#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dy3 s ASN 2 N 0.00 5.98 0.35 6.12 0.01 -1.26 -5.01 114.94 121.14 2dy3 s ASN 2 Ca 0.00 0.32 0.24 0.00 -0.71 0.00 0.00 52.86 52.70 2dy3 s ASN 2 Cb 0.00 -1.91 0.46 0.00 0.41 0.00 0.00 41.25 40.21 2dy3 s ASN 2 CO 0.00 0.35 1.62 -0.07 -1.51 0.00 0.00 177.10 177.49 2dy3 h LEU 3 N 5.40 0.00 -7.42 0.60 3.38 -1.94 -3.44 115.31 111.88 2dy3 h LEU 3 Ca -0.50 -0.01 -0.41 0.00 0.09 0.00 0.00 57.88 57.05 2dy3 h LEU 3 Cb 1.21 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 41.57 2dy3 h LEU 3 CO 0.60 0.00 -0.76 -0.22 0.09 0.00 0.00 178.44 178.16 2dy3 s LEU 4 N -5.63 0.45 0.21 1.67 2.96 -1.26 -1.03 118.68 116.05 2dy3 s LEU 4 Ca 0.08 -0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.85 2dy3 s LEU 4 Cb 0.08 -0.33 -0.01 0.00 0.50 0.00 0.00 46.19 46.43 2dy3 s LEU 4 CO 0.66 -0.21 0.38 0.42 -1.32 0.00 0.00 176.35 176.28 2dy3 s THR 5 N 2.01 0.03 -0.12 3.68 -4.23 -0.67 -0.83 115.64 115.51 2dy3 s THR 5 Ca 0.05 -1.38 0.03 0.00 -1.18 0.00 0.00 61.69 59.21 2dy3 s THR 5 Cb -0.12 -2.02 0.01 0.00 1.34 0.00 0.00 72.50 71.70 2dy3 s THR 5 CO -0.04 -0.12 -0.22 0.42 -0.54 0.00 0.00 174.62 174.12 2dy3 s THR 6 N -3.99 1.98 -0.24 3.99 -4.23 -0.26 -1.39 115.64 111.49 2dy3 s THR 6 Ca 0.20 -0.95 -0.18 0.00 -1.18 0.00 0.00 61.69 59.59 2dy3 s THR 6 Cb 0.01 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 72.08 2dy3 s THR 6 CO 0.05 0.54 0.49 -0.54 -0.54 0.00 0.00 174.62 174.61 2dy3 s LYS 7 N 0.66 4.11 -0.34 3.99 1.02 0.15 -0.78 119.74 128.54 2dy3 s LYS 7 Ca -0.11 0.31 -0.08 0.00 0.02 0.00 0.00 55.97 56.11 2dy3 s LYS 7 Cb -0.16 -3.61 0.03 0.00 -0.52 0.00 0.00 37.83 33.57 2dy3 s LYS 7 CO 0.02 -0.24 0.13 0.42 -0.92 0.00 0.00 175.35 174.76 2dy3 s ILE 8 N 1.96 4.02 -0.66 2.17 -1.09 0.20 -1.84 121.20 125.96 2dy3 s ILE 8 Ca 0.21 -1.02 -0.25 0.00 -2.23 0.00 0.00 60.65 57.36 2dy3 s ILE 8 Cb -0.15 -3.25 0.05 0.00 -1.58 0.00 0.00 42.46 37.52 2dy3 s ILE 8 CO 0.09 -0.17 1.10 -0.62 -1.23 0.00 0.00 174.94 174.11 2dy3 s ASP 9 N 1.45 6.23 0.28 3.58 -1.08 0.09 0.29 116.67 127.51 2dy3 s ASP 9 Ca -0.00 -0.55 0.03 0.00 -0.52 0.00 0.00 52.55 51.50 2dy3 s ASP 9 Cb -0.19 -2.49 0.40 0.00 -1.46 0.00 0.00 42.92 39.18 2dy3 s ASP 9 CO 0.04 -1.56 1.70 -0.07 0.52 0.00 0.00 175.17 175.80 2dy3 h LEU 10 N 11.98 0.43 -1.18 -1.34 3.38 -1.93 -2.75 115.31 123.89 2dy3 h LEU 10 Ca -0.28 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 2dy3 h LEU 10 Cb 1.06 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 2dy3 h LEU 10 CO 1.20 0.73 0.26 0.44 0.09 0.00 0.00 178.44 181.16 2dy3 h ASP 11 N 0.36 0.75 -0.72 -0.43 3.32 -1.99 -0.22 116.42 117.49 2dy3 h ASP 11 Ca 0.05 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 2dy3 h ASP 11 Cb 0.74 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 2dy3 h ASP 11 CO 0.06 0.66 0.33 0.00 -1.72 0.00 0.00 179.24 178.57 2dy3 h ALA 12 N 1.46 1.20 -0.40 3.45 0.00 -1.82 0.06 119.26 123.22 2dy3 h ALA 12 Ca 0.20 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2dy3 h ALA 12 Cb 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2dy3 h ALA 12 CO -0.02 0.60 -0.00 0.82 0.00 0.00 0.00 179.25 180.65 2dy3 h ILE 13 N 1.05 1.26 -0.42 0.00 2.04 -1.01 0.06 117.51 120.49 2dy3 h ILE 13 Ca 0.25 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 2dy3 h ILE 13 Cb 0.14 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2dy3 h ILE 13 CO -0.03 0.34 0.24 0.00 0.00 0.00 0.00 178.15 178.70 2dy3 h ALA 14 N 0.88 0.54 -0.00 1.87 0.00 -0.69 0.11 119.26 121.97 2dy3 h ALA 14 Ca 0.11 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2dy3 h ALA 14 Cb 0.48 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2dy3 h ALA 14 CO 0.02 0.05 -0.18 1.25 0.00 0.00 0.00 179.25 180.39 2dy3 h HIS 15 N 0.55 -0.46 -0.97 0.00 -0.00 -0.78 0.19 115.15 113.69 2dy3 h HIS 15 Ca 0.15 0.02 0.09 0.00 -0.00 0.00 0.00 60.37 60.62 2dy3 h HIS 15 Cb 0.03 0.20 -0.07 0.00 -0.00 0.00 0.00 27.41 27.57 2dy3 h HIS 15 CO -0.03 -0.25 0.61 -0.91 -0.00 0.00 0.00 177.93 177.35 2dy3 h ASN 16 N -0.29 0.94 -0.55 3.26 -0.26 -0.66 -0.01 115.58 118.02 2dy3 h ASN 16 Ca 0.06 0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 55.80 2dy3 h ASN 16 Cb 0.36 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.42 2dy3 h ASN 16 CO -0.17 0.56 0.25 0.74 -1.06 0.00 0.00 177.43 177.76 2dy3 h THR 17 N 1.05 1.21 -0.53 2.81 2.02 0.16 -0.73 112.91 118.91 2dy3 h THR 17 Ca 0.44 -0.61 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 2dy3 h THR 17 Cb 0.29 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 2dy3 h THR 17 CO -0.21 0.24 0.15 0.03 0.37 0.00 0.00 175.52 176.09 2dy3 h ARG 18 N 0.75 0.83 -0.36 6.66 3.08 0.06 0.01 114.38 125.41 2dy3 h ARG 18 Ca 0.19 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 2dy3 h ARG 18 Cb 0.14 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2dy3 h ARG 18 CO -0.02 0.78 -0.02 0.28 -1.07 0.00 0.00 179.97 179.92 2dy3 h VAL 19 N 0.73 1.21 0.03 2.04 2.07 -0.78 -0.95 116.25 120.59 2dy3 h VAL 19 Ca 0.17 -0.85 -0.23 0.00 0.82 0.00 0.00 66.70 66.60 2dy3 h VAL 19 Cb 0.31 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2dy3 h VAL 19 CO -0.00 0.29 -1.00 -0.07 0.02 0.00 0.00 177.57 176.81 2dy3 h LEU 20 N 0.54 0.50 -0.32 2.57 3.38 -0.88 -2.61 115.31 118.50 2dy3 h LEU 20 Ca 0.11 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 2dy3 h LEU 20 Cb 0.37 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2dy3 h LEU 20 CO 0.01 1.25 0.10 0.50 0.09 0.00 0.00 178.44 180.39 2dy3 h LYS 21 N 0.20 0.50 -0.62 1.13 1.63 -0.66 -0.66 116.57 118.09 2dy3 h LYS 21 Ca -0.09 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2dy3 h LYS 21 Cb 1.65 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 33.18 2dy3 h LYS 21 CO 0.17 0.55 0.40 0.37 -3.45 0.00 0.00 179.45 177.49 2dy3 h GLN 22 N 0.36 0.82 0.00 1.90 5.75 -1.22 -2.40 115.11 120.33 2dy3 h GLN 22 Ca 0.10 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.51 2dy3 h GLN 22 Cb 0.26 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 2dy3 h GLN 22 CO -0.00 0.55 -0.19 0.52 -2.65 0.00 0.00 178.83 177.06 2dy3 h MET 23 N 0.84 0.00 -0.00 1.69 2.86 -1.15 -2.90 114.93 116.27 2dy3 h MET 23 Ca 0.23 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.71 2dy3 h MET 23 Cb -0.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2dy3 h MET 23 CO -0.05 0.19 -0.74 0.00 1.06 0.00 0.00 176.91 177.37 2dy3 h ALA 24 N 1.81 0.78 -0.68 6.32 0.00 -0.60 -3.49 119.26 123.40 2dy3 h ALA 24 Ca -0.00 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2dy3 h ALA 24 Cb 0.44 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2dy3 h ALA 24 CO 0.02 0.92 0.00 0.41 0.00 0.00 0.00 179.25 180.60 2dy3 n GLY 25 N 0.59 2.81 0.23 0.00 0.00 -1.10 -2.46 105.19 105.27 2dy3 n GLY 25 Ca -0.01 -0.24 0.15 0.00 0.00 0.00 0.00 46.02 45.92 2dy3 n GLY 25 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dy3 h PRO 26 N 0.00 0.00 -7.00 1.61 0.13 -1.93 -3.45 132.00 121.36 2dy3 h PRO 26 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2dy3 h PRO 26 Cb 0.00 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.18 2dy3 h PRO 26 CO 0.00 0.00 0.47 0.00 -0.23 0.00 0.00 178.00 178.24 2dy3 s ALA 27 N -3.45 2.99 0.52 -0.56 0.00 -1.03 -5.01 121.76 115.22 2dy3 s ALA 27 Ca 0.04 0.88 -0.19 0.00 0.00 0.00 0.00 51.96 52.69 2dy3 s ALA 27 Cb 0.08 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 2dy3 s ALA 27 CO 0.57 -0.57 1.06 0.15 0.00 0.00 0.00 175.76 176.96 2dy3 s LYS 28 N -2.68 3.62 -0.37 0.00 1.02 0.33 -4.86 119.74 116.81 2dy3 s LYS 28 Ca 0.63 1.36 -0.07 0.00 0.02 0.00 0.00 55.97 57.91 2dy3 s LYS 28 Cb -0.27 -2.07 0.06 0.00 -0.52 0.00 0.00 37.83 35.03 2dy3 s LYS 28 CO 0.33 -0.58 0.16 -1.17 -0.92 0.00 0.00 175.35 173.17 2dy3 s LEU 29 N -3.76 4.66 -0.27 3.17 0.20 -1.26 -1.84 118.68 119.57 2dy3 s LEU 29 Ca 0.67 -1.32 -0.12 0.00 0.69 0.00 0.00 54.13 54.05 2dy3 s LEU 29 Cb -0.17 -1.90 -0.05 0.00 -0.43 0.00 0.00 46.19 43.64 2dy3 s LEU 29 CO 0.25 -0.41 0.24 -0.32 -0.29 0.00 0.00 176.35 175.82 2dy3 s MET 30 N 1.39 3.98 -0.27 1.98 -2.45 -0.42 -0.05 119.30 123.46 2dy3 s MET 30 Ca 0.01 -0.21 -0.19 0.00 -1.25 0.00 0.00 55.69 54.04 2dy3 s MET 30 Cb -0.21 -3.64 -0.02 0.00 1.25 0.00 0.00 34.83 32.21 2dy3 s MET 30 CO 0.02 -0.18 0.59 0.00 1.05 0.00 0.00 175.02 176.50 2dy3 s ALA 31 N 1.76 3.58 -0.47 4.11 0.00 0.67 -3.29 121.76 128.13 2dy3 s ALA 31 Ca 0.09 -0.55 -0.26 0.00 0.00 0.00 0.00 51.96 51.25 2dy3 s ALA 31 Cb -0.16 -3.00 0.03 0.00 0.00 0.00 0.00 23.12 19.99 2dy3 s ALA 31 CO 0.10 -0.85 0.97 0.08 0.00 0.00 0.00 175.76 176.06 2dy3 s VAL 32 N 2.46 4.41 -0.23 0.00 1.01 -0.84 -1.07 120.40 126.15 2dy3 s VAL 32 Ca 0.24 0.81 0.10 0.00 0.00 0.00 0.00 61.98 63.14 2dy3 s VAL 32 Cb -0.15 -4.48 0.43 0.00 0.00 0.00 0.00 36.38 32.18 2dy3 s VAL 32 CO 0.09 -0.90 1.21 1.33 0.00 0.00 0.00 175.10 176.84 2dy3 n VAL 33 N 6.50 2.22 -0.80 2.92 0.24 -0.55 -4.54 118.33 124.32 2dy3 n VAL 33 Ca 0.07 -3.46 -0.29 0.00 -2.04 0.00 0.00 64.34 58.62 2dy3 n VAL 33 Cb 0.49 -0.45 0.23 0.00 -1.47 0.00 0.00 33.84 32.64 2dy3 n VAL 33 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 2dy3 s LYS 34 N -3.25 -0.78 -1.46 7.34 -2.85 -1.23 -0.96 119.74 116.54 2dy3 s LYS 34 Ca 0.42 0.52 -0.11 0.00 -1.00 0.00 0.00 55.97 55.80 2dy3 s LYS 34 Cb 0.38 -1.60 0.05 0.00 -2.06 0.00 0.00 37.83 34.61 2dy3 s LYS 34 CO -0.04 -3.55 0.99 0.00 0.10 0.00 0.00 175.35 172.84 2dy3 n ALA 35 N -4.75 -1.24 -3.47 0.59 0.00 -1.26 -1.41 120.51 108.97 2dy3 n ALA 35 Ca 0.05 0.28 -0.18 0.00 0.00 0.00 0.00 53.44 53.60 2dy3 n ALA 35 Cb 0.57 -4.71 0.08 0.00 0.00 0.00 0.00 19.45 15.39 2dy3 n ALA 35 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2dy3 n ASN 36 N -2.83 -2.15 -3.49 0.00 5.15 -1.25 -1.07 115.26 109.62 2dy3 n ASN 36 Ca 0.01 -0.66 -0.18 0.00 -0.60 0.00 0.00 54.58 53.15 2dy3 n ASN 36 Cb 0.55 -4.93 0.08 0.00 -0.53 0.00 0.00 39.78 34.94 2dy3 n ASN 36 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dy3 n ALA 37 N -4.11 -2.02 -3.90 5.20 0.00 -0.14 -1.75 120.51 113.80 2dy3 n ALA 37 Ca -0.28 -0.08 -0.28 0.00 0.00 0.00 0.00 53.44 52.80 2dy3 n ALA 37 Cb 0.67 -2.33 0.02 0.00 0.00 0.00 0.00 19.45 17.81 2dy3 n ALA 37 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dy3 n TYR 38 N -4.17 -2.10 -0.96 0.00 4.02 -0.50 -0.71 117.16 112.74 2dy3 n TYR 38 Ca -0.29 0.87 0.00 0.00 -0.01 0.00 0.00 57.90 58.47 2dy3 n TYR 38 Cb 0.67 -3.95 0.00 0.00 -0.02 0.00 0.00 39.34 36.04 2dy3 n TYR 38 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2dy3 n ASN 39 N -2.88 -3.34 -0.24 7.72 4.05 -0.23 -4.47 115.26 115.87 2dy3 n ASN 39 Ca -0.07 0.00 0.13 0.00 0.45 0.00 0.00 54.58 55.10 2dy3 n ASN 39 Cb 0.57 -1.58 0.43 0.00 1.23 0.00 0.00 39.78 40.43 2dy3 n ASN 39 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2dy3 n HIS 40 N -2.47 0.00 -0.55 1.20 8.25 0.11 -4.99 115.22 116.77 2dy3 n HIS 40 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2dy3 n HIS 40 Cb 0.16 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2dy3 n HIS 40 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dy3 n GLY 41 N 1.32 -0.38 0.27 -1.41 0.00 -0.72 -4.73 105.19 99.54 2dy3 n GLY 41 Ca 0.13 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.76 2dy3 n GLY 41 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2dy3 h VAL 42 N 0.00 0.83 0.00 1.61 3.04 -1.85 0.28 116.25 120.16 2dy3 h VAL 42 Ca 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 2dy3 h VAL 42 Cb 0.00 1.00 -0.00 0.00 -2.01 0.00 0.00 31.29 30.28 2dy3 h VAL 42 CO 0.00 0.00 -0.05 -0.08 -1.01 0.00 0.00 177.57 176.43 2dy3 h GLU 43 N 0.00 0.00 0.00 4.17 4.81 -1.93 -2.08 114.58 119.56 2dy3 h GLU 43 Ca 0.00 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 58.92 2dy3 h GLU 43 Cb 0.01 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 2dy3 h GLU 43 CO -0.00 0.05 -2.16 1.63 -0.73 0.00 0.00 179.01 177.80 2dy3 n LYS 44 N -4.38 0.66 0.06 1.92 4.76 -0.77 -4.63 118.16 115.78 2dy3 n LYS 44 Ca -0.03 0.10 -0.13 0.00 -2.87 0.00 0.00 58.31 55.38 2dy3 n LYS 44 Cb 0.13 -1.41 -0.09 0.00 -1.84 0.00 0.00 35.03 31.83 2dy3 n LYS 44 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2dy3 h VAL 45 N 0.00 1.04 -0.72 -0.18 2.07 -0.92 -3.23 116.25 114.31 2dy3 h VAL 45 Ca -0.46 -0.64 0.12 0.00 0.82 0.00 0.00 66.70 66.55 2dy3 h VAL 45 Cb 1.76 1.44 -0.09 0.00 -1.52 0.00 0.00 31.29 32.89 2dy3 h VAL 45 CO -0.06 0.15 0.30 0.00 0.02 0.00 0.00 177.57 177.99 2dy3 h ALA 46 N 0.38 1.00 -0.43 1.67 0.00 -1.61 -0.71 119.26 119.56 2dy3 h ALA 46 Ca -0.02 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2dy3 h ALA 46 Cb 0.37 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2dy3 h ALA 46 CO 0.03 -0.17 0.03 -1.35 0.00 0.00 0.00 179.25 177.79 2dy3 h PRO 47 N 0.48 0.68 -0.32 0.00 0.11 -1.77 0.72 132.00 131.89 2dy3 h PRO 47 Ca 0.38 -0.15 -0.08 0.00 0.11 0.00 0.00 66.00 66.26 2dy3 h PRO 47 Cb 0.53 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 2dy3 h PRO 47 CO -0.36 0.67 -0.12 0.28 -0.21 0.00 0.00 178.00 178.27 2dy3 h VAL 48 N 0.64 1.29 -0.45 3.15 2.07 -1.33 -0.53 116.25 121.08 2dy3 h VAL 48 Ca 0.14 -1.20 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 2dy3 h VAL 48 Cb 0.36 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2dy3 h VAL 48 CO 0.01 0.39 0.10 0.40 0.02 0.00 0.00 177.57 178.49 2dy3 h ILE 49 N 0.41 1.20 -0.39 4.57 2.04 -0.85 -2.52 117.51 121.96 2dy3 h ILE 49 Ca 0.07 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.12 2dy3 h ILE 49 Cb 0.63 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2dy3 h ILE 49 CO 0.04 0.27 -0.09 0.00 0.00 0.00 0.00 178.15 178.37 2dy3 h ALA 50 N 1.45 0.54 0.00 1.87 0.00 -0.57 -2.71 119.26 119.83 2dy3 h ALA 50 Ca 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2dy3 h ALA 50 Cb 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2dy3 h ALA 50 CO -0.00 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.64 2dy3 n ALA 51 N -2.44 1.78 -1.29 0.00 0.00 -0.23 -3.09 120.51 115.23 2dy3 n ALA 51 Ca -0.01 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.45 2dy3 n ALA 51 Cb 0.35 -1.22 0.16 0.00 0.00 0.00 0.00 19.45 18.74 2dy3 n ALA 51 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2dy3 n HIS 52 N -1.29 0.00 0.00 0.00 -0.00 -1.04 -5.00 115.22 107.89 2dy3 n HIS 52 Ca 0.06 -1.15 0.00 0.00 -0.00 0.00 0.00 57.72 56.63 2dy3 n HIS 52 Cb 0.11 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 29.91 2dy3 n HIS 52 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2dy3 n GLY 53 N -1.27 2.10 3.62 -1.41 0.00 -1.18 -4.40 105.19 102.64 2dy3 n GLY 53 Ca 0.17 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.69 2dy3 n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dy3 n ALA 54 N 0.00 -0.13 0.09 4.61 0.00 -1.10 -4.78 120.51 119.19 2dy3 n ALA 54 Ca 0.00 0.49 0.10 0.00 0.00 0.00 0.00 53.44 54.03 2dy3 n ALA 54 Cb 0.00 -2.18 -0.02 0.00 0.00 0.00 0.00 19.45 17.25 2dy3 n ALA 54 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dy3 n ASP 55 N 2.88 0.77 -3.52 0.00 8.00 0.93 -4.86 116.55 120.74 2dy3 n ASP 55 Ca 0.18 0.30 -0.05 0.00 0.71 0.00 0.00 54.79 55.93 2dy3 n ASP 55 Cb 0.22 0.56 0.00 0.00 -0.02 0.00 0.00 41.12 41.89 2dy3 n ASP 55 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dy3 s ALA 56 N -3.33 -1.43 0.03 2.24 0.00 -0.87 -3.78 121.76 114.62 2dy3 s ALA 56 Ca -0.01 -0.21 0.03 0.00 0.00 0.00 0.00 51.96 51.76 2dy3 s ALA 56 Cb 0.10 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.91 2dy3 s ALA 56 CO 0.80 -1.04 -0.09 -0.06 0.00 0.00 0.00 175.76 175.38 2dy3 s PHE 57 N -2.88 0.76 -0.06 0.00 0.08 0.28 -0.23 117.98 115.92 2dy3 s PHE 57 Ca 0.15 -0.32 0.05 0.00 0.12 0.00 0.00 56.93 56.93 2dy3 s PHE 57 Cb -0.03 -0.46 -0.01 0.00 -0.57 0.00 0.00 43.02 41.96 2dy3 s PHE 57 CO 0.05 -0.03 -0.21 0.20 -0.10 0.00 0.00 175.22 175.13 2dy3 s GLY 58 N -0.97 1.15 0.21 4.36 0.00 -0.23 -0.68 107.32 111.15 2dy3 s GLY 58 Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2dy3 s GLY 58 CO 0.00 -0.46 0.09 -1.34 0.00 0.00 0.00 173.10 171.39 2dy3 s VAL 59 N 0.03 0.34 -0.14 1.40 -7.23 0.28 -1.49 120.40 113.59 2dy3 s VAL 59 Ca -0.07 -1.98 -0.14 0.00 -1.81 0.00 0.00 61.98 57.99 2dy3 s VAL 59 Cb -0.14 -2.42 -0.11 0.00 0.56 0.00 0.00 36.38 34.27 2dy3 s VAL 59 CO 0.04 -0.15 0.23 0.00 -0.31 0.00 0.00 175.10 174.91 2dy3 h ALA 60 N 2.58 0.04 -1.82 1.32 0.00 -1.94 -2.87 119.26 116.58 2dy3 h ALA 60 Ca -0.37 -0.42 -0.45 0.00 0.00 0.00 0.00 54.91 53.67 2dy3 h ALA 60 Cb 1.23 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2dy3 h ALA 60 CO 0.58 0.20 -0.37 0.95 0.00 0.00 0.00 179.25 180.62 2dy3 s THR 61 N -2.00 3.98 0.16 0.00 -4.23 -1.26 0.14 115.64 112.44 2dy3 s THR 61 Ca -0.13 -1.08 -0.15 0.00 -1.18 0.00 0.00 61.69 59.15 2dy3 s THR 61 Cb 0.00 -3.37 0.04 0.00 1.34 0.00 0.00 72.50 70.51 2dy3 s THR 61 CO 0.33 -0.16 1.83 -0.07 -0.54 0.00 0.00 174.62 176.00 2dy3 h LEU 62 N 0.98 0.52 -1.03 4.79 4.07 -1.95 -1.46 115.31 121.22 2dy3 h LEU 62 Ca -0.46 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.48 2dy3 h LEU 62 Cb 1.26 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 42.83 2dy3 h LEU 62 CO 0.54 0.38 0.45 0.00 -1.08 0.00 0.00 178.44 178.73 2dy3 h ALA 63 N 1.17 1.26 -0.34 1.53 0.00 -1.95 0.25 119.26 121.18 2dy3 h ALA 63 Ca 0.17 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2dy3 h ALA 63 Cb -0.07 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 2dy3 h ALA 63 CO -0.04 0.60 -0.27 0.93 0.00 0.00 0.00 179.25 180.48 2dy3 h GLU 64 N 1.13 0.79 -0.53 0.00 5.08 -1.86 -1.08 114.58 118.11 2dy3 h GLU 64 Ca 0.29 -0.39 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2dy3 h GLU 64 Cb 0.02 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2dy3 h GLU 64 CO -0.05 1.02 0.27 0.00 -1.00 0.00 0.00 179.01 179.25 2dy3 h ALA 65 N 0.76 0.68 -0.16 3.43 0.00 -0.91 -1.88 119.26 121.18 2dy3 h ALA 65 Ca 0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2dy3 h ALA 65 Cb 0.83 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2dy3 h ALA 65 CO 0.07 0.22 -0.18 0.52 0.00 0.00 0.00 179.25 179.88 2dy3 h MET 66 N 0.70 0.26 -0.27 0.00 2.86 -0.85 -2.16 114.93 115.48 2dy3 h MET 66 Ca 0.18 -0.07 -0.09 0.00 -2.06 0.00 0.00 59.70 57.66 2dy3 h MET 66 Cb 0.09 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2dy3 h MET 66 CO -0.03 0.44 -0.22 0.37 1.06 0.00 0.00 176.91 178.53 2dy3 h GLN 67 N 0.24 0.49 -0.49 1.72 4.15 -0.64 -1.26 115.11 119.32 2dy3 h GLN 67 Ca 0.04 -0.18 -0.04 0.00 0.77 0.00 0.00 58.65 59.25 2dy3 h GLN 67 Cb 0.46 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2dy3 h GLN 67 CO 0.03 0.68 0.15 -0.07 -1.93 0.00 0.00 178.83 177.70 2dy3 h LEU 68 N 0.44 0.71 -0.97 -2.39 3.38 -0.71 -1.97 115.31 113.81 2dy3 h LEU 68 Ca 0.07 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 2dy3 h LEU 68 Cb 0.63 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2dy3 h LEU 68 CO 0.04 0.73 0.02 0.03 0.09 0.00 0.00 178.44 179.35 2dy3 h ARG 69 N 0.66 0.77 -0.57 1.13 2.47 -1.21 -1.72 114.38 115.90 2dy3 h ARG 69 Ca 0.16 -0.19 0.04 0.00 -1.26 0.00 0.00 59.98 58.72 2dy3 h ARG 69 Cb 0.27 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.45 2dy3 h ARG 69 CO -0.01 0.77 0.33 -0.44 0.56 0.00 0.00 179.97 181.18 2dy3 h ASP 70 N 0.73 0.52 0.42 7.04 3.32 -0.68 -1.68 116.42 126.08 2dy3 h ASP 70 Ca 0.15 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2dy3 h ASP 70 Cb 0.41 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2dy3 h ASP 70 CO 0.02 0.36 0.00 2.30 -1.72 0.00 0.00 179.24 180.19 2dy3 n ILE 71 N -4.79 0.20 0.00 0.35 -5.35 -0.79 -4.87 119.36 104.11 2dy3 n ILE 71 Ca 0.05 0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 2dy3 n ILE 71 Cb 0.11 -0.65 0.00 0.00 -1.74 0.00 0.00 39.64 37.36 2dy3 n ILE 71 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dy3 n GLY 72 N 0.77 0.91 3.68 3.28 0.00 -0.63 -5.03 105.19 108.17 2dy3 n GLY 72 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2dy3 n GLY 72 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dy3 s ILE 73 N -2.00 3.03 -1.48 -0.61 -1.09 -0.66 -4.84 121.20 113.54 2dy3 s ILE 73 Ca 0.00 0.33 0.14 0.00 -2.23 0.00 0.00 60.65 58.90 2dy3 s ILE 73 Cb 0.00 -3.21 0.04 0.00 -1.58 0.00 0.00 42.46 37.70 2dy3 s ILE 73 CO 0.00 -0.01 0.85 -1.54 -1.23 0.00 0.00 174.94 173.00 2dy3 n SER 74 N 6.33 1.74 -4.76 3.58 3.41 -1.26 -4.43 113.62 118.24 2dy3 n SER 74 Ca 0.17 -1.37 -0.29 0.00 -0.26 0.00 0.00 58.87 57.12 2dy3 n SER 74 Cb 0.41 0.31 0.13 0.00 -0.26 0.00 0.00 64.21 64.79 2dy3 n SER 74 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2dy3 s GLN 75 N -1.56 1.39 0.28 4.33 1.11 -1.26 -4.96 119.66 118.98 2dy3 s GLN 75 Ca 0.14 0.59 -0.30 0.00 0.01 0.00 0.00 55.36 55.79 2dy3 s GLN 75 Cb 0.12 -1.84 -0.13 0.00 -1.01 0.00 0.00 33.01 30.15 2dy3 s GLN 75 CO 0.30 -2.09 1.47 -1.91 0.01 0.00 0.00 175.29 173.06 2dy3 n GLU 76 N -3.75 2.32 -4.59 2.91 2.13 -1.25 -4.81 120.64 113.60 2dy3 n GLU 76 Ca 0.07 0.82 -0.25 0.00 0.66 0.00 0.00 57.16 58.46 2dy3 n GLU 76 Cb 0.57 -2.52 -0.17 0.00 0.27 0.00 0.00 31.44 29.59 2dy3 n GLU 76 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2dy3 s VAL 77 N -0.20 1.18 -0.08 6.31 1.01 -1.26 -0.56 120.40 126.80 2dy3 s VAL 77 Ca 0.64 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 62.15 2dy3 s VAL 77 Cb -0.58 -1.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 2dy3 s VAL 77 CO 0.51 0.37 -0.16 -0.22 0.00 0.00 0.00 175.10 175.60 2dy3 s LEU 78 N 0.69 2.59 -0.08 3.92 2.96 0.14 -0.57 118.68 128.33 2dy3 s LEU 78 Ca -0.14 -0.30 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 2dy3 s LEU 78 Cb -0.16 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 45.00 2dy3 s LEU 78 CO 0.04 0.27 -0.19 0.00 -1.32 0.00 0.00 176.35 175.14 2dy3 n TRP 80 N 3.56 0.00 -3.80 0.00 2.14 -1.02 -1.68 117.44 116.64 2dy3 n TRP 80 Ca -0.20 -0.18 -0.30 0.00 2.07 0.00 0.00 57.50 58.88 2dy3 n TRP 80 Cb 0.52 -0.02 -0.15 0.00 -0.81 0.00 0.00 31.31 30.86 2dy3 n TRP 80 CO 0.00 0.00 0.00 0.42 2.07 0.00 0.00 177.69 180.18 2dy3 s ILE 81 N -0.37 1.33 0.25 -1.67 1.01 0.37 -4.90 121.20 117.23 2dy3 s ILE 81 Ca 0.00 -1.85 -0.19 0.00 0.00 0.00 0.00 60.65 58.61 2dy3 s ILE 81 Cb 0.00 -1.99 0.02 0.00 0.01 0.00 0.00 42.46 40.50 2dy3 s ILE 81 CO 0.00 -0.70 0.62 -1.66 0.00 0.00 0.00 174.94 173.20 2dy3 s TRP 82 N 1.20 -0.08 0.09 3.97 1.48 -1.26 -4.11 118.94 120.23 2dy3 s TRP 82 Ca 0.12 -0.32 0.04 0.00 -1.06 0.00 0.00 56.10 54.88 2dy3 s TRP 82 Cb -0.19 0.52 -0.03 0.00 -1.16 0.00 0.00 33.47 32.60 2dy3 s TRP 82 CO -0.16 -1.09 -0.10 0.95 -4.06 0.00 0.00 176.95 172.48 2dy3 s THR 83 N -3.92 0.91 -0.21 0.66 -4.23 -1.26 -5.02 115.64 102.57 2dy3 s THR 83 Ca 0.12 -1.55 0.22 0.00 -1.18 0.00 0.00 61.69 59.31 2dy3 s THR 83 Cb -0.03 -1.25 0.22 0.00 1.34 0.00 0.00 72.50 72.77 2dy3 s THR 83 CO 0.04 -0.51 1.67 -2.65 -0.54 0.00 0.00 174.62 172.63 2dy3 n PRO 84 N 0.73 0.14 0.16 3.99 -0.02 -1.26 -1.25 135.00 137.50 2dy3 n PRO 84 Ca -0.17 0.63 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 2dy3 n PRO 84 Cb 0.57 -1.96 0.33 0.00 -0.02 0.00 0.00 33.50 32.42 2dy3 n PRO 84 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2dy3 h GLU 85 N 0.00 0.00 -7.18 -0.52 3.07 -2.01 -3.46 114.58 104.49 2dy3 h GLU 85 Ca 0.00 0.00 -0.45 0.00 -0.50 0.00 0.00 59.36 58.41 2dy3 h GLU 85 Cb 0.02 0.00 0.08 0.00 -0.84 0.00 0.00 28.75 28.01 2dy3 h GLU 85 CO 0.00 0.00 0.15 -0.65 -1.40 0.00 0.00 179.01 177.11 2dy3 s GLN 86 N -3.19 2.07 -1.40 2.33 -0.21 -0.38 -4.96 119.66 113.92 2dy3 s GLN 86 Ca 0.08 -0.57 -0.12 0.00 0.02 0.00 0.00 55.36 54.77 2dy3 s GLN 86 Cb 0.09 -2.26 0.08 0.00 1.00 0.00 0.00 33.01 31.92 2dy3 s GLN 86 CO 0.61 -1.23 2.14 -3.47 -2.12 0.00 0.00 175.29 171.22 2dy3 n ASP 87 N -2.81 4.51 0.23 5.90 4.64 -1.26 -4.66 116.55 123.09 2dy3 n ASP 87 Ca 0.10 -2.93 0.11 0.00 -1.38 0.00 0.00 54.79 50.69 2dy3 n ASP 87 Cb 0.60 -1.59 0.52 0.00 -1.04 0.00 0.00 41.12 39.61 2dy3 n ASP 87 CO 0.00 0.00 0.00 2.19 -0.82 0.00 0.00 177.20 178.57 2dy3 h PHE 88 N 5.85 0.00 -0.48 -0.67 -5.15 -1.89 -2.49 116.94 112.12 2dy3 h PHE 88 Ca 0.52 0.00 0.02 0.00 -0.20 0.00 0.00 57.97 58.31 2dy3 h PHE 88 Cb 0.62 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.76 2dy3 h PHE 88 CO 1.41 0.19 0.32 -0.09 -2.00 0.00 0.00 178.31 178.14 2dy3 h ARG 89 N 0.00 0.58 -0.27 6.09 9.65 -1.98 0.47 114.38 128.91 2dy3 h ARG 89 Ca -0.00 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.83 2dy3 h ARG 89 Cb 0.66 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.10 2dy3 h ARG 89 CO 0.03 0.38 0.10 0.00 2.80 0.00 0.00 179.97 183.27 2dy3 h ALA 90 N 1.71 1.66 -0.03 2.80 0.00 -1.84 -0.64 119.26 122.92 2dy3 h ALA 90 Ca 0.18 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2dy3 h ALA 90 Cb 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.68 2dy3 h ALA 90 CO -0.04 0.27 -0.32 0.00 0.00 0.00 0.00 179.25 179.16 2dy3 h ALA 91 N 1.73 0.08 -0.71 0.00 0.00 -1.05 -3.06 119.26 116.25 2dy3 h ALA 91 Ca 0.10 -0.46 0.12 0.00 0.00 0.00 0.00 54.91 54.66 2dy3 h ALA 91 Cb 0.11 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 2dy3 h ALA 91 CO -0.01 0.16 0.30 0.82 0.00 0.00 0.00 179.25 180.52 2dy3 h ILE 92 N -0.29 0.74 0.00 0.00 2.04 -0.88 0.21 117.51 119.33 2dy3 h ILE 92 Ca -0.03 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 2dy3 h ILE 92 Cb 1.01 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2dy3 h ILE 92 CO 0.06 0.09 -0.00 0.44 0.00 0.00 0.00 178.15 178.74 2dy3 h ASP 93 N 0.49 0.00 -0.59 1.72 3.32 -1.12 -1.13 116.42 119.11 2dy3 h ASP 93 Ca 0.37 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.40 2dy3 h ASP 93 Cb 0.49 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2dy3 h ASP 93 CO -0.34 0.00 0.03 0.54 -1.72 0.00 0.00 179.24 177.76 2dy3 n ARG 94 N -3.65 4.75 -3.70 3.56 5.12 0.68 -4.93 116.66 118.49 2dy3 n ARG 94 Ca -0.03 -3.11 -0.24 0.00 -1.93 0.00 0.00 57.85 52.54 2dy3 n ARG 94 Cb 0.08 -2.26 0.05 0.00 -1.16 0.00 0.00 32.46 29.18 2dy3 n ARG 94 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2dy3 n ASN 95 N 0.53 -4.06 -4.59 0.55 5.15 -0.43 -4.98 115.26 107.44 2dy3 n ASN 95 Ca 0.29 -0.69 -0.36 0.00 -0.60 0.00 0.00 54.58 53.22 2dy3 n ASN 95 Cb 1.21 -4.45 -0.10 0.00 -0.53 0.00 0.00 39.78 35.91 2dy3 n ASN 95 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2dy3 s ILE 96 N -3.40 4.82 0.26 -1.44 1.01 -0.87 -4.59 121.20 117.00 2dy3 s ILE 96 Ca 0.40 -0.01 -0.29 0.00 0.00 0.00 0.00 60.65 60.74 2dy3 s ILE 96 Cb -0.19 -3.22 -0.09 0.00 0.01 0.00 0.00 42.46 38.97 2dy3 s ILE 96 CO 0.78 0.39 1.12 -1.81 0.00 0.00 0.00 174.94 175.43 2dy3 s ASP 97 N 0.92 7.22 -0.07 3.58 -0.00 0.26 -4.33 116.67 124.24 2dy3 s ASP 97 Ca 0.05 2.28 0.03 0.00 -0.00 0.00 0.00 52.55 54.91 2dy3 s ASP 97 Cb -0.14 -2.62 -0.02 0.00 -0.00 0.00 0.00 42.92 40.14 2dy3 s ASP 97 CO 0.03 -0.20 -0.16 -0.76 -0.00 0.00 0.00 175.17 174.08 2dy3 s LEU 98 N -1.24 2.59 0.21 1.23 1.43 -0.95 -1.82 118.68 120.13 2dy3 s LEU 98 Ca 0.46 -0.30 -0.27 0.00 -1.03 0.00 0.00 54.13 53.00 2dy3 s LEU 98 Cb -0.32 -1.53 -0.09 0.00 0.03 0.00 0.00 46.19 44.28 2dy3 s LEU 98 CO 0.41 0.28 0.85 0.00 0.23 0.00 0.00 176.35 178.12 2dy3 s ALA 99 N -0.34 3.38 -0.48 4.21 0.00 -0.68 -1.57 121.76 126.28 2dy3 s ALA 99 Ca 0.03 0.47 -0.21 0.00 0.00 0.00 0.00 51.96 52.25 2dy3 s ALA 99 Cb -0.13 -3.07 0.04 0.00 0.00 0.00 0.00 23.12 19.96 2dy3 s ALA 99 CO 0.02 0.25 0.69 0.08 0.00 0.00 0.00 175.76 176.80 2dy3 s VAL 100 N -1.23 4.77 -1.04 0.00 1.01 0.77 -4.88 120.40 119.80 2dy3 s VAL 100 Ca 0.40 -0.07 0.16 0.00 0.00 0.00 0.00 61.98 62.47 2dy3 s VAL 100 Cb -0.23 -4.29 -0.11 0.00 0.00 0.00 0.00 36.38 31.75 2dy3 s VAL 100 CO 0.28 -0.75 0.75 2.30 0.00 0.00 0.00 175.10 177.67 2dy3 n ILE 101 N 5.83 0.00 -3.48 2.22 -5.35 -1.26 -0.91 119.36 116.41 2dy3 n ILE 101 Ca -0.03 -0.21 -0.11 0.00 -0.27 0.00 0.00 62.75 62.14 2dy3 n ILE 101 Cb 0.47 1.08 -0.02 0.00 -1.74 0.00 0.00 39.64 39.42 2dy3 n ILE 101 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2dy3 s SER 102 N -2.28 -0.49 0.33 7.28 1.04 -1.26 -1.60 113.70 116.72 2dy3 s SER 102 Ca 0.09 -0.05 0.06 0.00 0.48 0.00 0.00 55.95 56.53 2dy3 s SER 102 Cb 0.12 0.55 0.72 0.00 0.10 0.00 0.00 66.02 67.52 2dy3 s SER 102 CO 0.56 -0.91 1.87 -0.65 0.98 0.00 0.00 173.24 175.09 2dy3 h PRO 103 N 2.00 0.78 -0.64 4.02 0.11 -1.95 -0.79 132.00 135.53 2dy3 h PRO 103 Ca -0.30 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 2dy3 h PRO 103 Cb 1.29 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 2dy3 h PRO 103 CO 0.35 0.51 0.31 0.00 -0.21 0.00 0.00 178.00 178.96 2dy3 h ALA 104 N 1.58 1.34 -0.39 -0.75 0.00 -1.99 0.27 119.26 119.32 2dy3 h ALA 104 Ca 0.44 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 2dy3 h ALA 104 Cb 0.57 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2dy3 h ALA 104 CO -0.20 0.51 -0.05 0.45 0.00 0.00 0.00 179.25 179.96 2dy3 h HIS 105 N 0.90 0.81 -0.52 0.00 3.86 -1.57 -0.93 115.15 117.70 2dy3 h HIS 105 Ca 0.22 -0.16 0.01 0.00 -1.16 0.00 0.00 60.37 59.28 2dy3 h HIS 105 Cb 0.09 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.33 2dy3 h HIS 105 CO 0.01 0.84 0.33 0.00 0.86 0.00 0.00 177.93 179.97 2dy3 h ALA 106 N 0.86 0.66 -0.47 2.45 0.00 -0.86 -1.97 119.26 119.92 2dy3 h ALA 106 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2dy3 h ALA 106 Cb 0.55 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2dy3 h ALA 106 CO 0.03 0.07 0.30 -0.22 0.00 0.00 0.00 179.25 179.43 2dy3 h LYS 107 N 0.67 0.62 -0.37 0.00 3.64 -0.66 -1.03 116.57 119.45 2dy3 h LYS 107 Ca 0.20 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2dy3 h LYS 107 Cb -0.04 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 2dy3 h LYS 107 CO -0.06 0.43 0.07 0.00 -2.27 0.00 0.00 179.45 177.62 2dy3 h ALA 108 N 1.16 1.44 -0.08 5.00 0.00 -0.90 -1.61 119.26 124.27 2dy3 h ALA 108 Ca 0.17 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2dy3 h ALA 108 Cb -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2dy3 h ALA 108 CO -0.04 0.40 -0.38 -0.07 0.00 0.00 0.00 179.25 179.17 2dy3 h LEU 109 N 0.53 0.48 -1.34 0.00 3.38 -0.88 -2.92 115.31 114.56 2dy3 h LEU 109 Ca 0.12 -0.64 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 2dy3 h LEU 109 Cb 0.23 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2dy3 h LEU 109 CO -0.00 1.04 0.03 0.40 0.09 0.00 0.00 178.44 180.00 2dy3 h ILE 110 N -0.05 1.17 -0.17 1.22 2.04 -1.05 -1.67 117.51 119.01 2dy3 h ILE 110 Ca -0.02 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.18 2dy3 h ILE 110 Cb 1.02 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2dy3 h ILE 110 CO 0.08 0.23 0.00 -0.62 0.00 0.00 0.00 178.15 177.84 2dy3 n GLU 111 N -4.32 1.52 -3.32 2.37 1.02 -0.62 -4.81 120.64 112.48 2dy3 n GLU 111 Ca 0.01 -0.80 -0.38 0.00 -0.02 0.00 0.00 57.16 55.97 2dy3 n GLU 111 Cb 0.21 -1.29 -0.07 0.00 -0.02 0.00 0.00 31.44 30.28 2dy3 n GLU 111 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2dy3 s THR 112 N -1.78 5.17 -1.09 2.62 2.01 -0.63 -5.01 115.64 116.92 2dy3 s THR 112 Ca 0.25 0.88 -0.15 0.00 0.31 0.00 0.00 61.69 62.97 2dy3 s THR 112 Cb 0.13 -3.80 0.17 0.00 0.01 0.00 0.00 72.50 69.01 2dy3 s THR 112 CO 0.19 0.26 1.27 -0.62 -0.69 0.00 0.00 174.62 175.04 2dy3 s ASP 113 N 0.88 6.93 0.05 3.53 -1.08 -1.26 -4.94 116.67 120.78 2dy3 s ASP 113 Ca 0.23 -2.72 0.04 0.00 -0.52 0.00 0.00 52.55 49.59 2dy3 s ASP 113 Cb -0.15 -2.38 -0.02 0.00 -1.46 0.00 0.00 42.92 38.91 2dy3 s ASP 113 CO 0.09 -0.81 -0.12 0.00 0.52 0.00 0.00 175.17 174.86 2dy3 s ALA 114 N 1.65 0.97 0.07 3.66 0.00 -1.26 -5.09 121.76 121.75 2dy3 s ALA 114 Ca 0.37 -0.85 -0.23 0.00 0.00 0.00 0.00 51.96 51.26 2dy3 s ALA 114 Cb -0.04 -0.08 -0.10 0.00 0.00 0.00 0.00 23.12 22.90 2dy3 s ALA 114 CO -0.04 0.13 1.37 1.05 0.00 0.00 0.00 175.76 178.26 2dy3 h GLU 115 N 4.61 -0.48 -2.86 0.00 4.11 -1.92 -3.42 114.58 114.61 2dy3 h GLU 115 Ca -0.38 0.03 -0.47 0.00 0.07 0.00 0.00 59.36 58.62 2dy3 h GLU 115 Cb 1.19 0.11 -0.40 0.00 0.50 0.00 0.00 28.75 30.15 2dy3 h GLU 115 CO 0.42 -0.32 -0.75 -1.58 0.07 0.00 0.00 179.01 176.85 2dy3 s HIS 116 N -4.82 0.17 -0.33 2.06 5.04 -1.26 -4.52 115.29 111.62 2dy3 s HIS 116 Ca -0.11 -0.47 -0.15 0.00 -1.54 0.00 0.00 55.06 52.79 2dy3 s HIS 116 Cb 0.04 -0.73 -0.02 0.00 0.04 0.00 0.00 32.58 31.91 2dy3 s HIS 116 CO 0.40 -0.66 0.33 0.42 -2.34 0.00 0.00 174.74 172.89 2dy3 s ILE 117 N 2.15 5.20 -0.16 0.89 1.01 0.13 -4.94 121.20 125.47 2dy3 s ILE 117 Ca 0.05 0.04 -0.25 0.00 0.00 0.00 0.00 60.65 60.50 2dy3 s ILE 117 Cb -0.16 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 2dy3 s ILE 117 CO -0.21 -0.05 0.79 -0.13 0.00 0.00 0.00 174.94 175.35 2dy3 s ARG 118 N 1.96 4.30 0.12 2.79 0.52 -1.26 -0.57 118.95 126.81 2dy3 s ARG 118 Ca 0.11 0.95 0.04 0.00 -0.52 0.00 0.00 55.73 56.31 2dy3 s ARG 118 Cb -0.17 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.70 2dy3 s ARG 118 CO 0.11 -0.27 -0.11 0.14 0.02 0.00 0.00 175.30 175.19 2dy3 s VAL 119 N 1.97 1.08 -0.07 3.52 -7.23 -0.79 -2.24 120.40 116.65 2dy3 s VAL 119 Ca 0.37 -1.82 0.01 0.00 -1.81 0.00 0.00 61.98 58.73 2dy3 s VAL 119 Cb -0.17 -1.58 0.02 0.00 0.56 0.00 0.00 36.38 35.22 2dy3 s VAL 119 CO 0.13 -0.61 -0.07 -0.55 -0.31 0.00 0.00 175.10 173.68 2dy3 s SER 120 N -2.73 1.56 -0.28 4.85 0.15 -0.61 -1.28 113.70 115.36 2dy3 s SER 120 Ca 0.10 -0.22 -0.29 0.00 0.70 0.00 0.00 55.95 56.25 2dy3 s SER 120 Cb -0.01 -0.66 0.01 0.00 -1.71 0.00 0.00 66.02 63.65 2dy3 s SER 120 CO 0.01 -0.05 1.04 -0.63 1.20 0.00 0.00 173.24 174.81 2dy3 s ILE 121 N 1.10 4.60 -0.21 6.45 1.01 -0.52 -0.16 121.20 133.47 2dy3 s ILE 121 Ca -0.07 1.83 -0.26 0.00 0.00 0.00 0.00 60.65 62.14 2dy3 s ILE 121 Cb -0.14 -4.36 -0.00 0.00 0.01 0.00 0.00 42.46 37.97 2dy3 s ILE 121 CO -0.01 -0.34 0.90 -0.75 0.00 0.00 0.00 174.94 174.74 2dy3 s LYS 122 N 3.42 4.26 -0.21 2.79 2.20 -0.09 -1.49 119.74 130.62 2dy3 s LYS 122 Ca 0.44 1.11 -0.09 0.00 -0.36 0.00 0.00 55.97 57.06 2dy3 s LYS 122 Cb -0.13 -3.61 -0.05 0.00 -1.51 0.00 0.00 37.83 32.53 2dy3 s LYS 122 CO 0.11 -0.47 0.12 0.42 -0.36 0.00 0.00 175.35 175.17 2dy3 s ILE 123 N 2.65 5.20 -0.72 5.43 -1.09 0.07 -1.32 121.20 131.42 2dy3 s ILE 123 Ca 0.39 0.12 -0.26 0.00 -2.23 0.00 0.00 60.65 58.67 2dy3 s ILE 123 Cb -0.16 -3.38 0.04 0.00 -1.58 0.00 0.00 42.46 37.38 2dy3 s ILE 123 CO 0.09 0.41 1.19 -0.62 -1.23 0.00 0.00 174.94 174.78 2dy3 s ASP 124 N 0.63 6.17 -0.14 3.58 -1.08 0.42 -4.57 116.67 121.68 2dy3 s ASP 124 Ca 0.07 -0.62 0.08 0.00 -0.52 0.00 0.00 52.55 51.56 2dy3 s ASP 124 Cb -0.12 -2.52 0.49 0.00 -1.46 0.00 0.00 42.92 39.31 2dy3 s ASP 124 CO 0.01 -1.72 1.24 -1.54 0.52 0.00 0.00 175.17 173.68 2dy3 n SER 125 N 8.88 3.83 0.00 -0.34 3.41 -1.26 -4.40 113.62 123.74 2dy3 n SER 125 Ca 0.01 -2.55 0.00 0.00 -0.26 0.00 0.00 58.87 56.07 2dy3 n SER 125 Cb 0.48 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2dy3 n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dy3 n GLY 126 N 0.37 1.42 0.25 5.00 0.00 -1.26 -4.43 105.19 106.54 2dy3 n GLY 126 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2dy3 n GLY 126 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dy3 h LEU 127 N 0.00 0.00 1.89 0.99 4.07 -1.95 -3.46 115.31 116.84 2dy3 h LEU 127 Ca 0.00 0.00 -0.41 0.00 0.08 0.00 0.00 57.88 57.55 2dy3 h LEU 127 Cb 0.00 0.00 0.03 0.00 1.08 0.00 0.00 40.66 41.77 2dy3 h LEU 127 CO 0.00 0.14 -0.58 1.41 -1.08 0.00 0.00 178.44 178.33 2dy3 n HIS 128 N -3.31 -1.53 0.00 1.13 8.25 -1.26 -4.97 115.22 113.53 2dy3 n HIS 128 Ca 0.00 0.29 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 2dy3 n HIS 128 Cb 0.37 -4.27 0.00 0.00 1.12 0.00 0.00 29.99 27.20 2dy3 n HIS 128 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2dy3 n ARG 129 N -3.57 0.00 -2.85 -0.41 1.74 -1.26 -5.09 116.66 105.22 2dy3 n ARG 129 Ca -0.17 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.69 2dy3 n ARG 129 Cb 0.65 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 32.11 2dy3 n ARG 129 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2dy3 s SER 130 N -1.00 5.58 0.00 0.55 0.15 -1.26 -5.02 113.70 112.70 2dy3 s SER 130 Ca 0.00 0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.76 2dy3 s SER 130 Cb 0.00 -1.19 0.00 0.00 -1.71 0.00 0.00 66.02 63.12 2dy3 s SER 130 CO 0.00 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.16 2dy3 n GLY 131 N -2.17 2.36 3.70 9.45 0.00 -0.63 -4.34 105.19 113.55 2dy3 n GLY 131 Ca 0.04 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 2dy3 n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dy3 s VAL 132 N -2.99 4.46 0.43 1.61 1.01 -0.43 -4.40 120.40 120.09 2dy3 s VAL 132 Ca 0.00 1.77 0.01 0.00 0.00 0.00 0.00 61.98 63.75 2dy3 s VAL 132 Cb 0.00 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 2dy3 s VAL 132 CO 0.00 0.04 0.65 1.51 0.00 0.00 0.00 175.10 177.30 2dy3 s ASP 133 N 1.23 5.90 0.27 3.32 1.47 -1.26 -0.44 116.67 127.16 2dy3 s ASP 133 Ca 0.54 0.28 -0.02 0.00 1.18 0.00 0.00 52.55 54.53 2dy3 s ASP 133 Cb -0.23 -1.58 0.57 0.00 -0.34 0.00 0.00 42.92 41.34 2dy3 s ASP 133 CO 0.23 -0.64 1.41 1.21 0.68 0.00 0.00 175.17 178.07 2dy3 n GLU 134 N -2.02 -0.08 0.30 2.11 2.13 -1.26 0.18 120.64 122.00 2dy3 n GLU 134 Ca 0.01 1.38 0.18 0.00 0.66 0.00 0.00 57.16 59.38 2dy3 n GLU 134 Cb 0.57 -2.13 0.90 0.00 0.27 0.00 0.00 31.44 31.05 2dy3 n GLU 134 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2dy3 h GLN 135 N 0.00 0.00 0.00 5.31 1.08 -1.98 -2.82 115.11 116.70 2dy3 h GLN 135 Ca 0.50 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.70 2dy3 h GLN 135 Cb 0.92 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.35 2dy3 h GLN 135 CO -0.89 0.04 -1.51 0.39 -0.95 0.00 0.00 178.83 175.91 2dy3 n GLU 136 N -3.28 0.43 -0.15 1.46 1.02 0.13 -4.56 120.64 115.69 2dy3 n GLU 136 Ca -0.02 -0.09 -0.04 0.00 -0.02 0.00 0.00 57.16 56.99 2dy3 n GLU 136 Cb 0.19 -1.55 0.02 0.00 -0.02 0.00 0.00 31.44 30.08 2dy3 n GLU 136 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 2dy3 h TRP 137 N 0.00 -0.55 -0.14 -0.32 6.55 -1.15 -1.88 115.95 118.45 2dy3 h TRP 137 Ca 0.00 0.05 0.04 0.00 0.95 0.00 0.00 58.89 59.93 2dy3 h TRP 137 Cb 0.83 0.32 -0.07 0.00 -0.86 0.00 0.00 29.16 29.38 2dy3 h TRP 137 CO 0.00 -0.30 -0.49 0.93 -1.05 0.00 0.00 178.44 177.53 2dy3 h GLU 138 N -0.11 -0.52 -0.24 0.49 4.39 -1.80 -0.12 114.58 116.67 2dy3 h GLU 138 Ca 0.23 0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.97 2dy3 h GLU 138 Cb 0.47 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 2dy3 h GLU 138 CO -0.56 -0.35 0.13 0.78 -1.16 0.00 0.00 179.01 177.86 2dy3 h GLY 139 N -0.54 0.32 0.95 -3.84 0.00 -1.78 -2.01 103.07 96.17 2dy3 h GLY 139 Ca 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 2dy3 h GLY 139 CO -0.43 0.09 0.18 -2.08 0.00 0.00 0.00 176.54 174.30 2dy3 h VAL 140 N 0.28 1.15 -0.64 4.60 2.07 -1.12 -0.05 116.25 122.54 2dy3 h VAL 140 Ca 0.09 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 2dy3 h VAL 140 Cb 0.00 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2dy3 h VAL 140 CO -0.05 0.16 0.16 -0.26 0.02 0.00 0.00 177.57 177.61 2dy3 h PHE 141 N 0.44 1.07 -0.53 1.57 0.04 -0.99 -1.00 116.94 117.55 2dy3 h PHE 141 Ca 0.12 -0.12 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2dy3 h PHE 141 Cb 0.09 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 37.91 2dy3 h PHE 141 CO -0.02 0.89 0.27 1.03 -0.60 0.00 0.00 178.31 179.88 2dy3 h SER 142 N 0.95 0.68 -0.10 2.17 0.87 -1.15 -1.08 113.55 115.89 2dy3 h SER 142 Ca 0.20 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 2dy3 h SER 142 Cb 0.35 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 2dy3 h SER 142 CO 0.00 0.60 0.03 0.00 -0.53 0.00 0.00 176.83 176.93 2dy3 h ALA 143 N 1.11 0.13 -0.26 6.23 0.00 -0.76 -2.76 119.26 122.95 2dy3 h ALA 143 Ca 0.18 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2dy3 h ALA 143 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2dy3 h ALA 143 CO -0.03 -0.24 -0.14 -0.07 0.00 0.00 0.00 179.25 178.77 2dy3 h LEU 144 N -0.04 0.42 -1.19 0.00 3.38 -1.10 -2.67 115.31 114.11 2dy3 h LEU 144 Ca 0.03 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 2dy3 h LEU 144 Cb 0.24 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2dy3 h LEU 144 CO -0.00 0.59 -0.18 0.00 0.09 0.00 0.00 178.44 178.94 2dy3 h ALA 145 N 1.45 1.33 0.00 1.53 0.00 -1.12 -2.40 119.26 120.05 2dy3 h ALA 145 Ca 0.07 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2dy3 h ALA 145 Cb 0.49 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2dy3 h ALA 145 CO 0.03 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2dy3 n ALA 146 N -2.48 2.10 -2.58 0.00 0.00 -1.02 -4.71 120.51 111.82 2dy3 n ALA 146 Ca -0.00 -0.03 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 2dy3 n ALA 146 Cb 0.33 -1.43 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 2dy3 n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dy3 s ALA 147 N -3.10 3.29 0.12 0.00 0.00 -0.90 -4.96 121.76 116.20 2dy3 s ALA 147 Ca 0.10 -1.17 -0.26 0.00 0.00 0.00 0.00 51.96 50.64 2dy3 s ALA 147 Cb 0.13 -3.48 -0.07 0.00 0.00 0.00 0.00 23.12 19.71 2dy3 s ALA 147 CO 0.50 -2.00 1.65 -1.35 0.00 0.00 0.00 175.76 174.56 2dy3 h PRO 148 N 9.03 -0.36 0.00 0.00 0.11 -1.86 -2.76 132.00 136.16 2dy3 h PRO 148 Ca -0.25 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2dy3 h PRO 148 Cb 1.09 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2dy3 h PRO 148 CO 0.97 -0.24 0.00 -2.39 -0.21 0.00 0.00 178.00 176.13 2dy3 n HIS 149 N -5.35 0.00 -3.93 0.65 1.44 -1.26 -4.72 115.22 102.04 2dy3 n HIS 149 Ca -0.05 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.31 2dy3 n HIS 149 Cb 0.26 -0.33 -0.10 0.00 0.12 0.00 0.00 29.99 29.95 2dy3 n HIS 149 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2dy3 s ILE 150 N -2.66 4.89 -0.29 0.61 1.01 -1.04 0.18 121.20 123.89 2dy3 s ILE 150 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.75 2dy3 s ILE 150 Cb 0.09 -3.22 0.04 0.00 0.01 0.00 0.00 42.46 39.39 2dy3 s ILE 150 CO 0.22 0.44 0.00 -0.70 0.00 0.00 0.00 174.94 174.91 2dy3 s GLU 151 N 0.48 2.55 -0.59 2.79 2.12 0.27 -4.91 118.70 121.40 2dy3 s GLU 151 Ca 0.04 -1.19 -0.27 0.00 0.36 0.00 0.00 54.97 53.91 2dy3 s GLU 151 Cb -0.12 -3.18 0.03 0.00 0.26 0.00 0.00 34.13 31.12 2dy3 s GLU 151 CO 0.00 -0.58 1.16 0.08 -0.54 0.00 0.00 175.26 175.39 2dy3 s VAL 152 N 1.29 4.05 -0.41 3.70 1.01 -1.26 -1.88 120.40 126.90 2dy3 s VAL 152 Ca -0.04 0.77 0.26 0.00 0.00 0.00 0.00 61.98 62.98 2dy3 s VAL 152 Cb -0.19 -4.71 0.31 0.00 0.00 0.00 0.00 36.38 31.79 2dy3 s VAL 152 CO -0.01 -1.35 1.77 0.00 0.00 0.00 0.00 175.10 175.51 2dy3 h THR 153 N 6.13 0.00 0.00 3.92 1.03 -1.55 -3.36 112.91 119.07 2dy3 h THR 153 Ca -0.25 -0.52 0.00 0.00 -0.01 0.00 0.00 66.41 65.63 2dy3 h THR 153 Cb 1.06 1.44 0.00 0.00 -1.07 0.00 0.00 68.15 69.58 2dy3 h THR 153 CO 1.18 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 177.30 2dy3 n GLY 154 N 0.60 -0.71 3.12 2.99 0.00 -1.25 -0.81 105.19 109.12 2dy3 n GLY 154 Ca 0.03 -1.30 -0.08 0.00 0.00 0.00 0.00 46.02 44.67 2dy3 n GLY 154 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2dy3 s MET 155 N -2.00 0.72 0.12 1.61 0.23 -1.25 -1.44 119.30 117.29 2dy3 s MET 155 Ca 0.00 -1.29 -0.14 0.00 -1.03 0.00 0.00 55.69 53.23 2dy3 s MET 155 Cb 0.00 0.12 0.03 0.00 -1.53 0.00 0.00 34.83 33.45 2dy3 s MET 155 CO 0.00 -0.12 0.35 -0.59 -2.03 0.00 0.00 175.02 172.63 2dy3 s PHE 156 N -3.88 -0.10 0.06 3.16 -0.71 -0.56 -2.60 117.98 113.35 2dy3 s PHE 156 Ca 0.11 -0.24 0.00 0.00 -1.04 0.00 0.00 56.93 55.76 2dy3 s PHE 156 Cb 0.07 0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 42.02 2dy3 s PHE 156 CO -0.07 -0.67 -0.04 -0.08 -1.34 0.00 0.00 175.22 173.03 2dy3 s THR 157 N -3.82 0.34 -0.43 -4.49 -1.32 -1.11 -0.75 115.64 104.06 2dy3 s THR 157 Ca 0.04 -1.63 -0.08 0.00 -1.21 0.00 0.00 61.69 58.81 2dy3 s THR 157 Cb 0.03 -1.27 0.09 0.00 -1.51 0.00 0.00 72.50 69.84 2dy3 s THR 157 CO -0.11 -0.84 0.27 -2.28 -2.21 0.00 0.00 174.62 169.45 2dy3 s HIS 158 N -3.23 3.39 -0.57 9.09 2.46 -1.26 -4.33 115.29 120.84 2dy3 s HIS 158 Ca 0.03 -1.74 -0.26 0.00 0.47 0.00 0.00 55.06 53.56 2dy3 s HIS 158 Cb 0.03 -3.10 -0.09 0.00 -0.13 0.00 0.00 32.58 29.28 2dy3 s HIS 158 CO -0.06 -0.90 2.44 1.28 -2.47 0.00 0.00 174.74 175.03 2dy3 n LEU 159 N 4.87 2.04 -4.34 8.88 7.99 -1.25 -4.84 117.00 130.34 2dy3 n LEU 159 Ca -0.09 -0.53 -0.37 0.00 -0.01 0.00 0.00 56.01 55.01 2dy3 n LEU 159 Cb 0.42 -1.52 0.05 0.00 -0.11 0.00 0.00 43.42 42.27 2dy3 n LEU 159 CO 0.39 -1.59 -0.31 0.00 -1.51 0.00 0.00 177.39 174.37 2dy3 n ALA 160 N 15.60 -2.51 -2.33 -1.18 0.00 -1.26 -4.63 120.51 124.20 2dy3 n ALA 160 Ca 0.41 -0.28 -0.36 0.00 0.00 0.00 0.00 53.44 53.21 2dy3 n ALA 160 Cb 0.48 -1.65 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 2dy3 n ALA 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dy3 n ALA 162 N 11.11 0.00 -0.87 0.00 0.00 -1.26 -5.15 120.51 124.34 2dy3 n ALA 162 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2dy3 n ALA 162 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2dy3 n ALA 162 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2dy3 n PRO 168 N 0.00 0.00 -0.03 0.00 -0.02 -1.26 -4.41 135.00 129.28 2dy3 n PRO 168 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.39 2dy3 n PRO 168 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.45 2dy3 n PRO 168 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2dy3 h GLU 169 N 0.00 -0.00 -0.09 -0.52 4.57 -2.01 -2.69 114.58 113.84 2dy3 h GLU 169 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 2dy3 h GLU 169 Cb 0.00 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 2dy3 h GLU 169 CO 0.00 -0.00 -0.21 1.15 -1.18 0.00 0.00 179.01 178.76 2dy3 h THR 170 N -0.00 0.48 -0.19 0.32 2.02 -1.92 -1.63 112.91 111.98 2dy3 h THR 170 Ca 0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 2dy3 h THR 170 Cb 0.13 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 2dy3 h THR 170 CO -0.18 0.00 0.02 0.44 0.37 0.00 0.00 175.52 176.18 2dy3 h ASP 171 N -0.29 0.25 -0.25 4.18 5.19 -1.94 -0.97 116.42 122.58 2dy3 h ASP 171 Ca 0.09 -0.03 -0.10 0.00 -0.62 0.00 0.00 57.03 56.37 2dy3 h ASP 171 Cb 0.42 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 2dy3 h ASP 171 CO -0.26 0.28 -0.19 -0.09 -3.12 0.00 0.00 179.24 175.86 2dy3 h ARG 172 N 0.27 0.71 -0.51 3.56 9.65 -1.05 -1.86 114.38 125.14 2dy3 h ARG 172 Ca 0.07 -0.26 -0.10 0.00 -1.10 0.00 0.00 59.98 58.58 2dy3 h ARG 172 Cb 0.15 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 2dy3 h ARG 172 CO 0.00 0.85 -0.07 1.96 2.80 0.00 0.00 179.97 185.51 2dy3 h GLN 173 N 0.63 0.96 -0.80 0.20 4.20 -0.31 -2.78 115.11 117.21 2dy3 h GLN 173 Ca 0.10 -0.34 -0.04 0.00 0.06 0.00 0.00 58.65 58.42 2dy3 h GLN 173 Cb 0.67 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 2dy3 h GLN 173 CO 0.05 1.01 0.33 0.82 -0.67 0.00 0.00 178.83 180.37 2dy3 h ILE 174 N 0.82 1.26 -0.14 2.54 1.08 -0.96 0.46 117.51 122.57 2dy3 h ILE 174 Ca 0.14 -0.81 0.02 0.00 -0.39 0.00 0.00 64.86 63.82 2dy3 h ILE 174 Cb 0.62 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 34.65 2dy3 h ILE 174 CO 0.04 0.33 0.03 0.40 -0.69 0.00 0.00 178.15 178.27 2dy3 h ILE 175 N 1.16 0.95 -0.64 -0.67 2.04 -1.21 0.10 117.51 119.24 2dy3 h ILE 175 Ca 0.27 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 66.05 2dy3 h ILE 175 Cb 0.20 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 2dy3 h ILE 175 CO -0.02 0.02 0.23 0.00 0.00 0.00 0.00 178.15 178.37 2dy3 h ALA 176 N 1.09 1.20 -0.50 1.87 0.00 -1.20 -2.14 119.26 119.58 2dy3 h ALA 176 Ca 0.06 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2dy3 h ALA 176 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2dy3 h ALA 176 CO -0.07 0.57 0.15 0.35 0.00 0.00 0.00 179.25 180.25 2dy3 h PHE 177 N 0.93 0.81 0.00 0.00 3.57 -0.44 -1.97 116.94 119.85 2dy3 h PHE 177 Ca 0.21 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 2dy3 h PHE 177 Cb 0.22 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2dy3 h PHE 177 CO 0.02 0.71 -0.26 0.00 -2.23 0.00 0.00 178.31 176.55 2dy3 h ARG 178 N 0.68 0.00 -0.37 1.11 3.08 -0.73 -0.68 114.38 117.47 2dy3 h ARG 178 Ca 0.16 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.05 2dy3 h ARG 178 Cb 0.28 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2dy3 h ARG 178 CO -0.00 0.26 -0.40 -0.09 -1.07 0.00 0.00 179.97 178.66 2dy3 h ARG 179 N 0.00 0.92 -0.27 0.04 2.43 -0.96 -2.04 114.38 114.50 2dy3 h ARG 179 Ca -0.00 -0.49 -0.07 0.00 -0.81 0.00 0.00 59.98 58.61 2dy3 h ARG 179 Cb 0.57 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2dy3 h ARG 179 CO 0.03 1.14 -0.09 0.00 -1.51 0.00 0.00 179.97 179.54 2dy3 h ALA 180 N 0.79 0.38 -0.90 2.80 0.00 -0.68 -2.33 119.26 119.31 2dy3 h ALA 180 Ca 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2dy3 h ALA 180 Cb 1.00 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 2dy3 h ALA 180 CO 0.10 0.21 0.49 1.25 0.00 0.00 0.00 179.25 181.31 2dy3 h LEU 181 N 0.29 1.12 -0.57 0.00 5.85 -1.10 0.39 115.31 121.29 2dy3 h LEU 181 Ca 0.07 -0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.57 2dy3 h LEU 181 Cb 0.58 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2dy3 h LEU 181 CO 0.03 0.90 -0.12 0.00 -0.34 0.00 0.00 178.44 178.91 2dy3 h ALA 182 N 1.29 0.77 -0.49 1.25 0.00 -1.33 -1.65 119.26 119.10 2dy3 h ALA 182 Ca 0.32 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2dy3 h ALA 182 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2dy3 h ALA 182 CO -0.05 0.67 -0.07 1.25 0.00 0.00 0.00 179.25 181.06 2dy3 h LEU 183 N 0.91 0.85 -0.27 0.00 6.46 -0.95 -0.78 115.31 121.53 2dy3 h LEU 183 Ca 0.14 -0.25 -0.04 0.00 -0.12 0.00 0.00 57.88 57.62 2dy3 h LEU 183 Cb 0.69 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 2dy3 h LEU 183 CO 0.05 0.96 0.03 0.00 -0.62 0.00 0.00 178.44 178.86 2dy3 h ALA 184 N 1.13 0.36 -0.04 1.25 0.00 -0.68 -2.37 119.26 118.91 2dy3 h ALA 184 Ca 0.14 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2dy3 h ALA 184 Cb 0.57 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2dy3 h ALA 184 CO 0.03 0.06 -0.44 0.00 0.00 0.00 0.00 179.25 178.90 2dy3 h ARG 185 N 0.26 0.09 0.00 0.00 3.08 -1.20 -0.62 114.38 115.98 2dy3 h ARG 185 Ca 0.08 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 2dy3 h ARG 185 Cb 0.36 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 2dy3 h ARG 185 CO 0.01 0.52 -0.13 -0.22 -1.07 0.00 0.00 179.97 179.08 2dy3 h LYS 186 N 0.07 0.00 -0.07 0.04 3.64 -0.93 -0.53 116.57 118.80 2dy3 h LYS 186 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2dy3 h LYS 186 Cb 0.81 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 2dy3 h LYS 186 CO 0.06 0.13 0.00 0.72 -2.27 0.00 0.00 179.45 178.09 2dy3 n HIS 187 N -3.63 0.07 -0.15 1.91 8.25 -0.52 -4.91 115.22 116.24 2dy3 n HIS 187 Ca -0.02 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 2dy3 n HIS 187 Cb 0.25 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.36 2dy3 n HIS 187 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dy3 n GLY 188 N 1.17 0.74 3.46 -1.41 0.00 -0.21 -4.87 105.19 104.07 2dy3 n GLY 188 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 2dy3 n GLY 188 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dy3 s LEU 189 N 0.00 4.87 0.25 0.99 1.43 -0.36 -4.94 118.68 120.92 2dy3 s LEU 189 Ca 0.00 -0.80 -0.03 0.00 -1.03 0.00 0.00 54.13 52.27 2dy3 s LEU 189 Cb 0.00 -2.49 0.45 0.00 0.03 0.00 0.00 46.19 44.18 2dy3 s LEU 189 CO 0.00 -0.87 1.79 -0.08 0.23 0.00 0.00 176.35 177.42 2dy3 h GLU 190 N 8.97 0.68 -6.13 1.70 4.81 -1.85 -3.09 114.58 119.67 2dy3 h GLU 190 Ca -0.27 -0.04 -0.41 0.00 -0.13 0.00 0.00 59.36 58.51 2dy3 h GLU 190 Cb 1.10 -0.15 0.09 0.00 0.63 0.00 0.00 28.75 30.42 2dy3 h GLU 190 CO 0.95 0.45 -0.92 0.00 -0.73 0.00 0.00 179.01 178.76 2dy3 h PRO 192 N -1.79 0.92 -4.54 0.00 0.11 -1.78 -3.41 132.00 121.51 2dy3 h PRO 192 Ca -0.65 -0.06 -0.63 0.00 0.11 0.00 0.00 66.00 64.77 2dy3 h PRO 192 Cb 1.35 -0.21 -0.37 0.00 0.11 0.00 0.00 31.00 31.88 2dy3 h PRO 192 CO 0.49 0.61 -0.80 0.08 -0.21 0.00 0.00 178.00 178.17 2dy3 s VAL 193 N -6.02 1.72 0.23 3.15 1.01 0.01 -4.89 120.40 115.59 2dy3 s VAL 193 Ca -0.12 -1.25 0.11 0.00 0.00 0.00 0.00 61.98 60.72 2dy3 s VAL 193 Cb 0.20 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.65 2dy3 s VAL 193 CO 0.80 0.00 -0.20 0.20 0.00 0.00 0.00 175.10 175.89 2dy3 s ASN 194 N 1.33 3.62 -0.05 3.32 0.01 -1.26 -3.77 114.94 118.14 2dy3 s ASN 194 Ca -0.05 -0.89 -0.24 0.00 -0.71 0.00 0.00 52.86 50.97 2dy3 s ASN 194 Cb -0.18 -0.34 0.05 0.00 0.41 0.00 0.00 41.25 41.18 2dy3 s ASN 194 CO -0.07 0.08 0.52 -1.38 -1.51 0.00 0.00 177.10 174.75 2dy3 s HIS 195 N -2.01 -0.47 0.00 2.20 -3.43 -1.07 -2.37 115.29 108.14 2dy3 s HIS 195 Ca 0.25 0.82 0.00 0.00 -0.80 0.00 0.00 55.06 55.33 2dy3 s HIS 195 Cb -0.07 0.27 0.00 0.00 -1.43 0.00 0.00 32.58 31.35 2dy3 s HIS 195 CO 0.13 -0.50 0.00 1.33 -2.00 0.00 0.00 174.74 173.70 2dy3 n VAL 196 N 1.21 0.00 -2.35 -5.38 0.24 -1.26 -2.75 118.33 108.04 2dy3 n VAL 196 Ca -0.20 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.68 2dy3 n VAL 196 Cb 0.57 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.91 2dy3 n VAL 196 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dy3 n ASN 198 N 7.48 1.54 -0.10 0.00 6.94 -1.26 -0.52 115.26 129.33 2dy3 n ASN 198 Ca 0.15 -2.15 -0.06 0.00 -0.02 0.00 0.00 54.58 52.50 2dy3 n ASN 198 Cb 0.46 -0.38 -0.00 0.00 -2.36 0.00 0.00 39.78 37.49 2dy3 n ASN 198 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2dy3 h SER 199 N -0.06 -0.80 -0.19 0.53 0.02 -1.90 0.36 113.55 111.51 2dy3 h SER 199 Ca -0.23 0.16 0.03 0.00 -0.84 0.00 0.00 61.79 60.91 2dy3 h SER 199 Cb 0.99 0.40 -0.03 0.00 0.14 0.00 0.00 62.40 63.91 2dy3 h SER 199 CO 0.30 -0.27 0.01 1.55 -1.14 0.00 0.00 176.83 177.29 2dy3 h PRO 200 N -0.18 0.07 -0.34 3.45 0.13 -1.95 -0.91 132.00 132.26 2dy3 h PRO 200 Ca 0.18 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.27 2dy3 h PRO 200 Cb 0.47 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.57 2dy3 h PRO 200 CO -0.48 0.05 0.07 0.00 -0.23 0.00 0.00 178.00 177.41 2dy3 h ALA 201 N 1.15 0.45 -0.70 -0.56 0.00 -1.89 -3.11 119.26 114.60 2dy3 h ALA 201 Ca 0.09 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2dy3 h ALA 201 Cb 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 2dy3 h ALA 201 CO -0.14 0.13 0.42 0.35 0.00 0.00 0.00 179.25 180.01 2dy3 h PHE 202 N 0.39 0.78 0.00 0.00 3.57 -0.75 1.04 116.94 121.97 2dy3 h PHE 202 Ca 0.10 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2dy3 h PHE 202 Cb 0.32 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.82 2dy3 h PHE 202 CO 0.02 0.41 0.00 1.28 -2.23 0.00 0.00 178.31 177.79 2dy3 n LEU 203 N -4.71 0.01 0.00 0.59 4.77 -0.36 -3.98 117.00 113.31 2dy3 n LEU 203 Ca 0.08 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2dy3 n LEU 203 Cb 0.13 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2dy3 n LEU 203 CO 0.31 0.00 0.00 1.07 -1.33 0.00 0.00 177.39 177.44 2dy3 n THR 204 N -0.49 0.00 -3.64 -5.08 5.66 -0.68 -5.02 114.28 105.03 2dy3 n THR 204 Ca 0.00 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.73 2dy3 n THR 204 Cb 0.00 0.46 -0.11 0.00 -1.55 0.00 0.00 70.33 69.13 2dy3 n THR 204 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2dy3 n ARG 205 N 0.00 1.02 0.28 1.09 5.12 0.35 -4.92 116.66 119.61 2dy3 n ARG 205 Ca 0.00 -3.84 0.18 0.00 -1.93 0.00 0.00 57.85 52.26 2dy3 n ARG 205 Cb 0.00 -1.98 0.77 0.00 -1.16 0.00 0.00 32.46 30.09 2dy3 n ARG 205 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2dy3 h SER 206 N 5.48 0.00 0.52 0.55 0.87 -1.80 -1.75 113.55 117.42 2dy3 h SER 206 Ca 0.21 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2dy3 h SER 206 Cb 0.83 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 2dy3 h SER 206 CO 0.55 0.00 0.00 -0.90 -0.53 0.00 0.00 176.83 175.95 2dy3 n ASP 207 N -3.01 0.00 -0.67 6.23 3.85 -1.26 -2.92 116.55 118.76 2dy3 n ASP 207 Ca -0.00 0.20 0.07 0.00 -0.71 0.00 0.00 54.79 54.35 2dy3 n ASP 207 Cb 0.25 -0.38 0.18 0.00 -1.35 0.00 0.00 41.12 39.83 2dy3 n ASP 207 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 2dy3 n LEU 208 N -1.38 3.21 0.00 -2.12 4.77 -0.66 -4.67 117.00 116.17 2dy3 n LEU 208 Ca 0.08 -2.43 0.02 0.00 -0.03 0.00 0.00 56.01 53.65 2dy3 n LEU 208 Cb 0.20 -0.34 0.37 0.00 -2.33 0.00 0.00 43.42 41.32 2dy3 n LEU 208 CO 0.17 0.69 1.07 0.45 -1.33 0.00 0.00 177.39 178.44 2dy3 h HIS 209 N 1.74 0.52 0.00 -1.77 3.86 -1.65 -3.40 115.15 114.44 2dy3 h HIS 209 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2dy3 h HIS 209 Cb 1.00 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.30 2dy3 h HIS 209 CO 0.31 0.41 0.00 -1.33 0.86 0.00 0.00 177.93 178.17 2dy3 n MET 210 N -4.39 0.00 0.09 2.45 2.81 -1.26 -2.50 117.12 114.31 2dy3 n MET 210 Ca 0.02 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.03 2dy3 n MET 210 Cb 0.14 0.00 0.10 0.00 -0.71 0.00 0.00 33.22 32.74 2dy3 n MET 210 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2dy3 h GLU 211 N 0.00 0.00 -2.45 0.03 3.07 -1.87 -3.44 114.58 109.93 2dy3 h GLU 211 Ca 0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 2dy3 h GLU 211 Cb 0.00 0.00 -0.20 0.00 -0.84 0.00 0.00 28.75 27.71 2dy3 h GLU 211 CO 0.00 0.00 -0.03 1.41 -1.40 0.00 0.00 179.01 178.99 2dy3 s MET 212 N -3.25 0.83 0.10 2.33 0.00 -1.00 -0.51 119.30 117.80 2dy3 s MET 212 Ca 0.03 0.22 0.09 0.00 0.00 0.00 0.00 55.69 56.04 2dy3 s MET 212 Cb 0.11 0.39 -0.04 0.00 0.00 0.00 0.00 34.83 35.30 2dy3 s MET 212 CO 0.75 -0.22 -0.24 0.14 0.00 0.00 0.00 175.02 175.44 2dy3 s VAL 213 N -0.90 2.01 -0.52 10.11 -7.23 -0.77 -4.25 120.40 118.85 2dy3 s VAL 213 Ca -0.09 -1.58 0.06 0.00 -1.81 0.00 0.00 61.98 58.55 2dy3 s VAL 213 Cb -0.03 -1.78 0.21 0.00 0.56 0.00 0.00 36.38 35.34 2dy3 s VAL 213 CO 0.06 0.09 0.50 -2.11 -0.31 0.00 0.00 175.10 173.34 2dy3 n ARG 214 N 1.18 1.17 -3.13 4.82 1.85 0.32 -1.30 116.66 121.57 2dy3 n ARG 214 Ca -0.18 -3.78 -0.33 0.00 -1.00 0.00 0.00 57.85 52.55 2dy3 n ARG 214 Cb 0.53 -1.81 -0.06 0.00 -1.05 0.00 0.00 32.46 30.07 2dy3 n ARG 214 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2dy3 s PRO 215 N -1.12 4.04 0.00 2.89 0.04 -1.21 -4.34 135.00 135.30 2dy3 s PRO 215 Ca 0.33 0.70 0.00 0.00 0.04 0.00 0.00 61.00 62.07 2dy3 s PRO 215 Cb 0.08 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 32.14 2dy3 s PRO 215 CO -0.13 0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.50 2dy3 n GLY 216 N -0.24 0.08 0.32 0.56 0.00 -1.26 -1.98 105.19 102.67 2dy3 n GLY 216 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2dy3 n GLY 216 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dy3 n LEU 217 N -2.20 -0.21 0.17 0.99 -0.00 -1.26 -0.89 117.00 113.60 2dy3 n LEU 217 Ca 0.00 1.56 0.10 0.00 -0.00 0.00 0.00 56.01 57.68 2dy3 n LEU 217 Cb 0.00 -0.52 0.63 0.00 -0.00 0.00 0.00 43.42 43.52 2dy3 n LEU 217 CO 0.00 -1.54 1.11 0.00 -0.00 0.00 0.00 177.39 176.95 2dy3 h ALA 218 N 1.83 2.08 0.00 1.96 0.00 -1.89 -1.86 119.26 121.38 2dy3 h ALA 218 Ca 0.50 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.38 2dy3 h ALA 218 Cb 0.92 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2dy3 h ALA 218 CO -0.90 -0.12 -0.12 0.74 0.00 0.00 0.00 179.25 178.84 2dy3 h PHE 219 N 0.06 0.00 -0.30 0.00 -1.00 -1.33 -1.25 116.94 113.13 2dy3 h PHE 219 Ca 0.08 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.86 2dy3 h PHE 219 Cb 0.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.80 2dy3 h PHE 219 CO -0.00 0.12 0.00 0.66 -1.61 0.00 0.00 178.31 177.48 2dy3 n TYR 220 N -3.81 0.39 -1.22 -0.55 4.01 -0.70 -4.55 117.16 110.73 2dy3 n TYR 220 Ca -0.02 -0.20 -0.01 0.00 -0.16 0.00 0.00 57.90 57.51 2dy3 n TYR 220 Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.25 2dy3 n TYR 220 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dy3 n GLY 221 N 1.21 0.43 3.57 2.72 0.00 -0.47 -1.95 105.19 110.71 2dy3 n GLY 221 Ca 0.16 -1.01 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 2dy3 n GLY 221 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dy3 s LEU 222 N -0.25 3.11 -0.13 0.99 1.43 -1.22 -3.24 118.68 119.37 2dy3 s LEU 222 Ca 0.00 -0.10 -0.21 0.00 -1.03 0.00 0.00 54.13 52.79 2dy3 s LEU 222 Cb 0.00 -1.72 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2dy3 s LEU 222 CO 0.00 0.33 0.62 -1.61 0.23 0.00 0.00 176.35 175.92 2dy3 s GLU 223 N -1.05 4.33 0.24 1.70 0.41 -1.26 -3.97 118.70 119.10 2dy3 s GLU 223 Ca 0.14 0.69 0.03 0.00 -0.41 0.00 0.00 54.97 55.42 2dy3 s GLU 223 Cb -0.11 -3.49 0.25 0.00 -1.78 0.00 0.00 34.13 29.00 2dy3 s GLU 223 CO 0.04 -0.03 1.57 -1.35 -0.49 0.00 0.00 175.26 175.00 2dy3 h PRO 224 N 7.01 0.31 -5.10 0.39 0.11 -1.94 -3.44 132.00 129.34 2dy3 h PRO 224 Ca -0.37 -0.20 -0.63 0.00 0.11 0.00 0.00 66.00 64.91 2dy3 h PRO 224 Cb 1.17 0.02 -0.33 0.00 0.11 0.00 0.00 31.00 31.97 2dy3 h PRO 224 CO 0.76 0.79 -0.86 0.54 -0.21 0.00 0.00 178.00 179.02 2dy3 s VAL 225 N -3.88 1.80 0.33 3.15 0.11 -1.26 -4.97 120.40 115.68 2dy3 s VAL 225 Ca -0.05 -0.86 -0.29 0.00 -2.93 0.00 0.00 61.98 57.85 2dy3 s VAL 225 Cb 0.12 -1.57 -0.11 0.00 -1.53 0.00 0.00 36.38 33.29 2dy3 s VAL 225 CO 0.80 0.50 1.49 0.00 -3.33 0.00 0.00 175.10 174.57 2dy3 s ALA 226 N 0.48 3.62 0.00 1.54 0.00 -1.26 -2.86 121.76 123.28 2dy3 s ALA 226 Ca -0.17 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.30 2dy3 s ALA 226 Cb -0.17 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2dy3 s ALA 226 CO 0.06 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.29 2dy3 n GLY 227 N 1.23 0.85 3.61 0.00 0.00 -1.26 -5.06 105.19 104.56 2dy3 n GLY 227 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2dy3 n GLY 227 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dy3 s LEU 228 N 0.00 3.48 -0.08 0.99 1.43 -1.14 -5.10 118.68 118.27 2dy3 s LEU 228 Ca 0.00 0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.11 2dy3 s LEU 228 Cb 0.00 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2dy3 s LEU 228 CO 0.00 0.28 0.04 -1.83 0.23 0.00 0.00 176.35 175.07 2dy3 s GLU 229 N -0.28 3.07 0.00 1.70 -1.05 -1.26 -4.96 118.70 115.93 2dy3 s GLU 229 Ca 0.06 -0.38 0.00 0.00 -0.15 0.00 0.00 54.97 54.50 2dy3 s GLU 229 Cb -0.12 -2.87 0.00 0.00 -0.44 0.00 0.00 34.13 30.69 2dy3 s GLU 229 CO 0.02 0.71 0.13 0.72 0.95 0.00 0.00 175.26 177.79 2dy3 n HIS 230 N 1.92 0.00 -2.18 4.83 8.25 -1.26 -5.02 115.22 121.75 2dy3 n HIS 230 Ca -0.18 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.20 2dy3 n HIS 230 Cb 0.54 0.03 -0.00 0.00 1.12 0.00 0.00 29.99 31.68 2dy3 n HIS 230 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dy3 n GLY 231 N 0.00 0.06 3.86 -1.41 0.00 -1.26 -5.02 105.19 101.42 2dy3 n GLY 231 Ca 0.00 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 2dy3 n GLY 231 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dy3 s LEU 232 N -2.30 3.85 -0.28 0.99 1.43 -1.26 -4.93 118.68 116.18 2dy3 s LEU 232 Ca 0.01 1.33 0.02 0.00 -1.03 0.00 0.00 54.13 54.45 2dy3 s LEU 232 Cb -0.00 -4.20 0.06 0.00 0.03 0.00 0.00 46.19 42.08 2dy3 s LEU 232 CO 0.01 -0.39 -0.07 -0.54 0.23 0.00 0.00 176.35 175.59 2dy3 s LYS 233 N -3.62 2.23 0.30 1.70 3.01 -1.26 -4.98 119.74 117.11 2dy3 s LYS 233 Ca 0.55 -1.38 -0.28 0.00 -1.01 0.00 0.00 55.97 53.85 2dy3 s LYS 233 Cb -0.10 -3.00 -0.14 0.00 -1.01 0.00 0.00 37.83 33.59 2dy3 s LYS 233 CO 0.26 -0.62 1.09 -2.30 0.51 0.00 0.00 175.35 174.29 2dy3 n PRO 234 N 4.47 1.55 -0.00 -1.68 -0.02 -1.20 -3.92 135.00 134.20 2dy3 n PRO 234 Ca -0.12 0.54 0.06 0.00 -2.02 0.00 0.00 63.50 61.96 2dy3 n PRO 234 Cb 0.42 -1.97 -0.08 0.00 -0.02 0.00 0.00 33.50 31.85 2dy3 n PRO 234 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dy3 n ALA 235 N 0.31 2.94 -2.63 3.55 0.00 -0.82 -4.90 120.51 118.96 2dy3 n ALA 235 Ca 0.08 -0.30 -0.34 0.00 0.00 0.00 0.00 53.44 52.89 2dy3 n ALA 235 Cb 0.33 -0.41 -0.11 0.00 0.00 0.00 0.00 19.45 19.26 2dy3 n ALA 235 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2dy3 s MET 236 N -2.47 2.84 -0.06 0.00 -2.45 -1.26 -0.73 119.30 115.18 2dy3 s MET 236 Ca -0.00 -0.55 0.00 0.00 -1.25 0.00 0.00 55.69 53.89 2dy3 s MET 236 Cb 0.08 -2.62 0.02 0.00 1.25 0.00 0.00 34.83 33.57 2dy3 s MET 236 CO 0.48 0.62 -0.04 0.99 1.05 0.00 0.00 175.02 178.12 2dy3 s THR 237 N -0.68 0.55 -0.24 10.11 2.01 -0.77 -4.34 115.64 122.29 2dy3 s THR 237 Ca 0.10 -0.09 -0.07 0.00 0.31 0.00 0.00 61.69 61.94 2dy3 s THR 237 Cb -0.11 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.77 2dy3 s THR 237 CO 0.02 0.25 0.05 0.86 -0.69 0.00 0.00 174.62 175.11 2dy3 s TRP 238 N 1.20 3.07 0.01 4.92 -0.00 0.12 0.30 118.94 128.55 2dy3 s TRP 238 Ca -0.07 -0.46 -0.07 0.00 -0.00 0.00 0.00 56.10 55.50 2dy3 s TRP 238 Cb -0.14 -2.21 0.00 0.00 -0.00 0.00 0.00 33.47 31.13 2dy3 s TRP 238 CO -0.02 -0.35 0.13 -1.83 -0.00 0.00 0.00 176.95 174.89 2dy3 s GLU 239 N 1.51 0.50 0.15 5.86 -1.05 -0.49 -0.51 118.70 124.67 2dy3 s GLU 239 Ca 0.06 -0.44 0.05 0.00 -0.15 0.00 0.00 54.97 54.49 2dy3 s GLU 239 Cb -0.15 0.21 -0.04 0.00 -0.44 0.00 0.00 34.13 33.70 2dy3 s GLU 239 CO 0.03 -0.12 -0.11 0.00 0.95 0.00 0.00 175.26 176.01 2dy3 s ALA 240 N -1.52 1.48 -0.19 -0.84 0.00 -0.17 -1.67 121.76 118.85 2dy3 s ALA 240 Ca -0.14 -1.46 -0.08 0.00 0.00 0.00 0.00 51.96 50.28 2dy3 s ALA 240 Cb -0.07 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 2dy3 s ALA 240 CO 0.01 -0.06 0.08 0.15 0.00 0.00 0.00 175.76 175.94 2dy3 s LYS 241 N -3.56 4.00 0.14 0.00 1.02 -0.19 0.64 119.74 121.79 2dy3 s LYS 241 Ca 0.16 -0.33 -0.32 0.00 0.02 0.00 0.00 55.97 55.50 2dy3 s LYS 241 Cb 0.01 -3.27 -0.12 0.00 -0.52 0.00 0.00 37.83 33.93 2dy3 s LYS 241 CO 0.01 0.25 1.75 0.28 -0.92 0.00 0.00 175.35 176.72 2dy3 n VAL 242 N 3.63 0.21 0.08 3.17 0.31 -0.01 -4.22 118.33 121.49 2dy3 n VAL 242 Ca -0.16 -0.04 -0.20 0.00 -0.01 0.00 0.00 64.34 63.93 2dy3 n VAL 242 Cb 0.52 -1.94 -0.15 0.00 -0.91 0.00 0.00 33.84 31.37 2dy3 n VAL 242 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2dy3 h SER 243 N 7.55 0.54 -4.27 4.52 4.64 -1.35 0.39 113.55 125.56 2dy3 h SER 243 Ca -0.45 -0.73 -0.12 0.00 -0.47 0.00 0.00 61.79 60.02 2dy3 h SER 243 Cb 1.23 -0.17 -0.23 0.00 -0.31 0.00 0.00 62.40 62.92 2dy3 h SER 243 CO 0.94 1.60 -0.22 -0.69 -0.87 0.00 0.00 176.83 177.59 2dy3 s VAL 244 N -2.60 0.02 -0.20 0.95 1.01 -1.24 -4.76 120.40 113.58 2dy3 s VAL 244 Ca -0.11 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 2dy3 s VAL 244 Cb 0.06 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 2dy3 s VAL 244 CO 0.87 -0.07 -0.08 -0.69 0.00 0.00 0.00 175.10 175.13 2dy3 s VAL 245 N -0.31 3.16 -0.05 2.92 1.01 -1.26 -0.15 120.40 125.71 2dy3 s VAL 245 Ca -0.05 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.40 2dy3 s VAL 245 Cb -0.03 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 2dy3 s VAL 245 CO 0.02 0.45 -0.16 -0.75 0.00 0.00 0.00 175.10 174.66 2dy3 s LYS 246 N 1.28 2.52 -0.18 2.72 2.47 0.15 -4.96 119.74 123.74 2dy3 s LYS 246 Ca 0.03 -0.74 -0.09 0.00 -1.56 0.00 0.00 55.97 53.62 2dy3 s LYS 246 Cb -0.14 -2.34 -0.05 0.00 -1.46 0.00 0.00 37.83 33.84 2dy3 s LYS 246 CO -0.03 0.57 0.11 -1.14 0.16 0.00 0.00 175.35 175.02 2dy3 s GLN 247 N -0.61 3.97 -0.16 4.03 0.74 -1.26 0.24 119.66 126.61 2dy3 s GLN 247 Ca 0.09 -0.24 -0.14 0.00 0.05 0.00 0.00 55.36 55.11 2dy3 s GLN 247 Cb -0.11 -3.31 -0.06 0.00 1.10 0.00 0.00 33.01 30.63 2dy3 s GLN 247 CO 0.01 0.39 -0.29 -0.89 -0.55 0.00 0.00 175.29 173.95 2dy3 n ILE 248 N 3.21 1.42 -2.42 -2.34 5.41 -1.26 -4.96 119.36 118.41 2dy3 n ILE 248 Ca -0.17 0.07 -0.43 0.00 1.00 0.00 0.00 62.75 63.22 2dy3 n ILE 248 Cb 0.53 -2.13 0.00 0.00 -0.71 0.00 0.00 39.64 37.32 2dy3 n ILE 248 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2dy3 n ARG 265 N -4.24 3.26 -3.40 0.38 0.63 -1.26 -4.80 116.66 107.24 2dy3 n ARG 265 Ca -0.19 -3.33 -0.20 0.00 -0.92 0.00 0.00 57.85 53.21 2dy3 n ARG 265 Cb 0.52 -3.20 -0.00 0.00 0.45 0.00 0.00 32.46 30.24 2dy3 n ARG 265 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2dy3 s GLY 266 N 2.82 1.58 0.03 5.14 0.00 -1.26 -4.28 107.32 111.35 2dy3 s GLY 266 Ca 0.46 -1.38 -0.03 0.00 0.00 0.00 0.00 44.72 43.77 2dy3 s GLY 266 CO 0.00 -1.28 0.04 -1.36 0.00 0.00 0.00 173.10 170.50 2dy3 s PHE 267 N -2.24 0.25 0.12 1.90 0.08 0.46 -4.45 117.98 114.10 2dy3 s PHE 267 Ca 0.45 -0.56 0.03 0.00 0.12 0.00 0.00 56.93 56.97 2dy3 s PHE 267 Cb -0.10 -0.19 -0.04 0.00 -0.57 0.00 0.00 43.02 42.12 2dy3 s PHE 267 CO 0.32 -0.29 -0.08 0.14 -0.10 0.00 0.00 175.22 175.21 2dy3 s VAL 268 N -2.25 0.88 0.02 -0.44 -7.23 0.14 -1.40 120.40 110.11 2dy3 s VAL 268 Ca -0.08 -1.98 0.05 0.00 -1.81 0.00 0.00 61.98 58.15 2dy3 s VAL 268 Cb -0.04 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 2dy3 s VAL 268 CO -0.03 -0.82 -0.14 0.00 -0.31 0.00 0.00 175.10 173.80 2dy3 s ALA 269 N -3.49 1.16 -0.20 1.32 0.00 -0.20 0.32 121.76 120.66 2dy3 s ALA 269 Ca 0.14 -0.73 -0.09 0.00 0.00 0.00 0.00 51.96 51.28 2dy3 s ALA 269 Cb 0.04 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 2dy3 s ALA 269 CO -0.03 0.24 0.10 0.08 0.00 0.00 0.00 175.76 176.16 2dy3 s VAL 270 N -0.63 5.03 -0.17 0.00 1.01 0.78 -1.67 120.40 124.75 2dy3 s VAL 270 Ca 0.03 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 2dy3 s VAL 270 Cb -0.07 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 2dy3 s VAL 270 CO 0.01 0.43 -0.11 0.54 0.00 0.00 0.00 175.10 175.96 2dy3 s VAL 271 N 0.58 3.01 -0.24 2.92 0.11 -0.83 -0.86 120.40 125.09 2dy3 s VAL 271 Ca 0.05 -0.65 -0.05 0.00 -2.93 0.00 0.00 61.98 58.40 2dy3 s VAL 271 Cb -0.12 -2.30 -0.06 0.00 -1.53 0.00 0.00 36.38 32.36 2dy3 s VAL 271 CO 0.01 0.49 1.35 -0.81 -3.33 0.00 0.00 175.10 172.81 2dy3 n PRO 272 N 4.15 0.53 -3.68 1.54 -0.04 -1.26 -2.69 135.00 133.55 2dy3 n PRO 272 Ca -0.19 -0.82 -0.10 0.00 -0.04 0.00 0.00 63.50 62.35 2dy3 n PRO 272 Cb 0.52 -2.19 -0.11 0.00 -0.04 0.00 0.00 33.50 31.68 2dy3 n PRO 272 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dy3 s ALA 273 N 4.85 -1.06 0.17 0.55 0.00 -0.77 -4.71 121.76 120.78 2dy3 s ALA 273 Ca 0.18 1.49 0.02 0.00 0.00 0.00 0.00 51.96 53.66 2dy3 s ALA 273 Cb 0.04 -1.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 2dy3 s ALA 273 CO 0.03 -0.44 0.07 0.41 0.00 0.00 0.00 175.76 175.84 2dy3 n GLY 274 N 4.67 3.72 0.25 0.00 0.00 -1.18 -2.40 105.19 110.25 2dy3 n GLY 274 Ca -0.18 -1.97 0.17 0.00 0.00 0.00 0.00 46.02 44.05 2dy3 n GLY 274 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2dy3 h TYR 275 N 1.31 0.00 0.00 1.61 -0.00 -1.00 0.37 116.97 119.25 2dy3 h TYR 275 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.60 2dy3 h TYR 275 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.24 2dy3 h TYR 275 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.16 2dy3 n ALA 276 N -1.95 2.02 0.59 0.10 0.00 -0.93 -2.87 120.51 117.46 2dy3 n ALA 276 Ca -0.02 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.49 2dy3 n ALA 276 Cb 0.10 -1.41 0.07 0.00 0.00 0.00 0.00 19.45 18.20 2dy3 n ALA 276 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dy3 n ASP 277 N -2.01 2.29 0.00 0.00 8.00 0.13 -3.64 116.55 121.32 2dy3 n ASP 277 Ca 0.04 -1.64 0.00 0.00 0.71 0.00 0.00 54.79 53.90 2dy3 n ASP 277 Cb 0.32 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 2dy3 n ASP 277 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dy3 n GLY 278 N 0.85 1.33 3.56 0.44 0.00 -1.13 0.28 105.19 110.52 2dy3 n GLY 278 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2dy3 n GLY 278 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dy3 s MET 279 N -0.19 3.41 0.45 1.61 0.00 -1.10 -4.72 119.30 118.76 2dy3 s MET 279 Ca 0.00 0.04 -0.25 0.00 0.00 0.00 0.00 55.69 55.49 2dy3 s MET 279 Cb 0.00 -4.06 -0.09 0.00 0.00 0.00 0.00 34.83 30.69 2dy3 s MET 279 CO 0.00 -1.73 1.29 -2.30 0.00 0.00 0.00 175.02 172.28 2dy3 n PRO 280 N 8.42 1.91 0.19 4.11 -0.02 -1.26 -2.84 135.00 145.51 2dy3 n PRO 280 Ca 0.06 0.68 0.04 0.00 -2.02 0.00 0.00 63.50 62.26 2dy3 n PRO 280 Cb 0.49 -2.44 0.38 0.00 -0.02 0.00 0.00 33.50 31.92 2dy3 n PRO 280 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dy3 h ARG 281 N 1.98 0.00 0.00 -0.52 3.08 -1.94 -2.59 114.38 114.38 2dy3 h ARG 281 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2dy3 h ARG 281 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2dy3 h ARG 281 CO 0.59 0.36 0.00 0.45 -1.07 0.00 0.00 179.97 180.30 2dy3 h HIS 282 N 0.00 0.00 0.00 3.04 3.86 -1.97 -2.68 115.15 117.40 2dy3 h HIS 282 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2dy3 h HIS 282 Cb 0.68 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.15 2dy3 h HIS 282 CO 0.00 0.00 0.00 0.00 0.86 0.00 0.00 177.93 178.79 2dy3 n ALA 283 N -1.83 1.95 -1.64 2.45 0.00 -0.98 -4.84 120.51 115.63 2dy3 n ALA 283 Ca 0.02 -0.08 -0.51 0.00 0.00 0.00 0.00 53.44 52.86 2dy3 n ALA 283 Cb 0.23 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 2dy3 n ALA 283 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2dy3 n GLN 284 N -1.27 1.48 -1.21 0.00 7.27 -1.01 -1.66 117.38 120.97 2dy3 n GLN 284 Ca 0.08 0.54 -0.07 0.00 0.07 0.00 0.00 57.00 57.62 2dy3 n GLN 284 Cb 0.14 -2.23 -0.03 0.00 2.41 0.00 0.00 30.24 30.52 2dy3 n GLN 284 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2dy3 n GLY 285 N 3.15 0.80 0.01 1.69 0.00 -1.26 -4.85 105.19 104.74 2dy3 n GLY 285 Ca 0.20 -0.11 0.05 0.00 0.00 0.00 0.00 46.02 46.16 2dy3 n GLY 285 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dy3 n LYS 286 N -1.08 3.18 -4.10 1.61 5.02 -0.67 -5.01 118.16 117.11 2dy3 n LYS 286 Ca -0.07 -0.02 -0.12 0.00 -2.02 0.00 0.00 58.31 56.08 2dy3 n LYS 286 Cb 0.46 -1.04 -0.06 0.00 -0.02 0.00 0.00 35.03 34.36 2dy3 n LYS 286 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2dy3 s PHE 287 N -2.07 0.86 0.10 2.13 -0.12 -1.26 -4.77 117.98 112.86 2dy3 s PHE 287 Ca 0.04 -1.12 0.05 0.00 -0.05 0.00 0.00 56.93 55.85 2dy3 s PHE 287 Cb 0.09 -0.14 -0.04 0.00 -0.63 0.00 0.00 43.02 42.30 2dy3 s PHE 287 CO 0.47 -0.93 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.46 2dy3 s SER 288 N -3.14 1.69 0.39 1.98 0.01 -1.26 -0.92 113.70 112.45 2dy3 s SER 288 Ca 0.30 -0.78 0.08 0.00 1.31 0.00 0.00 55.95 56.86 2dy3 s SER 288 Cb 0.02 -0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 2dy3 s SER 288 CO 0.14 -0.19 0.41 0.68 0.41 0.00 0.00 173.24 174.69 2dy3 s VAL 289 N -2.12 3.05 -0.15 3.43 -7.23 -0.53 -4.84 120.40 112.00 2dy3 s VAL 289 Ca 0.05 -1.25 0.01 0.00 -1.81 0.00 0.00 61.98 58.98 2dy3 s VAL 289 Cb -0.05 -3.08 0.02 0.00 0.56 0.00 0.00 36.38 33.84 2dy3 s VAL 289 CO 0.02 -0.05 -0.17 0.42 -0.31 0.00 0.00 175.10 175.01 2dy3 s THR 290 N -2.38 1.75 -0.27 5.32 -4.23 0.51 -1.44 115.64 114.90 2dy3 s THR 290 Ca 0.48 -0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 60.20 2dy3 s THR 290 Cb -0.06 -1.61 0.02 0.00 1.34 0.00 0.00 72.50 72.20 2dy3 s THR 290 CO 0.29 0.49 -0.01 -0.63 -0.54 0.00 0.00 174.62 174.22 2dy3 s ILE 291 N 1.34 3.24 -1.46 2.99 1.01 0.13 -0.28 121.20 128.17 2dy3 s ILE 291 Ca 0.03 -0.93 -0.07 0.00 0.00 0.00 0.00 60.65 59.69 2dy3 s ILE 291 Cb -0.13 -2.66 0.01 0.00 0.01 0.00 0.00 42.46 39.68 2dy3 s ILE 291 CO -0.10 0.15 0.88 0.47 0.00 0.00 0.00 174.94 176.34 2dy3 n ASP 292 N 4.73 -6.27 0.00 3.58 8.00 -1.26 -2.00 116.55 123.34 2dy3 n ASP 292 Ca -0.16 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 54.94 2dy3 n ASP 292 Cb 0.47 -4.99 0.00 0.00 -0.02 0.00 0.00 41.12 36.58 2dy3 n ASP 292 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dy3 n GLY 293 N -1.76 1.48 3.59 0.44 0.00 -1.26 -5.03 105.19 102.65 2dy3 n GLY 293 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 2dy3 n GLY 293 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dy3 s LEU 294 N 0.00 3.18 0.34 0.99 1.43 -0.84 -5.01 118.68 118.76 2dy3 s LEU 294 Ca 0.00 -0.06 -0.21 0.00 -1.03 0.00 0.00 54.13 52.83 2dy3 s LEU 294 Cb 0.00 -1.74 -0.10 0.00 0.03 0.00 0.00 46.19 44.38 2dy3 s LEU 294 CO 0.00 0.34 0.86 -1.81 0.23 0.00 0.00 176.35 175.96 2dy3 s ASP 295 N -1.03 7.03 -0.15 2.29 1.01 -1.26 -0.69 116.67 123.88 2dy3 s ASP 295 Ca 0.14 1.58 -0.04 0.00 0.71 0.00 0.00 52.55 54.95 2dy3 s ASP 295 Cb -0.11 -2.49 0.07 0.00 1.01 0.00 0.00 42.92 41.40 2dy3 s ASP 295 CO 0.04 -0.17 0.21 -0.31 0.21 0.00 0.00 175.17 175.14 2dy3 s TYR 296 N -1.85 -0.26 0.32 4.23 1.51 -0.52 -4.95 117.35 115.83 2dy3 s TYR 296 Ca 0.53 0.50 -0.29 0.00 -1.01 0.00 0.00 57.07 56.80 2dy3 s TYR 296 Cb -0.13 -0.27 -0.11 0.00 -0.11 0.00 0.00 41.96 41.34 2dy3 s TYR 296 CO 0.18 -0.44 1.43 -1.25 -1.11 0.00 0.00 175.55 174.37 2dy3 s PRO 297 N 2.33 4.23 0.36 -1.71 0.04 -1.26 -1.45 135.00 137.54 2dy3 s PRO 297 Ca 0.04 2.39 -0.26 0.00 0.04 0.00 0.00 61.00 63.21 2dy3 s PRO 297 Cb -0.14 -3.04 -0.09 0.00 0.04 0.00 0.00 34.50 31.27 2dy3 s PRO 297 CO -0.09 -0.40 1.10 -1.14 0.04 0.00 0.00 177.00 176.51 2dy3 s GLN 298 N -1.45 4.29 0.04 4.56 -0.44 -0.10 -1.28 119.66 125.28 2dy3 s GLN 298 Ca 0.54 1.70 0.01 0.00 -2.50 0.00 0.00 55.36 55.10 2dy3 s GLN 298 Cb -0.43 -2.79 -0.03 0.00 -1.64 0.00 0.00 33.01 28.11 2dy3 s GLN 298 CO 0.54 -0.07 -0.05 0.14 0.50 0.00 0.00 175.29 176.35 2dy3 s VAL 299 N -1.43 0.32 0.00 1.34 -7.23 0.12 -4.13 120.40 109.39 2dy3 s VAL 299 Ca 0.53 -1.30 0.00 0.00 -1.81 0.00 0.00 61.98 59.40 2dy3 s VAL 299 Cb -0.28 -0.83 0.00 0.00 0.56 0.00 0.00 36.38 35.83 2dy3 s VAL 299 CO 0.35 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 175.11 2dy3 n GLY 300 N 1.00 -1.47 3.77 2.32 0.00 -1.26 -3.97 105.19 105.58 2dy3 n GLY 300 Ca -0.20 -1.28 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 2dy3 n GLY 300 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dy3 s ARG 301 N 0.00 4.60 -0.16 1.61 0.52 -1.26 -4.66 118.95 119.59 2dy3 s ARG 301 Ca 0.00 1.19 -0.26 0.00 -0.52 0.00 0.00 55.73 56.14 2dy3 s ARG 301 Cb 0.00 -3.27 -0.01 0.00 0.52 0.00 0.00 34.95 32.19 2dy3 s ARG 301 CO 0.00 0.56 0.89 0.08 0.02 0.00 0.00 175.30 176.84 2dy3 s VAL 302 N -1.11 4.84 0.48 3.52 1.01 -1.26 -4.64 120.40 123.25 2dy3 s VAL 302 Ca 0.36 1.75 0.05 0.00 0.00 0.00 0.00 61.98 64.14 2dy3 s VAL 302 Cb -0.23 -4.19 0.09 0.00 0.00 0.00 0.00 36.38 32.04 2dy3 s VAL 302 CO 0.27 0.01 0.66 0.00 0.00 0.00 0.00 175.10 176.04 2dy3 h MET 304 N 0.00 1.08 -0.01 0.00 4.05 -1.94 -0.91 114.93 117.20 2dy3 h MET 304 Ca -0.22 -0.16 0.00 0.00 -0.28 0.00 0.00 59.70 59.04 2dy3 h MET 304 Cb 0.95 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 31.56 2dy3 h MET 304 CO 0.29 0.84 -0.27 -0.25 0.23 0.00 0.00 176.91 177.76 2dy3 n ASP 305 N -4.39 1.08 -3.73 1.39 8.00 -1.26 -2.20 116.55 115.44 2dy3 n ASP 305 Ca 0.06 -1.04 -0.05 0.00 0.71 0.00 0.00 54.79 54.47 2dy3 n ASP 305 Cb 0.14 0.58 -0.02 0.00 -0.02 0.00 0.00 41.12 41.80 2dy3 n ASP 305 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dy3 s GLN 306 N -1.50 1.30 0.15 -1.24 -2.07 -1.18 -1.85 119.66 113.26 2dy3 s GLN 306 Ca 0.08 -0.68 -0.03 0.00 -1.82 0.00 0.00 55.36 52.90 2dy3 s GLN 306 Cb 0.08 0.47 -0.03 0.00 -1.09 0.00 0.00 33.01 32.44 2dy3 s GLN 306 CO 0.29 -0.59 0.13 -0.59 -1.32 0.00 0.00 175.29 173.21 2dy3 s PHE 307 N -3.45 0.75 0.14 9.60 -0.71 -1.01 -0.48 117.98 122.82 2dy3 s PHE 307 Ca 0.10 -1.11 0.10 0.00 -1.04 0.00 0.00 56.93 54.98 2dy3 s PHE 307 Cb -0.02 -0.36 -0.04 0.00 -1.21 0.00 0.00 43.02 41.38 2dy3 s PHE 307 CO 0.01 -0.59 -0.23 0.08 -1.34 0.00 0.00 175.22 173.15 2dy3 s VAL 308 N -4.03 2.50 0.08 -2.49 1.01 -1.25 -1.96 120.40 114.25 2dy3 s VAL 308 Ca 0.23 -1.72 0.06 0.00 0.00 0.00 0.00 61.98 60.55 2dy3 s VAL 308 Cb 0.06 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 2dy3 s VAL 308 CO 0.02 0.05 -0.17 0.27 0.00 0.00 0.00 175.10 175.28 2dy3 s ILE 309 N -1.21 1.33 -0.16 2.22 -4.36 -0.67 0.11 121.20 118.46 2dy3 s ILE 309 Ca 0.17 -1.36 -0.14 0.00 -0.26 0.00 0.00 60.65 59.06 2dy3 s ILE 309 Cb -0.10 -1.24 -0.05 0.00 1.25 0.00 0.00 42.46 42.33 2dy3 s ILE 309 CO 0.08 -0.15 0.29 -0.94 0.24 0.00 0.00 174.94 174.46 2dy3 s SER 310 N -1.75 6.42 0.00 4.36 1.04 -0.41 -1.04 113.70 122.33 2dy3 s SER 310 Ca 0.01 0.49 0.23 0.00 0.48 0.00 0.00 55.95 57.17 2dy3 s SER 310 Cb -0.10 -2.18 0.15 0.00 0.10 0.00 0.00 66.02 63.99 2dy3 s SER 310 CO 0.03 0.10 1.19 0.18 0.98 0.00 0.00 173.24 175.71 2dy3 n LEU 311 N 3.61 1.98 0.00 2.42 4.77 -0.50 -4.20 117.00 125.08 2dy3 n LEU 311 Ca -0.12 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.15 2dy3 n LEU 311 Cb 0.52 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2dy3 n LEU 311 CO 0.40 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 2dy3 n GLY 312 N 1.40 2.33 0.56 -0.72 0.00 -1.21 -0.55 105.19 107.00 2dy3 n GLY 312 Ca 0.10 -0.34 0.05 0.00 0.00 0.00 0.00 46.02 45.83 2dy3 n GLY 312 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dy3 n ASP 313 N 5.59 1.61 -3.81 1.61 5.75 -1.26 -0.40 116.55 125.64 2dy3 n ASP 313 Ca 0.00 -2.00 -0.33 0.00 -0.01 0.00 0.00 54.79 52.45 2dy3 n ASP 313 Cb 0.00 -0.20 0.03 0.00 -1.03 0.00 0.00 41.12 39.91 2dy3 n ASP 313 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2dy3 n ASN 314 N 0.38 -4.08 0.27 -1.12 5.15 0.29 -4.88 115.26 111.28 2dy3 n ASN 314 Ca 0.10 -1.07 0.14 0.00 -0.60 0.00 0.00 54.58 53.16 2dy3 n ASN 314 Cb 0.25 -3.01 0.79 0.00 -0.53 0.00 0.00 39.78 37.28 2dy3 n ASN 314 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2dy3 h PRO 315 N -2.01 0.00 -0.39 1.20 0.13 -1.92 -2.42 132.00 126.59 2dy3 h PRO 315 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2dy3 h PRO 315 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2dy3 h PRO 315 CO 0.52 0.09 0.00 0.72 -0.23 0.00 0.00 178.00 179.10 2dy3 n HIS 316 N -3.54 0.52 -3.65 1.56 8.25 -1.26 -4.95 115.22 112.14 2dy3 n HIS 316 Ca -0.02 -0.26 -0.25 0.00 -0.26 0.00 0.00 57.72 56.93 2dy3 n HIS 316 Cb 0.22 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.40 2dy3 n HIS 316 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dy3 n GLY 317 N 1.30 -0.53 3.72 -1.41 0.00 -0.91 -4.92 105.19 102.43 2dy3 n GLY 317 Ca 0.17 0.24 -0.43 0.00 0.00 0.00 0.00 46.02 46.01 2dy3 n GLY 317 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2dy3 n VAL 318 N -4.93 0.71 -4.40 1.61 0.31 -1.26 -4.99 118.33 105.36 2dy3 n VAL 318 Ca 0.01 -0.18 -0.20 0.00 -0.01 0.00 0.00 64.34 63.96 2dy3 n VAL 318 Cb 0.56 -1.82 -0.10 0.00 -0.91 0.00 0.00 33.84 31.56 2dy3 n VAL 318 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2dy3 s GLU 319 N -0.02 1.50 0.46 5.55 2.02 -1.26 -4.99 118.70 121.96 2dy3 s GLU 319 Ca 0.68 -1.76 -0.25 0.00 0.02 0.00 0.00 54.97 53.67 2dy3 s GLU 319 Cb -0.55 -1.02 -0.08 0.00 0.10 0.00 0.00 34.13 32.58 2dy3 s GLU 319 CO 0.44 0.00 1.33 0.00 0.02 0.00 0.00 175.26 177.06 2dy3 n ALA 320 N -0.54 1.57 0.00 5.21 0.00 -1.26 -1.89 120.51 123.60 2dy3 n ALA 320 Ca -0.05 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2dy3 n ALA 320 Cb 0.64 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2dy3 n ALA 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dy3 n GLY 321 N 0.74 0.93 3.77 0.00 0.00 0.14 -4.96 105.19 105.81 2dy3 n GLY 321 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 2dy3 n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dy3 s ALA 322 N -2.24 3.31 -0.22 4.61 0.00 -0.79 -4.60 121.76 121.83 2dy3 s ALA 322 Ca 0.00 1.15 -0.28 0.00 0.00 0.00 0.00 51.96 52.84 2dy3 s ALA 322 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.67 2dy3 s ALA 322 CO 0.00 -0.66 0.96 0.15 0.00 0.00 0.00 175.76 176.22 2dy3 s LYS 323 N -2.08 4.26 -0.31 0.00 1.02 -1.26 -0.83 119.74 120.54 2dy3 s LYS 323 Ca 0.54 1.22 -0.07 0.00 0.02 0.00 0.00 55.97 57.68 2dy3 s LYS 323 Cb -0.36 -3.63 0.01 0.00 -0.52 0.00 0.00 37.83 33.33 2dy3 s LYS 323 CO 0.47 -0.54 0.10 0.00 -0.92 0.00 0.00 175.35 174.45 2dy3 s ALA 324 N 2.90 3.09 -0.22 5.17 0.00 0.21 -4.14 121.76 128.77 2dy3 s ALA 324 Ca 0.41 -1.50 -0.26 0.00 0.00 0.00 0.00 51.96 50.61 2dy3 s ALA 324 Cb -0.16 -2.21 -0.01 0.00 0.00 0.00 0.00 23.12 20.75 2dy3 s ALA 324 CO 0.08 -1.01 0.87 0.08 0.00 0.00 0.00 175.76 175.78 2dy3 s VAL 325 N 1.50 4.82 -0.04 0.00 1.01 0.61 -1.00 120.40 127.30 2dy3 s VAL 325 Ca 0.02 1.67 -0.17 0.00 0.00 0.00 0.00 61.98 63.50 2dy3 s VAL 325 Cb -0.18 -4.16 -0.32 0.00 0.00 0.00 0.00 36.38 31.73 2dy3 s VAL 325 CO 0.03 -0.06 0.81 0.40 0.00 0.00 0.00 175.10 176.28 2dy3 h ILE 326 N 5.36 1.24 -1.64 2.22 2.04 -1.12 0.15 117.51 125.75 2dy3 h ILE 326 Ca -0.24 -2.55 0.05 0.00 1.00 0.00 0.00 64.86 63.12 2dy3 h ILE 326 Cb 1.10 2.97 -0.24 0.00 -0.74 0.00 0.00 36.82 39.91 2dy3 h ILE 326 CO 0.88 0.76 0.45 0.72 0.00 0.00 0.00 178.15 180.96 2dy3 s PHE 327 N -2.51 -0.47 -1.51 1.37 -0.12 -1.12 -4.70 117.98 108.91 2dy3 s PHE 327 Ca -0.14 1.01 0.00 0.00 -0.05 0.00 0.00 56.93 57.75 2dy3 s PHE 327 Cb 0.03 0.39 0.00 0.00 -0.63 0.00 0.00 43.02 42.81 2dy3 s PHE 327 CO 0.85 -0.31 0.00 0.41 -0.05 0.00 0.00 175.22 176.12 2dy3 n GLY 328 N 1.60 0.43 3.75 1.99 0.00 -0.05 0.14 105.19 113.05 2dy3 n GLY 328 Ca -0.12 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 2dy3 n GLY 328 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dy3 n GLU 329 N 0.00 2.58 -2.18 1.61 2.13 -1.26 -2.06 120.64 121.46 2dy3 n GLU 329 Ca 0.00 0.91 -0.19 0.00 0.66 0.00 0.00 57.16 58.54 2dy3 n GLU 329 Cb 0.00 -2.63 -0.03 0.00 0.27 0.00 0.00 31.44 29.05 2dy3 n GLU 329 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2dy3 n ASN 330 N 1.08 -5.47 -0.24 4.31 3.02 -1.26 -4.92 115.26 111.78 2dy3 n ASN 330 Ca 0.04 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2dy3 n ASN 330 Cb 0.37 -4.55 0.00 0.00 -0.61 0.00 0.00 39.78 35.00 2dy3 n ASN 330 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dy3 n GLY 331 N -0.93 3.02 3.75 7.41 0.00 -0.87 -4.22 105.19 113.35 2dy3 n GLY 331 Ca -0.22 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.51 2dy3 n GLY 331 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dy3 s HIS 332 N -4.06 3.85 0.89 1.61 3.76 -1.26 -4.62 115.29 115.45 2dy3 s HIS 332 Ca 0.00 1.84 -0.12 0.00 -0.15 0.00 0.00 55.06 56.63 2dy3 s HIS 332 Cb 0.00 -3.08 0.13 0.00 1.11 0.00 0.00 32.58 30.73 2dy3 s HIS 332 CO 0.00 0.11 1.11 0.16 -0.85 0.00 0.00 174.74 175.28 2dy3 s ASP 333 N -1.08 3.65 0.32 1.40 1.47 -1.26 -0.87 116.67 120.30 2dy3 s ASP 333 Ca 0.42 1.14 0.06 0.00 1.18 0.00 0.00 52.55 55.36 2dy3 s ASP 333 Cb -0.28 -1.79 0.74 0.00 -0.34 0.00 0.00 42.92 41.25 2dy3 s ASP 333 CO 0.35 -2.48 1.82 0.00 0.68 0.00 0.00 175.17 175.54 2dy3 h ALA 334 N -1.45 1.72 -0.16 2.11 0.00 -1.91 -1.35 119.26 118.22 2dy3 h ALA 334 Ca -0.50 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 2dy3 h ALA 334 Cb 1.31 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2dy3 h ALA 334 CO 0.60 -0.02 0.01 1.15 0.00 0.00 0.00 179.25 180.99 2dy3 h THR 335 N 0.78 1.24 -0.23 0.00 2.02 -1.92 0.14 112.91 114.96 2dy3 h THR 335 Ca 0.52 -0.81 0.01 0.00 0.77 0.00 0.00 66.41 66.90 2dy3 h THR 335 Cb 0.77 1.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.62 2dy3 h THR 335 CO -0.29 0.24 0.13 -0.78 0.37 0.00 0.00 175.52 175.20 2dy3 h ASP 336 N 0.04 0.22 -0.93 4.18 3.58 -1.77 -0.50 116.42 121.24 2dy3 h ASP 336 Ca 0.05 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.50 2dy3 h ASP 336 Cb 0.36 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.32 2dy3 h ASP 336 CO 0.01 0.16 0.61 0.15 -2.88 0.00 0.00 179.24 177.28 2dy3 h PHE 337 N 0.28 1.19 0.07 0.28 3.04 -1.20 -1.09 116.94 119.51 2dy3 h PHE 337 Ca 0.09 0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.06 2dy3 h PHE 337 Cb -0.01 -0.40 -0.01 0.00 2.56 0.00 0.00 35.95 38.09 2dy3 h PHE 337 CO -0.08 0.76 -0.09 0.00 -2.02 0.00 0.00 178.31 176.89 2dy3 h ALA 338 N 1.33 -0.15 -0.06 2.41 0.00 -0.06 -1.66 119.26 121.07 2dy3 h ALA 338 Ca 0.34 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 2dy3 h ALA 338 Cb -0.12 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2dy3 h ALA 338 CO -0.07 -0.60 -0.22 1.05 0.00 0.00 0.00 179.25 179.41 2dy3 h GLU 339 N -0.18 0.10 -0.14 0.00 4.11 -0.77 -0.41 114.58 117.29 2dy3 h GLU 339 Ca 0.01 -0.03 -0.07 0.00 0.07 0.00 0.00 59.36 59.34 2dy3 h GLU 339 Cb 0.19 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2dy3 h GLU 339 CO -0.03 0.32 -0.23 0.00 0.07 0.00 0.00 179.01 179.13 2dy3 h ARG 340 N 0.09 0.24 -0.51 1.06 2.47 -0.80 -2.03 114.38 114.91 2dy3 h ARG 340 Ca 0.02 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 2dy3 h ARG 340 Cb 0.45 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 2dy3 h ARG 340 CO 0.03 0.47 0.00 1.28 0.56 0.00 0.00 179.97 182.31 2dy3 n LEU 341 N -4.18 2.73 -3.72 3.04 4.32 -0.50 -4.85 117.00 113.85 2dy3 n LEU 341 Ca -0.01 -1.37 -0.24 0.00 -0.02 0.00 0.00 56.01 54.38 2dy3 n LEU 341 Cb 0.35 -0.35 0.04 0.00 -1.62 0.00 0.00 43.42 41.84 2dy3 n LEU 341 CO 0.39 0.66 0.04 -0.67 -1.22 0.00 0.00 177.39 176.59 2dy3 n ASP 342 N 0.93 -2.91 -0.20 -1.43 2.03 -0.69 -4.96 116.55 109.32 2dy3 n ASP 342 Ca 0.17 -0.75 0.00 0.00 0.52 0.00 0.00 54.79 54.72 2dy3 n ASP 342 Cb 0.44 -4.24 0.00 0.00 -0.72 0.00 0.00 41.12 36.60 2dy3 n ASP 342 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2dy3 n THR 343 N -4.46 0.00 -4.42 5.18 5.66 -0.28 -5.01 114.28 110.94 2dy3 n THR 343 Ca -0.16 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.58 2dy3 n THR 343 Cb 0.62 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.29 2dy3 n THR 343 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 2dy3 s ILE 344 N -1.89 2.51 0.56 1.09 -4.36 -1.26 -3.85 121.20 114.00 2dy3 s ILE 344 Ca 0.00 -2.13 0.26 0.00 -0.26 0.00 0.00 60.65 58.51 2dy3 s ILE 344 Cb 0.00 -2.26 0.36 0.00 1.25 0.00 0.00 42.46 41.82 2dy3 s ILE 344 CO 0.00 -0.23 2.06 -0.55 0.24 0.00 0.00 174.94 176.46 2dy3 h ASN 345 N 2.79 0.00 -0.57 4.36 -0.00 -1.87 -1.16 115.58 119.13 2dy3 h ASN 345 Ca -0.44 0.00 0.06 0.00 -0.00 0.00 0.00 56.30 55.92 2dy3 h ASN 345 Cb 1.23 0.00 -0.05 0.00 -0.00 0.00 0.00 38.32 39.50 2dy3 h ASN 345 CO 0.53 0.00 0.28 1.88 -0.00 0.00 0.00 177.43 180.12 2dy3 h TYR 346 N 0.00 0.51 -0.18 4.14 -1.99 -1.95 -2.54 116.97 114.96 2dy3 h TYR 346 Ca 0.14 0.02 -0.21 0.00 2.00 0.00 0.00 58.73 60.68 2dy3 h TYR 346 Cb 0.63 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 39.22 2dy3 h TYR 346 CO 0.00 0.23 -0.70 1.49 -0.00 0.00 0.00 178.16 179.17 2dy3 h GLU 347 N 0.53 0.74 -0.75 4.88 4.81 -1.63 -3.20 114.58 119.96 2dy3 h GLU 347 Ca 0.26 -0.56 -0.03 0.00 -0.13 0.00 0.00 59.36 58.90 2dy3 h GLU 347 Cb 0.20 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 2dy3 h GLU 347 CO -0.19 1.18 0.34 -0.39 -0.73 0.00 0.00 179.01 179.22 2dy3 h VAL 348 N 0.53 1.24 0.00 0.32 -1.51 -1.33 -2.07 116.25 113.43 2dy3 h VAL 348 Ca -0.03 -0.71 -0.02 0.00 -1.23 0.00 0.00 66.70 64.71 2dy3 h VAL 348 Cb 1.32 0.32 -0.00 0.00 -2.13 0.00 0.00 31.29 30.80 2dy3 h VAL 348 CO 0.14 0.30 -0.10 -0.37 -1.23 0.00 0.00 177.57 176.31 2dy3 h VAL 349 N 1.06 0.28 0.00 7.19 -1.51 -1.53 -2.18 116.25 119.57 2dy3 h VAL 349 Ca 0.26 -0.68 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 2dy3 h VAL 349 Cb 0.14 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 30.83 2dy3 h VAL 349 CO -0.03 0.09 -0.31 0.00 -1.23 0.00 0.00 177.57 176.10 2dy3 h ARG 351 N 0.00 0.40 -6.07 0.00 2.47 -0.74 -3.45 114.38 106.99 2dy3 h ARG 351 Ca 0.00 -0.22 -0.67 0.00 -1.26 0.00 0.00 59.98 57.82 2dy3 h ARG 351 Cb 0.53 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2dy3 h ARG 351 CO 0.00 0.80 1.26 -2.30 0.56 0.00 0.00 179.97 180.29 2dy3 n PRO 352 N -4.50 1.31 0.00 0.04 -0.02 -1.26 -4.02 135.00 126.55 2dy3 n PRO 352 Ca -0.06 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2dy3 n PRO 352 Cb 0.40 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2dy3 n PRO 352 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2dy3 n THR 353 N 6.34 0.00 0.00 3.45 5.66 0.14 -4.97 114.28 124.90 2dy3 n THR 353 Ca 0.35 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.35 2dy3 n THR 353 Cb 0.23 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 2dy3 n THR 353 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dy3 n GLY 354 N 0.00 4.15 0.03 1.09 0.00 -1.24 -1.70 105.19 107.52 2dy3 n GLY 354 Ca 0.00 0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2dy3 n GLY 354 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dy3 n ARG 355 N 12.87 0.06 -1.68 1.61 3.00 -1.26 -4.83 116.66 126.42 2dy3 n ARG 355 Ca 0.00 0.15 -0.45 0.00 -0.01 0.00 0.00 57.85 57.54 2dy3 n ARG 355 Cb 0.00 -1.58 -0.04 0.00 0.00 0.00 0.00 32.46 30.84 2dy3 n ARG 355 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2dy3 n THR 356 N -1.68 0.29 -4.22 0.55 -2.24 -0.69 -4.77 114.28 101.52 2dy3 n THR 356 Ca 0.05 -0.05 -0.35 0.00 -2.27 0.00 0.00 64.05 61.42 2dy3 n THR 356 Cb 0.29 -1.88 -0.09 0.00 -2.10 0.00 0.00 70.33 66.55 2dy3 n THR 356 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2dy3 s VAL 357 N 2.43 4.67 -0.20 2.28 1.01 -0.01 -4.85 120.40 125.73 2dy3 s VAL 357 Ca 0.83 -0.11 -0.20 0.00 0.00 0.00 0.00 61.98 62.51 2dy3 s VAL 357 Cb -0.59 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2dy3 s VAL 357 CO 0.41 0.60 0.57 -0.60 0.00 0.00 0.00 175.10 176.08 2dy3 s ARG 358 N -0.88 4.20 -0.05 2.72 3.52 -1.26 -1.10 118.95 126.10 2dy3 s ARG 358 Ca 0.13 0.51 0.06 0.00 -0.13 0.00 0.00 55.73 56.30 2dy3 s ARG 358 Cb -0.12 -3.57 -0.01 0.00 -1.56 0.00 0.00 34.95 29.69 2dy3 s ARG 358 CO 0.03 -0.19 -0.23 0.00 -0.81 0.00 0.00 175.30 174.09 2dy3 s ALA 359 N 1.77 1.96 -0.24 6.12 0.00 0.04 -4.94 121.76 126.48 2dy3 s ALA 359 Ca 0.26 -0.95 -0.16 0.00 0.00 0.00 0.00 51.96 51.11 2dy3 s ALA 359 Cb -0.16 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 2dy3 s ALA 359 CO 0.10 0.40 0.39 0.71 0.00 0.00 0.00 175.76 177.36 2dy3 s TYR 360 N -0.20 3.31 0.00 0.00 2.02 -1.26 0.61 117.35 121.82 2dy3 s TYR 360 Ca -0.01 0.52 0.00 0.00 -0.37 0.00 0.00 57.07 57.21 2dy3 s TYR 360 Cb -0.12 -2.56 0.00 0.00 -0.40 0.00 0.00 41.96 38.88 2dy3 s TYR 360 CO 0.02 -0.13 0.00 0.28 -1.57 0.00 0.00 175.55 174.15