 0.03 0.00 0.11 0.00 0.00 30.24 29.21 2ie2 n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2ie2 n LYS 134 N 1.01 -4.08 -0.41 -1.09 5.02 -0.83 -4.92 118.16 112.86 2ie2 n LYS 134 Ca 0.18 0.61 0.08 0.00 -2.02 0.00 0.00 58.31 57.15 2ie2 n LYS 134 Cb 0.50 -5.05 0.25 0.00 -0.02 0.00 0.00 35.03 30.71 2ie2 n LYS 134 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2ie2 n ARG 135 N -4.18 3.15 -3.31 1.97 1.74 0.15 -4.98 116.66 111.19 2ie2 n ARG 135 Ca -0.25 -2.62 -0.32 0.00 -0.77 0.00 0.00 57.85 53.89 2ie2 n ARG 135 Cb 0.66 -1.69 -0.05 0.00 -1.02 0.00 0.00 32.46 30.36 2ie2 n ARG 135 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2ie2 s THR 136 N -2.09 4.86 -0.11 0.55 -4.23 -1.25 -1.00 115.64 112.37 2ie2 s THR 136 Ca 0.38 0.60 -0.09 0.00 -1.18 0.00 0.00 61.69 61.40 2ie2 s THR 136 Cb 0.27 -3.62 -0.05 0.00 1.34 0.00 0.00 72.50 70.44 2ie2 s THR 136 CO 0.14 -0.14 -0.20 0.52 -0.54 0.00 0.00 174.62 174.40 2ie2 n VAL 137 N -0.29 1.16 -3.53 2.29 0.31 0.80 -4.77 118.33 114.30 2ie2 n VAL 137 Ca 0.01 0.03 -0.08 0.00 -0.01 0.00 0.00 64.34 64.30 2ie2 n VAL 137 Cb 0.53 -1.89 -0.02 0.00 -0.91 0.00 0.00 33.84 31.55 2ie2 n VAL 137 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2ie2 s LYS 138 N -2.42 0.84 0.33 5.55 -2.85 -1.24 -4.99 119.74 114.95 2ie2 s LYS 138 Ca -0.19 -0.33 -0.27 0.00 -1.00 0.00 0.00 55.97 54.18 2ie2 s LYS 138 Cb 0.05 0.37 -0.09 0.00 -2.06 0.00 0.00 37.83 36.10 2ie2 s LYS 138 CO 0.26 -0.37 1.05 -1.58 0.10 0.00 0.00 175.35 174.81 2ie2 s TRP 139 N -3.12 3.51 0.58 1.78 0.52 -1.26 -0.60 118.94 120.34 2ie2 s TRP 139 Ca 0.06 1.71 -0.15 0.00 0.02 0.00 0.00 56.10 57.73 2ie2 s TRP 139 Cb -0.01 -3.16 -0.05 0.00 -1.15 0.00 0.00 33.47 29.10 2ie2 s TRP 139 CO -0.08 -0.41 1.03 -1.21 0.02 0.00 0.00 176.95 176.30 2ie2 s GLU 140 N -1.89 3.53 0.75 4.98 0.41 -0.13 -4.81 118.70 121.54 2ie2 s GLU 140 Ca 0.50 1.05 -0.15 0.00 -0.41 0.00 0.00 54.97 55.96 2ie2 s GLU 140 Cb -0.26 -2.07 0.04 0.00 -1.78 0.00 0.00 34.13 30.06 2ie2 s GLU 140 CO 0.33 -0.62 1.16 -0.35 -0.49 0.00 0.00 175.26 175.29 2ie2 n PRO 141 N -2.03 0.47 -4.19 0.39 -0.04 -1.26 -4.75 135.00 123.58 2ie2 n PRO 141 Ca 0.08 0.23 -0.12 0.00 -0.04 0.00 0.00 63.50 63.64 2ie2 n PRO 141 Cb 0.53 -2.40 -0.10 0.00 -0.04 0.00 0.00 33.50 31.49 2ie2 n PRO 141 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2ie2 s SER 142 N -1.84 0.17 -0.19 3.54 1.04 -0.19 -4.95 113.70 111.29 2ie2 s SER 142 Ca 0.75 -1.37 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2ie2 s SER 142 Cb -0.32 0.37 0.05 0.00 0.10 0.00 0.00 66.02 66.21 2ie2 s SER 142 CO 0.48 -0.83 -0.07 -0.89 0.98 0.00 0.00 173.24 172.92 2ie2 s THR 143 N -4.15 1.36 0.16 2.02 2.01 -1.26 -0.66 115.64 115.13 2ie2 s THR 143 Ca 0.37 -0.88 -0.27 0.00 0.31 0.00 0.00 61.69 61.22 2ie2 s THR 143 Cb 0.07 -1.53 -0.08 0.00 0.01 0.00 0.00 72.50 70.97 2ie2 s THR 143 CO 0.11 0.08 0.83 -0.70 -0.69 0.00 0.00 174.62 174.25 2ie2 s GLU 144 N 1.51 4.64 -0.25 4.92 2.12 0.61 -4.57 118.70 127.68 2ie2 s GLU 144 Ca -0.01 1.25 -0.08 0.00 0.36 0.00 0.00 54.97 56.49 2ie2 s GLU 144 Cb -0.16 -3.29 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 2ie2 s GLU 144 CO -0.08 0.48 0.08 0.15 -0.54 0.00 0.00 175.26 175.36 2ie2 s LYS 145 N -0.88 3.68 -0.12 4.30 3.01 0.52 -1.46 119.74 128.79 2ie2 s LYS 145 Ca 0.38 -0.46 -0.01 0.00 -1.01 0.00 0.00 55.97 54.87 2ie2 s LYS 145 Cb -0.23 -3.35 -0.02 0.00 -1.01 0.00 0.00 37.83 33.21 2ie2 s LYS 145 CO 0.27 -0.18 -0.09 -0.51 0.51 0.00 0.00 175.35 175.35 2ie2 s LEU 146 N 1.61 2.97 0.06 3.17 1.02 0.09 -0.92 118.68 126.68 2ie2 s LEU 146 Ca 0.06 -0.19 -0.15 0.00 0.02 0.00 0.00 54.13 53.87 2ie2 s LEU 146 Cb -0.15 -1.67 0.03 0.00 0.02 0.00 0.00 46.19 44.41 2ie2 s LEU 146 CO 0.04 0.23 0.35 -0.72 0.02 0.00 0.00 176.35 176.27 2ie2 s TYR 147 N -0.00 -0.16 0.01 0.29 -0.85 -0.19 -1.94 117.35 114.50 2ie2 s TYR 147 Ca -0.02 0.02 -0.14 0.00 -0.52 0.00 0.00 57.07 56.42 2ie2 s TYR 147 Cb -0.14 0.15 -0.06 0.00 0.38 0.00 0.00 41.96 42.30 2ie2 s TYR 147 CO 0.03 -0.56 0.40 0.08 -1.52 0.00 0.00 175.55 173.99 2ie2 s VAL 148 N -2.75 5.05 -0.17 -3.49 1.01 -1.26 -0.20 120.40 118.59 2ie2 s VAL 148 Ca -0.04 0.76 -0.13 0.00 0.00 0.00 0.00 61.98 62.57 2ie2 s VAL 148 Cb -0.00 -3.69 0.05 0.00 0.00 0.00 0.00 36.38 32.74 2ie2 s VAL 148 CO -0.04 0.53 0.44 -0.60 0.00 0.00 0.00 175.10 175.43 2ie2 s ARG 149 N -1.21 0.48 -1.44 2.72 3.52 -0.62 -4.94 118.95 117.47 2ie2 s ARG 149 Ca 0.25 0.70 -0.07 0.00 -0.13 0.00 0.00 55.73 56.48 2ie2 s ARG 149 Cb -0.16 0.15 0.04 0.00 -1.56 0.00 0.00 34.95 33.42 2ie2 s ARG 149 CO 0.14 -0.10 0.62 -0.25 -0.81 0.00 0.00 175.30 174.90 2ie2 n ASP 150 N 3.40 -5.08 0.00 -2.12 8.00 -1.26 -1.49 116.55 118.00 2ie2 n ASP 150 Ca -0.17 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 54.95 2ie2 n ASP 150 Cb 0.56 -4.12 0.00 0.00 -0.02 0.00 0.00 41.12 37.54 2ie2 n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ie2 n GLY 151 N -1.42 0.33 3.52 0.44 0.00 -1.26 -5.01 105.19 101.79 2ie2 n GLY 151 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 2ie2 n GLY 151 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ie2 s VAL 152 N -1.67 1.36 -0.17 1.61 -7.23 -0.55 -5.04 120.40 108.72 2ie2 s VAL 152 Ca 0.00 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 2ie2 s VAL 152 Cb 0.00 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.12 2ie2 s VAL 152 CO 0.00 0.00 0.05 -0.22 -0.31 0.00 0.00 175.10 174.62 2ie2 s LEU 153 N -3.58 3.78 0.06 1.32 2.96 -1.06 -1.59 118.68 120.58 2ie2 s LEU 153 Ca 0.33 0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.39 2ie2 s LEU 153 Cb 0.08 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 2ie2 s LEU 153 CO 0.15 0.21 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.81 2ie2 s LYS 154 N 0.15 2.46 -0.05 1.98 -0.14 0.72 0.49 119.74 125.35 2ie2 s LYS 154 Ca 0.04 -0.84 -0.02 0.00 -1.36 0.00 0.00 55.97 53.79 2ie2 s LYS 154 Cb -0.12 -2.48 0.03 0.00 -1.68 0.00 0.00 37.83 33.58 2ie2 s LYS 154 CO 0.01 0.56 0.06 0.20 -0.76 0.00 0.00 175.35 175.41 2ie2 s GLY 155 N -1.97 0.22 -0.04 -3.33 0.00 0.24 -1.02 107.32 101.42 2ie2 s GLY 155 Ca 0.22 0.16 0.06 0.00 0.00 0.00 0.00 44.72 45.16 2ie2 s GLY 155 CO 0.13 1.40 -0.21 0.99 0.00 0.00 0.00 173.10 175.41 2ie2 s ASP 156 N 2.16 3.42 -0.10 1.64 1.01 -0.10 -0.32 116.67 124.39 2ie2 s ASP 156 Ca 0.05 -0.38 -0.06 0.00 0.71 0.00 0.00 52.55 52.87 2ie2 s ASP 156 Cb -0.12 -0.64 0.04 0.00 1.01 0.00 0.00 42.92 43.21 2ie2 s ASP 156 CO -0.03 0.31 0.24 0.54 0.21 0.00 0.00 175.17 176.44 2ie2 s VAL 157 N -0.55 -0.03 -0.36 -1.27 0.11 -0.95 -0.36 120.40 117.00 2ie2 s VAL 157 Ca 0.08 0.11 -0.29 0.00 -2.93 0.00 0.00 61.98 58.94 2ie2 s VAL 157 Cb -0.11 -0.37 0.01 0.00 -1.53 0.00 0.00 36.38 34.38 2ie2 s VAL 157 CO 0.00 0.04 1.21 0.20 -3.33 0.00 0.00 175.10 173.23 2ie2 s ASN 158 N 0.96 6.71 0.09 3.54 0.01 -1.26 -1.43 114.94 123.55 2ie2 s ASN 158 Ca -0.07 0.95 0.06 0.00 -0.71 0.00 0.00 52.86 53.09 2ie2 s ASN 158 Cb -0.08 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.00 2ie2 s ASN 158 CO -0.06 -1.10 -0.05 -0.04 -1.51 0.00 0.00 177.10 174.34 2ie2 s MET 159 N 4.16 2.34 -0.04 -0.60 -1.94 0.98 -4.74 119.30 119.46 2ie2 s MET 159 Ca 0.52 -0.92 -0.01 0.00 -1.71 0.00 0.00 55.69 53.56 2ie2 s MET 159 Cb -0.13 -2.42 0.03 0.00 2.01 0.00 0.00 34.83 34.32 2ie2 s MET 159 CO 0.24 0.53 0.08 0.00 -0.01 0.00 0.00 175.02 175.86 2ie2 s ALA 160 N -1.24 -0.08 -0.22 3.03 0.00 -1.26 -0.72 121.76 121.27 2ie2 s ALA 160 Ca 0.23 0.46 -0.11 0.00 0.00 0.00 0.00 51.96 52.53 2ie2 s ALA 160 Cb -0.11 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.63 2ie2 s ALA 160 CO 0.15 -0.13 0.20 -0.51 0.00 0.00 0.00 175.76 175.48 2ie2 s LEU 161 N 1.06 4.16 0.29 0.00 1.43 0.55 -0.96 118.68 125.22 2ie2 s LEU 161 Ca -0.09 0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 52.96 2ie2 s LEU 161 Cb -0.12 -2.19 -0.10 0.00 0.03 0.00 0.00 46.19 43.82 2ie2 s LEU 161 CO -0.04 0.08 1.25 -0.55 0.23 0.00 0.00 176.35 177.32 2ie2 s SER 162 N 0.80 6.92 0.12 2.29 0.15 0.23 -0.64 113.70 123.57 2ie2 s SER 162 Ca 0.10 2.53 0.04 0.00 0.70 0.00 0.00 55.95 59.32 2ie2 s SER 162 Cb -0.13 -2.64 -0.04 0.00 -1.71 0.00 0.00 66.02 61.51 2ie2 s SER 162 CO 0.03 -0.43 0.10 -0.76 1.20 0.00 0.00 173.24 173.38 2ie2 s LEU 163 N -1.40 3.76 0.22 3.45 1.43 -0.71 -0.14 118.68 125.29 2ie2 s LEU 163 Ca 0.49 -0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 53.41 2ie2 s LEU 163 Cb -0.37 -2.41 0.24 0.00 0.03 0.00 0.00 46.19 43.68 2ie2 s LEU 163 CO 0.47 0.12 1.84 -0.33 0.23 0.00 0.00 176.35 178.68 2ie2 h GLU 164 N 2.85 0.81 0.00 1.70 5.08 -1.37 -1.65 114.58 122.00 2ie2 h GLU 164 Ca -0.47 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 2ie2 h GLU 164 Cb 1.18 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.25 2ie2 h GLU 164 CO 0.64 0.54 0.00 0.41 -1.00 0.00 0.00 179.01 179.59 2ie2 n GLY 165 N -1.30 -1.14 0.00 -3.84 0.00 -1.26 -5.01 105.19 92.64 2ie2 n GLY 165 Ca 0.09 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2ie2 n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ie2 n GLY 166 N 0.99 2.01 1.66 -0.02 0.00 -0.62 -5.14 105.19 104.07 2ie2 n GLY 166 Ca 0.14 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2ie2 n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ie2 n GLY 167 N 1.27 -2.44 3.22 -0.02 0.00 -1.26 -4.49 105.19 101.48 2ie2 n GLY 167 Ca 0.00 -1.60 -0.14 0.00 0.00 0.00 0.00 46.02 44.28 2ie2 n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ie2 s HIS 168 N -0.72 1.19 -0.12 1.61 0.09 -1.26 -1.74 115.29 114.35 2ie2 s HIS 168 Ca 0.00 -0.73 0.00 0.00 -0.00 0.00 0.00 55.06 54.33 2ie2 s HIS 168 Cb 0.00 -0.62 0.02 0.00 -0.00 0.00 0.00 32.58 31.98 2ie2 s HIS 168 CO 0.00 0.05 -0.10 -0.47 -0.00 0.00 0.00 174.74 174.22 2ie2 s TYR 169 N -3.05 1.63 0.03 1.40 5.04 0.18 -4.94 117.35 117.64 2ie2 s TYR 169 Ca 0.13 -0.82 -0.04 0.00 -2.44 0.00 0.00 57.07 53.90 2ie2 s TYR 169 Cb 0.01 -1.29 -0.04 0.00 0.35 0.00 0.00 41.96 40.98 2ie2 s TYR 169 CO 0.00 -0.52 0.24 1.03 -1.34 0.00 0.00 175.55 174.96 2ie2 s ARG 170 N 1.55 3.51 -0.06 4.97 1.81 -1.26 -0.33 118.95 129.13 2ie2 s ARG 170 Ca 0.03 -0.24 -0.06 0.00 -1.72 0.00 0.00 55.73 53.74 2ie2 s ARG 170 Cb -0.13 -3.05 0.02 0.00 -0.45 0.00 0.00 34.95 31.34 2ie2 s ARG 170 CO -0.07 0.62 0.17 0.00 -0.68 0.00 0.00 175.30 175.34 2ie2 s ASP 172 N 0.12 4.57 0.01 0.00 1.01 -0.31 -0.02 116.67 122.06 2ie2 s ASP 172 Ca -0.00 -0.31 -0.17 0.00 0.71 0.00 0.00 52.55 52.78 2ie2 s ASP 172 Cb -0.01 -1.79 -0.06 0.00 1.01 0.00 0.00 42.92 42.07 2ie2 s ASP 172 CO 0.00 0.00 0.47 -0.36 0.21 0.00 0.00 175.17 175.49 2ie2 s PHE 173 N 1.36 3.73 -0.24 4.23 0.40 -0.51 -1.11 117.98 125.84 2ie2 s PHE 173 Ca 0.04 1.07 -0.02 0.00 -0.60 0.00 0.00 56.93 57.42 2ie2 s PHE 173 Cb -0.14 -2.38 0.08 0.00 0.51 0.00 0.00 43.02 41.08 2ie2 s PHE 173 CO -0.00 0.57 0.06 0.15 0.70 0.00 0.00 175.22 176.69 2ie2 s LYS 174 N -0.88 0.70 -0.07 0.44 1.02 -0.31 -2.23 119.74 118.41 2ie2 s LYS 174 Ca 0.26 -0.67 -0.01 0.00 0.02 0.00 0.00 55.97 55.57 2ie2 s LYS 174 Cb -0.17 -2.04 -0.03 0.00 -0.52 0.00 0.00 37.83 35.07 2ie2 s LYS 174 CO 0.15 -0.77 -0.03 0.99 -0.92 0.00 0.00 175.35 174.76 2ie2 s THR 175 N 1.77 4.04 -0.18 2.17 2.01 0.56 -1.59 115.64 124.41 2ie2 s THR 175 Ca 0.03 -0.36 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 2ie2 s THR 175 Cb -0.17 -2.68 0.00 0.00 0.01 0.00 0.00 72.50 69.66 2ie2 s THR 175 CO -0.15 0.59 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.35 2ie2 s THR 176 N -0.86 2.72 -0.15 -0.82 2.01 0.30 -0.59 115.64 118.24 2ie2 s THR 176 Ca 0.13 -0.73 -0.06 0.00 0.31 0.00 0.00 61.69 61.34 2ie2 s THR 176 Cb -0.11 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 2ie2 s THR 176 CO 0.02 0.49 0.07 -0.31 -0.69 0.00 0.00 174.62 174.20 2ie2 s TYR 177 N 1.18 3.30 -0.25 4.92 2.02 0.18 -1.46 117.35 127.25 2ie2 s TYR 177 Ca 0.02 0.19 -0.02 0.00 -0.37 0.00 0.00 57.07 56.88 2ie2 s TYR 177 Cb -0.14 -2.00 0.08 0.00 -0.40 0.00 0.00 41.96 39.50 2ie2 s TYR 177 CO -0.05 0.33 0.08 0.15 -1.57 0.00 0.00 175.55 174.49 2ie2 s LYS 178 N -0.15 0.55 0.46 -0.62 1.02 0.58 -2.55 119.74 119.04 2ie2 s LYS 178 Ca 0.07 -0.64 -0.23 0.00 0.02 0.00 0.00 55.97 55.19 2ie2 s LYS 178 Cb -0.12 -1.87 -0.07 0.00 -0.52 0.00 0.00 37.83 35.25 2ie2 s LYS 178 CO 0.01 -0.83 1.22 0.00 -0.92 0.00 0.00 175.35 174.83 2ie2 s ALA 179 N 1.84 3.00 -0.71 5.17 0.00 -1.26 -1.06 121.76 128.74 2ie2 s ALA 179 Ca 0.05 1.06 0.26 0.00 0.00 0.00 0.00 51.96 53.32 2ie2 s ALA 179 Cb -0.17 -3.43 0.88 0.00 0.00 0.00 0.00 23.12 20.40 2ie2 s ALA 179 CO -0.19 -0.81 1.77 1.63 0.00 0.00 0.00 175.76 178.16 2ie2 n LYS 180 N -0.45 0.22 -4.42 0.00 5.02 -0.79 -4.77 118.16 112.95 2ie2 n LYS 180 Ca 0.07 0.24 -0.21 0.00 -2.02 0.00 0.00 58.31 56.40 2ie2 n LYS 180 Cb 0.47 -1.78 -0.11 0.00 -0.02 0.00 0.00 35.03 33.59 2ie2 n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2ie2 s LYS 181 N -3.14 1.59 -0.07 1.97 -2.85 -1.26 -5.06 119.74 110.92 2ie2 s LYS 181 Ca 0.09 -1.86 -0.30 0.00 -1.00 0.00 0.00 55.97 52.90 2ie2 s LYS 181 Cb 0.12 -0.80 -0.04 0.00 -2.06 0.00 0.00 37.83 35.05 2ie2 s LYS 181 CO 0.54 -0.17 1.37 0.08 0.10 0.00 0.00 175.35 177.27 2ie2 s VAL 182 N -3.33 3.96 0.17 1.79 1.01 -1.26 -5.01 120.40 117.72 2ie2 s VAL 182 Ca 0.35 1.25 0.04 0.00 0.00 0.00 0.00 61.98 63.63 2ie2 s VAL 182 Cb 0.08 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2ie2 s VAL 182 CO 0.14 -0.05 -0.08 0.68 0.00 0.00 0.00 175.10 175.79 2ie2 s VAL 183 N 3.00 1.15 0.15 2.92 -7.23 -1.26 -5.08 120.40 114.05 2ie2 s VAL 183 Ca 0.61 -2.06 -0.31 0.00 -1.81 0.00 0.00 61.98 58.41 2ie2 s VAL 183 Cb -0.28 -1.98 -0.10 0.00 0.56 0.00 0.00 36.38 34.59 2ie2 s VAL 183 CO 0.22 -0.64 1.54 -1.58 -0.31 0.00 0.00 175.10 174.34 2ie2 s GLN 184 N -3.77 4.23 0.08 4.82 2.00 -1.26 -4.99 119.66 120.77 2ie2 s GLN 184 Ca 0.20 2.30 -0.28 0.00 -2.00 0.00 0.00 55.36 55.58 2ie2 s GLN 184 Cb 0.03 -3.20 -0.06 0.00 0.80 0.00 0.00 33.01 30.58 2ie2 s GLN 184 CO 0.03 -0.58 0.88 -0.51 -0.50 0.00 0.00 175.29 174.60 2ie2 s LEU 185 N 1.23 4.47 0.60 3.68 1.43 -1.26 -4.64 118.68 124.21 2ie2 s LEU 185 Ca 0.69 1.64 -0.10 0.00 -1.03 0.00 0.00 54.13 55.34 2ie2 s LEU 185 Cb -0.42 -3.43 -0.03 0.00 0.03 0.00 0.00 46.19 42.33 2ie2 s LEU 185 CO 0.31 -0.04 0.99 -2.16 0.23 0.00 0.00 176.35 175.69 2ie2 s PRO 186 N -0.00 3.49 0.92 1.29 0.04 -1.26 -4.98 135.00 134.50 2ie2 s PRO 186 Ca 0.43 0.60 -0.12 0.00 0.04 0.00 0.00 61.00 61.96 2ie2 s PRO 186 Cb -0.22 -2.13 0.14 0.00 0.04 0.00 0.00 34.50 32.33 2ie2 s PRO 186 CO 0.27 -0.56 1.09 -0.51 0.04 0.00 0.00 177.00 177.33 2ie2 s ASP 187 N -4.19 3.30 0.08 6.66 -0.00 -1.26 -4.64 116.67 116.62 2ie2 s ASP 187 Ca 0.54 1.37 -0.35 0.00 -0.00 0.00 0.00 52.55 54.11 2ie2 s ASP 187 Cb -0.11 -2.05 -0.14 0.00 -0.00 0.00 0.00 42.92 40.62 2ie2 s ASP 187 CO 0.52 -2.73 1.59 0.00 -0.00 0.00 0.00 175.17 174.54 2ie2 n TYR 188 N -3.93 2.11 -3.67 4.23 9.36 -1.26 -4.84 117.16 119.15 2ie2 n TYR 188 Ca 0.06 0.32 -0.07 0.00 3.32 0.00 0.00 57.90 61.53 2ie2 n TYR 188 Cb 0.56 -2.51 0.00 0.00 -0.63 0.00 0.00 39.34 36.76 2ie2 n TYR 188 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 2ie2 n HIS 189 N 3.85 -1.50 -4.21 2.98 1.44 -0.82 -4.95 115.22 112.01 2ie2 n HIS 189 Ca 0.19 -1.32 -0.20 0.00 -2.01 0.00 0.00 57.72 54.38 2ie2 n HIS 189 Cb 0.26 0.47 -0.12 0.00 0.12 0.00 0.00 29.99 30.72 2ie2 n HIS 189 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2ie2 s PHE 190 N -4.26 1.38 -0.15 -1.40 0.40 -0.35 -0.73 117.98 112.87 2ie2 s PHE 190 Ca 0.14 -0.45 -0.00 0.00 -0.60 0.00 0.00 56.93 56.02 2ie2 s PHE 190 Cb -0.02 -0.77 0.04 0.00 0.51 0.00 0.00 43.02 42.78 2ie2 s PHE 190 CO 0.10 0.10 -0.06 0.08 0.70 0.00 0.00 175.22 176.14 2ie2 s VAL 191 N -1.23 1.13 0.10 -0.44 1.01 -0.53 -0.74 120.40 119.70 2ie2 s VAL 191 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.13 2ie2 s VAL 191 Cb -0.10 -1.25 -0.06 0.00 0.00 0.00 0.00 36.38 34.97 2ie2 s VAL 191 CO 0.03 0.21 1.11 -1.81 0.00 0.00 0.00 175.10 174.64 2ie2 s ASP 192 N 1.64 7.23 0.09 3.32 1.01 0.27 -0.29 116.67 129.94 2ie2 s ASP 192 Ca 0.02 1.98 0.08 0.00 0.71 0.00 0.00 52.55 55.35 2ie2 s ASP 192 Cb -0.14 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.16 2ie2 s ASP 192 CO -0.08 -0.31 -0.22 -1.00 0.21 0.00 0.00 175.17 173.77 2ie2 s HIS 193 N 0.43 1.89 -0.21 4.23 3.76 0.17 -1.01 115.29 124.56 2ie2 s HIS 193 Ca 0.53 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 55.00 2ie2 s HIS 193 Cb -0.28 -1.06 0.10 0.00 1.11 0.00 0.00 32.58 32.45 2ie2 s HIS 193 CO 0.31 0.20 0.24 -1.58 -0.85 0.00 0.00 174.74 173.07 2ie2 s HIS 194 N -1.06 -0.34 -0.12 1.40 2.46 -0.30 -1.02 115.29 116.31 2ie2 s HIS 194 Ca 0.08 0.29 -0.03 0.00 0.47 0.00 0.00 55.06 55.87 2ie2 s HIS 194 Cb -0.10 -0.32 -0.03 0.00 -0.13 0.00 0.00 32.58 32.00 2ie2 s HIS 194 CO 0.04 -0.62 -0.00 -1.50 -2.47 0.00 0.00 174.74 170.19 2ie2 s ILE 195 N 2.35 4.23 -0.06 0.89 2.07 -1.26 -1.81 121.20 127.61 2ie2 s ILE 195 Ca 0.08 -0.26 -0.02 0.00 -1.41 0.00 0.00 60.65 59.03 2ie2 s ILE 195 Cb -0.16 -2.82 0.04 0.00 0.13 0.00 0.00 42.46 39.65 2ie2 s ILE 195 CO -0.12 0.55 0.13 -1.61 -1.91 0.00 0.00 174.94 171.97 2ie2 s GLU 196 N -0.30 0.07 -0.38 3.50 2.02 0.32 -4.58 118.70 119.35 2ie2 s GLU 196 Ca 0.06 0.34 -0.29 0.00 0.02 0.00 0.00 54.97 55.10 2ie2 s GLU 196 Cb -0.12 -0.19 0.02 0.00 0.10 0.00 0.00 34.13 33.94 2ie2 s GLU 196 CO 0.02 -0.16 1.13 0.42 0.02 0.00 0.00 175.26 176.69 2ie2 s ILE 197 N 1.13 4.33 -0.07 -1.63 1.01 -1.26 -0.44 121.20 124.28 2ie2 s ILE 197 Ca -0.09 1.47 0.14 0.00 0.00 0.00 0.00 60.65 62.17 2ie2 s ILE 197 Cb -0.11 -4.46 -0.18 0.00 0.01 0.00 0.00 42.46 37.71 2ie2 s ILE 197 CO -0.05 -0.70 0.80 0.11 0.00 0.00 0.00 174.94 175.09 2ie2 h LYS 198 N 8.73 0.00 -2.65 2.79 1.79 -1.25 -3.48 116.57 122.50 2ie2 h LYS 198 Ca -0.22 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.17 2ie2 h LYS 198 Cb 1.06 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.54 2ie2 h LYS 198 CO 1.07 0.44 -0.00 -1.54 -1.08 0.00 0.00 179.45 178.34 2ie2 s SER 199 N -6.02 -0.43 -0.08 0.86 1.04 -1.17 -5.01 113.70 102.89 2ie2 s SER 199 Ca -0.03 0.28 -0.31 0.00 0.48 0.00 0.00 55.95 56.37 2ie2 s SER 199 Cb 0.08 0.46 0.09 0.00 0.10 0.00 0.00 66.02 66.75 2ie2 s SER 199 CO 0.82 -0.63 0.78 -1.38 0.98 0.00 0.00 173.24 173.80 2ie2 s HIS 200 N -1.90 -0.57 0.85 5.02 -3.43 -1.26 -0.48 115.29 113.52 2ie2 s HIS 200 Ca -0.08 0.98 -0.10 0.00 -0.80 0.00 0.00 55.06 55.05 2ie2 s HIS 200 Cb -0.01 0.42 0.15 0.00 -1.43 0.00 0.00 32.58 31.71 2ie2 s HIS 200 CO 0.02 -0.53 1.18 0.16 -2.00 0.00 0.00 174.74 173.58 2ie2 s ASP 201 N -1.16 3.79 0.21 7.38 1.47 -0.92 -4.95 116.67 122.49 2ie2 s ASP 201 Ca -0.08 0.17 -0.20 0.00 1.18 0.00 0.00 52.55 53.62 2ie2 s ASP 201 Cb -0.00 -0.43 0.16 0.00 -0.34 0.00 0.00 42.92 42.32 2ie2 s ASP 201 CO 0.07 -2.28 1.56 0.50 0.68 0.00 0.00 175.17 175.71 2ie2 h LYS 202 N -1.16 -0.07 -0.62 2.11 3.64 -2.03 -1.92 116.57 116.52 2ie2 h LYS 202 Ca -0.42 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2ie2 h LYS 202 Cb 1.26 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2ie2 h LYS 202 CO 0.44 -0.05 0.00 -0.40 -2.27 0.00 0.00 179.45 177.17 2ie2 n ASP 203 N -5.44 4.52 -1.64 4.20 5.68 -1.26 -4.94 116.55 117.67 2ie2 n ASP 203 Ca 0.07 -2.40 -0.19 0.00 -0.50 0.00 0.00 54.79 51.77 2ie2 n ASP 203 Cb 0.37 -0.54 -0.06 0.00 -1.14 0.00 0.00 41.12 39.75 2ie2 n ASP 203 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2ie2 n TYR 204 N 1.06 -0.24 0.03 2.11 4.02 -0.72 -4.42 117.16 118.98 2ie2 n TYR 204 Ca 0.25 0.00 -0.00 0.00 -0.01 0.00 0.00 57.90 58.13 2ie2 n TYR 204 Cb 0.83 -3.33 0.29 0.00 -0.02 0.00 0.00 39.34 37.11 2ie2 n TYR 204 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2ie2 h SER 205 N 0.00 0.43 -3.26 7.72 4.64 -1.92 -3.40 113.55 117.76 2ie2 h SER 205 Ca -0.40 -0.10 -0.67 0.00 -0.47 0.00 0.00 61.79 60.15 2ie2 h SER 205 Cb 1.26 -0.11 -0.32 0.00 -0.31 0.00 0.00 62.40 62.91 2ie2 h SER 205 CO 0.56 0.57 -0.85 0.20 -0.87 0.00 0.00 176.83 176.44 2ie2 s ASN 206 N -6.78 3.33 -0.04 4.97 0.01 -1.26 -1.87 114.94 113.30 2ie2 s ASN 206 Ca -0.07 -0.54 0.01 0.00 -0.71 0.00 0.00 52.86 51.56 2ie2 s ASN 206 Cb 0.15 -1.48 0.02 0.00 0.41 0.00 0.00 41.25 40.34 2ie2 s ASN 206 CO 0.76 0.11 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.71 2ie2 s VAL 207 N 0.67 0.57 -0.28 1.60 1.01 -0.71 -2.16 120.40 121.11 2ie2 s VAL 207 Ca -0.10 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.61 2ie2 s VAL 207 Cb -0.16 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 2ie2 s VAL 207 CO 0.02 0.22 0.13 0.21 0.00 0.00 0.00 175.10 175.68 2ie2 s ASN 208 N 0.64 5.55 -0.05 3.32 3.84 0.37 -0.52 114.94 128.09 2ie2 s ASN 208 Ca -0.09 -0.23 0.06 0.00 0.21 0.00 0.00 52.86 52.81 2ie2 s ASN 208 Cb -0.12 -2.01 -0.01 0.00 -0.55 0.00 0.00 41.25 38.56 2ie2 s ASN 208 CO 0.00 -0.09 -0.24 -0.22 -2.79 0.00 0.00 177.10 173.76 2ie2 s LEU 209 N 1.66 2.06 0.04 3.21 2.96 0.26 -0.64 118.68 128.22 2ie2 s LEU 209 Ca 0.06 -0.50 0.07 0.00 -0.22 0.00 0.00 54.13 53.55 2ie2 s LEU 209 Cb -0.16 -1.34 -0.02 0.00 0.50 0.00 0.00 46.19 45.17 2ie2 s LEU 209 CO 0.07 0.24 -0.20 -1.00 -1.32 0.00 0.00 176.35 174.14 2ie2 s HIS 210 N -0.18 1.74 0.00 5.38 3.76 0.42 -0.59 115.29 125.82 2ie2 s HIS 210 Ca -0.03 -0.37 0.01 0.00 -0.15 0.00 0.00 55.06 54.52 2ie2 s HIS 210 Cb -0.13 -1.04 -0.00 0.00 1.11 0.00 0.00 32.58 32.51 2ie2 s HIS 210 CO 0.03 0.08 -0.02 -2.00 -0.85 0.00 0.00 174.74 171.98 2ie2 s GLU 211 N -1.13 0.19 -0.02 1.40 2.12 -0.58 -0.52 118.70 120.15 2ie2 s GLU 211 Ca 0.07 -0.13 0.05 0.00 0.36 0.00 0.00 54.97 55.32 2ie2 s GLU 211 Cb -0.09 -0.15 -0.01 0.00 0.26 0.00 0.00 34.13 34.15 2ie2 s GLU 211 CO 0.02 0.04 -0.16 -3.38 -0.54 0.00 0.00 175.26 171.23 2ie2 s HIS 212 N -0.18 1.52 -0.01 5.30 -3.43 -0.75 -1.68 115.29 116.06 2ie2 s HIS 212 Ca -0.01 -0.34 -0.01 0.00 -0.80 0.00 0.00 55.06 53.90 2ie2 s HIS 212 Cb -0.02 -1.00 0.00 0.00 -1.43 0.00 0.00 32.58 30.14 2ie2 s HIS 212 CO -0.00 -0.07 0.04 0.00 -2.00 0.00 0.00 174.74 172.71 2ie2 s ALA 213 N -0.24 -0.09 -0.06 -1.38 0.00 0.34 -1.14 121.76 119.20 2ie2 s ALA 213 Ca 0.03 0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.03 2ie2 s ALA 213 Cb -0.08 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.03 2ie2 s ALA 213 CO 0.00 -0.03 0.07 -2.00 0.00 0.00 0.00 175.76 173.81 2ie2 s GLU 214 N -0.08 -0.06 0.33 0.00 2.12 -0.18 -1.62 118.70 119.22 2ie2 s GLU 214 Ca -0.01 0.36 -0.24 0.00 0.36 0.00 0.00 54.97 55.43 2ie2 s GLU 214 Cb -0.01 -0.61 -0.10 0.00 0.26 0.00 0.00 34.13 33.68 2ie2 s GLU 214 CO 0.00 -0.36 0.92 0.00 -0.54 0.00 0.00 175.26 175.28 2ie2 s ALA 215 N 2.18 3.20 0.23 6.30 0.00 0.13 -0.57 121.76 133.23 2ie2 s ALA 215 Ca 0.05 0.45 -0.16 0.00 0.00 0.00 0.00 51.96 52.30 2ie2 s ALA 215 Cb -0.12 -3.13 0.01 0.00 0.00 0.00 0.00 23.12 19.88 2ie2 s ALA 215 CO -0.04 0.19 0.53 -3.38 0.00 0.00 0.00 175.76 173.06 2ie2 s HIS 216 N -1.73 0.08 0.00 0.00 -3.43 0.08 -4.39 115.29 105.90 2ie2 s HIS 216 Ca 0.52 -0.45 0.00 0.00 -0.80 0.00 0.00 55.06 54.33 2ie2 s HIS 216 Cb -0.16 0.35 0.00 0.00 -1.43 0.00 0.00 32.58 31.34 2ie2 s HIS 216 CO 0.21 -0.99 0.00 -1.13 -2.00 0.00 0.00 174.74 170.83