#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xh3 s SER 2 N 0.00 6.55 0.02 1.61 0.01 -1.26 -3.80 113.70 116.83 1xh3 s SER 2 Ca 0.00 0.92 -0.05 0.00 1.31 0.00 0.00 55.95 58.13 1xh3 s SER 2 Cb 0.00 -2.23 -0.01 0.00 0.21 0.00 0.00 66.02 63.99 1xh3 s SER 2 CO 0.00 -0.20 0.09 -1.00 0.41 0.00 0.00 173.24 172.54 1xh3 s HIS 3 N -2.05 0.16 0.04 2.43 4.02 -0.83 -4.99 115.29 114.07 1xh3 s HIS 3 Ca 0.48 -0.39 -0.00 0.00 1.02 0.00 0.00 55.06 56.16 1xh3 s HIS 3 Cb -0.11 -0.12 -0.03 0.00 -1.02 0.00 0.00 32.58 31.30 1xh3 s HIS 3 CO 0.26 -0.31 -0.03 -1.54 1.02 0.00 0.00 174.74 174.14 1xh3 s SER 4 N -1.79 0.42 -0.02 1.40 1.04 -1.26 -0.16 113.70 113.33 1xh3 s SER 4 Ca -0.10 -0.78 0.08 0.00 0.48 0.00 0.00 55.95 55.63 1xh3 s SER 4 Cb -0.05 0.15 -0.02 0.00 0.10 0.00 0.00 66.02 66.21 1xh3 s SER 4 CO -0.02 -0.46 -0.26 -0.32 0.98 0.00 0.00 173.24 173.16 1xh3 s MET 5 N -2.85 2.11 0.00 4.02 0.00 -0.51 -0.96 119.30 121.11 1xh3 s MET 5 Ca -0.03 -0.93 -0.00 0.00 0.00 0.00 0.00 55.69 54.73 1xh3 s MET 5 Cb 0.00 -2.05 -0.00 0.00 0.00 0.00 0.00 34.83 32.78 1xh3 s MET 5 CO -0.06 0.56 0.00 1.03 0.00 0.00 0.00 175.02 176.55 1xh3 s ARG 6 N -0.63 0.05 -0.07 4.11 1.81 -0.30 -1.88 118.95 122.04 1xh3 s ARG 6 Ca 0.10 -0.07 0.00 0.00 -1.72 0.00 0.00 55.73 54.04 1xh3 s ARG 6 Cb -0.10 0.02 -0.03 0.00 -0.45 0.00 0.00 34.95 34.39 1xh3 s ARG 6 CO -0.01 -0.01 -0.05 0.71 -0.68 0.00 0.00 175.30 175.27 1xh3 s TYR 7 N -0.19 3.00 -0.18 -0.53 2.02 -0.40 -0.55 117.35 120.52 1xh3 s TYR 7 Ca -0.02 0.07 0.00 0.00 -0.37 0.00 0.00 57.07 56.75 1xh3 s TYR 7 Cb -0.01 -1.73 0.04 0.00 -0.40 0.00 0.00 41.96 39.86 1xh3 s TYR 7 CO -0.00 0.37 -0.10 -0.06 -1.57 0.00 0.00 175.55 174.20 1xh3 s PHE 8 N -0.84 2.21 -0.09 2.71 0.40 -0.16 -1.91 117.98 120.30 1xh3 s PHE 8 Ca 0.13 -1.41 -0.01 0.00 -0.60 0.00 0.00 56.93 55.04 1xh3 s PHE 8 Cb -0.11 -1.56 -0.03 0.00 0.51 0.00 0.00 43.02 41.83 1xh3 s PHE 8 CO 0.02 -0.70 -0.03 0.71 0.70 0.00 0.00 175.22 175.92 1xh3 s TYR 9 N 1.46 3.06 -0.10 0.36 2.02 0.16 -1.43 117.35 122.88 1xh3 s TYR 9 Ca 0.00 0.07 0.01 0.00 -0.37 0.00 0.00 57.07 56.78 1xh3 s TYR 9 Cb -0.15 -1.78 0.02 0.00 -0.40 0.00 0.00 41.96 39.65 1xh3 s TYR 9 CO -0.08 0.36 -0.10 0.99 -1.57 0.00 0.00 175.55 175.14 1xh3 s THR 10 N -0.70 1.11 -0.15 -0.71 2.01 -0.08 -1.47 115.64 115.65 1xh3 s THR 10 Ca 0.11 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.74 1xh3 s THR 10 Cb -0.11 -1.08 0.02 0.00 0.01 0.00 0.00 72.50 71.33 1xh3 s THR 10 CO 0.02 0.37 -0.19 0.00 -0.69 0.00 0.00 174.62 174.13 1xh3 s ALA 11 N 1.35 2.15 -0.11 7.40 0.00 0.05 -1.15 121.76 131.44 1xh3 s ALA 11 Ca -0.01 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 50.88 1xh3 s ALA 11 Cb -0.14 -1.06 0.02 0.00 0.00 0.00 0.00 23.12 21.95 1xh3 s ALA 11 CO -0.05 -0.22 -0.08 1.41 0.00 0.00 0.00 175.76 176.82 1xh3 s MET 12 N 1.14 1.58 0.67 0.00 1.75 -0.21 -1.08 119.30 123.15 1xh3 s MET 12 Ca -0.00 -0.28 -0.11 0.00 -1.25 0.00 0.00 55.69 54.05 1xh3 s MET 12 Cb -0.14 -1.59 0.00 0.00 2.84 0.00 0.00 34.83 35.94 1xh3 s MET 12 CO -0.08 -0.23 1.06 -1.54 -0.65 0.00 0.00 175.02 173.58 1xh3 s SER 13 N 1.58 5.64 -0.48 1.11 1.04 0.00 -1.38 113.70 121.22 1xh3 s SER 13 Ca 0.03 1.15 0.05 0.00 0.48 0.00 0.00 55.95 57.66 1xh3 s SER 13 Cb -0.13 -2.03 0.25 0.00 0.10 0.00 0.00 66.02 64.21 1xh3 s SER 13 CO -0.07 -1.20 0.93 -2.11 0.98 0.00 0.00 173.24 171.77 1xh3 n ARG 14 N -2.90 0.74 -1.63 4.02 1.85 -1.26 -4.00 116.66 113.48 1xh3 n ARG 14 Ca 0.06 -1.66 -0.48 0.00 -1.00 0.00 0.00 57.85 54.77 1xh3 n ARG 14 Cb 0.56 -1.34 -0.04 0.00 -1.05 0.00 0.00 32.46 30.59 1xh3 n ARG 14 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1xh3 n PRO 15 N 1.55 1.67 -0.12 2.89 -0.02 -1.26 -0.76 135.00 138.95 1xh3 n PRO 15 Ca 0.08 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1xh3 n PRO 15 Cb 0.64 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1xh3 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xh3 n GLY 16 N 2.69 1.25 1.89 -1.23 0.00 -1.26 -4.88 105.19 103.65 1xh3 n GLY 16 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 1xh3 n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xh3 n ARG 17 N -2.00 1.92 0.00 1.61 1.74 0.06 -5.11 116.66 114.87 1xh3 n ARG 17 Ca 0.00 -3.36 0.00 0.00 -0.77 0.00 0.00 57.85 53.72 1xh3 n ARG 17 Cb 0.00 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 1xh3 n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xh3 n GLY 18 N -0.51 -1.87 3.86 -0.13 0.00 -1.25 -4.92 105.19 100.36 1xh3 n GLY 18 Ca 0.20 -1.74 -0.31 0.00 0.00 0.00 0.00 46.02 44.17 1xh3 n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xh3 s GLU 19 N 0.00 3.64 0.40 1.61 0.41 -1.26 -4.54 118.70 118.96 1xh3 s GLU 19 Ca 0.00 0.79 -0.27 0.00 -0.41 0.00 0.00 54.97 55.08 1xh3 s GLU 19 Cb 0.00 -2.09 -0.10 0.00 -1.78 0.00 0.00 34.13 30.16 1xh3 s GLU 19 CO 0.00 -0.54 1.47 -2.14 -0.49 0.00 0.00 175.26 173.56 1xh3 s PRO 20 N -5.00 3.95 0.15 0.39 0.02 -1.26 -4.80 135.00 128.44 1xh3 s PRO 20 Ca 0.56 2.53 -0.29 0.00 0.02 0.00 0.00 61.00 63.81 1xh3 s PRO 20 Cb -0.11 -2.85 -0.07 0.00 0.02 0.00 0.00 34.50 31.49 1xh3 s PRO 20 CO 0.50 -0.65 0.92 0.50 -0.33 0.00 0.00 177.00 177.95 1xh3 s ARG 21 N -2.23 4.72 -0.14 5.54 3.52 -0.48 -4.84 118.95 125.04 1xh3 s ARG 21 Ca 0.56 1.41 0.02 0.00 -0.13 0.00 0.00 55.73 57.58 1xh3 s ARG 21 Cb -0.46 -3.34 0.00 0.00 -1.56 0.00 0.00 34.95 29.60 1xh3 s ARG 21 CO 0.61 0.35 -0.19 0.12 -0.81 0.00 0.00 175.30 175.38 1xh3 s PHE 22 N -0.47 2.71 -0.05 5.12 5.36 -1.26 -1.04 117.98 128.34 1xh3 s PHE 22 Ca 0.43 -1.16 0.06 0.00 -0.96 0.00 0.00 56.93 55.30 1xh3 s PHE 22 Cb -0.24 -1.84 -0.01 0.00 -0.34 0.00 0.00 43.02 40.59 1xh3 s PHE 22 CO 0.30 -0.52 -0.23 0.42 -1.46 0.00 0.00 175.22 173.72 1xh3 s ILE 23 N 0.76 1.89 -0.03 3.12 1.01 -0.30 -1.15 121.20 126.51 1xh3 s ILE 23 Ca -0.07 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 59.65 1xh3 s ILE 23 Cb -0.16 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.70 1xh3 s ILE 23 CO 0.00 0.53 -0.18 0.00 0.00 0.00 0.00 174.94 175.29 1xh3 s ALA 24 N -0.12 1.53 0.06 9.38 0.00 -0.14 -0.90 121.76 131.57 1xh3 s ALA 24 Ca -0.03 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.22 1xh3 s ALA 24 Cb -0.13 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 1xh3 s ALA 24 CO 0.03 0.33 -0.15 0.14 0.00 0.00 0.00 175.76 176.12 1xh3 s VAL 25 N -0.23 1.16 0.03 0.00 -7.23 -0.52 -0.82 120.40 112.78 1xh3 s VAL 25 Ca 0.02 -1.22 0.08 0.00 -1.81 0.00 0.00 61.98 59.06 1xh3 s VAL 25 Cb -0.09 -1.09 -0.02 0.00 0.56 0.00 0.00 36.38 35.74 1xh3 s VAL 25 CO 0.01 -0.13 -0.24 -0.83 -0.31 0.00 0.00 175.10 173.60 1xh3 s GLY 26 N -1.54 1.25 0.05 2.32 0.00 -0.89 -0.99 107.32 107.52 1xh3 s GLY 26 Ca -0.00 -1.14 0.05 0.00 0.00 0.00 0.00 44.72 43.63 1xh3 s GLY 26 CO 0.02 -1.02 -0.15 -0.19 0.00 0.00 0.00 173.10 171.77 1xh3 s TYR 27 N -0.73 1.28 -0.22 1.90 1.51 0.29 -0.55 117.35 120.83 1xh3 s TYR 27 Ca 0.10 -0.39 -0.03 0.00 -1.01 0.00 0.00 57.07 55.74 1xh3 s TYR 27 Cb -0.09 -0.74 -0.00 0.00 -0.11 0.00 0.00 41.96 41.01 1xh3 s TYR 27 CO 0.01 0.05 -0.06 0.08 -1.11 0.00 0.00 175.55 174.53 1xh3 s VAL 28 N -0.99 3.22 0.00 0.71 1.01 -0.32 -1.15 120.40 122.89 1xh3 s VAL 28 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1xh3 s VAL 28 Cb -0.09 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.83 1xh3 s VAL 28 CO 0.02 0.42 0.00 0.47 0.00 0.00 0.00 175.10 176.01 1xh3 n ASP 29 N 4.78 0.00 -2.00 3.32 8.00 -0.14 -1.17 116.55 129.34 1xh3 n ASP 29 Ca -0.18 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.25 1xh3 n ASP 29 Cb 0.51 0.00 0.30 0.00 -0.02 0.00 0.00 41.12 41.91 1xh3 n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1xh3 n ASP 30 N 4.05 4.78 -4.14 -2.24 8.00 -1.26 -4.86 116.55 120.89 1xh3 n ASP 30 Ca 0.00 -3.25 -0.33 0.00 0.71 0.00 0.00 54.79 51.92 1xh3 n ASP 30 Cb 0.00 -0.75 -0.15 0.00 -0.02 0.00 0.00 41.12 40.20 1xh3 n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1xh3 s THR 31 N -3.01 2.51 0.28 -3.53 2.01 -0.32 -5.02 115.64 108.56 1xh3 s THR 31 Ca 0.55 -1.29 -0.29 0.00 0.31 0.00 0.00 61.69 60.97 1xh3 s THR 31 Cb 0.44 -2.34 -0.09 0.00 0.01 0.00 0.00 72.50 70.52 1xh3 s THR 31 CO 0.13 0.12 1.06 -1.58 -0.69 0.00 0.00 174.62 173.67 1xh3 s GLN 32 N 1.23 4.64 0.00 4.92 0.74 -1.26 -1.17 119.66 128.76 1xh3 s GLN 32 Ca -0.03 1.71 0.00 0.00 0.05 0.00 0.00 55.36 57.09 1xh3 s GLN 32 Cb -0.18 -3.14 0.00 0.00 1.10 0.00 0.00 33.01 30.79 1xh3 s GLN 32 CO -0.05 0.24 0.00 1.97 -0.55 0.00 0.00 175.29 176.90 1xh3 n PHE 33 N 1.13 0.00 -3.87 1.67 -1.74 0.29 -4.00 117.46 110.94 1xh3 n PHE 33 Ca -0.01 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.79 1xh3 n PHE 33 Cb 0.46 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.38 1xh3 n PHE 33 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1xh3 s VAL 34 N -1.12 0.14 0.05 1.97 1.01 -1.22 -0.63 120.40 120.60 1xh3 s VAL 34 Ca 0.00 -1.15 -0.06 0.00 0.00 0.00 0.00 61.98 60.78 1xh3 s VAL 34 Cb 0.00 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 1xh3 s VAL 34 CO 0.00 -0.63 0.10 0.00 0.00 0.00 0.00 175.10 174.56 1xh3 s ARG 35 N -3.51 0.65 -0.08 2.72 1.70 -0.72 -2.10 118.95 117.61 1xh3 s ARG 35 Ca 0.02 -0.87 -0.06 0.00 -0.47 0.00 0.00 55.73 54.36 1xh3 s ARG 35 Cb 0.03 0.25 0.03 0.00 -0.57 0.00 0.00 34.95 34.70 1xh3 s ARG 35 CO -0.09 -0.17 0.21 0.12 -1.08 0.00 0.00 175.30 174.29 1xh3 s PHE 36 N -3.07 -0.25 -0.12 5.89 2.19 -0.00 -0.85 117.98 121.77 1xh3 s PHE 36 Ca -0.01 0.61 -0.02 0.00 0.33 0.00 0.00 56.93 57.84 1xh3 s PHE 36 Cb 0.02 0.04 0.04 0.00 -1.31 0.00 0.00 43.02 41.81 1xh3 s PHE 36 CO -0.07 -0.16 0.03 0.34 1.83 0.00 0.00 175.22 177.20 1xh3 s ASP 37 N 0.69 2.01 0.26 6.13 -1.08 -1.26 -0.97 116.67 122.44 1xh3 s ASP 37 Ca -0.05 -0.35 0.21 0.00 -0.52 0.00 0.00 52.55 51.85 1xh3 s ASP 37 Cb -0.06 -0.41 0.99 0.00 -1.46 0.00 0.00 42.92 41.97 1xh3 s ASP 37 CO -0.04 -0.26 1.65 -1.54 0.52 0.00 0.00 175.17 175.51 1xh3 n SER 38 N 5.16 0.57 -0.10 -0.34 3.41 -0.30 -1.59 113.62 120.43 1xh3 n SER 38 Ca -0.07 0.68 0.14 0.00 -0.26 0.00 0.00 58.87 59.36 1xh3 n SER 38 Cb 0.49 -0.79 0.58 0.00 -0.26 0.00 0.00 64.21 64.23 1xh3 n SER 38 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xh3 n ASP 39 N -2.18 0.45 -4.75 4.04 8.00 -1.26 -4.83 116.55 116.02 1xh3 n ASP 39 Ca 0.01 -0.47 -0.34 0.00 0.71 0.00 0.00 54.79 54.70 1xh3 n ASP 39 Cb 0.15 -0.08 0.06 0.00 -0.02 0.00 0.00 41.12 41.24 1xh3 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xh3 s ALA 40 N -2.55 2.33 0.25 2.24 0.00 -0.62 -4.89 121.76 118.52 1xh3 s ALA 40 Ca 0.26 0.69 -0.03 0.00 0.00 0.00 0.00 51.96 52.89 1xh3 s ALA 40 Cb 0.20 -3.38 0.46 0.00 0.00 0.00 0.00 23.12 20.39 1xh3 s ALA 40 CO 0.50 -1.50 1.79 0.00 0.00 0.00 0.00 175.76 176.55 1xh3 h ALA 41 N -0.05 1.23 -2.84 0.00 0.00 -1.92 -3.27 119.26 112.41 1xh3 h ALA 41 Ca -0.47 0.05 -0.60 0.00 0.00 0.00 0.00 54.91 53.88 1xh3 h ALA 41 Cb 1.27 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 18.56 1xh3 h ALA 41 CO 0.52 0.04 -0.78 0.45 0.00 0.00 0.00 179.25 179.49 1xh3 s SER 42 N -5.55 3.34 0.07 0.00 0.15 -1.26 -5.11 113.70 105.35 1xh3 s SER 42 Ca -0.12 -2.67 -0.31 0.00 0.70 0.00 0.00 55.95 53.56 1xh3 s SER 42 Cb 0.20 -0.88 -0.09 0.00 -1.71 0.00 0.00 66.02 63.55 1xh3 s SER 42 CO 0.78 -0.25 1.78 -2.84 1.20 0.00 0.00 173.24 173.91 1xh3 s PRO 43 N 0.35 4.16 0.04 5.44 0.02 -1.24 -4.96 135.00 138.82 1xh3 s PRO 43 Ca 0.20 2.47 -0.21 0.00 0.02 0.00 0.00 61.00 63.48 1xh3 s PRO 43 Cb -0.20 -3.74 0.05 0.00 0.02 0.00 0.00 34.50 30.63 1xh3 s PRO 43 CO -0.03 -0.83 0.48 -0.98 -0.33 0.00 0.00 177.00 175.31 1xh3 s ARG 44 N 3.15 0.98 0.12 5.54 1.70 -1.26 -5.04 118.95 124.14 1xh3 s ARG 44 Ca 0.79 -0.26 -0.31 0.00 -0.47 0.00 0.00 55.73 55.48 1xh3 s ARG 44 Cb -0.42 0.44 -0.08 0.00 -0.57 0.00 0.00 34.95 34.32 1xh3 s ARG 44 CO 0.35 -0.34 1.40 0.99 -1.08 0.00 0.00 175.30 176.62 1xh3 s THR 45 N -2.36 3.25 0.04 4.99 2.01 -1.26 -4.61 115.64 117.69 1xh3 s THR 45 Ca -0.06 0.90 0.08 0.00 0.31 0.00 0.00 61.69 62.92 1xh3 s THR 45 Cb -0.01 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.90 1xh3 s THR 45 CO -0.01 0.07 -0.23 -1.61 -0.69 0.00 0.00 174.62 172.15 1xh3 s GLU 46 N 1.10 1.60 0.37 4.92 2.02 -0.03 -4.98 118.70 123.71 1xh3 s GLU 46 Ca 0.65 -1.00 -0.26 0.00 0.02 0.00 0.00 54.97 54.37 1xh3 s GLU 46 Cb -0.37 -1.73 -0.09 0.00 0.10 0.00 0.00 34.13 32.04 1xh3 s GLU 46 CO 0.30 0.45 1.20 -1.25 0.02 0.00 0.00 175.26 175.97 1xh3 s PRO 47 N -1.15 4.18 0.00 0.39 0.04 -1.26 -1.75 135.00 135.45 1xh3 s PRO 47 Ca 0.09 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1xh3 s PRO 47 Cb -0.09 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.63 1xh3 s PRO 47 CO 0.02 -0.24 0.51 0.54 0.04 0.00 0.00 177.00 177.86 1xh3 n ARG 48 N 0.35 0.54 -3.94 4.56 5.12 0.20 -4.87 116.66 118.62 1xh3 n ARG 48 Ca 0.03 -0.64 -0.12 0.00 -1.93 0.00 0.00 57.85 55.19 1xh3 n ARG 48 Cb 0.45 -0.74 -0.14 0.00 -1.16 0.00 0.00 32.46 30.87 1xh3 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xh3 s ALA 49 N -0.26 0.11 0.41 7.54 0.00 -1.23 -4.61 121.76 123.72 1xh3 s ALA 49 Ca 0.00 -0.13 0.09 0.00 0.00 0.00 0.00 51.96 51.93 1xh3 s ALA 49 Cb 0.00 -0.00 0.90 0.00 0.00 0.00 0.00 23.12 24.02 1xh3 s ALA 49 CO 0.00 0.00 2.02 -1.35 0.00 0.00 0.00 175.76 176.43 1xh3 h PRO 50 N 5.92 0.52 0.00 0.00 0.11 -1.94 -2.85 132.00 133.76 1xh3 h PRO 50 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1xh3 h PRO 50 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1xh3 h PRO 50 CO 0.49 0.34 0.00 -2.67 -0.21 0.00 0.00 178.00 175.96 1xh3 n TRP 51 N -4.47 0.09 0.62 0.65 4.27 -1.26 -2.05 117.44 115.28 1xh3 n TRP 51 Ca 0.06 0.03 0.11 0.00 -3.89 0.00 0.00 57.50 53.82 1xh3 n TRP 51 Cb 0.19 -0.55 0.07 0.00 -1.36 0.00 0.00 31.31 29.66 1xh3 n TRP 51 CO 0.00 0.00 0.00 1.51 -2.29 0.00 0.00 177.69 176.91 1xh3 n ILE 52 N -1.58 0.18 0.16 -1.67 0.13 -1.07 -4.24 119.36 111.27 1xh3 n ILE 52 Ca 0.04 -0.22 0.06 0.00 -1.10 0.00 0.00 62.75 61.53 1xh3 n ILE 52 Cb 0.21 0.17 0.53 0.00 -0.84 0.00 0.00 39.64 39.71 1xh3 n ILE 52 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 1xh3 h GLU 53 N 0.00 0.19 0.00 9.51 5.08 -1.53 -1.78 114.58 126.06 1xh3 h GLU 53 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1xh3 h GLU 53 Cb 0.70 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1xh3 h GLU 53 CO 0.00 0.17 0.00 0.00 -1.00 0.00 0.00 179.01 178.18 1xh3 n GLN 54 N -4.47 0.04 -2.10 2.33 10.64 -1.26 -4.74 117.38 117.82 1xh3 n GLN 54 Ca -0.01 0.37 -0.39 0.00 -1.83 0.00 0.00 57.00 55.15 1xh3 n GLN 54 Cb 0.11 -1.59 -0.00 0.00 -0.86 0.00 0.00 30.24 27.89 1xh3 n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1xh3 s GLU 55 N -3.09 3.85 0.84 2.61 0.41 -0.67 -4.98 118.70 117.66 1xh3 s GLU 55 Ca 0.04 2.04 -0.12 0.00 -0.41 0.00 0.00 54.97 56.52 1xh3 s GLU 55 Cb 0.07 -2.62 0.12 0.00 -1.78 0.00 0.00 34.13 29.92 1xh3 s GLU 55 CO 0.21 -0.56 1.20 0.20 -0.49 0.00 0.00 175.26 175.82 1xh3 s GLY 56 N -0.94 1.67 0.48 -1.39 0.00 -1.26 -4.86 107.32 101.02 1xh3 s GLY 56 Ca 0.60 -0.91 0.15 0.00 0.00 0.00 0.00 44.72 44.56 1xh3 s GLY 56 CO 0.44 -0.34 2.09 -2.55 0.00 0.00 0.00 173.10 172.74 1xh3 h PRO 57 N -1.16 0.18 -0.75 2.90 0.11 -1.97 -0.82 132.00 130.48 1xh3 h PRO 57 Ca -0.45 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1xh3 h PRO 57 Cb 1.29 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.33 1xh3 h PRO 57 CO 0.55 0.12 0.40 1.49 -0.21 0.00 0.00 178.00 180.35 1xh3 h GLU 58 N 0.19 1.05 0.30 1.05 4.81 -1.99 0.88 114.58 120.88 1xh3 h GLU 58 Ca 0.11 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1xh3 h GLU 58 Cb 0.20 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1xh3 h GLU 58 CO -0.02 0.78 -0.14 -0.92 -0.73 0.00 0.00 179.01 177.98 1xh3 h TYR 59 N 1.05 -0.37 -0.75 0.92 3.20 -1.50 -1.27 116.97 118.25 1xh3 h TYR 59 Ca 0.27 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.10 1xh3 h TYR 59 Cb 0.04 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1xh3 h TYR 59 CO 0.01 -0.17 0.38 -1.49 -1.64 0.00 0.00 178.16 175.25 1xh3 h TRP 60 N -0.49 1.06 -0.72 -3.82 4.06 -1.33 -1.35 115.95 113.34 1xh3 h TRP 60 Ca -0.04 -0.04 -0.04 0.00 2.06 0.00 0.00 58.89 60.82 1xh3 h TRP 60 Cb 0.37 -0.33 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 1xh3 h TRP 60 CO -0.03 0.76 0.28 -0.44 -3.56 0.00 0.00 178.44 175.45 1xh3 h ASP 61 N 1.04 1.01 -0.36 -3.49 3.32 -0.81 -1.41 116.42 115.71 1xh3 h ASP 61 Ca 0.26 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 1xh3 h ASP 61 Cb 0.08 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1xh3 h ASP 61 CO -0.04 0.91 0.01 -0.09 -1.72 0.00 0.00 179.24 178.31 1xh3 h ARG 62 N 1.04 0.64 -0.46 3.56 9.65 -0.87 -0.25 114.38 127.69 1xh3 h ARG 62 Ca 0.24 -0.20 0.01 0.00 -1.10 0.00 0.00 59.98 58.93 1xh3 h ARG 62 Cb 0.22 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.72 1xh3 h ARG 62 CO -0.02 0.74 0.30 -0.91 2.80 0.00 0.00 179.97 182.88 1xh3 h ASN 63 N 0.46 0.51 -0.63 -3.80 2.35 -1.16 -1.48 115.58 111.82 1xh3 h ASN 63 Ca 0.10 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.78 1xh3 h ASN 63 Cb 0.45 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 1xh3 h ASN 63 CO 0.02 0.37 0.13 0.74 -1.65 0.00 0.00 177.43 177.03 1xh3 h THR 64 N 0.61 1.26 -0.48 2.81 2.02 -0.99 -0.14 112.91 118.00 1xh3 h THR 64 Ca 0.17 -0.97 0.05 0.00 0.77 0.00 0.00 66.41 66.43 1xh3 h THR 64 Cb -0.05 0.67 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 1xh3 h THR 64 CO -0.05 0.36 0.21 -0.61 0.37 0.00 0.00 175.52 175.81 1xh3 h GLN 65 N 0.95 0.40 -0.14 6.66 4.15 -0.81 0.64 115.11 126.96 1xh3 h GLN 65 Ca 0.20 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1xh3 h GLN 65 Cb 0.40 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 1xh3 h GLN 65 CO 0.01 0.27 0.05 0.82 -1.93 0.00 0.00 178.83 178.05 1xh3 h ILE 66 N 0.42 1.16 0.00 2.39 2.04 -0.68 -1.26 117.51 121.58 1xh3 h ILE 66 Ca 0.22 -0.48 -0.12 0.00 1.00 0.00 0.00 64.86 65.48 1xh3 h ILE 66 Cb 0.17 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 1xh3 h ILE 66 CO -0.18 0.15 -0.57 -0.26 0.00 0.00 0.00 178.15 177.28 1xh3 h PHE 67 N 0.07 0.00 -0.37 1.37 0.04 -0.87 -0.30 116.94 116.89 1xh3 h PHE 67 Ca 0.05 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.67 1xh3 h PHE 67 Cb 0.18 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 1xh3 h PHE 67 CO -0.01 0.57 -0.33 0.87 -0.60 0.00 0.00 178.31 178.81 1xh3 h LYS 68 N 0.00 0.87 -0.23 1.51 1.57 -0.70 -0.13 116.57 119.46 1xh3 h LYS 68 Ca -0.01 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1xh3 h LYS 68 Cb 1.13 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1xh3 h LYS 68 CO 0.07 1.09 0.15 1.15 -0.57 0.00 0.00 179.45 181.34 1xh3 h THR 69 N 0.67 1.05 -0.57 -0.16 2.02 -1.04 -2.91 112.91 111.98 1xh3 h THR 69 Ca 0.06 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1xh3 h THR 69 Cb 0.91 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1xh3 h THR 69 CO 0.08 0.05 0.33 0.78 0.37 0.00 0.00 175.52 177.14 1xh3 h ASN 70 N 0.30 0.68 -0.51 4.18 -0.26 -0.92 -1.33 115.58 117.72 1xh3 h ASN 70 Ca 0.08 -0.04 0.09 0.00 -0.56 0.00 0.00 56.30 55.88 1xh3 h ASN 70 Cb -0.03 -0.17 -0.08 0.00 -1.06 0.00 0.00 38.32 36.99 1xh3 h ASN 70 CO -0.02 0.53 0.08 0.74 -1.06 0.00 0.00 177.43 177.70 1xh3 h THR 71 N 0.78 0.68 -0.34 2.81 2.02 -0.83 0.06 112.91 118.09 1xh3 h THR 71 Ca 0.20 -0.07 -0.11 0.00 0.77 0.00 0.00 66.41 67.20 1xh3 h THR 71 Cb -0.01 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1xh3 h THR 71 CO -0.04 0.04 -0.21 1.56 0.37 0.00 0.00 175.52 177.24 1xh3 h GLN 72 N 0.21 0.75 -0.33 6.66 1.08 -1.20 -2.72 115.11 119.55 1xh3 h GLN 72 Ca 0.26 -0.35 -0.16 0.00 -1.45 0.00 0.00 58.65 56.96 1xh3 h GLN 72 Cb 0.37 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 1xh3 h GLN 72 CO -0.36 0.96 -0.41 1.79 -0.95 0.00 0.00 178.83 179.86 1xh3 h THR 73 N 0.53 1.28 0.00 -0.54 1.35 -0.92 -2.63 112.91 111.98 1xh3 h THR 73 Ca 0.07 -1.59 -0.07 0.00 -0.55 0.00 0.00 66.41 64.27 1xh3 h THR 73 Cb 0.77 1.46 -0.01 0.00 -1.73 0.00 0.00 68.15 68.64 1xh3 h THR 73 CO 0.06 0.52 -0.32 1.88 -0.25 0.00 0.00 175.52 177.41 1xh3 h TYR 74 N 0.67 0.00 -0.54 4.73 0.05 -1.05 0.35 116.97 121.17 1xh3 h TYR 74 Ca 0.05 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.81 1xh3 h TYR 74 Cb 0.98 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.70 1xh3 h TYR 74 CO 0.06 0.32 0.27 0.00 -1.05 0.00 0.00 178.16 177.75 1xh3 h ARG 75 N 0.00 0.78 -0.68 4.88 3.08 -1.19 -0.80 114.38 120.45 1xh3 h ARG 75 Ca -0.00 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.86 1xh3 h ARG 75 Cb 0.57 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1xh3 h ARG 75 CO 0.04 0.63 0.13 0.93 -1.07 0.00 0.00 179.97 180.63 1xh3 h GLU 76 N 0.73 1.11 -0.90 0.04 4.39 -1.08 -2.78 114.58 116.09 1xh3 h GLU 76 Ca 0.19 -0.29 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 1xh3 h GLU 76 Cb 0.10 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.57 1xh3 h GLU 76 CO -0.03 1.01 0.54 0.77 -1.16 0.00 0.00 179.01 180.14 1xh3 h SER 77 N 1.04 1.08 -0.80 1.42 0.02 -0.72 0.79 113.55 116.38 1xh3 h SER 77 Ca 0.21 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1xh3 h SER 77 Cb 0.42 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.65 1xh3 h SER 77 CO 0.01 0.83 0.46 -0.07 -1.14 0.00 0.00 176.83 176.92 1xh3 h LEU 78 N 1.24 0.97 -0.64 5.07 3.38 -1.01 0.51 115.31 124.82 1xh3 h LEU 78 Ca 0.32 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 1xh3 h LEU 78 Cb -0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 1xh3 h LEU 78 CO -0.06 0.77 0.30 0.03 0.09 0.00 0.00 178.44 179.57 1xh3 h ARG 79 N 1.10 0.93 -0.18 1.13 3.08 -1.13 -1.51 114.38 117.79 1xh3 h ARG 79 Ca 0.28 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1xh3 h ARG 79 Cb -0.01 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1xh3 h ARG 79 CO -0.05 0.75 0.10 -0.91 -1.07 0.00 0.00 179.97 178.78 1xh3 h ASN 80 N 0.89 0.22 -0.23 7.04 2.35 -0.36 -2.37 115.58 123.12 1xh3 h ASN 80 Ca 0.22 -0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.83 1xh3 h ASN 80 Cb 0.13 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1xh3 h ASN 80 CO -0.03 0.24 -0.01 -0.07 -1.65 0.00 0.00 177.43 175.91 1xh3 h LEU 81 N 0.18 0.50 -0.53 1.61 4.07 -0.80 -0.69 115.31 119.65 1xh3 h LEU 81 Ca 0.06 -0.10 0.03 0.00 0.08 0.00 0.00 57.88 57.95 1xh3 h LEU 81 Cb 0.07 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 41.64 1xh3 h LEU 81 CO -0.01 0.58 0.32 -0.09 -1.08 0.00 0.00 178.44 178.16 1xh3 h ARG 82 N 0.51 0.61 -0.56 1.13 2.43 -1.05 -2.02 114.38 115.43 1xh3 h ARG 82 Ca 0.11 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1xh3 h ARG 82 Cb 0.35 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 1xh3 h ARG 82 CO 0.01 0.40 0.27 0.78 -1.51 0.00 0.00 179.97 179.93 1xh3 h GLY 83 N 0.62 0.86 2.00 2.80 0.00 -0.94 0.49 103.07 108.91 1xh3 h GLY 83 Ca 0.22 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 1xh3 h GLY 83 CO -0.10 0.40 -0.00 -0.97 0.00 0.00 0.00 176.54 175.87 1xh3 h TYR 84 N 0.76 0.00 -0.55 5.60 0.05 -0.46 -2.00 116.97 120.37 1xh3 h TYR 84 Ca 0.19 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.97 1xh3 h TYR 84 Cb 0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 1xh3 h TYR 84 CO -0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.16 177.77 1xh3 n TYR 85 N -4.30 0.88 -3.98 4.88 4.01 -0.84 -4.76 117.16 113.05 1xh3 n TYR 85 Ca -0.03 -0.54 -0.31 0.00 -0.16 0.00 0.00 57.90 56.85 1xh3 n TYR 85 Cb 0.09 -0.07 0.01 0.00 -0.31 0.00 0.00 39.34 39.06 1xh3 n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1xh3 n ASN 86 N 1.01 -4.19 -4.89 7.72 3.02 -0.75 -4.94 115.26 112.23 1xh3 n ASN 86 Ca 0.20 -0.84 -0.29 0.00 -0.03 0.00 0.00 54.58 53.61 1xh3 n ASN 86 Cb 0.62 -3.60 -0.03 0.00 -0.61 0.00 0.00 39.78 36.16 1xh3 n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1xh3 s GLN 87 N -6.67 3.69 0.56 3.52 -0.21 0.12 -5.02 119.66 115.63 1xh3 s GLN 87 Ca 0.64 0.26 -0.20 0.00 0.02 0.00 0.00 55.36 56.08 1xh3 s GLN 87 Cb -0.33 -2.47 -0.05 0.00 1.00 0.00 0.00 33.01 31.16 1xh3 s GLN 87 CO 0.86 0.02 1.24 0.45 -2.12 0.00 0.00 175.29 175.73 1xh3 s SER 88 N -3.34 5.39 0.00 5.90 0.15 -1.26 -4.77 113.70 115.77 1xh3 s SER 88 Ca 0.48 2.47 0.18 0.00 0.70 0.00 0.00 55.95 59.78 1xh3 s SER 88 Cb -0.10 -2.61 0.99 0.00 -1.71 0.00 0.00 66.02 62.58 1xh3 s SER 88 CO 0.33 -1.47 1.53 -0.62 1.20 0.00 0.00 173.24 174.21 1xh3 n GLU 89 N -1.24 0.39 0.09 5.44 1.02 -1.26 -3.67 120.64 121.40 1xh3 n GLU 89 Ca 0.12 0.07 0.04 0.00 -0.02 0.00 0.00 57.16 57.37 1xh3 n GLU 89 Cb 0.48 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.39 1xh3 n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xh3 h ALA 90 N 2.97 0.65 -2.35 0.62 0.00 -1.98 -3.45 119.26 115.72 1xh3 h ALA 90 Ca 0.00 -0.48 -0.50 0.00 0.00 0.00 0.00 54.91 53.93 1xh3 h ALA 90 Cb 0.10 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1xh3 h ALA 90 CO 0.00 0.56 0.05 0.20 0.00 0.00 0.00 179.25 180.06 1xh3 s GLY 91 N -4.56 2.07 0.01 0.00 0.00 -1.24 -4.71 107.32 98.89 1xh3 s GLY 91 Ca 0.00 -0.19 -0.21 0.00 0.00 0.00 0.00 44.72 44.32 1xh3 s GLY 91 CO 0.78 -0.01 0.61 -0.45 0.00 0.00 0.00 173.10 174.03 1xh3 s SER 92 N -2.84 7.02 0.07 1.64 0.15 -1.26 -4.60 113.70 113.88 1xh3 s SER 92 Ca 0.51 1.21 0.00 0.00 0.70 0.00 0.00 55.95 58.37 1xh3 s SER 92 Cb -0.10 -2.38 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 1xh3 s SER 92 CO 0.26 0.11 -0.05 -1.00 1.20 0.00 0.00 173.24 173.77 1xh3 s HIS 93 N -0.29 0.69 -0.06 3.44 3.76 -1.26 -4.96 115.29 116.62 1xh3 s HIS 93 Ca 0.32 -0.95 0.01 0.00 -0.15 0.00 0.00 55.06 54.29 1xh3 s HIS 93 Cb -0.19 -0.44 0.02 0.00 1.11 0.00 0.00 32.58 33.08 1xh3 s HIS 93 CO 0.18 -0.25 -0.07 0.42 -0.85 0.00 0.00 174.74 174.18 1xh3 s ILE 94 N -3.55 0.74 -0.17 0.60 1.01 -1.26 -0.82 121.20 117.75 1xh3 s ILE 94 Ca 0.07 -0.22 -0.08 0.00 0.00 0.00 0.00 60.65 60.42 1xh3 s ILE 94 Cb 0.05 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 1xh3 s ILE 94 CO -0.07 0.28 0.09 -0.63 0.00 0.00 0.00 174.94 174.62 1xh3 s ILE 95 N 0.99 5.09 0.04 2.92 1.01 -0.24 -0.53 121.20 130.48 1xh3 s ILE 95 Ca -0.09 0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.71 1xh3 s ILE 95 Cb -0.14 -3.28 -0.03 0.00 0.01 0.00 0.00 42.46 39.02 1xh3 s ILE 95 CO -0.00 0.49 -0.26 -1.10 0.00 0.00 0.00 174.94 174.07 1xh3 s GLN 96 N 0.03 1.79 -0.00 2.79 -0.21 -0.46 -0.77 119.66 122.83 1xh3 s GLN 96 Ca 0.07 -1.08 0.02 0.00 0.02 0.00 0.00 55.36 54.39 1xh3 s GLN 96 Cb -0.12 -1.94 -0.00 0.00 1.00 0.00 0.00 33.01 31.95 1xh3 s GLN 96 CO 0.00 0.50 -0.06 0.50 -2.12 0.00 0.00 175.29 174.12 1xh3 s ARG 97 N -1.18 0.48 -0.04 2.91 3.52 -0.54 -0.72 118.95 123.37 1xh3 s ARG 97 Ca 0.11 -0.21 0.01 0.00 -0.13 0.00 0.00 55.73 55.51 1xh3 s ARG 97 Cb -0.10 -0.46 0.02 0.00 -1.56 0.00 0.00 34.95 32.85 1xh3 s ARG 97 CO 0.02 0.13 -0.05 0.00 -0.81 0.00 0.00 175.30 174.58 1xh3 s MET 98 N -0.15 0.86 0.09 5.12 0.23 0.06 -0.67 119.30 124.85 1xh3 s MET 98 Ca 0.02 -0.15 -0.10 0.00 -1.03 0.00 0.00 55.69 54.43 1xh3 s MET 98 Cb -0.02 -0.84 0.01 0.00 -1.53 0.00 0.00 34.83 32.45 1xh3 s MET 98 CO -0.00 -0.04 0.23 1.52 -2.03 0.00 0.00 175.02 174.70 1xh3 s TYR 99 N 0.73 0.08 -5.00 3.16 1.13 -0.80 -1.08 117.35 115.56 1xh3 s TYR 99 Ca -0.10 -0.47 0.00 0.00 -1.41 0.00 0.00 57.07 55.09 1xh3 s TYR 99 Cb -0.13 0.00 0.00 0.00 -1.10 0.00 0.00 41.96 40.73 1xh3 s TYR 99 CO 0.00 -0.56 0.00 0.41 -2.51 0.00 0.00 175.55 172.89 1xh3 n GLY 100 N -0.03 -0.84 3.17 5.49 0.00 -0.36 -1.28 105.19 111.34 1xh3 n GLY 100 Ca -0.15 -1.20 -0.19 0.00 0.00 0.00 0.00 46.02 44.47 1xh3 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xh3 s ASP 102 N -1.54 3.79 0.03 0.00 1.01 -0.09 -1.42 116.67 118.44 1xh3 s ASP 102 Ca -0.00 -0.34 0.06 0.00 0.71 0.00 0.00 52.55 52.97 1xh3 s ASP 102 Cb -0.09 -1.28 -0.03 0.00 1.01 0.00 0.00 42.92 42.53 1xh3 s ASP 102 CO 0.02 0.22 -0.14 -0.76 0.21 0.00 0.00 175.17 174.72 1xh3 s LEU 103 N -0.01 2.80 0.00 1.23 1.02 0.77 0.01 118.68 124.50 1xh3 s LEU 103 Ca -0.05 -0.32 -0.11 0.00 0.02 0.00 0.00 54.13 53.67 1xh3 s LEU 103 Cb -0.14 -1.62 0.19 0.00 0.02 0.00 0.00 46.19 44.63 1xh3 s LEU 103 CO 0.04 0.27 1.15 0.61 0.02 0.00 0.00 176.35 178.44 1xh3 n GLY 104 N 1.57 -0.84 0.34 -3.19 0.00 -0.58 -1.97 105.19 100.53 1xh3 n GLY 104 Ca -0.16 -1.80 0.21 0.00 0.00 0.00 0.00 46.02 44.27 1xh3 n GLY 104 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xh3 h PRO 105 N 0.00 0.00 -0.00 1.61 0.11 -1.91 -0.78 132.00 131.04 1xh3 h PRO 105 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1xh3 h PRO 105 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1xh3 h PRO 105 CO 0.30 0.00 -0.07 -0.40 -0.21 0.00 0.00 178.00 177.62 1xh3 n ASP 106 N -3.03 0.10 0.00 -2.05 5.68 -1.26 -4.92 116.55 111.07 1xh3 n ASP 106 Ca -0.03 0.21 0.00 0.00 -0.50 0.00 0.00 54.79 54.47 1xh3 n ASP 106 Cb 0.12 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 1xh3 n ASP 106 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xh3 n GLY 107 N 1.44 0.81 3.87 6.12 0.00 -0.30 -5.05 105.19 112.09 1xh3 n GLY 107 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 1xh3 n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xh3 s ARG 108 N -0.36 3.79 0.09 1.61 0.52 -1.26 -4.79 118.95 118.55 1xh3 s ARG 108 Ca 0.00 0.45 -0.31 0.00 -0.52 0.00 0.00 55.73 55.36 1xh3 s ARG 108 Cb 0.00 -2.42 -0.09 0.00 0.52 0.00 0.00 34.95 32.97 1xh3 s ARG 108 CO 0.00 0.01 1.67 -1.17 0.02 0.00 0.00 175.30 175.83 1xh3 s LEU 109 N -3.72 4.37 -0.18 2.53 2.96 -1.26 -1.52 118.68 121.85 1xh3 s LEU 109 Ca 0.51 2.55 -0.18 0.00 -0.22 0.00 0.00 54.13 56.78 1xh3 s LEU 109 Cb -0.10 -3.57 -0.15 0.00 0.50 0.00 0.00 46.19 42.87 1xh3 s LEU 109 CO 0.30 -0.90 0.15 -0.07 -1.32 0.00 0.00 176.35 174.51 1xh3 h LEU 110 N 8.35 0.00 -7.00 -0.68 3.38 -0.74 -3.46 115.31 115.16 1xh3 h LEU 110 Ca -0.43 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 57.25 1xh3 h LEU 110 Cb 1.20 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.79 1xh3 h LEU 110 CO 0.93 1.22 0.49 0.00 0.09 0.00 0.00 178.44 181.17 1xh3 s ARG 111 N -2.29 0.81 0.32 1.13 1.70 -1.17 -5.02 118.95 114.43 1xh3 s ARG 111 Ca -0.23 -0.25 0.08 0.00 -0.47 0.00 0.00 55.73 54.86 1xh3 s ARG 111 Cb 0.04 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.76 1xh3 s ARG 111 CO 0.48 -0.35 0.16 0.20 -1.08 0.00 0.00 175.30 174.71 1xh3 s GLY 112 N -2.34 1.80 -0.00 3.88 0.00 -1.26 -0.91 107.32 108.48 1xh3 s GLY 112 Ca 0.04 -1.71 -0.01 0.00 0.00 0.00 0.00 44.72 43.04 1xh3 s GLY 112 CO -0.08 -1.68 0.02 0.30 0.00 0.00 0.00 173.10 171.66 1xh3 s HIS 113 N -2.35 0.01 -0.27 1.90 0.09 -0.05 -4.85 115.29 109.78 1xh3 s HIS 113 Ca 0.37 -0.02 -0.02 0.00 -0.00 0.00 0.00 55.06 55.39 1xh3 s HIS 113 Cb -0.04 -0.02 0.16 0.00 -0.00 0.00 0.00 32.58 32.68 1xh3 s HIS 113 CO 0.23 -0.04 0.49 0.34 -0.00 0.00 0.00 174.74 175.77 1xh3 s ASP 114 N -0.19 -0.60 0.00 1.40 2.15 -1.26 -1.23 116.67 116.94 1xh3 s ASP 114 Ca -0.02 0.58 0.02 0.00 0.43 0.00 0.00 52.55 53.57 1xh3 s ASP 114 Cb -0.01 1.66 -0.01 0.00 -0.30 0.00 0.00 42.92 44.26 1xh3 s ASP 114 CO -0.00 -0.28 -0.08 -1.10 -0.17 0.00 0.00 175.17 173.55 1xh3 s GLN 115 N 2.71 0.60 0.14 4.34 -0.21 -0.24 -0.74 119.66 126.26 1xh3 s GLN 115 Ca 0.16 -0.34 0.08 0.00 0.02 0.00 0.00 55.36 55.28 1xh3 s GLN 115 Cb -0.15 -0.56 -0.04 0.00 1.00 0.00 0.00 33.01 33.26 1xh3 s GLN 115 CO -0.18 0.15 -0.17 -1.12 -2.12 0.00 0.00 175.29 171.84 1xh3 s SER 116 N -0.37 2.41 0.09 5.90 0.01 0.20 -0.76 113.70 121.18 1xh3 s SER 116 Ca 0.01 -0.81 0.04 0.00 1.31 0.00 0.00 55.95 56.50 1xh3 s SER 116 Cb -0.04 -0.12 -0.03 0.00 0.21 0.00 0.00 66.02 66.04 1xh3 s SER 116 CO -0.00 -0.06 -0.10 0.00 0.41 0.00 0.00 173.24 173.49 1xh3 s ALA 117 N -1.93 1.06 -0.10 1.44 0.00 0.10 -0.99 121.76 121.33 1xh3 s ALA 117 Ca 0.12 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1xh3 s ALA 117 Cb -0.06 0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.09 1xh3 s ALA 117 CO 0.05 -0.01 -0.13 -0.47 0.00 0.00 0.00 175.76 175.20 1xh3 s TYR 118 N -2.18 1.77 -1.41 0.00 5.04 -0.20 -1.35 117.35 119.01 1xh3 s TYR 118 Ca 0.03 -0.81 -0.13 0.00 -2.44 0.00 0.00 57.07 53.72 1xh3 s TYR 118 Cb -0.05 -1.31 0.10 0.00 0.35 0.00 0.00 41.96 41.06 1xh3 s TYR 118 CO 0.00 -0.45 0.61 -0.25 -1.34 0.00 0.00 175.55 174.13 1xh3 n ASP 119 N 4.29 -3.58 0.00 4.32 8.00 0.31 -1.68 116.55 128.20 1xh3 n ASP 119 Ca -0.19 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.71 1xh3 n ASP 119 Cb 0.51 -2.95 0.00 0.00 -0.02 0.00 0.00 41.12 38.66 1xh3 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xh3 n GLY 120 N -1.26 0.72 3.44 0.44 0.00 -1.26 -5.02 105.19 102.25 1xh3 n GLY 120 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1xh3 n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xh3 s LYS 121 N -0.25 2.92 0.13 1.61 1.02 -0.68 -5.07 119.74 119.44 1xh3 s LYS 121 Ca 0.00 -0.68 -0.34 0.00 0.02 0.00 0.00 55.97 54.97 1xh3 s LYS 121 Cb 0.00 -2.51 -0.17 0.00 -0.52 0.00 0.00 37.83 34.63 1xh3 s LYS 121 CO 0.00 0.44 1.07 -0.25 -0.92 0.00 0.00 175.35 175.69 1xh3 n ASP 122 N 2.86 0.71 0.04 2.83 9.92 -1.26 -1.04 116.55 130.61 1xh3 n ASP 122 Ca -0.18 1.14 -0.01 0.00 -0.53 0.00 0.00 54.79 55.22 1xh3 n ASP 122 Cb 0.52 -1.11 -0.00 0.00 -0.64 0.00 0.00 41.12 39.89 1xh3 n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xh3 n TYR 123 N 1.39 0.00 -3.74 1.24 9.36 -0.16 -4.71 117.16 120.53 1xh3 n TYR 123 Ca 0.17 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.26 1xh3 n TYR 123 Cb 0.20 -0.04 -0.10 0.00 -0.63 0.00 0.00 39.34 38.78 1xh3 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1xh3 s ILE 124 N -2.07 0.01 -0.01 2.97 2.07 -1.08 -1.18 121.20 121.92 1xh3 s ILE 124 Ca -0.02 -0.10 0.01 0.00 -1.41 0.00 0.00 60.65 59.13 1xh3 s ILE 124 Cb 0.00 -0.56 0.00 0.00 0.13 0.00 0.00 42.46 42.04 1xh3 s ILE 124 CO 0.03 -0.05 -0.04 0.00 -1.91 0.00 0.00 174.94 172.97 1xh3 s ALA 125 N -0.14 0.38 0.09 1.50 0.00 -0.52 -0.62 121.76 122.44 1xh3 s ALA 125 Ca -0.03 -0.15 -0.31 0.00 0.00 0.00 0.00 51.96 51.48 1xh3 s ALA 125 Cb -0.03 -0.13 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 1xh3 s ALA 125 CO 0.01 0.07 1.41 -1.17 0.00 0.00 0.00 175.76 176.09 1xh3 s LEU 126 N 0.06 4.36 0.89 0.00 2.96 0.08 -0.68 118.68 126.35 1xh3 s LEU 126 Ca -0.00 2.29 -0.12 0.00 -0.22 0.00 0.00 54.13 56.08 1xh3 s LEU 126 Cb -0.04 -3.58 0.12 0.00 0.50 0.00 0.00 46.19 43.20 1xh3 s LEU 126 CO -0.00 -0.68 1.10 0.20 -1.32 0.00 0.00 176.35 175.64 1xh3 s ASN 127 N 1.38 3.61 0.56 3.68 0.01 0.36 -4.54 114.94 120.00 1xh3 s ASN 127 Ca 0.65 1.30 0.30 0.00 -0.71 0.00 0.00 52.86 54.40 1xh3 s ASN 127 Cb -0.36 -1.97 1.69 0.00 0.41 0.00 0.00 41.25 41.02 1xh3 s ASN 127 CO 0.29 -2.53 2.18 -0.08 -1.51 0.00 0.00 177.10 175.46 1xh3 h GLU 128 N -1.47 0.00 0.00 -0.60 4.81 -1.88 0.62 114.58 116.06 1xh3 h GLU 128 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1xh3 h GLU 128 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1xh3 h GLU 128 CO 0.58 0.05 0.00 -0.40 -0.73 0.00 0.00 179.01 178.51 1xh3 n ASP 129 N -3.69 0.22 -2.13 1.04 5.68 -1.26 -4.80 116.55 111.60 1xh3 n ASP 129 Ca -0.02 0.57 -0.21 0.00 -0.50 0.00 0.00 54.79 54.63 1xh3 n ASP 129 Cb 0.15 -0.61 -0.04 0.00 -1.14 0.00 0.00 41.12 39.49 1xh3 n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1xh3 n LEU 130 N -1.76 -1.80 0.00 -2.12 4.77 0.21 -4.80 117.00 111.50 1xh3 n LEU 130 Ca 0.01 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1xh3 n LEU 130 Cb 0.11 -2.92 0.00 0.00 -2.33 0.00 0.00 43.42 38.28 1xh3 n LEU 130 CO 0.10 -0.51 -0.05 -1.20 -1.33 0.00 0.00 177.39 174.40 1xh3 n SER 131 N -1.80 0.51 -4.16 -1.43 7.64 -1.26 -4.43 113.62 108.68 1xh3 n SER 131 Ca -0.24 -0.02 -0.10 0.00 1.01 0.00 0.00 58.87 59.53 1xh3 n SER 131 Cb 0.69 0.14 -0.10 0.00 -1.01 0.00 0.00 64.21 63.93 1xh3 n SER 131 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1xh3 s SER 132 N -0.24 0.52 0.14 6.43 1.04 -1.26 -4.92 113.70 115.42 1xh3 s SER 132 Ca 0.00 -1.17 0.09 0.00 0.48 0.00 0.00 55.95 55.35 1xh3 s SER 132 Cb 0.00 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 1xh3 s SER 132 CO 0.00 -0.67 -0.15 0.26 0.98 0.00 0.00 173.24 173.65 1xh3 s TRP 133 N -3.95 2.56 -0.26 5.02 0.52 -1.26 -0.49 118.94 121.08 1xh3 s TRP 133 Ca 0.21 -0.25 -0.00 0.00 0.02 0.00 0.00 56.10 56.08 1xh3 s TRP 133 Cb 0.07 -1.31 0.04 0.00 -1.15 0.00 0.00 33.47 31.12 1xh3 s TRP 133 CO 0.00 0.44 -0.07 0.99 0.02 0.00 0.00 176.95 178.34 1xh3 s THR 134 N -1.38 2.65 -0.09 2.01 2.01 0.14 -4.89 115.64 116.09 1xh3 s THR 134 Ca 0.21 -1.28 -0.11 0.00 0.31 0.00 0.00 61.69 60.82 1xh3 s THR 134 Cb -0.10 -2.44 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1xh3 s THR 134 CO 0.12 0.08 0.25 0.00 -0.69 0.00 0.00 174.62 174.37 1xh3 s ALA 135 N 1.24 3.77 -0.14 7.40 0.00 -1.26 -1.44 121.76 131.34 1xh3 s ALA 135 Ca -0.03 -0.48 0.14 0.00 0.00 0.00 0.00 51.96 51.59 1xh3 s ALA 135 Cb -0.18 -2.17 0.04 0.00 0.00 0.00 0.00 23.12 20.81 1xh3 s ALA 135 CO -0.04 0.48 1.42 0.00 0.00 0.00 0.00 175.76 177.62 1xh3 h ALA 136 N 5.19 0.65 -2.83 0.00 0.00 -1.43 -3.47 119.26 117.37 1xh3 h ALA 136 Ca -0.51 -0.50 0.04 0.00 0.00 0.00 0.00 54.91 53.93 1xh3 h ALA 136 Cb 1.21 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1xh3 h ALA 136 CO 0.62 0.68 0.38 -0.40 0.00 0.00 0.00 179.25 180.54 1xh3 n ASP 137 N -3.23 -2.09 0.25 0.00 5.68 -1.26 -5.03 116.55 110.87 1xh3 n ASP 137 Ca 0.02 -2.34 0.14 0.00 -0.50 0.00 0.00 54.79 52.10 1xh3 n ASP 137 Cb 0.75 3.46 0.58 0.00 -1.14 0.00 0.00 41.12 44.77 1xh3 n ASP 137 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1xh3 h THR 138 N 1.98 0.29 -0.08 2.12 1.35 -1.99 -1.98 112.91 114.60 1xh3 h THR 138 Ca -0.31 -0.80 -0.02 0.00 -0.55 0.00 0.00 66.41 64.73 1xh3 h THR 138 Cb 1.21 1.62 -0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1xh3 h THR 138 CO 0.40 0.11 -0.04 0.00 -0.25 0.00 0.00 175.52 175.74 1xh3 h ALA 139 N 1.89 0.11 0.00 6.62 0.00 -1.97 -3.10 119.26 122.82 1xh3 h ALA 139 Ca -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1xh3 h ALA 139 Cb 0.61 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1xh3 h ALA 139 CO 0.01 -0.13 -0.08 0.00 0.00 0.00 0.00 179.25 179.06 1xh3 h ALA 140 N 0.63 1.66 -0.16 0.00 0.00 -1.77 -0.82 119.26 118.80 1xh3 h ALA 140 Ca 0.02 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1xh3 h ALA 140 Cb 0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1xh3 h ALA 140 CO 0.01 0.10 -0.18 1.96 0.00 0.00 0.00 179.25 181.13 1xh3 h GLN 141 N 0.00 0.26 -0.08 0.00 4.20 -1.32 0.44 115.11 118.61 1xh3 h GLN 141 Ca -0.00 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1xh3 h GLN 141 Cb 0.16 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 1xh3 h GLN 141 CO 0.01 0.45 0.04 0.82 -0.67 0.00 0.00 178.83 179.48 1xh3 h ILE 142 N 0.24 1.08 -0.76 2.54 1.08 -1.07 -0.32 117.51 120.30 1xh3 h ILE 142 Ca 0.05 -0.24 0.06 0.00 -0.39 0.00 0.00 64.86 64.33 1xh3 h ILE 142 Cb 0.47 1.10 -0.06 0.00 -3.07 0.00 0.00 36.82 35.26 1xh3 h ILE 142 CO 0.03 0.07 0.46 0.74 -0.69 0.00 0.00 178.15 178.76 1xh3 h THR 143 N 0.04 1.02 -0.28 -0.27 2.02 -1.19 -1.88 112.91 112.36 1xh3 h THR 143 Ca 0.03 -0.29 0.05 0.00 0.77 0.00 0.00 66.41 66.97 1xh3 h THR 143 Cb 0.08 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.55 1xh3 h THR 143 CO -0.00 0.15 0.01 -0.61 0.37 0.00 0.00 175.52 175.44 1xh3 h GLN 144 N 0.85 0.09 -0.70 6.66 4.15 0.10 0.21 115.11 126.47 1xh3 h GLN 144 Ca 0.33 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.74 1xh3 h GLN 144 Cb 0.16 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.79 1xh3 h GLN 144 CO -0.17 0.06 0.42 0.00 -1.93 0.00 0.00 178.83 177.21 1xh3 h ARG 145 N 0.10 0.94 -0.75 1.69 3.08 -0.75 0.30 114.38 119.00 1xh3 h ARG 145 Ca 0.13 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 60.11 1xh3 h ARG 145 Cb 0.17 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 29.98 1xh3 h ARG 145 CO -0.22 0.67 0.49 0.87 -1.07 0.00 0.00 179.97 180.72 1xh3 h LYS 146 N 0.95 0.99 -0.00 0.04 1.57 -0.84 -0.48 116.57 118.80 1xh3 h LYS 146 Ca 0.25 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.79 1xh3 h LYS 146 Cb -0.03 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1xh3 h LYS 146 CO -0.05 0.65 -0.82 -1.49 -0.57 0.00 0.00 179.45 177.18 1xh3 h TRP 147 N 1.01 0.13 -0.38 -1.35 6.55 -0.20 -2.05 115.95 119.66 1xh3 h TRP 147 Ca 0.27 -0.07 -0.07 0.00 0.95 0.00 0.00 58.89 59.98 1xh3 h TRP 147 Cb -0.12 -0.01 -0.01 0.00 -0.86 0.00 0.00 29.16 28.16 1xh3 h TRP 147 CO -0.02 0.87 -0.03 0.93 -1.05 0.00 0.00 178.44 179.14 1xh3 h GLU 148 N 0.05 0.69 -0.40 0.49 5.08 -0.29 -1.75 114.58 118.44 1xh3 h GLU 148 Ca -0.02 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 1xh3 h GLU 148 Cb 1.43 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.61 1xh3 h GLU 148 CO 0.12 0.80 0.15 0.00 -1.00 0.00 0.00 179.01 179.08 1xh3 h ALA 149 N 0.86 1.51 -0.30 3.43 0.00 -0.96 -3.08 119.26 120.73 1xh3 h ALA 149 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xh3 h ALA 149 Cb 0.51 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1xh3 h ALA 149 CO 0.03 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.65 1xh3 n ALA 150 N -2.47 2.46 -3.54 0.00 0.00 -0.78 -4.97 120.51 111.21 1xh3 n ALA 150 Ca 0.03 -0.82 -0.24 0.00 0.00 0.00 0.00 53.44 52.41 1xh3 n ALA 150 Cb 0.15 -0.94 0.07 0.00 0.00 0.00 0.00 19.45 18.73 1xh3 n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xh3 n ARG 151 N 1.09 -7.45 -0.18 0.00 1.74 -0.88 -4.89 116.66 106.10 1xh3 n ARG 151 Ca 0.18 0.83 -0.10 0.00 -0.77 0.00 0.00 57.85 57.99 1xh3 n ARG 151 Cb 0.51 -5.85 0.01 0.00 -1.02 0.00 0.00 32.46 26.11 1xh3 n ARG 151 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1xh3 h VAL 152 N -2.50 1.27 -0.81 1.55 2.07 -1.63 -3.08 116.25 113.11 1xh3 h VAL 152 Ca -0.57 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 65.76 1xh3 h VAL 152 Cb 1.37 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 1xh3 h VAL 152 CO 0.57 0.41 0.40 0.00 0.02 0.00 0.00 177.57 178.97 1xh3 h ALA 153 N 0.93 1.05 -0.95 1.67 0.00 -1.90 -0.51 119.26 119.54 1xh3 h ALA 153 Ca 0.14 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1xh3 h ALA 153 Cb 0.59 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 1xh3 h ALA 153 CO 0.04 0.60 0.62 0.93 0.00 0.00 0.00 179.25 181.44 1xh3 h GLU 154 N 1.15 1.17 -0.29 0.00 3.07 -1.78 0.16 114.58 118.05 1xh3 h GLU 154 Ca 0.28 -0.07 -0.13 0.00 -0.50 0.00 0.00 59.36 58.94 1xh3 h GLU 154 Cb 0.11 -0.26 -0.00 0.00 -0.84 0.00 0.00 28.75 27.75 1xh3 h GLU 154 CO -0.04 0.77 -0.31 1.96 -1.40 0.00 0.00 179.01 180.00 1xh3 h GLN 155 N 1.20 0.72 -0.61 2.33 4.20 -1.30 -2.12 115.11 119.54 1xh3 h GLN 155 Ca 0.37 -0.39 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1xh3 h GLN 155 Cb -0.01 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1xh3 h GLN 155 CO -0.12 1.01 0.12 -0.07 -0.67 0.00 0.00 178.83 179.10 1xh3 h LEU 156 N 0.47 0.93 -0.46 1.46 3.38 -0.88 -1.66 115.31 118.55 1xh3 h LEU 156 Ca 0.04 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1xh3 h LEU 156 Cb 0.88 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1xh3 h LEU 156 CO 0.08 0.92 0.28 -0.09 0.09 0.00 0.00 178.44 179.71 1xh3 h ARG 157 N 0.93 0.62 -0.67 1.13 2.43 -0.57 0.12 114.38 118.37 1xh3 h ARG 157 Ca 0.19 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1xh3 h ARG 157 Cb 0.38 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.76 1xh3 h ARG 157 CO 0.01 0.45 0.42 0.00 -1.51 0.00 0.00 179.97 179.34 1xh3 h ALA 158 N 1.13 0.87 0.00 2.80 0.00 -1.13 -0.43 119.26 122.50 1xh3 h ALA 158 Ca 0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1xh3 h ALA 158 Cb -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1xh3 h ALA 158 CO -0.03 0.20 -0.00 -0.92 0.00 0.00 0.00 179.25 178.50 1xh3 h TYR 159 N 0.84 -0.00 -0.46 0.00 3.20 -0.93 -1.75 116.97 117.85 1xh3 h TYR 159 Ca 0.26 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.06 1xh3 h TYR 159 Cb -0.01 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1xh3 h TYR 159 CO -0.04 0.08 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.48 1xh3 h LEU 160 N -0.09 0.74 0.00 2.82 3.38 -0.38 -0.03 115.31 121.74 1xh3 h LEU 160 Ca -0.00 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1xh3 h LEU 160 Cb 0.09 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1xh3 h LEU 160 CO 0.00 0.81 -0.57 -0.62 0.09 0.00 0.00 178.44 178.15 1xh3 n GLU 161 N -4.22 0.22 0.00 1.13 1.02 -0.20 -3.90 120.64 114.68 1xh3 n GLU 161 Ca 0.02 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1xh3 n GLU 161 Cb 0.30 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1xh3 n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xh3 n GLY 162 N 1.38 0.52 0.33 0.62 0.00 -0.66 -4.69 105.19 102.69 1xh3 n GLY 162 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.15 1xh3 n GLY 162 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xh3 h LEU 163 N 0.00 0.68 -0.03 0.99 3.38 -1.63 -0.92 115.31 117.78 1xh3 h LEU 163 Ca 0.00 0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1xh3 h LEU 163 Cb 0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1xh3 h LEU 163 CO 0.00 0.29 -0.12 0.00 0.09 0.00 0.00 178.44 178.70 1xh3 h VAL 165 N -0.19 1.29 -0.22 0.00 2.07 -1.53 -1.26 116.25 116.40 1xh3 h VAL 165 Ca 0.05 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1xh3 h VAL 165 Cb 0.27 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1xh3 h VAL 165 CO -0.14 0.38 0.14 -0.33 0.02 0.00 0.00 177.57 177.64 1xh3 h GLU 166 N 0.36 0.28 -0.42 1.57 5.08 -0.96 -0.75 114.58 119.75 1xh3 h GLU 166 Ca 0.07 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.31 1xh3 h GLU 166 Cb 0.63 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1xh3 h GLU 166 CO 0.04 0.19 -0.14 -1.49 -1.00 0.00 0.00 179.01 176.60 1xh3 h TRP 167 N 0.29 0.95 -0.38 4.33 4.06 -0.93 -1.68 115.95 122.59 1xh3 h TRP 167 Ca 0.08 -0.22 0.05 0.00 2.06 0.00 0.00 58.89 60.87 1xh3 h TRP 167 Cb -0.02 -0.23 -0.05 0.00 -1.00 0.00 0.00 29.16 27.86 1xh3 h TRP 167 CO -0.07 0.97 0.10 1.25 -3.56 0.00 0.00 178.44 177.13 1xh3 h LEU 168 N 0.66 0.05 -1.11 -4.49 5.85 -1.05 0.65 115.31 115.87 1xh3 h LEU 168 Ca 0.10 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1xh3 h LEU 168 Cb 0.69 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1xh3 h LEU 168 CO 0.05 0.07 0.38 0.03 -0.34 0.00 0.00 178.44 178.62 1xh3 h ARG 169 N 0.23 1.00 -0.21 1.25 3.08 -1.05 0.48 114.38 119.16 1xh3 h ARG 169 Ca 0.18 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1xh3 h ARG 169 Cb 0.20 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1xh3 h ARG 169 CO -0.22 0.74 0.12 -0.09 -1.07 0.00 0.00 179.97 179.45 1xh3 h ARG 170 N 1.00 0.29 -0.34 0.04 2.43 -0.58 -1.95 114.38 115.28 1xh3 h ARG 170 Ca 0.25 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1xh3 h ARG 170 Cb 0.05 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1xh3 h ARG 170 CO -0.04 0.27 0.22 1.88 -1.51 0.00 0.00 179.97 180.80 1xh3 h TYR 171 N 0.24 0.42 -0.94 2.20 0.05 -0.31 -0.75 116.97 117.88 1xh3 h TYR 171 Ca 0.07 0.01 0.09 0.00 0.05 0.00 0.00 58.73 58.96 1xh3 h TYR 171 Cb 0.06 -0.14 -0.07 0.00 1.01 0.00 0.00 36.73 37.59 1xh3 h TYR 171 CO -0.04 0.27 0.61 -0.07 -1.05 0.00 0.00 178.16 177.87 1xh3 h LEU 172 N 0.46 0.89 -0.06 3.88 3.38 -0.77 0.18 115.31 123.27 1xh3 h LEU 172 Ca 0.13 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1xh3 h LEU 172 Cb -0.05 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1xh3 h LEU 172 CO -0.03 0.52 -0.04 -0.08 0.09 0.00 0.00 178.44 178.90 1xh3 h GLU 173 N 0.98 0.13 -0.29 1.13 4.57 -1.00 -2.06 114.58 118.04 1xh3 h GLU 173 Ca 0.44 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.51 1xh3 h GLU 173 Cb 0.37 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 1xh3 h GLU 173 CO -0.20 0.55 -0.00 -0.91 -1.18 0.00 0.00 179.01 177.28 1xh3 h ASN 174 N -0.30 0.40 -0.65 1.04 2.35 -0.80 -2.52 115.58 115.11 1xh3 h ASN 174 Ca 0.01 -0.07 -0.24 0.00 -0.55 0.00 0.00 56.30 55.46 1xh3 h ASN 174 Cb 0.53 -0.10 -0.14 0.00 0.05 0.00 0.00 38.32 38.65 1xh3 h ASN 174 CO 0.01 0.47 0.24 0.61 -1.65 0.00 0.00 177.43 177.11 1xh3 n GLY 175 N -0.97 4.12 0.30 2.83 0.00 0.60 -4.77 105.19 107.30 1xh3 n GLY 175 Ca 0.01 -1.07 0.05 0.00 0.00 0.00 0.00 46.02 45.01 1xh3 n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1xh3 h LYS 176 N 1.92 0.43 0.00 1.61 2.10 -0.90 0.20 116.57 121.92 1xh3 h LYS 176 Ca 0.29 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 1xh3 h LYS 176 Cb 2.19 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 33.42 1xh3 h LYS 176 CO 0.67 0.28 0.00 0.93 -2.00 0.00 0.00 179.45 179.33 1xh3 h GLU 177 N 0.44 0.00 0.00 0.07 5.08 -1.86 -2.55 114.58 115.76 1xh3 h GLU 177 Ca 0.13 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 1xh3 h GLU 177 Cb -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1xh3 h GLU 177 CO -0.03 0.00 -1.04 0.25 -1.00 0.00 0.00 179.01 177.19 1xh3 n THR 178 N -2.55 0.36 0.16 1.13 -2.24 -0.50 -4.48 114.28 106.17 1xh3 n THR 178 Ca 0.01 0.01 0.04 0.00 -2.27 0.00 0.00 64.05 61.85 1xh3 n THR 178 Cb 0.25 -1.57 0.45 0.00 -2.10 0.00 0.00 70.33 67.36 1xh3 n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1xh3 h LEU 179 N -0.13 0.14 -3.61 3.22 3.38 -0.77 -2.31 115.31 115.23 1xh3 h LEU 179 Ca -0.08 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.71 1xh3 h LEU 179 Cb 0.93 -0.04 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 1xh3 h LEU 179 CO -0.05 0.28 0.17 0.00 0.09 0.00 0.00 178.44 178.93 1xh3 n GLN 180 N -4.33 3.48 -4.10 1.13 6.02 -0.96 -4.89 117.38 113.73 1xh3 n GLN 180 Ca -0.01 -3.07 -0.33 0.00 -0.01 0.00 0.00 57.00 53.58 1xh3 n GLN 180 Cb 0.23 -2.12 -0.16 0.00 1.02 0.00 0.00 30.24 29.21 1xh3 n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1xh3 s ARG 181 N -2.98 2.83 -0.16 -1.09 3.52 -0.87 -4.96 118.95 115.23 1xh3 s ARG 181 Ca 0.52 -0.94 -0.17 0.00 -0.13 0.00 0.00 55.73 55.01 1xh3 s ARG 181 Cb 0.42 -2.65 -0.04 0.00 -1.56 0.00 0.00 34.95 31.12 1xh3 s ARG 181 CO 0.11 -0.29 0.45 0.00 -0.81 0.00 0.00 175.30 174.76 1xh3 s ALA 182 N 1.25 3.52 -0.30 6.12 0.00 -1.26 -4.76 121.76 126.34 1xh3 s ALA 182 Ca 0.02 -0.36 -0.10 0.00 0.00 0.00 0.00 51.96 51.52 1xh3 s ALA 182 Cb -0.15 -2.66 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 1xh3 s ALA 182 CO -0.11 -0.18 0.17 -0.51 0.00 0.00 0.00 175.76 175.13 1xh3 s ASP 183 N 0.85 5.73 0.68 0.00 1.01 0.48 -4.74 116.67 120.68 1xh3 s ASP 183 Ca 0.23 -0.29 -0.14 0.00 0.71 0.00 0.00 52.55 53.07 1xh3 s ASP 183 Cb -0.15 -2.05 0.01 0.00 1.01 0.00 0.00 42.92 41.74 1xh3 s ASP 183 CO 0.09 -0.13 1.09 -2.16 0.21 0.00 0.00 175.17 174.27 1xh3 s PRO 184 N 1.68 2.75 0.41 8.23 0.04 -1.26 -1.44 135.00 145.40 1xh3 s PRO 184 Ca 0.06 1.27 -0.25 0.00 0.04 0.00 0.00 61.00 62.12 1xh3 s PRO 184 Cb -0.16 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.34 1xh3 s PRO 184 CO 0.08 -1.27 1.16 -1.25 0.04 0.00 0.00 177.00 175.75 1xh3 s PRO 185 N -4.38 4.03 -0.16 0.56 0.04 -1.26 -4.32 135.00 129.52 1xh3 s PRO 185 Ca 0.64 1.80 -0.22 0.00 0.04 0.00 0.00 61.00 63.26 1xh3 s PRO 185 Cb -0.18 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 31.70 1xh3 s PRO 185 CO 0.46 -0.33 0.67 0.15 0.04 0.00 0.00 177.00 177.99 1xh3 s LYS 186 N -2.36 4.29 0.01 4.56 1.02 0.55 -4.85 119.74 122.96 1xh3 s LYS 186 Ca 0.58 0.73 0.07 0.00 0.02 0.00 0.00 55.97 57.37 1xh3 s LYS 186 Cb -0.30 -3.53 -0.02 0.00 -0.52 0.00 0.00 37.83 33.46 1xh3 s LYS 186 CO 0.37 -0.15 -0.22 0.95 -0.92 0.00 0.00 175.35 175.38 1xh3 s THR 187 N 1.58 1.78 0.16 2.17 -4.23 -1.26 -1.28 115.64 114.56 1xh3 s THR 187 Ca 0.32 -1.08 -0.18 0.00 -1.18 0.00 0.00 61.69 59.57 1xh3 s THR 187 Cb -0.16 -1.50 0.04 0.00 1.34 0.00 0.00 72.50 72.22 1xh3 s THR 187 CO 0.12 0.39 0.49 -1.38 -0.54 0.00 0.00 174.62 173.70 1xh3 s HIS 188 N -0.64 -0.25 -0.11 3.99 -3.43 -1.10 -5.00 115.29 108.74 1xh3 s HIS 188 Ca 0.09 -0.06 0.01 0.00 -0.80 0.00 0.00 55.06 54.30 1xh3 s HIS 188 Cb -0.09 0.38 -0.01 0.00 -1.43 0.00 0.00 32.58 31.43 1xh3 s HIS 188 CO 0.00 -0.82 -0.15 0.08 -2.00 0.00 0.00 174.74 171.86 1xh3 s VAL 189 N -3.82 2.90 0.28 -5.38 1.01 -1.26 -0.63 120.40 113.50 1xh3 s VAL 189 Ca 0.05 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.39 1xh3 s VAL 189 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1xh3 s VAL 189 CO -0.09 0.54 0.10 0.42 0.00 0.00 0.00 175.10 176.07 1xh3 s THR 190 N 0.17 3.73 -0.06 3.92 -4.23 -0.13 -4.72 115.64 114.33 1xh3 s THR 190 Ca -0.08 -1.68 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 1xh3 s THR 190 Cb -0.15 -3.07 0.02 0.00 1.34 0.00 0.00 72.50 70.64 1xh3 s THR 190 CO 0.05 -0.33 -0.06 -2.28 -0.54 0.00 0.00 174.62 171.47 1xh3 s HIS 191 N -2.27 0.93 -0.29 3.99 2.46 -1.26 -1.57 115.29 117.28 1xh3 s HIS 191 Ca 0.33 -0.31 -0.02 0.00 0.47 0.00 0.00 55.06 55.54 1xh3 s HIS 191 Cb -0.06 -0.80 0.10 0.00 -0.13 0.00 0.00 32.58 31.68 1xh3 s HIS 191 CO 0.22 -0.25 0.10 -1.01 -2.47 0.00 0.00 174.74 171.33 1xh3 s HIS 192 N 1.06 1.28 0.23 3.88 3.76 0.03 -4.97 115.29 120.55 1xh3 s HIS 192 Ca -0.08 -1.41 -0.32 0.00 -0.15 0.00 0.00 55.06 53.10 1xh3 s HIS 192 Cb -0.14 -1.43 -0.14 0.00 1.11 0.00 0.00 32.58 31.99 1xh3 s HIS 192 CO -0.01 -0.83 1.41 -2.30 -0.85 0.00 0.00 174.74 172.16 1xh3 n PRO 193 N 4.97 2.01 -0.00 8.40 -0.02 -1.26 -0.35 135.00 148.74 1xh3 n PRO 193 Ca -0.04 0.71 0.04 0.00 -2.02 0.00 0.00 63.50 62.20 1xh3 n PRO 193 Cb 0.43 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.48 1xh3 n PRO 193 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1xh3 n VAL 194 N 2.01 0.00 -3.91 -1.45 0.24 -0.50 -4.84 118.33 109.88 1xh3 n VAL 194 Ca 0.12 -0.28 -0.03 0.00 -2.04 0.00 0.00 64.34 62.12 1xh3 n VAL 194 Cb 0.31 0.83 0.02 0.00 -1.47 0.00 0.00 33.84 33.53 1xh3 n VAL 194 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1xh3 s SER 195 N -2.09 0.01 0.56 -1.34 1.04 -0.98 -4.96 113.70 105.95 1xh3 s SER 195 Ca 0.02 -0.65 0.31 0.00 0.48 0.00 0.00 55.95 56.11 1xh3 s SER 195 Cb 0.06 0.47 1.65 0.00 0.10 0.00 0.00 66.02 68.30 1xh3 s SER 195 CO 0.35 -0.93 2.14 0.44 0.98 0.00 0.00 173.24 176.22 1xh3 h ASP 196 N 2.00 0.00 0.00 7.02 5.19 -2.03 -3.28 116.42 125.31 1xh3 h ASP 196 Ca -0.27 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.14 1xh3 h ASP 196 Cb 1.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.72 1xh3 h ASP 196 CO 0.36 0.07 0.00 0.00 -3.12 0.00 0.00 179.24 176.55 1xh3 n HIS 197 N -3.55 0.00 -4.04 4.55 1.44 -1.26 -4.88 115.22 107.49 1xh3 n HIS 197 Ca -0.02 -0.14 -0.10 0.00 -2.01 0.00 0.00 57.72 55.45 1xh3 n HIS 197 Cb 0.19 -0.01 -0.11 0.00 0.12 0.00 0.00 29.99 30.18 1xh3 n HIS 197 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1xh3 s GLU 198 N -0.28 0.46 0.03 -1.40 2.02 -1.24 -0.63 118.70 117.66 1xh3 s GLU 198 Ca 0.00 -0.82 -0.05 0.00 0.02 0.00 0.00 54.97 54.12 1xh3 s GLU 198 Cb 0.00 0.02 -0.01 0.00 0.10 0.00 0.00 34.13 34.23 1xh3 s GLU 198 CO 0.00 -0.04 0.08 0.00 0.02 0.00 0.00 175.26 175.32 1xh3 s ALA 199 N -2.10 -0.06 -0.13 5.21 0.00 -0.55 -1.41 121.76 122.71 1xh3 s ALA 199 Ca -0.08 -0.52 -0.17 0.00 0.00 0.00 0.00 51.96 51.19 1xh3 s ALA 199 Cb -0.05 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1xh3 s ALA 199 CO -0.03 -0.28 0.41 0.99 0.00 0.00 0.00 175.76 176.85 1xh3 s THR 200 N -2.33 5.23 -0.21 0.00 2.01 0.52 -0.69 115.64 120.16 1xh3 s THR 200 Ca -0.07 0.80 -0.08 0.00 0.31 0.00 0.00 61.69 62.65 1xh3 s THR 200 Cb -0.03 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 1xh3 s THR 200 CO -0.03 0.35 0.09 -0.76 -0.69 0.00 0.00 174.62 173.57 1xh3 s LEU 201 N 0.56 3.77 -0.16 4.42 1.43 -0.10 -0.79 118.68 127.81 1xh3 s LEU 201 Ca 0.22 0.00 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 1xh3 s LEU 201 Cb -0.14 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.11 1xh3 s LEU 201 CO 0.08 0.09 -0.18 -0.60 0.23 0.00 0.00 176.35 175.97 1xh3 s ARG 202 N 0.88 2.70 -0.25 1.70 3.52 -0.61 -1.44 118.95 125.46 1xh3 s ARG 202 Ca 0.05 -0.72 -0.13 0.00 -0.13 0.00 0.00 55.73 54.79 1xh3 s ARG 202 Cb -0.14 -2.35 -0.04 0.00 -1.56 0.00 0.00 34.95 30.86 1xh3 s ARG 202 CO 0.03 -0.19 0.29 0.00 -0.81 0.00 0.00 175.30 174.62 1xh3 s TRP 204 N 1.60 3.29 -0.10 0.00 0.52 0.20 -1.38 118.94 123.07 1xh3 s TRP 204 Ca 0.12 0.29 0.01 0.00 0.02 0.00 0.00 56.10 56.53 1xh3 s TRP 204 Cb -0.15 -1.83 0.02 0.00 -1.15 0.00 0.00 33.47 30.36 1xh3 s TRP 204 CO 0.08 0.54 -0.09 0.00 0.02 0.00 0.00 176.95 177.51 1xh3 s ALA 205 N -0.91 1.29 0.03 0.98 0.00 -0.16 -2.72 121.76 120.26 1xh3 s ALA 205 Ca 0.14 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.64 1xh3 s ALA 205 Cb -0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 1xh3 s ALA 205 CO 0.03 -0.23 -0.11 -0.51 0.00 0.00 0.00 175.76 174.94 1xh3 s LEU 206 N 1.34 2.15 -0.45 0.00 1.43 -0.40 -1.26 118.68 121.48 1xh3 s LEU 206 Ca -0.02 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1xh3 s LEU 206 Cb -0.14 -0.45 0.00 0.00 0.03 0.00 0.00 46.19 45.64 1xh3 s LEU 206 CO -0.04 -0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.14 1xh3 n GLY 207 N 2.05 0.42 3.92 -3.19 0.00 -0.77 -0.33 105.19 107.30 1xh3 n GLY 207 Ca -0.18 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.78 1xh3 n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xh3 s PHE 208 N -2.21 3.51 -0.17 1.61 -0.71 -1.08 -4.66 117.98 114.27 1xh3 s PHE 208 Ca 0.00 0.26 -0.12 0.00 -1.04 0.00 0.00 56.93 56.03 1xh3 s PHE 208 Cb 0.00 -1.77 0.05 0.00 -1.21 0.00 0.00 43.02 40.09 1xh3 s PHE 208 CO 0.00 0.56 0.42 -0.47 -1.34 0.00 0.00 175.22 174.39 1xh3 s TYR 209 N -1.57 -0.54 0.61 3.49 6.14 -0.52 -0.77 117.35 124.19 1xh3 s TYR 209 Ca 0.36 1.22 -0.10 0.00 0.64 0.00 0.00 57.07 59.18 1xh3 s TYR 209 Cb -0.13 0.21 0.15 0.00 0.42 0.00 0.00 41.96 42.62 1xh3 s TYR 209 CO 0.28 -0.28 0.60 -0.35 0.64 0.00 0.00 175.55 176.43 1xh3 n PRO 210 N 3.51 -1.80 0.17 4.97 -0.04 -1.26 -0.39 135.00 140.16 1xh3 n PRO 210 Ca -0.18 -0.94 0.04 0.00 -0.04 0.00 0.00 63.50 62.38 1xh3 n PRO 210 Cb 0.56 -0.82 0.24 0.00 -0.04 0.00 0.00 33.50 33.44 1xh3 n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xh3 h ALA 211 N -2.28 0.89 -2.57 0.55 0.00 -1.94 -3.45 119.26 110.46 1xh3 h ALA 211 Ca -0.22 -0.40 -0.53 0.00 0.00 0.00 0.00 54.91 53.77 1xh3 h ALA 211 Cb 0.64 -0.07 0.05 0.00 0.00 0.00 0.00 17.79 18.41 1xh3 h ALA 211 CO 0.14 0.54 1.06 -1.91 0.00 0.00 0.00 179.25 179.09 1xh3 n GLU 212 N -3.45 2.79 -3.50 0.00 4.07 -1.26 -4.96 120.64 114.32 1xh3 n GLU 212 Ca 0.00 1.01 -0.15 0.00 -0.06 0.00 0.00 57.16 57.96 1xh3 n GLU 212 Cb 0.58 -2.88 -0.05 0.00 -0.06 0.00 0.00 31.44 29.04 1xh3 n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1xh3 s ILE 213 N 1.96 0.01 -0.13 6.31 2.07 -1.26 -4.64 121.20 125.51 1xh3 s ILE 213 Ca 0.79 -0.06 0.02 0.00 -1.41 0.00 0.00 60.65 59.99 1xh3 s ILE 213 Cb -0.49 -0.99 0.02 0.00 0.13 0.00 0.00 42.46 41.12 1xh3 s ILE 213 CO 0.35 -0.03 -0.17 -0.89 -1.91 0.00 0.00 174.94 172.29 1xh3 s THR 214 N -2.27 1.68 -0.11 4.00 2.01 -0.62 -4.99 115.64 115.34 1xh3 s THR 214 Ca -0.06 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.22 1xh3 s THR 214 Cb -0.01 -1.52 0.01 0.00 0.01 0.00 0.00 72.50 70.99 1xh3 s THR 214 CO 0.00 0.48 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.49 1xh3 s LEU 215 N 1.06 1.75 0.02 4.42 1.43 -1.26 -0.82 118.68 125.29 1xh3 s LEU 215 Ca -0.04 -0.43 -0.02 0.00 -1.03 0.00 0.00 54.13 52.61 1xh3 s LEU 215 Cb -0.15 -1.10 -0.02 0.00 0.03 0.00 0.00 46.19 44.96 1xh3 s LEU 215 CO -0.04 0.03 0.01 0.42 0.23 0.00 0.00 176.35 177.00 1xh3 s THR 216 N 0.92 0.12 -0.06 5.49 -4.23 -0.73 -4.95 115.64 112.21 1xh3 s THR 216 Ca -0.08 -1.02 -0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1xh3 s THR 216 Cb -0.15 -0.55 -0.04 0.00 1.34 0.00 0.00 72.50 73.10 1xh3 s THR 216 CO -0.01 -0.56 0.06 0.26 -0.54 0.00 0.00 174.62 173.83 1xh3 s TRP 217 N -1.95 3.28 0.10 3.99 0.52 -1.26 -0.61 118.94 123.01 1xh3 s TRP 217 Ca -0.11 0.25 0.08 0.00 0.02 0.00 0.00 56.10 56.35 1xh3 s TRP 217 Cb -0.06 -1.79 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 1xh3 s TRP 217 CO -0.02 0.55 -0.18 -0.65 0.02 0.00 0.00 176.95 176.66 1xh3 s GLN 218 N -1.27 1.85 -0.16 4.98 -0.21 0.11 -1.03 119.66 123.94 1xh3 s GLN 218 Ca 0.18 -1.13 0.01 0.00 0.02 0.00 0.00 55.36 54.43 1xh3 s GLN 218 Cb -0.12 -2.13 0.01 0.00 1.00 0.00 0.00 33.01 31.77 1xh3 s GLN 218 CO 0.07 0.50 -0.18 0.50 -2.12 0.00 0.00 175.29 174.06 1xh3 s ARG 219 N -1.96 3.11 -1.40 2.91 3.52 -0.58 -1.10 118.95 123.44 1xh3 s ARG 219 Ca 0.17 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.98 1xh3 s ARG 219 Cb -0.11 -2.59 0.00 0.00 -1.56 0.00 0.00 34.95 30.69 1xh3 s ARG 219 CO 0.09 -0.08 0.00 -0.25 -0.81 0.00 0.00 175.30 174.25 1xh3 n ASP 220 N 4.31 -4.36 0.00 -2.12 8.00 -0.17 -1.00 116.55 121.20 1xh3 n ASP 220 Ca -0.20 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.51 1xh3 n ASP 220 Cb 0.51 -3.78 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 1xh3 n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xh3 n GLY 221 N -0.67 0.70 3.43 0.44 0.00 -1.26 -5.05 105.19 102.78 1xh3 n GLY 221 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 1xh3 n GLY 221 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xh3 s GLU 222 N -0.34 3.59 0.20 1.61 2.12 -0.17 -5.02 118.70 120.68 1xh3 s GLU 222 Ca 0.00 -0.53 -0.31 0.00 0.36 0.00 0.00 54.97 54.48 1xh3 s GLU 222 Cb 0.00 -3.06 -0.16 0.00 0.26 0.00 0.00 34.13 31.17 1xh3 s GLU 222 CO 0.00 -0.00 0.98 -0.25 -0.54 0.00 0.00 175.26 175.44 1xh3 n ASP 223 N 4.28 0.66 -2.64 -1.70 9.92 -1.26 -1.53 116.55 124.28 1xh3 n ASP 223 Ca -0.17 1.15 -0.34 0.00 -0.53 0.00 0.00 54.79 54.90 1xh3 n ASP 223 Cb 0.52 -1.15 0.03 0.00 -0.64 0.00 0.00 41.12 39.87 1xh3 n ASP 223 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xh3 n GLN 224 N 1.30 3.03 -0.08 -1.24 1.13 -0.19 -4.84 117.38 116.48 1xh3 n GLN 224 Ca 0.15 -3.86 -0.06 0.00 -1.94 0.00 0.00 57.00 51.28 1xh3 n GLN 224 Cb 0.25 -2.27 -0.00 0.00 0.11 0.00 0.00 30.24 28.33 1xh3 n GLN 224 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1xh3 h THR 225 N 2.08 0.58 0.00 5.09 2.02 -1.90 -1.48 112.91 119.30 1xh3 h THR 225 Ca 0.47 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.64 1xh3 h THR 225 Cb 0.53 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1xh3 h THR 225 CO 1.22 0.00 -0.04 1.56 0.37 0.00 0.00 175.52 178.63 1xh3 h GLN 226 N -0.07 0.00 -0.15 6.66 1.08 -2.00 -3.02 115.11 117.60 1xh3 h GLN 226 Ca 0.16 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 1xh3 h GLN 226 Cb 0.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 1xh3 h GLN 226 CO -0.36 0.04 0.00 -0.25 -0.95 0.00 0.00 178.83 177.31 1xh3 n ASP 227 N -3.21 2.48 -4.74 1.46 8.00 -0.64 -4.95 116.55 114.95 1xh3 n ASP 227 Ca -0.01 -1.72 -0.37 0.00 0.71 0.00 0.00 54.79 53.40 1xh3 n ASP 227 Cb 0.25 -0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.19 1xh3 n ASP 227 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1xh3 s THR 228 N -1.10 5.23 -0.27 -3.53 2.01 -0.70 -4.56 115.64 112.73 1xh3 s THR 228 Ca 0.20 0.74 -0.16 0.00 0.31 0.00 0.00 61.69 62.78 1xh3 s THR 228 Cb 0.13 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 1xh3 s THR 228 CO 0.18 0.39 0.43 -0.70 -0.69 0.00 0.00 174.62 174.23 1xh3 s GLU 229 N 0.33 4.04 -0.22 4.92 2.12 0.37 -4.92 118.70 125.33 1xh3 s GLU 229 Ca 0.21 0.15 0.02 0.00 0.36 0.00 0.00 54.97 55.71 1xh3 s GLU 229 Cb -0.14 -3.66 0.04 0.00 0.26 0.00 0.00 34.13 30.63 1xh3 s GLU 229 CO 0.07 -0.31 -0.14 -1.17 -0.54 0.00 0.00 175.26 173.18 1xh3 s LEU 230 N 2.17 2.71 0.54 2.70 2.96 -1.26 -0.44 118.68 128.05 1xh3 s LEU 230 Ca 0.17 -1.02 -0.15 0.00 -0.22 0.00 0.00 54.13 52.92 1xh3 s LEU 230 Cb -0.16 -1.45 -0.07 0.00 0.50 0.00 0.00 46.19 45.02 1xh3 s LEU 230 CO 0.10 -0.11 0.99 0.68 -1.32 0.00 0.00 176.35 176.69 1xh3 s VAL 231 N 1.24 4.58 0.34 1.68 -7.23 -0.97 -5.01 120.40 115.03 1xh3 s VAL 231 Ca -0.02 1.12 -0.29 0.00 -1.81 0.00 0.00 61.98 60.98 1xh3 s VAL 231 Cb -0.17 -3.76 -0.11 0.00 0.56 0.00 0.00 36.38 32.90 1xh3 s VAL 231 CO -0.09 -0.80 1.51 1.21 -0.31 0.00 0.00 175.10 176.62 1xh3 n GLU 232 N -1.87 2.62 -1.70 4.82 2.13 -1.26 -4.63 120.64 120.75 1xh3 n GLU 232 Ca 0.06 0.92 -0.44 0.00 0.66 0.00 0.00 57.16 58.37 1xh3 n GLU 232 Cb 0.54 -2.66 -0.02 0.00 0.27 0.00 0.00 31.44 29.57 1xh3 n GLU 232 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1xh3 n THR 233 N 1.17 0.84 -4.34 6.31 -1.04 -1.26 -4.84 114.28 111.11 1xh3 n THR 233 Ca 0.05 -0.21 -0.19 0.00 -2.04 0.00 0.00 64.05 61.66 1xh3 n THR 233 Cb 0.37 -1.69 -0.14 0.00 -1.82 0.00 0.00 70.33 67.06 1xh3 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xh3 s ARG 234 N -0.24 0.86 0.21 -2.82 1.70 -0.53 -4.97 118.95 113.15 1xh3 s ARG 234 Ca 0.68 -0.65 -0.30 0.00 -0.47 0.00 0.00 55.73 55.00 1xh3 s ARG 234 Cb -0.59 -0.83 -0.08 0.00 -0.57 0.00 0.00 34.95 32.88 1xh3 s ARG 234 CO 0.47 0.21 1.03 -1.25 -1.08 0.00 0.00 175.30 174.68 1xh3 s PRO 235 N -0.93 4.70 0.29 3.89 0.04 -1.26 -0.72 135.00 141.01 1xh3 s PRO 235 Ca 0.01 1.63 0.17 0.00 0.04 0.00 0.00 61.00 62.84 1xh3 s PRO 235 Cb -0.07 -3.28 0.10 0.00 0.04 0.00 0.00 34.50 31.30 1xh3 s PRO 235 CO 0.01 0.25 1.42 0.00 0.04 0.00 0.00 177.00 178.72 1xh3 h ALA 236 N 4.65 0.73 0.00 8.56 0.00 -1.22 -3.47 119.26 128.50 1xh3 h ALA 236 Ca -0.45 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1xh3 h ALA 236 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1xh3 h ALA 236 CO 0.70 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.87 1xh3 n GLY 237 N 1.21 0.39 0.61 0.00 0.00 -1.26 -4.94 105.19 101.20 1xh3 n GLY 237 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1xh3 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xh3 n ASP 238 N 0.00 3.33 0.00 1.61 5.68 -1.26 -4.95 116.55 120.96 1xh3 n ASP 238 Ca 0.00 -2.97 0.00 0.00 -0.50 0.00 0.00 54.79 51.32 1xh3 n ASP 238 Cb 0.00 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 39.50 1xh3 n ASP 238 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1xh3 n ARG 239 N -0.75 0.00 -2.51 0.11 1.85 -1.26 -5.05 116.66 109.05 1xh3 n ARG 239 Ca 0.19 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.80 1xh3 n ARG 239 Cb 0.78 -0.37 0.08 0.00 -1.05 0.00 0.00 32.46 31.89 1xh3 n ARG 239 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1xh3 s THR 240 N -1.98 2.35 0.27 8.89 -4.23 -1.26 -4.86 115.64 114.81 1xh3 s THR 240 Ca 0.00 -0.54 0.06 0.00 -1.18 0.00 0.00 61.69 60.03 1xh3 s THR 240 Cb 0.00 -2.81 -0.06 0.00 1.34 0.00 0.00 72.50 70.97 1xh3 s THR 240 CO 0.00 0.00 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.68 1xh3 s PHE 241 N -3.05 1.86 0.04 3.99 0.40 0.05 -0.68 117.98 120.58 1xh3 s PHE 241 Ca 0.62 -0.77 0.02 0.00 -0.60 0.00 0.00 56.93 56.20 1xh3 s PHE 241 Cb -0.08 -1.08 -0.02 0.00 0.51 0.00 0.00 43.02 42.35 1xh3 s PHE 241 CO 0.43 0.19 -0.08 -0.65 0.70 0.00 0.00 175.22 175.80 1xh3 s GLN 242 N -3.77 0.52 0.02 0.44 -0.21 0.10 -1.85 119.66 114.91 1xh3 s GLN 242 Ca 0.30 -0.72 -0.27 0.00 0.02 0.00 0.00 55.36 54.68 1xh3 s GLN 242 Cb 0.05 -0.30 0.07 0.00 1.00 0.00 0.00 33.01 33.82 1xh3 s GLN 242 CO 0.11 0.05 0.62 0.21 -2.12 0.00 0.00 175.29 174.17 1xh3 s LYS 243 N -1.49 1.10 0.05 2.91 2.20 -0.39 -1.46 119.74 122.67 1xh3 s LYS 243 Ca -0.09 -0.03 -0.03 0.00 -0.36 0.00 0.00 55.97 55.46 1xh3 s LYS 243 Cb -0.09 0.51 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 1xh3 s LYS 243 CO 0.00 -0.39 0.04 1.67 -0.36 0.00 0.00 175.35 176.31 1xh3 s TRP 244 N -2.07 0.35 -0.02 4.03 1.48 -1.26 -0.99 118.94 120.46 1xh3 s TRP 244 Ca -0.07 -0.80 0.02 0.00 -1.06 0.00 0.00 56.10 54.19 1xh3 s TRP 244 Cb -0.01 -0.25 0.00 0.00 -1.16 0.00 0.00 33.47 32.06 1xh3 s TRP 244 CO 0.02 -0.40 -0.08 0.00 -4.06 0.00 0.00 176.95 172.44 1xh3 s ALA 245 N -3.43 0.74 0.09 2.67 0.00 -0.48 -2.29 121.76 119.07 1xh3 s ALA 245 Ca 0.02 -0.28 0.05 0.00 0.00 0.00 0.00 51.96 51.75 1xh3 s ALA 245 Cb 0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1xh3 s ALA 245 CO -0.08 0.12 -0.14 0.00 0.00 0.00 0.00 175.76 175.66 1xh3 s ALA 246 N 0.17 1.27 -0.01 0.00 0.00 0.41 -0.17 121.76 123.44 1xh3 s ALA 246 Ca -0.02 -1.12 -0.03 0.00 0.00 0.00 0.00 51.96 50.79 1xh3 s ALA 246 Cb -0.07 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.97 1xh3 s ALA 246 CO 0.00 0.13 0.06 0.54 0.00 0.00 0.00 175.76 176.49 1xh3 s VAL 247 N -1.67 0.05 -0.22 0.00 0.11 -0.52 -0.48 120.40 117.66 1xh3 s VAL 247 Ca 0.02 -0.44 -0.11 0.00 -2.93 0.00 0.00 61.98 58.52 1xh3 s VAL 247 Cb -0.08 -0.24 -0.05 0.00 -1.53 0.00 0.00 36.38 34.48 1xh3 s VAL 247 CO 0.02 -0.24 0.20 -0.69 -3.33 0.00 0.00 175.10 171.06 1xh3 s VAL 248 N -0.75 5.34 0.18 2.04 1.01 -1.26 -0.93 120.40 126.02 1xh3 s VAL 248 Ca -0.08 0.28 0.09 0.00 0.00 0.00 0.00 61.98 62.27 1xh3 s VAL 248 Cb -0.05 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 1xh3 s VAL 248 CO 0.00 0.35 -0.19 0.68 0.00 0.00 0.00 175.10 175.93 1xh3 s VAL 249 N 0.96 1.95 0.22 2.92 -7.23 0.13 -4.94 120.40 114.41 1xh3 s VAL 249 Ca 0.10 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 1xh3 s VAL 249 Cb -0.13 -1.92 -0.10 0.00 0.56 0.00 0.00 36.38 34.79 1xh3 s VAL 249 CO 0.04 -0.28 1.45 -2.84 -0.31 0.00 0.00 175.10 173.16 1xh3 s PRO 250 N -2.81 4.27 0.32 4.82 0.02 -1.26 -1.48 135.00 138.89 1xh3 s PRO 250 Ca 0.17 2.27 -0.29 0.00 0.02 0.00 0.00 61.00 63.17 1xh3 s PRO 250 Cb -0.06 -3.14 -0.12 0.00 0.02 0.00 0.00 34.50 31.21 1xh3 s PRO 250 CO 0.08 -0.44 1.53 0.43 -0.33 0.00 0.00 177.00 178.27 1xh3 n SER 251 N 2.81 3.72 0.00 2.53 7.64 0.20 -1.11 113.62 129.41 1xh3 n SER 251 Ca 0.08 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.14 1xh3 n SER 251 Cb 0.40 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.01 1xh3 n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xh3 n GLY 252 N 1.51 1.47 0.77 0.23 0.00 -1.26 -4.88 105.19 103.02 1xh3 n GLY 252 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 1xh3 n GLY 252 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xh3 n GLU 253 N -2.00 2.41 -0.17 1.61 1.02 -0.27 -4.73 120.64 118.52 1xh3 n GLU 253 Ca 0.00 -2.01 0.17 0.00 -0.02 0.00 0.00 57.16 55.30 1xh3 n GLU 253 Cb 0.00 -1.33 0.53 0.00 -0.02 0.00 0.00 31.44 30.62 1xh3 n GLU 253 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1xh3 h GLU 254 N 2.66 0.35 0.00 3.49 3.07 -1.90 -1.08 114.58 121.16 1xh3 h GLU 254 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1xh3 h GLU 254 Cb 0.75 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 1xh3 h GLU 254 CO 0.00 0.23 0.00 1.04 -1.40 0.00 0.00 179.01 178.88 1xh3 n GLN 255 N -4.47 0.23 0.00 2.33 1.13 -1.26 -2.22 117.38 113.13 1xh3 n GLN 255 Ca 0.15 0.07 0.15 0.00 -1.94 0.00 0.00 57.00 55.43 1xh3 n GLN 255 Cb 0.60 -1.50 0.71 0.00 0.11 0.00 0.00 30.24 30.16 1xh3 n GLN 255 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1xh3 n ARG 256 N -1.35 0.28 -4.32 -1.09 1.74 -0.41 -4.82 116.66 106.69 1xh3 n ARG 256 Ca 0.10 -0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.83 1xh3 n ARG 256 Cb 0.22 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.05 1xh3 n ARG 256 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1xh3 s TYR 257 N -2.72 3.13 -0.02 -1.55 1.51 -0.94 -1.00 117.35 115.75 1xh3 s TYR 257 Ca 0.23 0.01 0.04 0.00 -1.01 0.00 0.00 57.07 56.34 1xh3 s TYR 257 Cb 0.20 -1.89 -0.00 0.00 -0.11 0.00 0.00 41.96 40.15 1xh3 s TYR 257 CO 0.49 0.24 -0.12 0.95 -1.11 0.00 0.00 175.55 176.00 1xh3 s THR 258 N -0.25 1.03 -0.12 -0.71 -4.23 -0.26 -4.69 115.64 106.40 1xh3 s THR 258 Ca 0.06 -0.52 -0.12 0.00 -1.18 0.00 0.00 61.69 59.93 1xh3 s THR 258 Cb -0.12 -0.88 -0.05 0.00 1.34 0.00 0.00 72.50 72.79 1xh3 s THR 258 CO 0.02 0.30 0.25 0.00 -0.54 0.00 0.00 174.62 174.66 1xh3 s HIS 260 N -0.22 2.34 -0.10 0.00 3.76 0.22 -0.52 115.29 120.76 1xh3 s HIS 260 Ca 0.16 -0.90 0.02 0.00 -0.15 0.00 0.00 55.06 54.19 1xh3 s HIS 260 Cb -0.13 -1.57 0.01 0.00 1.11 0.00 0.00 32.58 32.00 1xh3 s HIS 260 CO 0.05 -0.36 -0.16 0.08 -0.85 0.00 0.00 174.74 173.50 1xh3 s VAL 261 N 0.31 1.51 -0.08 -0.90 1.01 -0.15 -1.77 120.40 120.33 1xh3 s VAL 261 Ca -0.16 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1xh3 s VAL 261 Cb -0.17 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 1xh3 s VAL 261 CO 0.07 0.44 -0.21 -1.10 0.00 0.00 0.00 175.10 174.31 1xh3 s GLN 262 N 0.88 2.78 -0.14 2.72 -0.21 0.00 -1.46 119.66 124.23 1xh3 s GLN 262 Ca -0.09 -0.82 -0.28 0.00 0.02 0.00 0.00 55.36 54.19 1xh3 s GLN 262 Cb -0.15 -2.32 0.07 0.00 1.00 0.00 0.00 33.01 31.61 1xh3 s GLN 262 CO 0.00 0.36 0.69 -1.58 -2.12 0.00 0.00 175.29 172.64 1xh3 s HIS 263 N -0.09 -0.70 0.42 0.91 2.46 -1.26 -1.59 115.29 115.43 1xh3 s HIS 263 Ca -0.05 1.44 0.14 0.00 0.47 0.00 0.00 55.06 57.06 1xh3 s HIS 263 Cb -0.14 0.35 1.00 0.00 -0.13 0.00 0.00 32.58 33.66 1xh3 s HIS 263 CO 0.04 -0.51 1.92 1.49 -2.47 0.00 0.00 174.74 175.21 1xh3 h GLU 264 N 3.82 0.45 0.00 2.88 4.81 -1.94 -1.41 114.58 123.19 1xh3 h GLU 264 Ca -0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1xh3 h GLU 264 Cb 1.15 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1xh3 h GLU 264 CO 0.25 0.30 0.00 0.41 -0.73 0.00 0.00 179.01 179.24 1xh3 n GLY 265 N -1.51 -0.94 3.52 1.92 0.00 -1.26 -4.69 105.19 102.24 1xh3 n GLY 265 Ca 0.14 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1xh3 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xh3 s LEU 266 N -2.66 3.73 0.13 0.99 1.43 -0.53 -4.41 118.68 117.36 1xh3 s LEU 266 Ca 0.16 -0.10 -0.17 0.00 -1.03 0.00 0.00 54.13 52.99 1xh3 s LEU 266 Cb 0.12 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 1xh3 s LEU 266 CO 0.29 -0.03 1.71 1.55 0.23 0.00 0.00 176.35 180.10 1xh3 h PRO 267 N 8.20 0.52 -5.79 1.29 0.13 -1.85 -3.42 132.00 131.08 1xh3 h PRO 267 Ca -0.37 -0.08 -0.68 0.00 -0.87 0.00 0.00 66.00 64.01 1xh3 h PRO 267 Cb 1.18 -0.09 -0.29 0.00 0.13 0.00 0.00 31.00 31.92 1xh3 h PRO 267 CO 0.57 0.46 -0.84 -1.59 -0.23 0.00 0.00 178.00 176.38 1xh3 s LYS 268 N -5.72 2.82 0.63 0.86 0.00 -1.26 -5.12 119.74 111.95 1xh3 s LYS 268 Ca -0.13 -0.82 -0.18 0.00 0.00 0.00 0.00 55.97 54.84 1xh3 s LYS 268 Cb 0.10 -2.33 -0.03 0.00 0.00 0.00 0.00 37.83 35.57 1xh3 s LYS 268 CO 0.74 0.35 1.11 -2.30 0.00 0.00 0.00 175.35 175.24 1xh3 n PRO 269 N 3.08 0.97 -3.98 1.78 -0.02 -1.26 -4.99 135.00 130.57 1xh3 n PRO 269 Ca -0.18 0.38 -0.34 0.00 -2.02 0.00 0.00 63.50 61.35 1xh3 n PRO 269 Cb 0.52 -2.33 -0.06 0.00 -0.02 0.00 0.00 33.50 31.61 1xh3 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1xh3 s LEU 270 N -3.09 4.18 -0.14 2.45 1.43 -0.54 -4.93 118.68 118.05 1xh3 s LEU 270 Ca 0.79 0.28 0.01 0.00 -1.03 0.00 0.00 54.13 54.19 1xh3 s LEU 270 Cb -0.40 -2.40 -0.00 0.00 0.03 0.00 0.00 46.19 43.42 1xh3 s LEU 270 CO 0.44 0.29 -0.18 -0.89 0.23 0.00 0.00 176.35 176.23 1xh3 s THR 271 N -1.23 2.47 0.15 5.49 2.01 -1.26 -0.98 115.64 122.29 1xh3 s THR 271 Ca 0.24 -0.85 0.08 0.00 0.31 0.00 0.00 61.69 61.47 1xh3 s THR 271 Cb -0.12 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.33 1xh3 s THR 271 CO 0.15 0.53 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.68 1xh3 s LEU 272 N 0.67 2.43 0.19 4.42 1.02 0.32 -4.97 118.68 122.76 1xh3 s LEU 272 Ca -0.09 -0.84 0.03 0.00 0.02 0.00 0.00 54.13 53.25 1xh3 s LEU 272 Cb -0.16 -0.76 -0.05 0.00 0.02 0.00 0.00 46.19 45.24 1xh3 s LEU 272 CO 0.02 -0.06 -0.01 -0.13 0.02 0.00 0.00 176.35 176.19 1xh3 s ARG 273 N -2.74 1.20 0.18 1.70 0.52 -1.26 -0.89 118.95 117.66 1xh3 s ARG 273 Ca 0.14 -1.58 -0.31 0.00 -0.52 0.00 0.00 55.73 53.45 1xh3 s ARG 273 Cb -0.06 -0.47 -0.10 0.00 0.52 0.00 0.00 34.95 34.85 1xh3 s ARG 273 CO 0.06 -0.09 1.54 -0.46 0.02 0.00 0.00 175.30 176.37 1xh3 s TRP 274 N -3.51 3.05 -0.46 -0.53 -0.00 -1.26 -4.66 118.94 111.57 1xh3 s TRP 274 Ca 0.25 0.71 -0.01 0.00 -0.00 0.00 0.00 56.10 57.05 1xh3 s TRP 274 Cb 0.05 -3.90 0.12 0.00 -0.00 0.00 0.00 33.47 29.74 1xh3 s TRP 274 CO 0.06 -3.26 0.24 -1.21 -0.00 0.00 0.00 176.95 172.78 1xh3 s GLU 275 N 0.83 2.06 0.00 5.86 0.41 -1.26 -4.96 118.70 121.64 1xh3 s GLU 275 Ca 0.68 -2.05 0.31 0.00 -0.41 0.00 0.00 54.97 53.50 1xh3 s GLU 275 Cb -0.43 -3.55 1.65 0.00 -1.78 0.00 0.00 34.13 30.02 1xh3 s GLU 275 CO 0.34 -1.08 2.09 -0.35 -0.49 0.00 0.00 175.26 175.76