#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hg0 s ASN 2 N 0.00 1.76 -0.02 5.98 6.03 -1.26 -4.05 114.94 123.38 2hg0 s ASN 2 Ca 0.00 -1.45 -0.06 0.00 -1.03 0.00 0.00 52.86 50.32 2hg0 s ASN 2 Cb 0.00 0.19 -0.29 0.00 -3.03 0.00 0.00 41.25 38.12 2hg0 s ASN 2 CO 0.00 -0.76 0.78 0.00 -2.03 0.00 0.00 177.10 175.09 2hg0 n LEU 4 N -3.50 1.34 0.00 0.00 7.94 -1.26 -1.65 117.00 119.87 2hg0 n LEU 4 Ca -0.20 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 55.83 2hg0 n LEU 4 Cb 1.06 -1.05 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2hg0 n LEU 4 CO 0.51 -1.07 0.00 0.61 -1.11 0.00 0.00 177.39 176.33 2hg0 n GLY 5 N 2.96 2.38 3.81 -3.96 0.00 -1.26 -5.06 105.19 104.06 2hg0 n GLY 5 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 2hg0 n GLY 5 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2hg0 s MET 6 N -0.77 4.32 0.25 1.61 -1.94 -0.66 -4.97 119.30 117.13 2hg0 s MET 6 Ca 0.00 1.20 0.21 0.00 -1.71 0.00 0.00 55.69 55.40 2hg0 s MET 6 Cb 0.00 -2.37 0.07 0.00 2.01 0.00 0.00 34.83 34.54 2hg0 s MET 6 CO 0.00 0.04 1.18 0.66 -0.01 0.00 0.00 175.02 176.89 2hg0 h SER 7 N 2.29 0.00 -2.28 3.03 4.64 -1.91 -3.37 113.55 115.94 2hg0 h SER 7 Ca -0.48 0.00 -0.80 0.00 -0.47 0.00 0.00 61.79 60.04 2hg0 h SER 7 Cb 1.19 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 63.02 2hg0 h SER 7 CO 0.62 0.10 1.15 0.59 -0.87 0.00 0.00 176.83 178.42 2hg0 n ASN 8 N -2.84 7.11 -4.55 4.97 3.02 -1.26 -4.98 115.26 116.74 2hg0 n ASN 8 Ca -0.00 -3.54 -0.31 0.00 -0.03 0.00 0.00 54.58 50.70 2hg0 n ASN 8 Cb 0.59 -1.23 -0.11 0.00 -0.61 0.00 0.00 39.78 38.43 2hg0 n ASN 8 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2hg0 s ARG 9 N -3.45 2.23 -0.03 3.52 3.52 -1.26 -0.58 118.95 122.90 2hg0 s ARG 9 Ca 0.38 -0.92 0.01 0.00 -0.13 0.00 0.00 55.73 55.07 2hg0 s ARG 9 Cb 0.15 -2.33 0.02 0.00 -1.56 0.00 0.00 34.95 31.24 2hg0 s ARG 9 CO -0.06 0.54 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.45 2hg0 s ASP 10 N -1.75 0.47 -0.08 -2.12 1.01 -1.09 -4.99 116.67 108.12 2hg0 s ASP 10 Ca 0.18 -0.04 -0.10 0.00 0.71 0.00 0.00 52.55 53.29 2hg0 s ASP 10 Cb -0.11 -0.22 -0.05 0.00 1.01 0.00 0.00 42.92 43.55 2hg0 s ASP 10 CO 0.09 -0.07 0.25 -0.36 0.21 0.00 0.00 175.17 175.29 2hg0 s PHE 11 N 0.84 3.64 0.02 4.23 0.08 -1.26 -0.78 117.98 124.75 2hg0 s PHE 11 Ca -0.09 0.70 0.01 0.00 0.12 0.00 0.00 56.93 57.68 2hg0 s PHE 11 Cb -0.12 -2.09 -0.02 0.00 -0.57 0.00 0.00 43.02 40.22 2hg0 s PHE 11 CO -0.01 0.67 -0.05 -0.51 -0.10 0.00 0.00 175.22 175.22 2hg0 s LEU 12 N -0.95 2.18 -0.36 -0.37 1.43 0.17 -4.94 118.68 115.85 2hg0 s LEU 12 Ca 0.18 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.90 2hg0 s LEU 12 Cb -0.14 -0.11 0.11 0.00 0.03 0.00 0.00 46.19 46.09 2hg0 s LEU 12 CO 0.07 -0.15 0.14 -0.70 0.23 0.00 0.00 176.35 175.95 2hg0 s GLU 13 N -1.10 1.00 0.00 1.70 2.56 -1.26 0.99 118.70 122.59 2hg0 s GLU 13 Ca -0.08 -1.50 0.00 0.00 0.00 0.00 0.00 54.97 53.39 2hg0 s GLU 13 Cb -0.07 -2.24 0.00 0.00 2.00 0.00 0.00 34.13 33.82 2hg0 s GLU 13 CO -0.00 -1.05 0.13 0.41 -0.56 0.00 0.00 175.26 174.19 2hg0 n GLY 14 N 4.30 -0.94 0.00 -1.50 0.00 -1.25 -4.89 105.19 100.91 2hg0 n GLY 14 Ca 0.03 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2hg0 n GLY 14 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2hg0 n VAL 15 N -0.35 0.00 -3.24 1.61 0.31 -1.26 -4.96 118.33 110.44 2hg0 n VAL 15 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 2hg0 n VAL 15 Cb 0.00 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.86 2hg0 n VAL 15 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2hg0 s SER 16 N -0.96 6.53 -1.58 4.52 0.01 -1.26 -3.87 113.70 117.09 2hg0 s SER 16 Ca 0.00 0.64 0.00 0.00 1.31 0.00 0.00 55.95 57.90 2hg0 s SER 16 Cb 0.00 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.94 2hg0 s SER 16 CO 0.00 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2hg0 n GLY 17 N 4.01 0.49 3.77 3.44 0.00 -1.26 -4.97 105.19 110.68 2hg0 n GLY 17 Ca -0.04 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 2hg0 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hg0 s ALA 18 N -2.75 3.60 -2.74 4.61 0.00 -1.25 -4.94 121.76 118.30 2hg0 s ALA 18 Ca 0.00 -0.28 0.24 0.00 0.00 0.00 0.00 51.96 51.92 2hg0 s ALA 18 Cb 0.00 -2.46 0.33 0.00 0.00 0.00 0.00 23.12 20.99 2hg0 s ALA 18 CO 0.00 0.23 1.34 0.25 0.00 0.00 0.00 175.76 177.59 2hg0 n THR 19 N 2.86 0.24 -4.04 0.00 -2.24 -1.26 -4.79 114.28 105.06 2hg0 n THR 19 Ca -0.11 -0.61 -0.10 0.00 -2.27 0.00 0.00 64.05 60.96 2hg0 n THR 19 Cb 0.52 1.22 -0.08 0.00 -2.10 0.00 0.00 70.33 69.88 2hg0 n THR 19 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 2hg0 s TRP 20 N -1.76 0.59 -0.04 4.78 1.48 -1.26 0.76 118.94 123.50 2hg0 s TRP 20 Ca 0.34 -0.96 -0.12 0.00 -1.06 0.00 0.00 56.10 54.29 2hg0 s TRP 20 Cb 0.21 -0.24 0.02 0.00 -1.16 0.00 0.00 33.47 32.30 2hg0 s TRP 20 CO 0.31 -0.63 0.27 0.08 -4.06 0.00 0.00 176.95 172.92 2hg0 s VAL 21 N -4.00 0.04 -0.10 -0.66 1.01 -1.20 -4.52 120.40 110.97 2hg0 s VAL 21 Ca 0.20 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 2hg0 s VAL 21 Cb 0.05 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2hg0 s VAL 21 CO 0.00 -0.20 0.15 -1.81 0.00 0.00 0.00 175.10 173.24 2hg0 s ASP 22 N -0.87 6.38 0.24 3.32 1.01 -1.26 0.38 116.67 125.87 2hg0 s ASP 22 Ca -0.10 0.45 -0.04 0.00 0.71 0.00 0.00 52.55 53.57 2hg0 s ASP 22 Cb -0.05 -2.06 -0.02 0.00 1.01 0.00 0.00 42.92 41.80 2hg0 s ASP 22 CO 0.03 0.39 0.29 -0.22 0.21 0.00 0.00 175.17 175.86 2hg0 s LEU 23 N -1.18 0.91 -0.05 1.23 2.96 0.20 -4.93 118.68 117.82 2hg0 s LEU 23 Ca 0.17 -1.27 -0.00 0.00 -0.22 0.00 0.00 54.13 52.80 2hg0 s LEU 23 Cb -0.12 0.95 0.03 0.00 0.50 0.00 0.00 46.19 47.54 2hg0 s LEU 23 CO 0.06 -1.00 -0.00 -0.69 -1.32 0.00 0.00 176.35 173.40 2hg0 s VAL 24 N -3.96 0.33 0.10 1.68 1.01 -1.26 -0.63 120.40 117.66 2hg0 s VAL 24 Ca 0.33 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.48 2hg0 s VAL 24 Cb 0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 2hg0 s VAL 24 CO 0.13 0.22 -0.18 -0.76 0.00 0.00 0.00 175.10 174.51 2hg0 s LEU 25 N 1.52 2.70 -0.05 3.92 1.43 -0.69 -4.97 118.68 122.53 2hg0 s LEU 25 Ca -0.02 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.39 2hg0 s LEU 25 Cb -0.13 -1.56 0.03 0.00 0.03 0.00 0.00 46.19 44.57 2hg0 s LEU 25 CO -0.03 0.20 0.39 -1.83 0.23 0.00 0.00 176.35 175.30 2hg0 s GLU 26 N -1.97 0.68 0.00 1.70 -1.05 -1.26 -1.25 118.70 115.55 2hg0 s GLU 26 Ca 0.17 0.04 0.00 0.00 -0.15 0.00 0.00 54.97 55.04 2hg0 s GLU 26 Cb -0.11 0.31 0.00 0.00 -0.44 0.00 0.00 34.13 33.90 2hg0 s GLU 26 CO 0.09 -0.18 0.00 0.41 0.95 0.00 0.00 175.26 176.53 2hg0 n GLY 27 N 1.57 0.00 0.72 -3.83 0.00 -1.25 -0.15 105.19 102.25 2hg0 n GLY 27 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2hg0 n GLY 27 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2hg0 n ASP 28 N 0.00 1.75 -4.90 1.61 5.68 -1.26 -4.61 116.55 114.82 2hg0 n ASP 28 Ca 0.00 -2.10 -0.20 0.00 -0.50 0.00 0.00 54.79 51.98 2hg0 n ASP 28 Cb 0.00 -0.52 -0.03 0.00 -1.14 0.00 0.00 41.12 39.43 2hg0 n ASP 28 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2hg0 s SER 29 N 0.08 5.55 0.13 -1.12 1.04 0.79 -4.63 113.70 115.54 2hg0 s SER 29 Ca 0.05 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2hg0 s SER 29 Cb 0.04 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.02 2hg0 s SER 29 CO 0.01 -0.36 0.02 0.00 0.98 0.00 0.00 173.24 173.89 2hg0 s VAL 31 N -3.87 -0.04 -0.16 0.00 1.01 -0.35 -2.68 120.40 114.31 2hg0 s VAL 31 Ca 0.21 0.16 -0.06 0.00 0.00 0.00 0.00 61.98 62.28 2hg0 s VAL 31 Cb 0.07 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 2hg0 s VAL 31 CO 0.00 0.06 0.04 -0.89 0.00 0.00 0.00 175.10 174.32 2hg0 s THR 32 N 1.10 4.64 -0.08 3.92 2.01 0.04 -0.58 115.64 126.68 2hg0 s THR 32 Ca -0.08 -0.09 0.04 0.00 0.31 0.00 0.00 61.69 61.86 2hg0 s THR 32 Cb -0.10 -3.06 -0.00 0.00 0.01 0.00 0.00 72.50 69.34 2hg0 s THR 32 CO -0.06 0.50 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.51 2hg0 s ILE 33 N 0.11 1.91 0.08 1.82 1.01 0.10 0.46 121.20 126.69 2hg0 s ILE 33 Ca 0.04 -0.95 0.08 0.00 0.00 0.00 0.00 60.65 59.82 2hg0 s ILE 33 Cb -0.12 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2hg0 s ILE 33 CO 0.01 0.53 -0.18 -0.04 0.00 0.00 0.00 174.94 175.26 2hg0 s MET 34 N 0.26 1.91 -0.23 2.79 -1.94 0.28 -2.23 119.30 120.13 2hg0 s MET 34 Ca -0.14 -1.09 -0.10 0.00 -1.71 0.00 0.00 55.69 52.64 2hg0 s MET 34 Cb -0.16 -2.14 0.09 0.00 2.01 0.00 0.00 34.83 34.62 2hg0 s MET 34 CO 0.07 0.51 0.53 -1.54 -0.01 0.00 0.00 175.02 174.58 2hg0 s SER 35 N -1.81 -0.69 0.13 3.03 1.04 -1.26 -3.96 113.70 110.18 2hg0 s SER 35 Ca 0.16 1.23 -0.28 0.00 0.48 0.00 0.00 55.95 57.54 2hg0 s SER 35 Cb -0.11 1.43 -0.16 0.00 0.10 0.00 0.00 66.02 67.29 2hg0 s SER 35 CO 0.08 -0.22 0.59 1.17 0.98 0.00 0.00 173.24 175.84 2hg0 n LYS 36 N 4.86 0.00 -1.88 4.02 3.00 -1.26 -0.98 118.16 125.92 2hg0 n LYS 36 Ca -0.16 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.04 2hg0 n LYS 36 Cb 0.53 -1.00 -0.03 0.00 0.00 0.00 0.00 35.03 34.53 2hg0 n LYS 36 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2hg0 n ASP 37 N 1.64 -3.39 -3.97 3.14 8.00 -1.26 -4.93 116.55 115.78 2hg0 n ASP 37 Ca 0.16 0.25 -0.09 0.00 0.71 0.00 0.00 54.79 55.82 2hg0 n ASP 37 Cb 0.18 -3.05 -0.10 0.00 -0.02 0.00 0.00 41.12 38.12 2hg0 n ASP 37 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2hg0 s LYS 38 N -3.98 0.42 0.91 -1.24 1.02 -0.16 -4.50 119.74 112.21 2hg0 s LYS 38 Ca 0.00 -0.68 -0.13 0.00 0.02 0.00 0.00 55.97 55.18 2hg0 s LYS 38 Cb 0.00 0.15 0.04 0.00 -0.52 0.00 0.00 37.83 37.51 2hg0 s LYS 38 CO 0.00 -0.08 0.55 -2.30 -0.92 0.00 0.00 175.35 172.60 2hg0 n PRO 39 N 1.27 -0.20 -3.53 -1.68 -0.02 -1.26 -4.43 135.00 125.15 2hg0 n PRO 39 Ca -0.22 -0.01 -0.29 0.00 -2.02 0.00 0.00 63.50 60.96 2hg0 n PRO 39 Cb 0.56 -1.95 -0.04 0.00 -0.02 0.00 0.00 33.50 32.06 2hg0 n PRO 39 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2hg0 s THR 40 N -2.34 5.11 0.14 3.45 2.01 -1.26 -4.56 115.64 118.19 2hg0 s THR 40 Ca 0.60 -0.07 -0.05 0.00 0.31 0.00 0.00 61.69 62.48 2hg0 s THR 40 Cb -0.24 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.54 2hg0 s THR 40 CO 0.64 -0.19 0.16 0.27 -0.69 0.00 0.00 174.62 174.81 2hg0 s ILE 41 N -1.92 0.09 -0.12 1.82 -4.36 -0.95 -1.08 121.20 114.69 2hg0 s ILE 41 Ca 0.42 -1.66 -0.01 0.00 -0.26 0.00 0.00 60.65 59.14 2hg0 s ILE 41 Cb -0.11 -1.93 0.03 0.00 1.25 0.00 0.00 42.46 41.70 2hg0 s ILE 41 CO 0.28 -0.40 -0.06 -1.81 0.24 0.00 0.00 174.94 173.18 2hg0 s ASP 42 N -3.01 2.25 -0.11 4.36 1.01 -0.73 -0.72 116.67 119.72 2hg0 s ASP 42 Ca 0.20 -0.35 -0.09 0.00 0.71 0.00 0.00 52.55 53.03 2hg0 s ASP 42 Cb 0.06 -0.82 -0.04 0.00 1.01 0.00 0.00 42.92 43.12 2hg0 s ASP 42 CO 0.00 -0.14 0.18 -0.69 0.21 0.00 0.00 175.17 174.74 2hg0 s VAL 43 N 1.72 5.43 -0.19 -1.27 1.01 0.25 -1.37 120.40 125.98 2hg0 s VAL 43 Ca 0.04 0.30 -0.13 0.00 0.00 0.00 0.00 61.98 62.19 2hg0 s VAL 43 Cb -0.13 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.85 2hg0 s VAL 43 CO -0.08 0.59 0.48 -0.75 0.00 0.00 0.00 175.10 175.34 2hg0 s LYS 44 N -0.86 0.51 -0.21 2.72 2.20 -0.75 -1.21 119.74 122.15 2hg0 s LYS 44 Ca 0.16 0.79 -0.19 0.00 -0.36 0.00 0.00 55.97 56.37 2hg0 s LYS 44 Cb -0.13 0.13 -0.03 0.00 -1.51 0.00 0.00 37.83 36.29 2hg0 s LYS 44 CO 0.05 -0.12 0.54 1.41 -0.36 0.00 0.00 175.35 176.87 2hg0 s MET 45 N 0.92 4.18 -0.14 4.03 -2.45 -1.25 0.02 119.30 124.62 2hg0 s MET 45 Ca -0.05 0.44 -0.08 0.00 -1.25 0.00 0.00 55.69 54.74 2hg0 s MET 45 Cb -0.06 -3.57 -0.03 0.00 1.25 0.00 0.00 34.83 32.42 2hg0 s MET 45 CO -0.08 -0.18 -0.13 0.52 1.05 0.00 0.00 175.02 176.20 2hg0 h MET 46 N 7.51 0.00 -4.34 4.11 0.00 -0.25 -3.43 114.93 118.54 2hg0 h MET 46 Ca -0.33 0.00 -0.22 0.00 0.00 0.00 0.00 59.70 59.15 2hg0 h MET 46 Cb 1.15 0.00 -0.20 0.00 0.00 0.00 0.00 31.60 32.55 2hg0 h MET 46 CO 0.74 0.04 -0.71 1.21 0.00 0.00 0.00 176.91 178.19 2hg0 s ASN 47 N -5.75 0.63 -0.19 1.22 2.47 -1.14 -4.95 114.94 107.24 2hg0 s ASN 47 Ca -0.13 -0.61 0.01 0.00 0.42 0.00 0.00 52.86 52.55 2hg0 s ASN 47 Cb 0.02 0.08 0.04 0.00 -1.45 0.00 0.00 41.25 39.93 2hg0 s ASN 47 CO 0.20 -0.29 -0.11 -0.04 -3.72 0.00 0.00 177.10 173.14 2hg0 s MET 48 N -1.91 2.09 0.04 0.43 -1.94 -1.26 -1.89 119.30 114.86 2hg0 s MET 48 Ca -0.09 -0.78 -0.03 0.00 -1.71 0.00 0.00 55.69 53.08 2hg0 s MET 48 Cb -0.07 -2.35 -0.02 0.00 2.01 0.00 0.00 34.83 34.39 2hg0 s MET 48 CO -0.01 -0.39 0.03 -1.21 -0.01 0.00 0.00 175.02 173.43 2hg0 s GLU 49 N 1.41 0.53 -0.45 2.03 2.02 -1.16 0.33 118.70 123.42 2hg0 s GLU 49 Ca 0.00 -0.86 -0.10 0.00 0.02 0.00 0.00 54.97 54.03 2hg0 s GLU 49 Cb -0.15 0.20 0.10 0.00 0.10 0.00 0.00 34.13 34.37 2hg0 s GLU 49 CO -0.09 -0.12 0.32 0.00 0.02 0.00 0.00 175.26 175.40 2hg0 s ALA 50 N -2.74 3.38 0.27 5.21 0.00 0.82 -2.29 121.76 126.42 2hg0 s ALA 50 Ca -0.04 -2.31 0.06 0.00 0.00 0.00 0.00 51.96 49.67 2hg0 s ALA 50 Cb -0.00 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 2hg0 s ALA 50 CO -0.05 -1.77 0.30 0.00 0.00 0.00 0.00 175.76 174.23 2hg0 s ALA 51 N 1.44 3.82 -1.17 0.00 0.00 0.39 -2.68 121.76 123.55 2hg0 s ALA 51 Ca 0.04 -1.40 -0.03 0.00 0.00 0.00 0.00 51.96 50.57 2hg0 s ALA 51 Cb -0.25 -1.46 -0.02 0.00 0.00 0.00 0.00 23.12 21.39 2hg0 s ALA 51 CO 0.02 0.17 0.92 0.09 0.00 0.00 0.00 175.76 176.96 2hg0 n ASN 52 N -1.34 -3.40 -4.71 0.00 3.02 -1.26 -4.57 115.26 103.00 2hg0 n ASN 52 Ca -0.06 -0.70 -0.29 0.00 -0.03 0.00 0.00 54.58 53.50 2hg0 n ASN 52 Cb 0.58 -4.91 0.11 0.00 -0.61 0.00 0.00 39.78 34.95 2hg0 n ASN 52 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2hg0 s LEU 53 N -6.13 2.60 -0.05 3.41 1.43 -1.26 -4.96 118.68 113.72 2hg0 s LEU 53 Ca 0.16 0.60 -0.05 0.00 -1.03 0.00 0.00 54.13 53.81 2hg0 s LEU 53 Cb -0.03 -2.99 0.02 0.00 0.03 0.00 0.00 46.19 43.22 2hg0 s LEU 53 CO 0.75 -2.07 0.14 0.00 0.23 0.00 0.00 176.35 175.40 2hg0 s ALA 54 N -3.61 -0.34 0.75 4.21 0.00 -1.26 -5.03 121.76 116.49 2hg0 s ALA 54 Ca 0.65 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.92 2hg0 s ALA 54 Cb -0.09 -0.26 0.05 0.00 0.00 0.00 0.00 23.12 22.82 2hg0 s ALA 54 CO 0.49 -0.08 1.11 -2.00 0.00 0.00 0.00 175.76 175.29 2hg0 s GLU 55 N 0.22 2.28 0.00 0.00 2.12 -1.26 -0.91 118.70 121.14 2hg0 s GLU 55 Ca -0.01 1.32 0.00 0.00 0.36 0.00 0.00 54.97 56.64 2hg0 s GLU 55 Cb -0.02 -1.89 0.00 0.00 0.26 0.00 0.00 34.13 32.48 2hg0 s GLU 55 CO -0.01 -1.65 0.00 0.28 -0.54 0.00 0.00 175.26 173.35 2hg0 n VAL 56 N -3.20 0.00 -4.22 3.70 0.31 -0.75 -4.75 118.33 109.43 2hg0 n VAL 56 Ca 0.10 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.25 2hg0 n VAL 56 Cb 0.52 -0.50 -0.07 0.00 -0.91 0.00 0.00 33.84 32.89 2hg0 n VAL 56 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2hg0 s ARG 57 N -1.66 1.78 -0.35 5.55 6.06 -1.22 -4.60 118.95 124.51 2hg0 s ARG 57 Ca 0.00 -1.92 0.03 0.00 -2.50 0.00 0.00 55.73 51.34 2hg0 s ARG 57 Cb 0.00 0.36 0.19 0.00 0.06 0.00 0.00 34.95 35.56 2hg0 s ARG 57 CO 0.00 -0.68 0.73 -1.12 -2.50 0.00 0.00 175.30 171.73 2hg0 s SER 58 N -3.32 -1.24 0.26 -2.12 0.01 -0.91 -3.09 113.70 103.28 2hg0 s SER 58 Ca 0.37 -0.35 -0.24 0.00 1.31 0.00 0.00 55.95 57.04 2hg0 s SER 58 Cb 0.02 1.65 -0.09 0.00 0.21 0.00 0.00 66.02 67.81 2hg0 s SER 58 CO 0.25 -0.17 0.84 -0.31 0.41 0.00 0.00 173.24 174.26 2hg0 s TYR 59 N 2.22 3.74 0.29 2.43 2.02 -1.24 -2.11 117.35 124.70 2hg0 s TYR 59 Ca 0.15 1.63 0.09 0.00 -0.37 0.00 0.00 57.07 58.58 2hg0 s TYR 59 Cb -0.04 -2.80 -0.05 0.00 -0.40 0.00 0.00 41.96 38.68 2hg0 s TYR 59 CO -0.15 0.32 0.00 0.00 -1.57 0.00 0.00 175.55 174.16 2hg0 s TYR 61 N -2.40 1.93 0.33 0.00 1.51 -0.88 -4.47 117.35 113.36 2hg0 s TYR 61 Ca 0.33 -0.60 0.04 0.00 -1.01 0.00 0.00 57.07 55.83 2hg0 s TYR 61 Cb -0.04 -1.30 -0.06 0.00 -0.11 0.00 0.00 41.96 40.45 2hg0 s TYR 61 CO 0.20 -0.21 0.05 -1.17 -1.11 0.00 0.00 175.55 173.31 2hg0 s LEU 62 N 0.09 2.21 0.00 -1.29 1.98 -1.26 -2.83 118.68 117.58 2hg0 s LEU 62 Ca -0.06 -1.37 0.00 0.00 -2.89 0.00 0.00 54.13 49.80 2hg0 s LEU 62 Cb -0.13 -0.41 0.00 0.00 0.66 0.00 0.00 46.19 46.31 2hg0 s LEU 62 CO 0.03 -0.60 0.00 0.00 -1.89 0.00 0.00 176.35 173.90 2hg0 n ALA 63 N -0.69 0.15 -0.50 5.97 0.00 -1.26 -4.93 120.51 119.25 2hg0 n ALA 63 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.32 2hg0 n ALA 63 Cb 0.67 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.05 2hg0 n ALA 63 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2hg0 n THR 64 N 0.00 0.00 -2.72 0.00 -2.24 -1.26 -4.69 114.28 103.36 2hg0 n THR 64 Ca 0.00 -0.11 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 2hg0 n THR 64 Cb 0.00 -0.06 0.07 0.00 -2.10 0.00 0.00 70.33 68.24 2hg0 n THR 64 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2hg0 n VAL 65 N 2.09 0.42 -0.06 2.28 0.31 -1.26 -4.20 118.33 117.90 2hg0 n VAL 65 Ca 0.23 -2.40 -0.13 0.00 -0.01 0.00 0.00 64.34 62.03 2hg0 n VAL 65 Cb 0.03 0.80 -0.04 0.00 -0.91 0.00 0.00 33.84 33.72 2hg0 n VAL 65 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2hg0 n SER 66 N -0.23 1.42 -4.77 4.52 3.41 -1.26 -4.66 113.62 112.04 2hg0 n SER 66 Ca 0.05 0.23 -0.37 0.00 -0.26 0.00 0.00 58.87 58.53 2hg0 n SER 66 Cb 0.81 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 64.20 2hg0 n SER 66 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2hg0 s ASP 67 N -6.28 6.23 0.30 4.04 1.01 -1.26 -5.00 116.67 115.72 2hg0 s ASP 67 Ca -0.21 2.23 0.03 0.00 0.71 0.00 0.00 52.55 55.31 2hg0 s ASP 67 Cb 0.06 -2.60 -0.06 0.00 1.01 0.00 0.00 42.92 41.34 2hg0 s ASP 67 CO 0.29 -0.87 0.07 -0.76 0.21 0.00 0.00 175.17 174.11 2hg0 s LEU 68 N -3.06 2.03 -0.18 1.23 1.43 -1.26 -3.83 118.68 115.04 2hg0 s LEU 68 Ca 0.64 -1.37 -0.28 0.00 -1.03 0.00 0.00 54.13 52.08 2hg0 s LEU 68 Cb -0.26 -0.27 0.10 0.00 0.03 0.00 0.00 46.19 45.79 2hg0 s LEU 68 CO 0.32 -0.64 0.86 -0.44 0.23 0.00 0.00 176.35 176.68 2hg0 s SER 69 N -3.43 -0.54 -0.46 2.29 0.01 -0.95 -4.89 113.70 105.72 2hg0 s SER 69 Ca 0.37 0.80 0.06 0.00 1.31 0.00 0.00 55.95 58.48 2hg0 s SER 69 Cb 0.08 0.73 0.18 0.00 0.21 0.00 0.00 66.02 67.22 2hg0 s SER 69 CO 0.15 -0.36 0.54 0.35 0.41 0.00 0.00 173.24 174.33 2hg0 n THR 70 N 1.49 -0.60 -1.99 1.44 -2.24 -1.26 -2.24 114.28 108.88 2hg0 n THR 70 Ca -0.14 -2.21 -0.43 0.00 -2.27 0.00 0.00 64.05 59.00 2hg0 n THR 70 Cb 0.57 -0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 2hg0 n THR 70 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2hg0 s LYS 71 N 0.45 3.38 0.10 -0.78 2.47 -1.15 -4.87 119.74 119.35 2hg0 s LYS 71 Ca 0.32 1.50 -0.12 0.00 -1.56 0.00 0.00 55.97 56.11 2hg0 s LYS 71 Cb 0.02 -4.19 -0.06 0.00 -1.46 0.00 0.00 37.83 32.14 2hg0 s LYS 71 CO -0.13 -1.80 0.46 0.00 0.16 0.00 0.00 175.35 174.04 2hg0 s ALA 72 N 6.77 3.67 -0.03 3.13 0.00 -1.26 -2.48 121.76 131.55 2hg0 s ALA 72 Ca 0.80 -0.28 -0.00 0.00 0.00 0.00 0.00 51.96 52.48 2hg0 s ALA 72 Cb -0.23 -2.37 0.03 0.00 0.00 0.00 0.00 23.12 20.54 2hg0 s ALA 72 CO 0.34 0.52 0.01 0.00 0.00 0.00 0.00 175.76 176.63 2hg0 s ALA 73 N -1.42 0.30 0.70 0.00 0.00 -1.04 -4.95 121.76 115.36 2hg0 s ALA 73 Ca 0.35 0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.35 2hg0 s ALA 73 Cb -0.14 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.61 2hg0 s ALA 73 CO 0.18 -0.16 1.08 0.00 0.00 0.00 0.00 175.76 176.86 2hg0 n PRO 75 N -3.03 1.74 -0.60 0.00 -0.02 -1.26 -1.40 135.00 130.43 2hg0 n PRO 75 Ca 0.09 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2hg0 n PRO 75 Cb 0.53 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2hg0 n PRO 75 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2hg0 n THR 76 N -0.22 0.00 1.34 3.45 5.66 -1.26 -4.75 114.28 118.50 2hg0 n THR 76 Ca 0.07 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.18 2hg0 n THR 76 Cb 0.39 -0.37 0.41 0.00 -1.55 0.00 0.00 70.33 69.21 2hg0 n THR 76 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 2hg0 n MET 77 N -2.00 1.64 0.00 1.09 2.81 -0.49 -5.04 117.12 115.12 2hg0 n MET 77 Ca 0.00 -0.96 0.00 0.00 -1.81 0.00 0.00 57.70 54.93 2hg0 n MET 77 Cb 0.00 -1.39 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 2hg0 n MET 77 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hg0 n GLY 78 N 1.10 -0.53 3.96 3.03 0.00 -1.26 -4.88 105.19 106.60 2hg0 n GLY 78 Ca 0.16 -1.48 -0.25 0.00 0.00 0.00 0.00 46.02 44.45 2hg0 n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hg0 s GLU 79 N 0.00 1.79 -0.10 1.61 2.02 -1.26 -4.03 118.70 118.73 2hg0 s GLU 79 Ca 0.00 -0.63 0.03 0.00 0.02 0.00 0.00 54.97 54.39 2hg0 s GLU 79 Cb 0.00 -2.21 -0.01 0.00 0.10 0.00 0.00 34.13 32.02 2hg0 s GLU 79 CO 0.00 -1.45 -0.20 0.00 0.02 0.00 0.00 175.26 173.63 2hg0 s ALA 80 N -3.26 2.34 -0.27 5.21 0.00 -1.26 -4.85 121.76 119.67 2hg0 s ALA 80 Ca 0.64 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 51.63 2hg0 s ALA 80 Cb -0.08 -0.93 0.03 0.00 0.00 0.00 0.00 23.12 22.14 2hg0 s ALA 80 CO 0.45 0.31 -0.04 -1.58 0.00 0.00 0.00 175.76 174.90 2hg0 s HIS 81 N 0.23 3.13 -0.04 0.00 2.46 -1.26 -4.48 115.29 115.33 2hg0 s HIS 81 Ca -0.13 -1.66 -0.24 0.00 0.47 0.00 0.00 55.06 53.50 2hg0 s HIS 81 Cb -0.16 -2.08 -0.04 0.00 -0.13 0.00 0.00 32.58 30.17 2hg0 s HIS 81 CO 0.07 -0.75 0.73 1.21 -2.47 0.00 0.00 174.74 173.52 2hg0 s ASN 82 N 1.30 7.05 0.56 9.88 3.84 -1.26 -4.92 114.94 131.39 2hg0 s ASN 82 Ca -0.02 1.26 0.26 0.00 0.21 0.00 0.00 52.86 54.58 2hg0 s ASN 82 Cb -0.18 -2.43 1.49 0.00 -0.55 0.00 0.00 41.25 39.59 2hg0 s ASN 82 CO -0.03 -0.10 2.04 0.44 -2.79 0.00 0.00 177.10 176.65 2hg0 h ASP 83 N 6.57 0.00 0.00 -4.21 3.32 -1.98 -1.02 116.42 119.10 2hg0 h ASP 83 Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 2hg0 h ASP 83 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2hg0 h ASP 83 CO 0.74 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 178.55 2hg0 n LYS 84 N -4.09 0.61 0.00 3.56 4.76 -1.26 -2.22 118.16 119.53 2hg0 n LYS 84 Ca 0.05 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.50 2hg0 n LYS 84 Cb 0.46 -1.19 0.00 0.00 -1.84 0.00 0.00 35.03 32.46 2hg0 n LYS 84 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2hg0 n ARG 85 N 0.97 1.66 0.10 1.97 0.63 -0.39 -4.39 116.66 117.20 2hg0 n ARG 85 Ca 0.00 -0.41 -0.19 0.00 -0.92 0.00 0.00 57.85 56.33 2hg0 n ARG 85 Cb 0.31 -0.89 -0.12 0.00 0.45 0.00 0.00 32.46 32.21 2hg0 n ARG 85 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hg0 h ALA 86 N 0.34 0.09 -3.88 5.13 0.00 -1.68 -3.46 119.26 115.80 2hg0 h ALA 86 Ca 0.00 -0.81 -0.48 0.00 0.00 0.00 0.00 54.91 53.62 2hg0 h ALA 86 Cb 0.07 0.06 -0.25 0.00 0.00 0.00 0.00 17.79 17.66 2hg0 h ALA 86 CO 0.00 0.81 -0.81 0.34 0.00 0.00 0.00 179.25 179.60 2hg0 s ASP 87 N -7.28 1.88 0.00 0.00 -1.08 -1.26 -4.99 116.67 103.94 2hg0 s ASP 87 Ca -0.07 -0.45 0.00 0.00 -0.52 0.00 0.00 52.55 51.51 2hg0 s ASP 87 Cb 0.07 -0.14 0.00 0.00 -1.46 0.00 0.00 42.92 41.39 2hg0 s ASP 87 CO 0.90 0.08 0.00 -2.65 0.52 0.00 0.00 175.17 174.03 2hg0 n PRO 88 N 1.97 0.00 -0.25 4.34 -0.02 -1.26 -3.25 135.00 136.53 2hg0 n PRO 88 Ca -0.17 0.00 0.21 0.00 -2.02 0.00 0.00 63.50 61.51 2hg0 n PRO 88 Cb 0.54 -0.96 0.53 0.00 -0.02 0.00 0.00 33.50 33.60 2hg0 n PRO 88 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hg0 h ALA 89 N 0.88 2.28 -2.54 3.55 0.00 -1.93 -3.42 119.26 118.08 2hg0 h ALA 89 Ca 0.00 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 2hg0 h ALA 89 Cb 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 17.64 2hg0 h ALA 89 CO 0.00 -0.58 -0.52 -0.06 0.00 0.00 0.00 179.25 178.09 2hg0 s PHE 90 N -5.39 0.74 -0.23 0.00 0.08 -1.20 -3.39 117.98 108.60 2hg0 s PHE 90 Ca -0.08 -1.09 -0.05 0.00 0.12 0.00 0.00 56.93 55.83 2hg0 s PHE 90 Cb 0.23 -0.33 -0.02 0.00 -0.57 0.00 0.00 43.02 42.33 2hg0 s PHE 90 CO 0.78 -0.62 0.00 0.14 -0.10 0.00 0.00 175.22 175.43 2hg0 s VAL 91 N -4.04 3.81 0.13 -0.44 -7.23 0.61 -4.84 120.40 108.40 2hg0 s VAL 91 Ca 0.24 -0.35 0.05 0.00 -1.81 0.00 0.00 61.98 60.12 2hg0 s VAL 91 Cb 0.06 -2.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 2hg0 s VAL 91 CO 0.03 0.40 0.05 0.00 -0.31 0.00 0.00 175.10 175.27 2hg0 s ARG 93 N -2.74 0.44 0.47 0.00 0.52 -0.79 -5.00 118.95 111.85 2hg0 s ARG 93 Ca 0.28 0.86 -0.08 0.00 -0.52 0.00 0.00 55.73 56.28 2hg0 s ARG 93 Cb -0.11 0.01 -0.05 0.00 0.52 0.00 0.00 34.95 35.32 2hg0 s ARG 93 CO 0.20 -0.16 0.81 -0.65 0.02 0.00 0.00 175.30 175.53 2hg0 s GLN 94 N 1.45 3.63 0.32 3.54 -0.21 -1.25 -2.94 119.66 124.20 2hg0 s GLN 94 Ca -0.10 0.36 -0.15 0.00 0.02 0.00 0.00 55.36 55.49 2hg0 s GLN 94 Cb -0.08 -2.34 0.06 0.00 1.00 0.00 0.00 33.01 31.64 2hg0 s GLN 94 CO -0.14 -0.19 0.75 0.41 -2.12 0.00 0.00 175.29 174.00 2hg0 n GLY 95 N -2.00 1.00 3.04 3.09 0.00 0.24 -4.96 105.19 105.60 2hg0 n GLY 95 Ca 0.02 -1.21 -0.16 0.00 0.00 0.00 0.00 46.02 44.67 2hg0 n GLY 95 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hg0 s VAL 96 N -2.18 0.63 -0.05 1.61 -7.23 -1.26 -0.42 120.40 111.50 2hg0 s VAL 96 Ca 0.15 -0.70 0.04 0.00 -1.81 0.00 0.00 61.98 59.66 2hg0 s VAL 96 Cb -0.04 -0.60 0.00 0.00 0.56 0.00 0.00 36.38 36.30 2hg0 s VAL 96 CO 0.09 -0.08 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.95 2hg0 s VAL 97 N -0.73 1.40 -0.01 1.32 1.01 -0.34 -4.87 120.40 118.18 2hg0 s VAL 97 Ca -0.02 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 2hg0 s VAL 97 Cb -0.06 -1.22 -0.06 0.00 0.00 0.00 0.00 36.38 35.04 2hg0 s VAL 97 CO 0.00 0.41 1.58 -1.81 0.00 0.00 0.00 175.10 175.28 2hg0 s ASP 98 N 0.25 6.70 0.00 3.32 1.01 -1.26 -1.85 116.67 124.84 2hg0 s ASP 98 Ca -0.08 2.26 -0.00 0.00 0.71 0.00 0.00 52.55 55.43 2hg0 s ASP 98 Cb -0.13 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.25 2hg0 s ASP 98 CO 0.03 -0.86 0.01 -2.11 0.21 0.00 0.00 175.17 172.45 2hg0 n ARG 99 N 6.24 0.01 0.00 8.23 1.85 -0.91 -4.99 116.66 127.09 2hg0 n ARG 99 Ca 0.16 -0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 2hg0 n ARG 99 Cb 0.42 0.02 0.00 0.00 -1.05 0.00 0.00 32.46 31.85 2hg0 n ARG 99 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2hg0 n GLY 100 N -0.00 -0.54 0.40 2.89 0.00 -1.26 -1.03 105.19 105.65 2hg0 n GLY 100 Ca -0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 2hg0 n GLY 100 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2hg0 h TRP 101 N 0.00 -1.00 -0.54 1.61 6.55 -1.14 1.21 115.95 122.64 2hg0 h TRP 101 Ca 0.00 0.00 0.20 0.00 0.95 0.00 0.00 58.89 60.04 2hg0 h TRP 101 Cb 0.00 0.38 -0.10 0.00 -0.86 0.00 0.00 29.16 28.58 2hg0 h TRP 101 CO 0.00 -0.54 0.20 0.41 -1.05 0.00 0.00 178.44 177.46 2hg0 n GLY 102 N -1.49 -0.52 2.69 1.49 0.00 -1.26 -1.10 105.19 105.00 2hg0 n GLY 102 Ca -0.11 0.47 -0.24 0.00 0.00 0.00 0.00 46.02 46.14 2hg0 n GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2hg0 n ASN 103 N -4.37 3.39 0.00 1.61 0.23 -0.94 -4.96 115.26 110.22 2hg0 n ASN 103 Ca 0.18 -3.47 0.00 0.00 -0.53 0.00 0.00 54.58 50.76 2hg0 n ASN 103 Cb 0.61 -0.57 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 2hg0 n ASN 103 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2hg0 n GLY 104 N -0.11 1.31 3.89 4.83 0.00 -0.26 -4.76 105.19 110.10 2hg0 n GLY 104 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 2hg0 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hg0 h GLY 106 N 3.40 1.12 -1.83 0.00 0.00 -1.94 0.13 103.07 103.95 2hg0 h GLY 106 Ca -0.48 -0.91 -0.56 0.00 0.00 0.00 0.00 47.33 45.39 2hg0 h GLY 106 CO 0.70 0.83 -0.46 1.08 0.00 0.00 0.00 176.54 178.69 2hg0 s LEU 107 N -9.19 3.11 -0.15 3.11 1.43 -1.26 -4.69 118.68 111.03 2hg0 s LEU 107 Ca -0.11 -1.05 -0.03 0.00 -1.03 0.00 0.00 54.13 51.90 2hg0 s LEU 107 Cb 0.13 -1.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 2hg0 s LEU 107 CO 0.86 -0.62 -0.05 -0.36 0.23 0.00 0.00 176.35 176.41 2hg0 s PHE 108 N -2.60 3.00 -5.00 0.29 0.08 -1.26 -3.98 117.98 108.52 2hg0 s PHE 108 Ca 0.41 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 57.14 2hg0 s PHE 108 Cb 0.02 -1.94 0.00 0.00 -0.57 0.00 0.00 43.02 40.53 2hg0 s PHE 108 CO 0.23 -0.04 0.00 0.41 -0.10 0.00 0.00 175.22 175.72 2hg0 n GLY 109 N 3.48 -0.02 3.68 4.36 0.00 -0.20 -5.00 105.19 111.49 2hg0 n GLY 109 Ca -0.17 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 2hg0 n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hg0 s LYS 110 N -2.00 4.27 0.05 1.61 -0.14 -1.26 -2.14 119.74 120.13 2hg0 s LYS 110 Ca 0.00 1.91 0.04 0.00 -1.36 0.00 0.00 55.97 56.56 2hg0 s LYS 110 Cb 0.00 -3.66 -0.04 0.00 -1.68 0.00 0.00 37.83 32.45 2hg0 s LYS 110 CO 0.00 -0.62 -0.05 0.20 -0.76 0.00 0.00 175.35 174.12 2hg0 s GLY 111 N 2.05 1.83 0.83 -3.33 0.00 -0.77 -4.28 107.32 103.65 2hg0 s GLY 111 Ca 0.62 -1.09 -0.11 0.00 0.00 0.00 0.00 44.72 44.15 2hg0 s GLY 111 CO 0.24 -1.01 1.12 -0.45 0.00 0.00 0.00 173.10 173.00 2hg0 s SER 112 N -1.87 3.79 -0.27 1.64 0.15 -0.69 -1.20 113.70 115.26 2hg0 s SER 112 Ca 0.21 2.01 -0.13 0.00 0.70 0.00 0.00 55.95 58.74 2hg0 s SER 112 Cb -0.11 -2.54 0.09 0.00 -1.71 0.00 0.00 66.02 61.74 2hg0 s SER 112 CO 0.12 -2.52 0.63 -0.63 1.20 0.00 0.00 173.24 172.05 2hg0 s ILE 113 N -2.75 -0.27 -0.35 6.45 1.01 0.44 -2.50 121.20 123.23 2hg0 s ILE 113 Ca 0.64 0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.31 2hg0 s ILE 113 Cb -0.20 -0.93 0.14 0.00 0.01 0.00 0.00 42.46 41.48 2hg0 s ILE 113 CO 0.56 0.01 0.22 -0.62 0.00 0.00 0.00 174.94 175.11 2hg0 s ASP 114 N 1.96 2.84 0.58 3.58 2.15 -1.03 0.83 116.67 127.57 2hg0 s ASP 114 Ca -0.09 -2.13 -0.01 0.00 0.43 0.00 0.00 52.55 50.75 2hg0 s ASP 114 Cb -0.07 -0.32 0.03 0.00 -0.30 0.00 0.00 42.92 42.26 2hg0 s ASP 114 CO -0.18 -0.31 0.82 0.42 -0.17 0.00 0.00 175.17 175.75 2hg0 s THR 115 N 1.11 2.76 -0.07 1.71 -4.23 -1.15 -2.95 115.64 112.82 2hg0 s THR 115 Ca 0.18 -0.53 -0.13 0.00 -1.18 0.00 0.00 61.69 60.03 2hg0 s THR 115 Cb -0.22 -3.07 0.03 0.00 1.34 0.00 0.00 72.50 70.57 2hg0 s THR 115 CO 0.00 -0.06 0.32 0.00 -0.54 0.00 0.00 174.62 174.35 2hg0 s ALA 117 N -0.62 2.08 0.45 0.00 0.00 -0.51 -2.23 121.76 120.94 2hg0 s ALA 117 Ca -0.07 -1.56 -0.06 0.00 0.00 0.00 0.00 51.96 50.27 2hg0 s ALA 117 Cb -0.04 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 2hg0 s ALA 117 CO 0.02 0.20 0.76 0.21 0.00 0.00 0.00 175.76 176.95 2hg0 s LYS 118 N -3.05 3.58 -0.11 0.00 2.20 -1.25 0.22 119.74 121.34 2hg0 s LYS 118 Ca 0.19 0.20 -0.04 0.00 -0.36 0.00 0.00 55.97 55.96 2hg0 s LYS 118 Cb -0.05 -2.41 0.05 0.00 -1.51 0.00 0.00 37.83 33.92 2hg0 s LYS 118 CO 0.07 -0.13 0.21 0.12 -0.36 0.00 0.00 175.35 175.26 2hg0 s PHE 119 N -2.62 -0.30 0.12 4.03 2.19 -1.22 -4.28 117.98 115.90 2hg0 s PHE 119 Ca 0.47 0.79 -0.06 0.00 0.33 0.00 0.00 56.93 58.46 2hg0 s PHE 119 Cb -0.10 -0.14 -0.02 0.00 -1.31 0.00 0.00 43.02 41.46 2hg0 s PHE 119 CO 0.41 -0.31 0.18 0.00 1.83 0.00 0.00 175.22 177.33 2hg0 s ALA 120 N 2.27 0.15 0.16 11.12 0.00 -1.26 -4.96 121.76 129.24 2hg0 s ALA 120 Ca 0.01 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 51.08 2hg0 s ALA 120 Cb -0.12 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 2hg0 s ALA 120 CO -0.07 -0.54 0.05 0.00 0.00 0.00 0.00 175.76 175.19 2hg0 n SER 122 N -0.08 0.00 -4.39 0.00 7.64 -1.25 -4.95 113.62 110.59 2hg0 n SER 122 Ca -0.09 0.00 -0.45 0.00 1.01 0.00 0.00 58.87 59.34 2hg0 n SER 122 Cb 0.54 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.69 2hg0 n SER 122 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2hg0 s THR 123 N 0.00 4.95 -0.55 0.44 -4.23 -1.13 -4.99 115.64 110.13 2hg0 s THR 123 Ca 0.00 -0.94 -0.25 0.00 -1.18 0.00 0.00 61.69 59.32 2hg0 s THR 123 Cb 0.00 -4.37 0.04 0.00 1.34 0.00 0.00 72.50 69.51 2hg0 s THR 123 CO 0.00 -0.92 0.98 -0.54 -0.54 0.00 0.00 174.62 173.60 2hg0 s LYS 124 N 2.37 3.38 -0.91 3.99 1.02 -1.26 -2.07 119.74 126.26 2hg0 s LYS 124 Ca 0.10 -0.14 -0.16 0.00 0.02 0.00 0.00 55.97 55.79 2hg0 s LYS 124 Cb -0.24 -4.04 -0.10 0.00 -0.52 0.00 0.00 37.83 32.93 2hg0 s LYS 124 CO 0.07 -1.50 2.04 0.00 -0.92 0.00 0.00 175.35 175.04 2hg0 n ALA 125 N 7.60 4.07 -1.25 5.17 0.00 0.45 -4.80 120.51 131.76 2hg0 n ALA 125 Ca 0.03 -2.99 -0.35 0.00 0.00 0.00 0.00 53.44 50.13 2hg0 n ALA 125 Cb 0.48 -3.43 0.09 0.00 0.00 0.00 0.00 19.45 16.58 2hg0 n ALA 125 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2hg0 n ILE 126 N 5.32 2.16 -3.71 0.00 -5.35 -1.13 -3.65 119.36 112.99 2hg0 n ILE 126 Ca 0.49 -0.34 -0.14 0.00 -0.27 0.00 0.00 62.75 62.49 2hg0 n ILE 126 Cb 0.32 -0.96 -0.08 0.00 -1.74 0.00 0.00 39.64 37.18 2hg0 n ILE 126 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2hg0 s GLY 127 N -1.68 -0.22 0.21 3.28 0.00 -1.18 0.20 107.32 107.93 2hg0 s GLY 127 Ca 0.70 0.40 0.05 0.00 0.00 0.00 0.00 44.72 45.86 2hg0 s GLY 127 CO 0.54 0.17 0.19 0.54 0.00 0.00 0.00 173.10 174.54 2hg0 n ARG 128 N 1.00 0.27 -4.08 2.90 3.00 0.75 -1.80 116.66 118.70 2hg0 n ARG 128 Ca -0.20 -2.09 -0.23 0.00 -0.01 0.00 0.00 57.85 55.31 2hg0 n ARG 128 Cb 0.57 1.74 -0.06 0.00 0.00 0.00 0.00 32.46 34.71 2hg0 n ARG 128 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2hg0 s THR 129 N -2.85 3.09 -0.44 0.55 -4.23 -0.08 0.34 115.64 112.02 2hg0 s THR 129 Ca 0.25 -1.67 0.02 0.00 -1.18 0.00 0.00 61.69 59.11 2hg0 s THR 129 Cb 0.01 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 71.00 2hg0 s THR 129 CO 0.18 -0.19 0.27 -0.63 -0.54 0.00 0.00 174.62 173.70 2hg0 s ILE 130 N -2.41 1.13 0.42 2.99 1.01 -1.26 -4.03 121.20 119.05 2hg0 s ILE 130 Ca 0.38 -2.53 -0.26 0.00 0.00 0.00 0.00 60.65 58.24 2hg0 s ILE 130 Cb -0.03 -1.79 -0.10 0.00 0.01 0.00 0.00 42.46 40.55 2hg0 s ILE 130 CO 0.23 -0.97 1.37 0.18 0.00 0.00 0.00 174.94 175.75 2hg0 n LEU 131 N 3.43 4.51 0.20 2.97 4.77 -1.26 -4.74 117.00 126.89 2hg0 n LEU 131 Ca 0.13 1.14 0.14 0.00 -0.03 0.00 0.00 56.01 57.39 2hg0 n LEU 131 Cb 0.37 -1.56 0.72 0.00 -2.33 0.00 0.00 43.42 40.62 2hg0 n LEU 131 CO 0.20 -0.33 0.92 0.11 -1.33 0.00 0.00 177.39 176.97 2hg0 h LYS 132 N 2.33 0.00 0.00 3.23 1.57 -1.99 0.50 116.57 122.22 2hg0 h LYS 132 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2hg0 h LYS 132 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 2hg0 h LYS 132 CO 0.61 0.00 -0.03 0.39 -0.57 0.00 0.00 179.45 179.85 2hg0 n GLU 133 N -2.48 0.04 -0.07 3.15 1.02 -1.26 -3.10 120.64 117.94 2hg0 n GLU 133 Ca -0.01 0.03 0.12 0.00 -0.02 0.00 0.00 57.16 57.28 2hg0 n GLU 133 Cb 0.09 -1.54 0.34 0.00 -0.02 0.00 0.00 31.44 30.30 2hg0 n GLU 133 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2hg0 n ASN 134 N -1.61 2.20 -4.63 1.62 3.02 0.18 -4.87 115.26 111.17 2hg0 n ASN 134 Ca 0.07 -1.76 -0.41 0.00 -0.03 0.00 0.00 54.58 52.45 2hg0 n ASN 134 Cb 0.35 -0.09 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 2hg0 n ASN 134 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2hg0 s ILE 135 N -1.83 4.91 -0.00 2.41 -1.09 -1.18 -0.46 121.20 123.96 2hg0 s ILE 135 Ca 0.34 1.26 0.06 0.00 -2.23 0.00 0.00 60.65 60.08 2hg0 s ILE 135 Cb 0.20 -4.03 -0.02 0.00 -1.58 0.00 0.00 42.46 37.04 2hg0 s ILE 135 CO 0.30 -0.05 -0.18 -0.75 -1.23 0.00 0.00 174.94 173.03 2hg0 s LYS 136 N 2.68 1.39 0.12 2.79 2.20 -0.97 -4.15 119.74 123.80 2hg0 s LYS 136 Ca 0.30 -0.67 0.06 0.00 -0.36 0.00 0.00 55.97 55.30 2hg0 s LYS 136 Cb -0.15 -1.36 -0.04 0.00 -1.51 0.00 0.00 37.83 34.77 2hg0 s LYS 136 CO 0.09 0.37 -0.04 0.71 -0.36 0.00 0.00 175.35 176.12 2hg0 s TYR 137 N -0.49 2.86 -0.30 4.03 2.02 0.28 -2.98 117.35 122.77 2hg0 s TYR 137 Ca 0.06 -0.10 0.02 0.00 -0.37 0.00 0.00 57.07 56.68 2hg0 s TYR 137 Cb -0.07 -1.45 0.09 0.00 -0.40 0.00 0.00 41.96 40.12 2hg0 s TYR 137 CO -0.00 0.47 0.03 -2.00 -1.57 0.00 0.00 175.55 172.48 2hg0 s GLU 138 N -2.47 1.33 -0.13 -0.62 2.12 -0.79 0.34 118.70 118.48 2hg0 s GLU 138 Ca 0.25 -1.36 -0.04 0.00 0.36 0.00 0.00 54.97 54.17 2hg0 s GLU 138 Cb -0.11 -2.66 -0.04 0.00 0.26 0.00 0.00 34.13 31.59 2hg0 s GLU 138 CO 0.17 -0.84 0.03 0.08 -0.54 0.00 0.00 175.26 174.16 2hg0 s VAL 139 N 1.26 4.50 -0.14 3.70 1.01 -0.31 0.47 120.40 130.90 2hg0 s VAL 139 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.87 2hg0 s VAL 139 Cb -0.18 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 2hg0 s VAL 139 CO -0.12 0.54 -0.14 0.00 0.00 0.00 0.00 175.10 175.38 2hg0 s ALA 140 N -0.30 2.55 -0.14 5.51 0.00 0.10 -1.63 121.76 127.85 2hg0 s ALA 140 Ca 0.07 -0.94 -0.02 0.00 0.00 0.00 0.00 51.96 51.08 2hg0 s ALA 140 Cb -0.12 -1.19 -0.02 0.00 0.00 0.00 0.00 23.12 21.79 2hg0 s ALA 140 CO 0.02 0.17 -0.09 0.42 0.00 0.00 0.00 175.76 176.28 2hg0 s ILE 141 N 0.49 3.42 0.23 0.00 1.01 -0.10 -1.81 121.20 124.44 2hg0 s ILE 141 Ca -0.10 -0.53 0.09 0.00 0.00 0.00 0.00 60.65 60.11 2hg0 s ILE 141 Cb -0.16 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 2hg0 s ILE 141 CO 0.05 0.51 -0.00 0.12 0.00 0.00 0.00 174.94 175.62 2hg0 s PHE 142 N 0.32 2.75 -0.12 3.97 5.36 -0.47 -0.85 117.98 128.94 2hg0 s PHE 142 Ca -0.08 -0.19 0.01 0.00 -0.96 0.00 0.00 56.93 55.71 2hg0 s PHE 142 Cb -0.15 -1.26 0.02 0.00 -0.34 0.00 0.00 43.02 41.29 2hg0 s PHE 142 CO 0.04 0.58 -0.12 0.08 -1.46 0.00 0.00 175.22 174.34 2hg0 s VAL 143 N -2.09 1.36 0.00 3.12 1.01 -0.63 -1.77 120.40 121.39 2hg0 s VAL 143 Ca 0.30 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 2hg0 s VAL 143 Cb -0.07 -1.28 -0.09 0.00 0.00 0.00 0.00 36.38 34.93 2hg0 s VAL 143 CO 0.19 0.42 1.69 1.41 0.00 0.00 0.00 175.10 178.81 2hg0 n HIS 144 N 4.57 0.00 -1.87 5.22 8.25 -0.24 -4.82 115.22 126.33 2hg0 n HIS 144 Ca -0.17 -0.66 -0.26 0.00 -0.26 0.00 0.00 57.72 56.37 2hg0 n HIS 144 Cb 0.50 -0.78 0.18 0.00 1.12 0.00 0.00 29.99 31.01 2hg0 n HIS 144 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hg0 n GLY 145 N 2.40 -1.35 3.50 -1.41 0.00 -1.26 -4.71 105.19 102.36 2hg0 n GLY 145 Ca 0.14 -1.72 -0.49 0.00 0.00 0.00 0.00 46.02 43.95 2hg0 n GLY 145 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hg0 n PRO 146 N -3.50 0.59 -3.86 1.61 -0.02 -1.26 -4.98 135.00 123.59 2hg0 n PRO 146 Ca 0.15 0.21 -0.09 0.00 -2.02 0.00 0.00 63.50 61.75 2hg0 n PRO 146 Cb 0.52 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 2hg0 n PRO 146 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2hg0 s THR 147 N -0.67 0.00 0.09 3.45 -4.23 -1.26 -5.04 115.64 107.97 2hg0 s THR 147 Ca 0.69 -1.09 -0.00 0.00 -1.18 0.00 0.00 61.69 60.11 2hg0 s THR 147 Cb -0.90 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 2hg0 s THR 147 CO 0.56 0.00 -0.01 0.42 -0.54 0.00 0.00 174.62 175.05 2hg0 s THR 148 N -2.77 0.30 0.27 3.99 -4.23 -1.26 -0.17 115.64 111.76 2hg0 s THR 148 Ca 0.17 -1.87 -0.01 0.00 -1.18 0.00 0.00 61.69 58.79 2hg0 s THR 148 Cb -0.05 -1.72 0.31 0.00 1.34 0.00 0.00 72.50 72.38 2hg0 s THR 148 CO 0.11 -0.81 1.63 0.58 -0.54 0.00 0.00 174.62 175.60 2hg0 h VAL 149 N 3.01 0.29 0.00 2.29 2.07 -1.93 -0.61 116.25 121.37 2hg0 h VAL 149 Ca -0.35 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2hg0 h VAL 149 Cb 1.16 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2hg0 h VAL 149 CO 0.64 0.03 0.00 1.21 0.02 0.00 0.00 177.57 179.46 2hg0 n GLU 150 N -5.30 0.00 0.08 1.57 2.13 -1.26 -3.48 120.64 114.38 2hg0 n GLU 150 Ca 0.19 0.10 0.04 0.00 0.66 0.00 0.00 57.16 58.14 2hg0 n GLU 150 Cb 0.61 -0.90 0.21 0.00 0.27 0.00 0.00 31.44 31.64 2hg0 n GLU 150 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2hg0 n SER 151 N -0.50 0.20 0.01 4.31 3.41 -1.12 -3.13 113.62 116.81 2hg0 n SER 151 Ca 0.00 0.48 0.03 0.00 -0.26 0.00 0.00 58.87 59.12 2hg0 n SER 151 Cb 0.00 -0.47 0.38 0.00 -0.26 0.00 0.00 64.21 63.86 2hg0 n SER 151 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 2hg0 h HIS 152 N 0.00 0.50 -0.01 7.33 2.76 -1.14 -2.95 115.15 121.63 2hg0 h HIS 152 Ca 0.00 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2hg0 h HIS 152 Cb 0.36 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.16 2hg0 h HIS 152 CO 0.00 0.39 -0.42 0.41 -1.30 0.00 0.00 177.93 177.01 2hg0 n GLY 153 N -1.24 0.03 3.60 5.26 0.00 -1.18 -4.88 105.19 106.78 2hg0 n GLY 153 Ca 0.02 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 2hg0 n GLY 153 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2hg0 s ASN 154 N -2.27 6.62 0.22 1.61 3.84 -1.12 -4.88 114.94 118.95 2hg0 s ASN 154 Ca 0.17 0.57 -0.10 0.00 0.21 0.00 0.00 52.86 53.71 2hg0 s ASN 154 Cb 0.16 -2.55 0.17 0.00 -0.55 0.00 0.00 41.25 38.49 2hg0 s ASN 154 CO 0.51 -1.25 1.88 0.22 -2.79 0.00 0.00 177.10 175.68 2hg0 h TYR 155 N 9.33 1.01 0.00 0.43 3.20 -1.90 -2.42 116.97 126.62 2hg0 h TYR 155 Ca -0.23 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.66 2hg0 h TYR 155 Cb 1.07 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.00 2hg0 h TYR 155 CO 0.96 0.64 0.00 0.43 -1.64 0.00 0.00 178.16 178.56 2hg0 n SER 156 N -4.52 0.00 -0.35 -2.11 7.64 -1.26 -0.63 113.62 112.39 2hg0 n SER 156 Ca 0.08 0.93 -0.00 0.00 1.01 0.00 0.00 58.87 60.88 2hg0 n SER 156 Cb 0.02 -0.43 0.05 0.00 -1.01 0.00 0.00 64.21 62.84 2hg0 n SER 156 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2hg0 n THR 157 N -2.06 -0.48 -0.08 0.44 -1.04 -1.21 -0.56 114.28 109.29 2hg0 n THR 157 Ca 0.00 2.16 -0.07 0.00 -2.04 0.00 0.00 64.05 64.10 2hg0 n THR 157 Cb 0.00 -2.87 0.00 0.00 -1.82 0.00 0.00 70.33 65.64 2hg0 n THR 157 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2hg0 h GLN 158 N 0.00 0.23 0.04 -2.82 1.08 -1.20 0.48 115.11 112.91 2hg0 h GLN 158 Ca 0.33 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.54 2hg0 h GLN 158 Cb 0.56 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2hg0 h GLN 158 CO -0.92 0.15 -0.14 0.28 -0.95 0.00 0.00 178.83 177.25 2hg0 h VAL 159 N 0.24 0.67 -0.72 -0.54 2.07 0.16 0.16 116.25 118.29 2hg0 h VAL 159 Ca 0.14 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.82 2hg0 h VAL 159 Cb 0.11 0.67 -0.11 0.00 -1.52 0.00 0.00 31.29 30.43 2hg0 h VAL 159 CO -0.14 0.00 0.11 1.23 0.02 0.00 0.00 177.57 178.79 2hg0 h GLY 160 N -0.25 0.93 0.83 2.17 0.00 0.07 1.31 103.07 108.12 2hg0 h GLY 160 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2hg0 h GLY 160 CO -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 176.54 176.21 2hg0 n ALA 161 N -2.74 2.38 -3.76 3.60 0.00 0.16 -4.85 120.51 115.30 2hg0 n ALA 161 Ca 0.13 -0.13 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 2hg0 n ALA 161 Cb 0.45 -1.33 0.04 0.00 0.00 0.00 0.00 19.45 18.61 2hg0 n ALA 161 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2hg0 n THR 162 N -0.91 -3.30 -1.69 0.00 -2.24 0.45 -4.88 114.28 101.70 2hg0 n THR 162 Ca 0.15 -0.21 0.06 0.00 -2.27 0.00 0.00 64.05 61.78 2hg0 n THR 162 Cb 0.07 -3.50 0.14 0.00 -2.10 0.00 0.00 70.33 64.94 2hg0 n THR 162 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hg0 n GLN 163 N -4.56 1.07 -3.65 -0.78 6.02 0.39 -4.58 117.38 111.28 2hg0 n GLN 163 Ca -0.10 -2.69 -0.06 0.00 -0.01 0.00 0.00 57.00 54.14 2hg0 n GLN 163 Cb 0.59 -1.18 -0.02 0.00 1.02 0.00 0.00 30.24 30.66 2hg0 n GLN 163 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hg0 s ALA 164 N -2.24 -1.72 -0.13 -1.58 0.00 -1.23 -1.61 121.76 113.25 2hg0 s ALA 164 Ca 0.33 0.48 -0.32 0.00 0.00 0.00 0.00 51.96 52.45 2hg0 s ALA 164 Cb 0.32 0.56 0.13 0.00 0.00 0.00 0.00 23.12 24.13 2hg0 s ALA 164 CO -0.06 -0.90 1.07 0.20 0.00 0.00 0.00 175.76 176.07 2hg0 s GLY 165 N -2.76 -0.32 -0.21 0.00 0.00 -0.03 -4.62 107.32 99.38 2hg0 s GLY 165 Ca 0.09 1.57 -0.04 0.00 0.00 0.00 0.00 44.72 46.34 2hg0 s GLY 165 CO -0.03 0.60 0.17 -1.60 0.00 0.00 0.00 173.10 172.25 2hg0 s ARG 166 N -2.32 0.16 0.41 2.90 3.52 -1.26 -0.93 118.95 121.43 2hg0 s ARG 166 Ca 0.06 -0.02 0.06 0.00 -0.13 0.00 0.00 55.73 55.70 2hg0 s ARG 166 Cb -0.01 -1.36 -0.07 0.00 -1.56 0.00 0.00 34.95 31.95 2hg0 s ARG 166 CO -0.05 -0.74 0.02 -0.59 -0.81 0.00 0.00 175.30 173.12 2hg0 s PHE 167 N 2.24 2.36 0.18 5.12 -0.12 -0.64 -4.99 117.98 122.13 2hg0 s PHE 167 Ca 0.06 -0.75 0.09 0.00 -0.05 0.00 0.00 56.93 56.28 2hg0 s PHE 167 Cb -0.16 -1.68 -0.04 0.00 -0.63 0.00 0.00 43.02 40.51 2hg0 s PHE 167 CO -0.16 0.35 -0.12 -1.54 -0.05 0.00 0.00 175.22 173.70 2hg0 s SER 168 N -3.69 4.09 -0.04 1.98 1.04 -1.26 -1.16 113.70 114.66 2hg0 s SER 168 Ca 0.32 -0.64 0.06 0.00 0.48 0.00 0.00 55.95 56.17 2hg0 s SER 168 Cb 0.09 -0.63 -0.01 0.00 0.10 0.00 0.00 66.02 65.57 2hg0 s SER 168 CO 0.16 0.11 -0.21 -0.63 0.98 0.00 0.00 173.24 173.65 2hg0 s ILE 169 N -1.70 1.71 0.08 -1.02 1.01 0.15 -4.93 121.20 116.51 2hg0 s ILE 169 Ca 0.24 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 60.02 2hg0 s ILE 169 Cb -0.09 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2hg0 s ILE 169 CO 0.14 0.48 -0.07 0.42 0.00 0.00 0.00 174.94 175.91 2hg0 s THR 170 N -0.21 0.65 0.56 2.92 -4.23 -1.14 0.99 115.64 115.18 2hg0 s THR 170 Ca 0.00 -1.63 0.24 0.00 -1.18 0.00 0.00 61.69 59.12 2hg0 s THR 170 Cb -0.11 -1.31 0.33 0.00 1.34 0.00 0.00 72.50 72.75 2hg0 s THR 170 CO 0.02 -0.69 2.15 -0.65 -0.54 0.00 0.00 174.62 174.90 2hg0 h PRO 171 N 3.51 0.00 0.60 3.99 0.11 -1.90 0.74 132.00 139.05 2hg0 h PRO 171 Ca -0.36 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 2hg0 h PRO 171 Cb 1.18 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.29 2hg0 h PRO 171 CO 0.56 0.00 -0.29 0.00 -0.21 0.00 0.00 178.00 178.06 2hg0 h ALA 172 N 1.92 -0.80 -2.94 -0.75 0.00 -1.92 -3.38 119.26 111.39 2hg0 h ALA 172 Ca 0.05 -0.20 -0.61 0.00 0.00 0.00 0.00 54.91 54.15 2hg0 h ALA 172 Cb 0.22 0.31 -0.40 0.00 0.00 0.00 0.00 17.79 17.92 2hg0 h ALA 172 CO -0.00 -0.88 -0.74 0.00 0.00 0.00 0.00 179.25 177.63 2hg0 s ALA 173 N -5.51 2.23 -1.83 0.00 0.00 -0.65 -5.00 121.76 111.00 2hg0 s ALA 173 Ca -0.16 -2.69 0.14 0.00 0.00 0.00 0.00 51.96 49.25 2hg0 s ALA 173 Cb 0.03 -1.89 0.77 0.00 0.00 0.00 0.00 23.12 22.03 2hg0 s ALA 173 CO 0.56 -2.06 1.27 -2.30 0.00 0.00 0.00 175.76 173.23 2hg0 n PRO 174 N 3.35 0.36 -3.63 0.00 -0.02 0.16 -2.87 135.00 132.35 2hg0 n PRO 174 Ca 0.11 0.05 -0.19 0.00 -2.02 0.00 0.00 63.50 61.45 2hg0 n PRO 174 Cb 0.36 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.29 2hg0 n PRO 174 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2hg0 n SER 175 N -1.08 2.14 -3.63 2.55 3.41 -1.26 -2.30 113.62 113.44 2hg0 n SER 175 Ca 0.09 -2.40 -0.03 0.00 -0.26 0.00 0.00 58.87 56.26 2hg0 n SER 175 Cb 0.06 0.41 -0.04 0.00 -0.26 0.00 0.00 64.21 64.39 2hg0 n SER 175 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2hg0 s TYR 176 N -2.32 -0.08 -0.41 7.33 5.04 -0.25 -4.92 117.35 121.74 2hg0 s TYR 176 Ca 0.06 0.12 0.03 0.00 -2.44 0.00 0.00 57.07 54.83 2hg0 s TYR 176 Cb 0.00 0.49 0.12 0.00 0.35 0.00 0.00 41.96 42.92 2hg0 s TYR 176 CO 0.04 -0.09 0.16 0.99 -1.34 0.00 0.00 175.55 175.31 2hg0 s THR 177 N -1.35 1.96 -0.21 4.34 2.01 -1.26 -0.95 115.64 120.18 2hg0 s THR 177 Ca 0.08 -2.51 -0.29 0.00 0.31 0.00 0.00 61.69 59.28 2hg0 s THR 177 Cb -0.01 -2.41 0.00 0.00 0.01 0.00 0.00 72.50 70.09 2hg0 s THR 177 CO -0.06 -0.73 1.07 -0.22 -0.69 0.00 0.00 174.62 174.00 2hg0 s LEU 178 N 0.57 4.13 0.00 4.42 2.96 0.12 -4.89 118.68 125.99 2hg0 s LEU 178 Ca 0.14 1.45 -0.18 0.00 -0.22 0.00 0.00 54.13 55.31 2hg0 s LEU 178 Cb -0.22 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.87 2hg0 s LEU 178 CO -0.07 -0.66 0.52 -0.54 -1.32 0.00 0.00 176.35 174.28 2hg0 s LYS 179 N 3.12 4.18 -0.46 1.98 1.02 -1.26 -0.81 119.74 127.50 2hg0 s LYS 179 Ca 0.46 0.60 0.09 0.00 0.02 0.00 0.00 55.97 57.14 2hg0 s LYS 179 Cb -0.16 -3.29 0.38 0.00 -0.52 0.00 0.00 37.83 34.23 2hg0 s LYS 179 CO 0.09 0.51 0.94 1.28 -0.92 0.00 0.00 175.35 177.24 2hg0 n LEU 180 N 2.31 3.26 0.00 3.17 4.77 -0.14 -4.97 117.00 125.40 2hg0 n LEU 180 Ca -0.10 -5.12 0.00 0.00 -0.03 0.00 0.00 56.01 50.76 2hg0 n LEU 180 Cb 0.51 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2hg0 n LEU 180 CO 0.41 2.20 0.00 0.61 -1.33 0.00 0.00 177.39 179.28 2hg0 n GLY 181 N -0.16 2.20 0.00 -0.72 0.00 -1.26 -1.35 105.19 103.91 2hg0 n GLY 181 Ca 0.28 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2hg0 n GLY 181 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hg0 n GLU 182 N 13.25 0.00 -0.14 1.61 1.02 -1.26 -0.57 120.64 134.55 2hg0 n GLU 182 Ca 0.00 0.18 0.08 0.00 -0.02 0.00 0.00 57.16 57.40 2hg0 n GLU 182 Cb 0.00 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 30.19 2hg0 n GLU 182 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2hg0 n TYR 183 N -1.18 0.36 0.00 -0.32 4.01 -0.46 -4.71 117.16 114.87 2hg0 n TYR 183 Ca 0.00 -0.18 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2hg0 n TYR 183 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2hg0 n TYR 183 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hg0 n GLY 184 N 1.12 2.16 3.53 2.72 0.00 0.26 -0.27 105.19 114.71 2hg0 n GLY 184 Ca 0.14 -0.44 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 2hg0 n GLY 184 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hg0 s GLU 185 N 0.00 0.71 -0.02 1.61 -1.05 0.13 -0.97 118.70 119.11 2hg0 s GLU 185 Ca 0.00 -0.27 0.06 0.00 -0.15 0.00 0.00 54.97 54.62 2hg0 s GLU 185 Cb 0.00 0.32 -0.01 0.00 -0.44 0.00 0.00 34.13 34.00 2hg0 s GLU 185 CO 0.00 -0.31 -0.21 0.08 0.95 0.00 0.00 175.26 175.77 2hg0 s VAL 186 N -2.96 1.70 -0.28 1.83 1.01 0.01 -2.07 120.40 119.64 2hg0 s VAL 186 Ca 0.06 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.15 2hg0 s VAL 186 Cb -0.01 -1.42 0.08 0.00 0.00 0.00 0.00 36.38 35.03 2hg0 s VAL 186 CO -0.08 0.48 -0.00 -0.89 0.00 0.00 0.00 175.10 174.61 2hg0 s THR 187 N -0.39 1.63 0.34 3.92 2.01 -0.95 0.15 115.64 122.35 2hg0 s THR 187 Ca 0.05 -1.56 -0.04 0.00 0.31 0.00 0.00 61.69 60.46 2hg0 s THR 187 Cb -0.09 -2.02 -0.05 0.00 0.01 0.00 0.00 72.50 70.35 2hg0 s THR 187 CO 0.00 -0.33 0.60 0.68 -0.69 0.00 0.00 174.62 174.89 2hg0 s VAL 188 N 1.30 5.01 -0.31 3.82 -7.23 -0.13 -2.76 120.40 120.10 2hg0 s VAL 188 Ca 0.01 -0.01 0.15 0.00 -1.81 0.00 0.00 61.98 60.32 2hg0 s VAL 188 Cb -0.19 -3.78 0.47 0.00 0.56 0.00 0.00 36.38 33.44 2hg0 s VAL 188 CO -0.10 -0.47 1.10 0.47 -0.31 0.00 0.00 175.10 175.79 2hg0 n ASP 189 N -1.36 2.92 -4.48 4.85 8.00 -1.18 -1.09 116.55 124.20 2hg0 n ASP 189 Ca -0.02 -2.88 -0.43 0.00 0.71 0.00 0.00 54.79 52.17 2hg0 n ASP 189 Cb 0.55 -0.45 -0.00 0.00 -0.02 0.00 0.00 41.12 41.19 2hg0 n ASP 189 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hg0 s GLU 191 N -1.48 1.96 0.38 0.00 2.02 0.13 -4.45 118.70 117.26 2hg0 s GLU 191 Ca 0.62 -1.83 0.00 0.00 0.02 0.00 0.00 54.97 53.78 2hg0 s GLU 191 Cb -0.68 -3.56 0.00 0.00 0.10 0.00 0.00 34.13 29.99 2hg0 s GLU 191 CO 0.58 -1.06 0.60 -2.30 0.02 0.00 0.00 175.26 173.09 2hg0 n PRO 192 N 4.56 0.02 -1.59 0.39 -0.02 -1.26 -3.75 135.00 133.36 2hg0 n PRO 192 Ca -0.02 0.55 -0.41 0.00 -2.02 0.00 0.00 63.50 61.60 2hg0 n PRO 192 Cb 0.41 -1.56 0.02 0.00 -0.02 0.00 0.00 33.50 32.35 2hg0 n PRO 192 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2hg0 n ARG 193 N -1.66 1.17 -3.61 -0.52 1.85 -1.26 -4.92 116.66 107.70 2hg0 n ARG 193 Ca 0.00 0.42 -0.06 0.00 -1.00 0.00 0.00 57.85 57.21 2hg0 n ARG 193 Cb 0.60 -1.98 -0.02 0.00 -1.05 0.00 0.00 32.46 30.01 2hg0 n ARG 193 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2hg0 s SER 194 N -0.85 -0.28 -0.69 2.89 1.04 -1.26 -4.11 113.70 110.45 2hg0 s SER 194 Ca 0.65 -0.18 -0.16 0.00 0.48 0.00 0.00 55.95 56.74 2hg0 s SER 194 Cb -0.54 0.43 0.16 0.00 0.10 0.00 0.00 66.02 66.17 2hg0 s SER 194 CO 0.56 -0.74 0.67 -0.83 0.98 0.00 0.00 173.24 173.88 2hg0 s GLY 195 N -2.69 2.28 0.18 7.32 0.00 -1.26 -4.96 107.32 108.19 2hg0 s GLY 195 Ca 0.08 -2.84 -0.00 0.00 0.00 0.00 0.00 44.72 41.96 2hg0 s GLY 195 CO -0.04 1.32 0.23 0.29 0.00 0.00 0.00 173.10 174.90 2hg0 n ILE 196 N 4.77 0.00 -2.84 0.90 -5.35 -1.26 -4.59 119.36 110.99 2hg0 n ILE 196 Ca 0.00 -0.94 -0.41 0.00 -0.27 0.00 0.00 62.75 61.13 2hg0 n ILE 196 Cb 0.44 0.56 -0.04 0.00 -1.74 0.00 0.00 39.64 38.86 2hg0 n ILE 196 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2hg0 s ASP 197 N -2.11 7.08 0.51 7.28 1.01 -1.26 -5.01 116.67 124.18 2hg0 s ASP 197 Ca 0.15 1.32 -0.22 0.00 0.71 0.00 0.00 52.55 54.52 2hg0 s ASP 197 Cb -0.00 -2.49 -0.07 0.00 1.01 0.00 0.00 42.92 41.37 2hg0 s ASP 197 CO 0.11 -0.35 1.16 0.41 0.21 0.00 0.00 175.17 176.70 2hg0 n THR 198 N 4.44 3.24 0.19 -1.27 -1.04 -1.26 -4.79 114.28 113.79 2hg0 n THR 198 Ca 0.05 -0.50 0.05 0.00 -2.04 0.00 0.00 64.05 61.61 2hg0 n THR 198 Cb 0.49 -1.39 0.26 0.00 -1.82 0.00 0.00 70.33 67.87 2hg0 n THR 198 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2hg0 h ASN 199 N 1.32 0.00 -1.36 8.00 7.08 -1.95 -2.93 115.58 125.74 2hg0 h ASN 199 Ca -0.48 0.00 0.39 0.00 -3.08 0.00 0.00 56.30 53.13 2hg0 h ASN 199 Cb 1.33 0.00 -0.05 0.00 -2.08 0.00 0.00 38.32 37.51 2hg0 h ASN 199 CO 0.56 0.00 1.26 0.00 -2.08 0.00 0.00 177.43 177.16 2hg0 h ALA 200 N 0.74 3.28 -2.55 4.14 0.00 -1.91 -3.40 119.26 119.56 2hg0 h ALA 200 Ca 0.00 -0.05 -0.51 0.00 0.00 0.00 0.00 54.91 54.36 2hg0 h ALA 200 Cb 0.99 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2hg0 h ALA 200 CO 0.00 -1.96 0.19 0.71 0.00 0.00 0.00 179.25 178.19 2hg0 s TYR 201 N -4.62 3.71 0.73 0.00 2.02 -1.11 -3.75 117.35 114.34 2hg0 s TYR 201 Ca -0.04 1.55 -0.07 0.00 -0.37 0.00 0.00 57.07 58.14 2hg0 s TYR 201 Cb 0.19 -2.73 0.07 0.00 -0.40 0.00 0.00 41.96 39.09 2hg0 s TYR 201 CO 0.64 0.34 1.05 0.71 -1.57 0.00 0.00 175.55 176.71 2hg0 s TYR 202 N -1.48 2.80 -0.64 2.71 2.02 0.32 -4.74 117.35 118.34 2hg0 s TYR 202 Ca 0.44 0.44 -0.08 0.00 -0.37 0.00 0.00 57.07 57.49 2hg0 s TYR 202 Cb -0.18 -3.27 0.17 0.00 -0.40 0.00 0.00 41.96 38.27 2hg0 s TYR 202 CO 0.23 -1.52 0.51 0.08 -1.57 0.00 0.00 175.55 173.28 2hg0 s VAL 203 N -3.31 4.44 -0.08 0.71 1.01 0.15 -2.48 120.40 120.85 2hg0 s VAL 203 Ca 0.61 -2.47 -0.30 0.00 0.00 0.00 0.00 61.98 59.82 2hg0 s VAL 203 Cb -0.10 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 2hg0 s VAL 203 CO 0.46 -0.89 1.06 -0.32 0.00 0.00 0.00 175.10 175.40 2hg0 s MET 204 N 0.42 4.42 -0.14 2.72 1.75 0.38 -0.18 119.30 128.66 2hg0 s MET 204 Ca 0.14 1.47 0.02 0.00 -1.25 0.00 0.00 55.69 56.07 2hg0 s MET 204 Cb -0.19 -3.53 0.01 0.00 2.84 0.00 0.00 34.83 33.96 2hg0 s MET 204 CO -0.04 -0.33 -0.22 0.99 -0.65 0.00 0.00 175.02 174.78 2hg0 s THR 205 N 1.96 2.06 -0.31 10.11 2.01 0.13 0.26 115.64 131.86 2hg0 s THR 205 Ca 0.51 -0.97 -0.01 0.00 0.31 0.00 0.00 61.69 61.52 2hg0 s THR 205 Cb -0.20 -1.82 0.10 0.00 0.01 0.00 0.00 72.50 70.59 2hg0 s THR 205 CO 0.20 0.55 0.11 -0.69 -0.69 0.00 0.00 174.62 174.10 2hg0 s VAL 206 N 0.88 0.66 0.00 3.82 1.01 -1.19 -2.86 120.40 122.72 2hg0 s VAL 206 Ca -0.05 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 60.65 2hg0 s VAL 206 Cb -0.15 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 34.72 2hg0 s VAL 206 CO -0.03 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 174.98 2hg0 n GLY 207 N 4.91 0.43 0.24 4.51 0.00 -1.26 -1.92 105.19 112.11 2hg0 n GLY 207 Ca -0.03 0.64 -0.02 0.00 0.00 0.00 0.00 46.02 46.62 2hg0 n GLY 207 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hg0 n THR 208 N 0.00 0.11 -2.45 2.61 -1.04 -1.26 -4.98 114.28 107.27 2hg0 n THR 208 Ca 0.00 -0.04 -0.41 0.00 -2.04 0.00 0.00 64.05 61.56 2hg0 n THR 208 Cb 0.00 -0.81 -0.03 0.00 -1.82 0.00 0.00 70.33 67.67 2hg0 n THR 208 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2hg0 s LYS 209 N -2.04 3.11 0.49 -2.82 1.02 -0.81 -4.91 119.74 113.79 2hg0 s LYS 209 Ca -0.03 -0.02 -0.19 0.00 0.02 0.00 0.00 55.97 55.75 2hg0 s LYS 209 Cb 0.01 -4.20 -0.08 0.00 -0.52 0.00 0.00 37.83 33.03 2hg0 s LYS 209 CO 0.04 -2.22 1.00 0.99 -0.92 0.00 0.00 175.35 174.24 2hg0 s THR 210 N 6.30 4.18 0.20 2.17 2.01 -1.26 -3.18 115.64 126.07 2hg0 s THR 210 Ca 0.42 1.23 -0.09 0.00 0.31 0.00 0.00 61.69 63.56 2hg0 s THR 210 Cb -0.09 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.85 2hg0 s THR 210 CO 0.17 -0.42 0.32 -0.36 -0.69 0.00 0.00 174.62 173.65 2hg0 s PHE 211 N -2.28 0.53 -0.30 4.92 0.08 0.14 -2.36 117.98 118.71 2hg0 s PHE 211 Ca 0.63 -0.86 0.02 0.00 0.12 0.00 0.00 56.93 56.83 2hg0 s PHE 211 Cb -0.12 -0.06 0.07 0.00 -0.57 0.00 0.00 43.02 42.33 2hg0 s PHE 211 CO 0.23 -0.80 -0.03 -1.17 -0.10 0.00 0.00 175.22 173.35 2hg0 s LEU 212 N -3.02 3.97 0.27 -0.37 2.96 0.26 -0.47 118.68 122.28 2hg0 s LEU 212 Ca 0.23 -1.57 0.08 0.00 -0.22 0.00 0.00 54.13 52.65 2hg0 s LEU 212 Cb 0.03 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 2hg0 s LEU 212 CO 0.05 -0.27 0.14 0.68 -1.32 0.00 0.00 176.35 175.63 2hg0 s VAL 213 N 1.10 3.93 0.10 1.68 -7.23 -1.03 -2.34 120.40 116.60 2hg0 s VAL 213 Ca -0.03 -1.59 -0.31 0.00 -1.81 0.00 0.00 61.98 58.24 2hg0 s VAL 213 Cb -0.20 -3.17 -0.07 0.00 0.56 0.00 0.00 36.38 33.50 2hg0 s VAL 213 CO -0.05 -0.33 1.34 -1.00 -0.31 0.00 0.00 175.10 174.76 2hg0 s HIS 214 N -2.23 3.29 0.16 2.82 3.76 -1.26 0.12 115.29 121.94 2hg0 s HIS 214 Ca 0.33 1.04 -0.10 0.00 -0.15 0.00 0.00 55.06 56.18 2hg0 s HIS 214 Cb -0.07 -3.62 0.18 0.00 1.11 0.00 0.00 32.58 30.19 2hg0 s HIS 214 CO 0.23 -2.11 1.00 0.54 -0.85 0.00 0.00 174.74 173.55 2hg0 n ARG 215 N 3.96 -0.13 0.12 1.40 5.12 -1.25 -2.07 116.66 123.82 2hg0 n ARG 215 Ca 0.11 0.99 -0.11 0.00 -1.93 0.00 0.00 57.85 56.92 2hg0 n ARG 215 Cb 0.43 -1.48 -0.07 0.00 -1.16 0.00 0.00 32.46 30.19 2hg0 n ARG 215 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2hg0 h GLU 216 N 0.00 -0.35 -1.02 5.56 3.07 -1.91 0.14 114.58 120.07 2hg0 h GLU 216 Ca 0.24 0.02 0.36 0.00 -0.50 0.00 0.00 59.36 59.49 2hg0 h GLU 216 Cb 0.40 0.08 -0.16 0.00 -0.84 0.00 0.00 28.75 28.23 2hg0 h GLU 216 CO -0.64 -0.01 0.58 2.35 -1.40 0.00 0.00 179.01 179.88 2hg0 h TRP 217 N -0.93 0.87 0.00 4.33 7.01 -1.69 1.17 115.95 126.71 2hg0 h TRP 217 Ca -0.04 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.00 2hg0 h TRP 217 Cb 0.50 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.34 2hg0 h TRP 217 CO 0.05 -0.28 0.00 0.34 -2.79 0.00 0.00 178.44 175.75 2hg0 n PHE 218 N -5.10 0.00 -0.30 2.65 7.35 -0.90 -3.83 117.46 117.32 2hg0 n PHE 218 Ca 0.34 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 57.17 2hg0 n PHE 218 Cb 1.12 -0.15 0.30 0.00 0.35 0.00 0.00 39.48 41.10 2hg0 n PHE 218 CO 0.00 0.00 0.00 1.98 -0.76 0.00 0.00 176.76 177.98 2hg0 h MET 219 N 0.00 0.20 -2.77 -4.13 4.05 -0.17 -2.34 114.93 109.79 2hg0 h MET 219 Ca 0.00 -0.01 -0.78 0.00 -0.28 0.00 0.00 59.70 58.63 2hg0 h MET 219 Cb 0.00 -0.05 -0.20 0.00 -0.80 0.00 0.00 31.60 30.55 2hg0 h MET 219 CO 0.00 0.14 1.60 -0.25 0.23 0.00 0.00 176.91 178.62 2hg0 n ASP 220 N -5.22 6.89 -4.46 1.39 9.92 0.40 -4.93 116.55 120.53 2hg0 n ASP 220 Ca 0.22 -3.35 -0.22 0.00 -0.53 0.00 0.00 54.79 50.91 2hg0 n ASP 220 Cb 0.71 -1.31 -0.11 0.00 -0.64 0.00 0.00 41.12 39.77 2hg0 n ASP 220 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2hg0 s LEU 221 N -2.48 2.25 -0.43 0.64 2.96 -0.88 -4.70 118.68 116.05 2hg0 s LEU 221 Ca 0.42 -1.38 -0.03 0.00 -0.22 0.00 0.00 54.13 52.91 2hg0 s LEU 221 Cb 0.14 -0.44 0.12 0.00 0.50 0.00 0.00 46.19 46.51 2hg0 s LEU 221 CO -0.04 -0.60 0.23 0.21 -1.32 0.00 0.00 176.35 174.84 2hg0 s ASN 222 N -3.52 5.27 -0.13 3.68 3.84 -1.26 -5.03 114.94 117.80 2hg0 s ASN 222 Ca 0.36 -2.11 -0.30 0.00 0.21 0.00 0.00 52.86 51.02 2hg0 s ASN 222 Cb 0.09 -1.84 0.12 0.00 -0.55 0.00 0.00 41.25 39.07 2hg0 s ASN 222 CO 0.16 -0.53 0.98 -0.76 -2.79 0.00 0.00 177.10 174.15 2hg0 s LEU 223 N 1.03 -0.36 0.97 3.21 1.43 -1.26 -5.10 118.68 118.60 2hg0 s LEU 223 Ca 0.09 0.30 -0.13 0.00 -1.03 0.00 0.00 54.13 53.36 2hg0 s LEU 223 Cb -0.23 1.88 0.08 0.00 0.03 0.00 0.00 46.19 47.95 2hg0 s LEU 223 CO -0.04 -0.40 0.54 -2.65 0.23 0.00 0.00 176.35 174.04 2hg0 n PRO 224 N 0.49 -0.57 -3.52 1.29 -0.02 -1.26 -4.83 135.00 126.58 2hg0 n PRO 224 Ca -0.09 -0.12 -0.10 0.00 -2.02 0.00 0.00 63.50 61.17 2hg0 n PRO 224 Cb 0.59 -1.96 -0.02 0.00 -0.02 0.00 0.00 33.50 32.09 2hg0 n PRO 224 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2hg0 s TRP 225 N -2.43 -0.41 -0.22 6.00 1.48 -1.08 -2.71 118.94 119.58 2hg0 s TRP 225 Ca 0.59 0.19 -0.15 0.00 -1.06 0.00 0.00 56.10 55.67 2hg0 s TRP 225 Cb -0.21 0.58 0.06 0.00 -1.16 0.00 0.00 33.47 32.74 2hg0 s TRP 225 CO 0.65 -0.80 0.54 -1.12 -4.06 0.00 0.00 176.95 172.17 2hg0 s SER 226 N -2.70 -0.67 0.00 -2.66 0.01 -0.90 -1.74 113.70 105.04 2hg0 s SER 226 Ca 0.04 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.46 2hg0 s SER 226 Cb -0.02 1.08 0.00 0.00 0.21 0.00 0.00 66.02 67.29 2hg0 s SER 226 CO -0.08 -0.21 0.00 -1.54 0.41 0.00 0.00 173.24 171.82 2hg0 n SER 227 N 3.78 0.00 -0.56 2.44 3.41 -1.26 -2.14 113.62 119.29 2hg0 n SER 227 Ca -0.19 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.48 2hg0 n SER 227 Cb 0.57 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.67 2hg0 n SER 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hg0 n ALA 228 N -3.00 2.35 -2.50 7.33 0.00 -1.26 -4.61 120.51 118.81 2hg0 n ALA 228 Ca 0.00 -1.48 -0.25 0.00 0.00 0.00 0.00 53.44 51.71 2hg0 n ALA 228 Cb 0.00 -0.43 -0.08 0.00 0.00 0.00 0.00 19.45 18.94 2hg0 n ALA 228 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2hg0 s GLY 229 N -1.33 2.18 0.00 0.00 0.00 -1.26 -5.00 107.32 101.91 2hg0 s GLY 229 Ca 0.24 -2.02 0.29 0.00 0.00 0.00 0.00 44.72 43.24 2hg0 s GLY 229 CO 0.11 -1.89 2.07 -1.14 0.00 0.00 0.00 173.10 172.25 2hg0 n SER 230 N -1.10 0.00 -4.72 1.64 3.41 -1.26 -4.74 113.62 106.85 2hg0 n SER 230 Ca -0.03 -0.69 -0.39 0.00 -0.26 0.00 0.00 58.87 57.50 2hg0 n SER 230 Cb 0.63 -0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 64.45 2hg0 n SER 230 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2hg0 s THR 231 N -2.17 5.05 -0.05 6.66 -4.23 -1.26 -5.03 115.64 114.62 2hg0 s THR 231 Ca 0.39 1.37 0.04 0.00 -1.18 0.00 0.00 61.69 62.32 2hg0 s THR 231 Cb 0.20 -4.01 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 2hg0 s THR 231 CO 0.37 0.28 -0.15 0.68 -0.54 0.00 0.00 174.62 175.26 2hg0 s VAL 232 N 0.68 3.01 0.30 2.29 -7.23 -1.26 -4.62 120.40 113.57 2hg0 s VAL 232 Ca 0.36 -0.75 0.11 0.00 -1.81 0.00 0.00 61.98 59.88 2hg0 s VAL 232 Cb -0.17 -2.17 -0.06 0.00 0.56 0.00 0.00 36.38 34.54 2hg0 s VAL 232 CO 0.17 0.58 -0.15 0.26 -0.31 0.00 0.00 175.10 175.65 2hg0 s TRP 233 N -0.73 2.31 -1.92 2.82 0.52 -0.71 -4.73 118.94 116.50 2hg0 s TRP 233 Ca 0.11 -0.41 0.00 0.00 0.02 0.00 0.00 56.10 55.82 2hg0 s TRP 233 Cb -0.11 -1.14 0.00 0.00 -1.15 0.00 0.00 33.47 31.07 2hg0 s TRP 233 CO 0.01 0.65 0.00 0.54 0.02 0.00 0.00 176.95 178.16 2hg0 n ARG 234 N -0.68 -1.43 0.00 4.98 5.12 -1.26 -2.63 116.66 120.75 2hg0 n ARG 234 Ca -0.05 1.10 0.01 0.00 -1.93 0.00 0.00 57.85 56.97 2hg0 n ARG 234 Cb 0.61 -5.52 0.03 0.00 -1.16 0.00 0.00 32.46 26.42 2hg0 n ARG 234 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2hg0 n ASN 235 N -1.37 0.00 0.16 0.55 3.02 -1.26 -3.50 115.26 112.86 2hg0 n ASN 235 Ca -0.21 -0.22 0.06 0.00 -0.03 0.00 0.00 54.58 54.18 2hg0 n ASN 235 Cb 0.65 0.00 0.32 0.00 -0.61 0.00 0.00 39.78 40.14 2hg0 n ASN 235 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2hg0 n ARG 236 N -0.63 0.08 0.00 3.52 5.12 -1.26 -0.90 116.66 122.59 2hg0 n ARG 236 Ca 0.01 0.56 0.00 0.00 -1.93 0.00 0.00 57.85 56.48 2hg0 n ARG 236 Cb 0.00 -2.11 0.00 0.00 -1.16 0.00 0.00 32.46 29.20 2hg0 n ARG 236 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2hg0 n GLU 237 N -2.01 0.55 -0.74 5.56 -0.58 -1.23 -2.13 120.64 120.07 2hg0 n GLU 237 Ca -0.01 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.61 2hg0 n GLU 237 Cb 0.36 -1.09 0.13 0.00 -0.57 0.00 0.00 31.44 30.27 2hg0 n GLU 237 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2hg0 n THR 238 N -0.26 2.29 -0.14 2.62 5.66 -0.08 -4.56 114.28 119.81 2hg0 n THR 238 Ca 0.00 -1.15 -0.14 0.00 -3.05 0.00 0.00 64.05 59.72 2hg0 n THR 238 Cb 0.05 -0.64 0.13 0.00 -1.55 0.00 0.00 70.33 68.32 2hg0 n THR 238 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2hg0 n LEU 239 N -0.41 0.00 -3.63 1.09 4.77 -0.90 -4.59 117.00 113.33 2hg0 n LEU 239 Ca 0.35 -0.39 -0.22 0.00 -0.03 0.00 0.00 56.01 55.72 2hg0 n LEU 239 Cb 1.18 -0.47 0.04 0.00 -2.33 0.00 0.00 43.42 41.84 2hg0 n LEU 239 CO 0.36 -2.10 -0.05 0.23 -1.33 0.00 0.00 177.39 174.50 2hg0 n MET 240 N -3.33 -4.19 -0.09 3.23 2.81 -1.26 -4.26 117.12 110.03 2hg0 n MET 240 Ca 0.06 0.64 -0.16 0.00 -1.81 0.00 0.00 57.70 56.43 2hg0 n MET 240 Cb 0.27 -5.14 -0.07 0.00 -0.71 0.00 0.00 33.22 27.56 2hg0 n MET 240 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2hg0 n GLU 241 N -4.13 0.41 -0.21 0.03 0.28 -1.26 -3.66 120.64 112.09 2hg0 n GLU 241 Ca -0.25 0.13 -0.16 0.00 -0.16 0.00 0.00 57.16 56.73 2hg0 n GLU 241 Cb 0.66 -1.26 -0.04 0.00 1.43 0.00 0.00 31.44 32.23 2hg0 n GLU 241 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 2hg0 n PHE 242 N -3.38 0.10 0.30 -1.84 1.16 -1.26 -4.27 117.46 108.27 2hg0 n PHE 242 Ca -0.33 -0.59 0.03 0.00 -1.87 0.00 0.00 57.45 54.69 2hg0 n PHE 242 Cb 0.79 -0.72 0.16 0.00 -1.61 0.00 0.00 39.48 38.10 2hg0 n PHE 242 CO 0.00 0.00 0.00 -0.85 -1.87 0.00 0.00 176.76 174.04 2hg0 n GLU 243 N 5.94 0.10 -3.16 3.97 0.28 -1.26 -4.77 120.64 121.75 2hg0 n GLU 243 Ca 0.18 0.19 -0.07 0.00 -0.16 0.00 0.00 57.16 57.30 2hg0 n GLU 243 Cb 0.15 -1.50 0.03 0.00 1.43 0.00 0.00 31.44 31.54 2hg0 n GLU 243 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2hg0 n GLU 244 N -1.24 -1.69 0.00 3.44 -0.58 -1.26 -5.01 120.64 114.30 2hg0 n GLU 244 Ca 0.03 1.22 0.00 0.00 -0.42 0.00 0.00 57.16 57.99 2hg0 n GLU 244 Cb 0.04 -5.73 0.00 0.00 -0.57 0.00 0.00 31.44 25.19 2hg0 n GLU 244 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 2hg0 n PRO 245 N -2.40 0.86 -4.26 3.49 -0.02 -1.26 -5.07 135.00 126.33 2hg0 n PRO 245 Ca -0.03 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.21 2hg0 n PRO 245 Cb 0.55 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.96 2hg0 n PRO 245 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2hg0 s HIS 246 N -0.08 2.66 0.13 6.00 -3.43 -1.26 -4.80 115.29 114.51 2hg0 s HIS 246 Ca 0.00 -0.30 0.31 0.00 -0.80 0.00 0.00 55.06 54.27 2hg0 s HIS 246 Cb 0.00 -1.34 1.66 0.00 -1.43 0.00 0.00 32.58 31.47 2hg0 s HIS 246 CO 0.00 0.53 1.94 0.00 -2.00 0.00 0.00 174.74 175.21 2hg0 h ALA 247 N 1.80 1.00 0.16 -1.38 0.00 -1.97 -3.10 119.26 115.77 2hg0 h ALA 247 Ca -0.44 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 2hg0 h ALA 247 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2hg0 h ALA 247 CO 0.62 0.00 -0.07 1.15 0.00 0.00 0.00 179.25 180.95 2hg0 h THR 248 N 0.00 0.86 -2.59 0.00 2.02 -1.95 -3.44 112.91 107.81 2hg0 h THR 248 Ca 0.00 -1.15 -0.11 0.00 0.77 0.00 0.00 66.41 65.93 2hg0 h THR 248 Cb 0.00 1.45 -0.27 0.00 -1.74 0.00 0.00 68.15 67.60 2hg0 h THR 248 CO 0.00 0.22 -0.31 -0.75 0.37 0.00 0.00 175.52 175.06 2hg0 s LYS 249 N -3.39 0.38 -0.41 6.66 2.20 -1.17 -4.84 119.74 119.16 2hg0 s LYS 249 Ca -0.13 0.87 -0.09 0.00 -0.36 0.00 0.00 55.97 56.26 2hg0 s LYS 249 Cb 0.00 0.07 0.08 0.00 -1.51 0.00 0.00 37.83 36.47 2hg0 s LYS 249 CO 0.48 -0.18 0.25 -1.14 -0.36 0.00 0.00 175.35 174.39 2hg0 s GLN 250 N 1.73 2.59 -0.20 4.03 0.74 -1.26 -4.20 119.66 123.09 2hg0 s GLN 250 Ca -0.07 -1.45 -0.40 0.00 0.05 0.00 0.00 55.36 53.49 2hg0 s GLN 250 Cb -0.09 -3.76 -0.16 0.00 1.10 0.00 0.00 33.01 30.10 2hg0 s GLN 250 CO -0.13 -0.94 1.63 0.45 -0.55 0.00 0.00 175.29 175.75 2hg0 n SER 251 N 4.90 2.08 -3.62 6.67 2.88 -1.26 -4.88 113.62 120.40 2hg0 n SER 251 Ca -0.10 1.09 -0.31 0.00 -1.33 0.00 0.00 58.87 58.22 2hg0 n SER 251 Cb 0.43 -1.13 -0.06 0.00 -0.75 0.00 0.00 64.21 62.70 2hg0 n SER 251 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2hg0 n VAL 252 N 4.01 3.12 -1.86 2.46 0.31 -1.26 -4.39 118.33 120.71 2hg0 n VAL 252 Ca 0.25 -5.39 -0.42 0.00 -0.01 0.00 0.00 64.34 58.77 2hg0 n VAL 252 Cb 0.13 -2.11 -0.03 0.00 -0.91 0.00 0.00 33.84 30.92 2hg0 n VAL 252 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2hg0 s ILE 253 N -2.47 2.47 0.05 2.52 1.01 -1.24 -4.84 121.20 118.70 2hg0 s ILE 253 Ca 0.37 0.30 -0.31 0.00 0.00 0.00 0.00 60.65 61.01 2hg0 s ILE 253 Cb 0.11 -3.19 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 2hg0 s ILE 253 CO 0.01 0.02 1.39 0.00 0.00 0.00 0.00 174.94 176.36 2hg0 s ALA 254 N 1.33 3.57 0.11 9.38 0.00 -1.26 -4.67 121.76 130.23 2hg0 s ALA 254 Ca 0.72 0.98 -0.31 0.00 0.00 0.00 0.00 51.96 53.35 2hg0 s ALA 254 Cb -0.45 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.01 2hg0 s ALA 254 CO 0.32 -0.77 1.74 -1.17 0.00 0.00 0.00 175.76 175.87 2hg0 s LEU 255 N 1.83 4.38 0.06 0.00 2.96 -1.26 -4.88 118.68 121.77 2hg0 s LEU 255 Ca 0.64 2.66 -0.36 0.00 -0.22 0.00 0.00 54.13 56.84 2hg0 s LEU 255 Cb -0.33 -3.57 -0.16 0.00 0.50 0.00 0.00 46.19 42.63 2hg0 s LEU 255 CO 0.28 -0.95 1.45 0.61 -1.32 0.00 0.00 176.35 176.42 2hg0 n GLY 256 N 4.09 0.68 3.54 7.98 0.00 -1.26 -4.89 105.19 115.33 2hg0 n GLY 256 Ca 0.17 0.72 -0.43 0.00 0.00 0.00 0.00 46.02 46.48 2hg0 n GLY 256 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hg0 s SER 257 N 1.00 6.40 -0.61 1.61 0.01 -1.26 -5.00 113.70 115.86 2hg0 s SER 257 Ca 0.85 -0.16 -0.04 0.00 1.31 0.00 0.00 55.95 57.91 2hg0 s SER 257 Cb -0.90 -2.44 0.16 0.00 0.21 0.00 0.00 66.02 63.05 2hg0 s SER 257 CO 0.47 -1.14 0.43 0.00 0.41 0.00 0.00 173.24 173.40 2hg0 s GLN 258 N 3.84 2.55 0.00 12.44 0.00 -1.26 -4.93 119.66 132.31 2hg0 s GLN 258 Ca 0.33 -2.42 0.00 0.00 -0.00 0.00 0.00 55.36 53.27 2hg0 s GLN 258 Cb -0.12 -3.76 0.00 0.00 0.00 0.00 0.00 33.01 29.14 2hg0 s GLN 258 CO 0.22 -1.17 0.53 0.39 0.00 0.00 0.00 175.29 175.26 2hg0 n GLU 259 N 3.69 0.00 -0.20 9.60 -0.58 -1.26 -1.64 120.64 130.24 2hg0 n GLU 259 Ca 0.06 0.13 -0.08 0.00 -0.42 0.00 0.00 57.16 56.85 2hg0 n GLU 259 Cb 0.39 -1.55 0.02 0.00 -0.57 0.00 0.00 31.44 29.73 2hg0 n GLU 259 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2hg0 h GLY 260 N 0.00 0.93 -0.34 0.62 0.00 -1.98 -0.72 103.07 101.58 2hg0 h GLY 260 Ca 0.00 -0.51 0.28 0.00 0.00 0.00 0.00 47.33 47.10 2hg0 h GLY 260 CO 0.00 0.48 0.56 0.00 0.00 0.00 0.00 176.54 177.58 2hg0 h ALA 261 N 1.08 1.83 -0.06 3.60 0.00 -1.76 0.45 119.26 124.40 2hg0 h ALA 261 Ca 0.19 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2hg0 h ALA 261 Cb 0.21 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2hg0 h ALA 261 CO -0.02 -0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.09 2hg0 n LEU 262 N -4.99 0.06 -0.29 0.00 4.77 -0.97 -4.16 117.00 111.43 2hg0 n LEU 262 Ca 0.29 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 2hg0 n LEU 262 Cb 0.86 -0.49 0.04 0.00 -2.33 0.00 0.00 43.42 41.50 2hg0 n LEU 262 CO 0.12 -0.49 0.45 1.57 -1.33 0.00 0.00 177.39 177.72 2hg0 n HIS 263 N -1.97 0.06 -0.35 -1.77 -0.00 -0.31 0.47 115.22 111.35 2hg0 n HIS 263 Ca 0.00 0.93 0.27 0.00 0.46 0.00 0.00 57.72 59.38 2hg0 n HIS 263 Cb 0.00 -0.81 0.52 0.00 -0.12 0.00 0.00 29.99 29.59 2hg0 n HIS 263 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 2hg0 h GLN 264 N 0.00 0.23 -1.38 1.57 1.08 -0.28 0.56 115.11 116.89 2hg0 h GLN 264 Ca 0.28 -0.01 -0.53 0.00 -1.45 0.00 0.00 58.65 56.94 2hg0 h GLN 264 Cb 0.47 -0.05 -0.22 0.00 -0.05 0.00 0.00 27.48 27.63 2hg0 h GLN 264 CO -0.75 0.15 0.66 0.00 -0.95 0.00 0.00 178.83 177.94 2hg0 n ALA 265 N -2.33 5.87 -0.23 3.87 0.00 0.17 -4.64 120.51 123.23 2hg0 n ALA 265 Ca 0.33 -2.75 0.00 0.00 0.00 0.00 0.00 53.44 51.02 2hg0 n ALA 265 Cb 1.10 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2hg0 n ALA 265 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2hg0 n LEU 266 N -0.21 0.48 -0.33 0.00 7.94 0.20 -4.18 117.00 120.89 2hg0 n LEU 266 Ca 0.48 0.54 0.22 0.00 -1.11 0.00 0.00 56.01 56.13 2hg0 n LEU 266 Cb 0.58 -0.38 0.42 0.00 0.53 0.00 0.00 43.42 44.57 2hg0 n LEU 266 CO 0.56 -0.38 0.95 0.00 -1.11 0.00 0.00 177.39 177.41 2hg0 h ALA 267 N -2.00 1.62 -0.45 1.96 0.00 -1.82 -2.02 119.26 116.55 2hg0 h ALA 267 Ca 0.00 0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.24 2hg0 h ALA 267 Cb 0.00 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 2hg0 h ALA 267 CO 0.00 -0.70 -0.44 0.78 0.00 0.00 0.00 179.25 178.89 2hg0 h GLY 268 N 0.06 -1.24 -4.26 0.00 0.00 -1.91 -3.39 103.07 92.34 2hg0 h GLY 268 Ca 0.70 0.79 -0.53 0.00 0.00 0.00 0.00 47.33 48.29 2hg0 h GLY 268 CO -0.80 -0.24 0.27 0.00 0.00 0.00 0.00 176.54 175.78 2hg0 s ALA 269 N -5.20 3.31 0.29 3.60 0.00 -0.76 -5.03 121.76 117.97 2hg0 s ALA 269 Ca -0.11 0.45 -0.29 0.00 0.00 0.00 0.00 51.96 52.02 2hg0 s ALA 269 Cb 0.07 -3.15 -0.10 0.00 0.00 0.00 0.00 23.12 19.94 2hg0 s ALA 269 CO 0.48 0.04 1.17 0.42 0.00 0.00 0.00 175.76 177.86 2hg0 s ILE 270 N -0.14 3.24 0.35 0.00 -1.09 -0.99 -4.68 121.20 117.90 2hg0 s ILE 270 Ca 0.43 1.25 -0.20 0.00 -2.23 0.00 0.00 60.65 59.89 2hg0 s ILE 270 Cb -0.22 -3.79 -0.10 0.00 -1.58 0.00 0.00 42.46 36.77 2hg0 s ILE 270 CO 0.27 0.29 0.86 -2.16 -1.23 0.00 0.00 174.94 172.98 2hg0 s PRO 271 N -1.50 4.23 -0.16 2.79 0.04 -1.26 0.92 135.00 140.06 2hg0 s PRO 271 Ca 0.46 1.00 -0.14 0.00 0.04 0.00 0.00 61.00 62.36 2hg0 s PRO 271 Cb -0.34 -2.45 0.04 0.00 0.04 0.00 0.00 34.50 31.79 2hg0 s PRO 271 CO 0.45 0.13 0.42 0.08 0.04 0.00 0.00 177.00 178.11 2hg0 s VAL 272 N -1.94 -0.00 0.16 -0.36 1.01 -1.00 -4.85 120.40 113.41 2hg0 s VAL 272 Ca 0.55 0.01 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 2hg0 s VAL 272 Cb -0.12 -0.59 -0.08 0.00 0.00 0.00 0.00 36.38 35.59 2hg0 s VAL 272 CO 0.17 0.01 1.23 -0.70 0.00 0.00 0.00 175.10 175.81 2hg0 s GLU 273 N 0.39 4.45 -0.06 2.72 2.12 -1.26 -4.07 118.70 122.99 2hg0 s GLU 273 Ca -0.01 1.90 -0.03 0.00 0.36 0.00 0.00 54.97 57.19 2hg0 s GLU 273 Cb -0.04 -3.25 0.04 0.00 0.26 0.00 0.00 34.13 31.14 2hg0 s GLU 273 CO -0.01 -0.18 0.11 0.12 -0.54 0.00 0.00 175.26 174.77 2hg0 s PHE 274 N 0.28 -0.08 0.07 5.30 2.19 -1.26 -3.39 117.98 121.08 2hg0 s PHE 274 Ca 0.56 0.44 -0.02 0.00 0.33 0.00 0.00 56.93 58.24 2hg0 s PHE 274 Cb -0.33 -0.29 -0.04 0.00 -1.31 0.00 0.00 43.02 41.04 2hg0 s PHE 274 CO 0.35 -0.21 0.25 -1.54 1.83 0.00 0.00 175.22 175.90 2hg0 s SER 275 N 1.94 6.40 0.00 6.13 1.04 -0.39 -4.93 113.70 123.88 2hg0 s SER 275 Ca 0.00 0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.80 2hg0 s SER 275 Cb -0.12 -2.00 0.00 0.00 0.10 0.00 0.00 66.02 64.00 2hg0 s SER 275 CO -0.05 0.15 0.00 -0.24 0.98 0.00 0.00 173.24 174.09 2hg0 n SER 276 N 0.32 0.00 -0.05 7.02 2.88 -1.26 0.97 113.62 123.50 2hg0 n SER 276 Ca -0.05 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.49 2hg0 n SER 276 Cb 0.51 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.98 2hg0 n SER 276 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2hg0 n ASN 277 N -3.29 1.58 -4.17 -3.46 3.02 -1.26 -5.06 115.26 102.63 2hg0 n ASN 277 Ca 0.00 -1.52 -0.19 0.00 -0.03 0.00 0.00 54.58 52.84 2hg0 n ASN 277 Cb 0.00 -0.01 -0.12 0.00 -0.61 0.00 0.00 39.78 39.03 2hg0 n ASN 277 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2hg0 s THR 278 N -0.54 1.15 -0.33 3.41 2.01 0.27 -4.12 115.64 117.49 2hg0 s THR 278 Ca 0.02 -1.20 -0.00 0.00 0.31 0.00 0.00 61.69 60.81 2hg0 s THR 278 Cb 0.01 -1.07 0.10 0.00 0.01 0.00 0.00 72.50 71.55 2hg0 s THR 278 CO 0.01 -0.13 0.11 -0.69 -0.69 0.00 0.00 174.62 173.23 2hg0 s VAL 279 N -1.11 1.04 -0.25 3.82 1.01 -1.09 -1.27 120.40 122.55 2hg0 s VAL 279 Ca -0.00 -1.60 -0.29 0.00 0.00 0.00 0.00 61.98 60.09 2hg0 s VAL 279 Cb -0.09 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 2hg0 s VAL 279 CO 0.02 -0.70 1.44 -0.54 0.00 0.00 0.00 175.10 175.33 2hg0 s LYS 280 N 1.42 3.90 -0.04 2.72 1.02 -1.22 -0.12 119.74 127.42 2hg0 s LYS 280 Ca 0.11 1.48 -0.24 0.00 0.02 0.00 0.00 55.97 57.34 2hg0 s LYS 280 Cb -0.18 -3.94 -0.04 0.00 -0.52 0.00 0.00 37.83 33.15 2hg0 s LYS 280 CO -0.21 -1.15 0.72 -0.51 -0.92 0.00 0.00 175.35 173.28 2hg0 s LEU 281 N 4.65 4.35 -0.17 3.17 1.43 0.15 -4.65 118.68 127.61 2hg0 s LEU 281 Ca 0.63 1.26 -0.09 0.00 -1.03 0.00 0.00 54.13 54.90 2hg0 s LEU 281 Cb -0.21 -3.13 -0.22 0.00 0.03 0.00 0.00 46.19 42.66 2hg0 s LEU 281 CO 0.25 -0.09 0.18 1.07 0.23 0.00 0.00 176.35 177.99 2hg0 n THR 282 N 3.57 1.67 -3.14 5.49 5.66 -1.26 -4.35 114.28 121.91 2hg0 n THR 282 Ca -0.01 -0.49 -0.39 0.00 -3.05 0.00 0.00 64.05 60.10 2hg0 n THR 282 Cb 0.51 -1.75 -0.05 0.00 -1.55 0.00 0.00 70.33 67.49 2hg0 n THR 282 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2hg0 s SER 283 N -6.95 6.89 0.00 1.09 0.01 -1.26 -4.78 113.70 108.70 2hg0 s SER 283 Ca -0.27 1.07 0.00 0.00 1.31 0.00 0.00 55.95 58.06 2hg0 s SER 283 Cb 0.07 -2.37 0.00 0.00 0.21 0.00 0.00 66.02 63.94 2hg0 s SER 283 CO 0.68 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.88 2hg0 n GLY 284 N 3.11 2.78 3.30 3.44 0.00 -1.26 -4.85 105.19 111.70 2hg0 n GLY 284 Ca -0.03 -0.78 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 2hg0 n GLY 284 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2hg0 s HIS 285 N -2.00 1.40 -0.23 1.61 3.76 -1.26 -3.96 115.29 114.61 2hg0 s HIS 285 Ca 0.00 -1.47 -0.08 0.00 -0.15 0.00 0.00 55.06 53.36 2hg0 s HIS 285 Cb 0.00 -0.54 0.10 0.00 1.11 0.00 0.00 32.58 33.26 2hg0 s HIS 285 CO 0.00 -0.83 0.48 -1.17 -0.85 0.00 0.00 174.74 172.36 2hg0 s LEU 286 N -3.27 -0.78 -0.26 0.89 2.96 -0.38 -4.43 118.68 113.41 2hg0 s LEU 286 Ca 0.38 1.13 -0.23 0.00 -0.22 0.00 0.00 54.13 55.19 2hg0 s LEU 286 Cb 0.03 1.60 -0.01 0.00 0.50 0.00 0.00 46.19 48.31 2hg0 s LEU 286 CO 0.20 -0.23 0.76 -0.75 -1.32 0.00 0.00 176.35 175.01 2hg0 s LYS 287 N 2.69 4.11 0.33 1.98 2.36 -1.25 -1.71 119.74 128.25 2hg0 s LYS 287 Ca -0.02 0.74 0.07 0.00 -2.55 0.00 0.00 55.97 54.21 2hg0 s LYS 287 Cb -0.12 -3.67 -0.06 0.00 -1.05 0.00 0.00 37.83 32.93 2hg0 s LYS 287 CO -0.14 -0.52 -0.05 0.00 1.55 0.00 0.00 175.35 176.19 2hg0 s ARG 289 N -3.70 0.88 -1.40 0.00 3.52 -1.26 0.63 118.95 117.62 2hg0 s ARG 289 Ca 0.32 -1.12 -0.15 0.00 -0.13 0.00 0.00 55.73 54.65 2hg0 s ARG 289 Cb 0.05 -2.21 0.05 0.00 -1.56 0.00 0.00 34.95 31.28 2hg0 s ARG 289 CO 0.15 -0.92 2.07 0.28 -0.81 0.00 0.00 175.30 176.07 2hg0 n VAL 290 N 4.77 3.59 -1.89 7.11 0.31 0.16 -3.13 118.33 129.25 2hg0 n VAL 290 Ca -0.03 -3.34 -0.42 0.00 -0.01 0.00 0.00 64.34 60.54 2hg0 n VAL 290 Cb 0.43 -2.52 -0.03 0.00 -0.91 0.00 0.00 33.84 30.81 2hg0 n VAL 290 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2hg0 s LYS 291 N 3.56 4.19 -0.35 5.55 1.02 -1.11 -3.26 119.74 129.34 2hg0 s LYS 291 Ca 0.49 2.43 0.14 0.00 0.02 0.00 0.00 55.97 59.05 2hg0 s LYS 291 Cb 0.11 -3.11 0.43 0.00 -0.52 0.00 0.00 37.83 34.73 2hg0 s LYS 291 CO -0.03 -0.60 1.19 0.00 -0.92 0.00 0.00 175.35 174.98 2hg0 n MET 292 N 3.40 1.22 0.00 1.68 0.00 0.23 -2.24 117.12 121.41 2hg0 n MET 292 Ca 0.12 -2.48 0.15 0.00 0.00 0.00 0.00 57.70 55.49 2hg0 n MET 292 Cb 0.38 -0.60 0.71 0.00 0.00 0.00 0.00 33.22 33.70 2hg0 n MET 292 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2hg0 n GLU 293 N -0.44 0.31 -0.12 3.17 2.13 -1.06 -2.30 120.64 122.32 2hg0 n GLU 293 Ca 0.02 -0.01 0.11 0.00 0.66 0.00 0.00 57.16 57.94 2hg0 n GLU 293 Cb 0.84 -1.50 0.17 0.00 0.27 0.00 0.00 31.44 31.21 2hg0 n GLU 293 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2hg0 n LYS 294 N -1.34 2.29 -3.08 5.31 4.76 -1.26 -4.89 118.16 119.96 2hg0 n LYS 294 Ca 0.12 -2.08 -0.40 0.00 -2.87 0.00 0.00 58.31 53.08 2hg0 n LYS 294 Cb 0.27 -1.46 -0.05 0.00 -1.84 0.00 0.00 35.03 31.96 2hg0 n LYS 294 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2hg0 s LEU 295 N -1.53 4.29 0.03 -0.35 2.96 -0.88 0.20 118.68 123.40 2hg0 s LEU 295 Ca 0.33 1.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.35 2hg0 s LEU 295 Cb 0.20 -3.02 -0.02 0.00 0.50 0.00 0.00 46.19 43.85 2hg0 s LEU 295 CO 0.29 -0.12 -0.04 0.00 -1.32 0.00 0.00 176.35 175.15 2hg0 s GLN 296 N 0.92 0.36 1.17 1.98 -2.07 0.62 -4.86 119.66 117.79 2hg0 s GLN 296 Ca 0.35 -0.66 -0.16 0.00 -1.82 0.00 0.00 55.36 53.08 2hg0 s GLN 296 Cb -0.17 0.03 0.27 0.00 -1.09 0.00 0.00 33.01 32.05 2hg0 s GLN 296 CO 0.16 -0.03 1.05 -0.51 -1.32 0.00 0.00 175.29 174.64 2hg0 s LEU 297 N -1.53 0.67 0.20 2.60 1.43 -1.26 -4.30 118.68 116.49 2hg0 s LEU 297 Ca -0.14 1.06 -0.08 0.00 -1.03 0.00 0.00 54.13 53.94 2hg0 s LEU 297 Cb -0.09 -2.92 -0.02 0.00 0.03 0.00 0.00 46.19 43.19 2hg0 s LEU 297 CO -0.01 -4.07 0.29 -0.75 0.23 0.00 0.00 176.35 172.04 2hg0 s LYS 298 N -4.96 1.28 -1.60 1.70 2.20 -1.26 -4.73 119.74 112.36 2hg0 s LYS 298 Ca 0.68 -1.34 -0.10 0.00 -0.36 0.00 0.00 55.97 54.86 2hg0 s LYS 298 Cb -0.17 0.37 0.09 0.00 -1.51 0.00 0.00 37.83 36.61 2hg0 s LYS 298 CO 0.59 -0.47 0.51 0.41 -0.36 0.00 0.00 175.35 176.02 2hg0 n GLY 299 N -0.28 -0.31 0.00 5.54 0.00 -1.26 -4.83 105.19 104.05 2hg0 n GLY 299 Ca -0.03 0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2hg0 n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hg0 n THR 300 N -4.39 0.00 -0.46 2.61 -2.24 -1.26 -4.09 114.28 104.45 2hg0 n THR 300 Ca -0.12 -0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.77 2hg0 n THR 300 Cb 0.59 0.81 0.34 0.00 -2.10 0.00 0.00 70.33 69.97 2hg0 n THR 300 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2hg0 n THR 301 N -1.50 1.37 -3.01 4.28 5.66 -1.26 -4.95 114.28 114.86 2hg0 n THR 301 Ca 0.04 -1.07 -0.24 0.00 -3.05 0.00 0.00 64.05 59.74 2hg0 n THR 301 Cb 0.33 0.32 0.01 0.00 -1.55 0.00 0.00 70.33 69.44 2hg0 n THR 301 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 2hg0 s TYR 302 N -1.39 3.30 0.58 1.09 4.12 -1.26 -5.10 117.35 118.68 2hg0 s TYR 302 Ca 0.50 0.31 -0.02 0.00 0.02 0.00 0.00 57.07 57.89 2hg0 s TYR 302 Cb 0.29 -2.25 0.03 0.00 -1.52 0.00 0.00 41.96 38.52 2hg0 s TYR 302 CO 0.30 -0.28 0.83 0.20 0.02 0.00 0.00 175.55 176.62 2hg0 s GLY 303 N -4.18 1.73 0.31 0.71 0.00 -1.26 -4.79 107.32 99.85 2hg0 s GLY 303 Ca 0.47 -1.12 -0.28 0.00 0.00 0.00 0.00 44.72 43.78 2hg0 s GLY 303 CO 0.38 -0.83 1.09 0.14 0.00 0.00 0.00 173.10 173.88 2hg0 s VAL 304 N -2.87 3.53 0.16 1.40 1.01 -1.26 -1.34 120.40 121.04 2hg0 s VAL 304 Ca 0.56 1.45 -0.32 0.00 0.00 0.00 0.00 61.98 63.68 2hg0 s VAL 304 Cb -0.10 -3.89 -0.11 0.00 0.00 0.00 0.00 36.38 32.28 2hg0 s VAL 304 CO 0.41 0.28 1.66 0.00 0.00 0.00 0.00 175.10 177.44 2hg0 s SER 306 N 1.47 3.02 -0.10 0.00 0.01 -1.26 -4.73 113.70 112.11 2hg0 s SER 306 Ca 0.73 -3.15 -0.33 0.00 1.31 0.00 0.00 55.95 54.51 2hg0 s SER 306 Cb -0.46 -0.92 0.13 0.00 0.21 0.00 0.00 66.02 64.98 2hg0 s SER 306 CO 0.32 -0.17 1.18 -0.75 0.41 0.00 0.00 173.24 174.23 2hg0 s LYS 307 N -0.27 0.43 0.66 12.44 2.47 -1.26 -4.99 119.74 129.22 2hg0 s LYS 307 Ca 0.26 -0.19 -0.18 0.00 -1.56 0.00 0.00 55.97 54.30 2hg0 s LYS 307 Cb -0.06 0.18 -0.01 0.00 -1.46 0.00 0.00 37.83 36.48 2hg0 s LYS 307 CO -0.13 -0.19 1.27 0.00 0.16 0.00 0.00 175.35 176.46 2hg0 n ALA 308 N -0.24 1.04 -3.69 3.13 0.00 -1.26 -4.75 120.51 114.73 2hg0 n ALA 308 Ca -0.03 -0.02 -0.24 0.00 0.00 0.00 0.00 53.44 53.15 2hg0 n ALA 308 Cb 0.60 -2.31 -0.17 0.00 0.00 0.00 0.00 19.45 17.57 2hg0 n ALA 308 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2hg0 s PHE 309 N -1.43 1.22 -0.02 0.00 0.08 -1.26 -1.92 117.98 114.64 2hg0 s PHE 309 Ca 0.82 -0.49 0.05 0.00 0.12 0.00 0.00 56.93 57.43 2hg0 s PHE 309 Cb -0.38 -1.01 -0.03 0.00 -0.57 0.00 0.00 43.02 41.04 2hg0 s PHE 309 CO 0.41 -0.35 -0.15 0.21 -0.10 0.00 0.00 175.22 175.24 2hg0 s LYS 310 N 1.24 2.38 0.51 0.44 2.47 -0.92 -4.69 119.74 121.18 2hg0 s LYS 310 Ca -0.05 -0.79 -0.19 0.00 -1.56 0.00 0.00 55.97 53.39 2hg0 s LYS 310 Cb -0.14 -2.33 -0.07 0.00 -1.46 0.00 0.00 37.83 33.83 2hg0 s LYS 310 CO -0.02 0.60 1.05 -0.06 0.16 0.00 0.00 175.35 177.07 2hg0 s PHE 311 N -0.81 2.98 -0.19 4.03 0.08 -1.26 -1.99 117.98 120.82 2hg0 s PHE 311 Ca 0.13 1.56 0.16 0.00 0.12 0.00 0.00 56.93 58.90 2hg0 s PHE 311 Cb -0.11 -3.06 0.51 0.00 -0.57 0.00 0.00 43.02 39.79 2hg0 s PHE 311 CO 0.03 -0.92 1.41 1.28 -0.10 0.00 0.00 175.22 176.91 2hg0 n LEU 312 N -1.21 3.80 0.00 -0.37 4.77 -0.72 -4.88 117.00 118.39 2hg0 n LEU 312 Ca 0.09 -3.12 0.00 0.00 -0.03 0.00 0.00 56.01 52.95 2hg0 n LEU 312 Cb 0.52 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2hg0 n LEU 312 CO 0.41 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 2hg0 n GLY 313 N -0.68 4.38 3.65 -0.72 0.00 -1.26 -4.94 105.19 105.63 2hg0 n GLY 313 Ca 0.23 -1.22 -0.52 0.00 0.00 0.00 0.00 46.02 44.50 2hg0 n GLY 313 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hg0 n THR 314 N -1.83 0.16 -1.18 2.61 -1.04 -1.26 -4.75 114.28 106.98 2hg0 n THR 314 Ca 0.00 -0.03 -0.35 0.00 -2.04 0.00 0.00 64.05 61.63 2hg0 n THR 314 Cb 0.00 -1.21 0.09 0.00 -1.82 0.00 0.00 70.33 67.39 2hg0 n THR 314 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2hg0 n PRO 315 N 4.00 0.24 -4.31 -2.82 -0.02 -1.26 -4.96 135.00 125.88 2hg0 n PRO 315 Ca 0.21 0.14 -0.28 0.00 -2.02 0.00 0.00 63.50 61.55 2hg0 n PRO 315 Cb 0.21 -2.07 -0.10 0.00 -0.02 0.00 0.00 33.50 31.51 2hg0 n PRO 315 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hg0 s ALA 316 N -2.00 2.81 -0.25 3.55 0.00 0.46 -4.90 121.76 121.43 2hg0 s ALA 316 Ca 0.68 -1.45 -0.20 0.00 0.00 0.00 0.00 51.96 50.99 2hg0 s ALA 316 Cb -0.31 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.13 2hg0 s ALA 316 CO 0.56 0.51 0.63 0.34 0.00 0.00 0.00 175.76 177.80 2hg0 s ASP 317 N -2.57 6.60 0.14 0.00 2.15 -1.26 -0.75 116.67 120.99 2hg0 s ASP 317 Ca 0.22 0.74 0.24 0.00 0.43 0.00 0.00 52.55 54.17 2hg0 s ASP 317 Cb -0.09 -2.34 0.91 0.00 -0.30 0.00 0.00 42.92 41.10 2hg0 s ASP 317 CO 0.13 -0.36 1.73 0.35 -0.17 0.00 0.00 175.17 176.85 2hg0 n THR 318 N 5.12 0.62 -0.86 1.71 -2.24 -0.68 -4.85 114.28 113.10 2hg0 n THR 318 Ca -0.01 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2hg0 n THR 318 Cb 0.49 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 2hg0 n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hg0 n GLY 319 N 0.70 0.57 0.02 3.38 0.00 -1.26 -4.88 105.19 103.71 2hg0 n GLY 319 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2hg0 n GLY 319 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2hg0 n HIS 320 N -2.86 0.00 -0.66 1.61 8.25 -1.26 -4.96 115.22 115.35 2hg0 n HIS 320 Ca 0.00 -0.55 0.00 0.00 -0.26 0.00 0.00 57.72 56.91 2hg0 n HIS 320 Cb 0.00 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.04 2hg0 n HIS 320 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hg0 n GLY 321 N -0.63 0.66 3.30 -1.41 0.00 -1.26 -5.03 105.19 100.81 2hg0 n GLY 321 Ca 0.03 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 2hg0 n GLY 321 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hg0 s THR 322 N -2.00 1.18 0.19 2.61 -4.23 -1.26 -4.01 115.64 108.12 2hg0 s THR 322 Ca 0.00 -2.07 0.06 0.00 -1.18 0.00 0.00 61.69 58.51 2hg0 s THR 322 Cb 0.00 -2.08 -0.05 0.00 1.34 0.00 0.00 72.50 71.71 2hg0 s THR 322 CO 0.00 -0.55 -0.12 0.68 -0.54 0.00 0.00 174.62 174.08 2hg0 s VAL 323 N -3.32 1.52 0.23 2.29 -7.23 0.60 -1.69 120.40 112.80 2hg0 s VAL 323 Ca 0.22 -2.15 0.11 0.00 -1.81 0.00 0.00 61.98 58.34 2hg0 s VAL 323 Cb 0.04 -2.00 -0.05 0.00 0.56 0.00 0.00 36.38 34.93 2hg0 s VAL 323 CO 0.05 -0.63 -0.20 -0.69 -0.31 0.00 0.00 175.10 173.32 2hg0 s VAL 324 N -3.11 2.23 -0.05 1.32 1.01 0.07 -1.40 120.40 120.48 2hg0 s VAL 324 Ca 0.21 -2.23 -0.30 0.00 0.00 0.00 0.00 61.98 59.66 2hg0 s VAL 324 Cb 0.01 -2.15 0.11 0.00 0.00 0.00 0.00 36.38 34.35 2hg0 s VAL 324 CO 0.05 -0.36 1.01 -1.48 0.00 0.00 0.00 175.10 174.31 2hg0 s LEU 325 N -3.18 -0.27 -0.08 3.92 0.05 -0.25 -0.40 118.68 118.47 2hg0 s LEU 325 Ca 0.25 -0.04 0.02 0.00 0.05 0.00 0.00 54.13 54.41 2hg0 s LEU 325 Cb -0.05 1.82 0.01 0.00 -2.05 0.00 0.00 46.19 45.92 2hg0 s LEU 325 CO 0.11 -0.52 -0.14 -0.70 -0.55 0.00 0.00 176.35 174.56 2hg0 s GLU 326 N -2.90 1.93 0.49 1.48 2.12 -1.26 -0.38 118.70 120.18 2hg0 s GLU 326 Ca 0.07 -0.48 0.05 0.00 0.36 0.00 0.00 54.97 54.97 2hg0 s GLU 326 Cb -0.01 -1.59 0.03 0.00 0.26 0.00 0.00 34.13 32.82 2hg0 s GLU 326 CO -0.07 0.02 0.68 -0.51 -0.54 0.00 0.00 175.26 174.84 2hg0 s LEU 327 N 0.73 3.45 -0.01 2.70 1.02 0.78 -1.76 118.68 125.58 2hg0 s LEU 327 Ca -0.13 -0.27 0.00 0.00 0.02 0.00 0.00 54.13 53.75 2hg0 s LEU 327 Cb -0.16 -2.67 0.01 0.00 0.02 0.00 0.00 46.19 43.39 2hg0 s LEU 327 CO 0.03 -0.99 0.00 -1.58 0.02 0.00 0.00 176.35 173.83 2hg0 s GLN 328 N -4.57 0.08 -0.29 1.70 2.00 -0.84 -1.56 119.66 116.19 2hg0 s GLN 328 Ca 0.57 0.03 -0.07 0.00 -2.00 0.00 0.00 55.36 53.89 2hg0 s GLN 328 Cb -0.10 -0.18 -0.00 0.00 0.80 0.00 0.00 33.01 33.54 2hg0 s GLN 328 CO 0.36 -0.05 0.09 -0.47 -0.50 0.00 0.00 175.29 174.73 2hg0 s TYR 329 N 0.38 3.14 0.40 1.67 5.04 -0.52 -2.16 117.35 125.30 2hg0 s TYR 329 Ca -0.03 -0.81 0.11 0.00 -2.44 0.00 0.00 57.07 53.90 2hg0 s TYR 329 Cb -0.05 -2.27 0.82 0.00 0.35 0.00 0.00 41.96 40.80 2hg0 s TYR 329 CO -0.01 -0.52 1.92 1.79 -1.34 0.00 0.00 175.55 177.39 2hg0 h THR 330 N 5.77 1.18 -0.88 4.34 1.35 -1.72 0.72 112.91 123.66 2hg0 h THR 330 Ca -0.33 -0.82 -0.62 0.00 -0.55 0.00 0.00 66.41 64.09 2hg0 h THR 330 Cb 1.14 1.31 0.09 0.00 -1.73 0.00 0.00 68.15 68.95 2hg0 h THR 330 CO 0.60 0.25 -0.35 0.61 -0.25 0.00 0.00 175.52 176.38 2hg0 n GLY 331 N -0.84 -1.25 0.08 5.82 0.00 -1.25 -4.28 105.19 103.47 2hg0 n GLY 331 Ca -0.01 0.39 -0.04 0.00 0.00 0.00 0.00 46.02 46.36 2hg0 n GLY 331 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hg0 n THR 332 N 0.30 1.05 -0.64 2.61 -2.24 -1.26 -3.52 114.28 110.59 2hg0 n THR 332 Ca 0.16 -0.75 -0.30 0.00 -2.27 0.00 0.00 64.05 60.89 2hg0 n THR 332 Cb 0.19 -0.43 0.20 0.00 -2.10 0.00 0.00 70.33 68.18 2hg0 n THR 332 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2hg0 s ASP 333 N -5.34 2.21 0.00 3.42 1.47 -1.26 -4.29 116.67 112.88 2hg0 s ASP 333 Ca -0.08 1.96 0.00 0.00 1.18 0.00 0.00 52.55 55.61 2hg0 s ASP 333 Cb 0.08 -2.48 0.00 0.00 -0.34 0.00 0.00 42.92 40.18 2hg0 s ASP 333 CO 0.85 -3.51 0.00 0.61 0.68 0.00 0.00 175.17 173.79 2hg0 n GLY 334 N 0.43 0.08 3.52 2.12 0.00 -1.26 -4.59 105.19 105.50 2hg0 n GLY 334 Ca 0.09 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 2hg0 n GLY 334 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2hg0 n PRO 335 N 0.00 1.06 -4.29 1.61 -0.04 -1.23 -4.72 135.00 127.38 2hg0 n PRO 335 Ca 0.00 0.17 -0.16 0.00 -0.04 0.00 0.00 63.50 63.47 2hg0 n PRO 335 Cb 0.00 -2.85 -0.10 0.00 -0.04 0.00 0.00 33.50 30.51 2hg0 n PRO 335 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hg0 s LYS 337 N -3.72 4.63 -0.25 0.00 1.02 -0.45 -1.65 119.74 119.32 2hg0 s LYS 337 Ca 0.20 1.64 -0.23 0.00 0.02 0.00 0.00 55.97 57.60 2hg0 s LYS 337 Cb 0.02 -3.09 -0.01 0.00 -0.52 0.00 0.00 37.83 34.22 2hg0 s LYS 337 CO 0.04 0.25 0.76 0.08 -0.92 0.00 0.00 175.35 175.56 2hg0 s VAL 338 N -1.27 4.88 -1.41 3.17 1.01 -0.99 0.17 120.40 125.96 2hg0 s VAL 338 Ca 0.46 1.42 -0.14 0.00 0.00 0.00 0.00 61.98 63.72 2hg0 s VAL 338 Cb -0.28 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2hg0 s VAL 338 CO 0.35 -0.05 2.30 -0.81 0.00 0.00 0.00 175.10 176.90 2hg0 n PRO 339 N 5.92 2.84 -5.05 2.72 -0.04 -1.26 -4.74 135.00 135.38 2hg0 n PRO 339 Ca 0.04 -2.46 -0.32 0.00 -0.04 0.00 0.00 63.50 60.71 2hg0 n PRO 339 Cb 0.48 -3.18 -0.15 0.00 -0.04 0.00 0.00 33.50 30.61 2hg0 n PRO 339 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2hg0 s ILE 340 N 3.22 2.56 0.32 0.52 2.07 -1.26 -0.72 121.20 127.91 2hg0 s ILE 340 Ca 0.51 -0.88 -0.06 0.00 -1.41 0.00 0.00 60.65 58.81 2hg0 s ILE 340 Cb 0.15 -1.99 0.00 0.00 0.13 0.00 0.00 42.46 40.75 2hg0 s ILE 340 CO -0.07 0.57 0.48 -0.94 -1.91 0.00 0.00 174.94 173.08 2hg0 s SER 341 N -0.24 0.57 -0.21 4.50 1.04 -0.67 -5.00 113.70 113.69 2hg0 s SER 341 Ca -0.00 -1.32 -0.00 0.00 0.48 0.00 0.00 55.95 55.10 2hg0 s SER 341 Cb -0.13 0.65 0.02 0.00 0.10 0.00 0.00 66.02 66.66 2hg0 s SER 341 CO 0.03 -1.27 -0.14 -0.55 0.98 0.00 0.00 173.24 172.29 2hg0 s SER 342 N -3.17 3.71 -0.08 7.02 0.15 -1.26 -1.10 113.70 118.97 2hg0 s SER 342 Ca 0.28 -0.74 -0.00 0.00 0.70 0.00 0.00 55.95 56.19 2hg0 s SER 342 Cb -0.00 -1.57 -0.03 0.00 -1.71 0.00 0.00 66.02 62.71 2hg0 s SER 342 CO 0.17 -0.05 -0.04 -0.69 1.20 0.00 0.00 173.24 173.82 2hg0 s VAL 343 N 1.31 3.90 0.35 4.45 1.01 0.16 -0.68 120.40 130.90 2hg0 s VAL 343 Ca 0.03 -0.40 0.14 0.00 0.00 0.00 0.00 61.98 61.75 2hg0 s VAL 343 Cb -0.15 -2.62 0.09 0.00 0.00 0.00 0.00 36.38 33.71 2hg0 s VAL 343 CO -0.09 0.59 1.81 0.00 0.00 0.00 0.00 175.10 177.42 2hg0 h ALA 344 N 5.37 1.31 -2.27 5.51 0.00 -1.85 0.62 119.26 127.96 2hg0 h ALA 344 Ca -0.47 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.01 2hg0 h ALA 344 Cb 1.18 -0.06 -0.21 0.00 0.00 0.00 0.00 17.79 18.70 2hg0 h ALA 344 CO 0.54 0.48 -0.01 -1.12 0.00 0.00 0.00 179.25 179.14 2hg0 s SER 345 N -6.84 -0.57 0.37 0.00 0.01 -1.26 -4.57 113.70 100.84 2hg0 s SER 345 Ca -0.02 0.92 -0.23 0.00 1.31 0.00 0.00 55.95 57.92 2hg0 s SER 345 Cb 0.14 0.91 -0.15 0.00 0.21 0.00 0.00 66.02 67.13 2hg0 s SER 345 CO 0.72 -0.34 0.36 0.18 0.41 0.00 0.00 173.24 174.57 2hg0 n LEU 346 N 2.10 -1.39 -4.19 2.44 4.32 -1.26 -2.44 117.00 116.57 2hg0 n LEU 346 Ca -0.16 0.92 -0.31 0.00 -0.02 0.00 0.00 56.01 56.44 2hg0 n LEU 346 Cb 0.56 -0.99 -0.06 0.00 -1.62 0.00 0.00 43.42 41.31 2hg0 n LEU 346 CO 0.13 -3.41 -0.29 -0.46 -1.22 0.00 0.00 177.39 172.15 2hg0 n ASN 347 N 1.86 -0.40 -4.93 -1.43 6.94 -1.26 -4.99 115.26 111.06 2hg0 n ASN 347 Ca 0.13 -1.14 -0.26 0.00 -0.02 0.00 0.00 54.58 53.29 2hg0 n ASN 347 Cb 0.37 -2.31 0.01 0.00 -2.36 0.00 0.00 39.78 35.49 2hg0 n ASN 347 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2hg0 s ASP 348 N -4.12 5.91 -0.18 0.53 1.11 -1.02 -5.03 116.67 113.86 2hg0 s ASP 348 Ca 0.19 0.64 -0.10 0.00 0.18 0.00 0.00 52.55 53.45 2hg0 s ASP 348 Cb -0.11 -1.84 -0.22 0.00 1.07 0.00 0.00 42.92 41.83 2hg0 s ASP 348 CO 0.95 -0.76 0.17 0.18 1.18 0.00 0.00 175.17 176.88 2hg0 n LEU 349 N -2.29 2.41 -4.74 1.23 4.77 -1.26 -4.92 117.00 112.21 2hg0 n LEU 349 Ca 0.02 0.23 -0.37 0.00 -0.03 0.00 0.00 56.01 55.86 2hg0 n LEU 349 Cb 0.57 -1.02 -0.07 0.00 -2.33 0.00 0.00 43.42 40.57 2hg0 n LEU 349 CO 0.51 0.68 -0.01 0.42 -1.33 0.00 0.00 177.39 177.67 2hg0 s THR 350 N -2.50 5.30 1.39 -5.08 -4.23 -1.26 -5.09 115.64 104.17 2hg0 s THR 350 Ca -0.28 0.56 -0.20 0.00 -1.18 0.00 0.00 61.69 60.59 2hg0 s THR 350 Cb 0.08 -3.63 0.36 0.00 1.34 0.00 0.00 72.50 70.64 2hg0 s THR 350 CO 0.67 0.40 0.92 -2.65 -0.54 0.00 0.00 174.62 173.42 2hg0 n PRO 351 N 3.44 -4.10 0.00 3.99 -0.02 -1.26 -4.73 135.00 132.32 2hg0 n PRO 351 Ca -0.12 -1.20 0.00 0.00 -2.02 0.00 0.00 63.50 60.16 2hg0 n PRO 351 Cb 0.52 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 2hg0 n PRO 351 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2hg0 n VAL 352 N -5.58 0.00 -3.78 -1.45 0.31 0.14 -4.93 118.33 103.04 2hg0 n VAL 352 Ca 0.09 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.06 2hg0 n VAL 352 Cb 0.58 0.03 -0.11 0.00 -0.91 0.00 0.00 33.84 33.44 2hg0 n VAL 352 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2hg0 s GLY 353 N 0.00 1.88 0.15 2.92 0.00 -1.04 -4.57 107.32 106.66 2hg0 s GLY 353 Ca 0.00 -0.97 -0.29 0.00 0.00 0.00 0.00 44.72 43.46 2hg0 s GLY 353 CO 0.00 0.40 0.91 -1.60 0.00 0.00 0.00 173.10 172.81 2hg0 s ARG 354 N 1.19 4.71 -0.05 2.90 3.52 -1.18 -4.17 118.95 125.87 2hg0 s ARG 354 Ca 0.06 1.38 -0.22 0.00 -0.13 0.00 0.00 55.73 56.82 2hg0 s ARG 354 Cb -0.14 -3.33 -0.04 0.00 -1.56 0.00 0.00 34.95 29.87 2hg0 s ARG 354 CO 0.04 0.37 0.63 -0.51 -0.81 0.00 0.00 175.30 175.02 2hg0 s LEU 355 N -0.53 4.34 -0.05 -0.88 1.43 -1.26 -1.74 118.68 119.99 2hg0 s LEU 355 Ca 0.43 1.12 -0.23 0.00 -1.03 0.00 0.00 54.13 54.42 2hg0 s LEU 355 Cb -0.24 -2.97 -0.17 0.00 0.03 0.00 0.00 46.19 42.84 2hg0 s LEU 355 CO 0.29 -0.03 0.95 0.58 0.23 0.00 0.00 176.35 178.37 2hg0 h VAL 356 N 4.55 1.01 0.00 -1.59 2.07 -1.37 -3.32 116.25 117.60 2hg0 h VAL 356 Ca -0.42 -1.20 -0.64 0.00 0.82 0.00 0.00 66.70 65.25 2hg0 h VAL 356 Cb 1.19 1.69 0.03 0.00 -1.52 0.00 0.00 31.29 32.69 2hg0 h VAL 356 CO 0.74 0.26 2.46 0.41 0.02 0.00 0.00 177.57 181.45 2hg0 n THR 357 N -4.89 2.11 -1.57 2.57 -1.04 -0.71 -4.71 114.28 106.04 2hg0 n THR 357 Ca -0.08 -1.78 -0.36 0.00 -2.04 0.00 0.00 64.05 59.78 2hg0 n THR 357 Cb 0.28 -2.35 0.08 0.00 -1.82 0.00 0.00 70.33 66.52 2hg0 n THR 357 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2hg0 n VAL 358 N 5.72 4.16 -3.90 12.58 0.31 -1.25 -3.58 118.33 132.37 2hg0 n VAL 358 Ca 0.50 -0.43 -0.37 0.00 -0.01 0.00 0.00 64.34 64.03 2hg0 n VAL 358 Cb 0.38 -1.39 0.02 0.00 -0.91 0.00 0.00 33.84 31.94 2hg0 n VAL 358 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2hg0 n ASN 359 N -2.11 -4.68 -4.79 4.52 5.03 -1.26 -4.88 115.26 107.09 2hg0 n ASN 359 Ca 0.15 -1.12 -0.31 0.00 0.87 0.00 0.00 54.58 54.18 2hg0 n ASN 359 Cb 0.49 -2.10 0.08 0.00 -1.02 0.00 0.00 39.78 37.23 2hg0 n ASN 359 CO 0.00 0.00 0.00 -2.84 -1.83 0.00 0.00 177.26 172.59 2hg0 s PRO 360 N -6.35 2.40 -0.29 3.52 0.02 -1.24 -4.96 135.00 128.11 2hg0 s PRO 360 Ca 0.34 0.97 -0.27 0.00 0.02 0.00 0.00 61.00 62.07 2hg0 s PRO 360 Cb -0.17 -1.93 0.18 0.00 0.02 0.00 0.00 34.50 32.60 2hg0 s PRO 360 CO 0.93 -1.48 1.37 -0.59 -0.33 0.00 0.00 177.00 176.89 2hg0 s PHE 361 N -3.00 -0.09 -0.25 6.54 -0.12 -1.26 -2.35 117.98 117.45 2hg0 s PHE 361 Ca 0.60 0.21 -0.28 0.00 -0.05 0.00 0.00 56.93 57.40 2hg0 s PHE 361 Cb -0.16 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.68 2hg0 s PHE 361 CO 0.55 -0.06 1.96 0.08 -0.05 0.00 0.00 175.22 177.71 2hg0 s VAL 362 N -0.35 3.28 0.18 -2.49 1.01 -0.66 -4.77 120.40 116.59 2hg0 s VAL 362 Ca 0.07 0.29 -0.13 0.00 0.00 0.00 0.00 61.98 62.21 2hg0 s VAL 362 Cb -0.03 -3.35 0.07 0.00 0.00 0.00 0.00 36.38 33.06 2hg0 s VAL 362 CO -0.12 -0.21 1.78 -1.28 0.00 0.00 0.00 175.10 175.27 2hg0 h SER 363 N 13.43 0.31 -1.50 3.32 0.87 -1.90 -3.28 113.55 124.80 2hg0 h SER 363 Ca -0.38 0.03 -0.46 0.00 -1.23 0.00 0.00 61.79 59.75 2hg0 h SER 363 Cb 1.20 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 2hg0 h SER 363 CO 0.99 0.22 -0.33 -0.69 -0.53 0.00 0.00 176.83 176.48 2hg0 s VAL 364 N -6.13 2.82 -2.34 2.23 1.01 -1.26 -4.52 120.40 112.20 2hg0 s VAL 364 Ca -0.13 -1.21 0.23 0.00 0.00 0.00 0.00 61.98 60.87 2hg0 s VAL 364 Cb 0.14 -3.01 0.07 0.00 0.00 0.00 0.00 36.38 33.57 2hg0 s VAL 364 CO 0.73 -0.01 1.16 0.00 0.00 0.00 0.00 175.10 176.99 2hg0 n ALA 365 N -1.66 3.20 -2.38 5.51 0.00 -1.26 -3.51 120.51 120.40 2hg0 n ALA 365 Ca 0.05 -0.65 -0.41 0.00 0.00 0.00 0.00 53.44 52.43 2hg0 n ALA 365 Cb 0.61 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 19.22 2hg0 n ALA 365 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2hg0 s THR 366 N -2.32 3.65 0.85 0.00 2.01 -1.26 -4.34 115.64 114.22 2hg0 s THR 366 Ca 0.22 0.44 -0.17 0.00 0.31 0.00 0.00 61.69 62.48 2hg0 s THR 366 Cb 0.19 -4.53 -0.14 0.00 0.01 0.00 0.00 72.50 68.03 2hg0 s THR 366 CO 0.48 -1.41 -0.88 0.00 -0.69 0.00 0.00 174.62 172.11 2hg0 n ALA 367 N 10.27 -5.03 -3.84 7.40 0.00 -1.25 -3.68 120.51 124.37 2hg0 n ALA 367 Ca 0.10 -0.77 -0.24 0.00 0.00 0.00 0.00 53.44 52.53 2hg0 n ALA 367 Cb 0.50 -0.88 0.01 0.00 0.00 0.00 0.00 19.45 19.08 2hg0 n ALA 367 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2hg0 n ASN 368 N 2.97 -1.22 -4.88 0.00 0.23 0.25 -5.00 115.26 107.61 2hg0 n ASN 368 Ca -0.02 -0.90 -0.30 0.00 -0.53 0.00 0.00 54.58 52.83 2hg0 n ASN 368 Cb 0.53 -3.59 -0.04 0.00 -2.08 0.00 0.00 39.78 34.60 2hg0 n ASN 368 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2hg0 s ALA 369 N -3.74 3.48 0.08 -2.53 0.00 -1.24 -4.67 121.76 113.14 2hg0 s ALA 369 Ca 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 2hg0 s ALA 369 Cb -0.05 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.51 2hg0 s ALA 369 CO 0.85 0.18 0.25 0.15 0.00 0.00 0.00 175.76 177.20 2hg0 s LYS 370 N -3.53 3.48 -0.06 0.00 1.02 -1.26 -1.44 119.74 117.95 2hg0 s LYS 370 Ca 0.48 -0.36 -0.00 0.00 0.02 0.00 0.00 55.97 56.11 2hg0 s LYS 370 Cb -0.11 -2.99 0.03 0.00 -0.52 0.00 0.00 37.83 34.24 2hg0 s LYS 370 CO 0.28 0.57 -0.02 0.08 -0.92 0.00 0.00 175.35 175.35 2hg0 s VAL 371 N -1.56 0.44 0.14 3.17 1.01 -0.60 -4.67 120.40 118.33 2hg0 s VAL 371 Ca 0.36 0.03 -0.16 0.00 0.00 0.00 0.00 61.98 62.22 2hg0 s VAL 371 Cb -0.13 -0.55 -0.07 0.00 0.00 0.00 0.00 36.38 35.64 2hg0 s VAL 371 CO 0.27 0.25 0.57 -0.22 0.00 0.00 0.00 175.10 175.97 2hg0 s LEU 372 N 1.59 4.37 -0.10 3.92 0.20 0.75 -0.16 118.68 129.26 2hg0 s LEU 372 Ca -0.01 1.14 -0.05 0.00 0.69 0.00 0.00 54.13 55.90 2hg0 s LEU 372 Cb -0.13 -3.23 0.04 0.00 -0.43 0.00 0.00 46.19 42.44 2hg0 s LEU 372 CO -0.04 0.13 0.24 -0.63 -0.29 0.00 0.00 176.35 175.76 2hg0 s ILE 373 N -1.41 -0.04 -0.11 6.68 1.01 0.49 -4.72 121.20 123.11 2hg0 s ILE 373 Ca 0.37 0.14 0.03 0.00 0.00 0.00 0.00 60.65 61.19 2hg0 s ILE 373 Cb -0.16 -0.37 -0.00 0.00 0.01 0.00 0.00 42.46 41.94 2hg0 s ILE 373 CO 0.19 0.06 -0.21 -0.70 0.00 0.00 0.00 174.94 174.28 2hg0 s GLU 374 N 1.20 3.12 0.02 2.79 2.12 -1.26 -1.10 118.70 125.59 2hg0 s GLU 374 Ca -0.09 -0.83 -0.11 0.00 0.36 0.00 0.00 54.97 54.31 2hg0 s GLU 374 Cb -0.10 -2.39 0.01 0.00 0.26 0.00 0.00 34.13 31.91 2hg0 s GLU 374 CO -0.08 0.20 0.23 -0.48 -0.54 0.00 0.00 175.26 174.60 2hg0 s LEU 375 N 0.31 1.19 -0.33 2.70 0.05 -0.49 -0.92 118.68 121.19 2hg0 s LEU 375 Ca -0.16 -0.21 -0.12 0.00 0.05 0.00 0.00 54.13 53.69 2hg0 s LEU 375 Cb -0.17 1.06 -0.01 0.00 -2.05 0.00 0.00 46.19 45.01 2hg0 s LEU 375 CO 0.08 -0.52 0.21 -1.83 -0.55 0.00 0.00 176.35 173.74 2hg0 s GLU 376 N -2.11 3.45 0.56 1.48 -1.05 -0.71 -0.30 118.70 120.03 2hg0 s GLU 376 Ca -0.08 -0.66 -0.04 0.00 -0.15 0.00 0.00 54.97 54.04 2hg0 s GLU 376 Cb -0.03 -3.71 0.01 0.00 -0.44 0.00 0.00 34.13 29.96 2hg0 s GLU 376 CO -0.01 -0.42 0.84 -1.25 0.95 0.00 0.00 175.26 175.37 2hg0 s PRO 377 N 1.68 2.83 0.89 -4.83 0.04 -1.26 -3.09 135.00 131.27 2hg0 s PRO 377 Ca 0.06 -0.24 -0.12 0.00 0.04 0.00 0.00 61.00 60.74 2hg0 s PRO 377 Cb -0.17 -2.36 0.12 0.00 0.04 0.00 0.00 34.50 32.13 2hg0 s PRO 377 CO 0.09 -0.66 1.10 -1.25 0.04 0.00 0.00 177.00 176.32 2hg0 s PRO 378 N -4.89 1.35 0.88 0.56 0.04 -1.26 -4.97 135.00 126.71 2hg0 s PRO 378 Ca 0.54 0.73 -0.11 0.00 0.04 0.00 0.00 61.00 62.19 2hg0 s PRO 378 Cb -0.10 -1.83 0.12 0.00 0.04 0.00 0.00 34.50 32.73 2hg0 s PRO 378 CO 0.42 -2.16 1.09 -0.06 0.04 0.00 0.00 177.00 176.34 2hg0 s PHE 379 N -3.00 2.28 0.00 0.56 0.40 -1.26 -4.17 117.98 112.79 2hg0 s PHE 379 Ca 0.63 1.38 0.00 0.00 -0.60 0.00 0.00 56.93 58.34 2hg0 s PHE 379 Cb -0.17 -3.14 0.00 0.00 0.51 0.00 0.00 43.02 40.22 2hg0 s PHE 379 CO 0.56 -2.34 0.00 0.41 0.70 0.00 0.00 175.22 174.55 2hg0 n GLY 380 N -0.94 -0.79 3.80 4.36 0.00 0.02 -4.69 105.19 106.95 2hg0 n GLY 380 Ca 0.08 -1.10 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 2hg0 n GLY 380 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2hg0 s ASP 381 N -4.00 6.12 0.26 1.61 1.11 -1.26 -0.57 116.67 119.94 2hg0 s ASP 381 Ca 0.00 1.92 -0.21 0.00 0.18 0.00 0.00 52.55 54.44 2hg0 s ASP 381 Cb 0.00 -2.55 0.05 0.00 1.07 0.00 0.00 42.92 41.49 2hg0 s ASP 381 CO 0.00 -0.94 0.87 -0.94 1.18 0.00 0.00 175.17 175.34 2hg0 s SER 382 N -2.19 -0.10 -0.03 0.27 1.04 0.33 -4.92 113.70 108.09 2hg0 s SER 382 Ca 0.67 -0.73 0.04 0.00 0.48 0.00 0.00 55.95 56.41 2hg0 s SER 382 Cb -0.17 0.65 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 2hg0 s SER 382 CO 0.26 -1.26 -0.15 -0.31 0.98 0.00 0.00 173.24 172.76 2hg0 s TYR 383 N -2.91 1.43 -0.02 5.02 1.51 0.22 -0.18 117.35 122.41 2hg0 s TYR 383 Ca 0.15 -0.37 -0.09 0.00 -1.01 0.00 0.00 57.07 55.75 2hg0 s TYR 383 Cb -0.04 -0.96 -0.05 0.00 -0.11 0.00 0.00 41.96 40.80 2hg0 s TYR 383 CO 0.07 -0.11 0.28 0.42 -1.11 0.00 0.00 175.55 175.09 2hg0 s ILE 384 N -0.02 5.27 -0.03 2.71 1.01 0.54 0.40 121.20 131.08 2hg0 s ILE 384 Ca -0.01 0.36 -0.06 0.00 0.00 0.00 0.00 60.65 60.94 2hg0 s ILE 384 Cb -0.09 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.82 2hg0 s ILE 384 CO 0.01 0.47 0.14 0.68 0.00 0.00 0.00 174.94 176.24 2hg0 s VAL 385 N -1.19 0.04 -0.04 2.92 -7.23 -0.26 -1.52 120.40 113.11 2hg0 s VAL 385 Ca 0.24 -0.30 0.01 0.00 -1.81 0.00 0.00 61.98 60.12 2hg0 s VAL 385 Cb -0.14 -0.30 0.02 0.00 0.56 0.00 0.00 36.38 36.52 2hg0 s VAL 385 CO 0.13 -0.17 -0.06 -0.69 -0.31 0.00 0.00 175.10 174.00 2hg0 s VAL 386 N -0.54 0.65 0.00 1.32 1.01 -1.11 -1.67 120.40 120.05 2hg0 s VAL 386 Ca -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2hg0 s VAL 386 Cb -0.04 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2hg0 s VAL 386 CO 0.01 0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.96 2hg0 n GLY 387 N 3.91 -2.29 3.24 4.51 0.00 0.10 -1.58 105.19 113.08 2hg0 n GLY 387 Ca -0.24 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.10 2hg0 n GLY 387 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2hg0 s ARG 388 N -0.43 0.92 7.20 1.61 3.00 -1.26 -4.53 118.95 125.46 2hg0 s ARG 388 Ca 0.00 -0.91 0.00 0.00 -1.00 0.00 0.00 55.73 53.82 2hg0 s ARG 388 Cb 0.00 0.38 0.00 0.00 0.00 0.00 0.00 34.95 35.33 2hg0 s ARG 388 CO 0.00 -0.31 0.00 0.41 0.00 0.00 0.00 175.30 175.40 2hg0 n GLY 389 N -0.11 2.15 0.80 8.12 0.00 -1.26 -2.65 105.19 112.25 2hg0 n GLY 389 Ca -0.15 -0.37 0.11 0.00 0.00 0.00 0.00 46.02 45.61 2hg0 n GLY 389 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hg0 n GLU 390 N 12.87 2.05 -0.08 1.61 1.02 -1.26 -3.62 120.64 133.23 2hg0 n GLU 390 Ca 0.00 -1.58 -0.22 0.00 -0.02 0.00 0.00 57.16 55.34 2hg0 n GLU 390 Cb 0.00 -1.44 -0.12 0.00 -0.02 0.00 0.00 31.44 29.86 2hg0 n GLU 390 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2hg0 n GLN 391 N 0.81 0.66 -1.45 3.49 1.13 -1.08 -4.98 117.38 115.95 2hg0 n GLN 391 Ca 0.17 0.29 -0.53 0.00 -1.94 0.00 0.00 57.00 54.99 2hg0 n GLN 391 Cb 0.44 -1.62 -0.05 0.00 0.11 0.00 0.00 30.24 29.12 2hg0 n GLN 391 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 2hg0 n GLN 392 N -3.72 0.05 -4.63 -1.09 7.27 -1.15 -4.64 117.38 109.47 2hg0 n GLN 392 Ca -0.40 0.02 -0.32 0.00 0.07 0.00 0.00 57.00 56.37 2hg0 n GLN 392 Cb 0.94 -1.25 -0.07 0.00 2.41 0.00 0.00 30.24 32.26 2hg0 n GLN 392 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 2hg0 s ILE 393 N -0.54 1.31 0.10 1.69 -4.36 -0.61 -4.91 121.20 113.88 2hg0 s ILE 393 Ca 0.76 -1.93 -0.26 0.00 -0.26 0.00 0.00 60.65 58.96 2hg0 s ILE 393 Cb -1.07 -2.24 0.08 0.00 1.25 0.00 0.00 42.46 40.48 2hg0 s ILE 393 CO 0.56 0.00 0.80 0.54 0.24 0.00 0.00 174.94 177.08 2hg0 s ASN 394 N -3.91 -0.38 -0.20 4.36 4.22 -1.26 -2.75 114.94 115.02 2hg0 s ASN 394 Ca 0.12 -0.13 -0.11 0.00 -2.14 0.00 0.00 52.86 50.60 2hg0 s ASN 394 Cb 0.02 0.50 0.06 0.00 1.28 0.00 0.00 41.25 43.11 2hg0 s ASN 394 CO 0.07 -0.84 0.48 -2.28 -2.04 0.00 0.00 177.10 172.48 2hg0 s HIS 395 N -3.41 -0.71 0.59 1.54 2.46 -0.58 -4.98 115.29 110.21 2hg0 s HIS 395 Ca 0.06 1.49 -0.10 0.00 0.47 0.00 0.00 55.06 56.97 2hg0 s HIS 395 Cb -0.02 0.35 -0.04 0.00 -0.13 0.00 0.00 32.58 32.75 2hg0 s HIS 395 CO -0.07 -0.39 0.99 -1.58 -2.47 0.00 0.00 174.74 171.22 2hg0 s HIS 396 N 1.44 3.61 -0.04 3.88 5.04 -1.26 -0.34 115.29 127.62 2hg0 s HIS 396 Ca -0.10 1.22 -0.26 0.00 -1.54 0.00 0.00 55.06 54.38 2hg0 s HIS 396 Cb -0.08 -2.65 0.06 0.00 0.04 0.00 0.00 32.58 29.95 2hg0 s HIS 396 CO -0.14 -0.61 0.58 -0.46 -2.34 0.00 0.00 174.74 171.77 2hg0 s TRP 397 N -3.08 -0.53 -0.18 3.88 -0.11 0.75 -4.87 118.94 114.79 2hg0 s TRP 397 Ca 0.54 0.90 -0.03 0.00 1.22 0.00 0.00 56.10 58.73 2hg0 s TRP 397 Cb -0.11 0.32 0.06 0.00 -1.50 0.00 0.00 33.47 32.24 2hg0 s TRP 397 CO 0.52 -0.54 0.04 -1.58 -4.62 0.00 0.00 176.95 170.76 2hg0 s HIS 398 N -1.20 0.88 0.51 5.86 5.65 -1.26 0.12 115.29 125.85 2hg0 s HIS 398 Ca -0.12 -0.73 -0.06 0.00 0.25 0.00 0.00 55.06 54.41 2hg0 s HIS 398 Cb -0.02 -0.96 -0.03 0.00 -1.18 0.00 0.00 32.58 30.39 2hg0 s HIS 398 CO 0.08 -0.57 0.83 0.21 -0.65 0.00 0.00 174.74 174.63 2hg0 s LYS 399 N 1.91 3.50 0.00 2.88 2.20 0.26 -4.83 119.74 125.66 2hg0 s LYS 399 Ca -0.00 0.25 0.00 0.00 -0.36 0.00 0.00 55.97 55.86 2hg0 s LYS 399 Cb -0.17 -2.33 0.00 0.00 -1.51 0.00 0.00 37.83 33.83 2hg0 s LYS 399 CO -0.08 -0.29 0.18 0.43 -0.36 0.00 0.00 175.35 175.23