#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cdd s ASN 2 N 0.00 5.86 -0.03 7.83 -0.87 -1.26 -0.10 114.94 126.36 1cdd s ASN 2 Ca 0.00 -0.16 -0.14 0.00 -1.57 0.00 0.00 52.86 50.99 1cdd s ASN 2 Cb 0.00 -2.55 -0.05 0.00 -0.02 0.00 0.00 41.25 38.63 1cdd s ASN 2 CO 0.00 -2.02 0.38 -0.63 -2.57 0.00 0.00 177.10 172.26 1cdd s ILE 3 N 6.89 5.10 -0.12 0.60 1.01 -0.10 -0.20 121.20 134.39 1cdd s ILE 3 Ca 0.47 0.77 0.02 0.00 0.00 0.00 0.00 60.65 61.90 1cdd s ILE 3 Cb -0.10 -3.68 0.01 0.00 0.01 0.00 0.00 42.46 38.71 1cdd s ILE 3 CO 0.17 0.56 -0.17 0.68 0.00 0.00 0.00 174.94 176.18 1cdd s VAL 4 N -0.88 1.64 -0.15 2.92 -7.23 -1.07 -1.33 120.40 114.30 1cdd s VAL 4 Ca 0.23 -0.73 -0.06 0.00 -1.81 0.00 0.00 61.98 59.61 1cdd s VAL 4 Cb -0.16 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 1cdd s VAL 4 CO 0.12 0.47 0.05 0.68 -0.31 0.00 0.00 175.10 176.10 1cdd s VAL 5 N 0.93 4.69 -0.18 1.32 -7.23 -1.08 -2.01 120.40 116.84 1cdd s VAL 5 Ca -0.07 -0.08 -0.16 0.00 -1.81 0.00 0.00 61.98 59.85 1cdd s VAL 5 Cb -0.15 -3.06 -0.04 0.00 0.56 0.00 0.00 36.38 33.69 1cdd s VAL 5 CO -0.01 0.52 0.42 -0.76 -0.31 0.00 0.00 175.10 174.95 1cdd s LEU 6 N -0.14 4.18 0.24 1.32 1.02 -0.18 -2.31 118.68 122.81 1cdd s LEU 6 Ca 0.06 0.58 0.04 0.00 0.02 0.00 0.00 54.13 54.84 1cdd s LEU 6 Cb -0.12 -2.55 -0.05 0.00 0.02 0.00 0.00 46.19 43.48 1cdd s LEU 6 CO 0.01 -0.06 -0.02 0.27 0.02 0.00 0.00 176.35 176.57 1cdd s ILE 7 N 1.15 1.18 0.00 -0.59 -4.36 -0.41 -1.61 121.20 116.56 1cdd s ILE 7 Ca 0.21 -2.06 0.00 0.00 -0.26 0.00 0.00 60.65 58.54 1cdd s ILE 7 Cb -0.15 -2.34 0.00 0.00 1.25 0.00 0.00 42.46 41.22 1cdd s ILE 7 CO 0.08 -0.34 0.06 -1.20 0.24 0.00 0.00 174.94 173.79 1cdd n SER 8 N -0.45 0.13 0.00 4.36 7.64 -1.08 -3.26 113.62 120.96 1cdd n SER 8 Ca -0.05 -0.73 0.00 0.00 1.01 0.00 0.00 58.87 59.09 1cdd n SER 8 Cb 0.64 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.89 1cdd n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cdd n GLY 9 N 0.05 3.84 0.33 0.23 0.00 -1.26 -4.58 105.19 103.80 1cdd n GLY 9 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 46.02 45.71 1cdd n GLY 9 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1cdd h ASN 10 N 0.00 0.85 0.00 1.61 -0.73 -1.93 0.20 115.58 115.59 1cdd h ASN 10 Ca 0.00 -0.10 0.00 0.00 1.87 0.00 0.00 56.30 58.07 1cdd h ASN 10 Cb 0.00 -0.22 0.00 0.00 0.27 0.00 0.00 38.32 38.37 1cdd h ASN 10 CO 0.00 0.74 0.00 0.61 -0.37 0.00 0.00 177.43 178.41 1cdd n GLY 11 N -1.07 0.49 0.31 1.57 0.00 -1.26 -1.10 105.19 104.13 1cdd n GLY 11 Ca 0.06 -0.65 0.16 0.00 0.00 0.00 0.00 46.02 45.59 1cdd n GLY 11 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1cdd h SER 12 N 0.00 0.00 -0.19 1.61 4.64 -1.95 -0.55 113.55 117.11 1cdd h SER 12 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1cdd h SER 12 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1cdd h SER 12 CO 0.00 0.00 -0.41 0.78 -0.87 0.00 0.00 176.83 176.33 1cdd h ASN 13 N 0.00 0.68 -0.72 4.97 2.35 -1.91 -2.20 115.58 118.75 1cdd h ASN 13 Ca 0.01 -0.56 0.14 0.00 -0.55 0.00 0.00 56.30 55.34 1cdd h ASN 13 Cb 0.08 -0.20 -0.09 0.00 0.05 0.00 0.00 38.32 38.15 1cdd h ASN 13 CO -0.00 1.12 0.26 0.25 -1.65 0.00 0.00 177.43 177.41 1cdd h LEU 14 N 0.28 0.22 -0.32 1.61 6.46 -1.51 -1.83 115.31 120.22 1cdd h LEU 14 Ca 0.00 0.11 -0.05 0.00 -0.12 0.00 0.00 57.88 57.82 1cdd h LEU 14 Cb 1.02 0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 41.04 1cdd h LEU 14 CO 0.09 0.08 0.00 -0.61 -0.62 0.00 0.00 178.44 177.38 1cdd h GLN 15 N 0.40 0.57 -0.31 1.25 5.75 -1.04 0.25 115.11 121.99 1cdd h GLN 15 Ca 0.39 -0.18 0.05 0.00 -0.15 0.00 0.00 58.65 58.76 1cdd h GLN 15 Cb 0.59 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.07 1cdd h GLN 15 CO -0.40 0.70 0.21 0.00 -2.65 0.00 0.00 178.83 176.69 1cdd h ALA 16 N 0.85 2.03 0.02 3.38 0.00 -0.70 0.80 119.26 125.64 1cdd h ALA 16 Ca 0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1cdd h ALA 16 Cb 0.44 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1cdd h ALA 16 CO 0.02 -0.09 -0.01 0.82 0.00 0.00 0.00 179.25 179.99 1cdd h ILE 17 N 0.20 1.44 -0.86 0.00 2.04 -0.75 -1.00 117.51 118.59 1cdd h ILE 17 Ca 0.13 -1.82 0.20 0.00 1.00 0.00 0.00 64.86 64.37 1cdd h ILE 17 Cb 0.28 2.60 -0.12 0.00 -0.74 0.00 0.00 36.82 38.84 1cdd h ILE 17 CO -0.02 0.44 0.37 0.40 0.00 0.00 0.00 178.15 179.34 1cdd h ILE 18 N -0.87 0.53 -0.26 -0.67 2.04 -0.10 -0.56 117.51 117.63 1cdd h ILE 18 Ca -0.00 -0.15 -0.08 0.00 1.00 0.00 0.00 64.86 65.63 1cdd h ILE 18 Cb 0.75 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1cdd h ILE 18 CO 0.01 0.08 -0.14 0.44 0.00 0.00 0.00 178.15 178.53 1cdd h ASP 19 N 0.43 0.58 -0.44 1.72 5.19 -0.77 -0.77 116.42 122.36 1cdd h ASP 19 Ca 0.52 -0.42 -0.00 0.00 -0.62 0.00 0.00 57.03 56.51 1cdd h ASP 19 Cb 0.92 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.25 1cdd h ASP 19 CO -0.49 0.87 0.27 0.00 -3.12 0.00 0.00 179.24 176.77 1cdd h ALA 20 N 0.73 0.56 -0.34 3.45 0.00 -0.53 0.13 119.26 123.26 1cdd h ALA 20 Ca 0.06 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1cdd h ALA 20 Cb 0.66 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1cdd h ALA 20 CO 0.04 0.04 -0.41 0.00 0.00 0.00 0.00 179.25 178.92 1cdd h LYS 22 N 0.68 0.08 -1.00 0.00 3.64 -0.28 -2.58 116.57 117.12 1cdd h LYS 22 Ca 0.05 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 59.21 1cdd h LYS 22 Cb 0.99 -0.02 -0.13 0.00 -0.41 0.00 0.00 32.23 32.66 1cdd h LYS 22 CO 0.10 0.06 0.27 2.41 -2.27 0.00 0.00 179.45 180.01 1cdd n THR 23 N -5.11 1.90 -0.45 1.00 -1.04 0.39 -4.89 114.28 106.08 1cdd n THR 23 Ca -0.03 -0.79 0.00 0.00 -2.04 0.00 0.00 64.05 61.20 1cdd n THR 23 Cb 0.10 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 67.83 1cdd n THR 23 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1cdd n ASN 24 N -0.17 -2.60 0.20 8.00 4.05 -0.97 -4.84 115.26 118.91 1cdd n ASN 24 Ca 0.25 0.00 0.04 0.00 0.45 0.00 0.00 54.58 55.31 1cdd n ASN 24 Cb 0.98 -1.84 0.40 0.00 1.23 0.00 0.00 39.78 40.55 1cdd n ASN 24 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 1cdd h LYS 25 N 0.00 0.00 -5.59 1.20 1.57 -0.91 -3.36 116.57 109.47 1cdd h LYS 25 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1cdd h LYS 25 Cb 0.43 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.65 1cdd h LYS 25 CO 0.00 0.34 -0.31 0.42 -0.57 0.00 0.00 179.45 179.33 1cdd s ILE 26 N -4.14 5.28 -1.25 1.86 1.01 -0.35 -4.79 121.20 118.82 1cdd s ILE 26 Ca -0.03 0.58 -0.09 0.00 0.00 0.00 0.00 60.65 61.11 1cdd s ILE 26 Cb 0.14 -3.63 0.18 0.00 0.01 0.00 0.00 42.46 39.16 1cdd s ILE 26 CO 0.71 0.43 1.78 0.29 0.00 0.00 0.00 174.94 178.15 1cdd n LYS 27 N 3.18 3.69 -0.81 2.79 4.01 -1.26 -4.48 118.16 125.28 1cdd n LYS 27 Ca -0.13 -3.68 0.00 0.00 -0.51 0.00 0.00 58.31 53.99 1cdd n LYS 27 Cb 0.52 -2.89 0.00 0.00 -0.51 0.00 0.00 35.03 32.15 1cdd n LYS 27 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1cdd n GLY 28 N 2.78 1.87 3.31 0.72 0.00 -1.26 -3.58 105.19 109.03 1cdd n GLY 28 Ca 0.38 -0.87 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 1cdd n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cdd s THR 29 N -2.74 -0.01 -0.69 2.61 2.01 0.85 -4.81 115.64 112.86 1cdd s THR 29 Ca 0.00 0.04 -0.22 0.00 0.31 0.00 0.00 61.69 61.82 1cdd s THR 29 Cb 0.00 -0.62 0.08 0.00 0.01 0.00 0.00 72.50 71.97 1cdd s THR 29 CO 0.00 0.02 0.97 -0.69 -0.69 0.00 0.00 174.62 174.23 1cdd s VAL 30 N 0.77 4.38 0.19 3.82 1.01 -1.26 -0.92 120.40 128.38 1cdd s VAL 30 Ca -0.04 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 1cdd s VAL 30 Cb -0.05 -4.69 -0.00 0.00 0.00 0.00 0.00 36.38 31.64 1cdd s VAL 30 CO -0.06 -1.46 1.56 0.03 0.00 0.00 0.00 175.10 175.18 1cdd h ARG 31 N 9.49 0.80 -3.12 2.72 2.47 -1.57 -3.46 114.38 121.72 1cdd h ARG 31 Ca -0.24 -0.38 0.00 0.00 -1.26 0.00 0.00 59.98 58.10 1cdd h ARG 31 Cb 1.07 -0.01 -0.10 0.00 -1.65 0.00 0.00 29.97 29.28 1cdd h ARG 31 CO 1.18 1.00 0.14 0.00 0.56 0.00 0.00 179.97 182.85 1cdd s ALA 32 N -4.47 -1.25 -0.04 0.04 0.00 -1.26 -4.17 121.76 110.62 1cdd s ALA 32 Ca -0.10 0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.90 1cdd s ALA 32 Cb 0.12 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.13 1cdd s ALA 32 CO 0.85 -0.84 -0.02 0.08 0.00 0.00 0.00 175.76 175.83 1cdd s VAL 33 N -3.84 0.36 0.32 0.00 1.01 -0.61 -2.63 120.40 115.02 1cdd s VAL 33 Ca 0.06 -0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.11 1cdd s VAL 33 Cb -0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 1cdd s VAL 33 CO -0.05 0.19 0.16 -0.36 0.00 0.00 0.00 175.10 175.04 1cdd s PHE 34 N 1.03 2.77 -0.22 5.22 0.40 -0.98 -1.36 117.98 124.84 1cdd s PHE 34 Ca -0.09 -0.33 -0.20 0.00 -0.60 0.00 0.00 56.93 55.71 1cdd s PHE 34 Cb -0.14 -1.60 0.06 0.00 0.51 0.00 0.00 43.02 41.85 1cdd s PHE 34 CO -0.01 0.36 0.58 0.45 0.70 0.00 0.00 175.22 177.30 1cdd s SER 35 N -3.85 -0.62 0.00 1.36 0.15 -0.67 -1.29 113.70 108.77 1cdd s SER 35 Ca 0.37 1.18 0.28 0.00 0.70 0.00 0.00 55.95 58.48 1cdd s SER 35 Cb -0.04 1.18 1.14 0.00 -1.71 0.00 0.00 66.02 66.60 1cdd s SER 35 CO 0.23 -0.20 1.83 -3.20 1.20 0.00 0.00 173.24 173.10 1cdd n ASN 36 N 2.88 0.28 -3.82 5.45 4.05 -1.20 -1.04 115.26 121.86 1cdd n ASN 36 Ca -0.14 -0.15 -0.25 0.00 0.45 0.00 0.00 54.58 54.49 1cdd n ASN 36 Cb 0.56 -0.17 -0.17 0.00 1.23 0.00 0.00 39.78 41.23 1cdd n ASN 36 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1cdd s LYS 37 N -2.73 0.94 0.38 1.20 1.02 -1.26 -4.55 119.74 114.73 1cdd s LYS 37 Ca 0.21 -0.08 0.20 0.00 0.02 0.00 0.00 55.97 56.32 1cdd s LYS 37 Cb 0.19 -1.32 1.21 0.00 -0.52 0.00 0.00 37.83 37.40 1cdd s LYS 37 CO 0.53 -0.33 1.65 0.00 -0.92 0.00 0.00 175.35 176.28 1cdd h ALA 38 N 8.26 2.22 -0.33 5.17 0.00 -1.93 -2.53 119.26 130.13 1cdd h ALA 38 Ca -0.23 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1cdd h ALA 38 Cb 1.13 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1cdd h ALA 38 CO 0.32 -0.84 0.00 -0.40 0.00 0.00 0.00 179.25 178.33 1cdd n ASP 39 N -4.94 3.32 -4.55 0.00 5.68 -1.26 -5.01 116.55 109.78 1cdd n ASP 39 Ca 0.33 -1.98 -0.40 0.00 -0.50 0.00 0.00 54.79 52.25 1cdd n ASP 39 Cb 1.13 -0.21 -0.04 0.00 -1.14 0.00 0.00 41.12 40.87 1cdd n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1cdd n ALA 40 N 1.42 1.10 -0.33 2.12 0.00 -0.96 -4.84 120.51 119.02 1cdd n ALA 40 Ca 0.19 -0.63 0.29 0.00 0.00 0.00 0.00 53.44 53.29 1cdd n ALA 40 Cb 0.60 -3.02 0.50 0.00 0.00 0.00 0.00 19.45 17.52 1cdd n ALA 40 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1cdd n PHE 41 N 13.89 0.64 0.05 0.00 7.35 -1.17 0.03 117.46 138.24 1cdd n PHE 41 Ca 0.37 0.64 0.21 0.00 -0.76 0.00 0.00 57.45 57.91 1cdd n PHE 41 Cb 0.46 -1.05 0.74 0.00 0.35 0.00 0.00 39.48 39.98 1cdd n PHE 41 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1cdd h GLY 42 N 0.00 0.00 0.89 7.13 0.00 0.10 0.39 103.07 111.58 1cdd h GLY 42 Ca 0.67 0.00 0.02 0.00 0.00 0.00 0.00 47.33 48.02 1cdd h GLY 42 CO -0.42 0.00 0.38 1.41 0.00 0.00 0.00 176.54 177.90 1cdd h LEU 43 N 0.00 0.62 -0.20 3.11 3.38 -0.65 -1.53 115.31 120.03 1cdd h LEU 43 Ca 0.23 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.20 1cdd h LEU 43 Cb 1.10 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1cdd h LEU 43 CO -0.00 0.43 0.12 -0.08 0.09 0.00 0.00 178.44 179.00 1cdd h GLU 44 N 0.74 0.24 -0.96 1.13 4.57 -0.40 -1.04 114.58 118.86 1cdd h GLU 44 Ca 0.24 -0.01 0.17 0.00 -1.18 0.00 0.00 59.36 58.57 1cdd h GLU 44 Cb 0.01 -0.05 -0.10 0.00 -0.16 0.00 0.00 28.75 28.44 1cdd h GLU 44 CO -0.09 0.16 0.56 0.00 -1.18 0.00 0.00 179.01 178.46 1cdd h ARG 45 N 0.25 0.73 -0.39 1.92 3.08 -1.23 -1.61 114.38 117.13 1cdd h ARG 45 Ca 0.08 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 1cdd h ARG 45 Cb -0.01 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1cdd h ARG 45 CO -0.04 0.49 -0.18 0.00 -1.07 0.00 0.00 179.97 179.17 1cdd h ALA 46 N 1.61 0.96 0.17 0.04 0.00 -0.30 -2.57 119.26 119.17 1cdd h ALA 46 Ca 0.53 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1cdd h ALA 46 Cb 0.77 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1cdd h ALA 46 CO -0.36 0.61 -0.08 -0.09 0.00 0.00 0.00 179.25 179.32 1cdd h ARG 47 N 0.65 -0.22 -0.97 0.00 2.43 -0.55 0.14 114.38 115.85 1cdd h ARG 47 Ca 0.10 0.02 0.22 0.00 -0.81 0.00 0.00 59.98 59.50 1cdd h ARG 47 Cb 0.66 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 30.18 1cdd h ARG 47 CO 0.05 0.16 0.63 1.96 -1.51 0.00 0.00 179.97 181.25 1cdd h GLN 48 N -0.66 0.47 -0.54 0.20 7.50 -1.35 -0.98 115.11 119.74 1cdd h GLN 48 Ca -0.02 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.10 1cdd h GLN 48 Cb 0.48 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.91 1cdd h GLN 48 CO 0.04 0.31 0.00 0.00 -1.50 0.00 0.00 178.83 177.68 1cdd n ALA 49 N -2.46 2.68 -0.66 3.87 0.00 -0.97 -4.96 120.51 118.01 1cdd n ALA 49 Ca 0.22 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1cdd n ALA 49 Cb 0.73 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.18 1cdd n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cdd n GLY 50 N 1.01 1.49 3.76 0.00 0.00 -0.37 -5.04 105.19 106.04 1cdd n GLY 50 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1cdd n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cdd s ILE 51 N -3.59 4.56 -0.39 -0.61 1.09 0.44 -4.96 121.20 117.75 1cdd s ILE 51 Ca 0.00 1.64 -0.28 0.00 -1.10 0.00 0.00 60.65 60.91 1cdd s ILE 51 Cb 0.00 -4.11 -0.03 0.00 -1.06 0.00 0.00 42.46 37.26 1cdd s ILE 51 CO 0.00 0.45 1.93 0.00 -0.10 0.00 0.00 174.94 177.22 1cdd s ALA 52 N -0.62 2.58 0.83 9.38 0.00 -1.26 -4.23 121.76 128.43 1cdd s ALA 52 Ca 0.37 0.12 -0.11 0.00 0.00 0.00 0.00 51.96 52.34 1cdd s ALA 52 Cb -0.22 -4.12 0.09 0.00 0.00 0.00 0.00 23.12 18.88 1cdd s ALA 52 CO 0.24 -3.10 1.13 0.99 0.00 0.00 0.00 175.76 175.01 1cdd s THR 53 N 8.08 2.69 -0.23 0.00 2.01 -1.26 -1.57 115.64 125.36 1cdd s THR 53 Ca 0.82 0.24 -0.10 0.00 0.31 0.00 0.00 61.69 62.95 1cdd s THR 53 Cb -0.21 -2.53 0.09 0.00 0.01 0.00 0.00 72.50 69.86 1cdd s THR 53 CO 0.30 -0.28 0.53 -1.00 -0.69 0.00 0.00 174.62 173.48 1cdd s HIS 54 N -2.70 -0.92 -0.08 4.92 3.76 -0.47 -4.82 115.29 114.99 1cdd s HIS 54 Ca 0.65 1.77 -0.01 0.00 -0.15 0.00 0.00 55.06 57.32 1cdd s HIS 54 Cb -0.21 0.48 0.03 0.00 1.11 0.00 0.00 32.58 33.99 1cdd s HIS 54 CO 0.55 -0.49 -0.01 -0.08 -0.85 0.00 0.00 174.74 173.86 1cdd s THR 55 N 2.09 0.46 -0.25 1.30 -1.32 -1.26 -1.68 115.64 114.98 1cdd s THR 55 Ca -0.07 0.06 -0.07 0.00 -1.21 0.00 0.00 61.69 60.40 1cdd s THR 55 Cb -0.09 -0.61 -0.02 0.00 -1.51 0.00 0.00 72.50 70.27 1cdd s THR 55 CO -0.16 0.26 0.05 -0.76 -2.21 0.00 0.00 174.62 171.81 1cdd s LEU 56 N 1.94 3.36 -0.34 9.08 1.43 -0.21 -4.94 118.68 129.00 1cdd s LEU 56 Ca 0.05 -0.25 -0.13 0.00 -1.03 0.00 0.00 54.13 52.77 1cdd s LEU 56 Cb -0.12 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.19 1cdd s LEU 56 CO -0.06 -0.03 0.24 -0.63 0.23 0.00 0.00 176.35 176.10 1cdd s ILE 57 N 1.59 5.26 0.20 -0.59 1.09 -1.26 -4.15 121.20 123.34 1cdd s ILE 57 Ca 0.06 -0.26 0.08 0.00 -1.10 0.00 0.00 60.65 59.43 1cdd s ILE 57 Cb -0.15 -3.72 0.21 0.00 -1.06 0.00 0.00 42.46 37.74 1cdd s ILE 57 CO 0.02 -0.03 0.89 0.00 -0.10 0.00 0.00 174.94 175.72 1cdd n ALA 58 N 5.11 0.46 1.49 9.38 0.00 -1.26 -0.70 120.51 134.99 1cdd n ALA 58 Ca -0.13 0.59 0.12 0.00 0.00 0.00 0.00 53.44 54.02 1cdd n ALA 58 Cb 0.49 -0.52 0.71 0.00 0.00 0.00 0.00 19.45 20.13 1cdd n ALA 58 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1cdd n SER 59 N -4.44 0.00 -0.67 0.00 3.41 -1.26 -1.84 113.62 108.82 1cdd n SER 59 Ca 0.18 -0.72 0.11 0.00 -0.26 0.00 0.00 58.87 58.18 1cdd n SER 59 Cb 0.61 -0.01 0.35 0.00 -0.26 0.00 0.00 64.21 64.89 1cdd n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cdd n ALA 60 N -1.01 2.50 0.12 7.33 0.00 0.12 -4.65 120.51 124.92 1cdd n ALA 60 Ca 0.18 -0.60 0.01 0.00 0.00 0.00 0.00 53.44 53.03 1cdd n ALA 60 Cb 0.09 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.49 1cdd n ALA 60 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1cdd n PHE 61 N 0.55 0.00 0.00 0.00 3.72 -0.77 -5.05 117.46 115.91 1cdd n PHE 61 Ca 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.57 1cdd n PHE 61 Cb 0.39 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 1cdd n PHE 61 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1cdd n ASP 62 N -0.65 0.00 -4.37 4.37 8.00 -1.26 -4.63 116.55 118.01 1cdd n ASP 62 Ca 0.01 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.19 1cdd n ASP 62 Cb 0.05 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.00 1cdd n ASP 62 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1cdd s SER 63 N 0.00 3.41 0.61 -2.24 1.04 -1.26 -4.98 113.70 110.28 1cdd s SER 63 Ca 0.00 -0.37 0.30 0.00 0.48 0.00 0.00 55.95 56.36 1cdd s SER 63 Cb 0.00 -0.58 1.70 0.00 0.10 0.00 0.00 66.02 67.24 1cdd s SER 63 CO 0.00 0.32 2.07 -0.09 0.98 0.00 0.00 173.24 176.52 1cdd h ARG 64 N 5.51 0.00 -0.32 4.02 2.43 -1.95 0.17 114.38 124.24 1cdd h ARG 64 Ca -0.43 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.72 1cdd h ARG 64 Cb 1.14 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1cdd h ARG 64 CO 0.48 0.00 0.13 0.93 -1.51 0.00 0.00 179.97 180.00 1cdd h GLU 65 N 0.00 0.48 -0.53 0.20 3.07 -1.94 -2.27 114.58 113.59 1cdd h GLU 65 Ca 0.08 -0.09 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1cdd h GLU 65 Cb 0.57 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 1cdd h GLU 65 CO -0.00 0.48 0.13 0.00 -1.40 0.00 0.00 179.01 178.21 1cdd h ALA 66 N 0.98 0.70 -0.23 3.43 0.00 -1.01 -0.64 119.26 122.48 1cdd h ALA 66 Ca 0.11 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1cdd h ALA 66 Cb 0.18 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1cdd h ALA 66 CO -0.01 0.40 -0.06 -0.92 0.00 0.00 0.00 179.25 178.66 1cdd h TYR 67 N 0.75 -0.13 -0.40 0.00 5.03 -0.93 -1.41 116.97 119.86 1cdd h TYR 67 Ca 0.17 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.37 1cdd h TYR 67 Cb 0.34 0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.71 1cdd h TYR 67 CO 0.02 -0.11 -0.28 -0.44 -1.32 0.00 0.00 178.16 176.04 1cdd h ASP 68 N -0.01 0.89 -0.38 -2.11 3.32 -1.24 0.19 116.42 117.08 1cdd h ASP 68 Ca 0.11 -0.35 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 1cdd h ASP 68 Cb 0.18 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1cdd h ASP 68 CO -0.24 1.10 0.23 -0.09 -1.72 0.00 0.00 179.24 178.52 1cdd h ARG 69 N 0.73 0.52 0.12 3.56 2.43 -0.94 -0.92 114.38 119.88 1cdd h ARG 69 Ca 0.09 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1cdd h ARG 69 Cb 0.83 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1cdd h ARG 69 CO 0.07 0.39 -0.06 1.49 -1.51 0.00 0.00 179.97 180.35 1cdd h GLU 70 N 0.50 -0.15 -0.74 0.20 4.57 -0.86 -1.36 114.58 116.74 1cdd h GLU 70 Ca 0.14 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.38 1cdd h GLU 70 Cb 0.00 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.58 1cdd h GLU 70 CO -0.03 0.01 0.48 1.25 -1.18 0.00 0.00 179.01 179.55 1cdd h LEU 71 N -0.29 0.71 -0.10 1.64 5.85 -0.46 -0.77 115.31 121.88 1cdd h LEU 71 Ca -0.02 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1cdd h LEU 71 Cb 0.23 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1cdd h LEU 71 CO 0.03 0.47 -0.07 0.40 -0.34 0.00 0.00 178.44 178.93 1cdd h ILE 72 N 0.81 1.34 -0.48 4.05 2.04 -1.16 -0.67 117.51 123.44 1cdd h ILE 72 Ca 0.31 -1.15 0.08 0.00 1.00 0.00 0.00 64.86 65.10 1cdd h ILE 72 Cb 0.20 1.89 -0.10 0.00 -0.74 0.00 0.00 36.82 38.07 1cdd h ILE 72 CO -0.10 0.32 -0.43 -0.74 0.00 0.00 0.00 178.15 177.20 1cdd h HIS 73 N -0.16 -1.27 -0.08 1.37 2.76 -0.29 0.10 115.15 117.58 1cdd h HIS 73 Ca 0.02 0.07 -0.06 0.00 -2.20 0.00 0.00 60.37 58.20 1cdd h HIS 73 Cb 0.55 0.62 -0.01 0.00 1.55 0.00 0.00 27.41 30.12 1cdd h HIS 73 CO 0.08 -0.43 -0.24 0.93 -1.30 0.00 0.00 177.93 176.97 1cdd h GLU 74 N -0.29 0.13 -0.10 5.26 5.08 -1.16 -2.74 114.58 120.76 1cdd h GLU 74 Ca 0.15 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.32 1cdd h GLU 74 Cb 0.57 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1cdd h GLU 74 CO -0.62 0.36 -0.60 0.82 -1.00 0.00 0.00 179.01 177.97 1cdd h ILE 75 N 0.12 1.36 0.00 3.13 2.04 -0.14 -3.30 117.51 120.73 1cdd h ILE 75 Ca 0.02 -1.94 -0.08 0.00 1.00 0.00 0.00 64.86 63.86 1cdd h ILE 75 Cb 0.49 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.50 1cdd h ILE 75 CO 0.03 0.58 -0.37 0.44 0.00 0.00 0.00 178.15 178.83 1cdd h ASP 76 N 0.26 0.00 -0.03 1.72 3.32 -0.70 -2.08 116.42 118.92 1cdd h ASP 76 Ca -0.01 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1cdd h ASP 76 Cb 1.13 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.68 1cdd h ASP 76 CO 0.10 0.37 0.06 0.00 -1.72 0.00 0.00 179.24 178.06 1cdd h MET 77 N 0.00 0.00 -0.00 3.56 -0.00 -1.62 0.26 114.93 117.12 1cdd h MET 77 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1cdd h MET 77 Cb 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.35 1cdd h MET 77 CO 0.05 0.00 -0.14 0.66 -0.00 0.00 0.00 176.91 177.48 1cdd n TYR 78 N -3.38 0.00 -3.39 -0.10 4.01 -0.78 -4.97 117.16 108.55 1cdd n TYR 78 Ca -0.02 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.34 1cdd n TYR 78 Cb 0.14 -0.22 0.04 0.00 -0.31 0.00 0.00 39.34 38.99 1cdd n TYR 78 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1cdd n ALA 79 N -1.05 -2.22 -2.37 -0.72 0.00 0.90 -4.94 120.51 110.12 1cdd n ALA 79 Ca 0.13 0.31 -0.40 0.00 0.00 0.00 0.00 53.44 53.48 1cdd n ALA 79 Cb 0.29 -2.11 -0.05 0.00 0.00 0.00 0.00 19.45 17.58 1cdd n ALA 79 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1cdd s PRO 80 N -2.33 4.56 0.04 0.00 0.04 -1.26 -4.79 135.00 131.26 1cdd s PRO 80 Ca 0.37 1.18 0.02 0.00 0.04 0.00 0.00 61.00 62.61 1cdd s PRO 80 Cb -0.04 -3.37 -0.25 0.00 0.04 0.00 0.00 34.50 30.88 1cdd s PRO 80 CO 0.84 0.25 0.99 -0.44 0.04 0.00 0.00 177.00 178.68 1cdd h ASP 81 N 5.69 0.24 -3.46 6.66 3.32 -0.94 -3.46 116.42 124.46 1cdd h ASP 81 Ca -0.43 -0.30 -0.40 0.00 0.02 0.00 0.00 57.03 55.91 1cdd h ASP 81 Cb 1.21 -0.08 -0.34 0.00 0.22 0.00 0.00 39.33 40.34 1cdd h ASP 81 CO 0.71 1.25 -0.77 0.54 -1.72 0.00 0.00 179.24 179.25 1cdd s VAL 82 N -2.65 0.49 -0.26 -1.35 0.11 -1.20 -4.70 120.40 110.83 1cdd s VAL 82 Ca -0.05 -0.09 -0.06 0.00 -2.93 0.00 0.00 61.98 58.85 1cdd s VAL 82 Cb 0.08 -0.52 0.00 0.00 -1.53 0.00 0.00 36.38 34.41 1cdd s VAL 82 CO 0.85 0.21 0.03 0.54 -3.33 0.00 0.00 175.10 173.40 1cdd s VAL 83 N 0.94 3.77 -0.27 2.04 0.11 -0.43 -2.61 120.40 123.95 1cdd s VAL 83 Ca -0.11 -0.59 -0.09 0.00 -2.93 0.00 0.00 61.98 58.26 1cdd s VAL 83 Cb -0.14 -2.86 -0.03 0.00 -1.53 0.00 0.00 36.38 31.82 1cdd s VAL 83 CO -0.00 0.22 0.13 0.68 -3.33 0.00 0.00 175.10 172.80 1cdd s VAL 84 N 1.50 4.77 -0.04 2.04 -7.23 -0.85 -2.30 120.40 118.28 1cdd s VAL 84 Ca 0.04 -0.08 -0.28 0.00 -1.81 0.00 0.00 61.98 59.84 1cdd s VAL 84 Cb -0.16 -3.29 -0.03 0.00 0.56 0.00 0.00 36.38 33.47 1cdd s VAL 84 CO 0.01 0.25 0.92 -0.76 -0.31 0.00 0.00 175.10 175.20 1cdd s LEU 85 N 1.67 4.33 -0.53 1.32 1.43 -0.49 -1.01 118.68 125.40 1cdd s LEU 85 Ca 0.06 1.52 0.04 0.00 -1.03 0.00 0.00 54.13 54.72 1cdd s LEU 85 Cb -0.16 -3.45 0.16 0.00 0.03 0.00 0.00 46.19 42.77 1cdd s LEU 85 CO 0.07 -0.27 0.36 0.00 0.23 0.00 0.00 176.35 176.75 1cdd s ALA 86 N 1.19 2.56 0.00 4.21 0.00 -0.64 -4.18 121.76 124.90 1cdd s ALA 86 Ca 0.48 -3.02 0.00 0.00 0.00 0.00 0.00 51.96 49.42 1cdd s ALA 86 Cb -0.20 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.02 1cdd s ALA 86 CO 0.24 -2.05 0.00 0.41 0.00 0.00 0.00 175.76 174.36 1cdd n GLY 87 N 2.75 0.52 3.58 0.00 0.00 -1.26 -4.36 105.19 106.41 1cdd n GLY 87 Ca 0.19 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1cdd n GLY 87 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1cdd s PHE 88 N -2.00 2.30 -1.21 1.61 5.36 -1.26 -2.64 117.98 120.14 1cdd s PHE 88 Ca 0.00 0.47 -0.16 0.00 -0.96 0.00 0.00 56.93 56.28 1cdd s PHE 88 Cb 0.00 -4.40 0.13 0.00 -0.34 0.00 0.00 43.02 38.41 1cdd s PHE 88 CO 0.00 -1.96 1.51 -1.64 -1.46 0.00 0.00 175.22 171.68 1cdd s MET 89 N 5.47 4.01 0.01 10.12 -1.94 -1.26 -4.93 119.30 130.77 1cdd s MET 89 Ca 0.52 -2.29 -0.00 0.00 -1.71 0.00 0.00 55.69 52.21 1cdd s MET 89 Cb -0.11 -5.22 -0.01 0.00 2.01 0.00 0.00 34.83 31.50 1cdd s MET 89 CO 0.25 -1.94 -0.01 0.50 -0.01 0.00 0.00 175.02 173.80 1cdd s ARG 90 N 2.62 0.26 -0.39 2.03 3.52 -1.26 -5.02 118.95 120.72 1cdd s ARG 90 Ca 0.46 -0.48 -0.24 0.00 -0.13 0.00 0.00 55.73 55.34 1cdd s ARG 90 Cb -0.01 0.09 0.02 0.00 -1.56 0.00 0.00 34.95 33.49 1cdd s ARG 90 CO 0.02 -0.04 0.84 0.42 -0.81 0.00 0.00 175.30 175.72 1cdd s ILE 91 N -1.17 4.65 0.50 4.11 1.01 -1.26 -5.03 121.20 124.01 1cdd s ILE 91 Ca -0.13 0.89 -0.21 0.00 0.00 0.00 0.00 60.65 61.20 1cdd s ILE 91 Cb -0.08 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 38.04 1cdd s ILE 91 CO -0.01 -0.55 1.15 -0.76 0.00 0.00 0.00 174.94 174.77 1cdd s LEU 92 N 3.31 3.90 0.46 2.97 1.43 -1.26 -5.08 118.68 124.41 1cdd s LEU 92 Ca 0.34 2.25 -0.03 0.00 -1.03 0.00 0.00 54.13 55.65 1cdd s LEU 92 Cb -0.12 -4.39 -0.03 0.00 0.03 0.00 0.00 46.19 41.68 1cdd s LEU 92 CO 0.19 -1.05 0.74 -0.94 0.23 0.00 0.00 176.35 175.53 1cdd s SER 93 N -1.54 6.13 -0.14 2.29 1.04 -1.26 -4.68 113.70 115.53 1cdd s SER 93 Ca 0.68 0.73 -0.29 0.00 0.48 0.00 0.00 55.95 57.54 1cdd s SER 93 Cb -0.26 -2.05 -0.01 0.00 0.10 0.00 0.00 66.02 63.79 1cdd s SER 93 CO 0.31 -0.60 1.08 -2.16 0.98 0.00 0.00 173.24 172.86 1cdd s PRO 94 N -4.67 4.34 0.00 4.02 0.04 -1.26 -2.42 135.00 135.05 1cdd s PRO 94 Ca 0.47 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1cdd s PRO 94 Cb -0.10 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.84 1cdd s PRO 94 CO 0.42 -0.49 0.00 0.00 0.04 0.00 0.00 177.00 176.98 1cdd n ALA 95 N 5.65 0.00 0.44 8.56 0.00 -1.26 -4.88 120.51 129.01 1cdd n ALA 95 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.36 1cdd n ALA 95 Cb 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.83 1cdd n ALA 95 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1cdd h PHE 96 N 0.00 -1.02 -0.61 0.00 3.04 -1.91 -0.72 116.94 115.72 1cdd h PHE 96 Ca 0.00 -0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.91 1cdd h PHE 96 Cb 0.00 0.34 -0.03 0.00 2.56 0.00 0.00 35.95 38.82 1cdd h PHE 96 CO 0.00 -0.63 0.31 -0.39 -2.02 0.00 0.00 178.31 175.59 1cdd h VAL 97 N -1.19 1.19 -0.73 1.41 -1.51 -1.82 -1.44 116.25 112.16 1cdd h VAL 97 Ca -0.11 -0.51 -0.07 0.00 -1.23 0.00 0.00 66.70 64.78 1cdd h VAL 97 Cb 0.86 0.39 -0.03 0.00 -2.13 0.00 0.00 31.29 30.38 1cdd h VAL 97 CO 0.19 0.22 0.19 0.28 -1.23 0.00 0.00 177.57 177.22 1cdd h SER 98 N 0.85 1.09 -0.41 4.19 0.02 -1.82 -0.45 113.55 117.02 1cdd h SER 98 Ca 0.22 -0.22 -0.12 0.00 -0.84 0.00 0.00 61.79 60.82 1cdd h SER 98 Cb 0.05 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1cdd h SER 98 CO -0.03 1.03 -0.22 -0.74 -1.14 0.00 0.00 176.83 175.73 1cdd h HIS 99 N 1.09 1.01 -0.61 3.45 6.17 -0.12 -3.19 115.15 122.94 1cdd h HIS 99 Ca 0.23 -0.26 0.00 0.00 0.71 0.00 0.00 60.37 61.05 1cdd h HIS 99 Cb 0.35 -0.23 0.00 0.00 2.52 0.00 0.00 27.41 30.06 1cdd h HIS 99 CO 0.03 1.04 0.00 0.66 0.71 0.00 0.00 177.93 180.37 1cdd n TYR 100 N -4.20 1.09 0.00 5.26 4.01 -0.70 -4.96 117.16 117.65 1cdd n TYR 100 Ca -0.01 -0.56 0.00 0.00 -0.16 0.00 0.00 57.90 57.16 1cdd n TYR 100 Cb 0.45 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 1cdd n TYR 100 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1cdd n ALA 101 N 1.15 0.00 -1.59 -0.72 0.00 -0.22 -0.22 120.51 118.92 1cdd n ALA 101 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.63 1cdd n ALA 101 Cb 0.71 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.33 1cdd n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cdd n GLY 102 N 0.00 5.24 0.02 0.00 0.00 -1.26 -4.13 105.19 105.07 1cdd n GLY 102 Ca 0.00 -1.49 0.01 0.00 0.00 0.00 0.00 46.02 44.54 1cdd n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cdd n ARG 103 N -1.06 1.20 -2.54 1.61 1.74 0.70 -4.70 116.66 113.61 1cdd n ARG 103 Ca 0.30 -0.05 -0.43 0.00 -0.77 0.00 0.00 57.85 56.89 1cdd n ARG 103 Cb 0.88 -1.23 -0.02 0.00 -1.02 0.00 0.00 32.46 31.07 1cdd n ARG 103 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1cdd s LEU 104 N -4.07 3.84 0.09 0.55 2.96 -0.41 -1.32 118.68 120.33 1cdd s LEU 104 Ca -0.04 0.99 0.03 0.00 -0.22 0.00 0.00 54.13 54.89 1cdd s LEU 104 Cb 0.05 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 1cdd s LEU 104 CO 0.39 -1.05 0.10 -0.76 -1.32 0.00 0.00 176.35 173.70 1cdd s LEU 105 N 4.15 3.83 0.04 -0.68 1.43 -0.97 -1.51 118.68 124.96 1cdd s LEU 105 Ca 0.51 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.53 1cdd s LEU 105 Cb -0.13 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 1cdd s LEU 105 CO 0.22 0.15 0.12 0.21 0.23 0.00 0.00 176.35 177.29 1cdd s ASN 106 N -2.51 0.14 0.07 2.29 3.04 -0.88 -1.40 114.94 115.68 1cdd s ASN 106 Ca 0.30 -0.48 0.07 0.00 0.04 0.00 0.00 52.86 52.79 1cdd s ASN 106 Cb -0.12 0.24 -0.03 0.00 -1.54 0.00 0.00 41.25 39.80 1cdd s ASN 106 CO 0.22 -0.51 -0.18 -0.51 -3.04 0.00 0.00 177.10 173.08 1cdd s ILE 107 N -2.54 1.45 0.02 -5.21 1.10 -1.26 -1.38 121.20 113.39 1cdd s ILE 107 Ca -0.05 -1.29 0.02 0.00 -0.51 0.00 0.00 60.65 58.82 1cdd s ILE 107 Cb -0.01 -1.31 -0.01 0.00 0.15 0.00 0.00 42.46 41.27 1cdd s ILE 107 CO -0.04 -0.01 -0.08 -1.00 -2.11 0.00 0.00 174.94 171.70 1cdd s HIS 108 N -1.02 0.68 -0.92 3.50 3.76 -1.12 -4.89 115.29 115.29 1cdd s HIS 108 Ca 0.04 -0.30 -0.14 0.00 -0.15 0.00 0.00 55.06 54.51 1cdd s HIS 108 Cb -0.09 -0.42 -0.10 0.00 1.11 0.00 0.00 32.58 33.08 1cdd s HIS 108 CO 0.03 -0.03 2.06 -2.30 -0.85 0.00 0.00 174.74 173.64 1cdd n PRO 109 N 2.18 1.93 0.00 8.40 -0.02 -1.26 -1.99 135.00 144.24 1cdd n PRO 109 Ca -0.18 -1.77 0.00 0.00 -2.02 0.00 0.00 63.50 59.54 1cdd n PRO 109 Cb 0.56 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1cdd n PRO 109 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cdd n GLY 133 N 4.15 1.00 0.87 -1.23 0.00 -1.26 -5.06 105.19 103.66 1cdd n GLY 133 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1cdd n GLY 133 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1cdd n THR 134 N 0.00 0.00 -3.60 2.61 -2.24 -0.84 -4.31 114.28 105.90 1cdd n THR 134 Ca 0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 1cdd n THR 134 Cb 0.12 -0.58 -0.16 0.00 -2.10 0.00 0.00 70.33 67.62 1cdd n THR 134 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1cdd s SER 135 N 0.00 1.69 0.12 3.42 1.04 -1.21 -0.16 113.70 118.60 1cdd s SER 135 Ca 0.00 -0.27 -0.05 0.00 0.48 0.00 0.00 55.95 56.11 1cdd s SER 135 Cb 0.00 0.00 -0.05 0.00 0.10 0.00 0.00 66.02 66.07 1cdd s SER 135 CO 0.00 -0.31 0.36 0.54 0.98 0.00 0.00 173.24 174.80 1cdd s VAL 136 N 2.21 5.19 0.03 5.02 0.11 0.88 -2.78 120.40 131.06 1cdd s VAL 136 Ca 0.04 0.05 -0.07 0.00 -2.93 0.00 0.00 61.98 59.07 1cdd s VAL 136 Cb -0.15 -3.62 -0.00 0.00 -1.53 0.00 0.00 36.38 31.08 1cdd s VAL 136 CO -0.08 0.10 0.14 -1.38 -3.33 0.00 0.00 175.10 170.54 1cdd s HIS 137 N -1.59 0.11 -0.35 1.54 -3.43 -0.48 -0.51 115.29 110.59 1cdd s HIS 137 Ca 0.39 -0.33 -0.28 0.00 -0.80 0.00 0.00 55.06 54.03 1cdd s HIS 137 Cb -0.12 -0.08 -0.01 0.00 -1.43 0.00 0.00 32.58 30.93 1cdd s HIS 137 CO 0.23 -0.36 1.75 -0.06 -2.00 0.00 0.00 174.74 174.31 1cdd s PHE 138 N -2.22 1.88 -0.36 0.38 0.08 -0.26 -2.06 117.98 115.41 1cdd s PHE 138 Ca -0.08 0.63 -0.29 0.00 0.12 0.00 0.00 56.93 57.31 1cdd s PHE 138 Cb -0.03 -4.15 -0.00 0.00 -0.57 0.00 0.00 43.02 38.27 1cdd s PHE 138 CO -0.02 -2.82 1.52 0.08 -0.10 0.00 0.00 175.22 173.88 1cdd s VAL 139 N 6.74 3.79 -1.54 -0.44 1.01 -0.57 -3.74 120.40 125.65 1cdd s VAL 139 Ca 0.77 0.82 0.14 0.00 0.00 0.00 0.00 61.98 63.71 1cdd s VAL 139 Cb -0.21 -4.01 0.22 0.00 0.00 0.00 0.00 36.38 32.38 1cdd s VAL 139 CO 0.33 -0.61 1.09 0.41 0.00 0.00 0.00 175.10 176.33 1cdd n THR 140 N 7.04 0.38 -2.33 3.92 -1.04 0.25 -4.80 114.28 117.71 1cdd n THR 140 Ca 0.18 -0.69 -0.03 0.00 -2.04 0.00 0.00 64.05 61.47 1cdd n THR 140 Cb 0.47 0.99 0.01 0.00 -1.82 0.00 0.00 70.33 69.98 1cdd n THR 140 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1cdd n ASP 141 N 0.79 -0.51 0.00 8.00 5.68 -0.98 -4.95 116.55 124.58 1cdd n ASP 141 Ca 0.11 -2.05 0.00 0.00 -0.50 0.00 0.00 54.79 52.34 1cdd n ASP 141 Cb 0.40 0.21 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 1cdd n ASP 141 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1cdd n GLU 142 N -0.34 0.00 -2.64 0.11 0.28 -1.26 -4.47 120.64 112.32 1cdd n GLU 142 Ca -0.16 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.75 1cdd n GLU 142 Cb 0.84 -3.89 0.03 0.00 1.43 0.00 0.00 31.44 29.85 1cdd n GLU 142 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1cdd n LEU 143 N 0.00 2.22 -3.84 -1.84 4.32 -1.26 -4.74 117.00 111.86 1cdd n LEU 143 Ca 0.00 -3.71 -0.29 0.00 -0.02 0.00 0.00 56.01 51.99 1cdd n LEU 143 Cb 0.00 0.27 -0.05 0.00 -1.62 0.00 0.00 43.42 42.02 1cdd n LEU 143 CO 0.00 1.48 -0.11 -0.67 -1.22 0.00 0.00 177.39 176.87 1cdd n ASP 144 N -0.39 -1.52 -4.91 -1.43 2.03 -1.26 -4.93 116.55 104.13 1cdd n ASP 144 Ca 0.15 -0.71 -0.30 0.00 0.52 0.00 0.00 54.79 54.46 1cdd n ASP 144 Cb 0.81 -1.37 -0.04 0.00 -0.72 0.00 0.00 41.12 39.80 1cdd n ASP 144 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1cdd s GLY 145 N -2.80 2.06 0.00 0.27 0.00 -1.26 -4.91 107.32 100.69 1cdd s GLY 145 Ca 0.57 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.62 1cdd s GLY 145 CO 0.70 -0.60 0.00 0.61 0.00 0.00 0.00 173.10 173.81 1cdd n GLY 146 N -0.21 1.10 3.62 0.20 0.00 -1.25 0.86 105.19 109.52 1cdd n GLY 146 Ca -0.03 -1.04 -0.49 0.00 0.00 0.00 0.00 46.02 44.45 1cdd n GLY 146 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cdd n PRO 147 N -0.67 1.82 -2.89 1.61 -0.04 -1.25 -4.65 135.00 128.93 1cdd n PRO 147 Ca 0.00 0.62 -0.40 0.00 -0.04 0.00 0.00 63.50 63.68 1cdd n PRO 147 Cb 0.00 -2.62 -0.06 0.00 -0.04 0.00 0.00 33.50 30.78 1cdd n PRO 147 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1cdd s VAL 148 N 5.26 4.27 -0.24 0.52 -7.23 -1.26 -1.10 120.40 120.62 1cdd s VAL 148 Ca 0.98 1.85 -0.01 0.00 -1.81 0.00 0.00 61.98 62.99 1cdd s VAL 148 Cb -0.72 -4.21 -0.18 0.00 0.56 0.00 0.00 36.38 31.82 1cdd s VAL 148 CO 0.51 0.50 -0.14 -0.38 -0.31 0.00 0.00 175.10 175.28 1cdd n ILE 149 N 1.63 1.54 -3.65 -0.62 5.41 0.33 -3.92 119.36 120.08 1cdd n ILE 149 Ca -0.04 -0.56 -0.14 0.00 1.00 0.00 0.00 62.75 63.01 1cdd n ILE 149 Cb 0.48 -1.51 -0.08 0.00 -0.71 0.00 0.00 39.64 37.82 1cdd n ILE 149 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1cdd s LEU 150 N -6.70 -0.23 0.05 1.39 2.96 -1.07 -3.64 118.68 111.44 1cdd s LEU 150 Ca -0.33 1.02 0.07 0.00 -0.22 0.00 0.00 54.13 54.66 1cdd s LEU 150 Cb 0.09 2.05 -0.03 0.00 0.50 0.00 0.00 46.19 48.81 1cdd s LEU 150 CO 0.62 -0.30 -0.20 -1.10 -1.32 0.00 0.00 176.35 174.06 1cdd s GLN 151 N -0.09 1.26 -0.06 1.98 -0.21 -1.26 -0.08 119.66 121.20 1cdd s GLN 151 Ca -0.03 -0.95 -0.03 0.00 0.02 0.00 0.00 55.36 54.37 1cdd s GLN 151 Cb -0.04 -1.39 0.03 0.00 1.00 0.00 0.00 33.01 32.62 1cdd s GLN 151 CO 0.03 0.35 0.14 0.00 -2.12 0.00 0.00 175.29 173.68 1cdd s ALA 152 N -0.87 -0.28 0.05 6.09 0.00 0.78 -4.85 121.76 122.67 1cdd s ALA 152 Ca 0.06 0.58 0.05 0.00 0.00 0.00 0.00 51.96 52.65 1cdd s ALA 152 Cb -0.09 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 1cdd s ALA 152 CO 0.02 -0.13 -0.07 -1.59 0.00 0.00 0.00 175.76 174.00 1cdd s LYS 153 N 0.83 2.42 0.00 0.00 -2.85 -1.26 -4.10 119.74 114.78 1cdd s LYS 153 Ca -0.06 -0.83 0.04 0.00 -1.00 0.00 0.00 55.97 54.12 1cdd s LYS 153 Cb -0.08 -2.45 -0.03 0.00 -2.06 0.00 0.00 37.83 33.21 1cdd s LYS 153 CO -0.04 0.56 -0.10 0.14 0.10 0.00 0.00 175.35 176.01 1cdd s VAL 154 N -1.11 3.40 -0.02 1.79 -7.23 -1.26 -5.09 120.40 110.88 1cdd s VAL 154 Ca 0.20 -0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 59.22 1cdd s VAL 154 Cb -0.11 -2.45 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 1cdd s VAL 154 CO 0.11 0.41 1.25 -2.16 -0.31 0.00 0.00 175.10 174.40 1cdd s PRO 155 N -1.32 4.35 -0.02 4.82 0.04 -1.26 -5.05 135.00 136.57 1cdd s PRO 155 Ca 0.16 1.77 -0.17 0.00 0.04 0.00 0.00 61.00 62.79 1cdd s PRO 155 Cb -0.11 -3.52 -0.05 0.00 0.04 0.00 0.00 34.50 30.86 1cdd s PRO 155 CO 0.06 -0.44 0.47 0.54 0.04 0.00 0.00 177.00 177.67 1cdd s VAL 156 N 2.03 5.00 0.43 -0.36 0.11 -1.26 -5.02 120.40 121.33 1cdd s VAL 156 Ca 0.58 0.97 0.07 0.00 -2.93 0.00 0.00 61.98 60.68 1cdd s VAL 156 Cb -0.27 -3.79 -0.02 0.00 -1.53 0.00 0.00 36.38 30.77 1cdd s VAL 156 CO 0.24 0.50 0.35 -0.36 -3.33 0.00 0.00 175.10 172.50 1cdd s PHE 157 N -0.58 2.54 -0.31 1.54 0.40 -1.26 -5.06 117.98 115.26 1cdd s PHE 157 Ca 0.26 -0.56 -0.32 0.00 -0.60 0.00 0.00 56.93 55.71 1cdd s PHE 157 Cb -0.17 -2.10 -0.09 0.00 0.51 0.00 0.00 43.02 41.17 1cdd s PHE 157 CO 0.14 -0.12 2.21 0.00 0.70 0.00 0.00 175.22 178.16 1cdd n ALA 158 N -1.52 1.34 -0.11 5.36 0.00 -1.26 -2.63 120.51 121.70 1cdd n ALA 158 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1cdd n ALA 158 Cb 0.63 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.37 1cdd n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cdd n GLY 159 N 6.25 0.84 3.77 0.00 0.00 -1.26 -5.05 105.19 109.74 1cdd n GLY 159 Ca 0.37 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.04 1cdd n GLY 159 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cdd s ASP 160 N -2.28 5.84 0.52 1.61 1.01 -1.08 -5.04 116.67 117.26 1cdd s ASP 160 Ca 0.00 2.20 -0.05 0.00 0.71 0.00 0.00 52.55 55.41 1cdd s ASP 160 Cb 0.00 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 1cdd s ASP 160 CO 0.00 -1.14 0.82 -0.94 0.21 0.00 0.00 175.17 174.13 1cdd s SER 161 N -1.69 5.93 0.28 0.27 1.04 -1.26 -4.93 113.70 113.34 1cdd s SER 161 Ca 0.71 0.77 -0.00 0.00 0.48 0.00 0.00 55.95 57.90 1cdd s SER 161 Cb -0.25 -1.94 0.49 0.00 0.10 0.00 0.00 66.02 64.42 1cdd s SER 161 CO 0.28 -0.80 1.86 -0.08 0.98 0.00 0.00 173.24 175.49 1cdd h GLU 162 N 0.07 1.05 0.71 4.02 4.81 -1.99 -1.31 114.58 121.94 1cdd h GLU 162 Ca -0.46 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 1cdd h GLU 162 Cb 1.23 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 30.38 1cdd h GLU 162 CO 0.61 0.70 -0.34 0.22 -0.73 0.00 0.00 179.01 179.46 1cdd h ASP 163 N 1.08 -0.81 -1.18 1.04 3.58 -1.98 -0.44 116.42 117.71 1cdd h ASP 163 Ca 0.46 0.02 0.40 0.00 0.42 0.00 0.00 57.03 58.33 1cdd h ASP 163 Cb 0.32 0.21 -0.14 0.00 1.72 0.00 0.00 39.33 41.44 1cdd h ASP 163 CO -0.21 -0.56 0.73 0.44 -2.88 0.00 0.00 179.24 176.76 1cdd h ASP 164 N -1.00 0.33 0.31 2.28 3.32 -1.79 0.14 116.42 120.01 1cdd h ASP 164 Ca -0.10 0.17 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1cdd h ASP 164 Cb 0.74 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1cdd h ASP 164 CO 0.16 -0.20 -0.15 0.40 -1.72 0.00 0.00 179.24 177.73 1cdd h ILE 165 N 0.14 0.27 -0.84 0.35 1.08 -1.05 -2.97 117.51 114.48 1cdd h ILE 165 Ca 0.79 -0.78 0.16 0.00 -0.39 0.00 0.00 64.86 64.65 1cdd h ILE 165 Cb 2.27 0.44 -0.06 0.00 -3.07 0.00 0.00 36.82 36.40 1cdd h ILE 165 CO -0.51 0.07 0.55 0.74 -0.69 0.00 0.00 178.15 178.31 1cdd h THR 166 N -1.05 0.77 -0.09 -0.27 2.02 0.90 0.79 112.91 115.98 1cdd h THR 166 Ca -0.04 -0.17 -0.19 0.00 0.77 0.00 0.00 66.41 66.78 1cdd h THR 166 Cb 0.43 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1cdd h THR 166 CO 0.07 0.09 -0.73 0.00 0.37 0.00 0.00 175.52 175.32 1cdd h ALA 167 N 1.62 0.57 -1.01 6.16 0.00 -1.08 0.61 119.26 126.13 1cdd h ALA 167 Ca 0.42 -0.60 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1cdd h ALA 167 Cb 0.91 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 1cdd h ALA 167 CO -0.16 0.75 0.66 -0.09 0.00 0.00 0.00 179.25 180.41 1cdd h ARG 168 N 0.31 1.21 0.80 0.00 2.43 -0.72 -0.53 114.38 117.87 1cdd h ARG 168 Ca -0.03 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 1cdd h ARG 168 Cb 1.31 -0.27 0.01 0.00 -0.42 0.00 0.00 29.97 30.59 1cdd h ARG 168 CO 0.13 0.80 -0.38 0.28 -1.51 0.00 0.00 179.97 179.28 1cdd h VAL 169 N 1.24 0.00 -0.99 0.20 2.07 -1.18 -2.62 116.25 114.98 1cdd h VAL 169 Ca 0.41 -0.06 0.31 0.00 0.82 0.00 0.00 66.70 68.19 1cdd h VAL 169 Cb 0.05 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.64 1cdd h VAL 169 CO -0.14 0.00 0.19 1.56 0.02 0.00 0.00 177.57 179.20 1cdd h GLN 170 N -1.13 0.02 -0.54 1.57 4.20 -0.57 0.01 115.11 118.67 1cdd h GLN 170 Ca -0.11 -0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.52 1cdd h GLN 170 Cb 0.82 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 1cdd h GLN 170 CO 0.18 0.02 0.01 1.79 -0.67 0.00 0.00 178.83 180.16 1cdd h THR 171 N 0.03 1.26 -0.93 -0.54 1.35 -1.08 -1.66 112.91 111.35 1cdd h THR 171 Ca 0.67 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 1cdd h THR 171 Cb 1.52 0.90 -0.05 0.00 -1.73 0.00 0.00 68.15 68.79 1cdd h THR 171 CO -0.86 0.39 0.59 1.56 -0.25 0.00 0.00 175.52 176.95 1cdd h GLN 172 N 0.82 1.25 -0.42 4.72 1.08 -0.64 -2.55 115.11 119.37 1cdd h GLN 172 Ca 0.15 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1cdd h GLN 172 Cb 0.52 -0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 1cdd h GLN 172 CO 0.03 0.85 0.27 0.93 -0.95 0.00 0.00 178.83 179.96 1cdd h GLU 173 N 1.27 0.56 0.00 1.46 5.08 -0.61 0.20 114.58 122.55 1cdd h GLU 173 Ca 0.34 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1cdd h GLU 173 Cb -0.10 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1cdd h GLU 173 CO -0.07 0.38 0.00 0.45 -1.00 0.00 0.00 179.01 178.78 1cdd h HIS 174 N 0.57 0.00 0.00 4.33 3.86 -1.06 0.71 115.15 123.57 1cdd h HIS 174 Ca 0.15 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 58.99 1cdd h HIS 174 Cb -0.05 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.35 1cdd h HIS 174 CO -0.04 0.00 -2.37 0.00 0.86 0.00 0.00 177.93 176.38 1cdd n ALA 175 N -1.86 1.48 -0.05 2.45 0.00 0.32 -4.56 120.51 118.28 1cdd n ALA 175 Ca -0.01 -1.25 -0.21 0.00 0.00 0.00 0.00 53.44 51.98 1cdd n ALA 175 Cb 0.10 -0.20 -0.13 0.00 0.00 0.00 0.00 19.45 19.22 1cdd n ALA 175 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1cdd h ILE 176 N 0.00 1.02 -0.52 0.00 5.03 -0.43 -3.33 117.51 119.28 1cdd h ILE 176 Ca -0.54 -2.28 -0.02 0.00 -0.12 0.00 0.00 64.86 61.89 1cdd h ILE 176 Cb 2.15 2.54 -0.02 0.00 -3.03 0.00 0.00 36.82 38.46 1cdd h ILE 176 CO 0.01 0.53 0.25 0.22 -0.68 0.00 0.00 178.15 178.47 1cdd h TYR 177 N -0.67 0.76 0.59 1.37 5.03 -1.07 -1.92 116.97 121.05 1cdd h TYR 177 Ca -0.30 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 60.94 1cdd h TYR 177 Cb 1.49 -0.23 -0.00 0.00 1.55 0.00 0.00 36.73 39.54 1cdd h TYR 177 CO 0.13 0.60 -0.35 -1.35 -1.32 0.00 0.00 178.16 175.86 1cdd h PRO 178 N 0.70 -0.85 -0.84 1.82 0.11 -1.78 -1.55 132.00 129.61 1cdd h PRO 178 Ca 0.18 0.06 0.20 0.00 0.11 0.00 0.00 66.00 66.54 1cdd h PRO 178 Cb 0.13 0.19 -0.15 0.00 0.11 0.00 0.00 31.00 31.28 1cdd h PRO 178 CO -0.02 -0.57 -0.02 1.25 -0.21 0.00 0.00 178.00 178.43 1cdd h LEU 179 N -0.88 -0.45 -0.60 2.35 5.85 -1.60 0.41 115.31 120.39 1cdd h LEU 179 Ca -0.07 0.23 -0.09 0.00 0.84 0.00 0.00 57.88 58.78 1cdd h LEU 179 Cb 0.71 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1cdd h LEU 179 CO 0.08 -0.24 0.02 0.58 -0.34 0.00 0.00 178.44 178.54 1cdd h VAL 180 N 0.07 1.26 -0.07 1.05 2.07 -1.16 -0.87 116.25 118.60 1cdd h VAL 180 Ca 0.46 -1.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 1cdd h VAL 180 Cb 0.84 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1cdd h VAL 180 CO -0.77 0.41 -0.22 0.40 0.02 0.00 0.00 177.57 177.42 1cdd h ILE 181 N 0.94 1.19 0.28 4.57 2.04 0.69 -2.81 117.51 124.41 1cdd h ILE 181 Ca 0.17 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.14 1cdd h ILE 181 Cb 0.54 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 1cdd h ILE 181 CO 0.03 0.26 -0.30 0.28 0.00 0.00 0.00 178.15 178.42 1cdd h SER 182 N 0.11 -0.83 -0.65 1.72 0.02 0.67 -0.52 113.55 114.08 1cdd h SER 182 Ca 0.02 0.08 0.18 0.00 -0.84 0.00 0.00 61.79 61.23 1cdd h SER 182 Cb 0.45 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 1cdd h SER 182 CO 0.03 -0.43 0.46 -0.50 -1.14 0.00 0.00 176.83 175.25 1cdd h TRP 183 N -0.62 0.04 0.15 3.45 6.55 -1.09 -1.89 115.95 122.54 1cdd h TRP 183 Ca -0.01 0.00 -0.26 0.00 0.95 0.00 0.00 58.89 59.57 1cdd h TRP 183 Cb 0.58 -0.01 0.03 0.00 -0.86 0.00 0.00 29.16 28.90 1cdd h TRP 183 CO -0.20 0.01 -1.11 0.35 -1.05 0.00 0.00 178.44 176.45 1cdd h PHE 184 N 0.03 0.83 -1.52 0.49 3.57 -1.09 -2.28 116.94 116.97 1cdd h PHE 184 Ca 0.31 -0.56 -0.72 0.00 3.53 0.00 0.00 57.97 60.52 1cdd h PHE 184 Cb 1.19 -0.05 -0.19 0.00 2.79 0.00 0.00 35.95 39.69 1cdd h PHE 184 CO -0.00 1.42 1.59 0.00 -2.23 0.00 0.00 178.31 179.08 1cdd n ALA 185 N -2.68 6.53 -0.19 2.41 0.00 -0.29 -1.53 120.51 124.76 1cdd n ALA 185 Ca -0.14 -4.07 0.00 0.00 0.00 0.00 0.00 53.44 49.23 1cdd n ALA 185 Cb 0.93 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.94 1cdd n ALA 185 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1cdd n ASP 186 N 0.88 0.00 0.00 0.00 9.92 -1.20 -4.29 116.55 121.86 1cdd n ASP 186 Ca 0.55 -0.07 0.00 0.00 -0.53 0.00 0.00 54.79 54.75 1cdd n ASP 186 Cb 0.30 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 1cdd n ASP 186 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1cdd n GLY 187 N 0.00 2.10 0.35 0.44 0.00 -0.58 -4.79 105.19 102.71 1cdd n GLY 187 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1cdd n GLY 187 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1cdd h ARG 188 N 0.68 0.00 -5.08 1.61 3.08 -1.71 -3.42 114.38 109.54 1cdd h ARG 188 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1cdd h ARG 188 Cb 0.00 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 29.73 1cdd h ARG 188 CO 0.00 0.00 -0.84 -1.17 -1.07 0.00 0.00 179.97 176.89 1cdd s LEU 189 N -5.87 1.87 0.20 3.04 2.96 -0.89 -3.04 118.68 116.94 1cdd s LEU 189 Ca -0.03 -0.39 -0.09 0.00 -0.22 0.00 0.00 54.13 53.40 1cdd s LEU 189 Cb 0.08 -1.04 -0.01 0.00 0.50 0.00 0.00 46.19 45.72 1cdd s LEU 189 CO 0.27 0.12 0.32 -0.75 -1.32 0.00 0.00 176.35 174.99 1cdd s LYS 190 N 0.31 1.29 -0.30 1.98 2.47 -0.40 -4.72 119.74 120.38 1cdd s LYS 190 Ca -0.11 -1.27 -0.01 0.00 -1.56 0.00 0.00 55.97 53.02 1cdd s LYS 190 Cb -0.15 0.39 0.10 0.00 -1.46 0.00 0.00 37.83 36.71 1cdd s LYS 190 CO 0.04 -0.49 0.09 1.41 0.16 0.00 0.00 175.35 176.57 1cdd s MET 191 N -4.01 0.65 -0.24 4.03 1.75 -1.26 -0.95 119.30 119.27 1cdd s MET 191 Ca 0.22 -0.94 -0.11 0.00 -1.25 0.00 0.00 55.69 53.62 1cdd s MET 191 Cb 0.03 -1.90 -0.05 0.00 2.84 0.00 0.00 34.83 35.75 1cdd s MET 191 CO 0.05 -0.95 0.16 -1.01 -0.65 0.00 0.00 175.02 172.62 1cdd s HIS 192 N 1.70 3.32 -0.02 4.11 3.76 -1.10 -4.77 115.29 122.29 1cdd s HIS 192 Ca 0.08 0.24 -0.02 0.00 -0.15 0.00 0.00 55.06 55.22 1cdd s HIS 192 Cb -0.17 -2.27 0.00 0.00 1.11 0.00 0.00 32.58 31.25 1cdd s HIS 192 CO -0.25 0.08 0.03 -1.91 -0.85 0.00 0.00 174.74 171.84 1cdd n GLU 193 N 4.25 -0.15 -3.41 1.40 2.13 -1.26 -1.75 120.64 121.86 1cdd n GLU 193 Ca -0.15 0.22 -0.20 0.00 0.66 0.00 0.00 57.16 57.69 1cdd n GLU 193 Cb 0.52 -0.29 -0.03 0.00 0.27 0.00 0.00 31.44 31.91 1cdd n GLU 193 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1cdd n ASN 194 N 1.30 -1.94 -3.89 4.31 3.02 -1.26 -4.91 115.26 111.88 1cdd n ASN 194 Ca -0.00 -0.32 -0.20 0.00 -0.03 0.00 0.00 54.58 54.03 1cdd n ASN 194 Cb 0.13 -1.71 -0.16 0.00 -0.61 0.00 0.00 39.78 37.43 1cdd n ASN 194 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1cdd s ALA 195 N -2.66 0.72 -0.11 5.41 0.00 -0.72 -4.48 121.76 119.93 1cdd s ALA 195 Ca 0.38 -0.09 -0.22 0.00 0.00 0.00 0.00 51.96 52.04 1cdd s ALA 195 Cb -0.22 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 1cdd s ALA 195 CO 0.47 -0.04 0.63 0.00 0.00 0.00 0.00 175.76 176.82 1cdd s ALA 196 N 0.96 3.42 -0.10 0.00 0.00 -1.26 -2.69 121.76 122.10 1cdd s ALA 196 Ca -0.10 -0.04 0.04 0.00 0.00 0.00 0.00 51.96 51.85 1cdd s ALA 196 Cb -0.14 -2.89 -0.00 0.00 0.00 0.00 0.00 23.12 20.08 1cdd s ALA 196 CO -0.00 -0.20 -0.23 -1.58 0.00 0.00 0.00 175.76 173.76 1cdd s TRP 197 N 1.05 2.58 0.00 0.00 0.52 -0.12 -0.38 118.94 122.59 1cdd s TRP 197 Ca 0.33 -0.94 0.00 0.00 0.02 0.00 0.00 56.10 55.51 1cdd s TRP 197 Cb -0.17 -1.71 0.00 0.00 -1.15 0.00 0.00 33.47 30.44 1cdd s TRP 197 CO 0.14 -0.36 0.00 -0.11 0.02 0.00 0.00 176.95 176.64 1cdd n LEU 198 N 3.43 0.00 -3.56 2.99 7.94 -1.01 -1.27 117.00 125.52 1cdd n LEU 198 Ca -0.19 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.31 1cdd n LEU 198 Cb 0.53 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.47 1cdd n LEU 198 CO 0.28 0.00 2.87 0.47 -1.11 0.00 0.00 177.39 179.90 1cdd n ASP 199 N 0.00 6.32 0.00 1.96 8.00 -1.17 -4.30 116.55 127.36 1cdd n ASP 199 Ca 0.00 -2.79 0.00 0.00 0.71 0.00 0.00 54.79 52.71 1cdd n ASP 199 Cb 0.00 -1.57 0.00 0.00 -0.02 0.00 0.00 41.12 39.53 1cdd n ASP 199 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cdd n GLY 200 N 3.53 1.79 3.65 0.44 0.00 -1.26 -4.97 105.19 108.37 1cdd n GLY 200 Ca 0.62 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.96 1cdd n GLY 200 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1cdd s GLN 201 N 0.00 4.04 -0.10 1.61 0.00 -1.26 -4.98 119.66 118.96 1cdd s GLN 201 Ca 0.00 1.75 -0.37 0.00 -0.00 0.00 0.00 55.36 56.74 1cdd s GLN 201 Cb 0.00 -3.92 -0.14 0.00 0.00 0.00 0.00 33.01 28.94 1cdd s GLN 201 CO 0.00 -0.99 1.72 -2.13 0.00 0.00 0.00 175.29 173.89 1cdd n ARG 202 N 7.18 1.67 -2.30 9.60 0.63 -1.26 -2.40 116.66 129.77 1cdd n ARG 202 Ca 0.16 0.61 -0.34 0.00 -0.92 0.00 0.00 57.85 57.37 1cdd n ARG 202 Cb 0.45 -2.36 -0.01 0.00 0.45 0.00 0.00 32.46 30.98 1cdd n ARG 202 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1cdd s LEU 203 N 2.96 3.69 0.79 6.15 1.43 0.49 -4.95 118.68 129.24 1cdd s LEU 203 Ca 0.92 1.91 -0.11 0.00 -1.03 0.00 0.00 54.13 55.82 1cdd s LEU 203 Cb -0.86 -4.55 0.07 0.00 0.03 0.00 0.00 46.19 40.88 1cdd s LEU 203 CO 0.54 -0.99 1.09 -2.16 0.23 0.00 0.00 176.35 175.05 1cdd s PRO 204 N -3.59 2.11 0.14 1.29 0.04 -1.26 -4.74 135.00 128.98 1cdd s PRO 204 Ca 0.66 0.97 0.08 0.00 0.04 0.00 0.00 61.00 62.76 1cdd s PRO 204 Cb -0.17 -1.89 0.43 0.00 0.04 0.00 0.00 34.50 32.90 1cdd s PRO 204 CO 0.28 -1.69 1.17 -2.30 0.04 0.00 0.00 177.00 174.50 1cdd n PRO 205 N -3.53 0.05 0.00 0.56 -0.02 -1.26 -0.48 135.00 130.32 1cdd n PRO 205 Ca 0.08 0.50 0.11 0.00 -2.02 0.00 0.00 63.50 62.17 1cdd n PRO 205 Cb 0.54 -1.77 0.01 0.00 -0.02 0.00 0.00 33.50 32.26 1cdd n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1cdd n GLN 206 N -1.74 1.42 0.00 -0.52 10.64 -1.26 -4.64 117.38 121.28 1cdd n GLN 206 Ca -0.01 -1.16 0.00 0.00 -1.83 0.00 0.00 57.00 54.00 1cdd n GLN 206 Cb 0.11 -1.47 0.00 0.00 -0.86 0.00 0.00 30.24 28.03 1cdd n GLN 206 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1cdd n GLY 207 N 1.40 1.83 1.41 2.61 0.00 0.37 -4.18 105.19 108.63 1cdd n GLY 207 Ca 0.10 -0.25 0.09 0.00 0.00 0.00 0.00 46.02 45.96 1cdd n GLY 207 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1cdd n TYR 208 N 0.00 -3.53 -3.39 1.61 9.36 -1.24 -4.14 117.16 115.83 1cdd n TYR 208 Ca 0.00 1.94 -0.25 0.00 3.32 0.00 0.00 57.90 62.90 1cdd n TYR 208 Cb 0.00 -3.10 -0.10 0.00 -0.63 0.00 0.00 39.34 35.51 1cdd n TYR 208 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1cdd s ALA 209 N -4.79 0.76 0.00 2.98 0.00 -1.26 -4.91 121.76 114.54 1cdd s ALA 209 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1cdd s ALA 209 Cb 0.00 -1.71 0.00 0.00 0.00 0.00 0.00 23.12 21.41 1cdd s ALA 209 CO 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 175.76 173.69 1cdd n ALA 210 N 3.60 0.00 -3.63 0.00 0.00 -1.26 -5.15 120.51 114.07 1cdd n ALA 210 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.57 1cdd n ALA 210 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.82 1cdd n ALA 210 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1cdd s ASP 211 N -4.00 -0.90 0.00 0.00 1.47 -1.26 -5.11 116.67 106.86 1cdd s ASP 211 Ca 0.00 1.40 0.00 0.00 1.18 0.00 0.00 52.55 55.13 1cdd s ASP 211 Cb 0.00 1.52 0.00 0.00 -0.34 0.00 0.00 42.92 44.10 1cdd s ASP 211 CO 0.00 -0.22 0.00 1.21 0.68 0.00 0.00 175.17 176.84