#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ued n HIS 3 N 0.00 3.71 -3.84 1.61 -0.00 -1.26 -4.86 115.22 110.58 1ued n HIS 3 Ca 0.00 -3.97 -0.33 0.00 -0.00 0.00 0.00 57.72 53.41 1ued n HIS 3 Cb 0.00 -0.59 -0.12 0.00 -0.00 0.00 0.00 29.99 29.28 1ued n HIS 3 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1ued s ASP 4 N -2.77 4.80 0.10 0.41 -1.08 -1.26 -5.08 116.67 111.78 1ued s ASP 4 Ca 0.43 -2.84 -0.23 0.00 -0.52 0.00 0.00 52.55 49.40 1ued s ASP 4 Cb 0.19 -1.74 -0.07 0.00 -1.46 0.00 0.00 42.92 39.84 1ued s ASP 4 CO -0.05 -0.32 0.68 -0.63 0.52 0.00 0.00 175.17 175.37 1ued s ILE 5 N -0.04 4.61 0.45 4.11 1.09 -1.26 -4.24 121.20 125.92 1ued s ILE 5 Ca 0.16 1.47 0.05 0.00 -1.10 0.00 0.00 60.65 61.23 1ued s ILE 5 Cb -0.23 -4.03 0.05 0.00 -1.06 0.00 0.00 42.46 37.20 1ued s ILE 5 CO -0.02 0.50 0.43 0.47 -0.10 0.00 0.00 174.94 176.22 1ued n ASP 6 N 1.92 2.22 -4.70 3.58 8.00 -0.75 -5.06 116.55 121.76 1ued n ASP 6 Ca -0.07 -2.45 -0.32 0.00 0.71 0.00 0.00 54.79 52.66 1ued n ASP 6 Cb 0.50 -0.12 0.14 0.00 -0.02 0.00 0.00 41.12 41.62 1ued n ASP 6 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1ued s GLN 7 N -3.92 1.41 0.32 -1.24 -1.52 -1.26 -4.90 119.66 108.55 1ued s GLN 7 Ca 0.32 1.55 -0.29 0.00 -1.95 0.00 0.00 55.36 54.99 1ued s GLN 7 Cb -0.03 -1.77 -0.10 0.00 -0.22 0.00 0.00 33.01 30.89 1ued s GLN 7 CO 0.21 -2.34 1.30 0.08 -0.25 0.00 0.00 175.29 174.28 1ued s VAL 8 N -2.55 2.78 0.27 1.09 1.01 -1.26 -4.92 120.40 116.83 1ued s VAL 8 Ca 0.68 0.78 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 1ued s VAL 8 Cb -0.23 -3.49 -0.13 0.00 0.00 0.00 0.00 36.38 32.52 1ued s VAL 8 CO 0.55 0.18 1.28 0.00 0.00 0.00 0.00 175.10 177.11 1ued n ALA 9 N 0.94 0.75 -1.71 5.51 0.00 -1.26 -4.87 120.51 119.86 1ued n ALA 9 Ca 0.00 0.40 -0.39 0.00 0.00 0.00 0.00 53.44 53.45 1ued n ALA 9 Cb 0.42 -2.20 0.04 0.00 0.00 0.00 0.00 19.45 17.71 1ued n ALA 9 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ued n PRO 10 N 1.35 1.57 -2.92 0.00 -0.02 -1.26 -4.66 135.00 129.07 1ued n PRO 10 Ca 0.10 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.74 1ued n PRO 10 Cb 0.32 -2.46 -0.05 0.00 -0.02 0.00 0.00 33.50 31.29 1ued n PRO 10 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1ued s LEU 11 N -2.87 4.08 0.07 2.45 2.96 -1.26 -3.09 118.68 121.02 1ued s LEU 11 Ca 0.71 0.71 0.08 0.00 -0.22 0.00 0.00 54.13 55.40 1ued s LEU 11 Cb -0.44 -3.12 -0.03 0.00 0.50 0.00 0.00 46.19 43.10 1ued s LEU 11 CO 0.50 -0.63 -0.18 -0.76 -1.32 0.00 0.00 176.35 173.96 1ued s LEU 12 N 3.01 2.65 0.16 -0.68 1.43 0.09 -4.98 118.68 120.35 1ued s LEU 12 Ca 0.34 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.67 1ued s LEU 12 Cb -0.14 -1.54 -0.07 0.00 0.03 0.00 0.00 46.19 44.47 1ued s LEU 12 CO 0.13 0.23 1.10 -0.13 0.23 0.00 0.00 176.35 177.91 1ued s ARG 13 N -1.67 4.58 -0.00 1.70 1.81 -1.26 -0.72 118.95 123.38 1ued s ARG 13 Ca 0.16 1.71 -0.33 0.00 -1.72 0.00 0.00 55.73 55.54 1ued s ARG 13 Cb -0.11 -3.29 -0.12 0.00 -0.45 0.00 0.00 34.95 30.98 1ued s ARG 13 CO 0.07 0.05 1.82 -1.91 -0.68 0.00 0.00 175.30 174.65 1ued n GLU 14 N 2.56 2.30 -0.72 3.54 2.13 0.26 -4.79 120.64 125.91 1ued n GLU 14 Ca 0.03 0.84 -0.32 0.00 0.66 0.00 0.00 57.16 58.37 1ued n GLU 14 Cb 0.46 -2.68 0.15 0.00 0.27 0.00 0.00 31.44 29.64 1ued n GLU 14 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1ued n PRO 15 N 5.94 -0.45 0.01 5.31 -0.02 -1.26 -4.91 135.00 139.62 1ued n PRO 15 Ca 0.21 -0.08 -0.10 0.00 -2.02 0.00 0.00 63.50 61.51 1ued n PRO 15 Cb 0.31 -2.11 -0.04 0.00 -0.02 0.00 0.00 33.50 31.63 1ued n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ued h ALA 16 N -1.77 -0.00 -0.97 3.55 0.00 -1.96 -2.93 119.26 115.18 1ued h ALA 16 Ca -0.44 0.04 -0.64 0.00 0.00 0.00 0.00 54.91 53.86 1ued h ALA 16 Cb 1.28 0.15 -0.30 0.00 0.00 0.00 0.00 17.79 18.92 1ued h ALA 16 CO 0.38 -0.54 0.72 0.09 0.00 0.00 0.00 179.25 179.90 1ued n ASN 17 N -5.20 6.97 -4.73 0.00 3.02 -1.26 -4.99 115.26 109.07 1ued n ASN 17 Ca -0.04 -3.77 -0.42 0.00 -0.03 0.00 0.00 54.58 50.32 1ued n ASN 17 Cb 0.13 -0.91 -0.03 0.00 -0.61 0.00 0.00 39.78 38.36 1ued n ASN 17 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1ued s PHE 18 N -3.74 2.92 0.00 3.10 5.36 -1.11 -2.04 117.98 122.47 1ued s PHE 18 Ca 0.63 0.52 0.00 0.00 -0.96 0.00 0.00 56.93 57.12 1ued s PHE 18 Cb 0.50 -4.06 0.00 0.00 -0.34 0.00 0.00 43.02 39.12 1ued s PHE 18 CO 0.01 -3.89 0.00 1.04 -1.46 0.00 0.00 175.22 170.92 1ued n GLN 19 N 3.59 -1.18 -4.00 10.12 6.02 -1.26 -4.98 117.38 125.69 1ued n GLN 19 Ca 0.14 0.30 -0.21 0.00 -0.01 0.00 0.00 57.00 57.21 1ued n GLN 19 Cb 0.37 -4.39 -0.03 0.00 1.02 0.00 0.00 30.24 27.21 1ued n GLN 19 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ued s LEU 20 N 0.00 4.09 0.38 1.08 1.43 -0.86 -5.02 118.68 119.77 1ued s LEU 20 Ca 0.00 -0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.09 1ued s LEU 20 Cb 0.00 -2.64 -0.04 0.00 0.03 0.00 0.00 46.19 43.54 1ued s LEU 20 CO 0.00 -0.08 0.19 -0.13 0.23 0.00 0.00 176.35 176.55 1ued s ARG 21 N -3.94 2.34 -0.27 1.70 0.52 -1.26 -0.91 118.95 117.13 1ued s ARG 21 Ca 0.34 -1.65 0.00 0.00 -0.52 0.00 0.00 55.73 53.90 1ued s ARG 21 Cb -0.08 -2.13 0.08 0.00 0.52 0.00 0.00 34.95 33.33 1ued s ARG 21 CO 0.27 -0.01 0.03 0.99 0.02 0.00 0.00 175.30 176.60 1ued s THR 22 N -2.49 1.27 0.00 0.02 2.01 -0.09 -4.57 115.64 111.78 1ued s THR 22 Ca 0.40 -1.36 0.00 0.00 0.31 0.00 0.00 61.69 61.04 1ued s THR 22 Cb -0.00 -1.78 0.00 0.00 0.01 0.00 0.00 72.50 70.73 1ued s THR 22 CO 0.23 -0.40 0.00 0.59 -0.69 0.00 0.00 174.62 174.35 1ued n ASN 23 N 4.72 0.00 0.16 3.53 5.03 -1.26 -2.02 115.26 125.42 1ued n ASN 23 Ca -0.06 0.00 0.12 0.00 0.87 0.00 0.00 54.58 55.52 1ued n ASN 23 Cb 0.43 0.00 0.21 0.00 -1.02 0.00 0.00 39.78 39.40 1ued n ASN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ued s ASP 25 N -5.45 6.00 0.52 0.00 1.01 -0.85 -4.89 116.67 113.00 1ued s ASP 25 Ca 0.07 0.64 -0.21 0.00 0.71 0.00 0.00 52.55 53.76 1ued s ASP 25 Cb 0.08 -1.91 -0.06 0.00 1.01 0.00 0.00 42.92 42.05 1ued s ASP 25 CO 0.67 -0.68 1.21 -2.84 0.21 0.00 0.00 175.17 173.75 1ued s PRO 26 N -4.68 3.40 0.63 8.23 0.02 -1.26 -0.91 135.00 140.42 1ued s PRO 26 Ca 0.48 1.87 -0.18 0.00 0.02 0.00 0.00 61.00 63.19 1ued s PRO 26 Cb -0.10 -2.22 -0.02 0.00 0.02 0.00 0.00 34.50 32.18 1ued s PRO 26 CO 0.42 -0.87 1.22 -1.58 -0.33 0.00 0.00 177.00 175.85 1ued s HIS 27 N -1.53 2.27 0.35 6.54 5.65 -0.08 -4.43 115.29 124.07 1ued s HIS 27 Ca 0.70 1.53 0.14 0.00 0.25 0.00 0.00 55.06 57.67 1ued s HIS 27 Cb -0.31 -3.51 1.02 0.00 -1.18 0.00 0.00 32.58 28.60 1ued s HIS 27 CO 0.36 -2.41 1.72 1.49 -0.65 0.00 0.00 174.74 175.26 1ued h GLU 28 N 0.56 0.44 -1.02 2.88 4.57 -1.92 -1.14 114.58 118.95 1ued h GLU 28 Ca -0.50 -0.03 0.27 0.00 -1.18 0.00 0.00 59.36 57.92 1ued h GLU 28 Cb 1.30 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 29.72 1ued h GLU 28 CO 0.54 0.29 0.69 -0.44 -1.18 0.00 0.00 179.01 178.91 1ued h ASP 29 N 0.45 0.29 0.25 1.04 3.45 -1.90 0.10 116.42 120.11 1ued h ASP 29 Ca 0.66 0.05 -0.15 0.00 0.43 0.00 0.00 57.03 58.02 1ued h ASP 29 Cb 1.46 -0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 40.22 1ued h ASP 29 CO -0.45 0.07 -0.57 0.78 -1.57 0.00 0.00 179.24 177.50 1ued h ASN 30 N 0.27 0.37 0.35 6.45 2.35 -1.46 -1.86 115.58 122.05 1ued h ASN 30 Ca 0.54 -0.20 -0.18 0.00 -0.55 0.00 0.00 56.30 55.91 1ued h ASN 30 Cb 1.62 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.87 1ued h ASN 30 CO -0.18 0.87 -0.74 -0.26 -1.65 0.00 0.00 177.43 175.47 1ued h PHE 31 N 0.25 0.44 -0.55 1.19 -1.00 -0.95 -2.09 116.94 114.23 1ued h PHE 31 Ca -0.00 -0.20 -0.04 0.00 2.81 0.00 0.00 57.97 60.54 1ued h PHE 31 Cb 1.08 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 40.55 1ued h PHE 31 CO 0.03 0.95 0.20 0.78 -1.61 0.00 0.00 178.31 178.65 1ued h GLY 32 N 1.44 0.91 0.95 -1.45 0.00 -1.03 -1.86 103.07 102.03 1ued h GLY 32 Ca -0.03 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 1ued h GLY 32 CO 0.12 0.48 0.19 -2.00 0.00 0.00 0.00 176.54 175.33 1ued h LEU 33 N 0.76 0.57 -2.42 3.11 5.85 -1.29 -2.30 115.31 119.59 1ued h LEU 33 Ca 0.18 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1ued h LEU 33 Cb 0.24 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1ued h LEU 33 CO -0.01 0.56 -0.01 -0.09 -0.34 0.00 0.00 178.44 178.55 1ued h ARG 34 N 0.54 0.00 0.00 1.25 9.65 -1.11 -1.57 114.38 123.14 1ued h ARG 34 Ca 0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 1ued h ARG 34 Cb 0.15 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 1ued h ARG 34 CO -0.02 0.01 0.00 0.00 2.80 0.00 0.00 179.97 182.76 1ued h ALA 35 N 1.99 1.00 -0.00 2.80 0.00 -0.74 -2.17 119.26 122.14 1ued h ALA 35 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ued h ALA 35 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ued h ALA 35 CO 0.00 0.00 -0.01 0.72 0.00 0.00 0.00 179.25 179.96 1ued n HIS 36 N -2.37 0.00 0.00 0.00 8.25 -0.59 -5.01 115.22 115.50 1ued n HIS 36 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1ued n HIS 36 Cb 0.20 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.26 1ued n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ued n GLY 37 N 1.09 3.35 0.26 -1.41 0.00 -0.82 -4.89 105.19 102.78 1ued n GLY 37 Ca 0.21 -1.89 0.13 0.00 0.00 0.00 0.00 46.02 44.47 1ued n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ued h PRO 38 N 0.00 0.00 -3.83 1.61 0.13 -1.94 -3.41 132.00 124.55 1ued h PRO 38 Ca 0.00 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.65 1ued h PRO 38 Cb 0.00 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 1ued h PRO 38 CO 0.00 0.12 -0.78 -1.17 -0.23 0.00 0.00 178.00 175.95 1ued s LEU 39 N -6.87 0.95 0.36 1.56 2.96 -1.26 -1.11 118.68 115.26 1ued s LEU 39 Ca -0.01 -0.34 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 1ued s LEU 39 Cb 0.12 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 46.16 1ued s LEU 39 CO 0.58 -0.20 0.11 0.68 -1.32 0.00 0.00 176.35 176.19 1ued s VAL 40 N 1.86 0.76 -0.04 1.68 -7.23 -0.45 -4.88 120.40 112.09 1ued s VAL 40 Ca 0.03 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.27 1ued s VAL 40 Cb -0.14 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.25 1ued s VAL 40 CO -0.07 0.00 -0.22 -0.13 -0.31 0.00 0.00 175.10 174.37 1ued s ARG 41 N -3.81 2.34 0.03 4.82 0.52 -1.18 -0.52 118.95 121.16 1ued s ARG 41 Ca 0.30 -0.86 0.03 0.00 -0.52 0.00 0.00 55.73 54.69 1ued s ARG 41 Cb 0.05 -2.17 -0.02 0.00 0.52 0.00 0.00 34.95 33.33 1ued s ARG 41 CO 0.15 0.53 -0.10 0.96 0.02 0.00 0.00 175.30 176.85 1ued s ILE 42 N -0.52 0.79 -0.08 1.52 -4.36 -0.36 -0.73 121.20 117.46 1ued s ILE 42 Ca 0.07 -0.91 0.03 0.00 -0.26 0.00 0.00 60.65 59.57 1ued s ILE 42 Cb -0.11 -0.76 0.01 0.00 1.25 0.00 0.00 42.46 42.85 1ued s ILE 42 CO 0.01 -0.13 -0.15 -0.69 0.24 0.00 0.00 174.94 174.21 1ued s VAL 43 N -0.94 1.39 -3.86 8.37 1.01 0.10 -2.10 120.40 124.37 1ued s VAL 43 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1ued s VAL 43 Cb -0.08 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.06 1ued s VAL 43 CO 0.01 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1ued n GLY 44 N 3.75 -0.55 0.31 4.51 0.00 -1.26 -0.57 105.19 111.38 1ued n GLY 44 Ca -0.22 -0.77 0.07 0.00 0.00 0.00 0.00 46.02 45.11 1ued n GLY 44 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ued h GLU 45 N 0.00 0.64 -0.60 1.61 4.81 -1.97 -0.29 114.58 118.78 1ued h GLU 45 Ca 0.00 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1ued h GLU 45 Cb 0.00 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.21 1ued h GLU 45 CO 0.00 0.42 0.32 0.77 -0.73 0.00 0.00 179.01 179.79 1ued h SER 46 N 0.66 0.77 -0.36 1.04 0.02 -1.95 0.10 113.55 113.81 1ued h SER 46 Ca 0.47 -0.11 -0.13 0.00 -0.84 0.00 0.00 61.79 61.18 1ued h SER 46 Cb 0.65 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1ued h SER 46 CO -0.35 0.65 -0.25 0.77 -1.14 0.00 0.00 176.83 176.51 1ued h SER 47 N 0.82 0.90 -0.56 3.07 4.64 -1.67 -2.81 113.55 117.94 1ued h SER 47 Ca 0.21 -0.35 -0.11 0.00 -0.47 0.00 0.00 61.79 61.07 1ued h SER 47 Cb 0.07 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.90 1ued h SER 47 CO -0.03 1.10 -0.08 0.74 -0.87 0.00 0.00 176.83 177.69 1ued h THR 48 N 0.75 1.27 -0.21 2.95 2.02 -0.69 -2.12 112.91 116.87 1ued h THR 48 Ca 0.09 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 65.99 1ued h THR 48 Cb 0.80 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1ued h THR 48 CO 0.07 0.44 -0.06 1.56 0.37 0.00 0.00 175.52 177.90 1ued h GLN 49 N 0.92 0.32 -0.20 6.66 1.08 -0.93 -2.47 115.11 120.49 1ued h GLN 49 Ca 0.15 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 1ued h GLN 49 Cb 0.65 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1ued h GLN 49 CO 0.05 0.39 0.00 1.28 -0.95 0.00 0.00 178.83 179.60 1ued n LEU 50 N -4.31 1.63 -2.62 1.46 4.77 -1.06 -4.95 117.00 111.92 1ued n LEU 50 Ca -0.00 -0.72 -0.13 0.00 -0.03 0.00 0.00 56.01 55.13 1ued n LEU 50 Cb 0.23 -0.13 0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1ued n LEU 50 CO 0.38 0.36 0.11 0.61 -1.33 0.00 0.00 177.39 177.52 1ued n GLY 51 N 1.10 -0.08 3.15 -0.72 0.00 -0.93 -5.04 105.19 102.66 1ued n GLY 51 Ca 0.15 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1ued n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ued s ARG 52 N -5.30 0.92 0.25 1.61 1.81 -0.84 -5.03 118.95 112.37 1ued s ARG 52 Ca 0.15 -1.43 0.13 0.00 -1.72 0.00 0.00 55.73 52.87 1ued s ARG 52 Cb -0.07 0.24 0.09 0.00 -0.45 0.00 0.00 34.95 34.76 1ued s ARG 52 CO 0.49 -0.26 1.45 -0.44 -0.68 0.00 0.00 175.30 175.86 1ued h ASP 53 N 2.87 0.00 -5.14 0.23 3.32 -1.97 -3.37 116.42 112.36 1ued h ASP 53 Ca -0.35 0.00 0.11 0.00 0.02 0.00 0.00 57.03 56.81 1ued h ASP 53 Cb 1.20 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.69 1ued h ASP 53 CO 0.59 0.61 0.34 0.72 -1.72 0.00 0.00 179.24 179.79 1ued s PHE 54 N -3.00 -0.15 0.03 4.55 -0.12 -1.26 -4.77 117.98 113.26 1ued s PHE 54 Ca 0.03 -0.25 -0.02 0.00 -0.05 0.00 0.00 56.93 56.64 1ued s PHE 54 Cb 0.09 0.68 -0.02 0.00 -0.63 0.00 0.00 43.02 43.14 1ued s PHE 54 CO 0.76 -1.07 0.01 0.14 -0.05 0.00 0.00 175.22 175.00 1ued s VAL 55 N -3.59 0.15 0.48 -2.49 -7.23 -0.89 -4.76 120.40 102.05 1ued s VAL 55 Ca 0.12 -1.21 -0.15 0.00 -1.81 0.00 0.00 61.98 58.93 1ued s VAL 55 Cb -0.04 -0.79 -0.08 0.00 0.56 0.00 0.00 36.38 36.03 1ued s VAL 55 CO 0.05 -0.67 0.92 0.26 -0.31 0.00 0.00 175.10 175.35 1ued s TRP 56 N -2.46 3.45 -0.14 2.82 0.52 -0.56 -1.22 118.94 121.35 1ued s TRP 56 Ca -0.07 1.34 -0.02 0.00 0.02 0.00 0.00 56.10 57.38 1ued s TRP 56 Cb -0.02 -2.69 0.04 0.00 -1.15 0.00 0.00 33.47 29.65 1ued s TRP 56 CO -0.04 -0.27 -0.01 -1.14 0.02 0.00 0.00 176.95 175.51 1ued s GLN 57 N -3.95 0.92 -0.26 4.98 2.00 0.32 -0.51 119.66 123.15 1ued s GLN 57 Ca 0.57 -0.26 -0.12 0.00 -2.00 0.00 0.00 55.36 53.54 1ued s GLN 57 Cb -0.10 -1.68 -0.05 0.00 0.80 0.00 0.00 33.01 31.99 1ued s GLN 57 CO 0.30 -0.45 0.25 0.00 -0.50 0.00 0.00 175.29 174.90 1ued s ALA 58 N 1.82 3.56 0.00 1.58 0.00 0.33 -1.34 121.76 127.71 1ued s ALA 58 Ca 0.02 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1ued s ALA 58 Cb -0.15 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.45 1ued s ALA 58 CO -0.07 -0.48 0.47 -2.39 0.00 0.00 0.00 175.76 173.28 1ued n HIS 59 N 4.92 0.00 -3.54 0.00 1.44 -0.27 -1.00 115.22 116.78 1ued n HIS 59 Ca -0.12 -0.04 -0.30 0.00 -2.01 0.00 0.00 57.72 55.25 1ued n HIS 59 Cb 0.52 -0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.58 1ued n HIS 59 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1ued s GLY 60 N -0.08 2.08 0.12 -1.39 0.00 -1.16 -2.92 107.32 103.97 1ued s GLY 60 Ca 0.00 -0.54 -0.26 0.00 0.00 0.00 0.00 44.72 43.91 1ued s GLY 60 CO 0.00 -0.45 1.63 -1.82 0.00 0.00 0.00 173.10 172.46 1ued h TYR 61 N 2.34 -0.73 -0.29 1.90 3.20 -1.86 -2.22 116.97 119.31 1ued h TYR 61 Ca -0.47 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.47 1ued h TYR 61 Cb 1.18 0.32 -0.04 0.00 1.54 0.00 0.00 36.73 39.73 1ued h TYR 61 CO 0.59 -0.37 0.04 0.93 -1.64 0.00 0.00 178.16 177.72 1ued h GLU 62 N -0.42 0.13 -0.48 1.82 5.08 -1.95 -0.82 114.58 117.94 1ued h GLU 62 Ca 0.06 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.30 1ued h GLU 62 Cb 0.50 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1ued h GLU 62 CO -0.23 0.09 -0.16 -0.24 -1.00 0.00 0.00 179.01 177.47 1ued h VAL 63 N 0.14 1.27 -0.34 3.13 3.04 -1.92 -1.22 116.25 120.35 1ued h VAL 63 Ca 0.14 -1.30 -0.04 0.00 -1.01 0.00 0.00 66.70 64.49 1ued h VAL 63 Cb 0.16 1.06 -0.01 0.00 -2.01 0.00 0.00 31.29 30.48 1ued h VAL 63 CO -0.20 0.45 0.05 0.58 -1.01 0.00 0.00 177.57 177.44 1ued h VAL 64 N 0.82 1.24 -0.96 1.51 2.07 -1.18 -0.96 116.25 118.79 1ued h VAL 64 Ca 0.12 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1ued h VAL 64 Cb 0.70 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 1ued h VAL 64 CO 0.05 0.28 0.62 -0.09 0.02 0.00 0.00 177.57 178.45 1ued h ARG 65 N 0.39 1.27 -0.27 1.57 2.43 -1.01 -0.87 114.38 117.89 1ued h ARG 65 Ca 0.10 -0.09 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 1ued h ARG 65 Cb 0.37 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1ued h ARG 65 CO 0.01 0.86 -0.20 -0.09 -1.51 0.00 0.00 179.97 179.04 1ued h ARG 66 N 1.31 0.62 -0.40 0.20 2.43 -0.97 -2.91 114.38 114.65 1ued h ARG 66 Ca 0.35 -0.30 -0.16 0.00 -0.81 0.00 0.00 59.98 59.06 1ued h ARG 66 Cb -0.12 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1ued h ARG 66 CO -0.07 0.89 -0.36 0.82 -1.51 0.00 0.00 179.97 179.74 1ued h ILE 67 N 0.35 1.27 -0.63 1.20 2.04 -0.94 -2.51 117.51 118.30 1ued h ILE 67 Ca 0.05 -1.53 0.01 0.00 1.00 0.00 0.00 64.86 64.39 1ued h ILE 67 Cb 0.74 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1ued h ILE 67 CO 0.05 0.52 0.41 -0.07 0.00 0.00 0.00 178.15 179.06 1ued h LEU 68 N 0.78 0.72 -0.24 1.44 3.38 -1.21 -2.34 115.31 117.85 1ued h LEU 68 Ca 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ued h LEU 68 Cb 0.95 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1ued h LEU 68 CO 0.09 0.52 -0.20 0.61 0.09 0.00 0.00 178.44 179.55 1ued n GLY 69 N -1.44 -0.96 3.47 0.83 0.00 -1.10 -4.68 105.19 101.31 1ued n GLY 69 Ca 0.06 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 1ued n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ued s ASP 70 N -2.62 6.34 0.00 1.61 -1.08 -0.88 -4.73 116.67 115.30 1ued s ASP 70 Ca 0.23 -1.33 0.22 0.00 -0.52 0.00 0.00 52.55 51.15 1ued s ASP 70 Cb 0.19 -2.43 0.52 0.00 -1.46 0.00 0.00 42.92 39.74 1ued s ASP 70 CO 0.53 -1.35 1.45 0.00 0.52 0.00 0.00 175.17 176.32 1ued n HIS 71 N 7.53 0.60 0.01 -5.34 1.44 -1.26 -3.52 115.22 114.68 1ued n HIS 71 Ca 0.08 -0.30 -0.20 0.00 -2.01 0.00 0.00 57.72 55.30 1ued n HIS 71 Cb 0.47 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.44 1ued n HIS 71 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 1ued h GLU 72 N 3.97 0.22 -0.02 -1.40 4.81 -1.98 -3.39 114.58 116.79 1ued h GLU 72 Ca 0.00 -0.37 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1ued h GLU 72 Cb 0.89 0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1ued h GLU 72 CO 0.00 1.18 -0.32 0.72 -0.73 0.00 0.00 179.01 179.86 1ued n HIS 73 N -4.17 0.00 -4.13 0.92 8.25 -1.26 -4.77 115.22 110.06 1ued n HIS 73 Ca -0.17 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.13 1ued n HIS 73 Cb 0.78 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.77 1ued n HIS 73 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1ued s PHE 74 N -2.19 0.97 0.26 4.41 0.40 -1.23 -0.30 117.98 120.29 1ued s PHE 74 Ca 0.19 -0.51 0.09 0.00 -0.60 0.00 0.00 56.93 56.10 1ued s PHE 74 Cb 0.17 -0.55 -0.05 0.00 0.51 0.00 0.00 43.02 43.10 1ued s PHE 74 CO 0.46 -0.01 -0.13 -0.08 0.70 0.00 0.00 175.22 176.16 1ued s THR 75 N -1.53 1.96 -0.03 0.64 -1.32 0.82 -4.59 115.64 111.59 1ued s THR 75 Ca -0.04 -2.24 0.04 0.00 -1.21 0.00 0.00 61.69 58.24 1ued s THR 75 Cb -0.09 -2.27 0.06 0.00 -1.51 0.00 0.00 72.50 68.69 1ued s THR 75 CO 0.01 -0.43 0.93 0.35 -2.21 0.00 0.00 174.62 173.27 1ued n THR 76 N -0.54 0.90 -2.21 5.08 -2.24 -1.26 -1.04 114.28 112.98 1ued n THR 76 Ca -0.06 -0.98 -0.42 0.00 -2.27 0.00 0.00 64.05 60.32 1ued n THR 76 Cb 0.61 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 1ued n THR 76 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ued s ARG 77 N -1.11 4.35 0.00 -0.78 1.81 -1.14 -4.51 118.95 117.57 1ued s ARG 77 Ca 0.07 2.04 0.00 0.00 -1.72 0.00 0.00 55.73 56.12 1ued s ARG 77 Cb 0.06 -3.25 0.00 0.00 -0.45 0.00 0.00 34.95 31.31 1ued s ARG 77 CO 0.01 -0.38 0.16 -0.35 -0.68 0.00 0.00 175.30 174.05 1ued n PRO 78 N 3.67 0.00 0.02 3.54 -0.04 -1.26 -4.99 135.00 135.94 1ued n PRO 78 Ca 0.10 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.67 1ued n PRO 78 Cb 0.43 -0.57 -0.03 0.00 -0.04 0.00 0.00 33.50 33.29 1ued n PRO 78 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ued n ALA 91 N -1.85 3.52 0.00 0.55 0.00 -1.26 -5.23 120.51 116.25 1ued n ALA 91 Ca 0.00 -0.45 0.04 0.00 0.00 0.00 0.00 53.44 53.03 1ued n ALA 91 Cb 0.00 -0.91 0.23 0.00 0.00 0.00 0.00 19.45 18.76 1ued n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ued n GLN 92 N -1.94 3.09 -0.19 0.00 0.00 -1.26 -3.62 117.38 113.45 1ued n GLN 92 Ca 0.01 -1.76 0.07 0.00 0.00 0.00 0.00 57.00 55.32 1ued n GLN 92 Cb 0.44 -1.87 0.17 0.00 0.00 0.00 0.00 30.24 28.98 1ued n GLN 92 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1ued n PHE 93 N 0.40 0.51 -1.96 2.61 3.72 -1.26 -4.94 117.46 116.53 1ued n PHE 93 Ca 0.16 -0.45 -0.42 0.00 -0.05 0.00 0.00 57.45 56.69 1ued n PHE 93 Cb 0.74 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 39.24 1ued n PHE 93 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1ued s VAL 94 N -1.01 2.63 0.00 -4.37 1.01 -1.24 -1.69 120.40 115.72 1ued s VAL 94 Ca 0.27 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1ued s VAL 94 Cb 0.14 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1ued s VAL 94 CO 0.19 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1ued n GLY 95 N 3.19 2.52 3.24 4.51 0.00 -1.26 -3.93 105.19 113.46 1ued n GLY 95 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1ued n GLY 95 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ued n GLN 96 N -2.00 2.36 -0.41 1.61 1.13 -0.68 -3.10 117.38 116.29 1ued n GLN 96 Ca 0.00 -2.58 0.33 0.00 -1.94 0.00 0.00 57.00 52.81 1ued n GLN 96 Cb 0.00 -3.36 0.61 0.00 0.11 0.00 0.00 30.24 27.61 1ued n GLN 96 CO 0.00 0.00 0.00 0.97 -1.44 0.00 0.00 177.06 176.59 1ued h ILE 97 N 5.02 0.23 0.00 5.09 2.10 -1.87 0.19 117.51 128.26 1ued h ILE 97 Ca 0.43 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 66.31 1ued h ILE 97 Cb 0.78 0.05 0.00 0.00 -1.09 0.00 0.00 36.82 36.55 1ued h ILE 97 CO 1.64 0.03 0.00 0.77 -1.08 0.00 0.00 178.15 179.51 1ued h SER 98 N 0.16 0.00 -0.55 2.19 4.64 -1.98 -2.30 113.55 115.71 1ued h SER 98 Ca 0.76 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.08 1ued h SER 98 Cb 2.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.37 1ued h SER 98 CO -0.39 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 175.92 1ued n THR 99 N -2.68 0.73 -3.83 2.95 -2.24 0.06 -4.83 114.28 104.43 1ued n THR 99 Ca 0.00 -0.85 -0.31 0.00 -2.27 0.00 0.00 64.05 60.62 1ued n THR 99 Cb 0.19 0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 69.11 1ued n THR 99 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1ued s TYR 100 N -1.27 3.51 0.29 4.78 4.12 -0.87 -2.87 117.35 125.03 1ued s TYR 100 Ca 0.44 0.37 0.09 0.00 0.02 0.00 0.00 57.07 57.99 1ued s TYR 100 Cb 0.24 -1.86 -0.04 0.00 -1.52 0.00 0.00 41.96 38.78 1ued s TYR 100 CO 0.32 0.54 0.06 -0.51 0.02 0.00 0.00 175.55 175.99 1ued s ASP 101 N -2.41 4.66 0.61 2.29 1.01 -1.26 -4.64 116.67 116.93 1ued s ASP 101 Ca 0.36 -0.67 -0.17 0.00 0.71 0.00 0.00 52.55 52.78 1ued s ASP 101 Cb -0.13 -0.84 -0.02 0.00 1.01 0.00 0.00 42.92 42.94 1ued s ASP 101 CO 0.26 -0.11 1.14 -2.84 0.21 0.00 0.00 175.17 173.82 1ued s PRO 102 N -3.75 2.97 0.27 8.23 0.02 -1.26 -0.68 135.00 140.81 1ued s PRO 102 Ca 0.34 1.56 0.25 0.00 0.02 0.00 0.00 61.00 63.17 1ued s PRO 102 Cb -0.05 -1.96 0.53 0.00 0.02 0.00 0.00 34.50 33.04 1ued s PRO 102 CO 0.21 -1.15 1.60 -1.00 -0.33 0.00 0.00 177.00 176.33 1ued h PRO 103 N 0.55 0.00 -0.97 5.54 0.13 -2.02 -3.45 132.00 131.78 1ued h PRO 103 Ca -0.49 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.68 1ued h PRO 103 Cb 1.26 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.34 1ued h PRO 103 CO 0.55 0.00 0.64 0.93 -0.23 0.00 0.00 178.00 179.89 1ued h GLU 104 N 0.00 1.19 -0.74 0.86 3.07 -1.83 -1.89 114.58 115.24 1ued h GLU 104 Ca 0.00 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.76 1ued h GLU 104 Cb 0.84 -0.27 -0.03 0.00 -0.84 0.00 0.00 28.75 28.45 1ued h GLU 104 CO 0.00 0.79 0.35 1.25 -1.40 0.00 0.00 179.01 180.00 1ued h HIS 105 N 1.22 1.06 -0.91 4.33 2.76 -1.16 -2.71 115.15 119.75 1ued h HIS 105 Ca 0.39 -0.05 0.06 0.00 -2.20 0.00 0.00 60.37 58.56 1ued h HIS 105 Cb 0.01 -0.33 -0.06 0.00 1.55 0.00 0.00 27.41 28.58 1ued h HIS 105 CO -0.00 0.78 0.57 1.15 -1.30 0.00 0.00 177.93 179.13 1ued h THR 106 N 1.03 1.07 -0.35 6.26 2.02 -1.58 0.42 112.91 121.78 1ued h THR 106 Ca 0.25 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 1ued h THR 106 Cb 0.12 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.44 1ued h THR 106 CO -0.03 0.19 0.13 -0.09 0.37 0.00 0.00 175.52 176.09 1ued h ARG 107 N 1.05 0.53 -0.46 6.66 2.43 -1.30 -1.69 114.38 121.60 1ued h ARG 107 Ca 0.39 -0.10 -0.13 0.00 -0.81 0.00 0.00 59.98 59.33 1ued h ARG 107 Cb 0.14 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1ued h ARG 107 CO -0.16 0.54 -0.21 -0.07 -1.51 0.00 0.00 179.97 178.55 1ued h LEU 108 N 0.42 0.99 -0.73 3.80 3.38 -1.19 -2.90 115.31 119.08 1ued h LEU 108 Ca 0.12 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1ued h LEU 108 Cb 0.21 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ued h LEU 108 CO -0.01 1.16 0.44 -0.09 0.09 0.00 0.00 178.44 180.04 1ued h ARG 109 N 0.81 0.98 0.00 1.13 9.65 -0.81 -1.93 114.38 124.21 1ued h ARG 109 Ca 0.11 -0.09 -0.04 0.00 -1.10 0.00 0.00 59.98 58.86 1ued h ARG 109 Cb 0.78 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 29.15 1ued h ARG 109 CO 0.06 0.69 -0.17 0.87 2.80 0.00 0.00 179.97 184.23 1ued h LYS 110 N 0.99 0.00 -0.02 0.20 1.57 -1.23 -1.60 116.57 116.48 1ued h LYS 110 Ca 0.26 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.93 1ued h LYS 110 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1ued h LYS 110 CO -0.05 0.17 -0.50 0.52 -0.57 0.00 0.00 179.45 179.03 1ued h MET 111 N 0.00 0.04 0.11 3.15 2.86 -1.15 -3.33 114.93 116.62 1ued h MET 111 Ca -0.00 -0.02 -0.33 0.00 -2.06 0.00 0.00 59.70 57.29 1ued h MET 111 Cb 0.47 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 1ued h MET 111 CO 0.02 0.53 -1.73 -0.07 1.06 0.00 0.00 176.91 176.72 1ued h LEU 112 N 0.03 0.38 -0.82 1.22 3.38 -1.06 -3.41 115.31 115.03 1ued h LEU 112 Ca -0.00 -0.65 0.15 0.00 0.09 0.00 0.00 57.88 57.47 1ued h LEU 112 Cb 0.89 -0.12 -0.15 0.00 0.09 0.00 0.00 40.66 41.37 1ued h LEU 112 CO 0.07 1.56 -0.27 0.74 0.09 0.00 0.00 178.44 180.63 1ued h THR 113 N 0.07 0.13 -0.23 0.22 2.02 -1.43 -1.59 112.91 112.10 1ued h THR 113 Ca -0.32 0.00 0.07 0.00 0.77 0.00 0.00 66.41 66.93 1ued h THR 113 Cb 2.04 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 1ued h THR 113 CO 0.13 0.00 0.21 -0.65 0.37 0.00 0.00 175.52 175.58 1ued h PRO 114 N -0.03 0.00 -0.00 6.66 0.11 -1.79 -2.08 132.00 134.87 1ued h PRO 114 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1ued h PRO 114 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 1ued h PRO 114 CO -0.85 0.00 -0.33 0.39 -0.21 0.00 0.00 178.00 177.00 1ued n GLU 115 N -4.05 0.19 -0.18 1.05 4.71 -0.60 -4.11 120.64 117.65 1ued n GLU 115 Ca 0.03 -0.10 0.06 0.00 -0.01 0.00 0.00 57.16 57.14 1ued n GLU 115 Cb 0.35 -1.50 0.14 0.00 -1.01 0.00 0.00 31.44 29.42 1ued n GLU 115 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1ued n PHE 116 N -1.32 0.40 -1.43 -0.32 3.01 -0.78 -4.82 117.46 112.20 1ued n PHE 116 Ca 0.08 -0.68 -0.33 0.00 1.01 0.00 0.00 57.45 57.52 1ued n PHE 116 Cb 0.33 -0.13 0.09 0.00 -0.01 0.00 0.00 39.48 39.76 1ued n PHE 116 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1ued s THR 117 N -1.78 2.67 0.40 4.37 -4.23 -1.22 -4.75 115.64 111.10 1ued s THR 117 Ca 0.24 0.30 0.09 0.00 -1.18 0.00 0.00 61.69 61.14 1ued s THR 117 Cb 0.17 -2.78 0.18 0.00 1.34 0.00 0.00 72.50 71.41 1ued s THR 117 CO 0.08 -0.21 1.94 0.58 -0.54 0.00 0.00 174.62 176.48 1ued h VAL 118 N -0.46 1.16 -0.50 2.29 2.07 -1.96 -0.21 116.25 118.63 1ued h VAL 118 Ca -0.46 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 66.42 1ued h VAL 118 Cb 1.27 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 32.12 1ued h VAL 118 CO 0.50 0.21 0.29 -0.09 0.02 0.00 0.00 177.57 178.50 1ued h ARG 119 N 0.26 0.56 -0.33 1.57 2.43 -1.99 0.28 114.38 117.16 1ued h ARG 119 Ca 0.06 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.02 1ued h ARG 119 Cb 0.30 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1ued h ARG 119 CO 0.01 0.37 -0.47 0.00 -1.51 0.00 0.00 179.97 178.37 1ued h ARG 120 N 0.57 0.89 -0.97 0.20 3.08 -1.69 -3.13 114.38 113.33 1ued h ARG 120 Ca 0.21 -0.52 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1ued h ARG 120 Cb 0.05 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.09 1ued h ARG 120 CO -0.11 1.16 0.63 0.82 -1.07 0.00 0.00 179.97 181.40 1ued h ILE 121 N 0.70 1.26 -0.70 2.04 2.04 -0.52 -0.78 117.51 121.56 1ued h ILE 121 Ca 0.04 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.46 1ued h ILE 121 Cb 1.07 -0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 1ued h ILE 121 CO 0.11 0.26 0.46 0.03 0.00 0.00 0.00 178.15 179.00 1ued h ARG 122 N 1.33 0.71 0.00 2.37 3.08 -0.40 -0.45 114.38 121.01 1ued h ARG 122 Ca 0.35 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.33 1ued h ARG 122 Cb -0.12 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.77 1ued h ARG 122 CO -0.07 0.47 -0.17 0.00 -1.07 0.00 0.00 179.97 179.12 1ued h ARG 123 N 0.73 0.00 0.00 0.04 3.08 -1.10 -2.80 114.38 114.33 1ued h ARG 123 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1ued h ARG 123 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1ued h ARG 123 CO -0.10 0.17 -0.43 -1.33 -1.07 0.00 0.00 179.97 177.21 1ued n MET 124 N -3.37 0.20 -0.32 0.04 2.81 -0.22 -4.35 117.12 111.91 1ued n MET 124 Ca -0.00 0.08 0.09 0.00 -1.81 0.00 0.00 57.70 56.06 1ued n MET 124 Cb 0.38 -1.65 0.25 0.00 -0.71 0.00 0.00 33.22 31.49 1ued n MET 124 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1ued h GLU 125 N 0.00 0.68 -0.56 0.03 5.08 -1.16 -1.30 114.58 117.34 1ued h GLU 125 Ca 0.00 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1ued h GLU 125 Cb 0.67 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1ued h GLU 125 CO 0.00 0.45 0.27 -1.35 -1.00 0.00 0.00 179.01 177.38 1ued h PRO 126 N 0.70 0.81 -0.59 2.33 0.11 -1.80 -0.04 132.00 133.52 1ued h PRO 126 Ca 0.50 -0.12 -0.07 0.00 0.11 0.00 0.00 66.00 66.42 1ued h PRO 126 Cb 0.70 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.64 1ued h PRO 126 CO -0.36 0.67 0.10 0.00 -0.21 0.00 0.00 178.00 178.20 1ued h ALA 127 N 1.10 1.06 -0.31 -0.75 0.00 -1.67 -1.71 119.26 116.98 1ued h ALA 127 Ca 0.19 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1ued h ALA 127 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ued h ALA 127 CO -0.02 0.61 0.09 0.82 0.00 0.00 0.00 179.25 180.75 1ued h ILE 128 N 0.89 1.21 -0.98 0.00 2.04 -0.98 -1.69 117.51 118.01 1ued h ILE 128 Ca 0.18 -0.67 0.03 0.00 1.00 0.00 0.00 64.86 65.40 1ued h ILE 128 Cb 0.39 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 1ued h ILE 128 CO 0.01 0.23 0.65 -0.61 0.00 0.00 0.00 178.15 178.42 1ued h GLN 129 N 0.34 1.23 -0.39 2.37 5.75 -0.77 -0.70 115.11 122.94 1ued h GLN 129 Ca 0.10 -0.07 -0.14 0.00 -0.15 0.00 0.00 58.65 58.39 1ued h GLN 129 Cb 0.26 -0.28 -0.01 0.00 1.07 0.00 0.00 27.48 28.52 1ued h GLN 129 CO -0.00 0.81 -0.30 1.03 -2.65 0.00 0.00 178.83 177.72 1ued h SER 130 N 1.26 0.88 -0.15 -0.69 0.87 -1.14 0.70 113.55 115.30 1ued h SER 130 Ca 0.38 -0.36 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 1ued h SER 130 Cb -0.04 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.67 1ued h SER 130 CO -0.11 1.12 0.05 0.25 -0.53 0.00 0.00 176.83 177.61 1ued h LEU 131 N 0.72 0.21 -0.32 2.23 5.85 -0.89 -1.16 115.31 121.95 1ued h LEU 131 Ca 0.08 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1ued h LEU 131 Cb 0.86 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1ued h LEU 131 CO 0.08 0.34 0.20 0.40 -0.34 0.00 0.00 178.44 179.12 1ued h ILE 132 N 0.07 1.10 -0.31 4.05 2.04 -0.97 -0.95 117.51 122.54 1ued h ILE 132 Ca 0.05 -0.21 0.04 0.00 1.00 0.00 0.00 64.86 65.74 1ued h ILE 132 Cb 0.20 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 1ued h ILE 132 CO -0.00 0.10 0.08 0.44 0.00 0.00 0.00 178.15 178.77 1ued h ASP 133 N 0.42 0.06 -0.16 1.72 3.32 -0.77 -1.20 116.42 119.81 1ued h ASP 133 Ca 0.12 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.23 1ued h ASP 133 Cb -0.02 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1ued h ASP 133 CO -0.02 0.07 0.05 0.44 -1.72 0.00 0.00 179.24 178.06 1ued h ASP 134 N 0.21 0.05 -0.39 6.45 3.45 -0.96 -1.62 116.42 123.61 1ued h ASP 134 Ca 0.14 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.59 1ued h ASP 134 Cb 0.14 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 38.90 1ued h ASP 134 CO -0.17 0.05 0.14 0.03 -1.57 0.00 0.00 179.24 177.73 1ued h ARG 135 N 0.12 0.65 0.00 3.56 2.47 -0.94 -1.73 114.38 118.52 1ued h ARG 135 Ca 0.07 -0.10 -0.10 0.00 -1.26 0.00 0.00 59.98 58.59 1ued h ARG 135 Cb 0.05 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 1ued h ARG 135 CO -0.08 0.57 -0.47 -0.07 0.56 0.00 0.00 179.97 180.48 1ued h LEU 136 N 0.64 0.00 -0.65 3.04 3.38 -0.84 -0.92 115.31 119.97 1ued h LEU 136 Ca 0.15 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 1ued h LEU 136 Cb 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1ued h LEU 136 CO -0.01 0.47 -0.20 0.44 0.09 0.00 0.00 178.44 179.23 1ued h ASP 137 N 0.00 0.86 0.18 -0.43 3.45 -0.46 -1.37 116.42 118.65 1ued h ASP 137 Ca -0.00 -0.31 -0.13 0.00 0.43 0.00 0.00 57.03 57.02 1ued h ASP 137 Cb 0.88 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 39.41 1ued h ASP 137 CO 0.06 1.04 -0.48 -0.07 -1.57 0.00 0.00 179.24 178.22 1ued h LEU 138 N 0.75 0.38 -0.03 1.55 3.38 -1.05 -0.25 115.31 120.04 1ued h LEU 138 Ca 0.11 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1ued h LEU 138 Cb 0.73 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ued h LEU 138 CO 0.06 0.80 0.01 0.25 0.09 0.00 0.00 178.44 179.65 1ued h LEU 139 N 0.28 0.05 -0.26 1.67 5.85 -0.92 -2.54 115.31 119.43 1ued h LEU 139 Ca 0.02 -0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.54 1ued h LEU 139 Cb 0.95 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 1ued h LEU 139 CO 0.08 0.28 -0.03 -0.08 -0.34 0.00 0.00 178.44 178.35 1ued h GLU 140 N -0.19 0.04 -0.64 1.25 4.81 -1.14 -1.99 114.58 116.72 1ued h GLU 140 Ca 0.01 -0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.40 1ued h GLU 140 Cb 0.26 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1ued h GLU 140 CO 0.00 0.03 0.45 0.00 -0.73 0.00 0.00 179.01 178.76 1ued h ALA 141 N 1.24 2.41 0.00 2.92 0.00 -0.94 0.90 119.26 125.80 1ued h ALA 141 Ca 0.13 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1ued h ALA 141 Cb 0.18 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ued h ALA 141 CO -0.24 -0.60 -0.37 1.49 0.00 0.00 0.00 179.25 179.53 1ued h GLU 142 N 0.13 0.00 0.00 0.00 4.57 -0.93 -3.50 114.58 114.86 1ued h GLU 142 Ca 0.31 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.56 1ued h GLU 142 Cb 1.04 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.61 1ued h GLU 142 CO -0.04 0.37 -0.09 0.41 -1.18 0.00 0.00 179.01 178.49 1ued n GLY 143 N 0.44 -2.15 3.52 1.92 0.00 0.31 -4.72 105.19 104.51 1ued n GLY 143 Ca 0.00 -1.44 -0.51 0.00 0.00 0.00 0.00 46.02 44.07 1ued n GLY 143 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ued n PRO 144 N -1.44 0.64 -0.77 1.61 -0.02 -1.26 -1.53 135.00 132.22 1ued n PRO 144 Ca 0.00 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1ued n PRO 144 Cb 0.11 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1ued n PRO 144 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ued n SER 145 N 1.89 -1.14 -4.75 2.55 7.64 0.52 -4.99 113.62 115.34 1ued n SER 145 Ca 0.17 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.64 1ued n SER 145 Cb 0.20 -0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1ued n SER 145 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ued n ALA 146 N 0.31 1.97 -2.62 -0.43 0.00 -0.58 -4.38 120.51 114.78 1ued n ALA 146 Ca 0.00 0.33 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 1ued n ALA 146 Cb 0.00 -2.36 -0.03 0.00 0.00 0.00 0.00 19.45 17.06 1ued n ALA 146 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ued s ASP 147 N -0.25 6.31 0.42 0.00 2.15 -1.26 -0.83 116.67 123.20 1ued s ASP 147 Ca 0.55 -0.29 0.13 0.00 0.43 0.00 0.00 52.55 53.37 1ued s ASP 147 Cb -0.50 -2.51 0.88 0.00 -0.30 0.00 0.00 42.92 40.50 1ued s ASP 147 CO 0.62 -1.51 1.94 0.25 -0.17 0.00 0.00 175.17 176.30 1ued h LEU 148 N 11.92 0.06 0.27 -1.34 6.46 -1.48 -0.24 115.31 130.95 1ued h LEU 148 Ca -0.27 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.47 1ued h LEU 148 Cb 1.06 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.98 1ued h LEU 148 CO 1.19 0.28 -0.13 -0.61 -0.62 0.00 0.00 178.44 178.54 1ued h GLN 149 N 0.06 -0.35 -0.14 1.25 5.75 -1.90 -1.60 115.11 118.17 1ued h GLN 149 Ca 0.01 0.02 -0.13 0.00 -0.15 0.00 0.00 58.65 58.40 1ued h GLN 149 Cb 0.41 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.03 1ued h GLN 149 CO 0.03 -0.02 -0.47 0.78 -2.65 0.00 0.00 178.83 176.50 1ued h GLY 150 N -0.74 0.40 0.91 2.39 0.00 -1.80 0.58 103.07 104.80 1ued h GLY 150 Ca -0.04 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1ued h GLY 150 CO 0.06 0.38 -0.97 1.04 0.00 0.00 0.00 176.54 177.05 1ued n LEU 151 N -3.98 0.72 0.10 3.11 4.77 -0.11 -4.33 117.00 117.28 1ued n LEU 151 Ca -0.02 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1ued n LEU 151 Cb 0.54 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1ued n LEU 151 CO 0.44 -0.10 0.00 0.33 -1.33 0.00 0.00 177.39 176.73 1ued n PHE 152 N -2.38 -1.48 0.31 -1.77 7.35 -0.69 -4.69 117.46 114.11 1ued n PHE 152 Ca 0.01 0.26 -0.17 0.00 -0.76 0.00 0.00 57.45 56.79 1ued n PHE 152 Cb 0.50 0.36 -0.08 0.00 0.35 0.00 0.00 39.48 40.61 1ued n PHE 152 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ued h ALA 153 N 0.00 -0.81 -0.13 3.13 0.00 -1.18 -1.13 119.26 119.13 1ued h ALA 153 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1ued h ALA 153 Cb 0.00 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1ued h ALA 153 CO 0.00 -0.97 -0.05 -0.44 0.00 0.00 0.00 179.25 177.79 1ued h ASP 154 N -0.81 -0.17 -0.32 0.00 3.32 -1.14 -2.26 116.42 115.04 1ued h ASP 154 Ca -0.07 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 1ued h ASP 154 Cb 0.65 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 1ued h ASP 154 CO 0.08 -0.07 -0.08 1.55 -1.72 0.00 0.00 179.24 179.01 1ued h PRO 155 N -0.03 0.73 -0.42 3.56 0.13 -1.74 -0.65 132.00 133.57 1ued h PRO 155 Ca 0.07 -0.22 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 1ued h PRO 155 Cb 0.13 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.17 1ued h PRO 155 CO -0.15 0.80 0.21 0.28 -0.23 0.00 0.00 178.00 178.90 1ued h VAL 156 N 0.67 1.17 -0.14 1.56 2.07 -1.07 0.03 116.25 120.54 1ued h VAL 156 Ca 0.12 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1ued h VAL 156 Cb 0.53 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1ued h VAL 156 CO 0.03 0.18 0.04 1.23 0.02 0.00 0.00 177.57 179.08 1ued h GLY 157 N 0.54 0.24 0.89 2.17 0.00 -1.17 -1.69 103.07 104.04 1ued h GLY 157 Ca 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1ued h GLY 157 CO -0.02 0.13 0.05 0.00 0.00 0.00 0.00 176.54 176.70 1ued h ALA 158 N 0.85 0.39 0.00 3.60 0.00 -1.05 -2.69 119.26 120.37 1ued h ALA 158 Ca 0.05 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1ued h ALA 158 Cb 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1ued h ALA 158 CO -0.00 0.08 -0.62 0.45 0.00 0.00 0.00 179.25 179.16 1ued h HIS 159 N 0.31 0.00 -0.25 0.00 3.86 -1.03 -1.72 115.15 116.32 1ued h HIS 159 Ca 0.09 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1ued h HIS 159 Cb 0.34 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1ued h HIS 159 CO 0.02 0.62 0.07 0.00 0.86 0.00 0.00 177.93 179.51 1ued h ALA 160 N 1.38 0.33 -0.69 2.45 0.00 -1.29 -1.60 119.26 119.83 1ued h ALA 160 Ca -0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1ued h ALA 160 Cb 1.13 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1ued h ALA 160 CO 0.08 -0.03 0.17 -0.07 0.00 0.00 0.00 179.25 179.40 1ued h LEU 161 N 0.23 1.05 -0.56 0.00 -0.00 -1.34 -0.96 115.31 113.73 1ued h LEU 161 Ca 0.08 -0.22 -0.00 0.00 -0.00 0.00 0.00 57.88 57.74 1ued h LEU 161 Cb 0.26 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 40.62 1ued h LEU 161 CO -0.00 1.01 0.34 0.00 -0.00 0.00 0.00 178.44 179.78 1ued h GLU 163 N 0.75 0.35 -0.73 0.00 4.81 -1.05 -0.23 114.58 118.48 1ued h GLU 163 Ca 0.20 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1ued h GLU 163 Cb -0.02 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1ued h GLU 163 CO -0.04 0.67 0.35 1.25 -0.73 0.00 0.00 179.01 180.51 1ued h LEU 164 N 0.29 0.93 -0.96 1.64 5.85 -0.61 -1.56 115.31 120.90 1ued h LEU 164 Ca 0.03 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ued h LEU 164 Cb 0.79 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1ued h LEU 164 CO 0.06 0.79 0.00 0.18 -0.34 0.00 0.00 178.44 179.13 1ued n LEU 165 N -4.33 1.43 -2.80 2.25 4.77 -0.39 -3.36 117.00 114.58 1ued n LEU 165 Ca 0.07 -0.64 -0.21 0.00 -0.03 0.00 0.00 56.01 55.20 1ued n LEU 165 Cb 0.13 -0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1ued n LEU 165 CO 0.39 0.32 -0.03 0.61 -1.33 0.00 0.00 177.39 177.35 1ued n GLY 166 N 1.04 -0.46 3.70 -0.72 0.00 -0.36 -4.82 105.19 103.56 1ued n GLY 166 Ca 0.14 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1ued n GLY 166 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ued s ILE 167 N -3.13 4.84 0.32 -0.61 -1.09 -0.24 -4.99 121.20 116.29 1ued s ILE 167 Ca 0.26 1.98 -0.27 0.00 -2.23 0.00 0.00 60.65 60.38 1ued s ILE 167 Cb -0.11 -4.28 -0.13 0.00 -1.58 0.00 0.00 42.46 36.35 1ued s ILE 167 CO 0.32 0.08 1.07 -2.65 -1.23 0.00 0.00 174.94 172.53 1ued n PRO 168 N 4.55 1.53 -0.31 2.79 -0.02 -1.26 -4.70 135.00 137.59 1ued n PRO 168 Ca 0.07 0.54 0.13 0.00 -2.02 0.00 0.00 63.50 62.22 1ued n PRO 168 Cb 0.50 -1.98 0.31 0.00 -0.02 0.00 0.00 33.50 32.30 1ued n PRO 168 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1ued h ARG 169 N 2.05 0.41 -0.68 -0.52 9.65 -1.98 0.32 114.38 123.62 1ued h ARG 169 Ca -0.42 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 58.38 1ued h ARG 169 Cb 1.33 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 29.78 1ued h ARG 169 CO 0.60 0.27 0.19 -0.44 2.80 0.00 0.00 179.97 183.40 1ued h ASP 170 N 0.42 1.00 0.76 -3.80 3.32 -2.04 -2.57 116.42 113.51 1ued h ASP 170 Ca 0.56 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.42 1ued h ASP 170 Cb 1.05 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1ued h ASP 170 CO -0.52 0.94 0.00 0.47 -1.72 0.00 0.00 179.24 178.41 1ued n ASP 171 N -4.25 0.26 0.21 6.45 8.00 0.06 -2.89 116.55 124.39 1ued n ASP 171 Ca 0.05 0.55 0.09 0.00 0.71 0.00 0.00 54.79 56.20 1ued n ASP 171 Cb 0.23 -0.61 0.39 0.00 -0.02 0.00 0.00 41.12 41.12 1ued n ASP 171 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1ued h GLN 172 N 0.00 0.00 0.00 -1.24 4.20 -1.01 0.24 115.11 117.29 1ued h GLN 172 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ued h GLN 172 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1ued h GLN 172 CO 0.00 0.25 0.00 -2.13 -0.67 0.00 0.00 178.83 176.28 1ued n ARG 173 N -3.36 0.00 0.14 1.46 3.00 -1.14 -0.84 116.66 115.92 1ued n ARG 173 Ca 0.01 0.49 0.02 0.00 -0.00 0.00 0.00 57.85 58.37 1ued n ARG 173 Cb 0.47 -1.46 0.39 0.00 0.00 0.00 0.00 32.46 31.86 1ued n ARG 173 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1ued h GLU 174 N 0.00 0.17 -0.53 -0.14 3.07 -1.76 0.14 114.58 115.53 1ued h GLU 174 Ca 0.00 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.81 1ued h GLU 174 Cb 0.00 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 1ued h GLU 174 CO 0.00 0.37 0.29 0.35 -1.40 0.00 0.00 179.01 178.62 1ued h PHE 175 N 0.16 0.70 0.14 4.33 3.57 -0.51 0.34 116.94 125.68 1ued h PHE 175 Ca 0.03 -0.00 -0.29 0.00 3.53 0.00 0.00 57.97 61.23 1ued h PHE 175 Cb 0.44 -0.23 0.03 0.00 2.79 0.00 0.00 35.95 38.98 1ued h PHE 175 CO 0.00 0.49 -1.23 0.28 -2.23 0.00 0.00 178.31 175.63 1ued h VAL 176 N 0.73 1.30 -0.35 1.41 2.07 -0.36 -2.91 116.25 118.15 1ued h VAL 176 Ca 0.19 -2.48 0.07 0.00 0.82 0.00 0.00 66.70 65.30 1ued h VAL 176 Cb 0.02 2.77 -0.07 0.00 -1.52 0.00 0.00 31.29 32.48 1ued h VAL 176 CO -0.03 0.75 -0.15 -0.09 0.02 0.00 0.00 177.57 178.07 1ued h ARG 177 N 0.21 -0.08 -0.15 1.57 2.43 0.77 0.14 114.38 119.26 1ued h ARG 177 Ca -0.19 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.01 1ued h ARG 177 Cb 1.92 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 31.46 1ued h ARG 177 CO 0.24 -0.05 -0.04 0.00 -1.51 0.00 0.00 179.97 178.60 1ued h ARG 178 N -0.08 -0.00 -0.23 0.20 2.47 -0.46 -0.75 114.38 115.53 1ued h ARG 178 Ca 0.17 0.00 0.06 0.00 -1.26 0.00 0.00 59.98 58.95 1ued h ARG 178 Cb 0.35 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.60 1ued h ARG 178 CO -0.40 -0.00 -0.29 0.82 0.56 0.00 0.00 179.97 180.66 1ued h ILE 179 N -0.00 0.32 -0.69 2.04 2.04 -1.05 0.16 117.51 120.33 1ued h ILE 179 Ca 0.07 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 1ued h ILE 179 Cb 0.11 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 1ued h ILE 179 CO -0.16 0.00 0.32 0.03 0.00 0.00 0.00 178.15 178.34 1ued h ARG 180 N -0.31 0.98 -0.22 2.37 2.47 -0.39 -3.25 114.38 116.03 1ued h ARG 180 Ca 0.13 -0.14 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1ued h ARG 180 Cb 0.51 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.65 1ued h ARG 180 CO -0.40 0.76 0.00 2.89 0.56 0.00 0.00 179.97 183.78 1ued n ARG 181 N -4.33 1.86 0.17 0.04 1.85 -0.32 -4.34 116.66 111.60 1ued n ARG 181 Ca 0.06 -1.77 0.02 0.00 -1.00 0.00 0.00 57.85 55.16 1ued n ARG 181 Cb 0.14 -1.32 0.34 0.00 -1.05 0.00 0.00 32.46 30.57 1ued n ARG 181 CO 0.00 0.00 0.00 -0.97 -0.01 0.00 0.00 177.63 176.65 1ued h ASN 182 N 2.84 0.03 -3.52 2.89 -0.00 -0.72 -3.47 115.58 113.62 1ued h ASN 182 Ca 0.00 -0.01 -0.69 0.00 -0.00 0.00 0.00 56.30 55.60 1ued h ASN 182 Cb 0.71 -0.01 -0.35 0.00 -0.00 0.00 0.00 38.32 38.67 1ued h ASN 182 CO 0.00 0.40 -0.57 0.00 -0.00 0.00 0.00 177.43 177.26 1ued s ALA 183 N -4.18 3.12 0.00 1.57 0.00 -1.26 -4.87 121.76 116.13 1ued s ALA 183 Ca -0.03 -2.51 0.00 0.00 0.00 0.00 0.00 51.96 49.42 1ued s ALA 183 Cb 0.14 -2.35 0.00 0.00 0.00 0.00 0.00 23.12 20.92 1ued s ALA 183 CO 0.73 -1.77 0.00 -1.13 0.00 0.00 0.00 175.76 173.59 1ued n SER 186 N 4.56 0.00 0.19 0.00 3.41 -1.26 -5.05 113.62 115.47 1ued n SER 186 Ca -0.02 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.73 1ued n SER 186 Cb 0.41 -0.23 0.44 0.00 -0.26 0.00 0.00 64.21 64.58 1ued n SER 186 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1ued h ARG 187 N 0.89 0.00 0.00 4.33 3.08 -1.99 -3.49 114.38 117.20 1ued h ARG 187 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ued h ARG 187 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1ued h ARG 187 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1ued n GLY 188 N 0.60 2.36 0.22 0.04 0.00 -1.26 -4.39 105.19 102.77 1ued n GLY 188 Ca 0.03 -1.79 0.01 0.00 0.00 0.00 0.00 46.02 44.26 1ued n GLY 188 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ued h LEU 189 N 0.00 0.22 -0.22 0.99 3.38 -1.99 -1.94 115.31 115.74 1ued h LEU 189 Ca 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1ued h LEU 189 Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1ued h LEU 189 CO 0.00 0.48 0.10 0.11 0.09 0.00 0.00 178.44 179.22 1ued h LYS 190 N 0.20 0.33 -0.75 1.13 1.57 -2.00 -1.29 116.57 115.76 1ued h LYS 190 Ca 0.03 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1ued h LYS 190 Cb 0.55 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1ued h LYS 190 CO 0.04 0.35 0.34 0.00 -0.57 0.00 0.00 179.45 179.60 1ued h ALA 191 N 0.96 1.18 -0.55 3.86 0.00 -1.72 -1.74 119.26 121.25 1ued h ALA 191 Ca 0.08 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1ued h ALA 191 Cb 0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ued h ALA 191 CO -0.01 0.61 0.17 -0.09 0.00 0.00 0.00 179.25 179.93 1ued h ARG 192 N 1.08 0.86 -0.10 0.00 2.43 -1.13 -1.60 114.38 115.92 1ued h ARG 192 Ca 0.26 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 59.15 1ued h ARG 192 Cb 0.15 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1ued h ARG 192 CO -0.03 0.79 -0.35 0.00 -1.51 0.00 0.00 179.97 178.87 1ued h ALA 193 N 1.03 1.24 -0.34 2.80 0.00 -0.95 -1.20 119.26 121.85 1ued h ALA 193 Ca 0.18 -0.36 -0.17 0.00 0.00 0.00 0.00 54.91 54.56 1ued h ALA 193 Cb 0.29 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ued h ALA 193 CO -0.00 0.52 -0.46 0.00 0.00 0.00 0.00 179.25 179.30 1ued h ALA 194 N 1.48 0.51 -0.32 0.00 0.00 -0.97 -1.16 119.26 118.80 1ued h ALA 194 Ca 0.02 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1ued h ALA 194 Cb 0.70 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1ued h ALA 194 CO 0.05 0.68 0.06 -0.44 0.00 0.00 0.00 179.25 179.60 1ued h ASP 195 N 0.72 0.50 -0.78 0.00 3.32 -1.11 -1.44 116.42 117.64 1ued h ASP 195 Ca 0.04 -0.25 0.04 0.00 0.02 0.00 0.00 57.03 56.88 1ued h ASP 195 Cb 1.07 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 40.44 1ued h ASP 195 CO 0.11 0.62 0.48 -1.28 -1.72 0.00 0.00 179.24 177.45 1ued h SER 196 N 0.36 0.78 -0.48 6.45 0.87 -1.17 0.21 113.55 120.57 1ued h SER 196 Ca 0.10 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.63 1ued h SER 196 Cb 0.32 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 1ued h SER 196 CO 0.00 0.53 0.16 0.00 -0.53 0.00 0.00 176.83 176.99 1ued h ALA 197 N 1.34 0.63 -0.39 6.23 0.00 -1.05 -0.69 119.26 125.34 1ued h ALA 197 Ca 0.32 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1ued h ALA 197 Cb 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ued h ALA 197 CO -0.13 0.28 -0.36 0.00 0.00 0.00 0.00 179.25 179.04 1ued h ALA 198 N 1.01 0.61 -0.71 0.00 0.00 -0.78 -1.47 119.26 117.93 1ued h ALA 198 Ca 0.16 -0.45 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1ued h ALA 198 Cb 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1ued h ALA 198 CO -0.01 0.68 0.20 0.35 0.00 0.00 0.00 179.25 180.47 1ued h PHE 199 N 0.76 1.16 -0.20 0.00 3.04 -0.49 0.38 116.94 121.60 1ued h PHE 199 Ca 0.07 -0.13 -0.04 0.00 3.98 0.00 0.00 57.97 61.85 1ued h PHE 199 Cb 0.95 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 39.12 1ued h PHE 199 CO 0.06 0.93 -0.04 -0.91 -2.02 0.00 0.00 178.31 176.33 1ued h ASN 200 N 1.07 0.37 -0.57 0.41 2.35 -1.06 -2.08 115.58 116.07 1ued h ASN 200 Ca 0.23 -0.36 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 1ued h ASN 200 Cb 0.34 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 1ued h ASN 200 CO -0.00 0.64 0.30 0.03 -1.65 0.00 0.00 177.43 176.75 1ued h ARG 201 N 0.10 0.80 -0.08 0.81 3.08 -1.03 0.72 114.38 118.78 1ued h ARG 201 Ca 0.05 -0.10 0.03 0.00 0.07 0.00 0.00 59.98 60.03 1ued h ARG 201 Cb 0.48 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 1ued h ARG 201 CO 0.02 0.62 -0.10 -0.92 -1.07 0.00 0.00 179.97 178.52 1ued h TYR 202 N 0.77 -0.24 -0.05 3.04 3.20 -0.86 -2.04 116.97 120.78 1ued h TYR 202 Ca 0.20 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 1ued h TYR 202 Cb 0.06 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1ued h TYR 202 CO -0.01 -0.15 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.14 1ued h LEU 203 N -0.13 0.07 -0.62 2.82 3.38 -1.10 -1.34 115.31 118.39 1ued h LEU 203 Ca 0.06 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1ued h LEU 203 Cb 0.22 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1ued h LEU 203 CO -0.16 0.23 0.19 0.44 0.09 0.00 0.00 178.44 179.24 1ued h ASP 204 N 0.07 0.90 -0.43 -0.43 3.45 -0.24 -0.06 116.42 119.68 1ued h ASP 204 Ca 0.01 -0.21 -0.14 0.00 0.43 0.00 0.00 57.03 57.12 1ued h ASP 204 Cb 0.32 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 1ued h ASP 204 CO 0.02 0.87 -0.29 0.78 -1.57 0.00 0.00 179.24 179.05 1ued h ASN 205 N 0.89 1.01 -0.55 6.45 2.35 -0.80 -0.88 115.58 124.05 1ued h ASN 205 Ca 0.20 -0.42 -0.06 0.00 -0.55 0.00 0.00 56.30 55.48 1ued h ASN 205 Cb 0.30 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1ued h ASN 205 CO -0.01 1.22 0.13 0.25 -1.65 0.00 0.00 177.43 177.37 1ued h LEU 206 N 0.81 0.84 -0.70 1.61 5.85 -1.10 -2.15 115.31 120.47 1ued h LEU 206 Ca 0.09 -0.24 -0.12 0.00 0.84 0.00 0.00 57.88 58.45 1ued h LEU 206 Cb 0.88 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1ued h LEU 206 CO 0.08 0.86 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.70 1ued h LEU 207 N 0.78 0.73 -0.89 2.25 3.38 -0.89 -1.59 115.31 119.08 1ued h LEU 207 Ca 0.17 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1ued h LEU 207 Cb 0.35 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1ued h LEU 207 CO 0.00 0.96 0.40 0.00 0.09 0.00 0.00 178.44 179.89 1ued h ALA 208 N 1.09 1.13 -0.53 1.53 0.00 -0.96 -0.37 119.26 121.16 1ued h ALA 208 Ca 0.08 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 1ued h ALA 208 Cb 0.77 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1ued h ALA 208 CO 0.06 0.66 -0.12 0.00 0.00 0.00 0.00 179.25 179.85 1ued h ARG 209 N 1.19 1.01 -0.52 0.00 3.08 -1.18 -2.29 114.38 115.68 1ued h ARG 209 Ca 0.29 -0.38 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 1ued h ARG 209 Cb 0.12 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1ued h ARG 209 CO -0.04 1.06 -0.07 1.96 -1.07 0.00 0.00 179.97 181.82 1ued h GLN 210 N 0.89 0.96 0.00 0.04 1.08 -0.81 -2.55 115.11 114.72 1ued h GLN 210 Ca 0.14 -0.34 -0.09 0.00 -1.45 0.00 0.00 58.65 56.91 1ued h GLN 210 Cb 0.69 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 1ued h GLN 210 CO 0.05 1.00 -0.43 0.00 -0.95 0.00 0.00 178.83 178.50 1ued h ARG 211 N 0.82 0.00 -0.10 1.46 3.08 -1.00 0.03 114.38 118.67 1ued h ARG 211 Ca 0.14 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.03 1ued h ARG 211 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1ued h ARG 211 CO 0.04 0.43 -0.61 0.00 -1.07 0.00 0.00 179.97 178.76 1ued h ALA 212 N 1.57 0.78 -1.12 0.04 0.00 -1.24 -3.41 119.26 115.87 1ued h ALA 212 Ca -0.00 -0.55 -0.18 0.00 0.00 0.00 0.00 54.91 54.18 1ued h ALA 212 Cb 0.77 -0.08 -0.18 0.00 0.00 0.00 0.00 17.79 18.30 1ued h ALA 212 CO 0.06 0.72 -0.53 0.34 0.00 0.00 0.00 179.25 179.84 1ued s ASP 213 N -6.91 -1.19 -0.04 0.00 2.15 -0.98 -5.12 116.67 104.58 1ued s ASP 213 Ca -0.05 -1.76 -0.35 0.00 0.43 0.00 0.00 52.55 50.82 1ued s ASP 213 Cb 0.12 1.70 -0.13 0.00 -0.30 0.00 0.00 42.92 44.30 1ued s ASP 213 CO 0.81 -0.07 1.72 -2.65 -0.17 0.00 0.00 175.17 174.81 1ued n PRO 214 N 3.08 1.88 -0.04 4.34 -0.02 -0.02 -4.70 135.00 139.52 1ued n PRO 214 Ca 0.18 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1ued n PRO 214 Cb 0.55 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1ued n PRO 214 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1ued n ASP 215 N 5.13 0.00 -1.30 2.55 5.68 -1.26 -4.98 116.55 122.37 1ued n ASP 215 Ca 0.21 -0.06 -0.02 0.00 -0.50 0.00 0.00 54.79 54.43 1ued n ASP 215 Cb 0.25 0.00 0.23 0.00 -1.14 0.00 0.00 41.12 40.47 1ued n ASP 215 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1ued n ASP 216 N -0.17 3.42 -2.08 -1.12 2.03 -1.26 -3.54 116.55 113.84 1ued n ASP 216 Ca 0.00 -3.43 0.00 0.00 0.52 0.00 0.00 54.79 51.88 1ued n ASP 216 Cb 0.00 -0.64 0.00 0.00 -0.72 0.00 0.00 41.12 39.76 1ued n ASP 216 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ued n GLY 217 N -0.78 -1.04 0.13 0.27 0.00 -1.26 -4.70 105.19 97.81 1ued n GLY 217 Ca 0.33 -1.68 -0.12 0.00 0.00 0.00 0.00 46.02 44.56 1ued n GLY 217 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ued h LEU 218 N 0.00 0.35 -0.23 0.99 6.46 -1.89 -1.25 115.31 119.72 1ued h LEU 218 Ca 0.00 -0.34 -0.06 0.00 -0.12 0.00 0.00 57.88 57.35 1ued h LEU 218 Cb 0.00 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 1ued h LEU 218 CO 0.00 0.61 -0.09 -0.07 -0.62 0.00 0.00 178.44 178.27 1ued h LEU 219 N 0.08 0.49 -0.54 2.25 3.38 -1.87 -2.48 115.31 116.61 1ued h LEU 219 Ca 0.05 -0.39 0.07 0.00 0.09 0.00 0.00 57.88 57.70 1ued h LEU 219 Cb 0.45 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 1ued h LEU 219 CO 0.01 0.77 0.22 1.23 0.09 0.00 0.00 178.44 180.76 1ued h GLY 220 N 0.20 0.74 0.94 0.83 0.00 -1.76 0.06 103.07 104.08 1ued h GLY 220 Ca 0.06 -0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.28 1ued h GLY 220 CO 0.03 0.03 0.47 -0.33 0.00 0.00 0.00 176.54 176.74 1ued h MET 221 N 0.42 0.92 -0.23 4.80 2.86 -1.14 0.70 114.93 123.25 1ued h MET 221 Ca 0.26 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.81 1ued h MET 221 Cb 0.26 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1ued h MET 221 CO -0.24 0.61 0.02 0.82 1.06 0.00 0.00 176.91 179.18 1ued h ILE 222 N 0.95 1.24 -0.39 -1.22 2.04 -0.88 0.90 117.51 120.15 1ued h ILE 222 Ca 0.28 -0.82 -0.07 0.00 1.00 0.00 0.00 64.86 65.25 1ued h ILE 222 Cb -0.05 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1ued h ILE 222 CO -0.08 0.26 -0.06 -0.37 0.00 0.00 0.00 178.15 177.90 1ued h VAL 223 N 0.18 1.23 0.21 1.67 -1.51 -0.79 0.57 116.25 117.82 1ued h VAL 223 Ca 0.07 -1.00 -0.01 0.00 -1.23 0.00 0.00 66.70 64.53 1ued h VAL 223 Cb 0.36 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.52 1ued h VAL 223 CO 0.01 0.34 -0.10 -0.09 -1.23 0.00 0.00 177.57 176.49 1ued h ARG 224 N 0.60 -0.28 0.00 5.19 2.43 -0.64 0.77 114.38 122.45 1ued h ARG 224 Ca 0.12 0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.19 1ued h ARG 224 Cb 0.46 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1ued h ARG 224 CO 0.02 0.01 -0.55 -0.44 -1.51 0.00 0.00 179.97 177.51 1ued h ASP 225 N -0.57 0.00 0.00 -3.80 3.45 -0.66 -3.39 116.42 111.45 1ued h ASP 225 Ca -0.03 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.43 1ued h ASP 225 Cb 0.42 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.19 1ued h ASP 225 CO 0.05 0.55 -0.91 1.41 -1.57 0.00 0.00 179.24 178.77 1ued n HIS 226 N -3.60 0.00 0.00 4.55 8.25 0.20 -4.99 115.22 119.63 1ued n HIS 226 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ued n HIS 226 Cb 0.62 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.73 1ued n HIS 226 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ued n GLY 227 N 2.43 0.00 0.15 -1.41 0.00 0.27 0.30 105.19 106.92 1ued n GLY 227 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1ued n GLY 227 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ued h ASP 228 N 0.00 0.40 -0.48 1.61 5.19 -1.94 -3.27 116.42 117.93 1ued h ASP 228 Ca 0.00 -0.35 0.02 0.00 -0.62 0.00 0.00 57.03 56.08 1ued h ASP 228 Cb 0.00 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 39.38 1ued h ASP 228 CO 0.00 0.66 0.32 -1.13 -3.12 0.00 0.00 179.24 175.97 1ued h ASN 229 N 0.14 0.48 -3.11 6.45 -0.73 -0.56 -3.43 115.58 114.82 1ued h ASN 229 Ca 0.06 -0.01 -0.67 0.00 1.87 0.00 0.00 56.30 57.55 1ued h ASN 229 Cb 0.48 -0.11 -0.13 0.00 0.27 0.00 0.00 38.32 38.83 1ued h ASN 229 CO 0.02 0.34 -0.57 0.54 -0.37 0.00 0.00 177.43 177.38 1ued s VAL 230 N -5.50 4.72 0.52 2.57 0.11 -1.24 -5.11 120.40 116.47 1ued s VAL 230 Ca -0.08 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 58.84 1ued s VAL 230 Cb 0.18 -3.03 -0.01 0.00 -1.53 0.00 0.00 36.38 31.99 1ued s VAL 230 CO 0.74 0.59 0.80 0.42 -3.33 0.00 0.00 175.10 174.32 1ued s THR 231 N -0.79 4.15 0.28 5.04 -4.23 -1.26 -4.85 115.64 113.97 1ued s THR 231 Ca 0.13 -0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.57 1ued s THR 231 Cb -0.12 -3.59 0.09 0.00 1.34 0.00 0.00 72.50 70.22 1ued s THR 231 CO 0.03 -0.55 1.74 0.44 -0.54 0.00 0.00 174.62 175.74 1ued h ASP 232 N 0.11 0.59 -0.55 3.99 5.19 -1.99 -1.47 116.42 122.29 1ued h ASP 232 Ca -0.46 -0.17 -0.06 0.00 -0.62 0.00 0.00 57.03 55.72 1ued h ASP 232 Cb 1.24 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 40.56 1ued h ASP 232 CO 0.60 0.76 0.15 -0.33 -3.12 0.00 0.00 179.24 177.30 1ued h GLU 233 N 0.54 0.92 -0.35 3.56 4.39 -1.97 -0.50 114.58 121.17 1ued h GLU 233 Ca 0.09 -0.19 -0.11 0.00 0.34 0.00 0.00 59.36 59.48 1ued h GLU 233 Cb 0.57 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1ued h GLU 233 CO 0.04 0.82 -0.25 0.93 -1.16 0.00 0.00 179.01 179.38 1ued h GLU 234 N 0.88 0.71 -0.41 2.33 5.08 -1.73 -1.63 114.58 119.81 1ued h GLU 234 Ca 0.19 -0.29 -0.13 0.00 -1.00 0.00 0.00 59.36 58.13 1ued h GLU 234 Cb 0.31 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1ued h GLU 234 CO -0.00 0.89 -0.25 -0.07 -1.00 0.00 0.00 179.01 178.59 1ued h LEU 235 N 0.62 0.87 -0.52 1.33 3.38 -0.73 -1.07 115.31 119.19 1ued h LEU 235 Ca 0.08 -0.33 -0.11 0.00 0.09 0.00 0.00 57.88 57.62 1ued h LEU 235 Cb 0.75 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1ued h LEU 235 CO 0.06 1.07 -0.09 0.11 0.09 0.00 0.00 178.44 179.69 1ued h LYS 236 N 0.73 0.98 -0.36 1.13 1.57 -0.95 -1.43 116.57 118.24 1ued h LYS 236 Ca 0.09 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1ued h LYS 236 Cb 0.79 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 1ued h LYS 236 CO 0.07 1.03 0.20 0.78 -0.57 0.00 0.00 179.45 180.95 1ued h GLY 237 N 0.85 0.55 1.01 3.86 0.00 -1.10 -1.41 103.07 106.82 1ued h GLY 237 Ca 0.14 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1ued h GLY 237 CO 0.04 0.24 0.46 1.41 0.00 0.00 0.00 176.54 178.69 1ued h LEU 238 N 0.46 0.83 -0.31 3.11 3.38 -1.04 0.52 115.31 122.26 1ued h LEU 238 Ca 0.13 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1ued h LEU 238 Cb 0.06 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 1ued h LEU 238 CO -0.02 0.61 0.00 0.00 0.09 0.00 0.00 178.44 179.12 1ued h THR 240 N 0.09 1.09 -0.75 0.00 2.02 -0.79 -1.08 112.91 113.49 1ued h THR 240 Ca 0.15 -0.22 0.05 0.00 0.77 0.00 0.00 66.41 67.15 1ued h THR 240 Cb 0.20 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 66.94 1ued h THR 240 CO -0.25 0.12 0.45 0.00 0.37 0.00 0.00 175.52 176.22 1ued h ALA 241 N 1.21 1.00 -0.43 6.16 0.00 -0.34 0.01 119.26 126.86 1ued h ALA 241 Ca 0.20 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1ued h ALA 241 Cb -0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ued h ALA 241 CO -0.07 0.20 -0.29 -0.07 0.00 0.00 0.00 179.25 179.03 1ued h LEU 242 N 0.86 0.98 -0.03 0.00 3.38 -0.86 0.39 115.31 120.03 1ued h LEU 242 Ca 0.32 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1ued h LEU 242 Cb 0.10 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1ued h LEU 242 CO -0.15 1.19 0.01 0.40 0.09 0.00 0.00 178.44 179.98 1ued h ILE 243 N 0.80 1.17 0.00 1.22 2.04 -0.85 0.19 117.51 122.08 1ued h ILE 243 Ca 0.09 -0.51 -0.08 0.00 1.00 0.00 0.00 64.86 65.37 1ued h ILE 243 Cb 0.87 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1ued h ILE 243 CO 0.08 0.14 -0.37 -0.07 0.00 0.00 0.00 178.15 177.93 1ued h LEU 244 N -0.15 0.00 0.00 1.44 3.38 -0.89 -2.11 115.31 116.97 1ued h LEU 244 Ca 0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 1ued h LEU 244 Cb 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1ued h LEU 244 CO -0.00 0.37 -1.24 1.23 0.09 0.00 0.00 178.44 178.89 1ued h GLY 245 N 1.42 0.00 0.00 0.83 0.00 -0.09 -3.43 103.07 101.80 1ued h GLY 245 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 1ued h GLY 245 CO 0.05 0.00 -1.40 0.61 0.00 0.00 0.00 176.54 175.80 1ued n GLY 246 N 1.37 -0.38 0.21 4.60 0.00 0.65 -4.47 105.19 107.17 1ued n GLY 246 Ca -0.07 -0.19 -0.08 0.00 0.00 0.00 0.00 46.02 45.68 1ued n GLY 246 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ued h VAL 247 N 0.00 0.14 0.00 1.61 2.07 -1.55 -3.03 116.25 115.49 1ued h VAL 247 Ca -0.03 -0.73 -0.06 0.00 0.82 0.00 0.00 66.70 66.69 1ued h VAL 247 Cb 0.56 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1ued h VAL 247 CO 0.00 0.04 -0.29 -0.33 0.02 0.00 0.00 177.57 177.01 1ued h GLU 248 N -1.09 0.00 -0.08 1.57 4.39 -1.84 -1.66 114.58 115.87 1ued h GLU 248 Ca -0.04 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 1ued h GLU 248 Cb 0.39 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1ued h GLU 248 CO 0.07 0.29 -0.07 1.79 -1.16 0.00 0.00 179.01 179.94 1ued h THR 249 N 0.00 1.35 -0.54 1.13 1.35 -1.78 0.15 112.91 114.57 1ued h THR 249 Ca -0.00 -1.17 -0.05 0.00 -0.55 0.00 0.00 66.41 64.63 1ued h THR 249 Cb 0.71 1.95 -0.02 0.00 -1.73 0.00 0.00 68.15 69.06 1ued h THR 249 CO 0.04 0.33 0.14 0.58 -0.25 0.00 0.00 175.52 176.35 1ued h VAL 250 N -0.21 1.24 -0.61 6.82 2.07 -1.45 -0.30 116.25 123.81 1ued h VAL 250 Ca 0.02 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 1ued h VAL 250 Cb 0.56 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1ued h VAL 250 CO 0.02 0.31 0.34 0.00 0.02 0.00 0.00 177.57 178.27 1ued h ALA 251 N 1.01 0.78 -0.62 1.67 0.00 -1.29 -0.88 119.26 119.93 1ued h ALA 251 Ca 0.17 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1ued h ALA 251 Cb 0.33 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1ued h ALA 251 CO 0.00 0.29 0.13 0.78 0.00 0.00 0.00 179.25 180.45 1ued h GLY 252 N 0.83 1.09 1.01 0.00 0.00 -0.54 -0.09 103.07 105.37 1ued h GLY 252 Ca 0.22 -0.71 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 1ued h GLY 252 CO -0.04 0.66 0.28 -0.33 0.00 0.00 0.00 176.54 177.11 1ued h MET 253 N 0.93 0.96 0.02 4.80 2.86 -0.78 0.12 114.93 123.84 1ued h MET 253 Ca 0.19 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1ued h MET 253 Cb 0.39 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1ued h MET 253 CO 0.01 0.79 -0.01 0.82 1.06 0.00 0.00 176.91 179.58 1ued h ILE 254 N 0.91 1.18 0.28 -1.22 2.04 -0.98 0.22 117.51 119.94 1ued h ILE 254 Ca 0.22 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1ued h ILE 254 Cb 0.18 1.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1ued h ILE 254 CO -0.02 0.16 -0.13 1.23 0.00 0.00 0.00 178.15 179.38 1ued h GLY 255 N -0.30 -0.39 1.55 5.37 0.00 -0.97 -1.05 103.07 107.29 1ued h GLY 255 Ca -0.00 0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.37 1ued h GLY 255 CO 0.00 -0.14 -0.24 0.74 0.00 0.00 0.00 176.54 176.90 1ued h PHE 256 N -0.48 0.59 -0.73 5.60 0.05 -0.85 -2.31 116.94 118.82 1ued h PHE 256 Ca -0.04 -0.13 -0.04 0.00 3.82 0.00 0.00 57.97 61.58 1ued h PHE 256 Cb 0.36 -0.15 -0.03 0.00 2.00 0.00 0.00 35.95 38.13 1ued h PHE 256 CO -0.03 0.73 0.29 0.78 -0.18 0.00 0.00 178.31 179.89 1ued h GLY 257 N 1.01 1.16 0.92 -1.45 0.00 -0.42 0.14 103.07 104.43 1ued h GLY 257 Ca 0.07 -0.62 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 1ued h GLY 257 CO 0.05 0.59 -0.11 -2.08 0.00 0.00 0.00 176.54 174.99 1ued h VAL 258 N 1.06 1.29 -0.67 4.60 2.07 -0.98 0.76 116.25 124.38 1ued h VAL 258 Ca 0.24 -1.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 1ued h VAL 258 Cb 0.21 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1ued h VAL 258 CO -0.02 0.38 0.42 -0.07 0.02 0.00 0.00 177.57 178.30 1ued h LEU 259 N 0.40 0.79 -0.52 2.57 3.38 -1.04 -0.78 115.31 120.11 1ued h LEU 259 Ca 0.08 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 1ued h LEU 259 Cb 0.62 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1ued h LEU 259 CO 0.04 0.60 -0.25 0.00 0.09 0.00 0.00 178.44 178.92 1ued h ALA 260 N 1.22 0.71 -0.07 1.53 0.00 -0.57 -2.43 119.26 119.65 1ued h ALA 260 Ca 0.24 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 1ued h ALA 260 Cb -0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ued h ALA 260 CO -0.05 0.67 -0.64 -0.07 0.00 0.00 0.00 179.25 179.17 1ued h LEU 261 N 0.81 0.29 -1.15 0.00 3.38 -0.66 -1.78 115.31 116.20 1ued h LEU 261 Ca 0.10 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1ued h LEU 261 Cb 0.82 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1ued h LEU 261 CO 0.07 0.85 -0.35 -0.07 0.09 0.00 0.00 178.44 179.04 1ued h LEU 262 N 0.19 0.14 -0.65 1.67 3.38 -1.07 -2.32 115.31 116.65 1ued h LEU 262 Ca -0.01 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1ued h LEU 262 Cb 1.16 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1ued h LEU 262 CO 0.10 0.48 -0.14 0.44 0.09 0.00 0.00 178.44 179.41 1ued h ASP 263 N 0.12 0.00 -2.09 -0.43 3.45 -1.13 -3.34 116.42 112.99 1ued h ASP 263 Ca 0.01 0.00 -0.53 0.00 0.43 0.00 0.00 57.03 56.94 1ued h ASP 263 Cb 0.68 0.00 -0.41 0.00 -0.56 0.00 0.00 39.33 39.04 1ued h ASP 263 CO 0.05 0.14 -0.99 0.59 -1.57 0.00 0.00 179.24 177.46 1ued n ASN 264 N -3.19 1.94 -0.30 6.45 3.02 -0.70 -4.99 115.26 117.49 1ued n ASN 264 Ca 0.02 -3.18 0.33 0.00 -0.03 0.00 0.00 54.58 51.72 1ued n ASN 264 Cb 0.48 -0.61 0.72 0.00 -0.61 0.00 0.00 39.78 39.76 1ued n ASN 264 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1ued h PRO 265 N 3.24 0.05 0.00 3.52 0.13 -1.56 0.31 132.00 137.68 1ued h PRO 265 Ca 0.11 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1ued h PRO 265 Cb 0.81 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 1ued h PRO 265 CO 0.61 0.03 -0.01 0.78 -0.23 0.00 0.00 178.00 179.17 1ued h GLY 266 N 0.05 0.00 2.00 1.56 0.00 -1.94 -2.05 103.07 102.69 1ued h GLY 266 Ca 0.55 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.81 1ued h GLY 266 CO -0.05 0.00 -0.33 1.46 0.00 0.00 0.00 176.54 177.62 1ued h GLN 267 N 0.00 0.00 -0.90 4.80 1.08 -1.25 -3.24 115.11 115.60 1ued h GLN 267 Ca -0.00 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1ued h GLN 267 Cb 0.09 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.48 1ued h GLN 267 CO 0.00 0.33 0.59 0.82 -0.95 0.00 0.00 178.83 179.63 1ued h ILE 268 N 0.00 1.22 -0.73 2.54 2.04 -1.50 -2.39 117.51 118.68 1ued h ILE 268 Ca -0.00 -0.41 0.09 0.00 1.00 0.00 0.00 64.86 65.53 1ued h ILE 268 Cb 1.09 -0.09 -0.07 0.00 -0.74 0.00 0.00 36.82 37.01 1ued h ILE 268 CO 0.04 0.22 0.39 -0.33 0.00 0.00 0.00 178.15 178.47 1ued h GLU 269 N 1.21 0.66 -0.26 2.37 5.08 -1.68 -1.25 114.58 120.70 1ued h GLU 269 Ca 0.33 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.73 1ued h GLU 269 Cb -0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 1ued h GLU 269 CO -0.08 0.43 0.30 -0.07 -1.00 0.00 0.00 179.01 178.59 1ued h LEU 270 N 0.67 0.00 -1.31 1.33 3.38 -1.57 -2.04 115.31 115.77 1ued h LEU 270 Ca 0.35 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 1ued h LEU 270 Cb 0.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1ued h LEU 270 CO -0.24 0.00 0.10 -0.07 0.09 0.00 0.00 178.44 178.32 1ued h LEU 271 N 0.00 0.52 -2.56 1.67 3.38 -1.28 -2.85 115.31 114.19 1ued h LEU 271 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ued h LEU 271 Cb 0.72 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1ued h LEU 271 CO -0.00 0.52 0.00 0.49 0.09 0.00 0.00 178.44 179.54 1ued n PHE 272 N -4.34 0.63 -0.01 1.13 3.72 -0.78 -4.40 117.46 113.42 1ued n PHE 272 Ca 0.02 -0.38 -0.13 0.00 -0.05 0.00 0.00 57.45 56.91 1ued n PHE 272 Cb 0.18 -0.01 -0.10 0.00 -0.94 0.00 0.00 39.48 38.62 1ued n PHE 272 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1ued h GLU 273 N 3.67 -0.01 -2.17 -1.08 4.81 -1.40 -3.48 114.58 114.92 1ued h GLU 273 Ca 0.00 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.37 1ued h GLU 273 Cb 0.89 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.13 1ued h GLU 273 CO 0.00 0.48 0.54 -1.54 -0.73 0.00 0.00 179.01 177.76 1ued s SER 274 N -5.69 -0.30 0.43 1.04 1.04 -1.26 -4.97 113.70 103.99 1ued s SER 274 Ca -0.16 -0.06 0.11 0.00 0.48 0.00 0.00 55.95 56.32 1ued s SER 274 Cb 0.01 0.36 0.95 0.00 0.10 0.00 0.00 66.02 67.45 1ued s SER 274 CO 0.67 -0.61 2.02 1.55 0.98 0.00 0.00 173.24 177.85 1ued h PRO 275 N 2.00 0.24 -0.31 4.02 0.13 -1.93 -0.28 132.00 135.87 1ued h PRO 275 Ca -0.21 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 64.72 1ued h PRO 275 Cb 1.23 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1ued h PRO 275 CO 0.29 0.26 -0.48 0.93 -0.23 0.00 0.00 178.00 178.77 1ued h GLU 276 N 0.24 0.83 0.00 0.86 3.07 -1.97 -2.32 114.58 115.30 1ued h GLU 276 Ca 0.06 -0.49 -0.12 0.00 -0.50 0.00 0.00 59.36 58.31 1ued h GLU 276 Cb 0.15 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1ued h GLU 276 CO 0.00 1.12 -0.59 -0.22 -1.40 0.00 0.00 179.01 177.92 1ued h LYS 277 N 0.66 0.00 -0.41 2.33 1.63 -1.70 -2.84 116.57 116.24 1ued h LYS 277 Ca 0.03 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.70 1ued h LYS 277 Cb 1.07 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 1ued h LYS 277 CO 0.11 0.59 -0.29 0.00 -3.45 0.00 0.00 179.45 176.41 1ued h ALA 278 N 1.41 0.71 -0.50 5.00 0.00 -0.98 -1.91 119.26 122.99 1ued h ALA 278 Ca -0.01 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 1ued h ALA 278 Cb 1.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1ued h ALA 278 CO 0.08 0.67 0.06 0.93 0.00 0.00 0.00 179.25 180.98 1ued h GLU 279 N 0.76 0.80 -0.32 0.00 5.08 -1.33 -2.21 114.58 117.35 1ued h GLU 279 Ca 0.09 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.15 1ued h GLU 279 Cb 0.85 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1ued h GLU 279 CO 0.07 0.77 -0.24 0.00 -1.00 0.00 0.00 179.01 178.61 1ued h ARG 280 N 0.76 0.64 -0.39 2.33 3.08 -1.25 0.39 114.38 119.93 1ued h ARG 280 Ca 0.16 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 1ued h ARG 280 Cb 0.37 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1ued h ARG 280 CO 0.01 0.82 0.11 0.28 -1.07 0.00 0.00 179.97 180.12 1ued h VAL 281 N 0.56 1.22 -0.07 2.04 2.07 -1.02 0.13 116.25 121.17 1ued h VAL 281 Ca 0.08 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1ued h VAL 281 Cb 0.72 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1ued h VAL 281 CO 0.05 0.26 0.03 0.58 0.02 0.00 0.00 177.57 178.52 1ued h VAL 282 N 0.49 1.10 -0.58 2.57 2.07 -1.15 0.57 116.25 121.32 1ued h VAL 282 Ca 0.12 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1ued h VAL 282 Cb 0.29 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1ued h VAL 282 CO -0.00 0.09 0.27 0.78 0.02 0.00 0.00 177.57 178.73 1ued h ASN 283 N -0.00 0.74 -0.40 0.57 2.35 -0.78 -1.68 115.58 116.38 1ued h ASN 283 Ca 0.02 -0.07 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 1ued h ASN 283 Cb 0.11 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1ued h ASN 283 CO -0.00 0.64 -0.25 -0.08 -1.65 0.00 0.00 177.43 176.08 1ued h GLU 284 N 0.82 0.92 -0.77 0.81 4.57 -0.48 -1.34 114.58 119.11 1ued h GLU 284 Ca 0.20 -0.40 -0.05 0.00 -1.18 0.00 0.00 59.36 57.93 1ued h GLU 284 Cb 0.10 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 1ued h GLU 284 CO -0.03 1.06 0.28 -0.07 -1.18 0.00 0.00 179.01 179.07 1ued h LEU 285 N 0.79 1.09 -0.47 1.64 3.38 -0.45 -0.28 115.31 121.01 1ued h LEU 285 Ca 0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1ued h LEU 285 Cb 0.81 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1ued h LEU 285 CO 0.07 0.99 0.25 0.58 0.09 0.00 0.00 178.44 180.41 1ued h VAL 286 N 1.14 1.17 0.34 1.22 2.07 -1.10 0.14 116.25 121.23 1ued h VAL 286 Ca 0.25 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1ued h VAL 286 Cb 0.26 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1ued h VAL 286 CO -0.02 0.19 -0.16 -0.09 0.02 0.00 0.00 177.57 177.51 1ued h ARG 287 N 0.62 -0.44 -0.66 1.57 2.43 -0.97 -0.05 114.38 116.88 1ued h ARG 287 Ca 0.16 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1ued h ARG 287 Cb 0.08 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 1ued h ARG 287 CO -0.02 -0.25 0.26 -0.92 -1.51 0.00 0.00 179.97 177.53 1ued h TYR 288 N -0.52 0.98 0.13 2.20 3.20 -0.96 -3.31 116.97 118.69 1ued h TYR 288 Ca -0.05 -0.06 -0.35 0.00 3.14 0.00 0.00 58.73 61.41 1ued h TYR 288 Cb 0.39 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1ued h TYR 288 CO -0.04 0.75 -1.89 -0.07 -1.64 0.00 0.00 178.16 175.27 1ued h LEU 289 N 0.95 0.43 -3.44 2.82 3.38 -0.68 -3.48 115.31 115.29 1ued h LEU 289 Ca 0.22 -0.86 -0.39 0.00 0.09 0.00 0.00 57.88 56.94 1ued h LEU 289 Cb 0.18 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ued h LEU 289 CO -0.02 1.76 -0.84 -1.20 0.09 0.00 0.00 178.44 178.23 1ued n SER 290 N -3.47 -3.53 -0.08 -0.43 7.64 -0.04 -4.84 113.62 108.86 1ued n SER 290 Ca -0.28 -0.80 0.05 0.00 1.01 0.00 0.00 58.87 58.86 1ued n SER 290 Cb 1.06 -1.20 0.40 0.00 -1.01 0.00 0.00 64.21 63.45 1ued n SER 290 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1ued h PRO 291 N -0.22 0.62 -5.32 1.43 0.13 -1.88 -2.88 132.00 123.88 1ued h PRO 291 Ca -0.50 -0.04 -0.69 0.00 -0.87 0.00 0.00 66.00 63.90 1ued h PRO 291 Cb 1.07 -0.14 -0.14 0.00 0.13 0.00 0.00 31.00 31.92 1ued h PRO 291 CO 0.30 0.41 1.48 0.08 -0.23 0.00 0.00 178.00 180.04 1ued s VAL 292 N -5.56 4.55 0.08 1.56 1.01 -1.26 -0.95 120.40 119.82 1ued s VAL 292 Ca -0.09 -1.91 -0.17 0.00 0.00 0.00 0.00 61.98 59.81 1ued s VAL 292 Cb 0.18 -4.98 -0.10 0.00 0.00 0.00 0.00 36.38 31.48 1ued s VAL 292 CO 0.75 -1.75 1.42 -0.61 0.00 0.00 0.00 175.10 174.90 1ued h GLN 293 N 8.07 0.56 -3.34 2.72 4.15 -1.77 -3.42 115.11 122.08 1ued h GLN 293 Ca 0.30 -0.27 -0.50 0.00 0.77 0.00 0.00 58.65 58.94 1ued h GLN 293 Cb 0.93 -0.00 -0.40 0.00 0.21 0.00 0.00 27.48 28.21 1ued h GLN 293 CO 1.30 0.85 -0.76 0.00 -1.93 0.00 0.00 178.83 178.29 1ued s ALA 294 N -4.45 0.82 1.09 3.38 0.00 -1.26 -0.67 121.76 120.67 1ued s ALA 294 Ca -0.13 -0.64 -0.10 0.00 0.00 0.00 0.00 51.96 51.09 1ued s ALA 294 Cb 0.07 -1.17 0.14 0.00 0.00 0.00 0.00 23.12 22.17 1ued s ALA 294 CO 0.79 -1.23 0.58 -0.35 0.00 0.00 0.00 175.76 175.56 1ued n PRO 295 N 5.13 -1.66 -1.60 0.00 -0.04 -1.26 -4.91 135.00 130.65 1ued n PRO 295 Ca -0.08 -0.92 -0.48 0.00 -0.04 0.00 0.00 63.50 61.98 1ued n PRO 295 Cb 0.47 -0.78 -0.04 0.00 -0.04 0.00 0.00 33.50 33.11 1ued n PRO 295 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ued n ASN 296 N -3.79 1.78 -4.75 3.54 5.03 -1.26 -4.76 115.26 111.05 1ued n ASN 296 Ca 0.08 1.14 -0.38 0.00 0.87 0.00 0.00 54.58 56.28 1ued n ASN 296 Cb 0.29 -1.27 0.03 0.00 -1.02 0.00 0.00 39.78 37.82 1ued n ASN 296 CO 0.00 0.00 0.00 -2.84 -1.83 0.00 0.00 177.26 172.59 1ued s PRO 297 N -0.18 3.22 -0.20 3.52 0.02 -1.26 -4.82 135.00 135.30 1ued s PRO 297 Ca 0.74 2.18 -0.15 0.00 0.02 0.00 0.00 61.00 63.79 1ued s PRO 297 Cb -0.81 -2.27 -0.04 0.00 0.02 0.00 0.00 34.50 31.39 1ued s PRO 297 CO 0.50 -1.11 0.36 1.03 -0.33 0.00 0.00 177.00 177.45 1ued s ARG 298 N -2.88 4.17 -0.26 5.54 3.00 -0.45 -4.76 118.95 123.32 1ued s ARG 298 Ca 0.71 0.13 -0.12 0.00 0.00 0.00 0.00 55.73 56.44 1ued s ARG 298 Cb -0.39 -3.52 -0.05 0.00 0.00 0.00 0.00 34.95 30.99 1ued s ARG 298 CO 0.46 0.01 0.24 -1.17 0.00 0.00 0.00 175.30 174.84 1ued s LEU 299 N 1.18 4.07 0.16 2.53 2.96 -0.21 -0.73 118.68 128.63 1ued s LEU 299 Ca 0.17 0.15 -0.30 0.00 -0.22 0.00 0.00 54.13 53.93 1ued s LEU 299 Cb -0.14 -2.22 -0.08 0.00 0.50 0.00 0.00 46.19 44.24 1ued s LEU 299 CO 0.07 -0.04 1.32 0.00 -1.32 0.00 0.00 176.35 176.37 1ued s ALA 300 N 1.55 3.53 -0.47 5.97 0.00 -0.25 -0.13 121.76 131.96 1ued s ALA 300 Ca 0.10 1.08 0.06 0.00 0.00 0.00 0.00 51.96 53.20 1ued s ALA 300 Cb -0.15 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 1ued s ALA 300 CO 0.08 -0.54 0.41 0.44 0.00 0.00 0.00 175.76 176.15 1ued n ILE 301 N 3.19 0.00 -3.76 0.00 -5.35 0.58 -0.31 119.36 113.71 1ued n ILE 301 Ca 0.08 -0.41 -0.13 0.00 -0.27 0.00 0.00 62.75 62.03 1ued n ILE 301 Cb 0.43 1.05 -0.12 0.00 -1.74 0.00 0.00 39.64 39.26 1ued n ILE 301 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1ued s LYS 302 N -1.23 0.28 0.37 6.28 1.02 -1.16 -4.87 119.74 120.42 1ued s LYS 302 Ca 0.04 0.43 -0.27 0.00 0.02 0.00 0.00 55.97 56.19 1ued s LYS 302 Cb 0.05 0.06 -0.11 0.00 -0.52 0.00 0.00 37.83 37.30 1ued s LYS 302 CO 0.19 -0.08 1.28 -0.25 -0.92 0.00 0.00 175.35 175.58 1ued n ASP 303 N 3.38 2.69 -3.75 2.83 10.43 -1.26 -4.30 116.55 126.57 1ued n ASP 303 Ca -0.17 1.17 -0.13 0.00 2.57 0.00 0.00 54.79 58.23 1ued n ASP 303 Cb 0.57 -1.49 -0.10 0.00 1.84 0.00 0.00 41.12 41.93 1ued n ASP 303 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1ued s VAL 304 N -1.13 0.01 -0.27 2.53 0.11 0.48 -4.93 120.40 117.19 1ued s VAL 304 Ca 0.57 -0.10 -0.18 0.00 -2.93 0.00 0.00 61.98 59.34 1ued s VAL 304 Cb -0.55 -0.54 -0.02 0.00 -1.53 0.00 0.00 36.38 33.74 1ued s VAL 304 CO 0.61 -0.05 0.53 -0.69 -3.33 0.00 0.00 175.10 172.17 1ued s VAL 305 N -0.14 5.04 -0.06 2.04 1.01 -1.26 -0.14 120.40 126.89 1ued s VAL 305 Ca -0.03 0.84 -0.00 0.00 0.00 0.00 0.00 61.98 62.79 1ued s VAL 305 Cb -0.03 -3.87 0.03 0.00 0.00 0.00 0.00 36.38 32.51 1ued s VAL 305 CO 0.01 0.03 -0.01 -0.63 0.00 0.00 0.00 175.10 174.50 1ued s ILE 306 N 2.36 0.41 -1.44 2.22 1.01 0.77 -4.63 121.20 121.92 1ued s ILE 306 Ca 0.22 0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.80 1ued s ILE 306 Cb -0.16 -0.52 0.05 0.00 0.01 0.00 0.00 42.46 41.84 1ued s ILE 306 CO 0.10 0.24 1.01 -0.67 0.00 0.00 0.00 174.94 175.62 1ued n ASP 307 N 4.68 -4.68 0.00 3.58 -0.08 -1.26 -1.19 116.55 117.60 1ued n ASP 307 Ca -0.15 -0.70 0.00 0.00 -1.51 0.00 0.00 54.79 52.42 1ued n ASP 307 Cb 0.50 -4.32 0.00 0.00 2.34 0.00 0.00 41.12 39.65 1ued n ASP 307 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ued n GLY 308 N -1.75 0.58 3.49 0.27 0.00 -1.26 -4.92 105.19 101.60 1ued n GLY 308 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1ued n GLY 308 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ued s GLN 309 N -0.35 1.76 -0.36 1.61 -1.52 -0.33 -1.81 119.66 118.67 1ued s GLN 309 Ca 0.00 -1.22 -0.11 0.00 -1.95 0.00 0.00 55.36 52.08 1ued s GLN 309 Cb 0.00 -2.08 0.02 0.00 -0.22 0.00 0.00 33.01 30.72 1ued s GLN 309 CO 0.00 0.47 0.20 -1.17 -0.25 0.00 0.00 175.29 174.53 1ued s LEU 310 N -2.24 4.57 -0.30 2.90 1.98 -1.26 -0.16 118.68 124.17 1ued s LEU 310 Ca 0.18 -0.86 -0.18 0.00 -2.89 0.00 0.00 54.13 50.38 1ued s LEU 310 Cb -0.10 -2.02 -0.02 0.00 0.66 0.00 0.00 46.19 44.71 1ued s LEU 310 CO 0.10 -0.34 0.54 -0.63 -1.89 0.00 0.00 176.35 174.14 1ued s ILE 311 N 1.58 5.02 0.10 6.68 -1.09 0.80 -4.95 121.20 129.34 1ued s ILE 311 Ca 0.03 0.70 -0.24 0.00 -2.23 0.00 0.00 60.65 58.91 1ued s ILE 311 Cb -0.19 -3.91 -0.07 0.00 -1.58 0.00 0.00 42.46 36.72 1ued s ILE 311 CO 0.07 -0.06 0.73 -0.75 -1.23 0.00 0.00 174.94 173.69 1ued s LYS 312 N 2.41 4.47 0.18 2.79 2.20 -1.26 -0.39 119.74 130.14 1ued s LYS 312 Ca 0.21 1.03 -0.33 0.00 -0.36 0.00 0.00 55.97 56.53 1ued s LYS 312 Cb -0.15 -3.30 -0.15 0.00 -1.51 0.00 0.00 37.83 32.72 1ued s LYS 312 CO 0.11 0.47 1.27 0.00 -0.36 0.00 0.00 175.35 176.84 1ued n ALA 313 N 2.11 -0.21 0.00 3.13 0.00 -1.26 -0.61 120.51 123.66 1ued n ALA 313 Ca -0.05 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1ued n ALA 313 Cb 0.50 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.83 1ued n ALA 313 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ued n GLY 314 N 2.18 3.11 3.78 0.00 0.00 0.57 -4.96 105.19 109.87 1ued n GLY 314 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1ued n GLY 314 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ued s ASP 315 N -0.64 7.21 0.02 1.61 -0.00 0.22 -4.80 116.67 120.28 1ued s ASP 315 Ca 0.00 1.93 -0.05 0.00 -0.00 0.00 0.00 52.55 54.43 1ued s ASP 315 Cb 0.00 -2.59 -0.05 0.00 -0.00 0.00 0.00 42.92 40.29 1ued s ASP 315 CO 0.00 -0.17 0.25 -0.31 -0.00 0.00 0.00 175.17 174.95 1ued s TYR 316 N -1.57 3.55 -0.12 4.23 1.51 -1.26 -1.09 117.35 122.60 1ued s TYR 316 Ca 0.51 0.48 0.01 0.00 -1.01 0.00 0.00 57.07 57.05 1ued s TYR 316 Cb -0.21 -1.92 0.02 0.00 -0.11 0.00 0.00 41.96 39.74 1ued s TYR 316 CO 0.27 0.60 -0.12 0.08 -1.11 0.00 0.00 175.55 175.26 1ued s VAL 317 N -1.37 1.33 -0.08 0.71 1.01 0.09 -1.50 120.40 120.58 1ued s VAL 317 Ca 0.30 -0.50 -0.20 0.00 0.00 0.00 0.00 61.98 61.58 1ued s VAL 317 Cb -0.13 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1ued s VAL 317 CO 0.19 0.41 0.54 -0.76 0.00 0.00 0.00 175.10 175.49 1ued s LEU 318 N 1.36 4.32 -0.28 3.92 1.43 0.33 -1.34 118.68 128.41 1ued s LEU 318 Ca 0.00 0.96 -0.07 0.00 -1.03 0.00 0.00 54.13 53.99 1ued s LEU 318 Cb -0.14 -2.81 -0.01 0.00 0.03 0.00 0.00 46.19 43.27 1ued s LEU 318 CO -0.06 0.00 0.09 0.00 0.23 0.00 0.00 176.35 176.61 1ued s SER 320 N 1.55 6.22 0.21 0.00 0.15 -0.17 -4.03 113.70 117.63 1ued s SER 320 Ca 0.04 -0.98 -0.05 0.00 0.70 0.00 0.00 55.95 55.67 1ued s SER 320 Cb -0.16 -2.36 0.18 0.00 -1.71 0.00 0.00 66.02 61.96 1ued s SER 320 CO 0.03 -1.19 1.62 0.40 1.20 0.00 0.00 173.24 175.31 1ued h ILE 321 N 5.94 1.27 0.06 6.45 2.04 -1.16 -0.73 117.51 131.39 1ued h ILE 321 Ca -0.28 -1.35 -0.00 0.00 1.00 0.00 0.00 64.86 64.23 1ued h ILE 321 Cb 1.08 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 1ued h ILE 321 CO 1.09 0.45 -0.03 0.25 0.00 0.00 0.00 178.15 179.91 1ued h LEU 322 N 0.68 -0.07 -0.70 1.44 5.85 -1.78 -1.00 115.31 119.72 1ued h LEU 322 Ca 0.09 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.56 1ued h LEU 322 Cb 0.74 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 1ued h LEU 322 CO 0.06 0.10 -0.20 0.24 -0.34 0.00 0.00 178.44 178.30 1ued h MET 323 N -0.24 0.79 -0.82 1.25 2.86 -1.83 -2.50 114.93 114.45 1ued h MET 323 Ca -0.01 -0.31 0.01 0.00 -2.06 0.00 0.00 59.70 57.34 1ued h MET 323 Cb 0.21 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 1ued h MET 323 CO 0.01 0.92 0.54 0.00 1.06 0.00 0.00 176.91 179.44 1ued h ALA 324 N 1.08 1.04 0.00 6.32 0.00 -1.00 -1.12 119.26 125.59 1ued h ALA 324 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ued h ALA 324 Cb 0.71 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ued h ALA 324 CO 0.05 0.42 0.00 0.09 0.00 0.00 0.00 179.25 179.82 1ued n ASN 325 N -4.53 0.00 -1.18 0.00 3.02 -0.39 -2.19 115.26 109.99 1ued n ASN 325 Ca 0.09 0.47 0.10 0.00 -0.03 0.00 0.00 54.58 55.21 1ued n ASN 325 Cb 0.03 -0.49 0.28 0.00 -0.61 0.00 0.00 39.78 39.00 1ued n ASN 325 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ued n ARG 326 N -1.49 2.75 -2.40 3.52 5.12 -0.45 -4.82 116.66 118.90 1ued n ARG 326 Ca 0.05 -2.51 -0.42 0.00 -1.93 0.00 0.00 57.85 53.03 1ued n ARG 326 Cb 0.21 -1.50 -0.03 0.00 -1.16 0.00 0.00 32.46 29.98 1ued n ARG 326 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1ued s ASP 327 N -1.01 7.01 0.64 0.55 -1.08 -0.93 -4.74 116.67 117.11 1ued s ASP 327 Ca 0.43 1.93 0.39 0.00 -0.52 0.00 0.00 52.55 54.78 1ued s ASP 327 Cb 0.22 -2.56 2.18 0.00 -1.46 0.00 0.00 42.92 41.30 1ued s ASP 327 CO 0.29 -0.58 2.31 -0.33 0.52 0.00 0.00 175.17 177.38 1ued h GLU 328 N 7.36 0.00 0.00 4.34 3.07 -1.91 -1.10 114.58 126.35 1ued h GLU 328 Ca -0.37 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.43 1ued h GLU 328 Cb 1.18 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.08 1ued h GLU 328 CO 0.87 0.00 -0.29 0.00 -1.40 0.00 0.00 179.01 178.18 1ued h ALA 329 N 1.97 1.20 0.06 3.43 0.00 -1.95 -2.99 119.26 120.98 1ued h ALA 329 Ca 0.00 -0.27 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1ued h ALA 329 Cb 0.04 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ued h ALA 329 CO -0.00 0.37 -0.75 1.25 0.00 0.00 0.00 179.25 180.12 1ued h LEU 330 N 0.00 0.55 -7.00 0.00 5.85 -1.52 -3.48 115.31 109.71 1ued h LEU 330 Ca -0.00 -0.83 -0.04 0.00 0.84 0.00 0.00 57.88 57.85 1ued h LEU 330 Cb 0.65 -0.17 -0.21 0.00 0.37 0.00 0.00 40.66 41.30 1ued h LEU 330 CO 0.04 1.32 0.15 0.28 -0.34 0.00 0.00 178.44 179.89 1ued s THR 331 N -2.91 0.00 0.56 1.05 -1.32 -1.13 -4.95 115.64 106.94 1ued s THR 331 Ca -0.13 0.00 -0.21 0.00 -1.21 0.00 0.00 61.69 60.14 1ued s THR 331 Cb 0.03 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.97 1ued s THR 331 CO 0.84 0.00 1.27 -2.84 -2.21 0.00 0.00 174.62 171.68 1ued s PRO 332 N 0.35 3.13 -1.28 7.08 0.02 -1.25 -3.30 135.00 139.75 1ued s PRO 332 Ca 0.00 2.01 -0.09 0.00 0.02 0.00 0.00 61.00 62.94 1ued s PRO 332 Cb -0.05 -2.14 -0.00 0.00 0.02 0.00 0.00 34.50 32.33 1ued s PRO 332 CO 0.01 -1.13 0.61 -0.25 -0.33 0.00 0.00 177.00 175.91 1ued n ASP 333 N -1.20 -2.53 0.29 2.53 10.43 -1.26 -4.87 116.55 119.94 1ued n ASP 333 Ca 0.11 -0.99 0.18 0.00 2.57 0.00 0.00 54.79 56.66 1ued n ASP 333 Cb 0.47 -3.29 0.81 0.00 1.84 0.00 0.00 41.12 40.96 1ued n ASP 333 CO 0.00 0.00 0.00 1.55 -1.07 0.00 0.00 177.20 177.68 1ued h PRO 334 N -1.88 0.00 -0.68 -0.24 0.13 -1.85 -2.98 132.00 124.50 1ued h PRO 334 Ca -0.64 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1ued h PRO 334 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1ued h PRO 334 CO 0.56 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 178.09 1ued n ASP 335 N -3.13 3.11 -4.42 1.44 10.43 -1.26 -4.82 116.55 117.91 1ued n ASP 335 Ca -0.00 -2.36 -0.32 0.00 2.57 0.00 0.00 54.79 54.68 1ued n ASP 335 Cb 0.25 -0.51 -0.14 0.00 1.84 0.00 0.00 41.12 42.56 1ued n ASP 335 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1ued s VAL 336 N -1.81 2.68 -0.41 2.53 1.01 -1.13 -5.09 120.40 118.18 1ued s VAL 336 Ca 0.28 -0.96 -0.23 0.00 0.00 0.00 0.00 61.98 61.07 1ued s VAL 336 Cb 0.20 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.56 1ued s VAL 336 CO 0.11 0.52 0.76 -0.22 0.00 0.00 0.00 175.10 176.27 1ued s LEU 337 N -0.87 4.22 -0.30 3.92 2.96 -1.26 -4.99 118.68 122.37 1ued s LEU 337 Ca 0.12 0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.09 1ued s LEU 337 Cb -0.10 -2.95 0.14 0.00 0.50 0.00 0.00 46.19 43.77 1ued s LEU 337 CO 0.01 -0.82 0.32 -0.62 -1.32 0.00 0.00 176.35 173.92 1ued s ASP 338 N 2.00 1.48 0.07 3.68 2.15 -1.26 -4.96 116.67 119.83 1ued s ASP 338 Ca 0.29 -0.82 0.15 0.00 0.43 0.00 0.00 52.55 52.60 1ued s ASP 338 Cb -0.13 0.58 0.64 0.00 -0.30 0.00 0.00 42.92 43.71 1ued s ASP 338 CO 0.20 -0.37 1.46 0.00 -0.17 0.00 0.00 175.17 176.29 1ued n ALA 339 N 5.18 1.53 1.42 3.66 0.00 -1.26 -1.75 120.51 129.29 1ued n ALA 339 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1ued n ALA 339 Cb 0.46 -1.24 0.59 0.00 0.00 0.00 0.00 19.45 19.26 1ued n ALA 339 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ued n ASN 340 N -1.70 0.60 -4.68 0.00 3.02 -1.26 -4.78 115.26 106.47 1ued n ASN 340 Ca 0.02 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.56 1ued n ASN 340 Cb 0.15 -0.03 0.16 0.00 -0.61 0.00 0.00 39.78 39.45 1ued n ASN 340 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ued s ARG 341 N -2.42 1.07 0.26 3.52 1.70 -0.72 -4.91 118.95 117.45 1ued s ARG 341 Ca 0.30 1.46 -0.30 0.00 -0.47 0.00 0.00 55.73 56.72 1ued s ARG 341 Cb 0.20 -1.74 -0.10 0.00 -0.57 0.00 0.00 34.95 32.75 1ued s ARG 341 CO 0.47 -2.57 1.32 0.00 -1.08 0.00 0.00 175.30 173.43 1ued s ALA 342 N -2.67 3.53 0.22 7.88 0.00 -1.26 -4.92 121.76 124.52 1ued s ALA 342 Ca 0.66 1.18 -0.31 0.00 0.00 0.00 0.00 51.96 53.49 1ued s ALA 342 Cb -0.22 -3.48 -0.11 0.00 0.00 0.00 0.00 23.12 19.31 1ued s ALA 342 CO 0.58 -0.58 1.57 0.00 0.00 0.00 0.00 175.76 177.34 1ued s ALA 343 N -0.41 3.77 0.30 0.00 0.00 -1.26 -5.01 121.76 119.15 1ued s ALA 343 Ca 0.54 1.44 0.04 0.00 0.00 0.00 0.00 51.96 53.98 1ued s ALA 343 Cb -0.38 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.05 1ued s ALA 343 CO 0.44 -0.84 0.02 0.14 0.00 0.00 0.00 175.76 175.52 1ued s VAL 344 N 0.66 1.26 -1.23 0.00 -7.23 -1.26 -5.08 120.40 107.52 1ued s VAL 344 Ca 0.67 -2.03 -0.11 0.00 -1.81 0.00 0.00 61.98 58.70 1ued s VAL 344 Cb -0.45 -2.64 0.18 0.00 0.56 0.00 0.00 36.38 34.02 1ued s VAL 344 CO 0.37 -0.12 1.58 -0.24 -0.31 0.00 0.00 175.10 176.39 1ued n SER 345 N -0.62 5.24 -4.35 4.85 2.88 -1.26 -5.02 113.62 115.34 1ued n SER 345 Ca -0.03 -3.05 -0.29 0.00 -1.33 0.00 0.00 58.87 54.17 1ued n SER 345 Cb 0.65 -1.51 0.22 0.00 -0.75 0.00 0.00 64.21 62.82 1ued n SER 345 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1ued s ASP 346 N 1.83 1.55 -0.23 -3.46 -4.77 -1.26 -4.97 116.67 105.36 1ued s ASP 346 Ca 0.41 1.07 0.13 0.00 -3.30 0.00 0.00 52.55 50.85 1ued s ASP 346 Cb 0.02 -1.64 0.47 0.00 -1.09 0.00 0.00 42.92 40.67 1ued s ASP 346 CO 0.00 -3.79 1.37 1.33 0.70 0.00 0.00 175.17 174.79 1ued n VAL 347 N -4.59 2.33 -0.19 2.11 0.24 -1.26 -4.72 118.33 112.25 1ued n VAL 347 Ca 0.07 -2.51 0.07 0.00 -2.04 0.00 0.00 64.34 59.93 1ued n VAL 347 Cb 0.58 -0.28 0.36 0.00 -1.47 0.00 0.00 33.84 33.03 1ued n VAL 347 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1ued h GLY 348 N 1.05 0.96 -2.79 7.63 0.00 -1.88 -0.34 103.07 107.69 1ued h GLY 348 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1ued h GLY 348 CO 0.23 0.20 0.00 0.69 0.00 0.00 0.00 176.54 177.67 1ued n PHE 349 N -4.49 1.30 -1.46 5.60 3.72 -1.26 -4.83 117.46 116.04 1ued n PHE 349 Ca 0.11 -0.60 0.00 0.00 -0.05 0.00 0.00 57.45 56.91 1ued n PHE 349 Cb 0.26 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 1ued n PHE 349 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ued n GLY 350 N 1.09 -1.82 3.64 1.37 0.00 -0.14 -1.30 105.19 108.03 1ued n GLY 350 Ca 0.24 -1.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 1ued n GLY 350 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ued s HIS 351 N 0.00 -0.61 0.00 1.61 2.46 -1.26 -4.69 115.29 112.80 1ued s HIS 351 Ca 0.00 1.43 0.00 0.00 0.47 0.00 0.00 55.06 56.96 1ued s HIS 351 Cb 0.00 0.36 0.00 0.00 -0.13 0.00 0.00 32.58 32.81 1ued s HIS 351 CO 0.00 -0.30 0.00 0.41 -2.47 0.00 0.00 174.74 172.38 1ued n GLY 352 N 2.65 -1.07 0.26 1.59 0.00 -1.26 -3.47 105.19 103.88 1ued n GLY 352 Ca -0.14 -1.83 0.12 0.00 0.00 0.00 0.00 46.02 44.16 1ued n GLY 352 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1ued h ILE 353 N 0.00 0.67 -0.43 -0.61 3.07 -1.85 -2.10 117.51 116.26 1ued h ILE 353 Ca 0.00 -0.42 0.00 0.00 1.55 0.00 0.00 64.86 65.99 1ued h ILE 353 Cb 0.00 1.26 0.00 0.00 -0.27 0.00 0.00 36.82 37.81 1ued h ILE 353 CO 0.00 0.10 0.00 1.41 -1.05 0.00 0.00 178.15 178.61 1ued n HIS 354 N -3.84 0.56 -1.59 0.16 8.25 -1.26 -4.96 115.22 112.54 1ued n HIS 354 Ca -0.02 -0.28 -0.52 0.00 -0.26 0.00 0.00 57.72 56.64 1ued n HIS 354 Cb 0.20 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.25 1ued n HIS 354 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1ued n TYR 355 N 1.01 1.51 -1.34 4.41 4.19 -0.79 -4.64 117.16 121.51 1ued n TYR 355 Ca 0.18 0.63 -0.59 0.00 3.31 0.00 0.00 57.90 61.43 1ued n TYR 355 Cb 0.46 -2.33 -0.11 0.00 0.49 0.00 0.00 39.34 37.85 1ued n TYR 355 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1ued h VAL 357 N 6.05 0.77 -0.60 0.00 3.04 -1.92 -2.84 116.25 120.76 1ued h VAL 357 Ca -0.20 -0.78 0.00 0.00 -1.01 0.00 0.00 66.70 64.72 1ued h VAL 357 Cb 1.33 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 32.08 1ued h VAL 357 CO 1.00 0.19 0.00 0.61 -1.01 0.00 0.00 177.57 178.36 1ued n GLY 358 N -0.57 2.38 0.18 3.17 0.00 -1.26 -4.65 105.19 104.44 1ued n GLY 358 Ca -0.02 -0.75 -0.04 0.00 0.00 0.00 0.00 46.02 45.21 1ued n GLY 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ued h ALA 359 N 4.02 0.48 -0.40 4.61 0.00 -1.88 0.43 119.26 126.53 1ued h ALA 359 Ca 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1ued h ALA 359 Cb 1.27 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1ued h ALA 359 CO 0.18 -0.31 -0.14 0.00 0.00 0.00 0.00 179.25 178.98 1ued h ALA 360 N 1.33 1.00 -0.27 0.00 0.00 -1.86 -0.20 119.26 119.26 1ued h ALA 360 Ca 0.21 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1ued h ALA 360 Cb 0.26 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ued h ALA 360 CO -0.27 0.60 0.05 1.25 0.00 0.00 0.00 179.25 180.87 1ued h LEU 361 N 0.66 0.42 -0.52 0.00 5.85 -1.71 -1.82 115.31 118.19 1ued h LEU 361 Ca 0.11 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1ued h LEU 361 Cb 0.62 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1ued h LEU 361 CO 0.04 0.57 0.34 0.00 -0.34 0.00 0.00 178.44 179.05 1ued h ALA 362 N 0.87 0.66 -0.46 1.25 0.00 -0.60 -0.01 119.26 120.97 1ued h ALA 362 Ca 0.08 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ued h ALA 362 Cb 0.32 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1ued h ALA 362 CO 0.00 0.09 0.29 0.00 0.00 0.00 0.00 179.25 179.64 1ued h ARG 363 N 0.70 0.57 0.12 0.00 3.08 -0.96 0.45 114.38 118.33 1ued h ARG 363 Ca 0.19 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 1ued h ARG 363 Cb -0.07 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.86 1ued h ARG 363 CO -0.05 0.37 -0.06 1.03 -1.07 0.00 0.00 179.97 180.20 1ued h SER 364 N 0.58 -0.13 -0.86 7.04 0.87 -0.96 -2.25 113.55 117.84 1ued h SER 364 Ca 0.18 -0.17 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1ued h SER 364 Cb -0.02 0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 61.93 1ued h SER 364 CO -0.06 0.10 0.57 0.24 -0.53 0.00 0.00 176.83 177.14 1ued h MET 365 N -0.36 1.11 -0.55 2.24 2.86 -0.88 -2.40 114.93 116.95 1ued h MET 365 Ca -0.02 -0.07 -0.11 0.00 -2.06 0.00 0.00 59.70 57.44 1ued h MET 365 Cb 0.29 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1ued h MET 365 CO 0.03 0.73 -0.11 -0.07 1.06 0.00 0.00 176.91 178.55 1ued h LEU 366 N 1.14 1.03 -0.00 1.22 3.38 -0.89 0.55 115.31 121.74 1ued h LEU 366 Ca 0.32 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ued h LEU 366 Cb -0.10 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.37 1ued h LEU 366 CO -0.08 1.14 0.00 -0.09 0.09 0.00 0.00 178.44 179.50 1ued h ARG 367 N 0.92 0.00 -0.81 1.13 2.43 -1.20 -0.79 114.38 116.06 1ued h ARG 367 Ca 0.14 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1ued h ARG 367 Cb 0.67 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.18 1ued h ARG 367 CO 0.05 0.05 0.53 0.52 -1.51 0.00 0.00 179.97 179.61 1ued h MET 368 N -0.04 1.06 0.25 0.20 2.86 -1.35 -1.11 114.93 116.80 1ued h MET 368 Ca 0.00 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1ued h MET 368 Cb 0.04 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.47 1ued h MET 368 CO -0.00 0.70 -0.12 0.00 1.06 0.00 0.00 176.91 178.55 1ued h ALA 369 N 1.30 -0.33 -0.32 6.32 0.00 -0.55 -0.32 119.26 125.36 1ued h ALA 369 Ca 0.30 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1ued h ALA 369 Cb -0.11 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1ued h ALA 369 CO -0.07 -0.66 0.07 1.88 0.00 0.00 0.00 179.25 180.47 1ued h TYR 370 N -0.38 0.55 -0.54 0.00 0.99 -1.11 -1.48 116.97 115.00 1ued h TYR 370 Ca -0.03 -0.07 -0.03 0.00 2.00 0.00 0.00 58.73 60.59 1ued h TYR 370 Cb 0.29 -0.15 -0.02 0.00 1.00 0.00 0.00 36.73 37.84 1ued h TYR 370 CO -0.05 0.58 0.21 1.96 -0.00 0.00 0.00 178.16 180.86 1ued h GLN 371 N 0.36 0.81 -0.42 4.88 4.20 -1.17 -2.43 115.11 121.34 1ued h GLN 371 Ca 0.10 -0.15 -0.11 0.00 0.06 0.00 0.00 58.65 58.55 1ued h GLN 371 Cb 0.31 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1ued h GLN 371 CO 0.00 0.71 -0.15 1.15 -0.67 0.00 0.00 178.83 179.88 1ued h THR 372 N 0.73 1.28 -0.14 -0.54 2.02 -1.01 -1.35 112.91 113.89 1ued h THR 372 Ca 0.18 -1.28 0.04 0.00 0.77 0.00 0.00 66.41 66.12 1ued h THR 372 Cb 0.21 1.21 -0.05 0.00 -1.74 0.00 0.00 68.15 67.79 1ued h THR 372 CO -0.01 0.43 -0.14 0.25 0.37 0.00 0.00 175.52 176.42 1ued h LEU 373 N 0.67 -0.44 -0.57 2.58 5.85 -1.20 -0.16 115.31 122.03 1ued h LEU 373 Ca 0.10 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1ued h LEU 373 Cb 0.70 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1ued h LEU 373 CO 0.05 -0.18 0.00 -0.50 -0.34 0.00 0.00 178.44 177.47 1ued h TRP 374 N -0.17 0.00 -0.09 1.25 6.55 -1.38 0.19 115.95 122.30 1ued h TRP 374 Ca 0.10 0.00 -0.21 0.00 0.95 0.00 0.00 58.89 59.72 1ued h TRP 374 Cb 0.31 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 28.62 1ued h TRP 374 CO -0.27 0.00 -0.78 -0.09 -1.05 0.00 0.00 178.44 176.25 1ued h ARG 375 N 0.00 0.69 0.06 0.49 9.65 -0.79 -2.90 114.38 121.59 1ued h ARG 375 Ca 0.00 -0.62 -0.24 0.00 -1.10 0.00 0.00 59.98 58.02 1ued h ARG 375 Cb 0.76 0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 29.48 1ued h ARG 375 CO 0.00 1.23 -1.08 -0.09 2.80 0.00 0.00 179.97 182.83 1ued h ARG 376 N 0.37 0.21 -2.38 0.20 9.65 -0.87 -3.39 114.38 118.17 1ued h ARG 376 Ca -0.07 -0.31 -0.59 0.00 -1.10 0.00 0.00 59.98 57.91 1ued h ARG 376 Cb 1.43 0.11 -0.40 0.00 -1.39 0.00 0.00 29.97 29.71 1ued h ARG 376 CO 0.16 1.10 -0.81 1.19 2.80 0.00 0.00 179.97 184.41 1ued n PHE 377 N -3.54 1.51 0.03 2.20 3.01 0.64 -4.95 117.46 116.36 1ued n PHE 377 Ca -0.05 -3.85 0.12 0.00 1.01 0.00 0.00 57.45 54.67 1ued n PHE 377 Cb 0.94 -0.34 0.57 0.00 -0.01 0.00 0.00 39.48 40.63 1ued n PHE 377 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1ued h PRO 378 N 4.70 0.23 -0.80 -1.08 0.11 -1.72 -2.23 132.00 131.22 1ued h PRO 378 Ca 0.17 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 66.08 1ued h PRO 378 Cb 0.79 -0.05 -0.11 0.00 0.11 0.00 0.00 31.00 31.74 1ued h PRO 378 CO 0.61 0.15 0.24 0.41 -0.21 0.00 0.00 178.00 179.20 1ued n GLY 379 N -1.54 3.33 3.58 -0.55 0.00 -1.26 -5.00 105.19 103.75 1ued n GLY 379 Ca 0.06 -0.84 -0.48 0.00 0.00 0.00 0.00 46.02 44.76 1ued n GLY 379 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ued n LEU 380 N -0.07 1.63 -3.79 0.99 7.94 -0.84 -4.39 117.00 118.47 1ued n LEU 380 Ca 0.35 1.15 -0.13 0.00 -1.11 0.00 0.00 56.01 56.27 1ued n LEU 380 Cb 1.24 -1.24 -0.10 0.00 0.53 0.00 0.00 43.42 43.85 1ued n LEU 380 CO 0.38 -1.28 -0.06 -0.60 -1.11 0.00 0.00 177.39 174.71 1ued s ARG 381 N -0.55 0.45 0.19 1.96 3.52 0.20 -4.96 118.95 119.77 1ued s ARG 381 Ca 0.71 0.05 -0.31 0.00 -0.13 0.00 0.00 55.73 56.05 1ued s ARG 381 Cb -0.82 0.20 -0.09 0.00 -1.56 0.00 0.00 34.95 32.68 1ued s ARG 381 CO 0.53 -0.10 1.42 -1.17 -0.81 0.00 0.00 175.30 175.18 1ued s LEU 382 N -0.60 4.39 -0.07 -0.88 2.96 -1.26 -0.24 118.68 122.98 1ued s LEU 382 Ca -0.07 2.52 0.16 0.00 -0.22 0.00 0.00 54.13 56.52 1ued s LEU 382 Cb -0.04 -3.61 0.56 0.00 0.50 0.00 0.00 46.19 43.61 1ued s LEU 382 CO 0.02 -0.67 1.45 0.00 -1.32 0.00 0.00 176.35 175.83 1ued n ALA 383 N 3.06 2.82 -2.60 5.97 0.00 0.13 -4.75 120.51 125.15 1ued n ALA 383 Ca 0.09 -1.20 -0.09 0.00 0.00 0.00 0.00 53.44 52.24 1ued n ALA 383 Cb 0.41 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.78 1ued n ALA 383 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1ued s VAL 384 N -1.63 0.14 0.42 0.00 -7.23 -1.26 -4.95 120.40 105.89 1ued s VAL 384 Ca 0.41 -1.14 -0.26 0.00 -1.81 0.00 0.00 61.98 59.17 1ued s VAL 384 Cb 0.25 -1.26 -0.09 0.00 0.56 0.00 0.00 36.38 35.84 1ued s VAL 384 CO 0.22 -0.63 1.40 -2.84 -0.31 0.00 0.00 175.10 172.94 1ued s PRO 385 N -3.60 3.86 0.37 4.82 0.02 -1.26 -4.87 135.00 134.34 1ued s PRO 385 Ca 0.03 2.37 0.12 0.00 0.02 0.00 0.00 61.00 63.54 1ued s PRO 385 Cb 0.04 -2.75 0.92 0.00 0.02 0.00 0.00 34.50 32.73 1ued s PRO 385 CO -0.10 -0.66 1.85 0.97 -0.33 0.00 0.00 177.00 178.73 1ued h ILE 386 N 2.49 0.74 0.00 2.83 6.09 -1.99 0.83 117.51 128.51 1ued h ILE 386 Ca -0.50 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 1ued h ILE 386 Cb 1.25 0.11 0.00 0.00 0.47 0.00 0.00 36.82 38.66 1ued h ILE 386 CO 0.62 0.11 0.00 -1.84 -3.07 0.00 0.00 178.15 173.97 1ued n GLU 387 N -4.58 0.02 0.00 2.19 0.00 -1.26 -1.76 120.64 115.26 1ued n GLU 387 Ca 0.19 0.33 0.12 0.00 0.00 0.00 0.00 57.16 57.80 1ued n GLU 387 Cb 0.59 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.73 1ued n GLU 387 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1ued n GLU 388 N -1.47 0.23 -2.42 3.44 1.02 0.29 -4.88 120.64 116.85 1ued n GLU 388 Ca 0.02 -0.15 -0.42 0.00 -0.02 0.00 0.00 57.16 56.59 1ued n GLU 388 Cb 0.09 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 1ued n GLU 388 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1ued s VAL 389 N -2.87 3.98 0.12 2.62 1.01 -0.72 -5.03 120.40 119.51 1ued s VAL 389 Ca 0.14 1.45 0.04 0.00 0.00 0.00 0.00 61.98 63.61 1ued s VAL 389 Cb 0.18 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1ued s VAL 389 CO 0.69 0.12 0.07 -0.54 0.00 0.00 0.00 175.10 175.44 1ued s LYS 390 N 0.93 2.77 0.26 2.72 1.02 -1.26 -5.05 119.74 121.13 1ued s LYS 390 Ca 0.58 -0.82 0.11 0.00 0.02 0.00 0.00 55.97 55.86 1ued s LYS 390 Cb -0.30 -2.63 -0.05 0.00 -0.52 0.00 0.00 37.83 34.34 1ued s LYS 390 CO 0.30 0.52 -0.20 0.71 -0.92 0.00 0.00 175.35 175.76 1ued s TYR 391 N -1.53 2.20 0.70 3.18 2.02 -1.26 -0.77 117.35 121.89 1ued s TYR 391 Ca 0.29 -0.37 -0.11 0.00 -0.37 0.00 0.00 57.07 56.51 1ued s TYR 391 Cb -0.11 -0.98 0.01 0.00 -0.40 0.00 0.00 41.96 40.48 1ued s TYR 391 CO 0.21 0.64 1.09 1.03 -1.57 0.00 0.00 175.55 176.95 1ued s ARG 392 N -3.41 2.94 -0.47 -0.62 0.52 0.32 -4.70 118.95 113.52 1ued s ARG 392 Ca 0.28 0.53 0.03 0.00 -0.52 0.00 0.00 55.73 56.04 1ued s ARG 392 Cb -0.05 -2.02 0.14 0.00 0.52 0.00 0.00 34.95 33.53 1ued s ARG 392 CO 0.13 -0.99 0.26 -1.54 0.02 0.00 0.00 175.30 173.17 1ued s SER 393 N -4.30 3.86 0.13 0.23 1.04 -1.26 -4.58 113.70 108.82 1ued s SER 393 Ca 0.58 -2.81 0.02 0.00 0.48 0.00 0.00 55.95 54.22 1ued s SER 393 Cb -0.11 -1.24 -0.01 0.00 0.10 0.00 0.00 66.02 64.76 1ued s SER 393 CO 0.52 -0.25 0.13 0.00 0.98 0.00 0.00 173.24 174.63 1ued n ALA 394 N 3.33 0.17 0.27 5.32 0.00 -1.26 -5.02 120.51 123.31 1ued n ALA 394 Ca 0.08 -0.72 0.13 0.00 0.00 0.00 0.00 53.44 52.94 1ued n ALA 394 Cb 0.34 0.58 0.76 0.00 0.00 0.00 0.00 19.45 21.13 1ued n ALA 394 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1ued h PHE 395 N 1.41 0.00 -3.33 0.00 -1.00 -1.98 -3.40 116.94 108.64 1ued h PHE 395 Ca -0.09 0.00 -0.68 0.00 2.81 0.00 0.00 57.97 60.01 1ued h PHE 395 Cb 0.46 0.00 -0.33 0.00 3.61 0.00 0.00 35.95 39.69 1ued h PHE 395 CO 0.00 0.09 -0.87 0.08 -1.61 0.00 0.00 178.31 176.00 1ued s VAL 396 N -4.35 2.15 0.36 -0.55 1.01 -1.26 -4.65 120.40 113.11 1ued s VAL 396 Ca -0.04 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.69 1ued s VAL 396 Cb 0.14 -1.83 -0.09 0.00 0.00 0.00 0.00 36.38 34.60 1ued s VAL 396 CO 0.58 0.56 1.17 -1.81 0.00 0.00 0.00 175.10 175.60 1ued s ASP 397 N 0.38 6.73 -0.28 3.32 -0.00 -0.12 -4.88 116.67 121.80 1ued s ASP 397 Ca -0.17 2.37 -0.25 0.00 -0.00 0.00 0.00 52.55 54.50 1ued s ASP 397 Cb -0.18 -2.62 0.14 0.00 -0.00 0.00 0.00 42.92 40.26 1ued s ASP 397 CO 0.08 -0.54 1.14 0.00 -0.00 0.00 0.00 175.17 175.85 1ued s PRO 399 N 0.14 2.65 -0.13 0.00 0.02 -1.26 -0.52 135.00 135.89 1ued s PRO 399 Ca 0.04 1.94 -0.07 0.00 0.02 0.00 0.00 61.00 62.93 1ued s PRO 399 Cb -0.05 -1.87 -0.25 0.00 0.02 0.00 0.00 34.50 32.34 1ued s PRO 399 CO -0.09 -1.48 0.33 -3.47 -0.33 0.00 0.00 177.00 171.96 1ued n ASP 400 N -1.90 2.11 -3.77 2.53 2.03 0.05 -4.57 116.55 113.03 1ued n ASP 400 Ca 0.15 0.20 -0.13 0.00 0.52 0.00 0.00 54.79 55.54 1ued n ASP 400 Cb 0.49 -0.85 -0.12 0.00 -0.72 0.00 0.00 41.12 39.92 1ued n ASP 400 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1ued s GLN 401 N -2.55 0.30 -0.50 -0.67 -0.21 -1.25 -4.65 119.66 110.13 1ued s GLN 401 Ca -0.23 0.40 0.04 0.00 0.02 0.00 0.00 55.36 55.59 1ued s GLN 401 Cb 0.07 0.10 0.16 0.00 1.00 0.00 0.00 33.01 34.35 1ued s GLN 401 CO 0.75 -0.06 0.37 0.08 -2.12 0.00 0.00 175.29 174.31 1ued s VAL 402 N 0.35 1.17 0.14 1.09 1.01 -1.26 -4.50 120.40 118.40 1ued s VAL 402 Ca -0.02 -3.07 -0.31 0.00 0.00 0.00 0.00 61.98 58.58 1ued s VAL 402 Cb -0.03 -1.80 -0.10 0.00 0.00 0.00 0.00 36.38 34.45 1ued s VAL 402 CO -0.01 -1.13 1.71 -2.84 0.00 0.00 0.00 175.10 172.83 1ued s PRO 403 N -0.30 4.16 0.17 2.72 0.02 -1.26 -1.15 135.00 139.36 1ued s PRO 403 Ca 0.28 2.49 0.06 0.00 0.02 0.00 0.00 61.00 63.86 1ued s PRO 403 Cb -0.03 -3.36 -0.04 0.00 0.02 0.00 0.00 34.50 31.09 1ued s PRO 403 CO -0.16 -0.74 -0.12 0.14 -0.33 0.00 0.00 177.00 175.78 1ued s VAL 404 N 1.94 1.44 0.34 3.83 -7.23 -0.01 -0.69 120.40 120.02 1ued s VAL 404 Ca 0.75 -2.09 0.05 0.00 -1.81 0.00 0.00 61.98 58.88 1ued s VAL 404 Cb -0.45 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 1ued s VAL 404 CO 0.33 -0.65 0.20 0.28 -0.31 0.00 0.00 175.10 174.96 1ued s THR 405 N -3.05 0.23 0.00 5.32 -1.32 0.67 -0.35 115.64 117.14 1ued s THR 405 Ca 0.18 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.66 1ued s THR 405 Cb 0.00 -2.46 0.00 0.00 -1.51 0.00 0.00 72.50 68.53 1ued s THR 405 CO 0.04 0.00 0.00 -2.67 -2.21 0.00 0.00 174.62 169.78