#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 5.92 0.15 6.12 0.01 -1.26 -5.00 114.94 120.87 2dy3 s ASN 2 Ca 0.00 0.33 0.25 0.00 -0.71 0.00 0.00 52.86 52.74 2dy3 s ASN 2 Cb 0.00 -1.82 0.63 0.00 0.41 0.00 0.00 41.25 40.47 2dy3 s ASN 2 CO 0.00 0.39 1.58 0.18 -1.51 0.00 0.00 177.10 177.74 2dy3 n LEU 3 N 2.01 0.70 -3.67 0.60 4.77 -1.26 -4.77 117.00 115.39 2dy3 n LEU 3 Ca -0.19 0.40 -0.20 0.00 -0.03 0.00 0.00 56.01 55.99 2dy3 n LEU 3 Cb 0.54 -0.27 -0.18 0.00 -2.33 0.00 0.00 43.42 41.18 2dy3 n LEU 3 CO 0.30 -0.10 -0.34 -0.22 -1.33 0.00 0.00 177.39 175.70 2dy3 s LEU 4 N -4.23 0.15 0.17 2.23 2.96 -1.26 -0.20 118.68 118.49 2dy3 s LEU 4 Ca 0.09 0.04 -0.09 0.00 -0.22 0.00 0.00 54.13 53.95 2dy3 s LEU 4 Cb 0.13 -0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.68 2dy3 s LEU 4 CO 0.65 -0.26 0.29 0.42 -1.32 0.00 0.00 176.35 176.13 2dy3 s THR 5 N 2.17 0.06 -0.13 3.68 -4.23 -0.56 -0.85 115.64 115.79 2dy3 s THR 5 Ca 0.05 -1.39 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 2dy3 s THR 5 Cb -0.12 -1.86 -0.01 0.00 1.34 0.00 0.00 72.50 71.85 2dy3 s THR 5 CO -0.03 -0.28 -0.17 0.42 -0.54 0.00 0.00 174.62 174.02 2dy3 s THR 6 N -3.97 2.70 -0.29 3.99 -4.23 -0.47 -1.19 115.64 112.18 2dy3 s THR 6 Ca 0.18 -0.78 -0.15 0.00 -1.18 0.00 0.00 61.69 59.76 2dy3 s THR 6 Cb 0.03 -2.11 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 2dy3 s THR 6 CO 0.00 0.53 0.36 -0.75 -0.54 0.00 0.00 174.62 174.22 2dy3 s LYS 7 N 0.44 3.90 -0.41 3.99 2.20 0.21 -0.54 119.74 129.53 2dy3 s LYS 7 Ca -0.12 -0.09 -0.10 0.00 -0.36 0.00 0.00 55.97 55.29 2dy3 s LYS 7 Cb -0.16 -3.69 0.06 0.00 -1.51 0.00 0.00 37.83 32.53 2dy3 s LYS 7 CO 0.06 -0.33 0.26 0.42 -0.36 0.00 0.00 175.35 175.39 2dy3 s ILE 8 N 2.04 4.41 -0.83 5.43 -1.09 0.34 -1.60 121.20 129.89 2dy3 s ILE 8 Ca 0.14 -1.22 -0.26 0.00 -2.23 0.00 0.00 60.65 57.08 2dy3 s ILE 8 Cb -0.16 -3.62 0.03 0.00 -1.58 0.00 0.00 42.46 37.13 2dy3 s ILE 8 CO 0.11 -0.44 1.36 -0.62 -1.23 0.00 0.00 174.94 174.12 2dy3 s ASP 9 N 2.00 6.24 0.38 3.58 -1.08 0.28 -1.19 116.67 126.89 2dy3 s ASP 9 Ca 0.03 -0.78 0.13 0.00 -0.52 0.00 0.00 52.55 51.41 2dy3 s ASP 9 Cb -0.22 -2.56 0.76 0.00 -1.46 0.00 0.00 42.92 39.44 2dy3 s ASP 9 CO 0.04 -1.75 1.84 -0.07 0.52 0.00 0.00 175.17 175.75 2dy3 h LEU 10 N 13.09 0.00 -0.95 -1.34 3.38 -1.88 -2.41 115.31 125.20 2dy3 h LEU 10 Ca -0.11 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2dy3 h LEU 10 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2dy3 h LEU 10 CO 1.33 0.35 -0.24 0.44 0.09 0.00 0.00 178.44 180.41 2dy3 h ASP 11 N 0.00 0.48 -0.53 -0.43 3.45 -1.89 -0.47 116.42 117.03 2dy3 h ASP 11 Ca -0.00 -0.16 -0.08 0.00 0.43 0.00 0.00 57.03 57.21 2dy3 h ASP 11 Cb 0.63 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 39.25 2dy3 h ASP 11 CO 0.05 0.72 0.03 0.00 -1.57 0.00 0.00 179.24 178.47 2dy3 h ALA 12 N 1.32 0.97 -0.41 3.45 0.00 -1.78 -0.65 119.26 122.16 2dy3 h ALA 12 Ca 0.06 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 2dy3 h ALA 12 Cb 0.65 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2dy3 h ALA 12 CO 0.05 0.63 0.09 0.82 0.00 0.00 0.00 179.25 180.84 2dy3 h ILE 13 N 0.89 1.23 -0.60 0.00 2.04 -1.05 0.11 117.51 120.14 2dy3 h ILE 13 Ca 0.17 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 2dy3 h ILE 13 Cb 0.48 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 2dy3 h ILE 13 CO 0.02 0.29 0.34 0.00 0.00 0.00 0.00 178.15 178.79 2dy3 h ALA 14 N 0.95 0.77 -0.06 1.87 0.00 -0.87 -0.66 119.26 121.26 2dy3 h ALA 14 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2dy3 h ALA 14 Cb 0.33 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2dy3 h ALA 14 CO 0.00 0.28 0.02 1.25 0.00 0.00 0.00 179.25 180.81 2dy3 h HIS 15 N 0.82 0.04 -0.85 0.00 -0.00 -0.81 -1.97 115.15 112.37 2dy3 h HIS 15 Ca 0.21 0.00 0.05 0.00 -0.00 0.00 0.00 60.37 60.64 2dy3 h HIS 15 Cb 0.03 -0.01 -0.05 0.00 -0.00 0.00 0.00 27.41 27.38 2dy3 h HIS 15 CO -0.01 0.02 0.56 -0.91 -0.00 0.00 0.00 177.93 177.59 2dy3 h ASN 16 N 0.05 0.86 -0.40 3.26 2.35 -0.34 -1.57 115.58 119.79 2dy3 h ASN 16 Ca 0.02 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2dy3 h ASN 16 Cb 0.01 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 2dy3 h ASN 16 CO -0.02 0.57 0.21 0.74 -1.65 0.00 0.00 177.43 177.27 2dy3 h THR 17 N 0.99 1.16 -0.35 2.81 2.02 -0.67 -1.83 112.91 117.04 2dy3 h THR 17 Ca 0.35 -0.45 0.03 0.00 0.77 0.00 0.00 66.41 67.12 2dy3 h THR 17 Cb 0.14 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 2dy3 h THR 17 CO -0.12 0.17 0.15 0.03 0.37 0.00 0.00 175.52 176.12 2dy3 h ARG 18 N 0.51 0.30 0.00 6.66 2.47 -0.58 0.20 114.38 123.95 2dy3 h ARG 18 Ca 0.14 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.86 2dy3 h ARG 18 Cb 0.09 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 2dy3 h ARG 18 CO -0.02 0.20 -0.14 0.28 0.56 0.00 0.00 179.97 180.85 2dy3 h VAL 19 N 0.31 0.65 -0.66 2.04 2.07 -1.10 0.00 116.25 119.56 2dy3 h VAL 19 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.62 2dy3 h VAL 19 Cb 0.11 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2dy3 h VAL 19 CO -0.14 0.00 0.19 -0.07 0.02 0.00 0.00 177.57 177.57 2dy3 h LEU 20 N -0.24 0.96 -0.51 2.57 -0.00 -1.04 -0.80 115.31 116.25 2dy3 h LEU 20 Ca 0.05 -0.18 -0.02 0.00 -0.00 0.00 0.00 57.88 57.73 2dy3 h LEU 20 Cb 0.30 -0.25 -0.02 0.00 -0.00 0.00 0.00 40.66 40.68 2dy3 h LEU 20 CO -0.14 0.91 0.25 0.50 -0.00 0.00 0.00 178.44 179.96 2dy3 h LYS 21 N 0.98 0.73 -0.57 1.13 1.63 -0.27 0.24 116.57 120.44 2dy3 h LYS 21 Ca 0.21 -0.11 -0.05 0.00 -0.85 0.00 0.00 60.65 59.86 2dy3 h LYS 21 Cb 0.31 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.78 2dy3 h LYS 21 CO -0.00 0.61 0.16 1.96 -3.45 0.00 0.00 179.45 178.72 2dy3 h GLN 22 N 0.68 0.90 0.00 1.90 4.20 -0.72 -2.74 115.11 119.33 2dy3 h GLN 22 Ca 0.18 -0.21 -0.07 0.00 0.06 0.00 0.00 58.65 58.61 2dy3 h GLN 22 Cb 0.11 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2dy3 h GLN 22 CO -0.02 0.83 -0.35 0.52 -0.67 0.00 0.00 178.83 179.13 2dy3 h MET 23 N 0.81 0.00 0.00 1.46 2.86 -0.69 -2.98 114.93 116.39 2dy3 h MET 23 Ca 0.18 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 2dy3 h MET 23 Cb 0.32 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 2dy3 h MET 23 CO -0.00 0.35 -0.12 0.00 1.06 0.00 0.00 176.91 178.20 2dy3 h ALA 24 N 1.65 1.13 -0.96 6.32 0.00 -0.22 -3.48 119.26 123.69 2dy3 h ALA 24 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2dy3 h ALA 24 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2dy3 h ALA 24 CO 0.05 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2dy3 n GLY 25 N -0.33 3.71 0.17 0.00 0.00 -1.13 -1.79 105.19 105.82 2dy3 n GLY 25 Ca -0.01 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.08 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 -7.05 1.61 0.13 -1.92 -3.46 132.00 121.30 2dy3 h PRO 26 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 2dy3 h PRO 26 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 2dy3 h PRO 26 CO 0.00 0.00 0.48 0.00 -0.23 0.00 0.00 178.00 178.25 2dy3 s ALA 27 N -3.17 2.78 0.45 -0.56 0.00 -0.74 -4.99 121.76 115.53 2dy3 s ALA 27 Ca 0.08 0.95 -0.22 0.00 0.00 0.00 0.00 51.96 52.77 2dy3 s ALA 27 Cb 0.08 -3.41 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 2dy3 s ALA 27 CO 0.64 -0.87 1.08 0.15 0.00 0.00 0.00 175.76 176.76 2dy3 s LYS 28 N -3.04 3.88 -0.33 0.00 1.02 0.06 -4.87 119.74 116.46 2dy3 s LYS 28 Ca 0.70 1.53 -0.07 0.00 0.02 0.00 0.00 55.97 58.15 2dy3 s LYS 28 Cb -0.29 -2.32 0.03 0.00 -0.52 0.00 0.00 37.83 34.74 2dy3 s LYS 28 CO 0.33 -0.39 0.11 -1.17 -0.92 0.00 0.00 175.35 173.31 2dy3 s LEU 29 N -3.10 4.21 -0.32 3.17 1.98 -1.26 -1.33 118.68 122.03 2dy3 s LEU 29 Ca 0.63 -0.99 -0.11 0.00 -2.89 0.00 0.00 54.13 50.77 2dy3 s LEU 29 Cb -0.22 -1.89 -0.01 0.00 0.66 0.00 0.00 46.19 44.73 2dy3 s LEU 29 CO 0.26 -0.29 0.20 -0.32 -1.89 0.00 0.00 176.35 174.31 2dy3 s MET 30 N 1.45 3.44 -0.09 1.98 -2.45 0.60 -0.85 119.30 123.37 2dy3 s MET 30 Ca 0.00 -0.67 -0.21 0.00 -1.25 0.00 0.00 55.69 53.56 2dy3 s MET 30 Cb -0.19 -3.69 -0.04 0.00 1.25 0.00 0.00 34.83 32.16 2dy3 s MET 30 CO 0.03 -0.42 0.59 0.00 1.05 0.00 0.00 175.02 176.26 2dy3 s ALA 31 N 1.67 3.41 -0.31 4.11 0.00 -0.65 -2.88 121.76 127.11 2dy3 s ALA 31 Ca 0.05 -0.03 -0.18 0.00 0.00 0.00 0.00 51.96 51.80 2dy3 s ALA 31 Cb -0.17 -2.80 -0.01 0.00 0.00 0.00 0.00 23.12 20.14 2dy3 s ALA 31 CO 0.09 -0.05 0.52 0.08 0.00 0.00 0.00 175.76 176.40 2dy3 s VAL 32 N 0.70 5.03 -0.15 0.00 1.01 -0.70 -0.34 120.40 125.95 2dy3 s VAL 32 Ca 0.32 0.61 0.15 0.00 0.00 0.00 0.00 61.98 63.05 2dy3 s VAL 32 Cb -0.16 -3.91 0.40 0.00 0.00 0.00 0.00 36.38 32.71 2dy3 s VAL 32 CO 0.14 -0.08 1.20 1.33 0.00 0.00 0.00 175.10 177.69 2dy3 n VAL 33 N 5.32 1.66 -0.87 2.92 0.24 -0.32 -4.59 118.33 122.70 2dy3 n VAL 33 Ca -0.04 -2.61 -0.29 0.00 -2.04 0.00 0.00 64.34 59.36 2dy3 n VAL 33 Cb 0.49 0.04 0.21 0.00 -1.47 0.00 0.00 33.84 33.11 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 -2.45 -0.17 -1.34 7.34 -2.85 -1.24 -1.00 119.74 118.03 2dy3 s LYS 34 Ca 0.36 0.70 -0.06 0.00 -1.00 0.00 0.00 55.97 55.97 2dy3 s LYS 34 Cb 0.36 -1.65 0.02 0.00 -2.06 0.00 0.00 37.83 34.50 2dy3 s LYS 34 CO -0.08 -3.18 0.98 0.00 0.10 0.00 0.00 175.35 173.17 2dy3 n ALA 35 N -4.52 -1.66 -3.65 0.59 0.00 -1.26 -1.27 120.51 108.75 2dy3 n ALA 35 Ca 0.04 0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.37 2dy3 n ALA 35 Cb 0.56 -3.65 0.05 0.00 0.00 0.00 0.00 19.45 16.41 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 -3.02 -2.54 -3.47 0.00 2.85 -1.25 -0.33 115.26 107.50 2dy3 n ASN 36 Ca -0.13 -0.73 -0.19 0.00 -0.11 0.00 0.00 54.58 53.42 2dy3 n ASN 36 Cb 0.61 -4.43 0.06 0.00 1.24 0.00 0.00 39.78 37.26 2dy3 n ASN 36 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2dy3 n ALA 37 N -4.38 -2.21 -3.86 5.20 0.00 -0.17 -0.86 120.51 114.22 2dy3 n ALA 37 Ca -0.21 -0.05 -0.28 0.00 0.00 0.00 0.00 53.44 52.90 2dy3 n ALA 37 Cb 0.64 -3.45 0.03 0.00 0.00 0.00 0.00 19.45 16.67 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 -3.91 -2.28 -0.99 0.00 4.02 -0.40 -0.79 117.16 112.81 2dy3 n TYR 38 Ca -0.21 0.90 0.00 0.00 -0.01 0.00 0.00 57.90 58.58 2dy3 n TYR 38 Cb 0.65 -4.11 0.00 0.00 -0.02 0.00 0.00 39.34 35.86 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 -4.19 0.02 7.72 4.05 0.55 -4.45 115.26 116.08 2dy3 n ASN 39 Ca -0.01 0.00 0.12 0.00 0.45 0.00 0.00 54.58 55.14 2dy3 n ASN 39 Cb 0.55 -1.87 0.28 0.00 1.23 0.00 0.00 39.78 39.96 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 -2.50 0.19 -0.26 1.20 8.25 0.03 -4.99 115.22 117.14 2dy3 n HIS 40 Ca 0.00 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 2dy3 n HIS 40 Cb 0.22 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.91 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 1.45 0.03 0.36 -1.41 0.00 -0.04 -4.78 105.19 100.79 2dy3 n GLY 41 Ca 0.05 -0.60 0.15 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.56 1.61 3.04 -1.84 -0.50 116.25 118.84 2dy3 h VAL 42 Ca 0.00 -0.07 0.07 0.00 -1.01 0.00 0.00 66.70 65.69 2dy3 h VAL 42 Cb 0.00 0.61 -0.03 0.00 -2.01 0.00 0.00 31.29 29.85 2dy3 h VAL 42 CO 0.00 0.04 0.37 -0.33 -1.01 0.00 0.00 177.57 176.64 2dy3 h GLU 43 N 0.21 0.46 0.00 4.17 5.08 -1.93 -0.61 114.58 121.96 2dy3 h GLU 43 Ca 0.25 -0.03 -0.34 0.00 -1.00 0.00 0.00 59.36 58.24 2dy3 h GLU 43 Cb 0.70 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 2dy3 h GLU 43 CO -0.04 0.30 -2.27 1.63 -1.00 0.00 0.00 179.01 177.63 2dy3 n LYS 44 N -4.47 0.86 -0.01 2.33 4.76 -0.88 -4.57 118.16 116.17 2dy3 n LYS 44 Ca 0.08 0.05 -0.13 0.00 -2.87 0.00 0.00 58.31 55.44 2dy3 n LYS 44 Cb 0.28 -1.46 -0.10 0.00 -1.84 0.00 0.00 35.03 31.91 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 1.34 -0.17 -0.18 2.07 -0.93 -3.28 116.25 115.09 2dy3 h VAL 45 Ca -0.50 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.05 2dy3 h VAL 45 Cb 1.98 2.03 -0.06 0.00 -1.52 0.00 0.00 31.29 33.71 2dy3 h VAL 45 CO -0.02 0.26 -0.27 0.00 0.02 0.00 0.00 177.57 177.56 2dy3 h ALA 46 N 0.54 -0.25 -1.00 1.67 0.00 -1.35 -1.90 119.26 116.98 2dy3 h ALA 46 Ca -0.00 0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.16 2dy3 h ALA 46 Cb 0.44 0.54 -0.11 0.00 0.00 0.00 0.00 17.79 18.66 2dy3 h ALA 46 CO 0.00 -0.73 0.61 -1.35 0.00 0.00 0.00 179.25 177.79 2dy3 h PRO 47 N -0.32 0.65 -0.30 0.00 0.11 -1.77 0.16 132.00 130.54 2dy3 h PRO 47 Ca 0.11 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.11 2dy3 h PRO 47 Cb 0.49 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2dy3 h PRO 47 CO -0.36 0.43 -0.10 0.28 -0.21 0.00 0.00 178.00 178.05 2dy3 h VAL 48 N 0.67 1.29 -0.66 3.15 2.07 -1.43 -0.55 116.25 120.79 2dy3 h VAL 48 Ca 0.58 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2dy3 h VAL 48 Cb 1.03 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 2dy3 h VAL 48 CO -0.37 0.37 0.38 0.40 0.02 0.00 0.00 177.57 178.37 2dy3 h ILE 49 N 0.35 1.20 -0.71 4.57 2.04 -0.39 -1.87 117.51 122.71 2dy3 h ILE 49 Ca 0.07 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 2dy3 h ILE 49 Cb 0.60 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 2dy3 h ILE 49 CO 0.03 0.22 0.19 0.00 0.00 0.00 0.00 178.15 178.59 2dy3 h ALA 50 N 1.19 1.00 0.00 1.87 0.00 -0.58 -2.60 119.26 120.14 2dy3 h ALA 50 Ca 0.24 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2dy3 h ALA 50 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2dy3 h ALA 50 CO -0.04 0.66 -0.22 0.00 0.00 0.00 0.00 179.25 179.64 2dy3 h ALA 51 N 1.14 1.37 -0.75 0.00 0.00 -0.61 -3.08 119.26 117.34 2dy3 h ALA 51 Ca 0.22 -0.20 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 2dy3 h ALA 51 Cb 0.34 -0.04 -0.19 0.00 0.00 0.00 0.00 17.79 17.91 2dy3 h ALA 51 CO -0.00 0.28 0.35 0.72 0.00 0.00 0.00 179.25 180.59 2dy3 n HIS 52 N -3.89 2.38 0.00 0.00 8.25 -0.75 -4.95 115.22 116.26 2dy3 n HIS 52 Ca -0.02 -1.51 0.00 0.00 -0.26 0.00 0.00 57.72 55.94 2dy3 n HIS 52 Cb 0.31 -0.74 0.00 0.00 1.12 0.00 0.00 29.99 30.68 2dy3 n HIS 52 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dy3 n GLY 53 N -0.73 1.95 3.64 -1.41 0.00 -1.16 -4.43 105.19 103.05 2dy3 n GLY 53 Ca 0.46 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.04 0.52 0.12 4.61 0.00 -1.10 -4.82 120.51 119.80 2dy3 n ALA 54 Ca 0.00 0.46 0.09 0.00 0.00 0.00 0.00 53.44 53.99 2dy3 n ALA 54 Cb 0.00 -2.24 0.03 0.00 0.00 0.00 0.00 19.45 17.23 2dy3 n ALA 54 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2dy3 h ASP 55 N 5.18 0.00 -5.09 0.00 3.32 -1.36 -3.45 116.42 115.02 2dy3 h ASP 55 Ca -0.46 0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.64 2dy3 h ASP 55 Cb 1.29 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.81 2dy3 h ASP 55 CO 0.83 0.14 0.33 0.00 -1.72 0.00 0.00 179.24 178.82 2dy3 s ALA 56 N -3.22 -1.05 0.01 3.45 0.00 -1.00 -3.69 121.76 116.26 2dy3 s ALA 56 Ca 0.01 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.48 2dy3 s ALA 56 Cb 0.08 0.72 -0.01 0.00 0.00 0.00 0.00 23.12 23.91 2dy3 s ALA 56 CO 0.76 -1.02 -0.08 -0.06 0.00 0.00 0.00 175.76 175.37 2dy3 s PHE 57 N -2.72 0.71 -0.10 0.00 0.08 0.11 -1.64 117.98 114.42 2dy3 s PHE 57 Ca 0.15 -0.24 0.03 0.00 0.12 0.00 0.00 56.93 57.00 2dy3 s PHE 57 Cb -0.05 -0.44 -0.00 0.00 -0.57 0.00 0.00 43.02 41.96 2dy3 s PHE 57 CO 0.09 -0.02 -0.22 0.20 -0.10 0.00 0.00 175.22 175.17 2dy3 s GLY 58 N -0.62 1.36 0.25 4.36 0.00 0.54 -1.06 107.32 112.15 2dy3 s GLY 58 Ca -0.00 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 43.76 2dy3 s GLY 58 CO 0.00 -0.33 0.09 -1.34 0.00 0.00 0.00 173.10 171.52 2dy3 s VAL 59 N 0.30 0.51 -0.09 1.40 -7.23 0.23 -1.17 120.40 114.36 2dy3 s VAL 59 Ca -0.17 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 57.98 2dy3 s VAL 59 Cb -0.17 -2.59 -0.01 0.00 0.56 0.00 0.00 36.38 34.17 2dy3 s VAL 59 CO 0.08 -0.03 -0.05 0.00 -0.31 0.00 0.00 175.10 174.78 2dy3 h ALA 60 N 2.43 0.00 -1.73 1.32 0.00 -1.94 -3.01 119.26 116.33 2dy3 h ALA 60 Ca -0.38 -0.18 -0.43 0.00 0.00 0.00 0.00 54.91 53.92 2dy3 h ALA 60 Cb 1.24 0.16 0.03 0.00 0.00 0.00 0.00 17.79 19.22 2dy3 h ALA 60 CO 0.60 0.16 -0.14 0.95 0.00 0.00 0.00 179.25 180.82 2dy3 s THR 61 N -1.64 3.02 0.07 0.00 -4.23 -1.26 0.22 115.64 111.82 2dy3 s THR 61 Ca -0.05 -0.78 -0.23 0.00 -1.18 0.00 0.00 61.69 59.45 2dy3 s THR 61 Cb 0.01 -3.08 -0.15 0.00 1.34 0.00 0.00 72.50 70.61 2dy3 s THR 61 CO 0.07 -0.05 1.67 -0.07 -0.54 0.00 0.00 174.62 175.70 2dy3 h LEU 62 N 0.36 0.01 -0.92 4.79 4.07 -1.96 -1.71 115.31 119.95 2dy3 h LEU 62 Ca -0.42 -0.08 0.03 0.00 0.08 0.00 0.00 57.88 57.49 2dy3 h LEU 62 Cb 1.28 -0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.97 2dy3 h LEU 62 CO 0.50 0.08 0.60 0.00 -1.08 0.00 0.00 178.44 178.54 2dy3 h ALA 63 N 0.93 1.20 -0.43 1.53 0.00 -1.95 0.01 119.26 120.55 2dy3 h ALA 63 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2dy3 h ALA 63 Cb 0.07 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2dy3 h ALA 63 CO -0.00 0.48 -0.03 0.93 0.00 0.00 0.00 179.25 180.62 2dy3 h GLU 64 N 1.17 0.71 -0.53 0.00 5.08 -1.92 -1.01 114.58 118.08 2dy3 h GLU 64 Ca 0.36 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2dy3 h GLU 64 Cb -0.02 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 2dy3 h GLU 64 CO -0.11 0.75 -0.06 0.00 -1.00 0.00 0.00 179.01 178.59 2dy3 h ALA 65 N 1.30 0.73 -0.52 3.43 0.00 -0.29 -2.74 119.26 121.16 2dy3 h ALA 65 Ca 0.13 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2dy3 h ALA 65 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2dy3 h ALA 65 CO 0.02 0.60 0.09 0.52 0.00 0.00 0.00 179.25 180.48 2dy3 h MET 66 N 0.85 0.86 -0.84 0.00 2.86 -0.75 -2.82 114.93 115.10 2dy3 h MET 66 Ca 0.14 -0.23 0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2dy3 h MET 66 Cb 0.61 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 32.12 2dy3 h MET 66 CO 0.04 0.84 0.55 0.37 1.06 0.00 0.00 176.91 179.77 2dy3 h GLN 67 N 0.74 1.01 -0.82 1.72 4.15 -1.10 0.26 115.11 121.07 2dy3 h GLN 67 Ca 0.16 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 2dy3 h GLN 67 Cb 0.39 -0.23 -0.04 0.00 0.21 0.00 0.00 27.48 27.82 2dy3 h GLN 67 CO 0.01 0.67 0.37 -0.07 -1.93 0.00 0.00 178.83 177.88 2dy3 h LEU 68 N 1.04 1.09 -0.78 -2.39 3.38 -1.24 -1.42 115.31 114.98 2dy3 h LEU 68 Ca 0.33 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 2dy3 h LEU 68 Cb 0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2dy3 h LEU 68 CO -0.10 0.93 -0.51 0.03 0.09 0.00 0.00 178.44 178.88 2dy3 h ARG 69 N 1.17 0.25 0.00 1.13 2.47 -1.03 -2.20 114.38 116.18 2dy3 h ARG 69 Ca 0.28 -0.15 -0.06 0.00 -1.26 0.00 0.00 59.98 58.79 2dy3 h ARG 69 Cb 0.15 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.47 2dy3 h ARG 69 CO -0.03 0.71 -0.28 -0.44 0.56 0.00 0.00 179.97 180.49 2dy3 h ASP 70 N 0.20 0.00 0.10 7.04 3.32 0.33 -2.76 116.42 124.64 2dy3 h ASP 70 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2dy3 h ASP 70 Cb 0.97 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.52 2dy3 h ASP 70 CO 0.08 0.28 -0.16 2.30 -1.72 0.00 0.00 179.24 180.02 2dy3 n ILE 71 N -3.77 0.00 0.00 0.35 -5.35 -0.62 -4.95 119.36 105.02 2dy3 n ILE 71 Ca -0.01 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 2dy3 n ILE 71 Cb 0.38 0.60 0.00 0.00 -1.74 0.00 0.00 39.64 38.87 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 1.29 1.39 3.66 3.28 0.00 -1.04 -5.03 105.19 108.74 2dy3 n GLY 72 Ca 0.15 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.68 2dy3 n GLY 72 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dy3 n ILE 73 N -0.75 0.21 0.48 -0.61 2.08 -0.84 -4.84 119.36 115.10 2dy3 n ILE 73 Ca 0.00 -0.04 0.05 0.00 0.56 0.00 0.00 62.75 63.32 2dy3 n ILE 73 Cb 0.00 -1.50 -0.06 0.00 -0.75 0.00 0.00 39.64 37.34 2dy3 n ILE 73 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 2dy3 n SER 74 N 4.49 0.51 -4.61 4.38 3.41 -1.26 -4.48 113.62 116.05 2dy3 n SER 74 Ca 0.20 -0.76 -0.29 0.00 -0.26 0.00 0.00 58.87 57.76 2dy3 n SER 74 Cb 0.26 0.98 0.19 0.00 -0.26 0.00 0.00 64.21 65.38 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 -1.94 0.29 0.33 4.33 1.11 -1.26 -4.94 119.66 117.59 2dy3 s GLN 75 Ca 0.04 1.03 -0.29 0.00 0.01 0.00 0.00 55.36 56.15 2dy3 s GLN 75 Cb 0.08 -1.68 -0.12 0.00 -1.01 0.00 0.00 33.01 30.28 2dy3 s GLN 75 CO 0.41 -2.96 1.41 -1.91 0.01 0.00 0.00 175.29 172.25 2dy3 n GLU 76 N -4.41 2.36 -4.30 2.91 2.13 -1.24 -4.83 120.64 113.26 2dy3 n GLU 76 Ca 0.07 0.83 -0.19 0.00 0.66 0.00 0.00 57.16 58.52 2dy3 n GLU 76 Cb 0.54 -2.49 -0.15 0.00 0.27 0.00 0.00 31.44 29.60 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 -0.82 0.66 -0.02 6.31 1.01 -1.26 -0.71 120.40 125.56 2dy3 s VAL 77 Ca 0.58 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2dy3 s VAL 77 Cb -0.54 -0.60 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 2dy3 s VAL 77 CO 0.59 0.22 -0.15 -0.22 0.00 0.00 0.00 175.10 175.54 2dy3 s LEU 78 N 0.29 1.95 0.00 3.92 2.96 -0.22 0.53 118.68 128.11 2dy3 s LEU 78 Ca -0.04 -0.29 0.05 0.00 -0.22 0.00 0.00 54.13 53.62 2dy3 s LEU 78 Cb -0.09 -0.83 -0.01 0.00 0.50 0.00 0.00 46.19 45.76 2dy3 s LEU 78 CO 0.00 0.16 -0.14 0.00 -1.32 0.00 0.00 176.35 175.05 2dy3 n TRP 80 N 2.51 0.01 -3.96 0.00 2.14 -0.91 -2.38 117.44 114.84 2dy3 n TRP 80 Ca -0.15 -0.12 -0.31 0.00 2.07 0.00 0.00 57.50 59.00 2dy3 n TRP 80 Cb 0.55 -0.01 -0.15 0.00 -0.81 0.00 0.00 31.31 30.89 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 -0.28 2.01 0.22 -1.67 1.01 0.13 -4.87 121.20 117.75 2dy3 s ILE 81 Ca 0.01 -2.18 -0.19 0.00 0.00 0.00 0.00 60.65 58.29 2dy3 s ILE 81 Cb 0.01 -2.49 0.03 0.00 0.01 0.00 0.00 42.46 40.01 2dy3 s ILE 81 CO 0.01 -0.62 0.59 -1.66 0.00 0.00 0.00 174.94 173.26 2dy3 s TRP 82 N 1.02 -0.14 0.06 3.97 1.48 -1.26 -4.11 118.94 119.96 2dy3 s TRP 82 Ca 0.11 -0.23 0.03 0.00 -1.06 0.00 0.00 56.10 54.95 2dy3 s TRP 82 Cb -0.19 0.49 -0.03 0.00 -1.16 0.00 0.00 33.47 32.58 2dy3 s TRP 82 CO -0.11 -1.02 -0.09 0.95 -4.06 0.00 0.00 176.95 172.61 2dy3 s THR 83 N -3.89 0.73 0.65 0.66 -4.23 -1.26 -5.03 115.64 103.27 2dy3 s THR 83 Ca 0.10 -1.32 0.32 0.00 -1.18 0.00 0.00 61.69 59.61 2dy3 s THR 83 Cb -0.03 -0.94 0.34 0.00 1.34 0.00 0.00 72.50 73.20 2dy3 s THR 83 CO 0.00 -0.44 1.99 -0.65 -0.54 0.00 0.00 174.62 174.98 2dy3 h PRO 84 N 4.12 0.00 0.00 3.99 0.11 -1.96 0.42 132.00 138.68 2dy3 h PRO 84 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2dy3 h PRO 84 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2dy3 h PRO 84 CO 0.45 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.63 2dy3 n GLU 85 N -3.12 0.12 -2.62 1.05 4.71 -1.26 -4.80 120.64 114.72 2dy3 n GLU 85 Ca -0.00 0.12 -0.23 0.00 -0.01 0.00 0.00 57.16 57.04 2dy3 n GLU 85 Cb 0.37 -1.65 0.03 0.00 -1.01 0.00 0.00 31.44 29.19 2dy3 n GLU 85 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2dy3 s GLN 86 N -3.06 2.66 -1.41 3.49 -0.21 0.14 -4.97 119.66 116.30 2dy3 s GLN 86 Ca 0.12 -0.52 -0.11 0.00 0.02 0.00 0.00 55.36 54.86 2dy3 s GLN 86 Cb 0.15 -2.42 0.07 0.00 1.00 0.00 0.00 33.01 31.81 2dy3 s GLN 86 CO 0.54 -0.69 2.21 -3.47 -2.12 0.00 0.00 175.29 171.76 2dy3 n ASP 87 N -2.40 5.20 0.27 5.90 4.64 -1.26 -4.66 116.55 124.24 2dy3 n ASP 87 Ca 0.06 -2.93 0.17 0.00 -1.38 0.00 0.00 54.79 50.71 2dy3 n ASP 87 Cb 0.59 -1.56 0.65 0.00 -1.04 0.00 0.00 41.12 39.75 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 5.68 0.00 -0.41 -0.67 -5.15 -1.89 -2.89 116.94 111.61 2dy3 h PHE 88 Ca 0.56 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 58.28 2dy3 h PHE 88 Cb 0.57 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.72 2dy3 h PHE 88 CO 1.45 0.01 0.04 0.00 -2.00 0.00 0.00 178.31 177.81 2dy3 h ARG 89 N 0.00 0.63 -0.40 6.09 3.08 -1.98 -0.90 114.38 120.89 2dy3 h ARG 89 Ca -0.00 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 2dy3 h ARG 89 Cb 0.55 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 2dy3 h ARG 89 CO 0.00 0.62 0.09 0.00 -1.07 0.00 0.00 179.97 179.61 2dy3 h ALA 90 N 1.45 1.41 -0.21 0.04 0.00 -1.91 -0.79 119.26 119.25 2dy3 h ALA 90 Ca 0.13 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2dy3 h ALA 90 Cb 0.32 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2dy3 h ALA 90 CO 0.01 0.43 -0.08 0.00 0.00 0.00 0.00 179.25 179.61 2dy3 h ALA 91 N 1.52 0.29 -0.53 0.00 0.00 -1.33 -2.83 119.26 116.38 2dy3 h ALA 91 Ca 0.13 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.84 2dy3 h ALA 91 Cb 0.23 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 2dy3 h ALA 91 CO -0.00 0.10 0.19 0.82 0.00 0.00 0.00 179.25 180.36 2dy3 h ILE 92 N 0.13 0.82 0.00 0.00 2.04 -0.62 0.89 117.51 120.77 2dy3 h ILE 92 Ca 0.05 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2dy3 h ILE 92 Cb 0.55 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2dy3 h ILE 92 CO 0.03 0.07 0.00 0.47 0.00 0.00 0.00 178.15 178.71 2dy3 n ASP 93 N -5.00 0.00 -1.01 1.72 8.00 -0.36 -0.89 116.55 119.02 2dy3 n ASP 93 Ca 0.06 -0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.63 2dy3 n ASP 93 Cb 0.22 -0.24 0.25 0.00 -0.02 0.00 0.00 41.12 41.33 2dy3 n ASP 93 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2dy3 n ARG 94 N -1.24 3.16 -3.64 -1.24 3.00 0.28 -4.97 116.66 112.01 2dy3 n ARG 94 Ca 0.07 -2.57 -0.23 0.00 -0.00 0.00 0.00 57.85 55.12 2dy3 n ARG 94 Cb 0.10 -1.65 0.04 0.00 0.00 0.00 0.00 32.46 30.95 2dy3 n ARG 94 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2dy3 n ASN 95 N 0.35 -2.86 -4.22 6.15 5.15 -0.07 -4.99 115.26 114.76 2dy3 n ASN 95 Ca 0.19 -0.86 -0.33 0.00 -0.60 0.00 0.00 54.58 52.98 2dy3 n ASN 95 Cb 0.72 -4.01 -0.16 0.00 -0.53 0.00 0.00 39.78 35.81 2dy3 n ASN 95 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 2dy3 s ILE 96 N -3.60 2.49 0.37 -1.44 -1.16 -1.05 -4.55 121.20 112.27 2dy3 s ILE 96 Ca 0.18 -0.82 -0.27 0.00 -0.51 0.00 0.00 60.65 59.22 2dy3 s ILE 96 Cb -0.05 -2.05 -0.10 0.00 0.61 0.00 0.00 42.46 40.88 2dy3 s ILE 96 CO 0.82 0.52 1.33 -1.81 -2.81 0.00 0.00 174.94 172.98 2dy3 s ASP 97 N 0.93 6.51 -0.06 4.50 -0.00 0.19 -4.39 116.67 124.35 2dy3 s ASP 97 Ca -0.03 2.72 0.04 0.00 -0.00 0.00 0.00 52.55 55.27 2dy3 s ASP 97 Cb -0.15 -2.65 -0.02 0.00 -0.00 0.00 0.00 42.92 40.10 2dy3 s ASP 97 CO -0.03 -0.72 -0.17 -0.76 -0.00 0.00 0.00 175.17 173.50 2dy3 s LEU 98 N -2.12 2.56 0.11 1.23 1.43 -1.00 -2.46 118.68 118.43 2dy3 s LEU 98 Ca 0.53 -0.30 -0.24 0.00 -1.03 0.00 0.00 54.13 53.09 2dy3 s LEU 98 Cb -0.40 -1.52 -0.07 0.00 0.03 0.00 0.00 46.19 44.24 2dy3 s LEU 98 CO 0.52 0.29 0.73 0.00 0.23 0.00 0.00 176.35 178.13 2dy3 s ALA 99 N -0.41 3.45 -0.48 4.21 0.00 -1.00 -1.46 121.76 126.07 2dy3 s ALA 99 Ca 0.04 0.27 -0.21 0.00 0.00 0.00 0.00 51.96 52.07 2dy3 s ALA 99 Cb -0.12 -2.91 0.04 0.00 0.00 0.00 0.00 23.12 20.13 2dy3 s ALA 99 CO 0.02 0.24 0.69 0.08 0.00 0.00 0.00 175.76 176.79 2dy3 s VAL 100 N -0.78 4.77 -1.91 0.00 1.01 -0.30 -4.89 120.40 118.29 2dy3 s VAL 100 Ca 0.35 -0.05 0.17 0.00 0.00 0.00 0.00 61.98 62.45 2dy3 s VAL 100 Cb -0.22 -4.29 0.24 0.00 0.00 0.00 0.00 36.38 32.11 2dy3 s VAL 100 CO 0.24 -0.75 1.16 2.30 0.00 0.00 0.00 175.10 178.04 2dy3 n ILE 101 N 5.84 0.32 -3.58 2.22 -5.35 -1.26 -1.45 119.36 116.10 2dy3 n ILE 101 Ca -0.03 -0.66 -0.06 0.00 -0.27 0.00 0.00 62.75 61.73 2dy3 n ILE 101 Cb 0.47 1.08 -0.03 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 -1.29 -0.20 0.46 7.28 1.04 -1.26 -1.76 113.70 117.97 2dy3 s SER 102 Ca 0.25 0.07 0.18 0.00 0.48 0.00 0.00 55.95 56.93 2dy3 s SER 102 Cb 0.16 0.20 1.15 0.00 0.10 0.00 0.00 66.02 67.62 2dy3 s SER 102 CO 0.22 -0.29 1.98 1.55 0.98 0.00 0.00 173.24 177.68 2dy3 h PRO 103 N 2.10 0.27 -0.42 4.02 0.13 -1.94 0.19 132.00 136.34 2dy3 h PRO 103 Ca -0.13 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.94 2dy3 h PRO 103 Cb 1.18 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 2dy3 h PRO 103 CO 0.25 0.18 0.08 0.00 -0.23 0.00 0.00 178.00 178.28 2dy3 h ALA 104 N 1.71 1.35 -0.34 -0.56 0.00 -1.98 0.28 119.26 119.72 2dy3 h ALA 104 Ca 0.28 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 2dy3 h ALA 104 Cb 0.72 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2dy3 h ALA 104 CO -0.06 0.46 -0.35 0.45 0.00 0.00 0.00 179.25 179.75 2dy3 h HIS 105 N 0.62 1.00 -0.49 0.00 3.86 -1.38 -1.19 115.15 117.57 2dy3 h HIS 105 Ca 0.14 -0.30 -0.01 0.00 -1.16 0.00 0.00 60.37 59.03 2dy3 h HIS 105 Cb 0.27 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 2dy3 h HIS 105 CO 0.01 1.10 0.26 0.00 0.86 0.00 0.00 177.93 180.16 2dy3 h ALA 106 N 0.74 0.63 -0.67 2.45 0.00 -0.64 -0.96 119.26 120.80 2dy3 h ALA 106 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2dy3 h ALA 106 Cb 0.94 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2dy3 h ALA 106 CO 0.09 0.16 0.39 -0.22 0.00 0.00 0.00 179.25 179.67 2dy3 h LYS 107 N 0.65 0.92 -0.61 0.00 3.64 -0.35 -0.47 116.57 120.34 2dy3 h LYS 107 Ca 0.17 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 2dy3 h LYS 107 Cb 0.07 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 2dy3 h LYS 107 CO -0.03 0.67 0.31 0.00 -2.27 0.00 0.00 179.45 178.13 2dy3 h ALA 108 N 1.20 0.79 -0.30 5.00 0.00 -0.78 -1.60 119.26 123.57 2dy3 h ALA 108 Ca 0.24 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2dy3 h ALA 108 Cb -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2dy3 h ALA 108 CO -0.04 0.33 -0.12 -0.07 0.00 0.00 0.00 179.25 179.35 2dy3 h LEU 109 N 0.84 0.63 -1.30 0.00 3.38 -0.94 -2.53 115.31 115.38 2dy3 h LEU 109 Ca 0.21 -0.39 0.06 0.00 0.09 0.00 0.00 57.88 57.85 2dy3 h LEU 109 Cb 0.09 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 2dy3 h LEU 109 CO -0.03 0.88 0.51 0.40 0.09 0.00 0.00 178.44 180.29 2dy3 h ILE 110 N 0.37 1.06 -0.21 1.22 2.04 -0.89 -0.77 117.51 120.34 2dy3 h ILE 110 Ca 0.07 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2dy3 h ILE 110 Cb 0.63 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2dy3 h ILE 110 CO 0.04 0.16 0.00 -0.62 0.00 0.00 0.00 178.15 177.73 2dy3 n GLU 111 N -4.47 1.65 -3.20 2.37 1.02 -0.62 -4.86 120.64 112.52 2dy3 n GLU 111 Ca 0.11 -0.99 -0.39 0.00 -0.02 0.00 0.00 57.16 55.87 2dy3 n GLU 111 Cb 0.19 -1.31 -0.05 0.00 -0.02 0.00 0.00 31.44 30.24 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 -1.72 5.13 -0.13 2.62 2.01 -0.30 -4.97 115.64 118.28 2dy3 s THR 112 Ca 0.27 1.15 -0.04 0.00 0.31 0.00 0.00 61.69 63.38 2dy3 s THR 112 Cb 0.14 -3.91 -0.15 0.00 0.01 0.00 0.00 72.50 68.59 2dy3 s THR 112 CO 0.20 0.29 2.36 0.47 -0.69 0.00 0.00 174.62 177.25 2dy3 n ASP 113 N 3.74 3.44 -4.59 3.53 10.43 -1.26 -4.85 116.55 126.98 2dy3 n ASP 113 Ca -0.05 -2.12 -0.34 0.00 2.57 0.00 0.00 54.79 54.85 2dy3 n ASP 113 Cb 0.51 -0.89 -0.11 0.00 1.84 0.00 0.00 41.12 42.47 2dy3 n ASP 113 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2dy3 s ALA 114 N 2.00 3.02 0.12 2.24 0.00 -1.26 -5.02 121.76 122.85 2dy3 s ALA 114 Ca 0.41 -0.88 -0.14 0.00 0.00 0.00 0.00 51.96 51.35 2dy3 s ALA 114 Cb 0.18 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 2dy3 s ALA 114 CO -0.00 0.56 1.54 0.93 0.00 0.00 0.00 175.76 178.78 2dy3 h GLU 115 N 5.30 0.73 -2.87 0.00 5.08 -1.89 -3.43 114.58 117.51 2dy3 h GLU 115 Ca -0.48 -0.27 -0.44 0.00 -1.00 0.00 0.00 59.36 57.17 2dy3 h GLU 115 Cb 1.18 -0.05 -0.40 0.00 0.50 0.00 0.00 28.75 29.98 2dy3 h GLU 115 CO 0.53 0.86 -0.72 -1.58 -1.00 0.00 0.00 179.01 177.10 2dy3 s HIS 116 N -4.84 0.09 -0.24 4.33 5.04 -1.24 -4.42 115.29 114.01 2dy3 s HIS 116 Ca -0.13 -0.28 -0.03 0.00 -1.54 0.00 0.00 55.06 53.09 2dy3 s HIS 116 Cb 0.10 -0.64 0.01 0.00 0.04 0.00 0.00 32.58 32.09 2dy3 s HIS 116 CO 0.81 -0.59 -0.04 0.42 -2.34 0.00 0.00 174.74 173.00 2dy3 s ILE 117 N 2.18 3.18 -0.14 0.89 1.01 0.32 -4.98 121.20 123.66 2dy3 s ILE 117 Ca 0.04 -0.77 -0.25 0.00 0.00 0.00 0.00 60.65 59.67 2dy3 s ILE 117 Cb -0.16 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 2dy3 s ILE 117 CO -0.14 0.29 0.83 -0.13 0.00 0.00 0.00 174.94 175.78 2dy3 s ARG 118 N 1.41 4.34 0.07 2.79 0.52 -1.26 -0.69 118.95 126.12 2dy3 s ARG 118 Ca 0.03 1.04 0.03 0.00 -0.52 0.00 0.00 55.73 56.30 2dy3 s ARG 118 Cb -0.16 -3.55 -0.03 0.00 0.52 0.00 0.00 34.95 31.73 2dy3 s ARG 118 CO -0.04 -0.26 -0.08 0.14 0.02 0.00 0.00 175.30 175.08 2dy3 s VAL 119 N 1.90 0.70 -0.13 3.52 -7.23 -0.87 -2.37 120.40 115.91 2dy3 s VAL 119 Ca 0.39 -1.46 0.01 0.00 -1.81 0.00 0.00 61.98 59.11 2dy3 s VAL 119 Cb -0.17 -1.10 0.02 0.00 0.56 0.00 0.00 36.38 35.69 2dy3 s VAL 119 CO 0.14 -0.56 -0.14 -0.44 -0.31 0.00 0.00 175.10 173.80 2dy3 s SER 120 N -2.20 2.53 -0.11 4.85 0.01 -0.53 -1.22 113.70 117.02 2dy3 s SER 120 Ca 0.00 -0.44 -0.30 0.00 1.31 0.00 0.00 55.95 56.52 2dy3 s SER 120 Cb -0.04 -1.10 -0.03 0.00 0.21 0.00 0.00 66.02 65.06 2dy3 s SER 120 CO -0.01 -0.04 1.31 -0.63 0.41 0.00 0.00 173.24 174.28 2dy3 s ILE 121 N 1.33 4.13 -0.40 1.44 1.01 -0.65 -1.15 121.20 126.91 2dy3 s ILE 121 Ca 0.01 1.40 -0.20 0.00 0.00 0.00 0.00 60.65 61.86 2dy3 s ILE 121 Cb -0.14 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.44 2dy3 s ILE 121 CO -0.07 -0.09 0.64 -0.75 0.00 0.00 0.00 174.94 174.67 2dy3 s LYS 122 N 3.20 3.47 -0.09 2.79 2.20 -0.53 -1.15 119.74 129.63 2dy3 s LYS 122 Ca 0.58 -0.17 -0.05 0.00 -0.36 0.00 0.00 55.97 55.97 2dy3 s LYS 122 Cb -0.25 -3.88 -0.04 0.00 -1.51 0.00 0.00 37.83 32.15 2dy3 s LYS 122 CO 0.19 -0.87 0.13 0.96 -0.36 0.00 0.00 175.35 175.39 2dy3 s ILE 123 N 2.76 5.31 -0.47 5.43 -5.25 -0.20 -0.65 121.20 128.13 2dy3 s ILE 123 Ca 0.23 0.06 -0.27 0.00 -0.99 0.00 0.00 60.65 59.68 2dy3 s ILE 123 Cb -0.14 -3.34 0.03 0.00 2.95 0.00 0.00 42.46 41.96 2dy3 s ILE 123 CO 0.17 0.56 1.03 -0.62 -1.79 0.00 0.00 174.94 174.28 2dy3 s ASP 124 N -1.20 6.56 -0.19 4.36 -1.08 0.45 -4.54 116.67 121.03 2dy3 s ASP 124 Ca 0.17 0.28 0.12 0.00 -0.52 0.00 0.00 52.55 52.60 2dy3 s ASP 124 Cb -0.12 -2.50 0.70 0.00 -1.46 0.00 0.00 42.92 39.54 2dy3 s ASP 124 CO 0.07 -1.15 1.57 -1.54 0.52 0.00 0.00 175.17 174.63 2dy3 n SER 125 N 7.50 4.97 0.00 -0.34 3.41 -1.26 -4.41 113.62 123.49 2dy3 n SER 125 Ca 0.09 -2.75 0.00 0.00 -0.26 0.00 0.00 58.87 55.95 2dy3 n SER 125 Cb 0.49 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 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 0.59 1.48 0.24 5.00 0.00 -1.26 -4.38 105.19 106.86 2dy3 n GLY 126 Ca 0.24 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.39 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 0.52 0.99 4.07 -1.94 -3.47 115.31 115.49 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 0.08 0.00 1.08 0.00 0.00 40.66 41.82 2dy3 h LEU 127 CO 0.00 0.10 -0.63 1.41 -1.08 0.00 0.00 178.44 178.24 2dy3 n HIS 128 N -3.19 -2.21 0.00 1.13 8.25 -1.26 -4.97 115.22 112.97 2dy3 n HIS 128 Ca 0.01 0.65 0.00 0.00 -0.26 0.00 0.00 57.72 58.12 2dy3 n HIS 128 Cb 0.41 -4.62 0.00 0.00 1.12 0.00 0.00 29.99 26.90 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 -4.29 0.00 -2.78 -0.41 1.74 -1.26 -5.10 116.66 104.56 2dy3 n ARG 129 Ca -0.08 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.79 2dy3 n ARG 129 Cb 0.60 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 32.10 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 -0.71 5.10 0.00 0.55 0.15 -1.26 -5.02 113.70 112.51 2dy3 s SER 130 Ca 0.00 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.31 2dy3 s SER 130 Cb 0.00 -0.41 0.00 0.00 -1.71 0.00 0.00 66.02 63.90 2dy3 s SER 130 CO 0.00 -1.27 0.00 0.61 1.20 0.00 0.00 173.24 173.78 2dy3 n GLY 131 N -2.34 1.31 3.69 9.45 0.00 -0.72 -4.38 105.19 112.19 2dy3 n GLY 131 Ca 0.11 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 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 -2.91 4.63 0.64 1.61 1.01 0.17 -4.35 120.40 121.21 2dy3 s VAL 132 Ca 0.00 1.92 -0.07 0.00 0.00 0.00 0.00 61.98 63.83 2dy3 s VAL 132 Cb 0.00 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 32.17 2dy3 s VAL 132 CO 0.00 -0.01 0.96 1.51 0.00 0.00 0.00 175.10 177.57 2dy3 s ASP 133 N 1.21 5.43 0.36 3.32 1.47 -1.26 -0.41 116.67 126.79 2dy3 s ASP 133 Ca 0.50 0.77 0.14 0.00 1.18 0.00 0.00 52.55 55.14 2dy3 s ASP 133 Cb -0.20 -1.66 1.00 0.00 -0.34 0.00 0.00 42.92 41.72 2dy3 s ASP 133 CO 0.19 -1.22 1.76 -0.08 0.68 0.00 0.00 175.17 176.50 2dy3 h GLU 134 N -0.36 0.48 0.00 2.11 4.81 -1.97 0.27 114.58 119.92 2dy3 h GLU 134 Ca -0.45 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.73 2dy3 h GLU 134 Cb 1.27 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2dy3 h GLU 134 CO 0.61 0.31 -0.10 -0.56 -0.73 0.00 0.00 179.01 178.55 2dy3 h GLN 135 N 0.49 0.00 0.00 1.92 3.07 -1.98 -2.90 115.11 115.71 2dy3 h GLN 135 Ca 0.61 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.35 2dy3 h GLN 135 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.91 2dy3 h GLN 135 CO -0.36 0.10 -1.27 0.39 0.09 0.00 0.00 178.83 177.78 2dy3 n GLU 136 N -3.38 0.20 0.02 0.06 1.02 0.03 -4.59 120.64 114.01 2dy3 n GLU 136 Ca -0.01 -0.06 -0.15 0.00 -0.02 0.00 0.00 57.16 56.93 2dy3 n GLU 136 Cb 0.28 -1.51 -0.09 0.00 -0.02 0.00 0.00 31.44 30.10 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 -1.46 -0.41 -0.32 6.55 -1.20 -0.68 115.95 118.43 2dy3 h TRP 137 Ca 0.00 0.05 0.08 0.00 0.95 0.00 0.00 58.89 59.97 2dy3 h TRP 137 Cb 0.66 0.65 -0.09 0.00 -0.86 0.00 0.00 29.16 29.51 2dy3 h TRP 137 CO 0.00 -0.54 -0.37 0.93 -1.05 0.00 0.00 178.44 177.42 2dy3 h GLU 138 N -0.60 -0.27 -0.53 0.49 4.39 -1.81 0.29 114.58 116.54 2dy3 h GLU 138 Ca 0.04 0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.77 2dy3 h GLU 138 Cb 0.69 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 2dy3 h GLU 138 CO -0.39 -0.18 0.33 0.78 -1.16 0.00 0.00 179.01 178.39 2dy3 h GLY 139 N -0.28 0.75 0.73 -3.84 0.00 -1.77 -1.53 103.07 97.12 2dy3 h GLY 139 Ca 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.21 2dy3 h GLY 139 CO -0.56 0.23 -0.05 -2.08 0.00 0.00 0.00 176.54 174.08 2dy3 h VAL 140 N 0.66 1.31 -0.84 4.60 2.07 -0.46 -2.14 116.25 121.45 2dy3 h VAL 140 Ca 0.21 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 2dy3 h VAL 140 Cb -0.02 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 2dy3 h VAL 140 CO -0.08 0.31 0.39 -0.26 0.02 0.00 0.00 177.57 177.95 2dy3 h PHE 141 N -0.08 1.23 0.07 1.57 0.04 -0.42 -1.41 116.94 117.94 2dy3 h PHE 141 Ca 0.03 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 2dy3 h PHE 141 Cb 0.50 -0.38 0.00 0.00 2.20 0.00 0.00 35.95 38.27 2dy3 h PHE 141 CO 0.06 0.90 -0.03 1.03 -0.60 0.00 0.00 178.31 179.67 2dy3 h SER 142 N 1.21 -0.08 -0.67 2.17 0.87 -1.25 -0.92 113.55 114.89 2dy3 h SER 142 Ca 0.29 -0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.75 2dy3 h SER 142 Cb 0.14 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 2dy3 h SER 142 CO -0.03 -0.01 0.20 0.00 -0.53 0.00 0.00 176.83 176.46 2dy3 h ALA 143 N 0.79 0.87 -0.56 6.23 0.00 -1.23 -2.71 119.26 122.64 2dy3 h ALA 143 Ca -0.01 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 2dy3 h ALA 143 Cb 0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2dy3 h ALA 143 CO 0.02 0.56 0.07 -0.07 0.00 0.00 0.00 179.25 179.82 2dy3 h LEU 144 N 0.98 0.91 -1.80 0.00 3.38 -1.16 -2.76 115.31 114.85 2dy3 h LEU 144 Ca 0.21 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2dy3 h LEU 144 Cb 0.31 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2dy3 h LEU 144 CO -0.00 0.96 -0.14 0.00 0.09 0.00 0.00 178.44 179.34 2dy3 h ALA 145 N 0.99 1.60 -0.18 1.53 0.00 -1.02 -1.90 119.26 120.28 2dy3 h ALA 145 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2dy3 h ALA 145 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2dy3 h ALA 145 CO 0.02 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.44 2dy3 n ALA 146 N -2.44 2.51 -3.65 0.00 0.00 -1.04 -4.70 120.51 111.20 2dy3 n ALA 146 Ca -0.02 -0.47 -0.39 0.00 0.00 0.00 0.00 53.44 52.56 2dy3 n ALA 146 Cb 0.22 -1.09 -0.10 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.77 3.33 0.32 0.00 0.00 -0.72 -4.97 121.76 117.96 2dy3 s ALA 147 Ca 0.28 -2.62 0.07 0.00 0.00 0.00 0.00 51.96 49.69 2dy3 s ALA 147 Cb 0.15 -2.67 0.77 0.00 0.00 0.00 0.00 23.12 21.37 2dy3 s ALA 147 CO 0.22 -1.89 1.80 -1.35 0.00 0.00 0.00 175.76 174.54 2dy3 h PRO 148 N 8.16 0.72 0.00 0.00 0.11 -1.84 -2.11 132.00 137.03 2dy3 h PRO 148 Ca -0.15 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.91 2dy3 h PRO 148 Cb 1.05 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2dy3 h PRO 148 CO 0.78 0.47 0.00 -2.39 -0.21 0.00 0.00 178.00 176.66 2dy3 n HIS 149 N -4.69 0.00 -4.18 0.65 1.44 -1.26 -4.76 115.22 102.42 2dy3 n HIS 149 Ca 0.22 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.58 2dy3 n HIS 149 Cb 0.56 -0.48 -0.09 0.00 0.12 0.00 0.00 29.99 30.10 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 -2.96 4.59 -0.33 0.61 1.01 -0.80 -0.52 121.20 122.80 2dy3 s ILE 150 Ca 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 60.65 60.64 2dy3 s ILE 150 Cb 0.14 -3.00 0.08 0.00 0.01 0.00 0.00 42.46 39.69 2dy3 s ILE 150 CO 0.40 0.54 0.05 -0.70 0.00 0.00 0.00 174.94 175.22 2dy3 s GLU 151 N -0.28 2.12 -0.41 2.79 2.12 0.13 -4.91 118.70 120.27 2dy3 s GLU 151 Ca 0.07 -1.53 -0.29 0.00 0.36 0.00 0.00 54.97 53.58 2dy3 s GLU 151 Cb -0.12 -3.25 0.01 0.00 0.26 0.00 0.00 34.13 31.03 2dy3 s GLU 151 CO 0.02 -0.79 1.35 0.08 -0.54 0.00 0.00 175.26 175.38 2dy3 s VAL 152 N 1.14 3.98 -0.16 3.70 1.01 -1.26 -2.06 120.40 126.76 2dy3 s VAL 152 Ca 0.01 1.01 0.20 0.00 0.00 0.00 0.00 61.98 63.20 2dy3 s VAL 152 Cb -0.20 -4.27 0.19 0.00 0.00 0.00 0.00 36.38 32.10 2dy3 s VAL 152 CO -0.04 -0.77 1.60 0.71 0.00 0.00 0.00 175.10 176.61 2dy3 h THR 153 N 6.37 0.51 0.00 3.92 1.35 -1.53 -3.37 112.91 120.16 2dy3 h THR 153 Ca -0.27 -1.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 2dy3 h THR 153 Cb 1.10 2.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2dy3 h THR 153 CO 1.09 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 177.24 2dy3 n GLY 154 N 0.89 -1.34 3.20 5.82 0.00 -1.25 -1.42 105.19 111.09 2dy3 n GLY 154 Ca 0.02 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.85 0.93 0.10 1.61 0.23 -1.25 -1.64 119.30 117.43 2dy3 s MET 155 Ca 0.00 -1.39 -0.13 0.00 -1.03 0.00 0.00 55.69 53.15 2dy3 s MET 155 Cb 0.00 -0.32 0.02 0.00 -1.53 0.00 0.00 34.83 32.99 2dy3 s MET 155 CO 0.00 -0.01 0.30 -0.59 -2.03 0.00 0.00 175.02 172.69 2dy3 s PHE 156 N -3.55 -0.04 0.05 3.16 -0.71 -0.30 -2.56 117.98 114.03 2dy3 s PHE 156 Ca 0.14 -0.31 -0.03 0.00 -1.04 0.00 0.00 56.93 55.70 2dy3 s PHE 156 Cb 0.05 0.10 -0.03 0.00 -1.21 0.00 0.00 43.02 41.93 2dy3 s PHE 156 CO -0.02 -0.61 0.02 -0.08 -1.34 0.00 0.00 175.22 173.18 2dy3 s THR 157 N -3.70 0.19 -0.20 -4.49 -1.32 -1.19 -1.04 115.64 103.90 2dy3 s THR 157 Ca 0.03 -1.55 -0.04 0.00 -1.21 0.00 0.00 61.69 58.92 2dy3 s THR 157 Cb 0.03 -1.31 -0.01 0.00 -1.51 0.00 0.00 72.50 69.70 2dy3 s THR 157 CO -0.11 -0.86 -0.04 -2.28 -2.21 0.00 0.00 174.62 169.13 2dy3 s HIS 158 N -3.54 2.97 0.35 9.09 2.46 -1.26 -4.44 115.29 120.91 2dy3 s HIS 158 Ca 0.03 -0.73 -0.27 0.00 0.47 0.00 0.00 55.06 54.56 2dy3 s HIS 158 Cb 0.05 -2.06 -0.09 0.00 -0.13 0.00 0.00 32.58 30.34 2dy3 s HIS 158 CO -0.09 -0.40 1.18 -0.51 -2.47 0.00 0.00 174.74 172.45 2dy3 s LEU 159 N 1.16 4.36 -0.24 8.88 2.01 -1.26 -4.98 118.68 128.62 2dy3 s LEU 159 Ca 0.02 2.40 -0.03 0.00 0.01 0.00 0.00 54.13 56.52 2dy3 s LEU 159 Cb -0.14 -3.82 -0.18 0.00 0.01 0.00 0.00 46.19 42.06 2dy3 s LEU 159 CO -0.00 -0.47 -0.13 0.00 1.01 0.00 0.00 176.35 176.75 2dy3 n ALA 160 N 0.58 1.27 -1.92 4.21 0.00 -1.26 -4.66 120.51 118.74 2dy3 n ALA 160 Ca 0.02 -0.99 -0.26 0.00 0.00 0.00 0.00 53.44 52.21 2dy3 n ALA 160 Cb 0.45 -0.18 0.03 0.00 0.00 0.00 0.00 19.45 19.75 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 -0.74 1.72 0.43 0.00 0.00 -1.26 -3.11 120.51 117.55 2dy3 n ALA 162 Ca 0.47 0.07 -0.19 0.00 0.00 0.00 0.00 53.44 53.79 2dy3 n ALA 162 Cb 0.92 -1.39 -0.09 0.00 0.00 0.00 0.00 19.45 18.89 2dy3 n ALA 162 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2dy3 h ASP 163 N 0.00 -1.02 -3.33 0.00 3.32 -1.90 -3.39 116.42 110.10 2dy3 h ASP 163 Ca 0.00 0.05 -0.56 0.00 0.02 0.00 0.00 57.03 56.54 2dy3 h ASP 163 Cb 0.39 0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.15 2dy3 h ASP 163 CO 0.00 -0.68 1.00 -1.61 -1.72 0.00 0.00 179.24 176.22 2dy3 s GLU 164 N -6.00 3.56 0.00 3.56 2.02 -1.18 -4.81 118.70 115.84 2dy3 s GLU 164 Ca -0.19 0.49 0.00 0.00 0.02 0.00 0.00 54.97 55.29 2dy3 s GLU 164 Cb 0.03 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 30.26 2dy3 s GLU 164 CO 0.61 -1.61 0.00 -2.30 0.02 0.00 0.00 175.26 171.98 2dy3 n PRO 165 N 8.23 0.00 0.00 0.39 -0.02 -1.26 -5.02 135.00 137.32 2dy3 n PRO 165 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2dy3 n PRO 165 Cb 0.49 -0.41 0.00 0.00 -0.02 0.00 0.00 33.50 33.55 2dy3 n PRO 165 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2dy3 n THR 170 N 1.06 0.00 0.21 3.45 -1.04 -1.26 -5.15 114.28 111.54 2dy3 n THR 170 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 2dy3 n THR 170 Cb 0.00 0.00 0.44 0.00 -1.82 0.00 0.00 70.33 68.95 2dy3 n THR 170 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2dy3 h ASP 171 N 0.00 0.00 1.46 8.00 5.19 -2.00 -2.36 116.42 126.72 2dy3 h ASP 171 Ca 0.00 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 2dy3 h ASP 171 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 2dy3 h ASP 171 CO 0.00 0.28 -0.27 0.08 -3.12 0.00 0.00 179.24 176.21 2dy3 h ARG 172 N 0.00 0.00 -0.11 3.56 0.11 -2.00 -2.35 114.38 113.59 2dy3 h ARG 172 Ca -0.00 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.86 2dy3 h ARG 172 Cb 0.52 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.61 2dy3 h ARG 172 CO 0.04 0.27 -0.79 1.96 0.10 0.00 0.00 179.97 181.54 2dy3 h GLN 173 N 0.00 0.73 -0.47 0.08 4.20 -1.64 -2.93 115.11 115.08 2dy3 h GLN 173 Ca -0.00 -0.64 -0.09 0.00 0.06 0.00 0.00 58.65 57.98 2dy3 h GLN 173 Cb 1.07 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.98 2dy3 h GLN 173 CO 0.04 1.24 -0.07 0.82 -0.67 0.00 0.00 178.83 180.19 2dy3 h ILE 174 N 0.43 1.26 -0.57 2.54 5.03 -1.40 0.21 117.51 125.01 2dy3 h ILE 174 Ca -0.07 -1.14 -0.04 0.00 -0.12 0.00 0.00 64.86 63.50 2dy3 h ILE 174 Cb 1.43 0.97 -0.02 0.00 -3.03 0.00 0.00 36.82 36.16 2dy3 h ILE 174 CO 0.16 0.40 0.21 0.40 -0.68 0.00 0.00 178.15 178.63 2dy3 h ILE 175 N 0.76 1.23 -0.36 -0.67 2.04 -1.46 0.22 117.51 119.27 2dy3 h ILE 175 Ca 0.13 -0.75 -0.07 0.00 1.00 0.00 0.00 64.86 65.18 2dy3 h ILE 175 Cb 0.56 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2dy3 h ILE 175 CO 0.03 0.28 -0.06 0.00 0.00 0.00 0.00 178.15 178.41 2dy3 h ALA 176 N 1.06 0.49 -0.35 1.87 0.00 -1.30 -1.07 119.26 119.96 2dy3 h ALA 176 Ca 0.19 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2dy3 h ALA 176 Cb 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2dy3 h ALA 176 CO -0.01 0.31 0.13 0.35 0.00 0.00 0.00 179.25 180.03 2dy3 h PHE 177 N 0.46 0.24 0.00 0.00 3.57 -0.22 0.10 116.94 121.10 2dy3 h PHE 177 Ca 0.09 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 2dy3 h PHE 177 Cb 0.55 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 2dy3 h PHE 177 CO 0.05 0.11 -0.17 0.00 -2.23 0.00 0.00 178.31 176.07 2dy3 h ARG 178 N 0.29 0.00 -0.42 1.11 3.08 -0.44 0.42 114.38 118.42 2dy3 h ARG 178 Ca 0.15 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.06 2dy3 h ARG 178 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2dy3 h ARG 178 CO -0.14 0.17 -0.31 -0.09 -1.07 0.00 0.00 179.97 178.52 2dy3 h ARG 179 N 0.00 0.94 -0.15 0.04 2.43 0.34 -1.73 114.38 116.24 2dy3 h ARG 179 Ca -0.00 -0.45 -0.10 0.00 -0.81 0.00 0.00 59.98 58.62 2dy3 h ARG 179 Cb 0.34 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2dy3 h ARG 179 CO 0.02 1.11 -0.28 0.00 -1.51 0.00 0.00 179.97 179.31 2dy3 h ALA 180 N 0.85 0.24 -0.55 2.80 0.00 0.19 -2.64 119.26 120.15 2dy3 h ALA 180 Ca 0.08 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 54.64 2dy3 h ALA 180 Cb 0.90 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 2dy3 h ALA 180 CO 0.08 0.24 0.28 1.25 0.00 0.00 0.00 179.25 181.11 2dy3 h LEU 181 N 0.07 0.40 -0.82 0.00 5.85 -0.91 0.19 115.31 120.10 2dy3 h LEU 181 Ca 0.01 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2dy3 h LEU 181 Cb 0.87 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.82 2dy3 h LEU 181 CO 0.06 0.27 0.43 0.00 -0.34 0.00 0.00 178.44 178.86 2dy3 h ALA 182 N 1.30 1.05 -0.37 1.25 0.00 -1.32 -0.54 119.26 120.63 2dy3 h ALA 182 Ca 0.25 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2dy3 h ALA 182 Cb 0.16 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2dy3 h ALA 182 CO -0.17 0.58 -0.01 1.25 0.00 0.00 0.00 179.25 180.90 2dy3 h LEU 183 N 1.14 0.66 -0.51 0.00 6.46 -0.98 -1.29 115.31 120.79 2dy3 h LEU 183 Ca 0.28 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2dy3 h LEU 183 Cb 0.07 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 39.79 2dy3 h LEU 183 CO -0.04 0.81 0.34 0.00 -0.62 0.00 0.00 178.44 178.93 2dy3 h ALA 184 N 0.87 0.65 0.00 1.25 0.00 -0.26 -2.06 119.26 119.71 2dy3 h ALA 184 Ca 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2dy3 h ALA 184 Cb 0.48 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2dy3 h ALA 184 CO 0.02 0.10 -0.41 0.00 0.00 0.00 0.00 179.25 178.96 2dy3 h ARG 185 N 0.70 0.00 0.00 0.00 3.08 -1.00 -1.90 114.38 115.26 2dy3 h ARG 185 Ca 0.19 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.18 2dy3 h ARG 185 Cb -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2dy3 h ARG 185 CO -0.04 0.41 -0.27 -0.22 -1.07 0.00 0.00 179.97 178.77 2dy3 h LYS 186 N 0.00 0.00 -0.04 0.04 1.63 -0.55 -1.43 116.57 116.22 2dy3 h LYS 186 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2dy3 h LYS 186 Cb 0.72 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.35 2dy3 h LYS 186 CO 0.05 0.27 0.00 0.72 -3.45 0.00 0.00 179.45 177.05 2dy3 n HIS 187 N -4.01 0.05 -0.06 1.91 8.25 -0.78 -4.91 115.22 115.68 2dy3 n HIS 187 Ca -0.02 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2dy3 n HIS 187 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 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 0.98 0.47 3.53 -1.41 0.00 -0.54 -4.83 105.19 103.39 2dy3 n GLY 188 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 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 4.26 0.25 0.99 1.43 -0.82 -4.94 118.68 119.85 2dy3 s LEU 189 Ca 0.00 -0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 52.86 2dy3 s LEU 189 Cb 0.00 -2.92 0.33 0.00 0.03 0.00 0.00 46.19 43.63 2dy3 s LEU 189 CO 0.00 -0.97 1.88 -0.08 0.23 0.00 0.00 176.35 177.41 2dy3 h GLU 190 N 9.04 1.10 -6.14 1.70 4.81 -1.86 -3.20 114.58 120.03 2dy3 h GLU 190 Ca -0.25 -0.07 -0.36 0.00 -0.13 0.00 0.00 59.36 58.55 2dy3 h GLU 190 Cb 1.08 -0.25 0.06 0.00 0.63 0.00 0.00 28.75 30.28 2dy3 h GLU 190 CO 0.98 0.73 -0.81 0.00 -0.73 0.00 0.00 179.01 179.18 2dy3 h PRO 192 N -1.22 0.65 -4.79 0.00 0.11 -1.78 -3.42 132.00 121.56 2dy3 h PRO 192 Ca -0.55 -0.04 -0.66 0.00 0.11 0.00 0.00 66.00 64.86 2dy3 h PRO 192 Cb 1.31 -0.15 -0.37 0.00 0.11 0.00 0.00 31.00 31.90 2dy3 h PRO 192 CO 0.43 0.43 -0.80 0.08 -0.21 0.00 0.00 178.00 177.93 2dy3 s VAL 193 N -6.14 2.04 0.28 3.15 1.01 -0.51 -4.86 120.40 115.36 2dy3 s VAL 193 Ca -0.13 -1.49 0.11 0.00 0.00 0.00 0.00 61.98 60.47 2dy3 s VAL 193 Cb 0.12 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 2dy3 s VAL 193 CO 0.74 0.01 -0.11 0.20 0.00 0.00 0.00 175.10 175.94 2dy3 s ASN 194 N 1.17 3.96 -0.22 3.32 0.01 -1.26 -3.83 114.94 118.09 2dy3 s ASN 194 Ca -0.07 -0.91 -0.24 0.00 -0.71 0.00 0.00 52.86 50.93 2dy3 s ASN 194 Cb -0.19 -0.50 0.06 0.00 0.41 0.00 0.00 41.25 41.03 2dy3 s ASN 194 CO -0.06 -0.01 0.66 -1.38 -1.51 0.00 0.00 177.10 174.81 2dy3 s HIS 195 N -2.45 -0.72 0.00 2.20 -3.43 -1.06 -2.36 115.29 107.47 2dy3 s HIS 195 Ca 0.31 1.69 0.00 0.00 -0.80 0.00 0.00 55.06 56.26 2dy3 s HIS 195 Cb -0.05 0.27 0.00 0.00 -1.43 0.00 0.00 32.58 31.37 2dy3 s HIS 195 CO 0.17 -0.38 0.00 1.33 -2.00 0.00 0.00 174.74 173.86 2dy3 n VAL 196 N 2.49 0.00 -2.43 -5.38 0.24 -1.26 -3.14 118.33 108.85 2dy3 n VAL 196 Ca -0.15 -0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.72 2dy3 n VAL 196 Cb 0.56 0.13 -0.02 0.00 -1.47 0.00 0.00 33.84 33.03 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 6.26 0.39 0.14 0.00 6.94 -1.26 -0.82 115.26 126.91 2dy3 n ASN 198 Ca 0.13 -1.28 -0.14 0.00 -0.02 0.00 0.00 54.58 53.27 2dy3 n ASN 198 Cb 0.45 -0.09 -0.07 0.00 -2.36 0.00 0.00 39.78 37.72 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 0.00 -1.05 -0.96 0.53 0.02 -1.90 -0.50 113.55 109.69 2dy3 h SER 199 Ca -0.05 0.11 0.08 0.00 -0.84 0.00 0.00 61.79 61.09 2dy3 h SER 199 Cb 0.24 0.39 -0.07 0.00 0.14 0.00 0.00 62.40 63.09 2dy3 h SER 199 CO 0.07 -0.46 0.61 1.55 -1.14 0.00 0.00 176.83 177.46 2dy3 h PRO 200 N -0.64 1.05 -0.31 3.45 0.13 -1.92 -1.76 132.00 131.99 2dy3 h PRO 200 Ca 0.01 -0.06 -0.18 0.00 -0.87 0.00 0.00 66.00 64.90 2dy3 h PRO 200 Cb 0.64 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 31.53 2dy3 h PRO 200 CO -0.18 0.69 -0.51 0.00 -0.23 0.00 0.00 178.00 177.78 2dy3 h ALA 201 N 1.46 0.50 -0.71 -0.56 0.00 -1.72 -2.86 119.26 115.37 2dy3 h ALA 201 Ca 0.43 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2dy3 h ALA 201 Cb 0.24 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2dy3 h ALA 201 CO -0.19 0.68 0.27 0.35 0.00 0.00 0.00 179.25 180.36 2dy3 h PHE 202 N 0.69 1.08 0.00 0.00 3.57 -0.67 0.76 116.94 122.38 2dy3 h PHE 202 Ca 0.03 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2dy3 h PHE 202 Cb 1.11 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2dy3 h PHE 202 CO 0.07 0.84 0.00 1.28 -2.23 0.00 0.00 178.31 178.27 2dy3 n LEU 203 N -4.36 0.56 0.00 0.59 4.32 -0.70 -4.07 117.00 113.35 2dy3 n LEU 203 Ca 0.05 0.57 0.00 0.00 -0.02 0.00 0.00 56.01 56.61 2dy3 n LEU 203 Cb 0.18 -0.41 0.00 0.00 -1.62 0.00 0.00 43.42 41.57 2dy3 n LEU 203 CO 0.40 -0.21 0.07 0.35 -1.22 0.00 0.00 177.39 176.78 2dy3 n THR 204 N -2.04 0.00 -3.58 -5.08 -2.24 -1.00 -4.94 114.28 95.40 2dy3 n THR 204 Ca 0.05 -0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.25 2dy3 n THR 204 Cb 0.36 1.17 -0.11 0.00 -2.10 0.00 0.00 70.33 69.65 2dy3 n THR 204 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2dy3 s ARG 205 N -0.34 1.49 0.52 -0.78 1.81 0.26 -4.93 118.95 116.98 2dy3 s ARG 205 Ca 0.00 -2.58 0.17 0.00 -1.72 0.00 0.00 55.73 51.60 2dy3 s ARG 205 Cb 0.00 -2.16 1.29 0.00 -0.45 0.00 0.00 34.95 33.63 2dy3 s ARG 205 CO 0.00 -1.35 2.15 0.77 -0.68 0.00 0.00 175.30 176.19 2dy3 h SER 206 N 5.54 0.00 0.38 0.23 0.02 -1.80 -0.51 113.55 117.40 2dy3 h SER 206 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2dy3 h SER 206 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2dy3 h SER 206 CO 0.50 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.29 2dy3 n ASP 207 N -4.51 0.00 -0.61 3.07 3.85 -1.26 -2.74 116.55 114.35 2dy3 n ASP 207 Ca -0.03 -0.00 0.05 0.00 -0.71 0.00 0.00 54.79 54.10 2dy3 n ASP 207 Cb 0.09 -0.28 0.14 0.00 -1.35 0.00 0.00 41.12 39.72 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 -1.28 2.84 -0.04 -2.12 4.32 -0.20 -4.63 117.00 115.88 2dy3 n LEU 208 Ca 0.10 -1.94 -0.01 0.00 -0.02 0.00 0.00 56.01 54.13 2dy3 n LEU 208 Cb 0.16 -0.21 0.26 0.00 -1.62 0.00 0.00 43.42 42.00 2dy3 n LEU 208 CO 0.15 0.70 0.94 0.45 -1.22 0.00 0.00 177.39 178.42 2dy3 h HIS 209 N 1.97 0.65 0.00 -1.77 3.86 -1.57 -3.39 115.15 114.89 2dy3 h HIS 209 Ca 0.00 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 2dy3 h HIS 209 Cb 0.71 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2dy3 h HIS 209 CO 0.21 0.60 0.00 -1.33 0.86 0.00 0.00 177.93 178.28 2dy3 n MET 210 N -4.27 0.00 0.13 2.45 2.81 -1.26 -2.69 117.12 114.28 2dy3 n MET 210 Ca 0.02 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.04 2dy3 n MET 210 Cb 0.24 0.00 0.31 0.00 -0.71 0.00 0.00 33.22 33.07 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 -2.27 0.03 3.07 -1.88 -3.42 114.58 110.10 2dy3 h GLU 211 Ca 0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 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 0.06 1.41 -1.40 0.00 0.00 179.01 179.08 2dy3 s MET 212 N -3.14 0.92 0.12 2.33 0.00 -0.99 -0.76 119.30 117.76 2dy3 s MET 212 Ca 0.09 0.25 0.09 0.00 0.00 0.00 0.00 55.69 56.12 2dy3 s MET 212 Cb 0.11 0.43 -0.04 0.00 0.00 0.00 0.00 34.83 35.33 2dy3 s MET 212 CO 0.63 -0.26 -0.21 0.14 0.00 0.00 0.00 175.02 175.32 2dy3 s VAL 213 N -0.98 1.79 -0.40 10.11 -7.23 -0.44 -4.25 120.40 119.01 2dy3 s VAL 213 Ca -0.10 -1.63 0.03 0.00 -1.81 0.00 0.00 61.98 58.47 2dy3 s VAL 213 Cb -0.02 -1.66 0.16 0.00 0.56 0.00 0.00 36.38 35.43 2dy3 s VAL 213 CO 0.07 -0.09 0.31 0.00 -0.31 0.00 0.00 175.10 175.09 2dy3 s ARG 214 N -2.07 0.85 0.31 4.82 1.70 -0.00 -0.30 118.95 124.26 2dy3 s ARG 214 Ca 0.09 -1.94 -0.06 0.00 -0.47 0.00 0.00 55.73 53.35 2dy3 s ARG 214 Cb -0.09 -1.44 -0.05 0.00 -0.57 0.00 0.00 34.95 32.80 2dy3 s ARG 214 CO 0.05 -1.34 0.60 -1.25 -1.08 0.00 0.00 175.30 172.28 2dy3 s PRO 215 N 0.29 3.66 0.04 3.89 0.04 -1.14 -4.21 135.00 137.56 2dy3 s PRO 215 Ca 0.29 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.43 2dy3 s PRO 215 Cb -0.03 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.91 2dy3 s PRO 215 CO -0.14 0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.47 2dy3 n GLY 216 N -1.03 0.01 0.36 0.56 0.00 -1.26 -1.72 105.19 102.11 2dy3 n GLY 216 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.76 -0.43 0.10 0.99 -0.00 -1.26 -0.97 117.00 112.68 2dy3 n LEU 217 Ca 0.00 1.67 0.11 0.00 -0.00 0.00 0.00 56.01 57.79 2dy3 n LEU 217 Cb 0.00 -0.47 0.60 0.00 -0.00 0.00 0.00 43.42 43.55 2dy3 n LEU 217 CO 0.00 -1.58 1.13 0.00 -0.00 0.00 0.00 177.39 176.94 2dy3 h ALA 218 N 1.77 2.09 0.00 1.96 0.00 -1.90 -1.99 119.26 121.19 2dy3 h ALA 218 Ca 0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 2dy3 h ALA 218 Cb 0.67 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2dy3 h ALA 218 CO -0.99 -0.15 -0.12 0.74 0.00 0.00 0.00 179.25 178.73 2dy3 h PHE 219 N 0.14 0.00 -0.41 0.00 -1.00 -1.38 -0.34 116.94 113.95 2dy3 h PHE 219 Ca 0.13 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.91 2dy3 h PHE 219 Cb 0.34 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.90 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 -4.39 0.67 -1.15 -0.55 4.01 -0.75 -4.57 117.16 110.42 2dy3 n TYR 220 Ca -0.03 -0.31 -0.05 0.00 -0.16 0.00 0.00 57.90 57.35 2dy3 n TYR 220 Cb 0.19 -0.05 -0.02 0.00 -0.31 0.00 0.00 39.34 39.14 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 1.05 0.78 3.76 2.72 0.00 -0.14 -2.08 105.19 111.28 2dy3 n GLY 221 Ca 0.15 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.20 3.94 -0.03 0.99 1.43 -1.19 -3.35 118.68 119.27 2dy3 s LEU 222 Ca 0.00 0.27 -0.24 0.00 -1.03 0.00 0.00 54.13 53.13 2dy3 s LEU 222 Cb 0.00 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2dy3 s LEU 222 CO 0.00 0.37 0.74 -1.61 0.23 0.00 0.00 176.35 176.07 2dy3 s GLU 223 N -0.80 4.46 0.21 1.70 0.41 -1.26 -3.84 118.70 119.58 2dy3 s GLU 223 Ca 0.13 0.97 0.17 0.00 -0.41 0.00 0.00 54.97 55.82 2dy3 s GLU 223 Cb -0.12 -3.42 0.01 0.00 -1.78 0.00 0.00 34.13 28.82 2dy3 s GLU 223 CO 0.03 0.12 1.20 -1.35 -0.49 0.00 0.00 175.26 174.76 2dy3 h PRO 224 N 6.46 0.00 -5.05 0.39 0.11 -1.93 -3.45 132.00 128.53 2dy3 h PRO 224 Ca -0.42 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.02 2dy3 h PRO 224 Cb 1.20 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.98 2dy3 h PRO 224 CO 0.74 0.34 -0.83 0.08 -0.21 0.00 0.00 178.00 178.12 2dy3 s VAL 225 N -3.01 2.37 0.61 3.15 1.01 -1.26 -4.90 120.40 118.36 2dy3 s VAL 225 Ca 0.01 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.97 2dy3 s VAL 225 Cb 0.08 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2dy3 s VAL 225 CO 0.77 0.51 1.12 0.00 0.00 0.00 0.00 175.10 177.50 2dy3 n ALA 226 N 4.64 0.65 0.00 5.51 0.00 -1.26 -1.99 120.51 128.06 2dy3 n ALA 226 Ca -0.20 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2dy3 n ALA 226 Cb 0.50 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2dy3 n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dy3 n GLY 227 N 1.11 1.99 3.49 0.00 0.00 -1.26 -4.96 105.19 105.56 2dy3 n GLY 227 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 3.40 -0.00 0.99 1.43 -0.84 -5.09 118.68 118.56 2dy3 s LEU 228 Ca 0.00 -0.14 0.07 0.00 -1.03 0.00 0.00 54.13 53.04 2dy3 s LEU 228 Cb 0.00 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.34 2dy3 s LEU 228 CO 0.00 0.09 -0.23 -1.61 0.23 0.00 0.00 176.35 174.82 2dy3 s GLU 229 N 0.88 1.81 0.23 1.70 2.02 -1.26 -4.78 118.70 119.30 2dy3 s GLU 229 Ca 0.02 -0.88 0.02 0.00 0.02 0.00 0.00 54.97 54.14 2dy3 s GLU 229 Cb -0.14 -1.80 -0.01 0.00 0.10 0.00 0.00 34.13 32.28 2dy3 s GLU 229 CO 0.02 0.49 0.07 0.72 0.02 0.00 0.00 175.26 176.58 2dy3 n HIS 230 N 2.33 0.13 -0.66 1.61 8.25 -1.26 -5.04 115.22 120.57 2dy3 n HIS 230 Ca -0.16 -1.42 -0.12 0.00 -0.26 0.00 0.00 57.72 55.77 2dy3 n HIS 230 Cb 0.52 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 31.64 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 0.74 3.57 3.89 -1.41 0.00 -1.26 -4.95 105.19 105.77 2dy3 n GLY 231 Ca -0.04 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.30 3.60 -0.10 0.99 2.01 -1.26 -4.88 118.68 117.74 2dy3 s LEU 232 Ca 0.22 1.11 -0.00 0.00 0.01 0.00 0.00 54.13 55.47 2dy3 s LEU 232 Cb 0.17 -4.06 0.02 0.00 0.01 0.00 0.00 46.19 42.34 2dy3 s LEU 232 CO 0.00 -0.59 -0.07 -0.75 1.01 0.00 0.00 176.35 175.95 2dy3 s LYS 233 N -4.57 1.40 0.49 1.70 2.47 -1.26 -5.01 119.74 114.96 2dy3 s LYS 233 Ca 0.50 -0.21 -0.22 0.00 -1.56 0.00 0.00 55.97 54.48 2dy3 s LYS 233 Cb -0.10 -1.49 -0.09 0.00 -1.46 0.00 0.00 37.83 34.70 2dy3 s LYS 233 CO 0.43 -0.26 0.99 -2.30 0.16 0.00 0.00 175.35 174.37 2dy3 n PRO 234 N 4.90 1.22 -0.01 4.03 -0.02 -1.21 -3.91 135.00 140.01 2dy3 n PRO 234 Ca -0.12 0.45 0.07 0.00 -2.02 0.00 0.00 63.50 61.87 2dy3 n PRO 234 Cb 0.50 -2.10 -0.10 0.00 -0.02 0.00 0.00 33.50 31.78 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 -0.92 2.73 -2.61 3.55 0.00 -0.88 -4.89 120.51 117.49 2dy3 n ALA 235 Ca 0.11 -0.34 -0.33 0.00 0.00 0.00 0.00 53.44 52.87 2dy3 n ALA 235 Cb 0.42 -0.48 -0.11 0.00 0.00 0.00 0.00 19.45 19.29 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 -2.84 2.70 -0.03 0.00 -2.45 -1.26 -0.56 119.30 114.85 2dy3 s MET 236 Ca -0.03 -0.61 0.01 0.00 -1.25 0.00 0.00 55.69 53.81 2dy3 s MET 236 Cb 0.09 -2.58 0.02 0.00 1.25 0.00 0.00 34.83 33.61 2dy3 s MET 236 CO 0.57 0.64 -0.02 0.99 1.05 0.00 0.00 175.02 178.25 2dy3 s THR 237 N -0.91 0.34 -0.26 10.11 2.01 -0.63 -4.38 115.64 121.92 2dy3 s THR 237 Ca 0.15 -0.03 -0.04 0.00 0.31 0.00 0.00 61.69 62.08 2dy3 s THR 237 Cb -0.11 -0.39 0.01 0.00 0.01 0.00 0.00 72.50 72.01 2dy3 s THR 237 CO 0.05 0.17 -0.00 0.86 -0.69 0.00 0.00 174.62 175.01 2dy3 s TRP 238 N 0.86 3.06 0.03 4.92 -0.00 0.15 0.66 118.94 128.61 2dy3 s TRP 238 Ca -0.10 -1.12 -0.01 0.00 -0.00 0.00 0.00 56.10 54.87 2dy3 s TRP 238 Cb -0.13 -2.15 -0.03 0.00 -0.00 0.00 0.00 33.47 31.17 2dy3 s TRP 238 CO -0.01 -0.61 -0.02 -1.83 -0.00 0.00 0.00 176.95 174.48 2dy3 s GLU 239 N 1.44 0.42 0.14 5.86 -1.05 -0.33 -0.49 118.70 124.68 2dy3 s GLU 239 Ca 0.03 -0.80 0.03 0.00 -0.15 0.00 0.00 54.97 54.08 2dy3 s GLU 239 Cb -0.16 0.15 -0.04 0.00 -0.44 0.00 0.00 34.13 33.63 2dy3 s GLU 239 CO -0.01 -0.07 -0.06 0.00 0.95 0.00 0.00 175.26 176.06 2dy3 s ALA 240 N -2.26 1.26 -0.24 -0.84 0.00 0.23 -1.50 121.76 118.41 2dy3 s ALA 240 Ca -0.08 -1.46 -0.09 0.00 0.00 0.00 0.00 51.96 50.32 2dy3 s ALA 240 Cb -0.04 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 2dy3 s ALA 240 CO -0.04 -0.20 0.11 0.15 0.00 0.00 0.00 175.76 175.79 2dy3 s LYS 241 N -3.82 3.85 0.14 0.00 1.02 0.72 0.02 119.74 121.67 2dy3 s LYS 241 Ca 0.16 -0.38 -0.34 0.00 0.02 0.00 0.00 55.97 55.43 2dy3 s LYS 241 Cb 0.04 -3.43 -0.14 0.00 -0.52 0.00 0.00 37.83 33.79 2dy3 s LYS 241 CO -0.01 -0.07 1.62 0.28 -0.92 0.00 0.00 175.35 176.25 2dy3 n VAL 242 N 4.63 0.07 0.03 3.17 0.31 -0.49 -4.37 118.33 121.68 2dy3 n VAL 242 Ca -0.15 -0.01 -0.02 0.00 -0.01 0.00 0.00 64.34 64.14 2dy3 n VAL 242 Cb 0.52 -1.59 -0.09 0.00 -0.91 0.00 0.00 33.84 31.77 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 6.33 0.00 -4.00 4.52 4.64 -1.73 0.55 113.55 123.86 2dy3 h SER 243 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2dy3 h SER 243 Cb 1.25 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.12 2dy3 h SER 243 CO 0.90 0.71 0.29 0.54 -0.87 0.00 0.00 176.83 178.40 2dy3 s VAL 244 N -2.83 0.00 -0.17 0.95 0.11 -1.25 -4.79 120.40 112.42 2dy3 s VAL 244 Ca -0.02 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.01 2dy3 s VAL 244 Cb 0.08 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.92 2dy3 s VAL 244 CO 0.81 0.00 -0.08 -0.69 -3.33 0.00 0.00 175.10 171.80 2dy3 s VAL 245 N -0.20 3.30 -0.12 2.04 1.01 -1.26 -1.24 120.40 123.92 2dy3 s VAL 245 Ca -0.02 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2dy3 s VAL 245 Cb -0.03 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 2dy3 s VAL 245 CO 0.01 0.48 -0.19 -0.75 0.00 0.00 0.00 175.10 174.65 2dy3 s LYS 246 N 0.81 3.19 -0.25 2.72 2.47 0.57 -4.98 119.74 124.27 2dy3 s LYS 246 Ca -0.03 -0.80 -0.24 0.00 -1.56 0.00 0.00 55.97 53.34 2dy3 s LYS 246 Cb -0.15 -2.46 -0.01 0.00 -1.46 0.00 0.00 37.83 33.76 2dy3 s LYS 246 CO 0.01 0.17 0.81 -1.14 0.16 0.00 0.00 175.35 175.36 2dy3 s GLN 247 N 0.41 4.17 -0.49 4.03 0.74 -1.26 -0.83 119.66 126.42 2dy3 s GLN 247 Ca -0.14 0.90 -0.10 0.00 0.05 0.00 0.00 55.36 56.08 2dy3 s GLN 247 Cb -0.17 -3.65 0.13 0.00 1.10 0.00 0.00 33.01 30.42 2dy3 s GLN 247 CO 0.06 -0.52 0.38 0.42 -0.55 0.00 0.00 175.29 175.08 2dy3 s ILE 248 N 2.82 4.32 0.00 -2.34 1.01 0.18 -4.99 121.20 122.21 2dy3 s ILE 248 Ca 0.34 -1.83 0.00 0.00 0.00 0.00 0.00 60.65 59.17 2dy3 s ILE 248 Cb -0.15 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2dy3 s ILE 248 CO 0.08 -0.80 0.00 -0.62 0.00 0.00 0.00 174.94 173.60 2dy3 n GLU 249 N 4.86 2.00 0.00 2.79 1.02 -1.26 -2.57 120.64 127.48 2dy3 n GLU 249 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2dy3 n GLU 249 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.83 2dy3 n GLU 249 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dy3 n ALA 250 N -3.00 0.71 0.27 0.62 0.00 -1.26 -2.63 120.51 115.22 2dy3 n ALA 250 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 2dy3 n ALA 250 Cb 0.00 -0.59 0.83 0.00 0.00 0.00 0.00 19.45 19.69 2dy3 n ALA 250 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2dy3 h GLY 251 N 0.00 0.00 -5.45 0.00 0.00 -1.98 -3.54 103.07 92.10 2dy3 h GLY 251 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2dy3 h GLY 251 CO 0.00 0.00 -0.28 -1.06 0.00 0.00 0.00 176.54 175.20 2dy3 n GLN 252 N -3.18 -1.74 0.00 4.80 6.02 -1.08 -5.18 117.38 117.02 2dy3 n GLN 252 Ca 0.00 1.69 0.00 0.00 -0.01 0.00 0.00 57.00 58.68 2dy3 n GLN 252 Cb 0.41 -5.42 0.00 0.00 1.02 0.00 0.00 30.24 26.24 2dy3 n GLN 252 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dy3 n GLY 266 N -1.17 -0.96 3.00 1.08 0.00 -1.06 -5.14 105.19 100.93 2dy3 n GLY 266 Ca 0.02 -1.66 -0.11 0.00 0.00 0.00 0.00 46.02 44.28 2dy3 n GLY 266 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dy3 s PHE 267 N -1.79 0.06 0.13 1.61 0.08 0.11 -0.64 117.98 117.54 2dy3 s PHE 267 Ca 0.00 -0.12 0.06 0.00 0.12 0.00 0.00 56.93 56.98 2dy3 s PHE 267 Cb 0.00 -0.06 -0.04 0.00 -0.57 0.00 0.00 43.02 42.35 2dy3 s PHE 267 CO 0.00 -0.15 -0.14 0.14 -0.10 0.00 0.00 175.22 174.98 2dy3 s VAL 268 N -0.80 1.33 -0.02 -0.44 -7.23 -0.01 -0.49 120.40 112.74 2dy3 s VAL 268 Ca -0.09 -1.76 0.05 0.00 -1.81 0.00 0.00 61.98 58.37 2dy3 s VAL 268 Cb -0.05 -1.58 -0.01 0.00 0.56 0.00 0.00 36.38 35.30 2dy3 s VAL 268 CO 0.00 -0.45 -0.18 0.00 -0.31 0.00 0.00 175.10 174.17 2dy3 s ALA 269 N -2.26 1.50 -0.22 1.32 0.00 -0.10 -0.32 121.76 121.69 2dy3 s ALA 269 Ca 0.10 -0.74 -0.14 0.00 0.00 0.00 0.00 51.96 51.18 2dy3 s ALA 269 Cb -0.04 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2dy3 s ALA 269 CO 0.03 0.34 0.31 0.08 0.00 0.00 0.00 175.76 176.52 2dy3 s VAL 270 N -0.26 5.25 -0.26 0.00 1.01 -0.37 -0.90 120.40 124.87 2dy3 s VAL 270 Ca 0.03 0.51 -0.08 0.00 0.00 0.00 0.00 61.98 62.44 2dy3 s VAL 270 Cb -0.08 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2dy3 s VAL 270 CO 0.00 0.28 0.10 -0.69 0.00 0.00 0.00 175.10 174.79 2dy3 s VAL 271 N 1.28 4.58 -0.10 2.92 1.01 0.38 -1.85 120.40 128.63 2dy3 s VAL 271 Ca 0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2dy3 s VAL 271 Cb -0.14 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 2dy3 s VAL 271 CO 0.07 0.32 1.18 -2.65 0.00 0.00 0.00 175.10 174.02 2dy3 n PRO 272 N 4.92 0.48 -3.69 2.72 -0.02 -1.26 -1.88 135.00 136.27 2dy3 n PRO 272 Ca -0.16 -0.40 -0.10 0.00 -2.02 0.00 0.00 63.50 60.82 2dy3 n PRO 272 Cb 0.52 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 32.11 2dy3 n PRO 272 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dy3 s ALA 273 N 3.25 -1.09 0.05 3.55 0.00 -0.67 -4.73 121.76 122.13 2dy3 s ALA 273 Ca 0.13 1.55 0.01 0.00 0.00 0.00 0.00 51.96 53.64 2dy3 s ALA 273 Cb 0.05 -0.94 -0.00 0.00 0.00 0.00 0.00 23.12 22.23 2dy3 s ALA 273 CO -0.00 -0.27 0.02 0.41 0.00 0.00 0.00 175.76 175.92 2dy3 n GLY 274 N 4.17 4.00 0.26 0.00 0.00 -1.16 -2.74 105.19 109.72 2dy3 n GLY 274 Ca -0.23 -1.93 0.17 0.00 0.00 0.00 0.00 46.02 44.04 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 1.08 0.00 0.00 1.61 -0.00 -1.01 0.32 116.97 118.98 2dy3 h TYR 275 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.69 2dy3 h TYR 275 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.88 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 -1.97 2.07 -0.18 0.10 0.00 -0.92 -2.90 120.51 116.71 2dy3 n ALA 276 Ca -0.01 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.45 2dy3 n ALA 276 Cb 0.15 -1.41 0.16 0.00 0.00 0.00 0.00 19.45 18.35 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 -1.80 2.94 0.00 0.00 8.00 0.11 -3.67 116.55 122.13 2dy3 n ASP 277 Ca 0.05 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.56 2dy3 n ASP 277 Cb 0.31 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 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 0.54 0.45 3.51 0.44 0.00 -1.11 -1.64 105.19 107.38 2dy3 n GLY 278 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.77 3.31 0.34 1.61 0.00 -0.96 -4.76 119.30 118.07 2dy3 s MET 279 Ca 0.00 -0.32 -0.28 0.00 0.00 0.00 0.00 55.69 55.09 2dy3 s MET 279 Cb 0.00 -4.05 -0.12 0.00 0.00 0.00 0.00 34.83 30.66 2dy3 s MET 279 CO 0.00 -1.41 1.21 -2.30 0.00 0.00 0.00 175.02 172.52 2dy3 n PRO 280 N 7.20 1.89 -0.00 4.11 -0.02 -1.26 -2.65 135.00 144.27 2dy3 n PRO 280 Ca 0.01 0.66 0.01 0.00 -2.02 0.00 0.00 63.50 62.16 2dy3 n PRO 280 Cb 0.47 -2.20 0.34 0.00 -0.02 0.00 0.00 33.50 32.09 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 2.33 0.54 0.00 -0.52 3.08 -1.94 -1.50 114.38 116.36 2dy3 h ARG 281 Ca -0.45 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.52 2dy3 h ARG 281 Cb 1.30 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.26 2dy3 h ARG 281 CO 0.62 0.48 0.00 0.72 -1.07 0.00 0.00 179.97 180.72 2dy3 n HIS 282 N -4.35 0.00 0.34 3.04 8.25 -1.26 -2.96 115.22 118.28 2dy3 n HIS 282 Ca 0.02 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.62 2dy3 n HIS 282 Cb 0.17 0.00 0.44 0.00 1.12 0.00 0.00 29.99 31.72 2dy3 n HIS 282 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dy3 h ALA 283 N 3.26 1.00 -1.15 -1.41 0.00 -1.63 -3.46 119.26 115.87 2dy3 h ALA 283 Ca 0.00 0.00 -0.83 0.00 0.00 0.00 0.00 54.91 54.08 2dy3 h ALA 283 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.81 2dy3 h ALA 283 CO 0.00 0.00 0.66 0.94 0.00 0.00 0.00 179.25 180.85 2dy3 n GLN 284 N -2.81 0.31 -1.17 0.00 7.27 -1.15 -1.33 117.38 118.50 2dy3 n GLN 284 Ca 0.03 0.11 -0.06 0.00 0.07 0.00 0.00 57.00 57.15 2dy3 n GLN 284 Cb 0.39 -1.66 -0.02 0.00 2.41 0.00 0.00 30.24 31.36 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 3.72 0.76 0.14 1.69 0.00 -1.26 -4.89 105.19 105.35 2dy3 n GLY 285 Ca 0.28 -0.29 0.04 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.89 2.73 -4.06 1.61 5.02 -0.44 -5.03 118.16 116.09 2dy3 n LYS 286 Ca -0.06 -0.41 -0.12 0.00 -2.02 0.00 0.00 58.31 55.70 2dy3 n LYS 286 Cb 0.31 -1.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.27 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 -1.36 0.78 0.10 2.13 -0.12 -1.26 -4.74 117.98 113.50 2dy3 s PHE 287 Ca 0.06 -1.07 0.05 0.00 -0.05 0.00 0.00 56.93 55.92 2dy3 s PHE 287 Cb 0.07 -0.02 -0.03 0.00 -0.63 0.00 0.00 43.02 42.41 2dy3 s PHE 287 CO 0.24 -1.03 -0.13 -1.12 -0.05 0.00 0.00 175.22 173.14 2dy3 s SER 288 N -3.14 1.76 0.32 1.98 0.01 -1.26 -1.64 113.70 111.73 2dy3 s SER 288 Ca 0.28 -0.74 0.07 0.00 1.31 0.00 0.00 55.95 56.87 2dy3 s SER 288 Cb 0.00 -0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.16 2dy3 s SER 288 CO 0.15 -0.14 0.32 0.68 0.41 0.00 0.00 173.24 174.65 2dy3 s VAL 289 N -1.88 3.82 -0.15 3.43 -7.23 -0.56 -4.88 120.40 112.95 2dy3 s VAL 289 Ca 0.04 -1.28 0.02 0.00 -1.81 0.00 0.00 61.98 58.95 2dy3 s VAL 289 Cb -0.06 -3.28 0.01 0.00 0.56 0.00 0.00 36.38 33.61 2dy3 s VAL 289 CO 0.02 -0.20 -0.20 0.42 -0.31 0.00 0.00 175.10 174.83 2dy3 s THR 290 N -2.25 1.97 -0.22 5.32 -4.23 0.26 -1.71 115.64 114.78 2dy3 s THR 290 Ca 0.41 -0.91 -0.00 0.00 -1.18 0.00 0.00 61.69 60.00 2dy3 s THR 290 Cb -0.07 -1.76 0.02 0.00 1.34 0.00 0.00 72.50 72.03 2dy3 s THR 290 CO 0.27 0.53 -0.12 -0.63 -0.54 0.00 0.00 174.62 174.14 2dy3 s ILE 291 N 1.01 2.53 -1.43 2.99 1.01 0.93 -0.90 121.20 127.34 2dy3 s ILE 291 Ca -0.03 -1.02 -0.10 0.00 0.00 0.00 0.00 60.65 59.51 2dy3 s ILE 291 Cb -0.15 -2.22 0.05 0.00 0.01 0.00 0.00 42.46 40.15 2dy3 s ILE 291 CO -0.06 0.32 1.02 0.47 0.00 0.00 0.00 174.94 176.69 2dy3 n ASP 292 N 4.63 -4.70 0.00 3.58 8.00 -1.26 -1.65 116.55 125.16 2dy3 n ASP 292 Ca -0.18 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.62 2dy3 n ASP 292 Cb 0.48 -4.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.23 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 -1.75 1.48 3.55 0.44 0.00 -1.26 -5.03 105.19 102.62 2dy3 n GLY 293 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 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 2.98 0.19 0.99 1.43 -0.66 -5.02 118.68 118.60 2dy3 s LEU 294 Ca 0.00 -0.32 -0.19 0.00 -1.03 0.00 0.00 54.13 52.59 2dy3 s LEU 294 Cb 0.00 -1.76 -0.08 0.00 0.03 0.00 0.00 46.19 44.39 2dy3 s LEU 294 CO 0.00 0.23 0.68 -1.81 0.23 0.00 0.00 176.35 175.68 2dy3 s ASP 295 N -1.78 7.04 -0.06 2.29 -0.00 -1.26 -0.05 116.67 122.85 2dy3 s ASP 295 Ca 0.18 1.36 -0.02 0.00 -0.00 0.00 0.00 52.55 54.07 2dy3 s ASP 295 Cb -0.11 -2.40 0.04 0.00 -0.00 0.00 0.00 42.92 40.45 2dy3 s ASP 295 CO 0.10 0.08 0.10 -0.31 -0.00 0.00 0.00 175.17 175.13 2dy3 s TYR 296 N -1.45 -0.04 0.22 4.23 1.51 -0.70 -4.96 117.35 116.16 2dy3 s TYR 296 Ca 0.40 0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 56.56 2dy3 s TYR 296 Cb -0.17 -0.36 -0.09 0.00 -0.11 0.00 0.00 41.96 41.22 2dy3 s TYR 296 CO 0.21 -0.21 1.31 -1.25 -1.11 0.00 0.00 175.55 174.49 2dy3 s PRO 297 N 2.10 4.39 0.43 -1.71 0.04 -1.26 -1.50 135.00 137.50 2dy3 s PRO 297 Ca 0.03 2.07 -0.23 0.00 0.04 0.00 0.00 61.00 62.91 2dy3 s PRO 297 Cb -0.12 -3.18 -0.08 0.00 0.04 0.00 0.00 34.50 31.16 2dy3 s PRO 297 CO -0.04 -0.23 1.11 -1.14 0.04 0.00 0.00 177.00 176.73 2dy3 s GLN 298 N -0.37 3.95 0.01 4.56 -0.44 -0.65 -0.81 119.66 125.90 2dy3 s GLN 298 Ca 0.55 1.64 -0.00 0.00 -2.50 0.00 0.00 55.36 55.05 2dy3 s GLN 298 Cb -0.37 -2.46 -0.01 0.00 -1.64 0.00 0.00 33.01 28.53 2dy3 s GLN 298 CO 0.40 -0.36 -0.01 0.14 0.50 0.00 0.00 175.29 175.96 2dy3 s VAL 299 N -1.62 0.08 0.00 1.34 -7.23 0.27 -4.24 120.40 109.00 2dy3 s VAL 299 Ca 0.61 -0.67 0.00 0.00 -1.81 0.00 0.00 61.98 60.11 2dy3 s VAL 299 Cb -0.25 -0.21 0.00 0.00 0.56 0.00 0.00 36.38 36.48 2dy3 s VAL 299 CO 0.31 -0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 2dy3 n GLY 300 N 1.97 -1.89 3.76 2.32 0.00 -1.26 -4.12 105.19 105.97 2dy3 n GLY 300 Ca -0.21 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 44.05 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 4.50 -0.31 1.61 0.52 -1.26 -4.58 118.95 119.43 2dy3 s ARG 301 Ca 0.00 1.81 -0.20 0.00 -0.52 0.00 0.00 55.73 56.82 2dy3 s ARG 301 Cb 0.00 -3.05 -0.01 0.00 0.52 0.00 0.00 34.95 32.41 2dy3 s ARG 301 CO 0.00 0.08 0.62 0.08 0.02 0.00 0.00 175.30 176.10 2dy3 s VAL 302 N -1.25 4.94 0.68 3.52 1.01 -1.26 -4.61 120.40 123.43 2dy3 s VAL 302 Ca 0.48 0.82 0.02 0.00 0.00 0.00 0.00 61.98 63.30 2dy3 s VAL 302 Cb -0.31 -4.00 0.13 0.00 0.00 0.00 0.00 36.38 32.20 2dy3 s VAL 302 CO 0.40 -0.15 0.93 0.00 0.00 0.00 0.00 175.10 176.28 2dy3 h MET 304 N 0.00 1.27 -0.00 0.00 4.05 -1.94 -1.39 114.93 116.92 2dy3 h MET 304 Ca -0.31 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.03 2dy3 h MET 304 Cb 1.20 -0.29 0.00 0.00 -0.80 0.00 0.00 31.60 31.71 2dy3 h MET 304 CO 0.35 0.84 -0.42 -0.25 0.23 0.00 0.00 176.91 177.66 2dy3 n ASP 305 N -4.40 0.47 -3.66 1.39 8.00 -1.26 -2.16 116.55 114.93 2dy3 n ASP 305 Ca 0.12 -0.73 -0.08 0.00 0.71 0.00 0.00 54.79 54.81 2dy3 n ASP 305 Cb 0.04 0.98 -0.02 0.00 -0.02 0.00 0.00 41.12 42.10 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 -1.85 1.33 0.13 -1.24 -2.07 -1.18 -1.67 119.66 113.12 2dy3 s GLN 306 Ca 0.04 -0.65 -0.01 0.00 -1.82 0.00 0.00 55.36 52.92 2dy3 s GLN 306 Cb 0.07 0.51 -0.04 0.00 -1.09 0.00 0.00 33.01 32.46 2dy3 s GLN 306 CO 0.37 -0.60 0.05 -0.59 -1.32 0.00 0.00 175.29 173.20 2dy3 s PHE 307 N -3.57 0.86 0.19 9.60 -0.71 -0.79 -1.07 117.98 122.50 2dy3 s PHE 307 Ca 0.08 -1.21 0.09 0.00 -1.04 0.00 0.00 56.93 54.85 2dy3 s PHE 307 Cb -0.03 -0.49 -0.04 0.00 -1.21 0.00 0.00 43.02 41.25 2dy3 s PHE 307 CO -0.02 -0.49 -0.09 0.08 -1.34 0.00 0.00 175.22 173.36 2dy3 s VAL 308 N -4.01 3.21 0.05 -2.49 1.01 -1.26 -0.47 120.40 116.45 2dy3 s VAL 308 Ca 0.23 -1.68 0.04 0.00 0.00 0.00 0.00 61.98 60.57 2dy3 s VAL 308 Cb 0.07 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 2dy3 s VAL 308 CO 0.01 -0.13 -0.12 0.27 0.00 0.00 0.00 175.10 175.13 2dy3 s ILE 309 N -1.76 0.96 -0.14 2.22 -4.36 -0.08 -0.57 121.20 117.47 2dy3 s ILE 309 Ca 0.25 -1.13 -0.18 0.00 -0.26 0.00 0.00 60.65 59.33 2dy3 s ILE 309 Cb -0.09 -0.93 -0.04 0.00 1.25 0.00 0.00 42.46 42.66 2dy3 s ILE 309 CO 0.16 -0.18 0.49 -0.55 0.24 0.00 0.00 174.94 175.10 2dy3 s SER 310 N -1.47 6.65 0.00 4.36 0.15 0.01 -0.92 113.70 122.47 2dy3 s SER 310 Ca -0.03 0.77 0.17 0.00 0.70 0.00 0.00 55.95 57.57 2dy3 s SER 310 Cb -0.09 -2.29 0.28 0.00 -1.71 0.00 0.00 66.02 62.21 2dy3 s SER 310 CO 0.01 -0.06 1.19 0.18 1.20 0.00 0.00 173.24 175.77 2dy3 n LEU 311 N 4.04 2.86 0.00 3.45 4.77 0.35 -4.07 117.00 128.41 2dy3 n LEU 311 Ca -0.06 -1.41 0.00 0.00 -0.03 0.00 0.00 56.01 54.50 2dy3 n LEU 311 Cb 0.51 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2dy3 n LEU 311 CO 0.43 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 2dy3 n GLY 312 N 1.02 3.59 0.19 -0.72 0.00 -1.21 0.53 105.19 108.58 2dy3 n GLY 312 Ca 0.13 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.17 2dy3 n GLY 312 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dy3 n ASP 313 N 4.91 0.56 -3.75 1.61 8.00 -1.26 0.10 116.55 126.72 2dy3 n ASP 313 Ca 0.00 -1.50 -0.22 0.00 0.71 0.00 0.00 54.79 53.77 2dy3 n ASP 313 Cb 0.00 -0.03 0.02 0.00 -0.02 0.00 0.00 41.12 41.09 2dy3 n ASP 313 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2dy3 n ASN 314 N -0.42 -1.19 0.08 -2.24 4.05 0.19 -4.83 115.26 110.90 2dy3 n ASN 314 Ca 0.15 -0.87 0.18 0.00 0.45 0.00 0.00 54.58 54.49 2dy3 n ASN 314 Cb 0.16 -3.82 0.71 0.00 1.23 0.00 0.00 39.78 38.06 2dy3 n ASN 314 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2dy3 h PRO 315 N -1.85 0.00 -0.02 1.20 0.13 -1.91 -1.65 132.00 127.90 2dy3 h PRO 315 Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2dy3 h PRO 315 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2dy3 h PRO 315 CO 0.57 0.00 -0.02 0.72 -0.23 0.00 0.00 178.00 179.04 2dy3 n HIS 316 N -4.24 0.00 -2.74 1.56 8.25 -1.26 -4.97 115.22 111.82 2dy3 n HIS 316 Ca 0.06 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.41 2dy3 n HIS 316 Cb 0.48 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.60 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 1.21 0.11 3.72 -1.41 0.00 -0.62 -4.97 105.19 103.23 2dy3 n GLY 317 Ca 0.18 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.85 1.36 -4.38 1.61 0.31 -1.26 -4.99 118.33 107.12 2dy3 n VAL 318 Ca -0.04 -0.34 -0.19 0.00 -0.01 0.00 0.00 64.34 63.76 2dy3 n VAL 318 Cb 0.55 -1.76 -0.10 0.00 -0.91 0.00 0.00 33.84 31.62 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 -1.02 1.47 0.33 5.55 2.02 -1.26 -4.99 118.70 120.80 2dy3 s GLU 319 Ca 0.62 -1.77 -0.29 0.00 0.02 0.00 0.00 54.97 53.55 2dy3 s GLU 319 Cb -0.55 -0.80 -0.12 0.00 0.10 0.00 0.00 34.13 32.76 2dy3 s GLU 319 CO 0.54 -0.10 1.38 0.00 0.02 0.00 0.00 175.26 177.10 2dy3 n ALA 320 N -0.53 1.62 0.00 5.21 0.00 -1.26 -1.72 120.51 123.83 2dy3 n ALA 320 Ca -0.04 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2dy3 n ALA 320 Cb 0.65 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 1.05 3.20 3.65 0.00 0.00 0.19 -4.97 105.19 108.32 2dy3 n GLY 321 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 2dy3 n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dy3 n ALA 322 N -1.75 0.19 -2.65 4.61 0.00 -0.70 -4.50 120.51 115.71 2dy3 n ALA 322 Ca 0.00 -0.11 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 2dy3 n ALA 322 Cb 0.00 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.21 2dy3 n ALA 322 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dy3 s LYS 323 N -3.27 4.17 -0.25 0.00 2.20 -1.26 -1.40 119.74 119.93 2dy3 s LYS 323 Ca 0.76 0.50 -0.04 0.00 -0.36 0.00 0.00 55.97 56.83 2dy3 s LYS 323 Cb -0.36 -3.59 0.01 0.00 -1.51 0.00 0.00 37.83 32.37 2dy3 s LYS 323 CO 0.47 -0.24 -0.02 0.00 -0.36 0.00 0.00 175.35 175.20 2dy3 s ALA 324 N 1.94 2.84 -0.20 3.13 0.00 0.10 -4.17 121.76 125.41 2dy3 s ALA 324 Ca 0.26 -1.33 -0.20 0.00 0.00 0.00 0.00 51.96 50.69 2dy3 s ALA 324 Cb -0.16 -1.81 -0.03 0.00 0.00 0.00 0.00 23.12 21.12 2dy3 s ALA 324 CO 0.10 -0.68 0.58 0.08 0.00 0.00 0.00 175.76 175.84 2dy3 s VAL 325 N 1.44 5.06 -0.07 0.00 1.01 -0.08 -0.60 120.40 127.16 2dy3 s VAL 325 Ca 0.03 1.08 -0.17 0.00 0.00 0.00 0.00 61.98 62.92 2dy3 s VAL 325 Cb -0.16 -3.90 -0.30 0.00 0.00 0.00 0.00 36.38 32.03 2dy3 s VAL 325 CO -0.02 0.14 0.72 0.40 0.00 0.00 0.00 175.10 176.33 2dy3 h ILE 326 N 5.16 1.19 -1.90 2.22 2.04 -1.11 0.75 117.51 125.88 2dy3 h ILE 326 Ca -0.32 -2.49 -0.01 0.00 1.00 0.00 0.00 64.86 63.04 2dy3 h ILE 326 Cb 1.15 2.90 -0.22 0.00 -0.74 0.00 0.00 36.82 39.91 2dy3 h ILE 326 CO 0.76 0.73 0.22 0.72 0.00 0.00 0.00 178.15 180.58 2dy3 s PHE 327 N -2.48 -0.70 -2.45 1.37 -0.12 -1.19 -4.63 117.98 107.77 2dy3 s PHE 327 Ca -0.16 1.69 0.00 0.00 -0.05 0.00 0.00 56.93 58.41 2dy3 s PHE 327 Cb 0.03 0.30 0.00 0.00 -0.63 0.00 0.00 43.02 42.72 2dy3 s PHE 327 CO 0.81 -0.35 0.00 0.41 -0.05 0.00 0.00 175.22 176.04 2dy3 n GLY 328 N 2.48 0.53 3.71 1.99 0.00 0.12 -0.68 105.19 113.34 2dy3 n GLY 328 Ca -0.14 -1.87 -0.42 0.00 0.00 0.00 0.00 46.02 43.59 2dy3 n GLY 328 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dy3 s GLU 329 N -0.98 4.17 -0.84 1.61 2.12 -1.26 -1.98 118.70 121.53 2dy3 s GLU 329 Ca 0.00 2.47 -0.01 0.00 0.36 0.00 0.00 54.97 57.79 2dy3 s GLU 329 Cb 0.00 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 31.15 2dy3 s GLU 329 CO 0.00 -0.70 0.18 0.09 -0.54 0.00 0.00 175.26 174.29 2dy3 n ASN 330 N 4.40 -3.73 0.00 -1.70 3.02 -1.26 -4.97 115.26 111.03 2dy3 n ASN 330 Ca 0.15 -0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 2dy3 n ASN 330 Cb 0.38 -2.77 0.00 0.00 -0.61 0.00 0.00 39.78 36.78 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 -1.09 2.83 3.80 7.41 0.00 -0.84 -4.41 105.19 112.89 2dy3 n GLY 331 Ca -0.09 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.66 3.71 0.86 1.61 3.76 -1.26 -4.63 115.29 116.68 2dy3 s HIS 332 Ca 0.00 1.56 -0.12 0.00 -0.15 0.00 0.00 55.06 56.36 2dy3 s HIS 332 Cb 0.00 -2.75 0.11 0.00 1.11 0.00 0.00 32.58 31.05 2dy3 s HIS 332 CO 0.00 0.33 1.10 0.16 -0.85 0.00 0.00 174.74 175.48 2dy3 s ASP 333 N -1.54 3.89 0.29 1.40 1.47 -1.26 0.13 116.67 121.04 2dy3 s ASP 333 Ca 0.44 1.33 0.03 0.00 1.18 0.00 0.00 52.55 55.52 2dy3 s ASP 333 Cb -0.19 -2.02 0.63 0.00 -0.34 0.00 0.00 42.92 41.00 2dy3 s ASP 333 CO 0.23 -2.35 1.81 0.00 0.68 0.00 0.00 175.17 175.53 2dy3 h ALA 334 N -1.35 1.56 -0.78 2.11 0.00 -1.91 -1.40 119.26 117.49 2dy3 h ALA 334 Ca -0.49 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2dy3 h ALA 334 Cb 1.28 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2dy3 h ALA 334 CO 0.58 0.10 0.51 1.15 0.00 0.00 0.00 179.25 181.58 2dy3 h THR 335 N 0.88 1.21 0.04 0.00 2.02 -1.91 0.19 112.91 115.33 2dy3 h THR 335 Ca 0.53 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 2dy3 h THR 335 Cb 0.67 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 2dy3 h THR 335 CO -0.32 0.20 -0.02 -0.78 0.37 0.00 0.00 175.52 174.98 2dy3 h ASP 336 N 1.06 -0.04 -1.00 4.18 3.58 -1.63 -1.32 116.42 121.24 2dy3 h ASP 336 Ca 0.29 -0.25 0.08 0.00 0.42 0.00 0.00 57.03 57.57 2dy3 h ASP 336 Cb -0.10 0.01 -0.07 0.00 1.72 0.00 0.00 39.33 40.89 2dy3 h ASP 336 CO -0.06 0.23 0.65 0.15 -2.88 0.00 0.00 179.24 177.32 2dy3 h PHE 337 N -0.31 1.19 -0.59 0.28 -0.00 -1.15 -1.35 116.94 115.00 2dy3 h PHE 337 Ca -0.00 0.03 -0.02 0.00 -0.00 0.00 0.00 57.97 57.98 2dy3 h PHE 337 Cb 0.29 -0.39 -0.03 0.00 -0.00 0.00 0.00 35.95 35.82 2dy3 h PHE 337 CO 0.01 0.57 0.30 0.00 -0.00 0.00 0.00 178.31 179.20 2dy3 h ALA 338 N 1.48 0.76 -0.62 2.41 0.00 -0.41 -2.23 119.26 120.65 2dy3 h ALA 338 Ca 0.45 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 2dy3 h ALA 338 Cb 0.27 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2dy3 h ALA 338 CO -0.20 0.31 0.15 0.93 0.00 0.00 0.00 179.25 180.44 2dy3 h GLU 339 N 0.80 0.98 -0.72 0.00 5.08 -0.26 0.21 114.58 120.67 2dy3 h GLU 339 Ca 0.21 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2dy3 h GLU 339 Cb 0.09 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2dy3 h GLU 339 CO -0.03 0.87 0.39 0.00 -1.00 0.00 0.00 179.01 179.24 2dy3 h ARG 340 N 0.93 1.00 -0.35 2.33 2.47 -0.94 -2.52 114.38 117.30 2dy3 h ARG 340 Ca 0.20 -0.12 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2dy3 h ARG 340 Cb 0.33 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.46 2dy3 h ARG 340 CO 0.00 0.75 0.00 1.28 0.56 0.00 0.00 179.97 182.56 2dy3 n LEU 341 N -4.48 1.74 -3.64 3.04 4.32 -0.87 -4.91 117.00 112.21 2dy3 n LEU 341 Ca 0.06 -0.87 -0.24 0.00 -0.02 0.00 0.00 56.01 54.94 2dy3 n LEU 341 Cb 0.09 -0.24 0.07 0.00 -1.62 0.00 0.00 43.42 41.72 2dy3 n LEU 341 CO 0.38 0.40 0.18 -0.67 -1.22 0.00 0.00 177.39 176.46 2dy3 n ASP 342 N 0.37 -4.93 -0.80 -1.43 2.03 -0.75 -4.99 116.55 106.05 2dy3 n ASP 342 Ca 0.10 -0.62 0.00 0.00 0.52 0.00 0.00 54.79 54.79 2dy3 n ASP 342 Cb 0.29 -4.77 0.00 0.00 -0.72 0.00 0.00 41.12 35.92 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 -4.74 0.00 -4.28 5.18 5.66 0.65 -5.02 114.28 111.73 2dy3 n THR 343 Ca -0.06 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.70 2dy3 n THR 343 Cb 0.58 0.00 -0.08 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 -1.88 3.45 0.53 1.09 -4.36 -1.26 -3.90 121.20 114.86 2dy3 s ILE 344 Ca 0.00 -1.78 0.24 0.00 -0.26 0.00 0.00 60.65 58.85 2dy3 s ILE 344 Cb 0.00 -2.80 0.38 0.00 1.25 0.00 0.00 42.46 41.28 2dy3 s ILE 344 CO 0.00 -0.28 2.02 -0.55 0.24 0.00 0.00 174.94 176.37 2dy3 h ASN 345 N 2.21 0.00 -0.48 4.36 -0.00 -1.88 -1.48 115.58 118.31 2dy3 h ASN 345 Ca -0.45 0.00 0.08 0.00 -0.00 0.00 0.00 56.30 55.93 2dy3 h ASN 345 Cb 1.23 0.00 -0.07 0.00 -0.00 0.00 0.00 38.32 39.49 2dy3 h ASN 345 CO 0.59 0.00 0.10 1.88 -0.00 0.00 0.00 177.43 180.00 2dy3 h TYR 346 N 0.00 0.16 -0.21 4.14 -1.99 -1.95 -2.82 116.97 114.30 2dy3 h TYR 346 Ca 0.21 0.03 -0.21 0.00 2.00 0.00 0.00 58.73 60.76 2dy3 h TYR 346 Cb 0.84 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.58 2dy3 h TYR 346 CO 0.00 -0.00 -0.68 1.49 -0.00 0.00 0.00 178.16 178.96 2dy3 h GLU 347 N 0.23 0.82 -1.00 4.88 4.81 -1.69 -3.22 114.58 119.42 2dy3 h GLU 347 Ca 0.24 -0.61 0.04 0.00 -0.13 0.00 0.00 59.36 58.90 2dy3 h GLU 347 Cb 0.32 0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.74 2dy3 h GLU 347 CO -0.31 1.23 0.65 -0.39 -0.73 0.00 0.00 179.01 179.45 2dy3 h VAL 348 N 0.59 1.16 0.00 0.32 -1.51 -1.35 -1.05 116.25 114.41 2dy3 h VAL 348 Ca -0.02 -0.43 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 2dy3 h VAL 348 Cb 1.30 -0.20 0.00 0.00 -2.13 0.00 0.00 31.29 30.27 2dy3 h VAL 348 CO 0.14 0.23 0.00 -0.37 -1.23 0.00 0.00 177.57 176.34 2dy3 h VAL 349 N 1.25 0.00 -0.00 7.19 -1.51 -1.56 -2.46 116.25 119.15 2dy3 h VAL 349 Ca 0.40 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 65.30 2dy3 h VAL 349 Cb 0.03 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 2dy3 h VAL 349 CO -0.13 0.00 -0.30 0.00 -1.23 0.00 0.00 177.57 175.91 2dy3 h ARG 351 N 0.11 0.27 -6.13 0.00 2.47 -0.93 -3.45 114.38 106.72 2dy3 h ARG 351 Ca 0.00 -0.27 -0.74 0.00 -1.26 0.00 0.00 59.98 57.70 2dy3 h ARG 351 Cb 0.49 0.07 0.01 0.00 -1.65 0.00 0.00 29.97 28.89 2dy3 h ARG 351 CO 0.00 0.97 0.94 -2.30 0.56 0.00 0.00 179.97 180.14 2dy3 n PRO 352 N -4.41 1.08 0.00 0.04 -0.02 -1.26 -4.16 135.00 126.28 2dy3 n PRO 352 Ca -0.10 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2dy3 n PRO 352 Cb 0.55 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 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 4.77 0.00 0.00 3.45 5.66 -0.65 -4.98 114.28 122.53 2dy3 n THR 353 Ca 0.28 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.28 2dy3 n THR 353 Cb 0.12 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.90 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 4.07 0.00 1.09 0.00 -1.24 -1.17 105.19 107.94 2dy3 n GLY 354 Ca 0.00 0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.27 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 14.00 0.26 -1.81 1.61 3.00 -1.26 -4.84 116.66 127.62 2dy3 n ARG 355 Ca 0.00 0.06 -0.42 0.00 -0.01 0.00 0.00 57.85 57.48 2dy3 n ARG 355 Cb 0.00 -1.50 -0.03 0.00 0.00 0.00 0.00 32.46 30.93 2dy3 n ARG 355 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2dy3 s THR 356 N -2.68 2.41 -0.14 0.55 -4.23 -0.31 -4.76 115.64 106.48 2dy3 s THR 356 Ca 0.20 0.20 -0.04 0.00 -1.18 0.00 0.00 61.69 60.88 2dy3 s THR 356 Cb 0.16 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.85 2dy3 s THR 356 CO 0.39 0.01 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.77 2dy3 s VAL 357 N 1.64 4.04 0.06 2.29 1.01 -0.03 -4.82 120.40 124.60 2dy3 s VAL 357 Ca 0.75 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 62.12 2dy3 s VAL 357 Cb -0.46 -2.76 -0.05 0.00 0.00 0.00 0.00 36.38 33.11 2dy3 s VAL 357 CO 0.33 0.51 0.94 -0.13 0.00 0.00 0.00 175.10 176.75 2dy3 s ARG 358 N 0.11 4.63 -0.10 2.72 0.52 -1.26 -1.36 118.95 124.21 2dy3 s ARG 358 Ca 0.00 1.39 0.02 0.00 -0.52 0.00 0.00 55.73 56.62 2dy3 s ARG 358 Cb -0.13 -3.40 0.01 0.00 0.52 0.00 0.00 34.95 31.94 2dy3 s ARG 358 CO 0.02 0.13 -0.17 0.00 0.02 0.00 0.00 175.30 175.31 2dy3 s ALA 359 N 0.35 1.69 -0.24 2.13 0.00 0.30 -4.91 121.76 121.08 2dy3 s ALA 359 Ca 0.48 -0.71 -0.18 0.00 0.00 0.00 0.00 51.96 51.55 2dy3 s ALA 359 Cb -0.22 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.11 2dy3 s ALA 359 CO 0.28 0.06 0.50 0.71 0.00 0.00 0.00 175.76 177.31 2dy3 s TYR 360 N 0.75 3.31 0.00 0.00 2.02 -1.26 -0.51 117.35 121.65 2dy3 s TYR 360 Ca -0.12 0.67 0.00 0.00 -0.37 0.00 0.00 57.07 57.25 2dy3 s TYR 360 Cb -0.16 -2.68 0.00 0.00 -0.40 0.00 0.00 41.96 38.72 2dy3 s TYR 360 CO 0.02 -0.20 0.43 1.33 -1.57 0.00 0.00 175.55 175.56