#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xdh n SER 2 N 0.00 0.00 -4.92 6.43 2.88 -1.26 -5.14 113.62 111.61 1xdh n SER 2 Ca 0.00 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.27 1xdh n SER 2 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1xdh n SER 2 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1xdh s ASN 3 N 0.00 6.35 -0.01 -3.46 0.01 -1.26 -5.06 114.94 111.51 1xdh s ASN 3 Ca 0.00 0.67 -0.18 0.00 -0.71 0.00 0.00 52.86 52.64 1xdh s ASN 3 Cb 0.00 -2.13 -0.05 0.00 0.41 0.00 0.00 41.25 39.48 1xdh s ASN 3 CO 0.00 -0.32 0.50 -0.62 -1.51 0.00 0.00 177.10 175.15 1xdh s ASP 4 N -3.69 6.88 -0.10 -1.22 3.68 -1.18 -4.95 116.67 116.09 1xdh s ASP 4 Ca 0.43 1.04 0.03 0.00 2.13 0.00 0.00 52.55 56.18 1xdh s ASP 4 Cb -0.10 -2.31 0.01 0.00 -1.45 0.00 0.00 42.92 39.07 1xdh s ASP 4 CO 0.35 0.19 -0.18 0.20 0.13 0.00 0.00 175.17 175.86 1xdh s ASN 5 N -0.48 2.57 -0.26 -0.34 0.01 -1.26 -1.01 114.94 114.17 1xdh s ASN 5 Ca 0.27 -0.46 -0.15 0.00 -0.71 0.00 0.00 52.86 51.81 1xdh s ASN 5 Cb -0.17 -1.17 -0.04 0.00 0.41 0.00 0.00 41.25 40.28 1xdh s ASN 5 CO 0.15 0.07 0.40 -0.63 -1.51 0.00 0.00 177.10 175.58 1xdh s ILE 6 N 0.69 5.16 0.36 0.60 1.01 0.27 -4.71 121.20 124.59 1xdh s ILE 6 Ca -0.12 0.64 -0.27 0.00 0.00 0.00 0.00 60.65 60.90 1xdh s ILE 6 Cb -0.16 -3.72 -0.09 0.00 0.01 0.00 0.00 42.46 38.50 1xdh s ILE 6 CO 0.03 0.16 1.18 -0.70 0.00 0.00 0.00 174.94 175.61 1xdh s GLU 7 N 1.98 4.23 -0.06 2.79 2.12 -1.26 -0.98 118.70 127.51 1xdh s GLU 7 Ca 0.17 1.90 0.05 0.00 0.36 0.00 0.00 54.97 57.45 1xdh s GLU 7 Cb -0.16 -2.85 -0.02 0.00 0.26 0.00 0.00 34.13 31.37 1xdh s GLU 7 CO 0.09 -0.19 -0.21 -0.51 -0.54 0.00 0.00 175.26 173.91 1xdh s LEU 8 N -2.15 2.33 -0.02 2.70 1.43 0.04 -4.32 118.68 118.68 1xdh s LEU 8 Ca 0.53 -0.40 0.08 0.00 -1.03 0.00 0.00 54.13 53.31 1xdh s LEU 8 Cb -0.33 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 1xdh s LEU 8 CO 0.42 0.27 -0.26 -0.69 0.23 0.00 0.00 176.35 176.32 1xdh s VAL 9 N -0.30 2.07 0.52 -1.59 1.01 -0.59 -1.80 120.40 119.71 1xdh s VAL 9 Ca 0.01 -1.11 -0.21 0.00 0.00 0.00 0.00 61.98 60.67 1xdh s VAL 9 Cb -0.13 -1.71 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 1xdh s VAL 9 CO 0.03 0.58 1.16 1.51 0.00 0.00 0.00 175.10 178.37 1xdh s ASP 10 N -0.63 5.83 -0.24 3.32 -4.77 -1.26 -0.92 116.67 117.99 1xdh s ASP 10 Ca 0.10 2.26 -0.01 0.00 -3.30 0.00 0.00 52.55 51.60 1xdh s ASP 10 Cb -0.10 -2.59 0.03 0.00 -1.09 0.00 0.00 42.92 39.17 1xdh s ASP 10 CO -0.01 -1.15 -0.08 0.12 0.70 0.00 0.00 175.17 174.76 1xdh s PHE 11 N -1.66 3.06 -1.58 2.11 5.36 0.51 -4.76 117.98 121.02 1xdh s PHE 11 Ca 0.70 -1.65 -0.15 0.00 -0.96 0.00 0.00 56.93 54.87 1xdh s PHE 11 Cb -0.27 -2.03 0.11 0.00 -0.34 0.00 0.00 43.02 40.49 1xdh s PHE 11 CO 0.31 -0.75 0.92 1.04 -1.46 0.00 0.00 175.22 175.27 1xdh n GLN 12 N 4.64 -4.78 -0.42 10.12 6.02 -1.26 -2.29 117.38 129.40 1xdh n GLN 12 Ca -0.17 0.53 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 1xdh n GLN 12 Cb 0.47 -5.36 0.00 0.00 1.02 0.00 0.00 30.24 26.37 1xdh n GLN 12 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1xdh n ASN 13 N -2.78 0.00 0.00 1.08 5.15 -1.26 -4.64 115.26 112.81 1xdh n ASN 13 Ca 0.04 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 1xdh n ASN 13 Cb 0.52 -1.27 0.00 0.00 -0.53 0.00 0.00 39.78 38.50 1xdh n ASN 13 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1xdh n ILE 14 N -2.00 0.00 -2.65 -1.44 5.41 -1.05 -4.90 119.36 112.73 1xdh n ILE 14 Ca 0.00 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.52 1xdh n ILE 14 Cb 0.00 -0.72 0.12 0.00 -0.71 0.00 0.00 39.64 38.33 1xdh n ILE 14 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1xdh s MET 15 N -1.82 1.58 0.01 0.38 -1.94 -0.97 -4.80 119.30 111.74 1xdh s MET 15 Ca 0.00 -1.27 -0.15 0.00 -1.71 0.00 0.00 55.69 52.56 1xdh s MET 15 Cb 0.00 -2.35 0.02 0.00 2.01 0.00 0.00 34.83 34.52 1xdh s MET 15 CO 0.00 -1.52 0.32 -0.59 -0.01 0.00 0.00 175.02 173.22 1xdh s PHE 16 N -3.15 -0.16 0.21 -0.03 -0.12 -1.26 -0.37 117.98 113.10 1xdh s PHE 16 Ca 0.68 0.15 0.09 0.00 -0.05 0.00 0.00 56.93 57.79 1xdh s PHE 16 Cb -0.04 0.11 -0.05 0.00 -0.63 0.00 0.00 43.02 42.41 1xdh s PHE 16 CO 0.45 -0.45 -0.16 0.71 -0.05 0.00 0.00 175.22 175.71 1xdh s TYR 17 N -1.92 1.82 0.05 3.49 2.02 -0.10 -4.56 117.35 118.15 1xdh s TYR 17 Ca -0.09 -0.51 -0.03 0.00 -0.37 0.00 0.00 57.07 56.07 1xdh s TYR 17 Cb -0.03 -0.85 -0.03 0.00 -0.40 0.00 0.00 41.96 40.66 1xdh s TYR 17 CO 0.01 0.41 0.02 0.20 -1.57 0.00 0.00 175.55 174.62 1xdh s GLY 18 N -3.20 0.34 -0.02 0.71 0.00 -0.54 -1.55 107.32 103.06 1xdh s GLY 18 Ca 0.22 -0.96 -0.02 0.00 0.00 0.00 0.00 44.72 43.97 1xdh s GLY 18 CO 0.08 -1.08 0.12 0.99 0.00 0.00 0.00 173.10 173.21 1xdh s ASP 19 N -2.65 5.97 0.31 1.64 1.11 -1.26 -0.20 116.67 121.60 1xdh s ASP 19 Ca 0.03 0.25 -0.01 0.00 0.18 0.00 0.00 52.55 52.99 1xdh s ASP 19 Cb 0.04 -1.80 -0.01 0.00 1.07 0.00 0.00 42.92 42.23 1xdh s ASP 19 CO -0.08 0.28 0.39 0.00 1.18 0.00 0.00 175.17 176.94 1xdh s ALA 20 N -1.22 0.95 0.10 5.23 0.00 -0.79 -4.69 121.76 121.34 1xdh s ALA 20 Ca 0.23 -1.60 0.06 0.00 0.00 0.00 0.00 51.96 50.65 1xdh s ALA 20 Cb -0.12 1.24 -0.03 0.00 0.00 0.00 0.00 23.12 24.21 1xdh s ALA 20 CO 0.14 -0.75 -0.14 -1.83 0.00 0.00 0.00 175.76 173.19 1xdh s GLU 21 N -3.36 0.93 0.00 0.00 1.03 -0.38 -1.04 118.70 115.88 1xdh s GLU 21 Ca 0.33 -1.11 0.04 0.00 0.03 0.00 0.00 54.97 54.26 1xdh s GLU 21 Cb 0.01 -0.87 -0.01 0.00 -0.80 0.00 0.00 34.13 32.45 1xdh s GLU 21 CO 0.20 0.18 -0.12 0.08 -1.33 0.00 0.00 175.26 174.26 1xdh s VAL 22 N -1.73 0.97 0.00 1.83 1.01 -0.28 -0.66 120.40 121.54 1xdh s VAL 22 Ca 0.04 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1xdh s VAL 22 Cb -0.07 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.48 1xdh s VAL 22 CO 0.03 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1xdh n GLY 23 N 2.60 1.11 0.18 4.51 0.00 0.36 -1.70 105.19 112.24 1xdh n GLY 23 Ca -0.15 -1.68 0.14 0.00 0.00 0.00 0.00 46.02 44.33 1xdh n GLY 23 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1xdh h ASP 24 N 0.00 0.00 -0.31 1.61 2.03 -1.91 -1.65 116.42 116.20 1xdh h ASP 24 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1xdh h ASP 24 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1xdh h ASP 24 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 179.24 177.75 1xdh n ASN 25 N -2.53 1.73 -3.50 4.15 6.94 -1.26 -4.97 115.26 115.82 1xdh n ASN 25 Ca 0.01 -2.02 -0.18 0.00 -0.02 0.00 0.00 54.58 52.37 1xdh n ASN 25 Cb 0.24 -0.23 0.08 0.00 -2.36 0.00 0.00 39.78 37.51 1xdh n ASN 25 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xdh n GLN 26 N 0.40 -6.24 -1.99 -3.83 1.13 -0.62 -4.90 117.38 101.33 1xdh n GLN 26 Ca 0.10 0.80 -0.42 0.00 -1.94 0.00 0.00 57.00 55.54 1xdh n GLN 26 Cb 0.28 -5.71 -0.03 0.00 0.11 0.00 0.00 30.24 24.90 1xdh n GLN 26 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1xdh s GLN 27 N -5.51 4.07 0.23 -1.09 -0.21 -0.69 -4.76 119.66 111.69 1xdh s GLN 27 Ca 0.01 2.12 -0.20 0.00 0.02 0.00 0.00 55.36 57.31 1xdh s GLN 27 Cb -0.00 -4.02 -0.08 0.00 1.00 0.00 0.00 33.01 29.90 1xdh s GLN 27 CO 0.75 -0.98 0.73 -1.25 -2.12 0.00 0.00 175.29 172.42 1xdh s PRO 28 N 4.27 4.25 0.01 2.91 0.04 -1.26 -1.13 135.00 144.09 1xdh s PRO 28 Ca 0.75 0.87 -0.03 0.00 0.04 0.00 0.00 61.00 62.63 1xdh s PRO 28 Cb -0.33 -2.86 -0.01 0.00 0.04 0.00 0.00 34.50 31.34 1xdh s PRO 28 CO 0.31 0.38 0.05 -0.06 0.04 0.00 0.00 177.00 177.72 1xdh s PHE 29 N -1.54 0.12 -0.16 0.56 0.40 -0.21 -4.85 117.98 112.30 1xdh s PHE 29 Ca 0.44 -0.26 -0.15 0.00 -0.60 0.00 0.00 56.93 56.35 1xdh s PHE 29 Cb -0.16 -0.10 -0.04 0.00 0.51 0.00 0.00 43.02 43.22 1xdh s PHE 29 CO 0.21 -0.20 0.37 0.99 0.70 0.00 0.00 175.22 177.28 1xdh s THR 30 N -1.18 5.25 0.03 0.64 2.01 -1.26 -1.89 115.64 119.24 1xdh s THR 30 Ca -0.13 0.68 0.07 0.00 0.31 0.00 0.00 61.69 62.63 1xdh s THR 30 Cb -0.08 -3.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.71 1xdh s THR 30 CO 0.00 0.33 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.69 1xdh s PHE 31 N 0.77 1.90 -0.13 4.92 0.40 0.72 0.13 117.98 126.70 1xdh s PHE 31 Ca 0.19 -0.38 -0.29 0.00 -0.60 0.00 0.00 56.93 55.85 1xdh s PHE 31 Cb -0.14 -1.15 -0.02 0.00 0.51 0.00 0.00 43.02 42.22 1xdh s PHE 31 CO 0.07 0.07 1.21 0.42 0.70 0.00 0.00 175.22 177.69 1xdh s ILE 32 N -0.74 4.33 -0.39 0.64 1.01 -0.81 -1.47 121.20 123.78 1xdh s ILE 32 Ca 0.08 1.62 -0.18 0.00 0.00 0.00 0.00 60.65 62.18 1xdh s ILE 32 Cb -0.09 -4.05 0.01 0.00 0.01 0.00 0.00 42.46 38.34 1xdh s ILE 32 CO 0.01 -0.08 0.49 -0.76 0.00 0.00 0.00 174.94 174.60 1xdh s LEU 33 N 2.92 4.54 -0.37 2.97 1.43 -1.26 -0.99 118.68 127.92 1xdh s LEU 33 Ca 0.54 -0.31 0.03 0.00 -1.03 0.00 0.00 54.13 53.36 1xdh s LEU 33 Cb -0.22 -2.51 0.11 0.00 0.03 0.00 0.00 46.19 43.59 1xdh s LEU 33 CO 0.17 -0.54 0.11 -0.62 0.23 0.00 0.00 176.35 175.69 1xdh s ASP 34 N 1.81 4.46 0.23 2.29 2.15 -0.08 -4.21 116.67 123.32 1xdh s ASP 34 Ca 0.16 -2.23 0.19 0.00 0.43 0.00 0.00 52.55 51.10 1xdh s ASP 34 Cb -0.16 -1.43 0.91 0.00 -0.30 0.00 0.00 42.92 41.94 1xdh s ASP 34 CO 0.14 -0.35 1.58 0.35 -0.17 0.00 0.00 175.17 176.71 1xdh n THR 35 N 4.13 1.09 0.69 1.71 -2.24 -1.26 -0.51 114.28 117.89 1xdh n THR 35 Ca 0.03 0.49 0.08 0.00 -2.27 0.00 0.00 64.05 62.38 1xdh n THR 35 Cb 0.40 -1.45 0.23 0.00 -2.10 0.00 0.00 70.33 67.41 1xdh n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xdh n GLY 36 N -0.77 0.97 3.39 3.38 0.00 -1.26 -3.91 105.19 106.99 1xdh n GLY 36 Ca 0.00 -0.49 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 1xdh n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xdh s SER 37 N -1.14 1.17 0.00 1.61 1.04 -1.01 -5.00 113.70 110.38 1xdh s SER 37 Ca 0.31 -1.59 0.13 0.00 0.48 0.00 0.00 55.95 55.28 1xdh s SER 37 Cb 0.16 0.60 0.21 0.00 0.10 0.00 0.00 66.02 67.09 1xdh s SER 37 CO 0.22 -1.17 1.04 0.00 0.98 0.00 0.00 173.24 174.31 1xdh n ALA 38 N -0.57 2.46 -2.59 5.32 0.00 -1.26 -0.37 120.51 123.51 1xdh n ALA 38 Ca 0.04 -1.52 -0.22 0.00 0.00 0.00 0.00 53.44 51.74 1xdh n ALA 38 Cb 0.62 -0.55 -0.13 0.00 0.00 0.00 0.00 19.45 19.39 1xdh n ALA 38 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1xdh s ASN 39 N -1.40 2.06 -0.17 0.00 -0.87 -1.26 -4.49 114.94 108.81 1xdh s ASN 39 Ca 0.17 -0.54 -0.07 0.00 -1.57 0.00 0.00 52.86 50.85 1xdh s ASN 39 Cb 0.19 -0.13 -0.04 0.00 -0.02 0.00 0.00 41.25 41.24 1xdh s ASN 39 CO -0.08 0.06 0.07 -0.22 -2.57 0.00 0.00 177.10 174.36 1xdh s LEU 40 N -1.36 3.91 0.01 0.60 2.96 -1.26 -1.45 118.68 122.10 1xdh s LEU 40 Ca 0.04 0.15 -0.04 0.00 -0.22 0.00 0.00 54.13 54.06 1xdh s LEU 40 Cb -0.09 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 1xdh s LEU 40 CO 0.02 0.22 0.06 -1.66 -1.32 0.00 0.00 176.35 173.67 1xdh s TRP 41 N 0.09 0.15 0.03 5.38 1.48 -0.43 -0.82 118.94 124.82 1xdh s TRP 41 Ca 0.06 -0.33 0.02 0.00 -1.06 0.00 0.00 56.10 54.79 1xdh s TRP 41 Cb -0.12 -0.12 -0.02 0.00 -1.16 0.00 0.00 33.47 32.05 1xdh s TRP 41 CO 0.00 -0.25 -0.06 0.14 -4.06 0.00 0.00 176.95 172.72 1xdh s VAL 42 N -1.47 0.44 0.26 -0.66 -7.23 -0.73 -2.68 120.40 108.34 1xdh s VAL 42 Ca -0.15 -0.88 -0.29 0.00 -1.81 0.00 0.00 61.98 58.84 1xdh s VAL 42 Cb -0.08 -0.50 -0.09 0.00 0.56 0.00 0.00 36.38 36.26 1xdh s VAL 42 CO 0.00 -0.30 1.16 -2.16 -0.31 0.00 0.00 175.10 173.49 1xdh s PRO 43 N -1.28 4.55 0.32 4.82 0.04 -1.26 -0.97 135.00 141.23 1xdh s PRO 43 Ca -0.09 1.90 -0.06 0.00 0.04 0.00 0.00 61.00 62.79 1xdh s PRO 43 Cb -0.08 -3.18 -0.05 0.00 0.04 0.00 0.00 34.50 31.22 1xdh s PRO 43 CO 0.00 0.06 0.60 0.45 0.04 0.00 0.00 177.00 178.15 1xdh s SER 44 N -0.52 6.44 0.62 6.66 0.15 0.20 -0.86 113.70 126.39 1xdh s SER 44 Ca 0.48 0.79 0.34 0.00 0.70 0.00 0.00 55.95 58.26 1xdh s SER 44 Cb -0.33 -2.17 1.98 0.00 -1.71 0.00 0.00 66.02 63.78 1xdh s SER 44 CO 0.42 -0.25 2.25 -0.37 1.20 0.00 0.00 173.24 176.48 1xdh h VAL 45 N 1.23 0.32 0.00 4.45 -1.51 -1.38 -0.25 116.25 119.11 1xdh h VAL 45 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1xdh h VAL 45 Cb 1.19 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 1xdh h VAL 45 CO 0.65 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 177.28 1xdh n LYS 46 N -3.55 0.70 -2.02 5.19 5.02 -1.26 -4.86 118.16 117.38 1xdh n LYS 46 Ca -0.02 0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.87 1xdh n LYS 46 Cb 0.14 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.63 1xdh n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xdh n THR 48 N 1.40 0.00 -3.41 0.00 -2.24 -1.08 -5.02 114.28 103.94 1xdh n THR 48 Ca 0.03 -0.37 -0.28 0.00 -2.27 0.00 0.00 64.05 61.16 1xdh n THR 48 Cb 0.41 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.64 1xdh n THR 48 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xdh s THR 49 N -1.46 5.07 0.39 4.28 -4.23 -1.26 -4.99 115.64 113.44 1xdh s THR 49 Ca 0.04 -0.08 0.08 0.00 -1.18 0.00 0.00 61.69 60.54 1xdh s THR 49 Cb 0.06 -3.75 0.20 0.00 1.34 0.00 0.00 72.50 70.35 1xdh s THR 49 CO 0.25 -0.32 1.97 0.00 -0.54 0.00 0.00 174.62 175.98 1xdh h ALA 50 N 1.63 1.57 0.00 3.99 0.00 -1.97 -1.86 119.26 122.63 1xdh h ALA 50 Ca -0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1xdh h ALA 50 Cb 1.19 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1xdh h ALA 50 CO 0.66 0.32 -0.03 0.78 0.00 0.00 0.00 179.25 180.98 1xdh h GLY 51 N 0.65 0.00 2.00 0.00 0.00 -1.94 -1.81 103.07 101.97 1xdh h GLY 51 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1xdh h GLY 51 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1xdh h LEU 53 N 0.00 0.34 -1.62 0.00 6.46 -1.49 -1.95 115.31 117.05 1xdh h LEU 53 Ca 0.00 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 1xdh h LEU 53 Cb 0.36 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.30 1xdh h LEU 53 CO 0.00 0.21 0.00 0.35 -0.62 0.00 0.00 178.44 178.38 1xdh n THR 54 N -4.93 0.58 -4.01 1.05 -2.24 -1.26 -4.97 114.28 98.51 1xdh n THR 54 Ca 0.08 -0.59 -0.25 0.00 -2.27 0.00 0.00 64.05 61.02 1xdh n THR 54 Cb 0.24 0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.73 1xdh n THR 54 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1xdh s LYS 55 N -1.42 3.20 0.33 -0.78 -0.14 -0.74 -5.08 119.74 115.12 1xdh s LYS 55 Ca 0.30 -0.75 -0.28 0.00 -1.36 0.00 0.00 55.97 53.88 1xdh s LYS 55 Cb 0.15 -2.81 -0.10 0.00 -1.68 0.00 0.00 37.83 33.40 1xdh s LYS 55 CO 0.20 0.49 1.22 -1.01 -0.76 0.00 0.00 175.35 175.49 1xdh s HIS 56 N -1.79 3.21 -0.01 3.18 3.76 -1.26 -5.04 115.29 117.33 1xdh s HIS 56 Ca 0.33 1.52 0.06 0.00 -0.15 0.00 0.00 55.06 56.82 1xdh s HIS 56 Cb -0.10 -3.52 -0.01 0.00 1.11 0.00 0.00 32.58 30.06 1xdh s HIS 56 CO 0.26 -1.38 -0.18 -0.51 -0.85 0.00 0.00 174.74 172.08 1xdh s LEU 57 N -1.81 2.05 -0.12 0.89 1.43 -1.26 -4.50 118.68 115.36 1xdh s LEU 57 Ca 0.49 -0.34 -0.21 0.00 -1.03 0.00 0.00 54.13 53.04 1xdh s LEU 57 Cb -0.36 -0.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.90 1xdh s LEU 57 CO 0.47 0.21 0.60 -0.47 0.23 0.00 0.00 176.35 177.40 1xdh s TYR 58 N -0.46 3.50 -0.33 0.29 5.04 -0.04 -4.69 117.35 120.66 1xdh s TYR 58 Ca 0.07 1.04 0.02 0.00 -2.44 0.00 0.00 57.07 55.76 1xdh s TYR 58 Cb -0.07 -2.71 0.09 0.00 0.35 0.00 0.00 41.96 39.61 1xdh s TYR 58 CO -0.00 0.05 0.04 0.34 -1.34 0.00 0.00 175.55 174.64 1xdh s ASP 59 N 0.84 4.82 0.50 4.32 -1.08 -1.26 -1.09 116.67 123.72 1xdh s ASP 59 Ca 0.31 -1.90 0.24 0.00 -0.52 0.00 0.00 52.55 50.68 1xdh s ASP 59 Cb -0.16 -1.66 1.33 0.00 -1.46 0.00 0.00 42.92 40.96 1xdh s ASP 59 CO 0.13 -0.36 2.05 0.77 0.52 0.00 0.00 175.17 178.28 1xdh h SER 60 N 7.77 0.00 0.52 -0.34 4.64 -1.96 -2.48 113.55 121.70 1xdh h SER 60 Ca -0.10 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.19 1xdh h SER 60 Cb 1.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1xdh h SER 60 CO 0.54 0.14 -0.14 0.77 -0.87 0.00 0.00 176.83 177.28 1xdh h SER 61 N 0.00 0.00 -0.01 4.97 4.64 -2.01 -2.80 113.55 118.34 1xdh h SER 61 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xdh h SER 61 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1xdh h SER 61 CO 0.02 0.14 -0.00 0.29 -0.87 0.00 0.00 176.83 176.40 1xdh n LYS 62 N -3.53 1.53 -4.21 4.77 4.76 -0.93 -4.81 118.16 115.75 1xdh n LYS 62 Ca -0.01 -0.78 -0.32 0.00 -2.87 0.00 0.00 58.31 54.32 1xdh n LYS 62 Cb 0.28 -1.48 -0.16 0.00 -1.84 0.00 0.00 35.03 31.83 1xdh n LYS 62 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1xdh s SER 63 N -2.01 3.01 0.37 4.39 0.15 -1.06 -4.63 113.70 113.93 1xdh s SER 63 Ca 0.40 -0.60 0.12 0.00 0.70 0.00 0.00 55.95 56.57 1xdh s SER 63 Cb 0.21 -1.40 0.70 0.00 -1.71 0.00 0.00 66.02 63.82 1xdh s SER 63 CO 0.34 0.00 1.81 0.03 1.20 0.00 0.00 173.24 176.63 1xdh h ARG 64 N 7.83 0.00 -0.07 5.44 3.08 -1.87 -2.98 114.38 125.82 1xdh h ARG 64 Ca -0.42 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1xdh h ARG 64 Cb 1.15 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 1xdh h ARG 64 CO 0.60 0.39 0.00 0.25 -1.07 0.00 0.00 179.97 180.14 1xdh n THR 65 N -4.08 0.08 -1.77 2.04 -2.24 -1.26 -4.88 114.28 102.17 1xdh n THR 65 Ca -0.02 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1xdh n THR 65 Cb 0.42 0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 1xdh n THR 65 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1xdh s TYR 66 N -1.92 2.79 -0.14 4.78 5.04 -1.13 -4.49 117.35 122.28 1xdh s TYR 66 Ca 0.35 0.70 0.00 0.00 -2.44 0.00 0.00 57.07 55.68 1xdh s TYR 66 Cb 0.18 -4.08 0.02 0.00 0.35 0.00 0.00 41.96 38.43 1xdh s TYR 66 CO 0.29 -3.72 -0.14 -1.21 -1.34 0.00 0.00 175.55 169.43 1xdh s GLU 67 N -0.16 2.24 0.49 4.97 2.02 0.14 -5.01 118.70 123.39 1xdh s GLU 67 Ca 0.65 -0.54 -0.23 0.00 0.02 0.00 0.00 54.97 54.88 1xdh s GLU 67 Cb -0.48 -2.04 -0.06 0.00 0.10 0.00 0.00 34.13 31.64 1xdh s GLU 67 CO 0.45 -0.21 1.25 0.21 0.02 0.00 0.00 175.26 176.98 1xdh s LYS 68 N 1.43 3.53 0.00 1.61 2.20 -1.26 -2.03 119.74 125.22 1xdh s LYS 68 Ca 0.03 1.99 0.00 0.00 -0.36 0.00 0.00 55.97 57.63 1xdh s LYS 68 Cb -0.13 -2.38 0.00 0.00 -1.51 0.00 0.00 37.83 33.81 1xdh s LYS 68 CO -0.09 -0.80 0.00 -3.47 -0.36 0.00 0.00 175.35 170.63 1xdh n ASP 69 N -0.65 0.00 0.00 1.43 -0.08 -1.25 -4.87 116.55 111.13 1xdh n ASP 69 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1xdh n ASP 69 Cb 0.46 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.92 1xdh n ASP 69 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xdh n GLY 70 N 1.76 0.82 3.68 0.27 0.00 -0.26 -4.99 105.19 106.47 1xdh n GLY 70 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1xdh n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xdh s THR 71 N -2.96 2.76 0.55 2.61 2.01 -1.26 -4.64 115.64 114.70 1xdh s THR 71 Ca 0.00 0.12 -0.19 0.00 0.31 0.00 0.00 61.69 61.93 1xdh s THR 71 Cb 0.00 -3.08 -0.05 0.00 0.01 0.00 0.00 72.50 69.38 1xdh s THR 71 CO 0.00 -0.00 1.11 -0.54 -0.69 0.00 0.00 174.62 174.49 1xdh s LYS 72 N 3.21 3.35 -0.27 4.92 1.02 -1.26 -0.91 119.74 129.80 1xdh s LYS 72 Ca 0.82 1.51 -0.25 0.00 0.02 0.00 0.00 55.97 58.07 1xdh s LYS 72 Cb -0.44 -2.01 0.09 0.00 -0.52 0.00 0.00 37.83 34.94 1xdh s LYS 72 CO 0.37 -0.83 0.83 0.54 -0.92 0.00 0.00 175.35 175.33 1xdh s VAL 73 N -1.93 0.00 -0.11 3.17 0.11 -0.60 -4.87 120.40 116.18 1xdh s VAL 73 Ca 0.70 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.76 1xdh s VAL 73 Cb -0.22 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.62 1xdh s VAL 73 CO 0.28 0.00 -0.14 -0.70 -3.33 0.00 0.00 175.10 171.21 1xdh s GLU 74 N 0.30 3.17 -0.23 1.54 2.12 -1.26 -1.30 118.70 123.04 1xdh s GLU 74 Ca 0.01 -0.70 -0.05 0.00 0.36 0.00 0.00 54.97 54.59 1xdh s GLU 74 Cb -0.05 -2.55 -0.01 0.00 0.26 0.00 0.00 34.13 31.78 1xdh s GLU 74 CO -0.01 0.30 -0.00 1.41 -0.54 0.00 0.00 175.26 176.42 1xdh s MET 75 N 0.11 3.45 -0.14 4.30 -2.45 0.15 -5.01 119.30 119.71 1xdh s MET 75 Ca -0.07 -0.59 -0.02 0.00 -1.25 0.00 0.00 55.69 53.76 1xdh s MET 75 Cb -0.15 -3.13 -0.02 0.00 1.25 0.00 0.00 34.83 32.78 1xdh s MET 75 CO 0.05 -0.21 -0.06 -0.80 1.05 0.00 0.00 175.02 175.05 1xdh s ASN 76 N 1.52 4.59 0.33 1.11 0.01 -1.26 -2.00 114.94 119.25 1xdh s ASN 76 Ca 0.06 -0.17 0.08 0.00 -0.71 0.00 0.00 52.86 52.12 1xdh s ASN 76 Cb -0.15 -1.70 -0.06 0.00 0.41 0.00 0.00 41.25 39.75 1xdh s ASN 76 CO -0.01 0.18 -0.07 -0.31 -1.51 0.00 0.00 177.10 175.39 1xdh s TYR 77 N 0.27 2.26 0.26 2.20 2.02 0.89 -5.02 117.35 120.24 1xdh s TYR 77 Ca -0.05 -0.59 -0.02 0.00 -0.37 0.00 0.00 57.07 56.04 1xdh s TYR 77 Cb -0.14 -1.33 0.46 0.00 -0.40 0.00 0.00 41.96 40.55 1xdh s TYR 77 CO 0.04 0.46 1.83 0.28 -1.57 0.00 0.00 175.55 176.59 1xdh h VAL 78 N 2.08 0.95 -0.01 0.71 2.07 -1.99 -2.74 116.25 117.32 1xdh h VAL 78 Ca -0.41 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.78 1xdh h VAL 78 Cb 1.24 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1xdh h VAL 78 CO 0.70 0.17 -0.11 -1.20 0.02 0.00 0.00 177.57 177.16 1xdh n SER 79 N -4.65 1.29 0.00 0.57 7.64 -1.26 -5.02 113.62 112.20 1xdh n SER 79 Ca 0.16 -1.23 0.00 0.00 1.01 0.00 0.00 58.87 58.81 1xdh n SER 79 Cb 0.29 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 1xdh n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xdh n GLY 80 N 1.24 -1.96 2.89 0.23 0.00 -1.03 -4.89 105.19 101.68 1xdh n GLY 80 Ca 0.16 -1.36 -0.14 0.00 0.00 0.00 0.00 46.02 44.68 1xdh n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xdh s THR 81 N -2.30 0.15 0.13 2.61 2.01 -0.41 -0.07 115.64 117.77 1xdh s THR 81 Ca 0.00 -0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.00 1xdh s THR 81 Cb 0.00 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.32 1xdh s THR 81 CO 0.00 0.06 -0.13 0.68 -0.69 0.00 0.00 174.62 174.53 1xdh s VAL 82 N 0.09 1.33 0.06 3.82 -7.23 -0.85 -2.42 120.40 115.21 1xdh s VAL 82 Ca -0.01 -1.80 -0.03 0.00 -1.81 0.00 0.00 61.98 58.33 1xdh s VAL 82 Cb -0.02 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.28 1xdh s VAL 82 CO -0.00 -0.48 0.03 -0.94 -0.31 0.00 0.00 175.10 173.40 1xdh s SER 83 N -2.62 0.37 0.00 4.85 1.04 -0.85 -0.67 113.70 115.82 1xdh s SER 83 Ca 0.11 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1xdh s SER 83 Cb -0.04 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.32 1xdh s SER 83 CO 0.03 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.24 1xdh n GLY 84 N 0.15 -0.48 3.31 7.32 0.00 -0.42 -1.15 105.19 113.93 1xdh n GLY 84 Ca -0.15 0.29 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 1xdh n GLY 84 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xdh s PHE 85 N 0.00 -0.22 0.37 1.61 -0.12 -0.66 -1.55 117.98 117.42 1xdh s PHE 85 Ca 0.00 0.09 -0.25 0.00 -0.05 0.00 0.00 56.93 56.72 1xdh s PHE 85 Cb 0.00 0.20 -0.09 0.00 -0.63 0.00 0.00 43.02 42.50 1xdh s PHE 85 CO 0.00 -0.59 1.04 -0.06 -0.05 0.00 0.00 175.22 175.56 1xdh s PHE 86 N -2.82 3.38 0.19 3.49 0.08 -0.09 -0.46 117.98 121.76 1xdh s PHE 86 Ca -0.03 1.67 -0.03 0.00 0.12 0.00 0.00 56.93 58.66 1xdh s PHE 86 Cb -0.00 -3.12 -0.03 0.00 -0.57 0.00 0.00 43.02 39.30 1xdh s PHE 86 CO -0.05 -0.48 0.18 -1.12 -0.10 0.00 0.00 175.22 173.65 1xdh s SER 87 N -1.47 0.13 -0.03 1.36 0.01 -0.18 -1.10 113.70 112.41 1xdh s SER 87 Ca 0.55 -1.24 0.03 0.00 1.31 0.00 0.00 55.95 56.59 1xdh s SER 87 Cb -0.23 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.40 1xdh s SER 87 CO 0.29 -0.87 -0.11 -0.75 0.41 0.00 0.00 173.24 172.21 1xdh s LYS 88 N -4.10 1.16 0.26 12.44 2.20 -0.86 -1.01 119.74 129.83 1xdh s LYS 88 Ca 0.32 -0.37 -0.21 0.00 -0.36 0.00 0.00 55.97 55.35 1xdh s LYS 88 Cb 0.06 -1.05 0.04 0.00 -1.51 0.00 0.00 37.83 35.36 1xdh s LYS 88 CO 0.09 0.13 0.79 0.34 -0.36 0.00 0.00 175.35 176.34 1xdh s ASP 89 N 0.20 -0.20 0.02 1.43 -1.08 -0.83 -0.69 116.67 115.51 1xdh s ASP 89 Ca -0.04 -0.63 -0.30 0.00 -0.52 0.00 0.00 52.55 51.06 1xdh s ASP 89 Cb -0.10 0.68 -0.07 0.00 -1.46 0.00 0.00 42.92 41.97 1xdh s ASP 89 CO 0.01 -1.28 1.69 -0.22 0.52 0.00 0.00 175.17 175.89 1xdh s LEU 90 N -2.96 4.36 -0.16 -1.34 2.96 -1.26 -0.97 118.68 119.31 1xdh s LEU 90 Ca 0.12 2.41 -0.04 0.00 -0.22 0.00 0.00 54.13 56.40 1xdh s LEU 90 Cb -0.05 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 1xdh s LEU 90 CO 0.06 -0.92 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.45 1xdh s VAL 91 N 3.37 3.88 -0.23 1.68 1.01 -0.01 -0.49 120.40 129.60 1xdh s VAL 91 Ca 0.75 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1xdh s VAL 91 Cb -0.38 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.34 1xdh s VAL 91 CO 0.32 0.49 -0.11 -0.89 0.00 0.00 0.00 175.10 174.91 1xdh s THR 92 N 0.38 2.48 -0.23 3.92 2.01 0.17 -1.51 115.64 122.85 1xdh s THR 92 Ca -0.04 -1.14 -0.01 0.00 0.31 0.00 0.00 61.69 60.80 1xdh s THR 92 Cb -0.14 -2.25 0.02 0.00 0.01 0.00 0.00 72.50 70.14 1xdh s THR 92 CO 0.03 0.24 -0.08 0.68 -0.69 0.00 0.00 174.62 174.80 1xdh s VAL 93 N 1.26 2.80 0.00 3.82 -7.23 -0.04 -1.25 120.40 119.78 1xdh s VAL 93 Ca -0.01 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.22 1xdh s VAL 93 Cb -0.16 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.40 1xdh s VAL 93 CO -0.07 0.28 0.00 0.61 -0.31 0.00 0.00 175.10 175.61 1xdh n GLY 94 N 4.67 2.62 1.34 2.32 0.00 -1.26 -1.86 105.19 113.02 1xdh n GLY 94 Ca -0.17 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.48 1xdh n GLY 94 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xdh n ASN 95 N 4.41 3.35 -4.85 1.61 0.23 -1.26 -4.95 115.26 113.80 1xdh n ASN 95 Ca 0.00 -3.47 -0.36 0.00 -0.53 0.00 0.00 54.58 50.22 1xdh n ASN 95 Cb 0.00 -0.65 -0.06 0.00 -2.08 0.00 0.00 39.78 36.99 1xdh n ASN 95 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1xdh s LEU 96 N -3.10 4.40 0.02 -4.53 1.43 -0.78 -5.11 118.68 111.02 1xdh s LEU 96 Ca 0.47 0.90 -0.10 0.00 -1.03 0.00 0.00 54.13 54.37 1xdh s LEU 96 Cb 0.40 -2.84 0.01 0.00 0.03 0.00 0.00 46.19 43.79 1xdh s LEU 96 CO 0.06 0.23 0.20 -0.94 0.23 0.00 0.00 176.35 176.13 1xdh s SER 97 N -1.46 -0.00 -0.10 2.29 1.04 -1.26 -0.86 113.70 113.36 1xdh s SER 97 Ca 0.29 -0.26 -0.30 0.00 0.48 0.00 0.00 55.95 56.16 1xdh s SER 97 Cb -0.15 0.27 0.07 0.00 0.10 0.00 0.00 66.02 66.31 1xdh s SER 97 CO 0.16 -0.50 0.70 -1.48 0.98 0.00 0.00 173.24 173.10 1xdh s LEU 98 N -1.81 -0.67 0.25 2.42 2.34 -0.57 -4.98 118.68 115.66 1xdh s LEU 98 Ca -0.09 0.86 -0.31 0.00 0.06 0.00 0.00 54.13 54.65 1xdh s LEU 98 Cb -0.03 2.51 -0.12 0.00 -0.56 0.00 0.00 46.19 47.98 1xdh s LEU 98 CO -0.01 -0.53 1.57 -2.65 -1.06 0.00 0.00 176.35 173.66 1xdh n PRO 99 N 1.26 2.48 -3.71 1.48 -0.02 -1.26 -0.83 135.00 134.40 1xdh n PRO 99 Ca -0.18 0.89 -0.13 0.00 -2.02 0.00 0.00 63.50 62.06 1xdh n PRO 99 Cb 0.57 -2.64 -0.10 0.00 -0.02 0.00 0.00 33.50 31.31 1xdh n PRO 99 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1xdh s TYR 100 N 0.27 -0.54 -0.04 6.00 5.04 -0.14 -4.89 117.35 123.06 1xdh s TYR 100 Ca 0.69 1.27 -0.30 0.00 -2.44 0.00 0.00 57.07 56.29 1xdh s TYR 100 Cb -0.56 0.20 -0.02 0.00 0.35 0.00 0.00 41.96 41.93 1xdh s TYR 100 CO 0.45 -0.27 0.98 0.21 -1.34 0.00 0.00 175.55 175.59 1xdh s LYS 101 N 0.45 4.51 0.29 4.97 2.20 -1.26 -1.97 119.74 128.93 1xdh s LYS 101 Ca -0.02 1.40 -0.02 0.00 -0.36 0.00 0.00 55.97 56.97 1xdh s LYS 101 Cb -0.04 -3.49 -0.01 0.00 -1.51 0.00 0.00 37.83 32.78 1xdh s LYS 101 CO -0.02 -0.13 0.36 -0.59 -0.36 0.00 0.00 175.35 174.60 1xdh s PHE 102 N 1.33 1.08 -0.19 4.03 -0.12 -0.18 -4.70 117.98 119.23 1xdh s PHE 102 Ca 0.50 -1.28 -0.05 0.00 -0.05 0.00 0.00 56.93 56.06 1xdh s PHE 102 Cb -0.20 -0.26 -0.02 0.00 -0.63 0.00 0.00 43.02 41.90 1xdh s PHE 102 CO 0.25 -0.94 -0.01 0.42 -0.05 0.00 0.00 175.22 174.88 1xdh s ILE 103 N -3.57 3.91 -0.45 -4.49 1.01 -0.00 -1.02 121.20 116.59 1xdh s ILE 103 Ca 0.33 -0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.39 1xdh s ILE 103 Cb 0.02 -2.76 0.03 0.00 0.01 0.00 0.00 42.46 39.76 1xdh s ILE 103 CO 0.18 0.44 0.95 -1.61 0.00 0.00 0.00 174.94 174.89 1xdh s GLU 104 N 0.90 3.59 -0.06 2.79 2.02 0.40 -1.77 118.70 126.57 1xdh s GLU 104 Ca 0.01 0.25 -0.22 0.00 0.02 0.00 0.00 54.97 55.03 1xdh s GLU 104 Cb -0.14 -3.91 -0.04 0.00 0.10 0.00 0.00 34.13 30.14 1xdh s GLU 104 CO 0.02 -1.21 0.65 0.08 0.02 0.00 0.00 175.26 174.82 1xdh s VAL 105 N 3.80 5.03 -0.14 2.63 1.01 -0.14 -1.65 120.40 130.94 1xdh s VAL 105 Ca 0.38 1.35 0.02 0.00 0.00 0.00 0.00 61.98 63.73 1xdh s VAL 105 Cb -0.10 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 1xdh s VAL 105 CO 0.26 0.30 0.23 2.30 0.00 0.00 0.00 175.10 178.19 1xdh n ILE 106 N 3.55 0.00 -3.61 2.22 -5.35 -0.30 -0.63 119.36 115.24 1xdh n ILE 106 Ca -0.03 -0.47 -0.24 0.00 -0.27 0.00 0.00 62.75 61.74 1xdh n ILE 106 Cb 0.51 1.01 -0.17 0.00 -1.74 0.00 0.00 39.64 39.26 1xdh n ILE 106 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1xdh s ASP 107 N -0.87 2.07 0.00 7.28 -1.08 -1.00 -2.62 116.67 120.45 1xdh s ASP 107 Ca 0.01 -0.47 0.09 0.00 -0.52 0.00 0.00 52.55 51.67 1xdh s ASP 107 Cb 0.02 -0.17 0.21 0.00 -1.46 0.00 0.00 42.92 41.51 1xdh s ASP 107 CO 0.06 -0.33 1.10 0.35 0.52 0.00 0.00 175.17 176.87 1xdh n THR 108 N 5.29 0.72 0.27 1.71 -2.24 -1.26 -2.01 114.28 116.75 1xdh n THR 108 Ca -0.06 -0.86 0.11 0.00 -2.27 0.00 0.00 64.05 60.97 1xdh n THR 108 Cb 0.49 0.70 0.73 0.00 -2.10 0.00 0.00 70.33 70.15 1xdh n THR 108 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1xdh h ASN 109 N 1.76 0.00 0.00 3.42 2.35 -1.95 -1.33 115.58 119.83 1xdh h ASN 109 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1xdh h ASN 109 Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1xdh h ASN 109 CO 0.00 0.06 0.00 0.61 -1.65 0.00 0.00 177.43 176.45 1xdh n GLY 110 N -1.18 -0.88 0.43 2.83 0.00 -1.24 -3.38 105.19 101.77 1xdh n GLY 110 Ca -0.03 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.91 1xdh n GLY 110 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1xdh n PHE 111 N -0.94 0.00 -4.02 1.61 7.35 -0.50 -1.29 117.46 119.67 1xdh n PHE 111 Ca 0.19 -1.24 -0.30 0.00 -0.76 0.00 0.00 57.45 55.34 1xdh n PHE 111 Cb 0.09 -0.20 -0.06 0.00 0.35 0.00 0.00 39.48 39.66 1xdh n PHE 111 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1xdh s GLU 112 N -2.91 3.04 0.00 -4.13 0.41 -1.22 -1.05 118.70 112.84 1xdh s GLU 112 Ca 0.35 -0.66 0.30 0.00 -0.41 0.00 0.00 54.97 54.55 1xdh s GLU 112 Cb 0.33 -2.79 1.52 0.00 -1.78 0.00 0.00 34.13 31.40 1xdh s GLU 112 CO -0.03 0.56 2.04 -0.35 -0.49 0.00 0.00 175.26 176.98 1xdh n PRO 113 N 0.22 0.64 -0.15 0.39 -0.04 -1.26 -4.93 135.00 129.88 1xdh n PRO 113 Ca -0.08 -0.08 -0.03 0.00 -0.04 0.00 0.00 63.50 63.28 1xdh n PRO 113 Cb 0.52 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.54 1xdh n PRO 113 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1xdh h THR 114 N 0.20 0.69 -0.24 0.52 2.02 -1.91 -1.67 112.91 112.52 1xdh h THR 114 Ca 0.00 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 1xdh h THR 114 Cb 0.25 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1xdh h THR 114 CO 0.00 0.03 0.03 0.22 0.37 0.00 0.00 175.52 176.17 1xdh h TYR 115 N 0.18 0.42 -0.10 3.16 3.20 -1.45 -1.84 116.97 120.54 1xdh h TYR 115 Ca 0.24 -0.06 -0.10 0.00 3.14 0.00 0.00 58.73 61.95 1xdh h TYR 115 Cb 0.33 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 1xdh h TYR 115 CO -0.25 0.53 -0.39 1.15 -1.64 0.00 0.00 178.16 177.56 1xdh h THR 116 N 0.19 1.30 0.00 1.81 2.02 -1.78 -2.77 112.91 113.68 1xdh h THR 116 Ca 0.07 -1.45 0.00 0.00 0.77 0.00 0.00 66.41 65.80 1xdh h THR 116 Cb 0.34 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 1xdh h THR 116 CO 0.01 0.43 0.00 0.00 0.37 0.00 0.00 175.52 176.33 1xdh n ALA 117 N -2.47 2.40 -2.53 6.16 0.00 -0.64 -4.86 120.51 118.56 1xdh n ALA 117 Ca -0.01 -0.12 -0.25 0.00 0.00 0.00 0.00 53.44 53.05 1xdh n ALA 117 Cb 0.46 -1.48 -0.09 0.00 0.00 0.00 0.00 19.45 18.34 1xdh n ALA 117 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xdh s SER 118 N -2.75 4.12 -0.04 0.00 0.01 -0.72 -5.05 113.70 109.26 1xdh s SER 118 Ca 0.22 -1.05 0.11 0.00 1.31 0.00 0.00 55.95 56.54 1xdh s SER 118 Cb 0.19 -0.49 0.33 0.00 0.21 0.00 0.00 66.02 66.26 1xdh s SER 118 CO 0.48 -0.27 1.27 0.35 0.41 0.00 0.00 173.24 175.48 1xdh n THR 119 N -0.96 1.27 -2.61 1.44 -2.24 -1.26 -4.94 114.28 104.99 1xdh n THR 119 Ca -0.04 -1.20 -0.32 0.00 -2.27 0.00 0.00 64.05 60.23 1xdh n THR 119 Cb 0.63 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 69.16 1xdh n THR 119 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1xdh s PHE 120 N -1.40 3.44 -0.19 4.78 -0.71 -1.26 -4.88 117.98 117.77 1xdh s PHE 120 Ca 0.25 1.34 -0.11 0.00 -1.04 0.00 0.00 56.93 57.38 1xdh s PHE 120 Cb 0.16 -2.68 -0.21 0.00 -1.21 0.00 0.00 43.02 39.08 1xdh s PHE 120 CO 0.13 -0.25 0.14 -0.25 -1.34 0.00 0.00 175.22 173.65 1xdh n ASP 121 N -1.35 2.01 -1.48 1.98 8.00 0.12 -4.99 116.55 120.83 1xdh n ASP 121 Ca 0.05 0.23 -0.04 0.00 0.71 0.00 0.00 54.79 55.75 1xdh n ASP 121 Cb 0.54 -0.82 -0.01 0.00 -0.02 0.00 0.00 41.12 40.81 1xdh n ASP 121 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xdh n GLY 122 N 1.78 3.16 3.16 0.44 0.00 -0.96 -4.25 105.19 108.52 1xdh n GLY 122 Ca -0.37 -1.52 -0.26 0.00 0.00 0.00 0.00 46.02 43.87 1xdh n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xdh s ILE 123 N -2.46 1.50 -0.32 -0.61 1.01 -1.09 -1.92 121.20 117.32 1xdh s ILE 123 Ca 0.08 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 59.97 1xdh s ILE 123 Cb -0.00 -1.27 0.08 0.00 0.01 0.00 0.00 42.46 41.28 1xdh s ILE 123 CO 0.05 0.43 0.01 -0.22 0.00 0.00 0.00 174.94 175.21 1xdh s LEU 124 N -0.14 4.26 0.41 2.97 0.20 -0.17 -1.31 118.68 124.90 1xdh s LEU 124 Ca -0.00 -1.77 -0.24 0.00 0.69 0.00 0.00 54.13 52.81 1xdh s LEU 124 Cb -0.10 -1.64 -0.08 0.00 -0.43 0.00 0.00 46.19 43.94 1xdh s LEU 124 CO 0.01 -0.32 1.11 -0.83 -0.29 0.00 0.00 176.35 176.03 1xdh s GLY 125 N 1.12 2.79 -0.05 7.98 0.00 -0.53 -0.91 107.32 117.73 1xdh s GLY 125 Ca 0.02 0.83 0.22 0.00 0.00 0.00 0.00 44.72 45.79 1xdh s GLY 125 CO -0.06 1.29 1.18 1.04 0.00 0.00 0.00 173.10 176.56 1xdh n LEU 126 N -0.06 1.42 0.00 0.66 4.77 0.33 -4.64 117.00 119.48 1xdh n LEU 126 Ca 0.05 -2.47 0.00 0.00 -0.03 0.00 0.00 56.01 53.56 1xdh n LEU 126 Cb 0.48 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1xdh n LEU 126 CO 0.47 0.72 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 1xdh n GLY 127 N 0.10 1.49 3.97 -0.72 0.00 0.50 -4.69 105.19 105.83 1xdh n GLY 127 Ca 0.09 -1.93 -0.21 0.00 0.00 0.00 0.00 46.02 43.98 1xdh n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xdh s TRP 128 N 1.83 3.43 0.29 1.61 0.52 -0.82 -4.73 118.94 121.05 1xdh s TRP 128 Ca 0.00 -0.03 0.03 0.00 0.02 0.00 0.00 56.10 56.11 1xdh s TRP 128 Cb 0.00 -1.59 0.61 0.00 -1.15 0.00 0.00 33.47 31.34 1xdh s TRP 128 CO 0.00 0.42 1.82 -0.22 0.02 0.00 0.00 176.95 178.99 1xdh h LYS 129 N 1.16 0.89 0.00 4.98 3.64 -1.87 -1.60 116.57 123.77 1xdh h LYS 129 Ca -0.52 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.81 1xdh h LYS 129 Cb 1.23 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1xdh h LYS 129 CO 0.61 0.59 0.00 -0.44 -2.27 0.00 0.00 179.45 177.93 1xdh h ASP 130 N 0.92 0.00 1.38 4.20 3.32 -1.89 -0.88 116.42 123.47 1xdh h ASP 130 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 1xdh h ASP 130 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1xdh h ASP 130 CO -0.30 0.00 -0.33 0.25 -1.72 0.00 0.00 179.24 177.13 1xdh h LEU 131 N 0.00 0.00-10.20 1.55 5.85 -1.53 -3.47 115.31 107.51 1xdh h LEU 131 Ca 0.00 -0.06 -0.49 0.00 0.84 0.00 0.00 57.88 58.17 1xdh h LEU 131 Cb 0.26 0.00 0.06 0.00 0.37 0.00 0.00 40.66 41.35 1xdh h LEU 131 CO 0.00 0.03 0.38 -0.94 -0.34 0.00 0.00 178.44 177.57 1xdh s SER 132 N -5.05 5.84 -0.09 1.25 1.04 -0.33 -4.52 113.70 111.84 1xdh s SER 132 Ca 0.07 1.79 -0.11 0.00 0.48 0.00 0.00 55.95 58.18 1xdh s SER 132 Cb 0.10 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.64 1xdh s SER 132 CO 0.68 -1.13 0.26 -0.63 0.98 0.00 0.00 173.24 173.41 1xdh s ILE 133 N -2.48 5.30 0.00 -1.02 -1.09 -1.26 -4.45 121.20 116.19 1xdh s ILE 133 Ca 0.63 0.50 0.00 0.00 -2.23 0.00 0.00 60.65 59.55 1xdh s ILE 133 Cb -0.15 -3.56 0.00 0.00 -1.58 0.00 0.00 42.46 37.17 1xdh s ILE 133 CO 0.37 0.56 0.00 0.61 -1.23 0.00 0.00 174.94 175.25 1xdh n GLY 134 N 2.21 0.51 3.84 6.18 0.00 -1.26 -4.39 105.19 112.28 1xdh n GLY 134 Ca -0.16 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 44.72 1xdh n GLY 134 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xdh n SER 135 N 1.42 -4.20 -4.66 1.61 7.64 -1.26 -4.93 113.62 109.25 1xdh n SER 135 Ca 0.00 -1.10 -0.38 0.00 1.01 0.00 0.00 58.87 58.40 1xdh n SER 135 Cb 0.00 -2.81 -0.09 0.00 -1.01 0.00 0.00 64.21 60.30 1xdh n SER 135 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1xdh s VAL 136 N -3.57 5.26 0.25 0.44 1.01 -1.26 -5.06 120.40 117.47 1xdh s VAL 136 Ca 0.41 0.47 -0.30 0.00 0.00 0.00 0.00 61.98 62.56 1xdh s VAL 136 Cb -0.17 -3.63 -0.10 0.00 0.00 0.00 0.00 36.38 32.48 1xdh s VAL 136 CO 0.90 0.28 1.44 -1.81 0.00 0.00 0.00 175.10 175.90 1xdh s ASP 137 N 1.15 6.66 0.51 3.32 1.01 -1.26 -4.43 116.67 123.62 1xdh s ASP 137 Ca 0.14 2.66 -0.22 0.00 0.71 0.00 0.00 52.55 55.83 1xdh s ASP 137 Cb -0.14 -2.62 -0.07 0.00 1.01 0.00 0.00 42.92 41.09 1xdh s ASP 137 CO 0.07 -0.70 1.22 -2.65 0.21 0.00 0.00 175.17 173.32 1xdh n PRO 138 N 2.38 1.59 -0.15 8.23 -0.02 -1.26 -4.76 135.00 141.00 1xdh n PRO 138 Ca 0.07 0.58 -0.04 0.00 -2.02 0.00 0.00 63.50 62.09 1xdh n PRO 138 Cb 0.40 -2.39 0.03 0.00 -0.02 0.00 0.00 33.50 31.52 1xdh n PRO 138 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1xdh h ILE 139 N 1.47 0.51 -0.08 4.25 2.04 -1.92 0.20 117.51 123.98 1xdh h ILE 139 Ca -0.49 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.26 1xdh h ILE 139 Cb 1.32 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1xdh h ILE 139 CO 0.57 0.00 -0.43 0.58 0.00 0.00 0.00 178.15 178.86 1xdh h VAL 140 N -0.02 1.32 -0.05 1.67 2.07 -1.96 -0.39 116.25 118.90 1xdh h VAL 140 Ca 0.22 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 1xdh h VAL 140 Cb 0.36 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1xdh h VAL 140 CO -0.49 0.46 -0.02 0.58 0.02 0.00 0.00 177.57 178.12 1xdh h VAL 141 N 0.15 1.33 -0.83 2.57 2.07 -1.76 -2.56 116.25 117.24 1xdh h VAL 141 Ca 0.01 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.50 1xdh h VAL 141 Cb 0.83 1.93 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 1xdh h VAL 141 CO 0.06 0.28 0.55 -0.33 0.02 0.00 0.00 177.57 178.15 1xdh h GLU 142 N -0.30 1.08 -0.86 1.57 4.39 -0.81 0.11 114.58 119.76 1xdh h GLU 142 Ca 0.01 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1xdh h GLU 142 Cb 0.47 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 28.83 1xdh h GLU 142 CO 0.01 0.72 0.42 -0.07 -1.16 0.00 0.00 179.01 178.93 1xdh h LEU 143 N 1.11 1.12 -0.38 1.33 3.38 -1.07 0.16 115.31 120.97 1xdh h LEU 143 Ca 0.30 -0.13 -0.19 0.00 0.09 0.00 0.00 57.88 57.95 1xdh h LEU 143 Cb -0.12 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.34 1xdh h LEU 143 CO -0.07 0.94 -0.76 0.50 0.09 0.00 0.00 178.44 179.14 1xdh h LYS 144 N 1.23 0.38 0.00 1.13 3.11 -1.04 0.30 116.57 121.68 1xdh h LYS 144 Ca 0.30 -0.33 -0.05 0.00 -2.81 0.00 0.00 60.65 57.76 1xdh h LYS 144 Cb 0.11 0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.40 1xdh h LYS 144 CO -0.04 0.98 -0.22 -0.91 -2.81 0.00 0.00 179.45 176.44 1xdh h ASN 145 N 0.25 0.00 -0.30 4.20 2.35 -0.03 -0.82 115.58 121.23 1xdh h ASN 145 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1xdh h ASN 145 Cb 1.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.72 1xdh h ASN 145 CO 0.13 0.22 0.00 0.00 -1.65 0.00 0.00 177.43 176.13 1xdh n GLN 146 N -4.17 2.17 -2.40 0.81 6.02 0.48 -4.96 117.38 115.33 1xdh n GLN 146 Ca -0.02 -1.76 -0.16 0.00 -0.01 0.00 0.00 57.00 55.04 1xdh n GLN 146 Cb 0.29 -1.46 -0.00 0.00 1.02 0.00 0.00 30.24 30.09 1xdh n GLN 146 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1xdh n ASN 147 N 0.98 -4.80 0.05 1.08 2.85 -0.31 -4.91 115.26 110.20 1xdh n ASN 147 Ca 0.18 -0.05 0.12 0.00 -0.11 0.00 0.00 54.58 54.71 1xdh n ASN 147 Cb 0.48 -3.88 0.12 0.00 1.24 0.00 0.00 39.78 37.75 1xdh n ASN 147 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1xdh n LYS 148 N -2.65 0.30 -4.16 1.20 5.02 0.97 -4.90 118.16 113.94 1xdh n LYS 148 Ca -0.17 0.06 -0.12 0.00 -2.02 0.00 0.00 58.31 56.05 1xdh n LYS 148 Cb 0.63 -1.66 -0.10 0.00 -0.02 0.00 0.00 35.03 33.88 1xdh n LYS 148 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1xdh s ILE 149 N -3.18 0.79 0.02 -0.18 -4.36 -1.23 -4.99 121.20 108.07 1xdh s ILE 149 Ca 0.05 -1.73 -0.25 0.00 -0.26 0.00 0.00 60.65 58.46 1xdh s ILE 149 Cb 0.14 -1.44 -0.18 0.00 1.25 0.00 0.00 42.46 42.22 1xdh s ILE 149 CO 0.75 -0.70 1.45 -0.33 0.24 0.00 0.00 174.94 176.35 1xdh h GLU 150 N 3.35 -0.01 -5.36 0.37 4.39 -1.91 -3.43 114.58 111.99 1xdh h GLU 150 Ca -0.36 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 58.79 1xdh h GLU 150 Cb 1.18 0.00 -0.31 0.00 -0.10 0.00 0.00 28.75 29.52 1xdh h GLU 150 CO 0.58 0.29 -0.83 -0.80 -1.16 0.00 0.00 179.01 177.08 1xdh s ASN 151 N -5.49 2.08 -1.19 1.42 0.01 -1.13 -5.04 114.94 105.60 1xdh s ASN 151 Ca -0.15 -0.34 -0.18 0.00 -0.71 0.00 0.00 52.86 51.49 1xdh s ASN 151 Cb 0.03 -0.49 -0.03 0.00 0.41 0.00 0.00 41.25 41.17 1xdh s ASN 151 CO 0.67 0.16 2.06 0.00 -1.51 0.00 0.00 177.10 178.48 1xdh n ALA 152 N 3.03 4.37 -2.85 0.60 0.00 -1.26 -4.06 120.51 120.34 1xdh n ALA 152 Ca -0.17 -3.63 -0.10 0.00 0.00 0.00 0.00 53.44 49.53 1xdh n ALA 152 Cb 0.53 -3.58 -0.08 0.00 0.00 0.00 0.00 19.45 16.32 1xdh n ALA 152 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1xdh s LEU 153 N 2.57 1.36 0.23 0.00 0.05 -1.26 -0.88 118.68 120.76 1xdh s LEU 153 Ca 0.53 -0.38 0.00 0.00 0.05 0.00 0.00 54.13 54.33 1xdh s LEU 153 Cb 0.12 0.96 -0.04 0.00 -2.05 0.00 0.00 46.19 45.18 1xdh s LEU 153 CO 0.01 -0.56 0.13 0.72 -0.55 0.00 0.00 176.35 176.10 1xdh s PHE 154 N -2.62 1.32 -0.04 3.48 -0.12 -0.48 -0.96 117.98 118.57 1xdh s PHE 154 Ca -0.05 -1.35 -0.03 0.00 -0.05 0.00 0.00 56.93 55.46 1xdh s PHE 154 Cb -0.01 -0.68 0.01 0.00 -0.63 0.00 0.00 43.02 41.72 1xdh s PHE 154 CO -0.04 -0.57 0.09 0.99 -0.05 0.00 0.00 175.22 175.64 1xdh s THR 155 N -3.97 -0.01 -0.15 -4.49 2.01 0.10 -0.05 115.64 109.07 1xdh s THR 155 Ca 0.39 0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.44 1xdh s THR 155 Cb 0.07 -0.14 0.01 0.00 0.01 0.00 0.00 72.50 72.45 1xdh s THR 155 CO 0.14 0.02 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.53 1xdh s PHE 156 N 0.26 2.72 -0.27 4.92 0.08 -0.23 -1.01 117.98 124.47 1xdh s PHE 156 Ca -0.02 -1.29 0.03 0.00 0.12 0.00 0.00 56.93 55.77 1xdh s PHE 156 Cb -0.03 -1.86 0.07 0.00 -0.57 0.00 0.00 43.02 40.63 1xdh s PHE 156 CO -0.01 -0.60 -0.08 -0.47 -0.10 0.00 0.00 175.22 173.97 1xdh s TYR 157 N 0.89 3.18 0.32 0.36 5.04 -0.22 -2.68 117.35 124.25 1xdh s TYR 157 Ca -0.05 -2.32 -0.23 0.00 -2.44 0.00 0.00 57.07 52.04 1xdh s TYR 157 Cb -0.15 -2.00 -0.10 0.00 0.35 0.00 0.00 41.96 40.07 1xdh s TYR 157 CO -0.03 -0.87 0.88 -0.51 -1.34 0.00 0.00 175.55 173.68 1xdh s LEU 158 N 1.13 4.24 0.67 6.97 1.02 -1.26 -0.33 118.68 131.12 1xdh s LEU 158 Ca -0.06 1.66 -0.14 0.00 0.02 0.00 0.00 54.13 55.62 1xdh s LEU 158 Cb -0.20 -4.02 0.01 0.00 0.02 0.00 0.00 46.19 42.00 1xdh s LEU 158 CO -0.06 -0.11 1.10 -2.16 0.02 0.00 0.00 176.35 175.14 1xdh s PRO 159 N -2.32 2.77 -0.09 1.29 0.04 -1.26 -4.56 135.00 130.87 1xdh s PRO 159 Ca 0.51 1.30 0.02 0.00 0.04 0.00 0.00 61.00 62.88 1xdh s PRO 159 Cb -0.16 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1xdh s PRO 159 CO 0.21 -1.26 -0.16 0.08 0.04 0.00 0.00 177.00 175.91 1xdh s VAL 160 N -2.49 1.46 0.07 -0.36 1.01 -0.30 -4.88 120.40 114.91 1xdh s VAL 160 Ca 0.65 -0.65 -0.22 0.00 0.00 0.00 0.00 61.98 61.76 1xdh s VAL 160 Cb -0.19 -1.31 -0.09 0.00 0.00 0.00 0.00 36.38 34.79 1xdh s VAL 160 CO 0.44 0.43 1.36 -0.74 0.00 0.00 0.00 175.10 176.59 1xdh h HIS 161 N 7.06 -1.05 0.00 5.22 2.76 -1.91 -1.78 115.15 125.46 1xdh h HIS 161 Ca -0.28 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.93 1xdh h HIS 161 Cb 1.20 0.46 0.00 0.00 1.55 0.00 0.00 27.41 30.62 1xdh h HIS 161 CO 0.48 -0.36 0.00 -0.44 -1.30 0.00 0.00 177.93 176.31 1xdh h ASP 162 N -0.40 0.00 0.00 3.26 3.32 -2.01 -3.40 116.42 117.18 1xdh h ASP 162 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1xdh h ASP 162 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1xdh h ASP 162 CO -0.27 0.00 -0.09 0.29 -1.72 0.00 0.00 179.24 177.45 1xdh n LYS 163 N -2.93 0.06 -3.79 3.56 5.02 -0.83 -5.10 118.16 114.15 1xdh n LYS 163 Ca 0.03 0.12 -0.10 0.00 -2.02 0.00 0.00 58.31 56.35 1xdh n LYS 163 Cb 0.43 -0.70 -0.07 0.00 -0.02 0.00 0.00 35.03 34.67 1xdh n LYS 163 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 1xdh s HIS 164 N -1.19 0.02 0.95 2.13 -3.43 -0.73 -5.01 115.29 108.03 1xdh s HIS 164 Ca -0.03 -0.35 -0.14 0.00 -0.80 0.00 0.00 55.06 53.74 1xdh s HIS 164 Cb 0.00 0.04 0.17 0.00 -1.43 0.00 0.00 32.58 31.36 1xdh s HIS 164 CO 0.04 -0.56 1.18 0.95 -2.00 0.00 0.00 174.74 174.34 1xdh s THR 165 N -3.50 1.94 0.49 -5.38 -4.23 -1.26 -1.15 115.64 102.55 1xdh s THR 165 Ca 0.02 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.56 1xdh s THR 165 Cb 0.03 -2.79 -0.02 0.00 1.34 0.00 0.00 72.50 71.05 1xdh s THR 165 CO -0.09 0.00 0.07 -0.83 -0.54 0.00 0.00 174.62 173.23 1xdh s GLY 166 N -4.25 2.80 -0.05 3.99 0.00 -0.74 -4.44 107.32 104.63 1xdh s GLY 166 Ca 0.67 -0.95 -0.04 0.00 0.00 0.00 0.00 44.72 44.40 1xdh s GLY 166 CO 0.53 -2.13 0.12 -1.36 0.00 0.00 0.00 173.10 170.27 1xdh s PHE 167 N -2.81 -0.14 -0.31 1.90 0.08 0.56 -0.78 117.98 116.47 1xdh s PHE 167 Ca 0.17 0.36 -0.18 0.00 0.12 0.00 0.00 56.93 57.40 1xdh s PHE 167 Cb 0.03 -0.00 -0.01 0.00 -0.57 0.00 0.00 43.02 42.46 1xdh s PHE 167 CO 0.09 -0.10 0.53 -1.17 -0.10 0.00 0.00 175.22 174.47 1xdh s LEU 168 N 0.44 4.19 -0.17 -0.37 2.96 -0.16 -1.05 118.68 124.52 1xdh s LEU 168 Ca -0.03 0.25 -0.05 0.00 -0.22 0.00 0.00 54.13 54.07 1xdh s LEU 168 Cb -0.05 -2.64 -0.03 0.00 0.50 0.00 0.00 46.19 43.97 1xdh s LEU 168 CO -0.02 -0.40 0.00 -0.89 -1.32 0.00 0.00 176.35 173.72 1xdh s THR 169 N 2.39 4.17 -0.13 3.68 2.01 -0.18 -0.56 115.64 127.02 1xdh s THR 169 Ca 0.20 -0.25 -0.02 0.00 0.31 0.00 0.00 61.69 61.93 1xdh s THR 169 Cb -0.15 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.47 1xdh s THR 169 CO 0.12 0.47 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.83 1xdh s ILE 170 N 0.51 3.74 0.00 1.82 1.01 -0.18 -0.72 121.20 127.38 1xdh s ILE 170 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.21 1xdh s ILE 170 Cb -0.14 -2.60 0.00 0.00 0.01 0.00 0.00 42.46 39.73 1xdh s ILE 170 CO 0.02 0.52 0.00 0.61 0.00 0.00 0.00 174.94 176.09 1xdh n GLY 171 N 3.22 2.98 3.69 6.18 0.00 -0.14 -3.12 105.19 118.00 1xdh n GLY 171 Ca -0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 1xdh n GLY 171 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xdh s GLY 172 N -2.78 -0.29 -0.14 -0.02 0.00 -1.26 -2.84 107.32 99.99 1xdh s GLY 172 Ca 0.00 0.33 -0.05 0.00 0.00 0.00 0.00 44.72 45.01 1xdh s GLY 172 CO 0.00 0.08 0.02 -0.42 0.00 0.00 0.00 173.10 172.78 1xdh s ILE 173 N -3.27 4.46 -0.17 0.90 1.01 -1.26 -4.79 121.20 118.08 1xdh s ILE 173 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.59 1xdh s ILE 173 Cb -0.01 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.51 1xdh s ILE 173 CO -0.01 0.53 -0.15 -1.61 0.00 0.00 0.00 174.94 173.70 1xdh s GLU 174 N -0.15 3.18 0.54 2.79 2.02 -1.26 -5.01 118.70 120.82 1xdh s GLU 174 Ca 0.05 -0.76 0.27 0.00 0.02 0.00 0.00 54.97 54.56 1xdh s GLU 174 Cb -0.12 -2.65 1.56 0.00 0.10 0.00 0.00 34.13 33.02 1xdh s GLU 174 CO 0.02 -0.05 2.14 0.93 0.02 0.00 0.00 175.26 178.32 1xdh h GLU 175 N 7.50 0.00 -0.02 1.61 5.08 -1.99 -2.90 114.58 123.87 1xdh h GLU 175 Ca -0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1xdh h GLU 175 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1xdh h GLU 175 CO 0.58 0.07 0.04 0.07 -1.00 0.00 0.00 179.01 178.78 1xdh h ARG 176 N 0.00 0.00 0.00 2.33 0.11 -2.03 -2.92 114.38 111.87 1xdh h ARG 176 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1xdh h ARG 176 Cb 0.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.26 1xdh h ARG 176 CO 0.01 0.00 -0.59 0.74 0.10 0.00 0.00 179.97 180.23 1xdh h PHE 177 N 0.00 0.00 -4.06 4.08 0.04 -1.93 -3.45 116.94 111.63 1xdh h PHE 177 Ca 0.01 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.65 1xdh h PHE 177 Cb 0.09 0.00 -0.17 0.00 2.20 0.00 0.00 35.95 38.07 1xdh h PHE 177 CO 0.00 0.00 -0.63 1.52 -0.60 0.00 0.00 178.31 178.60 1xdh s TYR 178 N -3.19 0.37 0.17 -0.55 1.13 -1.11 -1.12 117.35 113.05 1xdh s TYR 178 Ca 0.06 -0.80 0.09 0.00 -1.41 0.00 0.00 57.07 55.01 1xdh s TYR 178 Cb 0.12 -0.27 -0.04 0.00 -1.10 0.00 0.00 41.96 40.67 1xdh s TYR 178 CO 0.72 -0.35 -0.12 -1.83 -2.51 0.00 0.00 175.55 171.45 1xdh s GLU 179 N -3.11 1.96 1.27 -3.49 -1.05 -0.25 -4.76 118.70 109.27 1xdh s GLU 179 Ca -0.01 -1.27 0.00 0.00 -0.15 0.00 0.00 54.97 53.55 1xdh s GLU 179 Cb 0.02 -2.13 0.00 0.00 -0.44 0.00 0.00 34.13 31.58 1xdh s GLU 179 CO -0.07 0.44 0.00 0.41 0.95 0.00 0.00 175.26 176.99 1xdh n GLY 180 N 0.22 -1.59 3.85 -3.83 0.00 -1.26 -3.86 105.19 98.72 1xdh n GLY 180 Ca -0.12 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 1xdh n GLY 180 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xdh s PRO 181 N -0.32 3.93 0.25 1.61 0.04 -1.26 -4.93 135.00 134.31 1xdh s PRO 181 Ca 0.00 0.71 -0.30 0.00 0.04 0.00 0.00 61.00 61.45 1xdh s PRO 181 Cb 0.00 -2.32 -0.09 0.00 0.04 0.00 0.00 34.50 32.13 1xdh s PRO 181 CO 0.00 -0.04 0.98 -0.51 0.04 0.00 0.00 177.00 177.47 1xdh s LEU 182 N -3.60 4.63 -0.11 -3.56 1.43 -1.26 -4.57 118.68 111.64 1xdh s LEU 182 Ca 0.55 2.03 0.03 0.00 -1.03 0.00 0.00 54.13 55.70 1xdh s LEU 182 Cb -0.10 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 1xdh s LEU 182 CO 0.25 0.09 -0.19 -0.89 0.23 0.00 0.00 176.35 175.84 1xdh s THR 183 N -1.17 2.50 -0.15 5.49 2.01 -0.29 -4.91 115.64 119.13 1xdh s THR 183 Ca 0.42 -0.87 -0.07 0.00 0.31 0.00 0.00 61.69 61.49 1xdh s THR 183 Cb -0.27 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.20 1xdh s THR 183 CO 0.34 0.55 0.08 -0.31 -0.69 0.00 0.00 174.62 174.59 1xdh s TYR 184 N 0.25 3.35 -0.14 4.92 1.51 -1.26 -0.46 117.35 125.52 1xdh s TYR 184 Ca -0.13 0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.22 1xdh s TYR 184 Cb -0.16 -1.99 0.01 0.00 -0.11 0.00 0.00 41.96 39.71 1xdh s TYR 184 CO 0.07 0.41 -0.22 -1.21 -1.11 0.00 0.00 175.55 173.49 1xdh s GLU 185 N -0.29 3.02 0.30 -0.62 0.41 0.35 -4.94 118.70 116.92 1xdh s GLU 185 Ca 0.09 -0.85 -0.29 0.00 -0.41 0.00 0.00 54.97 53.51 1xdh s GLU 185 Cb -0.12 -2.44 -0.10 0.00 -1.78 0.00 0.00 34.13 29.69 1xdh s GLU 185 CO 0.01 -0.02 1.18 0.15 -0.49 0.00 0.00 175.26 176.10 1xdh s LYS 186 N 0.83 4.53 0.32 1.61 -0.14 -1.26 -0.77 119.74 124.85 1xdh s LYS 186 Ca -0.07 1.97 -0.29 0.00 -1.36 0.00 0.00 55.97 56.22 1xdh s LYS 186 Cb -0.15 -3.15 -0.11 0.00 -1.68 0.00 0.00 37.83 32.75 1xdh s LYS 186 CO -0.02 0.05 1.42 -0.51 -0.76 0.00 0.00 175.35 175.53 1xdh s LEU 187 N -1.53 4.38 0.37 3.17 1.43 -0.23 -4.47 118.68 121.79 1xdh s LEU 187 Ca 0.46 2.81 0.22 0.00 -1.03 0.00 0.00 54.13 56.59 1xdh s LEU 187 Cb -0.35 -3.65 0.23 0.00 0.03 0.00 0.00 46.19 42.46 1xdh s LEU 187 CO 0.45 -0.71 1.45 -0.55 0.23 0.00 0.00 176.35 177.23 1xdh h ASN 188 N 3.90 0.00 -4.84 2.29 7.08 -1.58 -3.46 115.58 118.97 1xdh h ASN 188 Ca -0.48 0.00 -0.10 0.00 -3.08 0.00 0.00 56.30 52.63 1xdh h ASN 188 Cb 1.23 0.00 -0.20 0.00 -2.08 0.00 0.00 38.32 37.26 1xdh h ASN 188 CO 0.70 0.06 -0.14 -1.00 -2.08 0.00 0.00 177.43 174.97 1xdh s HIS 189 N -3.22 -0.35 -1.10 4.14 3.76 -1.26 -5.09 115.29 112.18 1xdh s HIS 189 Ca 0.05 0.63 -0.16 0.00 -0.15 0.00 0.00 55.06 55.42 1xdh s HIS 189 Cb 0.06 0.19 0.15 0.00 1.11 0.00 0.00 32.58 34.09 1xdh s HIS 189 CO 0.71 -0.43 1.32 -0.51 -0.85 0.00 0.00 174.74 174.98 1xdh s ASP 190 N -1.07 6.88 0.00 1.40 1.01 -1.26 -4.49 116.67 119.13 1xdh s ASP 190 Ca -0.11 -2.57 0.00 0.00 0.71 0.00 0.00 52.55 50.58 1xdh s ASP 190 Cb -0.04 -2.41 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1xdh s ASP 190 CO 0.05 -0.90 0.00 -0.11 0.21 0.00 0.00 175.17 174.42 1xdh n LEU 191 N 6.16 0.00 -4.92 1.23 7.94 -1.26 -4.53 117.00 121.63 1xdh n LEU 191 Ca 0.32 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.94 1xdh n LEU 191 Cb 0.46 0.00 0.11 0.00 0.53 0.00 0.00 43.42 44.52 1xdh n LEU 191 CO 0.58 0.00 0.76 -0.31 -1.11 0.00 0.00 177.39 177.31 1xdh s TYR 192 N 0.00 2.51 -1.22 1.96 1.51 -1.26 -1.95 117.35 118.89 1xdh s TYR 192 Ca 0.00 0.51 -0.19 0.00 -1.01 0.00 0.00 57.07 56.38 1xdh s TYR 192 Cb 0.00 -3.57 0.07 0.00 -0.11 0.00 0.00 41.96 38.34 1xdh s TYR 192 CO 0.00 -1.93 1.65 -1.58 -1.11 0.00 0.00 175.55 172.59 1xdh s TRP 193 N -3.57 2.74 -0.14 2.71 0.52 -1.26 -4.86 118.94 115.08 1xdh s TRP 193 Ca 0.65 -1.44 0.02 0.00 0.02 0.00 0.00 56.10 55.35 1xdh s TRP 193 Cb -0.09 -4.73 0.01 0.00 -1.15 0.00 0.00 33.47 27.51 1xdh s TRP 193 CO 0.49 -1.83 -0.20 1.14 0.02 0.00 0.00 176.95 176.57 1xdh s GLN 194 N 4.35 3.08 0.22 4.98 -2.07 -1.26 -0.86 119.66 128.11 1xdh s GLN 194 Ca 0.52 -0.82 0.07 0.00 -1.82 0.00 0.00 55.36 53.31 1xdh s GLN 194 Cb 0.03 -2.48 -0.05 0.00 -1.09 0.00 0.00 33.01 29.42 1xdh s GLN 194 CO 0.03 0.02 -0.13 0.96 -1.32 0.00 0.00 175.29 174.85 1xdh s ILE 195 N 0.76 1.71 -0.26 3.63 -4.36 0.11 -1.40 121.20 121.40 1xdh s ILE 195 Ca -0.08 -2.19 -0.09 0.00 -0.26 0.00 0.00 60.65 58.02 1xdh s ILE 195 Cb -0.16 -2.13 -0.04 0.00 1.25 0.00 0.00 42.46 41.38 1xdh s ILE 195 CO -0.00 -0.53 0.13 -0.89 0.24 0.00 0.00 174.94 173.89 1xdh s THR 196 N -2.99 4.93 0.01 8.37 2.01 -1.26 0.05 115.64 126.76 1xdh s THR 196 Ca 0.24 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1xdh s THR 196 Cb 0.00 -3.32 -0.01 0.00 0.01 0.00 0.00 72.50 69.19 1xdh s THR 196 CO 0.08 0.31 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.54 1xdh s LEU 197 N 1.49 2.09 0.15 4.42 1.43 -0.61 -4.83 118.68 122.81 1xdh s LEU 197 Ca 0.06 -0.18 -0.30 0.00 -1.03 0.00 0.00 54.13 52.68 1xdh s LEU 197 Cb -0.15 0.00 -0.08 0.00 0.03 0.00 0.00 46.19 45.99 1xdh s LEU 197 CO 0.07 -0.10 1.28 -1.81 0.23 0.00 0.00 176.35 176.02 1xdh s ASP 198 N -0.52 6.96 -0.17 2.29 1.01 -0.21 -0.56 116.67 125.47 1xdh s ASP 198 Ca -0.05 2.26 -0.03 0.00 0.71 0.00 0.00 52.55 55.44 1xdh s ASP 198 Cb -0.04 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 1xdh s ASP 198 CO -0.00 -0.51 -0.07 0.00 0.21 0.00 0.00 175.17 174.81 1xdh s ALA 199 N 0.49 2.82 -0.05 5.23 0.00 0.15 -0.96 121.76 129.44 1xdh s ALA 199 Ca 0.58 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.57 1xdh s ALA 199 Cb -0.34 -1.52 0.02 0.00 0.00 0.00 0.00 23.12 21.28 1xdh s ALA 199 CO 0.34 -0.02 -0.04 -1.58 0.00 0.00 0.00 175.76 174.46 1xdh s HIS 200 N 0.79 0.79 0.11 0.00 5.04 0.35 -0.49 115.29 121.89 1xdh s HIS 200 Ca -0.02 -0.24 0.00 0.00 -1.54 0.00 0.00 55.06 53.26 1xdh s HIS 200 Cb -0.15 -0.73 0.00 0.00 0.04 0.00 0.00 32.58 31.74 1xdh s HIS 200 CO 0.02 -0.24 0.00 0.28 -2.34 0.00 0.00 174.74 172.46 1xdh n VAL 201 N 4.30 0.49 0.00 0.89 0.31 -0.67 -0.61 118.33 123.04 1xdh n VAL 201 Ca -0.21 0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1xdh n VAL 201 Cb 0.51 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 1xdh n VAL 201 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xdh n GLY 202 N 2.73 0.67 1.54 2.92 0.00 -1.26 -4.54 105.19 107.25 1xdh n GLY 202 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1xdh n GLY 202 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xdh n ASN 203 N 0.00 3.94 -4.70 1.61 6.94 -1.26 -4.95 115.26 116.85 1xdh n ASN 203 Ca 0.00 -2.75 -0.37 0.00 -0.02 0.00 0.00 54.58 51.44 1xdh n ASN 203 Cb 0.00 -0.66 -0.08 0.00 -2.36 0.00 0.00 39.78 36.69 1xdh n ASN 203 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1xdh s ILE 204 N -2.17 5.29 -0.04 1.53 1.01 -1.26 -5.07 121.20 120.49 1xdh s ILE 204 Ca 0.37 0.51 0.02 0.00 0.00 0.00 0.00 60.65 61.55 1xdh s ILE 204 Cb 0.29 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 39.14 1xdh s ILE 204 CO 0.09 0.34 -0.09 -0.32 0.00 0.00 0.00 174.94 174.96 1xdh s MET 205 N 0.85 1.09 -0.30 2.79 1.75 -1.26 -1.66 119.30 122.57 1xdh s MET 205 Ca 0.15 -0.29 0.03 0.00 -1.25 0.00 0.00 55.69 54.33 1xdh s MET 205 Cb -0.14 -1.00 0.08 0.00 2.84 0.00 0.00 34.83 36.62 1xdh s MET 205 CO 0.05 0.06 -0.03 -1.17 -0.65 0.00 0.00 175.02 173.28 1xdh s LEU 206 N 0.43 3.98 0.33 4.11 2.96 0.36 -5.00 118.68 125.84 1xdh s LEU 206 Ca -0.07 -1.74 -0.27 0.00 -0.22 0.00 0.00 54.13 51.83 1xdh s LEU 206 Cb -0.11 -1.55 -0.09 0.00 0.50 0.00 0.00 46.19 44.93 1xdh s LEU 206 CO 0.01 -0.28 1.09 -1.61 -1.32 0.00 0.00 176.35 174.24 1xdh s GLU 207 N 1.04 4.43 -1.45 1.98 2.02 -1.26 -0.67 118.70 124.78 1xdh s GLU 207 Ca 0.01 1.73 -0.11 0.00 0.02 0.00 0.00 54.97 56.61 1xdh s GLU 207 Cb -0.19 -2.94 0.05 0.00 0.10 0.00 0.00 34.13 31.15 1xdh s GLU 207 CO -0.07 0.05 1.07 1.63 0.02 0.00 0.00 175.26 177.95 1xdh n LYS 208 N 0.69 -6.60 -2.12 1.61 5.02 -1.23 -4.90 118.16 110.64 1xdh n LYS 208 Ca 0.01 0.70 -0.40 0.00 -2.02 0.00 0.00 58.31 56.61 1xdh n LYS 208 Cb 0.46 -5.66 -0.01 0.00 -0.02 0.00 0.00 35.03 29.80 1xdh n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xdh s ALA 209 N -3.32 3.35 -0.18 7.82 0.00 0.28 -4.74 121.76 124.98 1xdh s ALA 209 Ca 0.61 1.21 -0.29 0.00 0.00 0.00 0.00 51.96 53.48 1xdh s ALA 209 Cb -0.29 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.36 1xdh s ALA 209 CO 0.79 -0.70 1.17 1.21 0.00 0.00 0.00 175.76 178.22 1xdh s ASN 210 N -0.68 7.02 -0.21 0.00 2.47 -1.03 -1.57 114.94 120.94 1xdh s ASN 210 Ca 0.53 1.59 0.01 0.00 0.42 0.00 0.00 52.86 55.40 1xdh s ASN 210 Cb -0.38 -2.54 0.03 0.00 -1.45 0.00 0.00 41.25 36.91 1xdh s ASN 210 CO 0.49 -0.70 -0.15 0.00 -3.72 0.00 0.00 177.10 173.02 1xdh s ILE 212 N 1.28 5.27 -0.44 0.00 1.01 0.41 -0.71 121.20 128.02 1xdh s ILE 212 Ca 0.02 0.44 -0.20 0.00 0.00 0.00 0.00 60.65 60.91 1xdh s ILE 212 Cb -0.15 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.73 1xdh s ILE 212 CO -0.09 0.28 0.59 -0.69 0.00 0.00 0.00 174.94 175.03 1xdh s VAL 213 N 1.28 4.89 -0.28 2.92 1.01 -0.04 0.31 120.40 130.51 1xdh s VAL 213 Ca 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 1xdh s VAL 213 Cb -0.14 -4.18 0.09 0.00 0.00 0.00 0.00 36.38 32.15 1xdh s VAL 213 CO 0.07 -0.58 0.06 -0.62 0.00 0.00 0.00 175.10 174.03 1xdh s ASP 214 N 2.01 3.85 0.58 3.32 2.15 -0.65 -4.56 116.67 123.38 1xdh s ASP 214 Ca 0.19 -1.45 0.35 0.00 0.43 0.00 0.00 52.55 52.06 1xdh s ASP 214 Cb -0.15 -0.92 1.78 0.00 -0.30 0.00 0.00 42.92 43.33 1xdh s ASP 214 CO 0.17 -0.37 2.16 0.77 -0.17 0.00 0.00 175.17 177.74 1xdh h SER 215 N 8.06 0.00 -0.47 -0.34 4.64 -1.84 -2.65 113.55 120.96 1xdh h SER 215 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1xdh h SER 215 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1xdh h SER 215 CO 0.44 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.06 1xdh n GLY 216 N -0.70 1.75 3.40 -0.77 0.00 -1.26 -4.66 105.19 102.95 1xdh n GLY 216 Ca -0.02 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1xdh n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xdh s THR 217 N -1.61 3.25 -0.72 2.61 2.01 -1.00 -5.01 115.64 115.17 1xdh s THR 217 Ca 0.35 -0.59 0.26 0.00 0.31 0.00 0.00 61.69 62.02 1xdh s THR 217 Cb 0.21 -2.39 0.22 0.00 0.01 0.00 0.00 72.50 70.55 1xdh s THR 217 CO 0.19 0.51 1.66 -1.54 -0.69 0.00 0.00 174.62 174.75 1xdh n SER 218 N 3.58 0.75 -4.72 3.53 3.41 -1.26 -0.77 113.62 118.14 1xdh n SER 218 Ca -0.18 0.44 -0.31 0.00 -0.26 0.00 0.00 58.87 58.56 1xdh n SER 218 Cb 0.53 -0.52 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1xdh n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xdh s ALA 219 N -3.11 3.83 -0.06 7.33 0.00 -1.26 -4.40 121.76 124.09 1xdh s ALA 219 Ca 0.10 -1.01 -0.20 0.00 0.00 0.00 0.00 51.96 50.85 1xdh s ALA 219 Cb 0.13 0.04 -0.05 0.00 0.00 0.00 0.00 23.12 23.25 1xdh s ALA 219 CO 0.63 -0.06 0.57 0.42 0.00 0.00 0.00 175.76 177.32 1xdh s ILE 220 N -2.82 5.04 -0.11 0.00 -1.09 -0.83 -2.80 121.20 118.58 1xdh s ILE 220 Ca 0.16 1.17 -0.01 0.00 -2.23 0.00 0.00 60.65 59.74 1xdh s ILE 220 Cb 0.04 -3.91 -0.03 0.00 -1.58 0.00 0.00 42.46 36.99 1xdh s ILE 220 CO 0.08 0.35 -0.07 -0.89 -1.23 0.00 0.00 174.94 173.19 1xdh s THR 221 N 0.30 3.65 0.03 2.92 2.01 -0.70 -1.52 115.64 122.32 1xdh s THR 221 Ca 0.30 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 61.86 1xdh s THR 221 Cb -0.17 -2.54 -0.02 0.00 0.01 0.00 0.00 72.50 69.78 1xdh s THR 221 CO 0.15 0.54 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.85 1xdh s VAL 222 N -0.13 0.58 0.34 3.82 1.01 -0.08 -1.63 120.40 124.30 1xdh s VAL 222 Ca 0.01 -0.91 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 1xdh s VAL 222 Cb -0.13 -0.61 -0.12 0.00 0.00 0.00 0.00 36.38 35.52 1xdh s VAL 222 CO 0.03 -0.24 1.24 -2.65 0.00 0.00 0.00 175.10 173.47 1xdh n PRO 223 N 1.79 1.99 -0.31 2.72 -0.02 -1.23 -0.92 135.00 139.02 1xdh n PRO 223 Ca -0.20 0.70 -0.03 0.00 -2.02 0.00 0.00 63.50 61.95 1xdh n PRO 223 Cb 0.55 -2.25 0.12 0.00 -0.02 0.00 0.00 33.50 31.91 1xdh n PRO 223 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1xdh h THR 224 N 2.43 1.25 -0.27 3.45 1.35 -1.89 -0.92 112.91 118.30 1xdh h THR 224 Ca -0.45 -0.59 -0.01 0.00 -0.55 0.00 0.00 66.41 64.82 1xdh h THR 224 Cb 1.29 0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 67.75 1xdh h THR 224 CO 0.62 0.27 0.15 -0.78 -0.25 0.00 0.00 175.52 175.53 1xdh h ASP 225 N 1.21 0.34 -0.53 5.36 3.58 -1.97 -0.91 116.42 123.50 1xdh h ASP 225 Ca 0.31 -0.09 0.06 0.00 0.42 0.00 0.00 57.03 57.73 1xdh h ASP 225 Cb -0.00 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 40.90 1xdh h ASP 225 CO -0.05 0.33 0.23 0.15 -2.88 0.00 0.00 179.24 177.02 1xdh h PHE 226 N 0.32 0.40 -0.40 0.28 3.04 -1.80 -1.66 116.94 117.13 1xdh h PHE 226 Ca 0.09 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.04 1xdh h PHE 226 Cb 0.07 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 38.46 1xdh h PHE 226 CO -0.03 0.16 0.14 1.25 -2.02 0.00 0.00 178.31 177.81 1xdh h LEU 227 N 0.43 0.57 -0.49 0.59 5.85 -0.84 0.32 115.31 121.75 1xdh h LEU 227 Ca 0.25 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1xdh h LEU 227 Cb 0.23 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1xdh h LEU 227 CO -0.22 0.60 0.29 -1.13 -0.34 0.00 0.00 178.44 177.65 1xdh h ASN 228 N 0.51 0.48 -0.44 1.25 -0.00 -0.92 -1.77 115.58 114.68 1xdh h ASN 228 Ca 0.13 0.00 -0.10 0.00 -0.00 0.00 0.00 56.30 56.33 1xdh h ASN 228 Cb 0.22 -0.10 -0.01 0.00 -0.00 0.00 0.00 38.32 38.43 1xdh h ASN 228 CO -0.01 0.34 -0.13 0.11 -0.00 0.00 0.00 177.43 177.75 1xdh h LYS 229 N 0.59 0.87 -0.74 6.67 1.57 -1.12 -2.99 116.57 121.42 1xdh h LYS 229 Ca 0.19 -0.34 0.16 0.00 -1.87 0.00 0.00 60.65 58.80 1xdh h LYS 229 Cb 0.00 -0.04 -0.11 0.00 0.08 0.00 0.00 32.23 32.16 1xdh h LYS 229 CO -0.08 0.98 0.15 0.52 -0.57 0.00 0.00 179.45 180.45 1xdh h MET 230 N 0.70 0.23 -0.01 3.15 2.86 -0.54 -2.81 114.93 118.50 1xdh h MET 230 Ca 0.11 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1xdh h MET 230 Cb 0.67 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1xdh h MET 230 CO 0.05 0.15 -0.04 1.28 1.06 0.00 0.00 176.91 179.41 1xdh n LEU 231 N -5.19 1.17 -0.07 1.22 4.77 -0.70 -4.65 117.00 113.54 1xdh n LEU 231 Ca 0.14 -0.37 -0.04 0.00 -0.03 0.00 0.00 56.01 55.72 1xdh n LEU 231 Cb 0.47 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 1xdh n LEU 231 CO 0.11 0.20 0.50 1.56 -1.33 0.00 0.00 177.39 178.43 1xdh h GLN 232 N 1.77 -0.07 -1.70 3.23 4.20 -1.39 -3.05 115.11 118.10 1xdh h GLN 232 Ca 0.00 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.11 1xdh h GLN 232 Cb 0.42 0.02 -0.41 0.00 0.30 0.00 0.00 27.48 27.81 1xdh h GLN 232 CO 0.00 -0.04 -0.56 -1.71 -0.67 0.00 0.00 178.83 175.85 1xdh n ASN 233 N -3.53 4.92 -0.40 1.46 2.85 -1.26 -4.75 115.26 114.54 1xdh n ASN 233 Ca -0.00 -3.72 0.08 0.00 -0.11 0.00 0.00 54.58 50.82 1xdh n ASN 233 Cb 0.09 -0.53 0.00 0.00 1.24 0.00 0.00 39.78 40.58 1xdh n ASN 233 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1xdh n LEU 234 N -0.44 1.72 -3.73 1.20 4.77 -1.15 -4.98 117.00 114.40 1xdh n LEU 234 Ca 0.39 -0.79 -0.26 0.00 -0.03 0.00 0.00 56.01 55.32 1xdh n LEU 234 Cb 0.57 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.72 1xdh n LEU 234 CO 0.35 0.33 0.18 0.47 -1.33 0.00 0.00 177.39 177.39 1xdh n ASP 235 N -0.01 -5.53 -4.58 -1.43 8.00 -1.26 -4.78 116.55 106.96 1xdh n ASP 235 Ca 0.07 -0.65 -0.34 0.00 0.71 0.00 0.00 54.79 54.58 1xdh n ASP 235 Cb 0.35 -4.55 -0.11 0.00 -0.02 0.00 0.00 41.12 36.80 1xdh n ASP 235 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xdh s VAL 236 N -3.32 4.27 -0.28 2.53 1.01 -1.26 -4.65 120.40 118.69 1xdh s VAL 236 Ca 0.59 -0.23 -0.19 0.00 0.00 0.00 0.00 61.98 62.15 1xdh s VAL 236 Cb -0.28 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1xdh s VAL 236 CO 0.77 0.51 0.57 -0.63 0.00 0.00 0.00 175.10 176.32 1xdh s ILE 237 N 0.07 5.01 -0.34 2.22 1.01 0.36 -4.89 121.20 124.64 1xdh s ILE 237 Ca 0.02 0.85 -0.20 0.00 0.00 0.00 0.00 60.65 61.32 1xdh s ILE 237 Cb -0.13 -3.92 -0.00 0.00 0.01 0.00 0.00 42.46 38.42 1xdh s ILE 237 CO 0.02 -0.03 0.63 -0.75 0.00 0.00 0.00 174.94 174.80 1xdh s LYS 238 N 2.45 3.75 0.05 2.79 2.20 -1.26 -0.60 119.74 129.12 1xdh s LYS 238 Ca 0.23 0.13 -0.31 0.00 -0.36 0.00 0.00 55.97 55.66 1xdh s LYS 238 Cb -0.15 -3.78 -0.08 0.00 -1.51 0.00 0.00 37.83 32.31 1xdh s LYS 238 CO 0.10 -0.67 1.59 0.08 -0.36 0.00 0.00 175.35 176.09 1xdh s VAL 239 N 2.66 3.20 0.05 4.02 1.01 -0.56 -4.86 120.40 125.91 1xdh s VAL 239 Ca 0.24 0.64 -0.37 0.00 0.00 0.00 0.00 61.98 62.49 1xdh s VAL 239 Cb -0.15 -3.41 -0.16 0.00 0.00 0.00 0.00 36.38 32.66 1xdh s VAL 239 CO 0.14 -0.00 1.40 -2.65 0.00 0.00 0.00 175.10 173.99 1xdh n PRO 240 N 5.50 1.19 -0.94 2.72 -0.02 -1.26 -1.40 135.00 140.79 1xdh n PRO 240 Ca 0.15 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1xdh n PRO 240 Cb 0.41 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1xdh n PRO 240 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1xdh n PHE 241 N 2.92 0.00 -4.77 6.00 3.72 -1.26 -4.99 117.46 119.08 1xdh n PHE 241 Ca 0.19 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.29 1xdh n PHE 241 Cb 0.19 -1.18 -0.13 0.00 -0.94 0.00 0.00 39.48 37.41 1xdh n PHE 241 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1xdh s LEU 242 N 0.00 2.47 -1.34 4.37 1.43 -0.50 -5.02 118.68 120.10 1xdh s LEU 242 Ca 0.00 -0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 52.55 1xdh s LEU 242 Cb 0.00 -1.45 -0.11 0.00 0.03 0.00 0.00 46.19 44.66 1xdh s LEU 242 CO 0.00 0.26 2.99 -0.81 0.23 0.00 0.00 176.35 179.03 1xdh n PRO 243 N 1.70 3.33 -3.77 1.29 -0.04 -1.26 -4.42 135.00 131.83 1xdh n PRO 243 Ca -0.16 -1.96 -0.29 0.00 -0.04 0.00 0.00 63.50 61.05 1xdh n PRO 243 Cb 0.52 -2.65 -0.16 0.00 -0.04 0.00 0.00 33.50 31.17 1xdh n PRO 243 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1xdh s PHE 244 N 2.09 1.39 -0.28 0.54 5.36 -1.26 -4.96 117.98 120.86 1xdh s PHE 244 Ca 0.67 -1.19 0.00 0.00 -0.96 0.00 0.00 56.93 55.46 1xdh s PHE 244 Cb 0.19 -1.26 0.05 0.00 -0.34 0.00 0.00 43.02 41.67 1xdh s PHE 244 CO -0.05 -0.69 -0.06 0.71 -1.46 0.00 0.00 175.22 173.67 1xdh s TYR 245 N 1.73 3.23 -0.10 10.12 2.02 -1.26 -1.50 117.35 131.60 1xdh s TYR 245 Ca 0.00 -2.02 -0.01 0.00 -0.37 0.00 0.00 57.07 54.67 1xdh s TYR 245 Cb -0.17 -2.02 -0.03 0.00 -0.40 0.00 0.00 41.96 39.33 1xdh s TYR 245 CO -0.11 -0.83 -0.03 0.08 -1.57 0.00 0.00 175.55 173.08 1xdh s VAL 246 N 1.20 3.99 0.07 0.71 1.01 0.23 -0.81 120.40 126.80 1xdh s VAL 246 Ca -0.06 -0.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.46 1xdh s VAL 246 Cb -0.19 -2.68 0.01 0.00 0.00 0.00 0.00 36.38 33.52 1xdh s VAL 246 CO -0.03 0.58 0.23 0.28 0.00 0.00 0.00 175.10 176.15 1xdh s THR 247 N -0.55 0.12 0.22 3.92 -1.32 -0.31 -0.48 115.64 117.23 1xdh s THR 247 Ca 0.09 -0.96 -0.31 0.00 -1.21 0.00 0.00 61.69 59.30 1xdh s THR 247 Cb -0.12 -1.13 -0.11 0.00 -1.51 0.00 0.00 72.50 69.64 1xdh s THR 247 CO 0.02 -0.53 1.55 -0.22 -2.21 0.00 0.00 174.62 173.23 1xdh s LEU 248 N -2.48 4.37 0.36 9.08 2.96 -1.26 -0.63 118.68 131.08 1xdh s LEU 248 Ca 0.00 2.73 0.08 0.00 -0.22 0.00 0.00 54.13 56.72 1xdh s LEU 248 Cb 0.02 -3.61 0.80 0.00 0.50 0.00 0.00 46.19 43.90 1xdh s LEU 248 CO -0.08 -0.82 1.90 0.00 -1.32 0.00 0.00 176.35 176.03 1xdh n ASN 250 N -4.52 3.65 -4.48 0.00 5.03 -1.26 -4.92 115.26 108.76 1xdh n ASN 250 Ca 0.15 -2.33 -0.53 0.00 0.87 0.00 0.00 54.58 52.74 1xdh n ASN 250 Cb 0.39 -0.50 -0.08 0.00 -1.02 0.00 0.00 39.78 38.58 1xdh n ASN 250 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1xdh n ASN 251 N 0.78 2.08 0.15 6.41 4.05 -0.64 -4.85 115.26 123.24 1xdh n ASN 251 Ca 0.19 0.58 0.13 0.00 0.45 0.00 0.00 54.58 55.93 1xdh n ASN 251 Cb 0.69 -1.21 0.51 0.00 1.23 0.00 0.00 39.78 41.01 1xdh n ASN 251 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 177.26 174.98 1xdh h SER 252 N 10.99 0.00 0.84 1.20 4.64 -1.91 -3.09 113.55 126.22 1xdh h SER 252 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1xdh h SER 252 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1xdh h SER 252 CO 1.01 0.00 -0.17 0.29 -0.87 0.00 0.00 176.83 177.10 1xdh n LYS 253 N -2.38 0.01 -2.06 4.77 5.02 -1.26 -4.91 118.16 117.35 1xdh n LYS 253 Ca 0.02 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 1xdh n LYS 253 Cb 0.26 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 1xdh n LYS 253 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1xdh s LEU 254 N -3.04 4.34 0.72 -0.35 1.43 -1.17 -4.97 118.68 115.64 1xdh s LEU 254 Ca 0.13 2.32 -0.07 0.00 -1.03 0.00 0.00 54.13 55.48 1xdh s LEU 254 Cb 0.18 -3.56 0.07 0.00 0.03 0.00 0.00 46.19 42.91 1xdh s LEU 254 CO 0.59 -0.81 1.03 -2.16 0.23 0.00 0.00 176.35 175.22 1xdh s PRO 255 N 2.54 2.13 -0.19 1.29 0.04 -1.26 -4.82 135.00 134.72 1xdh s PRO 255 Ca 0.69 -0.27 -0.05 0.00 0.04 0.00 0.00 61.00 61.41 1xdh s PRO 255 Cb -0.36 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 1xdh s PRO 255 CO 0.30 -1.29 0.00 0.99 0.04 0.00 0.00 177.00 177.04 1xdh s THR 256 N -3.27 4.03 0.33 1.26 2.01 -1.26 -4.16 115.64 114.58 1xdh s THR 256 Ca 0.61 -0.29 -0.29 0.00 0.31 0.00 0.00 61.69 62.03 1xdh s THR 256 Cb -0.10 -2.81 -0.10 0.00 0.01 0.00 0.00 72.50 69.49 1xdh s THR 256 CO 0.45 0.44 1.32 -0.36 -0.69 0.00 0.00 174.62 175.78 1xdh s PHE 257 N 0.84 3.02 -0.14 4.92 0.40 -0.34 -4.55 117.98 122.12 1xdh s PHE 257 Ca 0.01 1.38 -0.02 0.00 -0.60 0.00 0.00 56.93 57.70 1xdh s PHE 257 Cb -0.14 -3.70 0.05 0.00 0.51 0.00 0.00 43.02 39.73 1xdh s PHE 257 CO 0.02 -1.95 0.02 -2.00 0.70 0.00 0.00 175.22 172.01 1xdh s GLU 258 N -1.73 0.66 -0.18 0.44 2.12 0.22 -0.67 118.70 119.55 1xdh s GLU 258 Ca 0.50 -0.19 -0.02 0.00 0.36 0.00 0.00 54.97 55.61 1xdh s GLU 258 Cb -0.40 -1.62 -0.01 0.00 0.26 0.00 0.00 34.13 32.36 1xdh s GLU 258 CO 0.53 -0.49 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.62 1xdh s PHE 259 N 1.91 2.90 0.05 5.30 0.40 0.38 -0.49 117.98 128.43 1xdh s PHE 259 Ca 0.02 -0.82 0.05 0.00 -0.60 0.00 0.00 56.93 55.57 1xdh s PHE 259 Cb -0.15 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.37 1xdh s PHE 259 CO -0.07 -0.40 -0.14 0.95 0.70 0.00 0.00 175.22 176.26 1xdh s THR 260 N 0.98 1.12 0.34 0.64 -4.23 -0.13 -0.58 115.64 113.78 1xdh s THR 260 Ca -0.01 -1.09 0.03 0.00 -1.18 0.00 0.00 61.69 59.44 1xdh s THR 260 Cb -0.15 -1.03 -0.01 0.00 1.34 0.00 0.00 72.50 72.65 1xdh s THR 260 CO -0.00 -0.06 0.10 -1.54 -0.54 0.00 0.00 174.62 172.58 1xdh n SER 261 N 1.72 1.42 -0.10 3.99 3.41 -0.24 -1.05 113.62 122.76 1xdh n SER 261 Ca -0.19 -2.75 0.08 0.00 -0.26 0.00 0.00 58.87 55.75 1xdh n SER 261 Cb 0.54 0.76 0.43 0.00 -0.26 0.00 0.00 64.21 65.68 1xdh n SER 261 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1xdh h GLU 262 N 0.00 0.56 0.07 4.33 5.08 -2.01 -3.20 114.58 119.40 1xdh h GLU 262 Ca -0.27 -0.03 -0.25 0.00 -1.00 0.00 0.00 59.36 57.81 1xdh h GLU 262 Cb 0.98 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1xdh h GLU 262 CO 0.42 0.37 -1.16 -0.91 -1.00 0.00 0.00 179.01 176.73 1xdh h ASN 263 N 0.57 0.22 -5.14 1.42 4.21 -1.95 -3.49 115.58 111.42 1xdh h ASN 263 Ca 0.26 -0.24 0.12 0.00 1.21 0.00 0.00 56.30 57.65 1xdh h ASN 263 Cb 0.29 -0.07 -0.07 0.00 -1.12 0.00 0.00 38.32 37.35 1xdh h ASN 263 CO -0.08 1.19 0.35 -0.83 -1.29 0.00 0.00 177.43 176.78 1xdh s GLY 264 N -4.71 -0.18 -0.06 2.83 0.00 -1.21 -4.99 107.32 99.00 1xdh s GLY 264 Ca -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 44.72 44.64 1xdh s GLY 264 CO 0.85 -0.03 -0.01 1.25 0.00 0.00 0.00 173.10 175.17 1xdh s LYS 265 N -3.61 0.57 -0.12 2.90 2.20 -1.26 -1.08 119.74 119.34 1xdh s LYS 265 Ca 0.11 0.07 0.03 0.00 -0.36 0.00 0.00 55.97 55.81 1xdh s LYS 265 Cb -0.04 -0.83 0.01 0.00 -1.51 0.00 0.00 37.83 35.46 1xdh s LYS 265 CO 0.04 -0.22 -0.21 0.71 -0.36 0.00 0.00 175.35 175.30 1xdh s TYR 266 N 1.57 2.49 0.16 4.03 2.02 0.26 -4.99 117.35 122.89 1xdh s TYR 266 Ca -0.01 -1.19 0.10 0.00 -0.37 0.00 0.00 57.07 55.60 1xdh s TYR 266 Cb -0.13 -1.70 -0.04 0.00 -0.40 0.00 0.00 41.96 39.68 1xdh s TYR 266 CO -0.03 -0.54 -0.21 0.95 -1.57 0.00 0.00 175.55 174.14 1xdh s THR 267 N 0.73 2.56 -0.29 -0.71 -4.23 -1.26 -0.47 115.64 111.97 1xdh s THR 267 Ca -0.10 -1.78 -0.01 0.00 -1.18 0.00 0.00 61.69 58.62 1xdh s THR 267 Cb -0.16 -2.19 0.09 0.00 1.34 0.00 0.00 72.50 71.58 1xdh s THR 267 CO 0.01 -0.01 0.08 -0.22 -0.54 0.00 0.00 174.62 173.93 1xdh s LEU 268 N -2.40 2.20 0.67 4.79 2.96 0.15 -4.96 118.68 122.09 1xdh s LEU 268 Ca 0.19 -1.51 -0.11 0.00 -0.22 0.00 0.00 54.13 52.48 1xdh s LEU 268 Cb -0.09 -0.88 -0.01 0.00 0.50 0.00 0.00 46.19 45.71 1xdh s LEU 268 CO 0.10 -0.39 1.06 -1.61 -1.32 0.00 0.00 176.35 174.19 1xdh s GLU 269 N 1.61 3.17 0.34 1.98 8.01 -1.26 -1.20 118.70 131.35 1xdh s GLU 269 Ca 0.07 0.73 0.12 0.00 0.01 0.00 0.00 54.97 55.89 1xdh s GLU 269 Cb -0.17 -2.03 0.93 0.00 -4.31 0.00 0.00 34.13 28.54 1xdh s GLU 269 CO -0.21 -0.87 1.75 -1.35 0.01 0.00 0.00 175.26 174.59 1xdh h PRO 270 N -0.54 0.54 -0.28 0.39 0.11 -1.88 -0.43 132.00 129.91 1xdh h PRO 270 Ca -0.44 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.71 1xdh h PRO 270 Cb 1.21 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1xdh h PRO 270 CO 0.61 0.36 0.26 1.05 -0.21 0.00 0.00 178.00 180.07 1xdh h GLU 271 N 0.55 0.00 0.00 1.05 4.11 -1.92 -0.09 114.58 118.28 1xdh h GLU 271 Ca 0.62 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.81 1xdh h GLU 271 Cb 1.26 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.47 1xdh h GLU 271 CO -0.41 0.00 -1.50 1.88 0.07 0.00 0.00 179.01 179.05 1xdh h TYR 272 N 0.00 0.00 -0.02 2.06 0.05 -1.43 -3.38 116.97 114.25 1xdh h TYR 272 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.91 1xdh h TYR 272 Cb 0.65 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.39 1xdh h TYR 272 CO 0.00 0.85 -0.31 2.48 -1.05 0.00 0.00 178.16 180.13 1xdh n TYR 273 N -3.03 0.00 -3.41 4.88 0.18 -0.73 -4.79 117.16 110.26 1xdh n TYR 273 Ca -0.12 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.29 1xdh n TYR 273 Cb 0.96 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.86 1xdh n TYR 273 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1xdh s LEU 274 N -2.09 4.45 -0.12 -3.48 1.43 -0.12 -0.28 118.68 118.47 1xdh s LEU 274 Ca 0.17 1.05 0.03 0.00 -1.03 0.00 0.00 54.13 54.35 1xdh s LEU 274 Cb 0.15 -2.87 -0.00 0.00 0.03 0.00 0.00 46.19 43.50 1xdh s LEU 274 CO 0.42 0.24 -0.21 -1.10 0.23 0.00 0.00 176.35 175.93 1xdh s GLN 275 N -1.38 3.10 0.32 1.70 -1.52 -0.04 -4.91 119.66 116.94 1xdh s GLN 275 Ca 0.29 -0.84 -0.29 0.00 -1.95 0.00 0.00 55.36 52.58 1xdh s GLN 275 Cb -0.17 -2.40 -0.10 0.00 -0.22 0.00 0.00 33.01 30.12 1xdh s GLN 275 CO 0.17 0.14 1.37 -1.01 -0.25 0.00 0.00 175.29 175.71 1xdh s HIS 276 N 0.46 2.94 -0.40 0.91 3.76 -1.26 -0.52 115.29 121.19 1xdh s HIS 276 Ca -0.15 1.28 0.12 0.00 -0.15 0.00 0.00 55.06 56.16 1xdh s HIS 276 Cb -0.17 -3.78 0.40 0.00 1.11 0.00 0.00 32.58 30.13 1xdh s HIS 276 CO 0.06 -2.27 0.91 0.44 -0.85 0.00 0.00 174.74 173.03 1xdh n ILE 277 N 1.03 1.18 -0.14 0.60 -5.35 -0.41 -4.83 119.36 111.44 1xdh n ILE 277 Ca 0.02 -4.27 0.13 0.00 -0.27 0.00 0.00 62.75 58.35 1xdh n ILE 277 Cb 0.41 -0.29 0.47 0.00 -1.74 0.00 0.00 39.64 38.50 1xdh n ILE 277 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1xdh h GLU 278 N 2.93 0.46 0.00 6.28 4.57 -1.71 -0.72 114.58 126.39 1xdh h GLU 278 Ca 0.07 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1xdh h GLU 278 Cb 0.96 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.44 1xdh h GLU 278 CO 0.61 0.31 -0.09 -0.44 -1.18 0.00 0.00 179.01 178.21 1xdh h ASP 279 N 0.48 0.00 -0.00 1.04 3.45 -1.93 -2.72 116.42 116.74 1xdh h ASP 279 Ca 0.33 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.77 1xdh h ASP 279 Cb 0.63 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.41 1xdh h ASP 279 CO -0.10 0.09 -0.05 0.58 -1.57 0.00 0.00 179.24 178.18 1xdh h VAL 280 N 0.00 1.60 -1.96 -1.35 2.07 -1.54 -3.48 116.25 111.59 1xdh h VAL 280 Ca -0.00 -1.83 0.08 0.00 0.82 0.00 0.00 66.70 65.77 1xdh h VAL 280 Cb 0.48 2.82 -0.19 0.00 -1.52 0.00 0.00 31.29 32.89 1xdh h VAL 280 CO 0.01 0.48 0.49 -0.83 0.02 0.00 0.00 177.57 177.74 1xdh s GLY 281 N -3.78 -0.40 0.26 2.17 0.00 -1.02 -5.11 107.32 99.44 1xdh s GLY 281 Ca -0.17 1.46 -0.31 0.00 0.00 0.00 0.00 44.72 45.69 1xdh s GLY 281 CO 0.70 0.68 1.61 -1.55 0.00 0.00 0.00 173.10 174.53 1xdh n PRO 282 N 0.26 2.61 -1.21 2.90 -0.04 -1.25 -2.35 135.00 135.93 1xdh n PRO 282 Ca -0.10 0.93 -0.07 0.00 -0.04 0.00 0.00 63.50 64.22 1xdh n PRO 282 Cb 0.60 -2.72 -0.03 0.00 -0.04 0.00 0.00 33.50 31.31 1xdh n PRO 282 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xdh n GLY 283 N 2.71 0.85 3.88 0.55 0.00 -1.26 -4.98 105.19 106.93 1xdh n GLY 283 Ca 0.11 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 1xdh n GLY 283 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xdh s LEU 284 N -1.62 4.34 0.17 0.99 1.43 -0.99 -1.09 118.68 121.91 1xdh s LEU 284 Ca 0.00 0.68 0.04 0.00 -1.03 0.00 0.00 54.13 53.82 1xdh s LEU 284 Cb 0.00 -2.96 -0.05 0.00 0.03 0.00 0.00 46.19 43.21 1xdh s LEU 284 CO 0.00 0.17 -0.07 0.00 0.23 0.00 0.00 176.35 176.68 1xdh s MET 286 N -3.79 2.06 -0.14 0.00 0.23 0.33 -1.16 119.30 116.82 1xdh s MET 286 Ca 0.20 -1.02 -0.29 0.00 -1.03 0.00 0.00 55.69 53.55 1xdh s MET 286 Cb 0.04 -2.22 -0.01 0.00 -1.53 0.00 0.00 34.83 31.10 1xdh s MET 286 CO 0.03 0.52 1.12 -0.51 -2.03 0.00 0.00 175.02 174.15 1xdh s LEU 287 N -1.77 4.20 -1.40 0.18 1.43 0.01 -0.86 118.68 120.46 1xdh s LEU 287 Ca 0.17 1.59 -0.10 0.00 -1.03 0.00 0.00 54.13 54.76 1xdh s LEU 287 Cb -0.11 -3.55 0.08 0.00 0.03 0.00 0.00 46.19 42.64 1xdh s LEU 287 CO 0.08 -0.61 2.28 -3.20 0.23 0.00 0.00 176.35 175.13 1xdh n ASN 288 N 5.78 6.05 -3.86 2.29 5.15 0.62 -4.59 115.26 126.70 1xdh n ASN 288 Ca 0.11 -2.94 -0.12 0.00 -0.60 0.00 0.00 54.58 51.03 1xdh n ASN 288 Cb 0.46 -1.52 -0.12 0.00 -0.53 0.00 0.00 39.78 38.08 1xdh n ASN 288 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1xdh s ILE 289 N 1.16 0.04 0.04 -1.44 1.01 -1.26 -1.97 121.20 118.77 1xdh s ILE 289 Ca 0.50 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.86 1xdh s ILE 289 Cb 0.14 -0.25 -0.03 0.00 0.01 0.00 0.00 42.46 42.33 1xdh s ILE 289 CO -0.05 -0.16 -0.04 -0.51 0.00 0.00 0.00 174.94 174.17 1xdh s ILE 290 N -0.52 0.28 -0.07 2.92 2.07 -0.58 -4.92 121.20 120.38 1xdh s ILE 290 Ca -0.06 -1.23 -0.23 0.00 -1.41 0.00 0.00 60.65 57.72 1xdh s ILE 290 Cb -0.04 -0.73 -0.04 0.00 0.13 0.00 0.00 42.46 41.78 1xdh s ILE 290 CO 0.00 -0.61 0.67 -0.83 -1.91 0.00 0.00 174.94 172.26 1xdh s GLY 291 N -1.94 2.59 -0.18 1.50 0.00 -1.26 -0.90 107.32 107.14 1xdh s GLY 291 Ca -0.07 0.09 -0.08 0.00 0.00 0.00 0.00 44.72 44.66 1xdh s GLY 291 CO -0.03 1.11 0.40 -2.27 0.00 0.00 0.00 173.10 172.30 1xdh s LEU 292 N 0.73 -0.33 -0.21 0.66 2.96 -0.09 -4.84 118.68 117.55 1xdh s LEU 292 Ca 0.36 0.90 -0.07 0.00 -0.22 0.00 0.00 54.13 55.09 1xdh s LEU 292 Cb -0.17 1.27 -0.04 0.00 0.50 0.00 0.00 46.19 47.75 1xdh s LEU 292 CO 0.17 -0.21 0.07 -1.81 -1.32 0.00 0.00 176.35 173.24 1xdh s ASP 293 N 2.01 5.44 0.43 3.68 1.01 -1.26 -3.98 116.67 124.00 1xdh s ASP 293 Ca -0.05 -0.03 0.08 0.00 0.71 0.00 0.00 52.55 53.25 1xdh s ASP 293 Cb -0.10 -1.95 0.01 0.00 1.01 0.00 0.00 42.92 41.89 1xdh s ASP 293 CO -0.12 0.09 0.54 -0.36 0.21 0.00 0.00 175.17 175.53 1xdh s PHE 294 N 0.87 2.66 0.35 4.23 0.40 -1.26 -5.01 117.98 120.23 1xdh s PHE 294 Ca 0.04 -0.45 0.08 0.00 -0.60 0.00 0.00 56.93 55.99 1xdh s PHE 294 Cb -0.14 -2.32 0.79 0.00 0.51 0.00 0.00 43.02 41.86 1xdh s PHE 294 CO 0.02 -0.41 1.89 -1.35 0.70 0.00 0.00 175.22 176.07 1xdh h PRO 295 N 0.69 0.70 -6.14 0.24 0.11 -2.02 -3.39 132.00 122.19 1xdh h PRO 295 Ca -0.39 -0.04 -0.68 0.00 0.11 0.00 0.00 66.00 64.99 1xdh h PRO 295 Cb 1.28 -0.16 -0.19 0.00 0.11 0.00 0.00 31.00 32.04 1xdh h PRO 295 CO 0.47 0.46 -0.69 0.08 -0.21 0.00 0.00 178.00 178.12 1xdh s VAL 296 N -5.69 3.76 -0.10 3.15 1.01 -1.26 -5.07 120.40 116.21 1xdh s VAL 296 Ca -0.10 -0.47 -0.36 0.00 0.00 0.00 0.00 61.98 61.05 1xdh s VAL 296 Cb 0.21 -2.54 -0.13 0.00 0.00 0.00 0.00 36.38 33.92 1xdh s VAL 296 CO 0.79 0.59 1.79 -2.65 0.00 0.00 0.00 175.10 175.61 1xdh n PRO 297 N 2.18 1.88 -3.92 2.72 -0.02 -1.26 -4.93 135.00 131.64 1xdh n PRO 297 Ca -0.18 0.69 -0.13 0.00 -2.02 0.00 0.00 63.50 61.86 1xdh n PRO 297 Cb 0.53 -2.48 -0.14 0.00 -0.02 0.00 0.00 33.50 31.39 1xdh n PRO 297 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1xdh s THR 298 N 3.41 0.08 -0.12 3.45 2.01 -1.26 -2.47 115.64 120.74 1xdh s THR 298 Ca 0.92 -0.02 -0.04 0.00 0.31 0.00 0.00 61.69 62.86 1xdh s THR 298 Cb -0.79 -0.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.59 1xdh s THR 298 CO 0.53 0.03 0.01 -0.36 -0.69 0.00 0.00 174.62 174.15 1xdh s PHE 299 N 0.10 3.17 -0.38 4.92 0.40 0.13 -3.57 117.98 122.75 1xdh s PHE 299 Ca -0.01 0.08 -0.16 0.00 -0.60 0.00 0.00 56.93 56.24 1xdh s PHE 299 Cb -0.02 -1.89 0.00 0.00 0.51 0.00 0.00 43.02 41.63 1xdh s PHE 299 CO -0.00 0.31 0.39 0.42 0.70 0.00 0.00 175.22 177.03 1xdh s ILE 300 N -0.37 5.14 -1.03 0.64 1.01 -0.65 -0.44 121.20 125.49 1xdh s ILE 300 Ca 0.07 -0.18 -0.21 0.00 0.00 0.00 0.00 60.65 60.34 1xdh s ILE 300 Cb -0.12 -3.92 0.07 0.00 0.01 0.00 0.00 42.46 38.50 1xdh s ILE 300 CO 0.02 -0.25 1.41 -0.76 0.00 0.00 0.00 174.94 175.36 1xdh s LEU 301 N 2.04 3.89 0.00 2.97 1.43 0.15 -1.72 118.68 127.44 1xdh s LEU 301 Ca 0.11 -1.70 0.00 0.00 -1.03 0.00 0.00 54.13 51.52 1xdh s LEU 301 Cb -0.17 -2.53 0.00 0.00 0.03 0.00 0.00 46.19 43.52 1xdh s LEU 301 CO 0.12 -1.37 0.00 0.61 0.23 0.00 0.00 176.35 175.94 1xdh n GLY 302 N 6.40 0.81 0.37 -3.19 0.00 -1.12 -1.63 105.19 106.83 1xdh n GLY 302 Ca 0.33 -1.69 0.13 0.00 0.00 0.00 0.00 46.02 44.78 1xdh n GLY 302 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xdh h ASP 303 N 0.00 0.74 -0.96 1.61 3.32 -1.05 -1.47 116.42 118.61 1xdh h ASP 303 Ca 0.00 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.14 1xdh h ASP 303 Cb 0.00 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.44 1xdh h ASP 303 CO 0.00 0.31 0.64 -0.65 -1.72 0.00 0.00 179.24 177.81 1xdh h PRO 304 N 0.75 1.25 -0.17 3.56 0.11 -1.82 0.17 132.00 135.85 1xdh h PRO 304 Ca 0.54 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 66.55 1xdh h PRO 304 Cb 0.85 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 1xdh h PRO 304 CO -0.31 0.83 0.04 0.35 -0.21 0.00 0.00 178.00 178.70 1xdh h PHE 305 N 1.29 0.28 0.00 0.65 3.57 -1.59 -3.15 116.94 117.98 1xdh h PHE 305 Ca 0.36 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.83 1xdh h PHE 305 Cb -0.12 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.54 1xdh h PHE 305 CO -0.00 0.40 0.00 0.52 -2.23 0.00 0.00 178.31 177.00 1xdh h MET 306 N 0.08 0.00 -0.18 1.11 2.86 -0.94 -0.35 114.93 117.51 1xdh h MET 306 Ca 0.05 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.54 1xdh h MET 306 Cb 0.26 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1xdh h MET 306 CO 0.00 0.00 -0.52 -0.09 1.06 0.00 0.00 176.91 177.36 1xdh h ARG 307 N 0.00 0.50 0.12 1.72 2.43 -0.64 -3.27 114.38 115.24 1xdh h ARG 307 Ca 0.00 -0.30 -0.18 0.00 -0.81 0.00 0.00 59.98 58.69 1xdh h ARG 307 Cb 0.49 0.03 0.02 0.00 -0.42 0.00 0.00 29.97 30.08 1xdh h ARG 307 CO 0.00 0.90 -0.81 -0.22 -1.51 0.00 0.00 179.97 178.33 1xdh h LYS 308 N 0.39 0.25 -4.97 0.20 3.64 -1.38 -3.46 116.57 111.25 1xdh h LYS 308 Ca 0.01 -0.43 -0.65 0.00 -1.27 0.00 0.00 60.65 58.30 1xdh h LYS 308 Cb 1.04 0.16 -0.25 0.00 -0.41 0.00 0.00 32.23 32.77 1xdh h LYS 308 CO 0.09 1.21 -0.67 0.71 -2.27 0.00 0.00 179.45 178.52 1xdh s TYR 309 N -2.41 3.03 0.26 1.91 2.02 -0.21 -0.96 117.35 120.98 1xdh s TYR 309 Ca -0.15 -0.69 -0.31 0.00 -0.37 0.00 0.00 57.07 55.55 1xdh s TYR 309 Cb 0.01 -2.18 -0.13 0.00 -0.40 0.00 0.00 41.96 39.26 1xdh s TYR 309 CO 0.80 -0.46 1.36 0.34 -1.57 0.00 0.00 175.55 176.02 1xdh n PHE 310 N 4.86 2.11 -4.60 2.71 7.35 0.58 -4.40 117.46 126.07 1xdh n PHE 310 Ca -0.17 0.48 -0.22 0.00 -0.76 0.00 0.00 57.45 56.77 1xdh n PHE 310 Cb 0.51 -2.44 -0.15 0.00 0.35 0.00 0.00 39.48 37.75 1xdh n PHE 310 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1xdh s THR 311 N -0.30 1.06 -0.14 -2.13 -4.23 -1.09 -2.00 115.64 106.81 1xdh s THR 311 Ca 0.66 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 60.61 1xdh s THR 311 Cb -0.64 -0.89 -0.01 0.00 1.34 0.00 0.00 72.50 72.29 1xdh s THR 311 CO 0.53 0.30 -0.15 -0.69 -0.54 0.00 0.00 174.62 174.07 1xdh s VAL 312 N -0.18 2.85 -0.35 2.29 1.01 0.99 -1.06 120.40 125.94 1xdh s VAL 312 Ca 0.03 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 1xdh s VAL 312 Cb -0.07 -2.19 0.08 0.00 0.00 0.00 0.00 36.38 34.21 1xdh s VAL 312 CO -0.00 0.52 0.08 -0.36 0.00 0.00 0.00 175.10 175.34 1xdh s PHE 313 N 0.51 3.48 -0.38 5.22 0.40 0.92 -0.15 117.98 127.98 1xdh s PHE 313 Ca -0.10 -2.30 -0.03 0.00 -0.60 0.00 0.00 56.93 53.90 1xdh s PHE 313 Cb -0.16 -2.67 0.09 0.00 0.51 0.00 0.00 43.02 40.79 1xdh s PHE 313 CO 0.04 -0.90 0.15 0.34 0.70 0.00 0.00 175.22 175.56 1xdh s ASP 314 N 1.41 5.21 0.13 1.36 -1.08 -0.25 -1.38 116.67 122.06 1xdh s ASP 314 Ca 0.03 -1.75 -0.12 0.00 -0.52 0.00 0.00 52.55 50.19 1xdh s ASP 314 Cb -0.21 -1.82 -0.07 0.00 -1.46 0.00 0.00 42.92 39.36 1xdh s ASP 314 CO -0.04 -0.46 1.44 1.88 0.52 0.00 0.00 175.17 178.51 1xdh h TYR 315 N 8.08 1.06 -0.84 -5.34 -1.99 -1.29 -0.20 116.97 116.45 1xdh h TYR 315 Ca -0.16 -0.34 0.05 0.00 2.00 0.00 0.00 58.73 60.27 1xdh h TYR 315 Cb 1.06 -0.21 -0.06 0.00 2.00 0.00 0.00 36.73 39.52 1xdh h TYR 315 CO 0.58 1.16 0.53 -0.44 -0.00 0.00 0.00 178.16 179.98 1xdh h ASP 316 N 0.66 0.85 -0.26 3.88 3.32 -1.92 -2.96 116.42 120.00 1xdh h ASP 316 Ca 0.04 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1xdh h ASP 316 Cb 1.02 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.40 1xdh h ASP 316 CO 0.10 0.57 0.00 0.59 -1.72 0.00 0.00 179.24 178.78 1xdh n ASN 317 N -4.60 2.81 -3.86 6.45 3.02 -1.23 -5.00 115.26 112.86 1xdh n ASN 317 Ca 0.11 -1.83 -0.25 0.00 -0.03 0.00 0.00 54.58 52.58 1xdh n ASN 317 Cb 0.13 -0.17 -0.00 0.00 -0.61 0.00 0.00 39.78 39.13 1xdh n ASN 317 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1xdh n HIS 318 N 0.90 -1.73 -3.85 3.10 8.25 -0.16 -4.89 115.22 116.83 1xdh n HIS 318 Ca 0.13 0.74 -0.09 0.00 -0.26 0.00 0.00 57.72 58.24 1xdh n HIS 318 Cb 0.44 -3.88 -0.07 0.00 1.12 0.00 0.00 29.99 27.60 1xdh n HIS 318 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1xdh s SER 319 N -4.29 0.05 -0.18 0.41 1.04 -0.77 -1.07 113.70 108.90 1xdh s SER 319 Ca 0.04 -0.67 -0.04 0.00 0.48 0.00 0.00 55.95 55.77 1xdh s SER 319 Cb -0.02 0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.47 1xdh s SER 319 CO 0.87 -0.79 -0.03 -0.69 0.98 0.00 0.00 173.24 173.58 1xdh s VAL 320 N -3.88 3.84 -0.08 5.02 1.01 0.05 -1.09 120.40 125.26 1xdh s VAL 320 Ca 0.08 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.56 1xdh s VAL 320 Cb 0.04 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1xdh s VAL 320 CO -0.08 0.46 0.32 -0.83 0.00 0.00 0.00 175.10 174.97 1xdh s GLY 321 N 0.70 2.33 -0.05 4.51 0.00 0.79 -0.50 107.32 115.10 1xdh s GLY 321 Ca -0.01 -0.37 0.02 0.00 0.00 0.00 0.00 44.72 44.35 1xdh s GLY 321 CO 0.02 0.15 -0.10 -0.42 0.00 0.00 0.00 173.10 172.75 1xdh s ILE 322 N -0.52 0.97 0.04 0.90 1.01 0.39 -0.01 121.20 123.98 1xdh s ILE 322 Ca 0.20 -0.40 -0.12 0.00 0.00 0.00 0.00 60.65 60.32 1xdh s ILE 322 Cb -0.15 -0.89 0.01 0.00 0.01 0.00 0.00 42.46 41.45 1xdh s ILE 322 CO 0.08 0.31 0.27 0.00 0.00 0.00 0.00 174.94 175.60 1xdh s ALA 323 N 0.57 -0.58 0.07 9.38 0.00 -0.85 -1.14 121.76 129.22 1xdh s ALA 323 Ca -0.11 -0.09 -0.30 0.00 0.00 0.00 0.00 51.96 51.45 1xdh s ALA 323 Cb -0.14 0.31 -0.09 0.00 0.00 0.00 0.00 23.12 23.20 1xdh s ALA 323 CO 0.02 -0.40 1.89 -1.17 0.00 0.00 0.00 175.76 176.11 1xdh s LEU 324 N -2.09 4.42 0.37 0.00 2.96 -1.25 -0.31 118.68 122.78 1xdh s LEU 324 Ca -0.05 2.69 -0.27 0.00 -0.22 0.00 0.00 54.13 56.28 1xdh s LEU 324 Cb -0.01 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 43.04 1xdh s LEU 324 CO -0.04 -1.03 1.33 0.00 -1.32 0.00 0.00 176.35 175.30 1xdh s ALA 325 N 3.68 3.40 0.21 5.97 0.00 -0.13 -1.09 121.76 133.79 1xdh s ALA 325 Ca 0.84 1.29 -0.31 0.00 0.00 0.00 0.00 51.96 53.79 1xdh s ALA 325 Cb -0.44 -3.50 -0.10 0.00 0.00 0.00 0.00 23.12 19.08 1xdh s ALA 325 CO 0.39 -0.78 1.52 0.15 0.00 0.00 0.00 175.76 177.04 1xdh s LYS 326 N -2.04 4.22 0.37 0.00 1.02 -0.27 -4.72 119.74 118.32 1xdh s LYS 326 Ca 0.53 2.36 0.07 0.00 0.02 0.00 0.00 55.97 58.95 1xdh s LYS 326 Cb -0.40 -3.12 0.72 0.00 -0.52 0.00 0.00 37.83 34.51 1xdh s LYS 326 CO 0.53 -0.54 1.93 0.87 -0.92 0.00 0.00 175.35 177.21 1xdh h LYS 327 N 5.96 0.42 -3.69 1.68 1.79 -1.93 -3.44 116.57 117.36 1xdh h LYS 327 Ca -0.44 -0.08 -0.20 0.00 -2.18 0.00 0.00 60.65 57.75 1xdh h LYS 327 Cb 1.21 -0.07 -0.26 0.00 -1.58 0.00 0.00 32.23 31.53 1xdh h LYS 327 CO 0.85 0.45 -0.66 -0.80 -1.08 0.00 0.00 179.45 178.21 1xdh s ASN 328 N -6.78 0.02 0.00 0.86 0.01 -1.26 -4.90 114.94 102.88 1xdh s ASN 328 Ca -0.07 -0.05 0.30 0.00 -0.71 0.00 0.00 52.86 52.33 1xdh s ASN 328 Cb 0.16 0.10 1.46 0.00 0.41 0.00 0.00 41.25 43.37 1xdh s ASN 328 CO 0.75 -0.09 1.98 0.18 -1.51 0.00 0.00 177.10 178.40