#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ipf s GLY 3 N 0.00 1.58 0.33 0.00 0.00 -1.25 -4.96 107.32 103.03 1ipf s GLY 3 Ca 0.00 -0.87 0.12 0.00 0.00 0.00 0.00 44.72 43.97 1ipf s GLY 3 CO 0.00 -0.65 1.67 -0.09 0.00 0.00 0.00 173.10 174.03 1ipf h ARG 4 N 0.14 0.32 -0.95 2.90 2.43 -1.99 -1.69 114.38 115.53 1ipf h ARG 4 Ca -0.46 -0.02 -0.57 0.00 -0.81 0.00 0.00 59.98 58.13 1ipf h ARG 4 Cb 1.25 -0.07 -0.42 0.00 -0.42 0.00 0.00 29.97 30.31 1ipf h ARG 4 CO 0.59 0.21 -0.73 0.91 -1.51 0.00 0.00 179.97 179.44 1ipf n TRP 5 N -5.07 2.93 -3.80 2.20 7.02 -1.26 -2.79 117.44 116.67 1ipf n TRP 5 Ca 0.30 -2.46 -0.04 0.00 -1.02 0.00 0.00 57.50 54.27 1ipf n TRP 5 Cb 0.91 -0.32 -0.00 0.00 -2.42 0.00 0.00 31.31 29.48 1ipf n TRP 5 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1ipf s ASN 6 N -3.51 -0.12 -0.18 -0.99 2.20 -0.64 -5.06 114.94 106.65 1ipf s ASN 6 Ca 0.51 -0.57 0.13 0.00 -0.94 0.00 0.00 52.86 51.99 1ipf s ASN 6 Cb 0.41 0.55 0.40 0.00 -2.00 0.00 0.00 41.25 40.62 1ipf s ASN 6 CO -0.02 -1.05 1.21 0.18 -2.94 0.00 0.00 177.10 174.47 1ipf n LEU 7 N -0.53 2.48 -4.50 3.54 4.77 -0.24 -3.76 117.00 118.75 1ipf n LEU 7 Ca -0.05 -3.61 -0.47 0.00 -0.03 0.00 0.00 56.01 51.85 1ipf n LEU 7 Cb 0.60 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1ipf n LEU 7 CO 0.17 1.24 1.85 -0.62 -1.33 0.00 0.00 177.39 178.70 1ipf n GLU 8 N -0.97 1.34 0.00 3.23 -0.58 -1.15 -0.97 120.64 121.53 1ipf n GLU 8 Ca 0.17 0.34 0.00 0.00 -0.42 0.00 0.00 57.16 57.25 1ipf n GLU 8 Cb 0.73 -2.77 0.00 0.00 -0.57 0.00 0.00 31.44 28.84 1ipf n GLU 8 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ipf n GLY 9 N 6.26 2.55 3.77 0.62 0.00 -0.82 -2.67 105.19 114.91 1ipf n GLY 9 Ca 0.38 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.99 1ipf n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ipf s THR 11 N -1.15 4.60 -0.05 0.00 -4.23 -1.26 -1.04 115.64 112.51 1ipf s THR 11 Ca 0.51 -0.51 -0.30 0.00 -1.18 0.00 0.00 61.69 60.21 1ipf s THR 11 Cb -0.41 -3.68 0.09 0.00 1.34 0.00 0.00 72.50 69.83 1ipf s THR 11 CO 0.55 -0.45 0.76 0.00 -0.54 0.00 0.00 174.62 174.94 1ipf s ALA 12 N -2.40 -1.79 -0.10 3.99 0.00 -0.22 -2.26 121.76 118.98 1ipf s ALA 12 Ca 0.44 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.66 1ipf s ALA 12 Cb -0.10 -0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.02 1ipf s ALA 12 CO 0.36 -0.43 -0.12 -1.17 0.00 0.00 0.00 175.76 174.41 1ipf s LEU 13 N -1.46 1.54 -0.18 0.00 2.96 -0.34 -1.06 118.68 120.14 1ipf s LEU 13 Ca -0.06 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.51 1ipf s LEU 13 Cb -0.00 -0.92 0.04 0.00 0.50 0.00 0.00 46.19 45.80 1ipf s LEU 13 CO 0.04 -0.02 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.25 1ipf s VAL 14 N 1.10 1.57 0.20 1.68 1.01 -0.10 -0.46 120.40 125.39 1ipf s VAL 14 Ca -0.06 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 1ipf s VAL 14 Cb -0.14 -1.59 -0.08 0.00 0.00 0.00 0.00 36.38 34.57 1ipf s VAL 14 CO -0.02 0.27 1.04 0.42 0.00 0.00 0.00 175.10 176.81 1ipf s THR 15 N 1.45 3.97 -1.07 3.92 -4.23 -0.98 -3.14 115.64 115.56 1ipf s THR 15 Ca 0.01 1.79 -0.05 0.00 -1.18 0.00 0.00 61.69 62.27 1ipf s THR 15 Cb -0.15 -4.14 -0.05 0.00 1.34 0.00 0.00 72.50 69.49 1ipf s THR 15 CO -0.09 0.35 0.93 0.61 -0.54 0.00 0.00 174.62 175.88 1ipf n GLY 16 N 1.80 -0.98 1.45 3.99 0.00 0.34 -2.55 105.19 109.25 1ipf n GLY 16 Ca 0.01 0.48 0.10 0.00 0.00 0.00 0.00 46.02 46.61 1ipf n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ipf n GLY 17 N -1.21 2.68 0.16 -0.02 0.00 -1.07 -3.95 105.19 101.78 1ipf n GLY 17 Ca -0.12 -0.82 0.13 0.00 0.00 0.00 0.00 46.02 45.21 1ipf n GLY 17 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ipf h SER 18 N 4.07 0.00 -5.22 1.61 4.64 -1.88 -3.22 113.55 113.55 1ipf h SER 18 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1ipf h SER 18 Cb 1.24 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.22 1ipf h SER 18 CO 0.13 0.00 -0.21 -0.13 -0.87 0.00 0.00 176.83 175.75 1ipf s ARG 19 N -3.16 1.28 1.68 4.77 0.52 -1.26 -4.90 118.95 117.88 1ipf s ARG 19 Ca 0.09 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.18 1ipf s ARG 19 Cb 0.09 0.43 0.00 0.00 0.52 0.00 0.00 34.95 35.99 1ipf s ARG 19 CO 0.62 -0.50 0.00 0.41 0.02 0.00 0.00 175.30 175.85 1ipf n GLY 20 N -0.28 2.63 0.27 -3.53 0.00 -1.26 -1.93 105.19 101.09 1ipf n GLY 20 Ca -0.07 0.22 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 1ipf n GLY 20 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ipf h ILE 21 N 0.00 1.27 -0.94 -0.61 2.04 -1.90 0.08 117.51 117.44 1ipf h ILE 21 Ca 0.00 -1.24 0.02 0.00 1.00 0.00 0.00 64.86 64.64 1ipf h ILE 21 Cb 0.00 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.10 1ipf h ILE 21 CO 0.00 0.43 0.62 1.23 0.00 0.00 0.00 178.15 180.43 1ipf h GLY 22 N 0.79 1.34 0.89 5.37 0.00 -1.62 0.19 103.07 110.03 1ipf h GLY 22 Ca 0.12 -0.48 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 1ipf h GLY 22 CO 0.05 0.45 0.05 -1.82 0.00 0.00 0.00 176.54 175.26 1ipf h TYR 23 N 1.24 0.54 -0.39 5.60 5.03 -1.08 -1.31 116.97 126.60 1ipf h TYR 23 Ca 0.36 -0.08 0.03 0.00 2.58 0.00 0.00 58.73 61.62 1ipf h TYR 23 Cb -0.09 -0.15 -0.02 0.00 1.55 0.00 0.00 36.73 38.02 1ipf h TYR 23 CO -0.01 0.59 0.26 0.78 -1.32 0.00 0.00 178.16 178.47 1ipf h GLY 24 N 0.33 0.48 1.56 1.82 0.00 0.05 -2.39 103.07 104.91 1ipf h GLY 24 Ca 0.09 -0.17 -0.22 0.00 0.00 0.00 0.00 47.33 47.03 1ipf h GLY 24 CO 0.01 0.15 -0.92 -2.22 0.00 0.00 0.00 176.54 173.56 1ipf h ILE 25 N 0.43 1.41 -0.14 2.60 2.04 -0.21 -1.77 117.51 121.87 1ipf h ILE 25 Ca 0.16 -2.44 -0.01 0.00 1.00 0.00 0.00 64.86 63.56 1ipf h ILE 25 Cb 0.09 2.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 1ipf h ILE 25 CO -0.04 0.73 0.05 0.58 0.00 0.00 0.00 178.15 179.47 1ipf h VAL 26 N 0.22 1.17 -0.39 1.67 2.07 -0.85 -2.12 116.25 118.03 1ipf h VAL 26 Ca -0.07 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 1ipf h VAL 26 Cb 1.56 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 1ipf h VAL 26 CO 0.16 0.16 0.23 -0.33 0.02 0.00 0.00 177.57 177.81 1ipf h GLU 27 N 0.05 0.53 0.18 1.57 5.08 -1.49 0.27 114.58 120.77 1ipf h GLU 27 Ca 0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ipf h GLU 27 Cb 0.21 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1ipf h GLU 27 CO -0.00 0.41 -0.17 1.49 -1.00 0.00 0.00 179.01 179.74 1ipf h GLU 28 N 0.51 -0.36 -0.46 2.33 4.57 -1.22 0.12 114.58 120.06 1ipf h GLU 28 Ca 0.14 0.02 -0.10 0.00 -1.18 0.00 0.00 59.36 58.24 1ipf h GLU 28 Cb 0.02 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1ipf h GLU 28 CO -0.03 -0.24 -0.11 -0.07 -1.18 0.00 0.00 179.01 177.39 1ipf h LEU 29 N -0.37 0.90 -0.99 1.64 3.38 -1.32 -2.25 115.31 116.29 1ipf h LEU 29 Ca -0.00 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.67 1ipf h LEU 29 Cb 0.35 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 1ipf h LEU 29 CO -0.04 1.05 0.64 0.00 0.09 0.00 0.00 178.44 180.18 1ipf h ALA 30 N 0.88 1.37 0.00 1.53 0.00 -0.27 -0.64 119.26 122.13 1ipf h ALA 30 Ca 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ipf h ALA 30 Cb 0.65 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ipf h ALA 30 CO 0.04 0.45 -0.13 0.66 0.00 0.00 0.00 179.25 180.28 1ipf h SER 31 N 1.18 0.00 -0.52 0.00 4.64 -0.58 -3.08 113.55 115.19 1ipf h SER 31 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1ipf h SER 31 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1ipf h SER 31 CO -0.16 0.13 0.00 0.18 -0.87 0.00 0.00 176.83 176.11 1ipf n LEU 32 N -3.22 2.85 0.00 5.97 4.77 -0.35 -4.92 117.00 122.09 1ipf n LEU 32 Ca 0.01 -1.41 0.00 0.00 -0.03 0.00 0.00 56.01 54.58 1ipf n LEU 32 Cb 0.43 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1ipf n LEU 32 CO 0.32 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 1ipf n GLY 33 N 1.35 0.57 3.85 -0.72 0.00 -1.07 -1.08 105.19 108.10 1ipf n GLY 33 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1ipf n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ipf s ALA 34 N -2.00 2.97 -0.30 4.61 0.00 -0.59 -1.94 121.76 124.51 1ipf s ALA 34 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 51.96 51.89 1ipf s ALA 34 Cb 0.00 -3.12 -0.01 0.00 0.00 0.00 0.00 23.12 20.00 1ipf s ALA 34 CO 0.00 -0.78 0.13 0.45 0.00 0.00 0.00 175.76 175.56 1ipf s SER 35 N -3.86 5.44 0.20 0.00 0.15 -0.21 -4.38 113.70 111.05 1ipf s SER 35 Ca 0.57 -0.53 0.05 0.00 0.70 0.00 0.00 55.95 56.74 1ipf s SER 35 Cb -0.12 -1.97 -0.03 0.00 -1.71 0.00 0.00 66.02 62.18 1ipf s SER 35 CO 0.50 -0.18 0.24 -0.69 1.20 0.00 0.00 173.24 174.31 1ipf s VAL 36 N 1.59 4.83 -0.10 4.45 1.01 0.14 -1.05 120.40 131.27 1ipf s VAL 36 Ca 0.04 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 1ipf s VAL 36 Cb -0.17 -3.55 0.05 0.00 0.00 0.00 0.00 36.38 32.71 1ipf s VAL 36 CO 0.05 -0.23 0.17 -0.47 0.00 0.00 0.00 175.10 174.62 1ipf s TYR 37 N -1.91 -0.19 0.10 5.22 6.14 -0.22 -1.49 117.35 125.00 1ipf s TYR 37 Ca 0.33 0.57 0.00 0.00 0.64 0.00 0.00 57.07 58.61 1ipf s TYR 37 Cb -0.09 -0.27 -0.00 0.00 0.42 0.00 0.00 41.96 42.01 1ipf s TYR 37 CO 0.26 -0.31 0.01 -2.37 0.64 0.00 0.00 175.55 173.78 1ipf n THR 38 N 5.32 0.00 -3.52 4.34 5.66 -0.71 -0.93 114.28 124.44 1ipf n THR 38 Ca -0.05 -0.50 -0.08 0.00 -3.05 0.00 0.00 64.05 60.37 1ipf n THR 38 Cb 0.50 0.12 -0.02 0.00 -1.55 0.00 0.00 70.33 69.38 1ipf n THR 38 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ipf n SER 40 N -0.23 -0.97 -1.28 0.00 3.41 -1.26 -0.50 113.62 112.78 1ipf n SER 40 Ca -0.08 -1.65 0.09 0.00 -0.26 0.00 0.00 58.87 56.97 1ipf n SER 40 Cb 0.61 1.62 0.29 0.00 -0.26 0.00 0.00 64.21 66.47 1ipf n SER 40 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ipf n ARG 41 N -0.25 2.91 -3.75 4.33 1.74 -1.26 0.12 116.66 120.50 1ipf n ARG 41 Ca -0.03 -2.34 -0.25 0.00 -0.77 0.00 0.00 57.85 54.46 1ipf n ARG 41 Cb 0.26 -1.65 -0.17 0.00 -1.02 0.00 0.00 32.46 29.88 1ipf n ARG 41 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1ipf s ASN 42 N -0.91 2.05 0.04 0.55 3.04 -1.26 -4.86 114.94 113.59 1ipf s ASN 42 Ca 0.43 -0.35 -0.26 0.00 0.04 0.00 0.00 52.86 52.72 1ipf s ASN 42 Cb 0.25 -0.48 -0.17 0.00 -1.54 0.00 0.00 41.25 39.31 1ipf s ASN 42 CO 0.25 -0.24 1.46 -0.61 -3.04 0.00 0.00 177.10 174.91 1ipf h GLN 43 N 8.31 -0.34 -0.87 0.43 5.75 -1.98 -1.55 115.11 124.86 1ipf h GLN 43 Ca -0.18 0.02 0.11 0.00 -0.15 0.00 0.00 58.65 58.45 1ipf h GLN 43 Cb 1.12 0.08 -0.06 0.00 1.07 0.00 0.00 27.48 29.69 1ipf h GLN 43 CO 0.29 -0.09 0.56 -0.22 -2.65 0.00 0.00 178.83 176.72 1ipf h LYS 44 N -0.55 0.75 -0.25 1.69 3.64 -1.99 0.19 116.57 120.05 1ipf h LYS 44 Ca -0.04 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.20 1ipf h LYS 44 Cb 0.40 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1ipf h LYS 44 CO 0.06 0.50 -0.23 0.93 -2.27 0.00 0.00 179.45 178.44 1ipf h GLU 45 N 0.77 0.59 -0.55 1.90 5.08 -1.97 -2.03 114.58 118.38 1ipf h GLU 45 Ca 0.41 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1ipf h GLU 45 Cb 0.54 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1ipf h GLU 45 CO -0.18 0.90 0.28 -0.07 -1.00 0.00 0.00 179.01 178.93 1ipf h LEU 46 N 0.30 0.72 -0.94 1.33 3.38 -0.40 -2.05 115.31 117.66 1ipf h LEU 46 Ca 0.04 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.92 1ipf h LEU 46 Cb 0.78 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 1ipf h LEU 46 CO 0.06 0.63 0.61 0.78 0.09 0.00 0.00 178.44 180.61 1ipf h ASN 47 N 0.74 1.04 0.66 -0.43 2.35 -0.55 0.26 115.58 119.65 1ipf h ASN 47 Ca 0.19 -0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 1ipf h ASN 47 Cb 0.10 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 1ipf h ASN 47 CO -0.03 0.73 -0.15 0.44 -1.65 0.00 0.00 177.43 176.78 1ipf h ASP 48 N 1.21 0.00 0.03 5.81 3.45 -1.05 -0.77 116.42 125.10 1ipf h ASP 48 Ca 0.36 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.67 1ipf h ASP 48 Cb -0.06 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 38.73 1ipf h ASP 48 CO -0.10 0.15 -0.60 0.00 -1.57 0.00 0.00 179.24 177.11 1ipf h LEU 50 N -0.21 0.88 -0.71 0.00 3.38 -0.15 0.59 115.31 119.09 1ipf h LEU 50 Ca -0.08 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1ipf h LEU 50 Cb 1.34 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1ipf h LEU 50 CO 0.12 0.73 0.36 0.74 0.09 0.00 0.00 178.44 180.48 1ipf h THR 51 N 0.98 1.23 -0.16 0.22 2.02 -1.19 -0.70 112.91 115.31 1ipf h THR 51 Ca 0.24 -0.61 -0.13 0.00 0.77 0.00 0.00 66.41 66.68 1ipf h THR 51 Cb 0.07 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1ipf h THR 51 CO -0.03 0.26 -0.39 -0.61 0.37 0.00 0.00 175.52 175.12 1ipf h GLN 52 N 0.99 0.55 -0.22 6.66 5.75 -1.31 -3.11 115.11 124.42 1ipf h GLN 52 Ca 0.25 -0.37 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 1ipf h GLN 52 Cb 0.09 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1ipf h GLN 52 CO -0.03 0.99 0.03 -1.49 -2.65 0.00 0.00 178.83 175.67 1ipf h TRP 53 N 0.19 0.40 0.00 3.99 6.55 -0.76 -2.95 115.95 123.37 1ipf h TRP 53 Ca -0.00 -0.06 0.00 0.00 0.95 0.00 0.00 58.89 59.78 1ipf h TRP 53 Cb 1.00 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 29.19 1ipf h TRP 53 CO 0.10 0.52 0.00 0.54 -1.05 0.00 0.00 178.44 178.55 1ipf n ARG 54 N -4.70 0.09 0.05 0.49 1.74 -0.28 -2.12 116.66 111.91 1ipf n ARG 54 Ca -0.04 0.31 0.13 0.00 -0.77 0.00 0.00 57.85 57.48 1ipf n ARG 54 Cb 0.21 -1.66 0.46 0.00 -1.02 0.00 0.00 32.46 30.44 1ipf n ARG 54 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1ipf n SER 55 N -1.82 0.43 -0.82 0.55 3.41 -1.11 -3.04 113.62 111.22 1ipf n SER 55 Ca 0.03 0.42 0.07 0.00 -0.26 0.00 0.00 58.87 59.13 1ipf n SER 55 Cb 0.21 -0.47 0.21 0.00 -0.26 0.00 0.00 64.21 63.89 1ipf n SER 55 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ipf n LYS 56 N -1.85 2.97 -1.04 4.33 5.02 -0.90 -4.95 118.16 121.73 1ipf n LYS 56 Ca 0.06 -2.37 -0.01 0.00 -2.02 0.00 0.00 58.31 53.96 1ipf n LYS 56 Cb 0.38 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.89 1ipf n LYS 56 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ipf n GLY 57 N 0.32 0.50 3.75 0.72 0.00 -1.17 -5.01 105.19 104.30 1ipf n GLY 57 Ca 0.16 -0.78 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 1ipf n GLY 57 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ipf s PHE 58 N -2.03 3.80 -0.70 1.61 2.99 -1.01 -4.97 117.98 117.67 1ipf s PHE 58 Ca 0.00 1.81 -0.19 0.00 0.00 0.00 0.00 56.93 58.55 1ipf s PHE 58 Cb 0.00 -3.12 0.11 0.00 0.00 0.00 0.00 43.02 40.01 1ipf s PHE 58 CO 0.00 -0.01 0.85 0.15 -0.00 0.00 0.00 175.22 176.21 1ipf s LYS 59 N -1.21 3.22 0.06 0.44 1.02 -1.26 -4.39 119.74 117.62 1ipf s LYS 59 Ca 0.43 -1.41 0.03 0.00 0.02 0.00 0.00 55.97 55.03 1ipf s LYS 59 Cb -0.29 -4.41 -0.03 0.00 -0.52 0.00 0.00 37.83 32.59 1ipf s LYS 59 CO 0.36 -1.63 -0.09 0.08 -0.92 0.00 0.00 175.35 173.15 1ipf s VAL 60 N 2.75 0.68 0.01 3.17 1.01 -1.26 -0.68 120.40 126.08 1ipf s VAL 60 Ca 0.19 -1.25 -0.16 0.00 0.00 0.00 0.00 61.98 60.75 1ipf s VAL 60 Cb -0.17 -0.86 0.03 0.00 0.00 0.00 0.00 36.38 35.37 1ipf s VAL 60 CO 0.02 -0.42 0.35 -0.70 0.00 0.00 0.00 175.10 174.35 1ipf s GLU 61 N -1.94 0.77 0.25 2.72 2.56 -0.55 -4.97 118.70 117.53 1ipf s GLU 61 Ca -0.05 -0.28 -0.16 0.00 0.00 0.00 0.00 54.97 54.48 1ipf s GLU 61 Cb -0.08 0.34 0.01 0.00 2.00 0.00 0.00 34.13 36.40 1ipf s GLU 61 CO 0.00 -0.23 0.56 0.00 -0.56 0.00 0.00 175.26 175.02 1ipf s ALA 62 N -1.85 -0.66 -0.28 6.30 0.00 -1.26 -1.74 121.76 122.26 1ipf s ALA 62 Ca -0.10 -0.58 -0.23 0.00 0.00 0.00 0.00 51.96 51.05 1ipf s ALA 62 Cb -0.03 0.96 0.11 0.00 0.00 0.00 0.00 23.12 24.16 1ipf s ALA 62 CO 0.01 -0.90 0.91 -1.54 0.00 0.00 0.00 175.76 174.25 1ipf s SER 63 N -2.96 -0.59 0.12 0.00 1.04 -1.17 -4.98 113.70 105.16 1ipf s SER 63 Ca 0.16 1.07 -0.35 0.00 0.48 0.00 0.00 55.95 57.32 1ipf s SER 63 Cb -0.02 1.13 -0.16 0.00 0.10 0.00 0.00 66.02 67.07 1ipf s SER 63 CO 0.06 -0.18 1.31 0.52 0.98 0.00 0.00 173.24 175.93 1ipf n VAL 64 N 2.80 0.29 -3.64 5.02 0.31 -1.26 -4.16 118.33 117.69 1ipf n VAL 64 Ca -0.15 -0.07 -0.09 0.00 -0.01 0.00 0.00 64.34 64.02 1ipf n VAL 64 Cb 0.56 -0.90 -0.07 0.00 -0.91 0.00 0.00 33.84 32.52 1ipf n VAL 64 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ipf s ASP 66 N 1.30 6.17 0.00 0.00 2.15 -1.26 -4.03 116.67 121.00 1ipf s ASP 66 Ca -0.07 -1.35 0.07 0.00 0.43 0.00 0.00 52.55 51.63 1ipf s ASP 66 Cb -0.05 -2.22 0.32 0.00 -0.30 0.00 0.00 42.92 40.67 1ipf s ASP 66 CO -0.14 -0.77 1.21 0.18 -0.17 0.00 0.00 175.17 175.49 1ipf n LEU 67 N 5.46 0.00 0.00 -1.34 4.77 -1.26 -1.43 117.00 123.20 1ipf n LEU 67 Ca -0.11 0.47 0.14 0.00 -0.03 0.00 0.00 56.01 56.48 1ipf n LEU 67 Cb 0.43 -0.47 0.67 0.00 -2.33 0.00 0.00 43.42 41.72 1ipf n LEU 67 CO 0.51 -0.35 0.98 -1.54 -1.33 0.00 0.00 177.39 175.66 1ipf n SER 68 N -1.47 0.00 -4.47 -1.43 3.41 -1.26 -4.57 113.62 103.83 1ipf n SER 68 Ca 0.02 0.25 -0.36 0.00 -0.26 0.00 0.00 58.87 58.52 1ipf n SER 68 Cb 0.08 -0.42 -0.12 0.00 -0.26 0.00 0.00 64.21 63.49 1ipf n SER 68 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ipf s SER 69 N -2.83 5.08 0.09 4.04 0.15 -0.52 -4.85 113.70 114.87 1ipf s SER 69 Ca 0.20 -0.17 -0.25 0.00 0.70 0.00 0.00 55.95 56.43 1ipf s SER 69 Cb 0.19 -1.89 -0.16 0.00 -1.71 0.00 0.00 66.02 62.46 1ipf s SER 69 CO 0.50 0.03 1.71 -0.09 1.20 0.00 0.00 173.24 176.59 1ipf h ARG 70 N 7.78 -0.19 -0.68 5.44 2.43 -1.86 -2.69 114.38 124.61 1ipf h ARG 70 Ca -0.37 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 58.87 1ipf h ARG 70 Cb 1.18 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.73 1ipf h ARG 70 CO 0.60 -0.13 0.45 0.66 -1.51 0.00 0.00 179.97 180.04 1ipf h SER 71 N -0.20 0.62 -0.11 -3.80 4.64 -1.95 -2.59 113.55 110.17 1ipf h SER 71 Ca -0.02 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1ipf h SER 71 Cb 0.15 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1ipf h SER 71 CO 0.03 0.41 -0.05 -0.33 -0.87 0.00 0.00 176.83 176.02 1ipf h GLU 72 N 0.71 0.23 -0.86 4.77 5.08 -1.82 -2.70 114.58 119.98 1ipf h GLU 72 Ca 0.29 -0.10 0.18 0.00 -1.00 0.00 0.00 59.36 58.73 1ipf h GLU 72 Cb 0.23 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 1ipf h GLU 72 CO -0.09 0.56 0.57 0.00 -1.00 0.00 0.00 179.01 179.05 1ipf h ARG 73 N -0.12 0.45 -0.32 2.33 3.08 -1.14 0.34 114.38 119.00 1ipf h ARG 73 Ca 0.03 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1ipf h ARG 73 Cb 0.49 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1ipf h ARG 73 CO 0.01 0.29 0.02 1.96 -1.07 0.00 0.00 179.97 181.19 1ipf h GLN 74 N 0.46 0.55 -0.79 0.04 4.20 -1.30 -1.68 115.11 116.59 1ipf h GLN 74 Ca 0.44 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.94 1ipf h GLN 74 Cb 1.02 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.71 1ipf h GLN 74 CO -0.17 0.67 0.29 0.93 -0.67 0.00 0.00 178.83 179.88 1ipf h GLU 75 N 0.36 1.19 -0.18 1.46 5.08 -0.28 -2.46 114.58 119.76 1ipf h GLU 75 Ca 0.09 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1ipf h GLU 75 Cb 0.41 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1ipf h GLU 75 CO 0.01 0.98 0.02 1.25 -1.00 0.00 0.00 179.01 180.27 1ipf h LEU 76 N 1.16 -0.02 -1.28 1.33 5.85 -0.20 -2.18 115.31 119.97 1ipf h LEU 76 Ca 0.26 0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.03 1ipf h LEU 76 Cb 0.25 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1ipf h LEU 76 CO -0.02 0.01 0.49 -0.03 -0.34 0.00 0.00 178.44 178.56 1ipf h MET 77 N 0.08 0.96 0.07 1.25 4.05 -1.03 -1.16 114.93 119.15 1ipf h MET 77 Ca 0.08 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.44 1ipf h MET 77 Cb 0.09 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 30.67 1ipf h MET 77 CO -0.12 0.64 -0.04 -0.91 0.23 0.00 0.00 176.91 176.71 1ipf h ASN 78 N 0.99 -0.08 0.15 1.39 2.35 -1.09 -1.43 115.58 117.86 1ipf h ASN 78 Ca 0.28 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1ipf h ASN 78 Cb -0.08 0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1ipf h ASN 78 CO -0.07 0.17 -0.18 0.74 -1.65 0.00 0.00 177.43 176.44 1ipf h THR 79 N -0.34 0.60 -0.78 2.81 2.02 -1.13 -1.03 112.91 115.06 1ipf h THR 79 Ca -0.01 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.24 1ipf h THR 79 Cb 0.29 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 1ipf h THR 79 CO 0.02 0.00 0.51 0.58 0.37 0.00 0.00 175.52 176.99 1ipf h VAL 80 N -0.38 1.02 -0.14 3.16 2.07 -1.24 0.10 116.25 120.84 1ipf h VAL 80 Ca 0.01 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1ipf h VAL 80 Cb 0.37 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1ipf h VAL 80 CO -0.06 0.15 0.05 0.00 0.02 0.00 0.00 177.57 177.72 1ipf h ALA 81 N 1.59 0.18 -0.49 1.67 0.00 -0.71 0.12 119.26 121.62 1ipf h ALA 81 Ca 0.34 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1ipf h ALA 81 Cb 0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1ipf h ALA 81 CO -0.12 -0.21 0.12 -0.91 0.00 0.00 0.00 179.25 178.13 1ipf h ASN 82 N 0.06 0.74 -0.53 0.00 2.35 -0.61 1.63 115.58 119.21 1ipf h ASN 82 Ca 0.05 -0.23 0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1ipf h ASN 82 Cb 0.20 -0.19 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 1ipf h ASN 82 CO -0.00 0.78 0.22 -0.74 -1.65 0.00 0.00 177.43 176.04 1ipf h HIS 83 N 0.67 0.40 -0.52 1.19 2.76 -0.55 -1.53 115.15 117.57 1ipf h HIS 83 Ca 0.15 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1ipf h HIS 83 Cb 0.32 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.18 1ipf h HIS 83 CO 0.02 0.15 0.00 1.19 -1.30 0.00 0.00 177.93 177.99 1ipf n PHE 84 N -4.95 0.96 -3.60 5.26 3.72 0.39 -4.93 117.46 114.31 1ipf n PHE 84 Ca 0.06 -0.42 -0.21 0.00 -0.05 0.00 0.00 57.45 56.83 1ipf n PHE 84 Cb 0.20 -0.11 0.06 0.00 -0.94 0.00 0.00 39.48 38.69 1ipf n PHE 84 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1ipf n HIS 85 N 0.94 -2.29 -2.24 1.38 8.25 0.62 -2.30 115.22 119.58 1ipf n HIS 85 Ca 0.19 0.93 -0.20 0.00 -0.26 0.00 0.00 57.72 58.38 1ipf n HIS 85 Cb 0.60 -4.76 -0.02 0.00 1.12 0.00 0.00 29.99 26.92 1ipf n HIS 85 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ipf n GLY 86 N -1.52 -0.02 2.66 -1.41 0.00 0.53 -4.97 105.19 100.46 1ipf n GLY 86 Ca -0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1ipf n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ipf s LYS 87 N -4.79 0.26 -0.13 1.61 1.02 -0.97 -4.67 119.74 112.07 1ipf s LYS 87 Ca 0.00 -0.16 0.01 0.00 0.02 0.00 0.00 55.97 55.84 1ipf s LYS 87 Cb 0.00 -1.81 0.02 0.00 -0.52 0.00 0.00 37.83 35.52 1ipf s LYS 87 CO 0.00 -0.63 -0.13 -1.17 -0.92 0.00 0.00 175.35 172.50 1ipf s LEU 88 N 2.05 1.60 -0.07 3.17 2.96 -1.01 -4.76 118.68 122.62 1ipf s LEU 88 Ca 0.01 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.54 1ipf s LEU 88 Cb -0.16 -1.09 -0.24 0.00 0.50 0.00 0.00 46.19 45.20 1ipf s LEU 88 CO -0.08 -0.05 0.57 0.78 -1.32 0.00 0.00 176.35 176.25 1ipf h ASN 89 N 7.89 0.17 -3.99 3.68 4.21 -1.83 -3.27 115.58 122.45 1ipf h ASN 89 Ca -0.35 -0.37 -0.45 0.00 1.21 0.00 0.00 56.30 56.34 1ipf h ASN 89 Cb 1.15 -0.05 -0.30 0.00 -1.12 0.00 0.00 38.32 37.99 1ipf h ASN 89 CO 0.50 1.33 -0.80 -0.63 -1.29 0.00 0.00 177.43 176.54 1ipf s ILE 90 N -2.59 0.93 -0.18 2.81 1.01 -0.96 0.75 121.20 122.98 1ipf s ILE 90 Ca -0.11 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.06 1ipf s ILE 90 Cb 0.07 -0.80 0.05 0.00 0.01 0.00 0.00 42.46 41.80 1ipf s ILE 90 CO 0.81 0.27 -0.03 -0.22 0.00 0.00 0.00 174.94 175.77 1ipf s LEU 91 N -0.07 1.65 -0.40 2.97 2.96 -0.53 -1.20 118.68 124.06 1ipf s LEU 91 Ca 0.01 -0.78 -0.07 0.00 -0.22 0.00 0.00 54.13 53.07 1ipf s LEU 91 Cb -0.07 -0.86 0.08 0.00 0.50 0.00 0.00 46.19 45.84 1ipf s LEU 91 CO 0.00 -0.23 0.21 -0.69 -1.32 0.00 0.00 176.35 174.33 1ipf s VAL 92 N 1.66 3.91 -1.19 1.68 1.01 0.40 -0.59 120.40 127.28 1ipf s VAL 92 Ca -0.01 -1.49 -0.18 0.00 0.00 0.00 0.00 61.98 60.30 1ipf s VAL 92 Cb -0.16 -3.42 0.10 0.00 0.00 0.00 0.00 36.38 32.89 1ipf s VAL 92 CO -0.07 -0.48 1.55 0.20 0.00 0.00 0.00 175.10 176.30 1ipf s ASN 93 N 1.94 6.81 -0.24 3.32 -0.87 0.03 -2.32 114.94 123.61 1ipf s ASN 93 Ca 0.03 -2.35 0.05 0.00 -1.57 0.00 0.00 52.86 49.03 1ipf s ASN 93 Cb -0.22 -2.52 -0.19 0.00 -0.02 0.00 0.00 41.25 38.30 1ipf s ASN 93 CO 0.01 -1.13 -0.13 -3.20 -2.57 0.00 0.00 177.10 170.08 1ipf n ASN 94 N 7.67 1.52 -4.53 -1.22 5.15 -1.26 -1.92 115.26 120.67 1ipf n ASN 94 Ca 0.41 -0.09 -0.51 0.00 -0.60 0.00 0.00 54.58 53.78 1ipf n ASN 94 Cb 0.46 -0.10 -0.05 0.00 -0.53 0.00 0.00 39.78 39.57 1ipf n ASN 94 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ipf n ALA 95 N -3.13 -1.83 -3.58 5.20 0.00 -1.06 -4.87 120.51 111.24 1ipf n ALA 95 Ca -0.42 0.49 -0.10 0.00 0.00 0.00 0.00 53.44 53.41 1ipf n ALA 95 Cb 1.03 -1.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.54 1ipf n ALA 95 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ipf s GLY 96 N -0.15 -0.25 0.29 0.00 0.00 -1.26 -4.64 107.32 101.30 1ipf s GLY 96 Ca 0.76 2.06 0.05 0.00 0.00 0.00 0.00 44.72 47.60 1ipf s GLY 96 CO 0.54 1.05 -0.01 -0.26 0.00 0.00 0.00 173.10 174.41 1ipf s ILE 97 N -1.08 1.43 0.04 0.90 -4.36 -1.26 -5.03 121.20 111.83 1ipf s ILE 97 Ca -0.01 -2.07 0.04 0.00 -0.26 0.00 0.00 60.65 58.35 1ipf s ILE 97 Cb -0.01 -2.55 -0.02 0.00 1.25 0.00 0.00 42.46 41.13 1ipf s ILE 97 CO 0.01 -0.21 -0.13 0.68 0.24 0.00 0.00 174.94 175.53 1ipf s VAL 98 N -3.15 1.03 -0.30 8.37 -7.23 -1.26 -4.93 120.40 112.94 1ipf s VAL 98 Ca 0.32 -0.97 -0.02 0.00 -1.81 0.00 0.00 61.98 59.49 1ipf s VAL 98 Cb 0.06 -0.94 0.10 0.00 0.56 0.00 0.00 36.38 36.15 1ipf s VAL 98 CO 0.13 -0.03 0.10 -0.63 -0.31 0.00 0.00 175.10 174.36 1ipf s ILE 99 N -0.87 0.57 -0.73 -0.62 1.01 -1.26 -5.09 121.20 114.22 1ipf s ILE 99 Ca 0.01 -1.15 -0.27 0.00 0.00 0.00 0.00 60.65 59.24 1ipf s ILE 99 Cb -0.08 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 40.99 1ipf s ILE 99 CO 0.01 -0.66 1.47 -0.31 0.00 0.00 0.00 174.94 175.45 1ipf s TYR 100 N 1.78 2.11 0.18 3.97 2.02 -1.26 -4.80 117.35 121.35 1ipf s TYR 100 Ca 0.09 0.15 -0.16 0.00 -0.37 0.00 0.00 57.07 56.78 1ipf s TYR 100 Cb -0.17 -4.47 0.03 0.00 -0.40 0.00 0.00 41.96 36.95 1ipf s TYR 100 CO -0.28 -2.13 0.47 0.15 -1.57 0.00 0.00 175.55 172.20 1ipf s LYS 101 N 6.09 1.28 0.65 -0.62 1.02 -1.24 -5.02 119.74 121.90 1ipf s LYS 101 Ca 0.45 -0.87 -0.11 0.00 0.02 0.00 0.00 55.97 55.47 1ipf s LYS 101 Cb -0.09 0.49 -0.02 0.00 -0.52 0.00 0.00 37.83 37.69 1ipf s LYS 101 CO 0.15 -0.53 1.05 -1.21 -0.92 0.00 0.00 175.35 173.89 1ipf s GLU 102 N -3.87 3.35 0.16 1.68 2.02 -1.26 -4.34 118.70 116.45 1ipf s GLU 102 Ca 0.09 0.72 -0.22 0.00 0.02 0.00 0.00 54.97 55.58 1ipf s GLU 102 Cb 0.00 -2.06 0.06 0.00 0.10 0.00 0.00 34.13 32.24 1ipf s GLU 102 CO -0.05 -0.74 1.61 0.00 0.02 0.00 0.00 175.26 176.10 1ipf h ALA 103 N -0.44 -0.11 0.00 5.21 0.00 -1.99 -1.25 119.26 120.67 1ipf h ALA 103 Ca -0.44 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ipf h ALA 103 Cb 1.21 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1ipf h ALA 103 CO 0.62 -0.68 0.00 0.36 0.00 0.00 0.00 179.25 179.54 1ipf n LYS 104 N -5.41 0.01 -0.11 0.00 2.85 -1.26 -3.04 118.16 111.20 1ipf n LYS 104 Ca 0.01 0.26 0.11 0.00 -1.05 0.00 0.00 58.31 57.64 1ipf n LYS 104 Cb 0.32 -1.52 0.28 0.00 -0.65 0.00 0.00 35.03 33.47 1ipf n LYS 104 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1ipf n ASP 105 N -1.53 2.60 -4.71 -5.58 10.43 -0.47 -4.96 116.55 112.33 1ipf n ASP 105 Ca 0.03 -1.86 -0.42 0.00 2.57 0.00 0.00 54.79 55.12 1ipf n ASP 105 Cb 0.17 -0.15 -0.03 0.00 1.84 0.00 0.00 41.12 42.95 1ipf n ASP 105 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1ipf s TYR 106 N -1.70 3.58 0.31 1.24 2.02 -1.17 -4.88 117.35 116.74 1ipf s TYR 106 Ca 0.35 1.56 -0.10 0.00 -0.37 0.00 0.00 57.07 58.51 1ipf s TYR 106 Cb 0.20 -3.22 -0.07 0.00 -0.40 0.00 0.00 41.96 38.47 1ipf s TYR 106 CO 0.29 -0.44 0.66 0.95 -1.57 0.00 0.00 175.55 175.45 1ipf s THR 107 N 1.08 4.84 0.59 -0.71 -4.23 -1.26 -4.89 115.64 111.06 1ipf s THR 107 Ca 0.54 0.56 0.29 0.00 -1.18 0.00 0.00 61.69 61.90 1ipf s THR 107 Cb -0.24 -3.67 0.39 0.00 1.34 0.00 0.00 72.50 70.32 1ipf s THR 107 CO 0.28 -0.27 1.86 0.58 -0.54 0.00 0.00 174.62 176.53 1ipf h VAL 108 N 1.63 0.34 -0.06 2.29 2.07 -1.99 0.28 116.25 120.81 1ipf h VAL 108 Ca -0.47 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 66.96 1ipf h VAL 108 Cb 1.18 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1ipf h VAL 108 CO 0.66 0.00 -0.30 -0.33 0.02 0.00 0.00 177.57 177.62 1ipf h GLU 109 N 0.00 0.31 0.89 1.57 4.39 -1.99 -1.81 114.58 117.95 1ipf h GLU 109 Ca 0.24 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1ipf h GLU 109 Cb 1.31 0.05 0.01 0.00 -0.10 0.00 0.00 28.75 30.02 1ipf h GLU 109 CO -0.00 0.90 -0.43 -0.44 -1.16 0.00 0.00 179.01 177.88 1ipf h ASP 110 N -0.20 -1.01 -0.62 1.42 3.45 -0.88 -1.79 116.42 116.80 1ipf h ASP 110 Ca -0.02 0.03 0.11 0.00 0.43 0.00 0.00 57.03 57.59 1ipf h ASP 110 Cb 0.96 0.26 -0.08 0.00 -0.56 0.00 0.00 39.33 39.90 1ipf h ASP 110 CO 0.06 -0.72 0.16 0.22 -1.57 0.00 0.00 179.24 177.40 1ipf h TYR 111 N -1.20 0.27 -0.32 4.55 5.03 -1.33 -0.56 116.97 123.42 1ipf h TYR 111 Ca -0.12 0.04 -0.09 0.00 2.58 0.00 0.00 58.73 61.13 1ipf h TYR 111 Cb 0.91 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 39.15 1ipf h TYR 111 CO -0.01 -0.00 -0.19 0.77 -1.32 0.00 0.00 178.16 177.41 1ipf h SER 112 N 0.30 0.58 0.49 -2.11 0.02 -1.29 -1.93 113.55 109.61 1ipf h SER 112 Ca 0.33 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1ipf h SER 112 Cb 0.47 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1ipf h SER 112 CO -0.39 0.78 -0.24 0.25 -1.14 0.00 0.00 176.83 176.10 1ipf h LEU 113 N 0.52 -0.56 -1.60 5.07 5.85 -0.55 -2.53 115.31 121.51 1ipf h LEU 113 Ca 0.08 -0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1ipf h LEU 113 Cb 0.62 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 1ipf h LEU 113 CO 0.04 -0.15 0.41 -0.29 -0.34 0.00 0.00 178.44 178.11 1ipf h ILE 114 N -1.10 0.92 -0.00 4.05 2.10 -1.17 -2.01 117.51 120.30 1ipf h ILE 114 Ca -0.07 -0.16 -0.18 0.00 1.08 0.00 0.00 64.86 65.53 1ipf h ILE 114 Cb 0.57 0.42 -0.02 0.00 -1.09 0.00 0.00 36.82 36.70 1ipf h ILE 114 CO 0.11 0.08 -0.83 -0.03 -1.08 0.00 0.00 178.15 176.41 1ipf h MET 115 N 0.46 0.13 -0.02 2.19 4.05 -1.38 -1.23 114.93 119.12 1ipf h MET 115 Ca 0.28 -0.14 -0.16 0.00 -0.28 0.00 0.00 59.70 59.40 1ipf h MET 115 Cb 0.48 0.04 0.01 0.00 -0.80 0.00 0.00 31.60 31.33 1ipf h MET 115 CO -0.08 0.88 -0.61 0.66 0.23 0.00 0.00 176.91 178.00 1ipf h SER 116 N 0.07 0.58 0.28 1.39 4.64 -0.97 -0.27 113.55 119.27 1ipf h SER 116 Ca -0.03 -0.73 -0.01 0.00 -0.47 0.00 0.00 61.79 60.55 1ipf h SER 116 Cb 1.44 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1ipf h SER 116 CO 0.12 1.23 -0.13 0.40 -0.87 0.00 0.00 176.83 177.57 1ipf h ILE 117 N -0.02 0.48 -0.10 0.95 2.04 -1.45 0.57 117.51 119.97 1ipf h ILE 117 Ca -0.07 -0.85 -0.12 0.00 1.00 0.00 0.00 64.86 64.82 1ipf h ILE 117 Cb 1.30 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1ipf h ILE 117 CO 0.12 0.12 -0.48 0.78 0.00 0.00 0.00 178.15 178.69 1ipf h ASN 118 N -0.97 0.27 0.00 1.72 4.21 -1.38 -3.36 115.58 116.07 1ipf h ASN 118 Ca -0.04 -0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.34 1ipf h ASN 118 Cb 0.48 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.60 1ipf h ASN 118 CO 0.06 0.71 -0.04 0.33 -1.29 0.00 0.00 177.43 177.20 1ipf n PHE 119 N -3.97 0.00 -0.30 1.19 7.35 -1.06 -4.59 117.46 116.07 1ipf n PHE 119 Ca -0.02 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.62 1ipf n PHE 119 Cb 0.53 -0.02 -0.00 0.00 0.35 0.00 0.00 39.48 40.34 1ipf n PHE 119 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1ipf h GLU 120 N -0.04 -0.09 -0.72 -4.13 5.08 -1.07 0.17 114.58 113.79 1ipf h GLU 120 Ca 0.00 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1ipf h GLU 120 Cb 0.04 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 1ipf h GLU 120 CO 0.00 -0.06 0.41 0.00 -1.00 0.00 0.00 179.01 178.36 1ipf h ALA 121 N 1.01 0.97 -0.32 3.43 0.00 -0.00 0.74 119.26 125.10 1ipf h ALA 121 Ca 0.26 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 1ipf h ALA 121 Cb 0.56 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1ipf h ALA 121 CO -0.84 0.09 -0.05 0.00 0.00 0.00 0.00 179.25 178.44 1ipf h ALA 122 N 1.37 0.43 0.46 0.00 0.00 -1.26 0.12 119.26 120.39 1ipf h ALA 122 Ca 0.32 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ipf h ALA 122 Cb 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ipf h ALA 122 CO -0.19 0.24 -0.22 -0.92 0.00 0.00 0.00 179.25 178.16 1ipf h TYR 123 N 0.38 -0.58 -0.19 0.00 3.20 -0.30 -2.31 116.97 117.17 1ipf h TYR 123 Ca 0.08 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.99 1ipf h TYR 123 Cb 0.53 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.93 1ipf h TYR 123 CO 0.05 -0.30 -0.20 1.25 -1.64 0.00 0.00 178.16 177.32 1ipf h HIS 124 N -0.75 -0.53 -0.66 -3.82 2.76 0.56 -2.49 115.15 110.22 1ipf h HIS 124 Ca -0.06 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1ipf h HIS 124 Cb 0.54 0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.73 1ipf h HIS 124 CO -0.02 -0.28 0.43 -0.07 -1.30 0.00 0.00 177.93 176.69 1ipf h LEU 125 N -0.23 0.77 -0.36 0.26 3.38 -0.78 -1.80 115.31 116.55 1ipf h LEU 125 Ca 0.12 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.13 1ipf h LEU 125 Cb 0.41 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 40.88 1ipf h LEU 125 CO -0.33 0.57 -0.35 0.28 0.09 0.00 0.00 178.44 178.70 1ipf h SER 126 N 0.90 -1.17 -0.85 -0.43 0.02 -1.05 0.21 113.55 111.19 1ipf h SER 126 Ca 0.24 0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.37 1ipf h SER 126 Cb -0.09 0.53 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 1ipf h SER 126 CO -0.05 -0.34 0.49 0.58 -1.14 0.00 0.00 176.83 176.37 1ipf h VAL 127 N -0.30 1.24 -0.21 2.27 2.07 -1.15 -0.20 116.25 119.98 1ipf h VAL 127 Ca 0.15 -0.56 -0.11 0.00 0.82 0.00 0.00 66.70 67.01 1ipf h VAL 127 Cb 0.56 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1ipf h VAL 127 CO -0.52 0.26 -0.32 -0.07 0.02 0.00 0.00 177.57 176.94 1ipf h LEU 128 N 1.18 0.45 0.00 2.57 3.38 -0.32 -2.86 115.31 119.71 1ipf h LEU 128 Ca 0.30 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ipf h LEU 128 Cb -0.01 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1ipf h LEU 128 CO -0.05 0.75 -0.10 0.00 0.09 0.00 0.00 178.44 179.13 1ipf h ALA 129 N 1.28 0.95 -0.52 1.53 0.00 -0.11 -3.39 119.26 119.00 1ipf h ALA 129 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.05 1ipf h ALA 129 Cb 0.75 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.43 1ipf h ALA 129 CO 0.06 0.00 -0.35 1.25 0.00 0.00 0.00 179.25 180.21 1ipf h HIS 130 N 0.00 -0.99 -0.05 0.00 6.17 -0.80 -0.49 115.15 118.99 1ipf h HIS 130 Ca 0.00 0.07 0.02 0.00 0.71 0.00 0.00 60.37 61.16 1ipf h HIS 130 Cb 0.91 0.51 -0.00 0.00 2.52 0.00 0.00 27.41 31.35 1ipf h HIS 130 CO 0.00 -0.39 0.05 -1.00 0.71 0.00 0.00 177.93 177.30 1ipf h PRO 131 N -0.21 0.00 0.03 5.26 0.13 -1.77 -1.61 132.00 133.82 1ipf h PRO 131 Ca 0.20 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 65.07 1ipf h PRO 131 Cb 0.55 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.65 1ipf h PRO 131 CO -0.63 0.00 -1.32 0.74 -0.23 0.00 0.00 178.00 176.55 1ipf h PHE 132 N 0.00 0.11 -0.25 1.56 0.04 -1.46 -2.53 116.94 114.41 1ipf h PHE 132 Ca 0.03 -0.08 -0.16 0.00 2.80 0.00 0.00 57.97 60.56 1ipf h PHE 132 Cb 0.12 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 1ipf h PHE 132 CO 0.00 1.09 -0.48 -0.07 -0.60 0.00 0.00 178.31 178.25 1ipf h LEU 133 N 0.02 0.74 0.07 1.54 3.38 -0.57 -1.57 115.31 118.91 1ipf h LEU 133 Ca -0.14 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.46 1ipf h LEU 133 Cb 1.90 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.44 1ipf h LEU 133 CO 0.12 1.10 -0.03 0.50 0.09 0.00 0.00 178.44 180.22 1ipf h LYS 134 N 0.54 -0.09 -0.24 1.13 3.64 -1.39 -2.87 116.57 117.29 1ipf h LYS 134 Ca 0.03 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 1ipf h LYS 134 Cb 1.03 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1ipf h LYS 134 CO 0.10 0.34 0.21 0.00 -2.27 0.00 0.00 179.45 177.83 1ipf h ALA 135 N 0.34 2.02 0.00 5.00 0.00 -1.43 0.71 119.26 125.90 1ipf h ALA 135 Ca -0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ipf h ALA 135 Cb 0.46 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ipf h ALA 135 CO 0.02 -0.33 -0.18 0.66 0.00 0.00 0.00 179.25 179.42 1ipf h SER 136 N 0.00 0.00 0.00 0.00 4.64 -1.07 -3.46 113.55 113.66 1ipf h SER 136 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1ipf h SER 136 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1ipf h SER 136 CO -0.00 0.18 0.00 -0.62 -0.87 0.00 0.00 176.83 175.51 1ipf n GLU 137 N -3.63 -0.47 -2.72 4.77 1.02 0.25 -4.81 120.64 115.04 1ipf n GLU 137 Ca -0.01 0.12 -0.07 0.00 -0.02 0.00 0.00 57.16 57.17 1ipf n GLU 137 Cb 0.30 -3.52 0.07 0.00 -0.02 0.00 0.00 31.44 28.27 1ipf n GLU 137 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ipf n ARG 138 N -1.76 0.68 -2.97 3.49 0.63 -1.25 -4.92 116.66 110.55 1ipf n ARG 138 Ca 0.00 -1.52 -0.31 0.00 -0.92 0.00 0.00 57.85 55.10 1ipf n ARG 138 Cb 0.12 -1.05 -0.04 0.00 0.45 0.00 0.00 32.46 31.94 1ipf n ARG 138 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1ipf s GLY 139 N -1.23 2.03 -0.05 5.14 0.00 -1.12 -4.70 107.32 107.39 1ipf s GLY 139 Ca 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 44.72 44.79 1ipf s GLY 139 CO -0.17 0.01 0.11 -1.31 0.00 0.00 0.00 173.10 171.74 1ipf s ASN 140 N -2.94 -0.08 -0.10 1.64 0.01 0.23 -2.29 114.94 111.41 1ipf s ASN 140 Ca 0.51 0.22 0.03 0.00 -0.71 0.00 0.00 52.86 52.91 1ipf s ASN 140 Cb -0.10 0.15 0.01 0.00 0.41 0.00 0.00 41.25 41.71 1ipf s ASN 140 CO 0.28 -0.11 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.88 1ipf s VAL 141 N 0.77 1.75 -0.10 1.60 1.01 -0.78 -1.46 120.40 123.19 1ipf s VAL 141 Ca -0.06 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1ipf s VAL 141 Cb -0.08 -1.55 0.02 0.00 0.00 0.00 0.00 36.38 34.77 1ipf s VAL 141 CO -0.03 0.49 -0.12 -0.69 0.00 0.00 0.00 175.10 174.75 1ipf s VAL 142 N 0.63 1.29 -0.13 2.92 1.01 0.24 -1.73 120.40 124.63 1ipf s VAL 142 Ca -0.13 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.28 1ipf s VAL 142 Cb -0.16 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1ipf s VAL 142 CO 0.04 0.40 0.10 -0.36 0.00 0.00 0.00 175.10 175.28 1ipf s PHE 143 N 1.18 3.45 -0.52 5.22 0.08 -0.27 -0.79 117.98 126.32 1ipf s PHE 143 Ca -0.04 0.39 -0.17 0.00 0.12 0.00 0.00 56.93 57.23 1ipf s PHE 143 Cb -0.14 -1.95 0.09 0.00 -0.57 0.00 0.00 43.02 40.45 1ipf s PHE 143 CO -0.03 0.58 0.55 0.42 -0.10 0.00 0.00 175.22 176.63 1ipf s ILE 144 N -0.70 5.04 0.00 0.64 -1.09 -0.81 -0.42 121.20 123.86 1ipf s ILE 144 Ca 0.13 -0.97 0.00 0.00 -2.23 0.00 0.00 60.65 57.57 1ipf s ILE 144 Cb -0.12 -4.30 0.00 0.00 -1.58 0.00 0.00 42.46 36.46 1ipf s ILE 144 CO 0.03 -0.82 0.00 -0.24 -1.23 0.00 0.00 174.94 172.67 1ipf n SER 145 N 5.74 0.00 -3.59 3.58 2.88 0.03 -4.88 113.62 117.38 1ipf n SER 145 Ca -0.10 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.38 1ipf n SER 145 Cb 0.43 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.86 1ipf n SER 145 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ipf s SER 146 N -1.00 -0.19 0.47 -3.46 0.15 -1.26 -4.15 113.70 104.26 1ipf s SER 146 Ca 0.00 0.09 0.23 0.00 0.70 0.00 0.00 55.95 56.97 1ipf s SER 146 Cb 0.00 0.18 1.15 0.00 -1.71 0.00 0.00 66.02 65.64 1ipf s SER 146 CO 0.00 -0.26 1.96 -0.37 1.20 0.00 0.00 173.24 175.77 1ipf h VAL 147 N 2.13 0.73 0.00 4.45 -1.51 -1.74 -2.21 116.25 118.11 1ipf h VAL 147 Ca -0.12 -0.84 0.00 0.00 -1.23 0.00 0.00 66.70 64.51 1ipf h VAL 147 Cb 1.18 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.86 1ipf h VAL 147 CO 0.25 0.20 0.00 -1.20 -1.23 0.00 0.00 177.57 175.59 1ipf n SER 148 N -3.70 0.00 -0.89 4.19 7.64 -1.26 -1.81 113.62 117.79 1ipf n SER 148 Ca -0.01 -0.58 0.09 0.00 1.01 0.00 0.00 58.87 59.37 1ipf n SER 148 Cb 0.32 0.00 0.17 0.00 -1.01 0.00 0.00 64.21 63.69 1ipf n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ipf n GLY 149 N 0.05 1.60 0.00 0.23 0.00 -0.83 -3.99 105.19 102.25 1ipf n GLY 149 Ca 0.11 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1ipf n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ipf n ALA 150 N 1.08 1.05 -2.74 4.61 0.00 -0.92 -4.13 120.51 119.46 1ipf n ALA 150 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.42 1ipf n ALA 150 Cb 0.49 0.05 -0.13 0.00 0.00 0.00 0.00 19.45 19.86 1ipf n ALA 150 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ipf s LEU 151 N -1.58 2.15 0.31 0.00 1.43 -0.75 -5.13 118.68 115.10 1ipf s LEU 151 Ca 0.00 -0.38 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 1ipf s LEU 151 Cb 0.00 -0.39 -0.10 0.00 0.03 0.00 0.00 46.19 45.73 1ipf s LEU 151 CO 0.00 -0.02 1.33 0.00 0.23 0.00 0.00 176.35 177.89 1ipf s ALA 152 N -0.78 3.52 -0.02 4.21 0.00 -1.26 -4.30 121.76 123.13 1ipf s ALA 152 Ca -0.02 1.27 -0.06 0.00 0.00 0.00 0.00 51.96 53.15 1ipf s ALA 152 Cb -0.07 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.57 1ipf s ALA 152 CO 0.01 -0.65 0.13 0.08 0.00 0.00 0.00 175.76 175.33 1ipf s VAL 153 N -0.89 0.05 0.14 0.00 1.01 -1.26 -5.04 120.40 114.41 1ipf s VAL 153 Ca 0.51 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.73 1ipf s VAL 153 Cb -0.40 -0.34 -0.10 0.00 0.00 0.00 0.00 36.38 35.54 1ipf s VAL 153 CO 0.51 -0.24 1.66 -2.84 0.00 0.00 0.00 175.10 174.18 1ipf s PRO 154 N -0.84 4.18 -0.21 2.72 0.02 -1.26 -2.92 135.00 136.68 1ipf s PRO 154 Ca -0.09 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.36 1ipf s PRO 154 Cb -0.05 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 31.15 1ipf s PRO 154 CO 0.01 -0.70 0.00 0.66 -0.33 0.00 0.00 177.00 176.64 1ipf n TYR 155 N 4.64 0.00 -1.66 6.54 4.01 -1.26 -4.88 117.16 124.54 1ipf n TYR 155 Ca 0.15 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.95 1ipf n TYR 155 Cb 0.38 -1.03 0.16 0.00 -0.31 0.00 0.00 39.34 38.54 1ipf n TYR 155 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1ipf n GLU 156 N -1.70 1.20 0.15 -0.72 1.02 -1.15 -3.68 120.64 115.76 1ipf n GLU 156 Ca -0.02 -2.85 -0.14 0.00 -0.02 0.00 0.00 57.16 54.13 1ipf n GLU 156 Cb 0.22 -1.29 -0.08 0.00 -0.02 0.00 0.00 31.44 30.28 1ipf n GLU 156 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ipf h ALA 157 N 0.76 -0.37 -0.31 0.62 0.00 -1.86 0.57 119.26 118.67 1ipf h ALA 157 Ca -0.04 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1ipf h ALA 157 Cb 1.16 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1ipf h ALA 157 CO 0.02 -0.58 -0.37 0.28 0.00 0.00 0.00 179.25 178.60 1ipf h VAL 158 N -0.63 1.29 -0.21 0.00 2.07 -1.92 0.34 116.25 117.19 1ipf h VAL 158 Ca -0.04 -1.53 -0.07 0.00 0.82 0.00 0.00 66.70 65.88 1ipf h VAL 158 Cb 0.45 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1ipf h VAL 158 CO 0.06 0.50 -0.18 0.22 0.02 0.00 0.00 177.57 178.19 1ipf h TYR 159 N 0.59 0.38 0.02 1.57 5.03 -1.85 -1.37 116.97 121.33 1ipf h TYR 159 Ca 0.06 -0.06 -0.21 0.00 2.58 0.00 0.00 58.73 61.09 1ipf h TYR 159 Cb 0.90 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 39.07 1ipf h TYR 159 CO 0.04 0.52 -0.95 0.78 -1.32 0.00 0.00 178.16 177.24 1ipf h GLY 160 N 0.91 0.24 1.51 1.82 0.00 0.45 -2.86 103.07 105.13 1ipf h GLY 160 Ca 0.06 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 1ipf h GLY 160 CO 0.03 0.41 0.28 0.00 0.00 0.00 0.00 176.54 177.26 1ipf h ALA 161 N 0.89 1.59 0.00 3.60 0.00 -0.14 0.61 119.26 125.81 1ipf h ALA 161 Ca -0.06 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 1ipf h ALA 161 Cb 1.60 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1ipf h ALA 161 CO 0.15 0.35 -0.86 1.79 0.00 0.00 0.00 179.25 180.69 1ipf h THR 162 N 0.66 1.57 0.00 0.00 1.35 -1.21 -2.53 112.91 112.76 1ipf h THR 162 Ca 0.17 -2.81 -0.20 0.00 -0.55 0.00 0.00 66.41 63.03 1ipf h THR 162 Cb -0.01 2.54 -0.03 0.00 -1.73 0.00 0.00 68.15 68.92 1ipf h THR 162 CO -0.03 0.81 -1.01 0.11 -0.25 0.00 0.00 175.52 175.15 1ipf h LYS 163 N 0.03 0.00 -0.01 4.72 1.79 -1.10 -2.56 116.57 119.45 1ipf h LYS 163 Ca -0.02 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.31 1ipf h LYS 163 Cb 1.50 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.13 1ipf h LYS 163 CO 0.12 0.80 -0.65 0.78 -1.08 0.00 0.00 179.45 179.42 1ipf h GLY 164 N 3.20 0.03 0.67 3.86 0.00 0.19 -2.17 103.07 108.85 1ipf h GLY 164 Ca -0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 1ipf h GLY 164 CO 0.11 0.03 -0.13 0.00 0.00 0.00 0.00 176.54 176.55 1ipf h ALA 165 N 1.33 0.15 -0.94 3.60 0.00 -1.43 -3.07 119.26 118.90 1ipf h ALA 165 Ca -0.01 -0.32 0.08 0.00 0.00 0.00 0.00 54.91 54.66 1ipf h ALA 165 Cb 1.15 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 1ipf h ALA 165 CO 0.09 0.03 0.59 1.98 0.00 0.00 0.00 179.25 181.93 1ipf h MET 166 N -0.15 0.99 -0.43 0.00 -1.53 -1.39 -1.46 114.93 110.96 1ipf h MET 166 Ca 0.01 -0.06 -0.07 0.00 -3.44 0.00 0.00 59.70 56.14 1ipf h MET 166 Cb 0.67 -0.22 -0.02 0.00 -0.55 0.00 0.00 31.60 31.48 1ipf h MET 166 CO 0.03 0.66 -0.02 -0.44 0.14 0.00 0.00 176.91 177.28 1ipf h ASP 167 N 1.02 0.67 0.02 1.39 3.45 -1.39 0.14 116.42 121.72 1ipf h ASP 167 Ca 0.43 -0.16 -0.14 0.00 0.43 0.00 0.00 57.03 57.59 1ipf h ASP 167 Cb 0.28 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 1ipf h ASP 167 CO -0.21 0.75 -0.48 -0.61 -1.57 0.00 0.00 179.24 177.13 1ipf h GLN 168 N 0.66 0.53 -0.10 3.56 5.75 -1.30 -1.74 115.11 122.47 1ipf h GLN 168 Ca 0.13 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.33 1ipf h GLN 168 Cb 0.44 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 1ipf h GLN 168 CO 0.02 0.90 0.06 1.25 -2.65 0.00 0.00 178.83 178.40 1ipf h LEU 169 N 0.43 0.10 -0.21 -2.39 5.85 -0.61 -1.12 115.31 117.35 1ipf h LEU 169 Ca 0.02 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.80 1ipf h LEU 169 Cb 1.00 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 1ipf h LEU 169 CO 0.09 0.07 -0.27 0.74 -0.34 0.00 0.00 178.44 178.73 1ipf h THR 170 N 0.12 0.36 -0.06 1.05 2.02 -0.48 -0.32 112.91 115.60 1ipf h THR 170 Ca 0.04 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.25 1ipf h THR 170 Cb -0.01 0.36 -0.04 0.00 -1.74 0.00 0.00 68.15 66.72 1ipf h THR 170 CO -0.01 0.00 -0.14 0.03 0.37 0.00 0.00 175.52 175.77 1ipf h ARG 171 N -0.29 -0.19 -0.52 6.66 3.08 -1.03 -2.39 114.38 119.70 1ipf h ARG 171 Ca 0.12 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.16 1ipf h ARG 171 Cb 0.49 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 1ipf h ARG 171 CO -0.38 -0.13 0.21 0.00 -1.07 0.00 0.00 179.97 178.61 1ipf h LEU 173 N 0.70 0.12 -1.74 0.00 3.38 -0.93 -1.32 115.31 115.52 1ipf h LEU 173 Ca 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1ipf h LEU 173 Cb 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1ipf h LEU 173 CO -0.01 0.15 0.10 0.00 0.09 0.00 0.00 178.44 178.77 1ipf h ALA 174 N 1.87 1.80 0.00 1.53 0.00 -1.24 -0.31 119.26 122.91 1ipf h ALA 174 Ca 0.03 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.68 1ipf h ALA 174 Cb 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1ipf h ALA 174 CO 0.00 0.17 -1.57 1.19 0.00 0.00 0.00 179.25 179.04 1ipf n PHE 175 N -4.48 0.94 0.05 0.00 3.72 -0.57 -2.99 117.46 114.13 1ipf n PHE 175 Ca -0.00 0.32 -0.03 0.00 -0.05 0.00 0.00 57.45 57.69 1ipf n PHE 175 Cb 0.10 -1.11 -0.08 0.00 -0.94 0.00 0.00 39.48 37.45 1ipf n PHE 175 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1ipf h GLU 176 N 0.00 0.00 -0.27 -1.08 5.08 -1.04 -3.35 114.58 113.92 1ipf h GLU 176 Ca -0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1ipf h GLU 176 Cb 1.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.01 1ipf h GLU 176 CO 0.06 0.59 0.00 0.91 -1.00 0.00 0.00 179.01 179.56 1ipf n TRP 177 N -3.14 0.34 -0.33 4.33 7.02 -0.15 -4.55 117.44 120.97 1ipf n TRP 177 Ca -0.06 -0.23 0.01 0.00 -1.02 0.00 0.00 57.50 56.20 1ipf n TRP 177 Cb 0.89 -0.01 0.15 0.00 -2.42 0.00 0.00 31.31 29.92 1ipf n TRP 177 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ipf h ALA 178 N 3.32 1.24 0.00 6.99 0.00 -1.67 -0.55 119.26 128.60 1ipf h ALA 178 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ipf h ALA 178 Cb 0.79 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ipf h ALA 178 CO 0.00 0.35 0.00 0.36 0.00 0.00 0.00 179.25 179.96 1ipf n LYS 179 N -4.57 0.05 -0.28 0.00 2.85 -1.26 -2.23 118.16 112.72 1ipf n LYS 179 Ca 0.13 0.27 0.11 0.00 -1.05 0.00 0.00 58.31 57.76 1ipf n LYS 179 Cb 0.17 -1.60 0.27 0.00 -0.65 0.00 0.00 35.03 33.22 1ipf n LYS 179 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1ipf n ASP 180 N -1.70 3.31 -0.38 -5.58 8.00 -0.24 -4.92 116.55 115.05 1ipf n ASP 180 Ca 0.04 -1.98 -0.05 0.00 0.71 0.00 0.00 54.79 53.51 1ipf n ASP 180 Cb 0.21 -0.37 -0.02 0.00 -0.02 0.00 0.00 41.12 40.92 1ipf n ASP 180 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ipf n ASN 181 N 1.33 -3.82 -4.44 -2.24 5.03 -0.95 -4.53 115.26 105.63 1ipf n ASN 181 Ca 0.21 0.12 -0.37 0.00 0.87 0.00 0.00 54.58 55.41 1ipf n ASN 181 Cb 0.54 -1.76 -0.12 0.00 -1.02 0.00 0.00 39.78 37.42 1ipf n ASN 181 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ipf s ILE 182 N -2.11 4.38 -0.01 2.41 1.01 -1.08 -2.80 121.20 123.00 1ipf s ILE 182 Ca 0.00 -0.26 -0.17 0.00 0.00 0.00 0.00 60.65 60.22 1ipf s ILE 182 Cb 0.00 -3.11 -0.06 0.00 0.01 0.00 0.00 42.46 39.30 1ipf s ILE 182 CO 0.00 0.25 0.47 -0.13 0.00 0.00 0.00 174.94 175.54 1ipf s ARG 183 N 1.61 4.11 -0.12 2.79 0.52 -0.97 -4.05 118.95 122.85 1ipf s ARG 183 Ca 0.06 0.52 0.01 0.00 -0.52 0.00 0.00 55.73 55.79 1ipf s ARG 183 Cb -0.16 -3.28 0.02 0.00 0.52 0.00 0.00 34.95 32.05 1ipf s ARG 183 CO 0.04 0.53 -0.13 0.08 0.02 0.00 0.00 175.30 175.85 1ipf s VAL 184 N -0.63 1.36 0.04 3.52 1.01 -1.26 -1.86 120.40 122.58 1ipf s VAL 184 Ca 0.26 -0.53 -0.00 0.00 0.00 0.00 0.00 61.98 61.70 1ipf s VAL 184 Cb -0.17 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1ipf s VAL 184 CO 0.14 0.42 -0.04 0.20 0.00 0.00 0.00 175.10 175.82 1ipf s ASN 185 N 1.27 0.46 0.21 3.32 0.01 -0.71 0.10 114.94 119.61 1ipf s ASN 185 Ca -0.01 -0.77 0.10 0.00 -0.71 0.00 0.00 52.86 51.46 1ipf s ASN 185 Cb -0.14 0.14 -0.04 0.00 0.41 0.00 0.00 41.25 41.62 1ipf s ASN 185 CO -0.05 -0.45 -0.11 -0.83 -1.51 0.00 0.00 177.10 174.15 1ipf s GLY 186 N -2.26 1.73 -0.17 0.66 0.00 0.56 -1.12 107.32 106.72 1ipf s GLY 186 Ca -0.03 -1.60 -0.03 0.00 0.00 0.00 0.00 44.72 43.07 1ipf s GLY 186 CO -0.05 -1.64 0.03 0.14 0.00 0.00 0.00 173.10 171.58 1ipf s VAL 187 N -1.95 0.52 -0.57 1.40 1.01 0.44 -1.16 120.40 120.09 1ipf s VAL 187 Ca 0.26 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.60 1ipf s VAL 187 Cb -0.08 -0.96 0.09 0.00 0.00 0.00 0.00 36.38 35.43 1ipf s VAL 187 CO 0.15 -0.12 0.70 -0.83 0.00 0.00 0.00 175.10 175.00 1ipf s GLY 188 N 1.87 1.74 0.66 4.51 0.00 0.18 -0.79 107.32 115.49 1ipf s GLY 188 Ca 0.00 -2.04 -0.14 0.00 0.00 0.00 0.00 44.72 42.54 1ipf s GLY 188 CO -0.08 1.59 1.08 2.56 0.00 0.00 0.00 173.10 178.26 1ipf s PRO 189 N 2.79 2.91 0.00 2.90 0.05 -1.26 -2.13 135.00 140.26 1ipf s PRO 189 Ca 0.14 1.24 0.00 0.00 0.05 0.00 0.00 61.00 62.43 1ipf s PRO 189 Cb -0.22 -1.98 0.00 0.00 0.05 0.00 0.00 34.50 32.35 1ipf s PRO 189 CO 0.08 -1.14 0.00 0.41 0.05 0.00 0.00 177.00 176.40 1ipf n GLY 190 N -0.96 0.76 2.96 0.56 0.00 -0.79 -2.64 105.19 105.08 1ipf n GLY 190 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1ipf n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ipf s VAL 191 N 0.56 1.48 -0.04 1.61 1.01 -1.26 -4.80 120.40 118.95 1ipf s VAL 191 Ca 0.00 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.15 1ipf s VAL 191 Cb 0.00 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1ipf s VAL 191 CO 0.00 0.15 -0.25 -0.63 0.00 0.00 0.00 175.10 174.37 1ipf s ILE 192 N 1.47 2.15 -0.73 2.22 -1.09 -1.26 -0.72 121.20 123.23 1ipf s ILE 192 Ca -0.01 -1.06 -0.26 0.00 -2.23 0.00 0.00 60.65 57.10 1ipf s ILE 192 Cb -0.16 -1.76 -0.05 0.00 -1.58 0.00 0.00 42.46 38.91 1ipf s ILE 192 CO -0.08 0.58 1.99 0.00 -1.23 0.00 0.00 174.94 176.20 1ipf s ALA 193 N -0.44 1.79 0.38 9.38 0.00 0.15 -4.75 121.76 128.26 1ipf s ALA 193 Ca 0.05 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.11 1ipf s ALA 193 Cb -0.12 -4.43 -0.04 0.00 0.00 0.00 0.00 23.12 18.53 1ipf s ALA 193 CO 0.01 -4.49 0.08 0.95 0.00 0.00 0.00 175.76 172.31 1ipf s THR 194 N 10.27 0.96 0.48 0.00 -4.23 -1.26 -4.56 115.64 117.29 1ipf s THR 194 Ca 0.73 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 59.39 1ipf s THR 194 Cb -0.11 -2.56 0.23 0.00 1.34 0.00 0.00 72.50 71.40 1ipf s THR 194 CO 0.12 0.00 2.07 0.77 -0.54 0.00 0.00 174.62 177.04 1ipf h SER 195 N 1.91 0.03 -0.18 3.99 4.64 -1.95 0.16 113.55 122.15 1ipf h SER 195 Ca -0.39 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 1ipf h SER 195 Cb 1.26 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1ipf h SER 195 CO 0.65 0.10 -0.07 0.25 -0.87 0.00 0.00 176.83 176.90 1ipf h LEU 196 N 0.03 0.37 -1.07 5.97 6.46 -1.95 -1.18 115.31 123.93 1ipf h LEU 196 Ca 0.01 -0.39 -0.05 0.00 -0.12 0.00 0.00 57.88 57.32 1ipf h LEU 196 Cb 0.15 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 1ipf h LEU 196 CO 0.01 0.68 0.06 0.58 -0.62 0.00 0.00 178.44 179.15 1ipf h VAL 197 N 0.05 1.22 0.98 1.05 2.07 -1.65 -2.55 116.25 117.42 1ipf h VAL 197 Ca 0.04 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.67 1ipf h VAL 197 Cb 0.53 0.80 0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1ipf h VAL 197 CO 0.02 0.30 -0.48 -0.08 0.02 0.00 0.00 177.57 177.35 1ipf h GLU 198 N 0.69 -1.28 -0.88 1.57 4.81 -0.44 -1.87 114.58 117.19 1ipf h GLU 198 Ca 0.15 0.09 0.24 0.00 -0.13 0.00 0.00 59.36 59.70 1ipf h GLU 198 Cb 0.34 0.29 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 1ipf h GLU 198 CO 0.01 -0.85 0.61 0.00 -0.73 0.00 0.00 179.01 178.05 1ipf h MET 199 N -1.33 0.12 0.81 1.92 -0.00 -1.18 -2.44 114.93 112.85 1ipf h MET 199 Ca -0.13 -0.01 -0.04 0.00 -0.00 0.00 0.00 59.70 59.52 1ipf h MET 199 Cb 1.02 -0.03 0.01 0.00 -0.00 0.00 0.00 31.60 32.60 1ipf h MET 199 CO 0.21 0.08 -0.39 1.15 -0.00 0.00 0.00 176.91 177.96 1ipf h THR 200 N 0.13 0.09 0.00 -0.10 2.02 -0.97 -2.92 112.91 111.16 1ipf h THR 200 Ca 0.43 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.46 1ipf h THR 200 Cb 1.51 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1ipf h THR 200 CO -0.06 0.01 0.00 2.30 0.37 0.00 0.00 175.52 178.13 1ipf n ILE 201 N -5.51 0.00 0.24 3.11 -5.35 -0.76 -0.76 119.36 110.32 1ipf n ILE 201 Ca -0.14 0.00 0.12 0.00 -0.27 0.00 0.00 62.75 62.46 1ipf n ILE 201 Cb 0.44 -0.85 0.52 0.00 -1.74 0.00 0.00 39.64 38.00 1ipf n ILE 201 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1ipf h GLN 202 N 0.00 0.00 -5.28 6.28 1.08 -1.49 -3.41 115.11 112.28 1ipf h GLN 202 Ca 0.00 0.00 -0.62 0.00 -1.45 0.00 0.00 58.65 56.58 1ipf h GLN 202 Cb 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 27.30 1ipf h GLN 202 CO 0.00 0.14 -0.16 0.34 -0.95 0.00 0.00 178.83 178.21 1ipf s ASP 203 N -6.03 6.35 0.63 1.46 -1.08 0.06 -4.97 116.67 113.09 1ipf s ASP 203 Ca 0.01 0.42 0.31 0.00 -0.52 0.00 0.00 52.55 52.77 1ipf s ASP 203 Cb 0.10 -2.24 1.70 0.00 -1.46 0.00 0.00 42.92 41.02 1ipf s ASP 203 CO 0.61 -0.19 2.01 -0.65 0.52 0.00 0.00 175.17 177.47 1ipf h PRO 204 N 7.93 0.00 0.05 4.34 0.11 -1.87 0.17 132.00 142.73 1ipf h PRO 204 Ca -0.32 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.56 1ipf h PRO 204 Cb 1.16 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1ipf h PRO 204 CO 0.68 0.00 -1.26 1.49 -0.21 0.00 0.00 178.00 178.70 1ipf h GLU 205 N 0.00 0.10 0.00 1.05 4.81 -1.93 -3.10 114.58 115.50 1ipf h GLU 205 Ca 0.06 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.07 1ipf h GLU 205 Cb 0.65 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 1ipf h GLU 205 CO -0.00 1.08 -0.30 1.96 -0.73 0.00 0.00 179.01 181.02 1ipf h GLN 206 N -0.68 0.00 -0.27 1.92 1.08 -1.69 0.37 115.11 115.85 1ipf h GLN 206 Ca -0.31 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 56.74 1ipf h GLN 206 Cb 1.48 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.91 1ipf h GLN 206 CO -0.08 0.30 -0.43 -0.22 -0.95 0.00 0.00 178.83 177.44 1ipf h LYS 207 N 0.00 0.76 -0.34 1.46 3.64 -0.82 0.97 116.57 122.25 1ipf h LYS 207 Ca -0.00 -0.46 -0.08 0.00 -1.27 0.00 0.00 60.65 58.83 1ipf h LYS 207 Cb 0.58 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1ipf h LYS 207 CO 0.04 1.09 -0.14 1.49 -2.27 0.00 0.00 179.45 179.66 1ipf h GLU 208 N 0.51 0.59 0.00 1.90 4.81 -1.34 -1.59 114.58 119.46 1ipf h GLU 208 Ca 0.02 -0.19 -0.12 0.00 -0.13 0.00 0.00 59.36 58.94 1ipf h GLU 208 Cb 1.03 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1ipf h GLU 208 CO 0.10 0.72 -0.55 -0.91 -0.73 0.00 0.00 179.01 177.63 1ipf h ASN 209 N 0.54 0.00 -0.09 1.04 2.35 -0.74 -3.01 115.58 115.68 1ipf h ASN 209 Ca 0.09 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.64 1ipf h ASN 209 Cb 0.56 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.94 1ipf h ASN 209 CO 0.04 0.55 -0.73 0.25 -1.65 0.00 0.00 177.43 175.89 1ipf h LEU 210 N 0.00 0.79 -1.98 1.61 5.85 -0.13 -3.09 115.31 118.36 1ipf h LEU 210 Ca -0.01 -0.67 -0.01 0.00 0.84 0.00 0.00 57.88 58.03 1ipf h LEU 210 Cb 0.99 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 1ipf h LEU 210 CO 0.07 1.35 -0.03 0.78 -0.34 0.00 0.00 178.44 180.27 1ipf h ASN 211 N 0.30 0.00 -0.32 1.25 -0.26 -1.29 -1.09 115.58 114.18 1ipf h ASN 211 Ca -0.07 0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.59 1ipf h ASN 211 Cb 1.39 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.64 1ipf h ASN 211 CO 0.15 0.03 -0.11 0.11 -1.06 0.00 0.00 177.43 176.55 1ipf h LYS 212 N 0.00 0.64 -0.20 0.81 1.57 -1.45 -2.12 116.57 115.81 1ipf h LYS 212 Ca -0.00 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1ipf h LYS 212 Cb 0.34 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1ipf h LYS 212 CO 0.00 0.83 0.08 -0.07 -0.57 0.00 0.00 179.45 179.73 1ipf h LEU 213 N 0.40 0.28 -1.58 2.94 3.38 -1.18 -1.38 115.31 118.18 1ipf h LEU 213 Ca 0.08 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1ipf h LEU 213 Cb 0.62 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1ipf h LEU 213 CO 0.04 0.37 -0.22 0.40 0.09 0.00 0.00 178.44 179.12 1ipf h ILE 214 N 0.18 1.10 0.00 1.22 2.04 -1.39 -1.73 117.51 118.92 1ipf h ILE 214 Ca 0.07 -0.76 -0.12 0.00 1.00 0.00 0.00 64.86 65.05 1ipf h ILE 214 Cb 0.18 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1ipf h ILE 214 CO -0.01 0.21 -0.55 0.44 0.00 0.00 0.00 178.15 178.24 1ipf h ASP 215 N 0.00 0.00 -0.09 1.72 3.45 -0.99 -2.77 116.42 117.74 1ipf h ASP 215 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1ipf h ASP 215 Cb 0.40 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 1ipf h ASP 215 CO 0.03 0.55 0.00 0.54 -1.57 0.00 0.00 179.24 178.79 1ipf n ARG 216 N -3.51 1.38 -2.35 3.56 1.74 -0.55 -4.85 116.66 112.09 1ipf n ARG 216 Ca 0.00 -0.58 -0.29 0.00 -0.77 0.00 0.00 57.85 56.21 1ipf n ARG 216 Cb 0.64 -1.34 -0.00 0.00 -1.02 0.00 0.00 32.46 30.74 1ipf n ARG 216 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ipf h ALA 218 N 0.19 0.07 0.00 0.00 0.00 -1.42 -3.28 119.26 114.83 1ipf h ALA 218 Ca -0.46 -1.01 -0.15 0.00 0.00 0.00 0.00 54.91 53.29 1ipf h ALA 218 Cb 1.20 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1ipf h ALA 218 CO 0.62 0.94 -0.81 -0.07 0.00 0.00 0.00 179.25 179.93 1ipf h LEU 219 N 0.11 0.00 -1.47 0.00 3.38 -1.83 -3.48 115.31 112.01 1ipf h LEU 219 Ca -0.26 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.33 1ipf h LEU 219 Cb 2.09 0.00 0.11 0.00 0.09 0.00 0.00 40.66 42.95 1ipf h LEU 219 CO 0.21 0.68 -0.77 0.54 0.09 0.00 0.00 178.44 179.19 1ipf n ARG 220 N -3.21 -6.35 -3.63 1.13 1.74 -1.24 -4.98 116.66 100.12 1ipf n ARG 220 Ca -0.01 0.76 -0.08 0.00 -0.77 0.00 0.00 57.85 57.76 1ipf n ARG 220 Cb 0.82 -5.66 -0.02 0.00 -1.02 0.00 0.00 32.46 26.59 1ipf n ARG 220 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1ipf s ARG 221 N -5.83 1.27 0.52 5.56 1.70 -1.25 -4.86 118.95 116.06 1ipf s ARG 221 Ca 0.18 -0.60 -0.11 0.00 -0.47 0.00 0.00 55.73 54.73 1ipf s ARG 221 Cb -0.08 0.50 -0.05 0.00 -0.57 0.00 0.00 34.95 34.74 1ipf s ARG 221 CO 0.76 -0.57 0.92 -1.64 -1.08 0.00 0.00 175.30 173.69 1ipf s MET 222 N -3.51 3.71 0.63 3.89 -1.94 -1.26 -4.95 119.30 115.86 1ipf s MET 222 Ca 0.07 0.63 -0.02 0.00 -1.71 0.00 0.00 55.69 54.66 1ipf s MET 222 Cb -0.02 -2.21 0.05 0.00 2.01 0.00 0.00 34.83 34.65 1ipf s MET 222 CO -0.03 -0.32 0.89 0.20 -0.01 0.00 0.00 175.02 175.75 1ipf s GLY 223 N -3.69 1.77 -0.11 -0.03 0.00 0.10 -4.85 107.32 100.50 1ipf s GLY 223 Ca 0.54 -1.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.07 1ipf s GLY 223 CO 0.42 -0.82 -0.07 -0.54 0.00 0.00 0.00 173.10 172.09 1ipf s GLU 224 N -5.00 3.20 0.35 2.90 0.41 -1.26 -0.68 118.70 118.62 1ipf s GLU 224 Ca 0.59 -0.56 0.28 0.00 -0.41 0.00 0.00 54.97 54.88 1ipf s GLU 224 Cb -0.10 -2.72 1.13 0.00 -1.78 0.00 0.00 34.13 30.66 1ipf s GLU 224 CO 0.41 0.43 1.10 -2.30 -0.49 0.00 0.00 175.26 174.42 1ipf n PRO 225 N 2.92 -0.01 0.17 0.39 -0.02 -1.26 0.16 135.00 137.35 1ipf n PRO 225 Ca -0.18 0.83 0.09 0.00 -2.02 0.00 0.00 63.50 62.23 1ipf n PRO 225 Cb 0.53 -1.75 0.10 0.00 -0.02 0.00 0.00 33.50 32.35 1ipf n PRO 225 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1ipf h LYS 226 N 0.00 0.00 -0.05 -0.52 2.10 -1.92 -1.67 116.57 114.50 1ipf h LYS 226 Ca 0.64 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 59.14 1ipf h LYS 226 Cb 2.30 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 33.61 1ipf h LYS 226 CO -0.19 0.13 -0.65 0.93 -2.00 0.00 0.00 179.45 177.66 1ipf h GLU 227 N 0.00 0.22 0.04 0.07 5.08 0.11 -1.59 114.58 118.51 1ipf h GLU 227 Ca -0.01 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1ipf h GLU 227 Cb 1.12 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1ipf h GLU 227 CO 0.02 0.79 -0.02 1.25 -1.00 0.00 0.00 179.01 180.05 1ipf h LEU 228 N 0.15 -0.04 -2.11 1.33 7.12 -1.54 -3.28 115.31 116.94 1ipf h LEU 228 Ca -0.01 -0.64 0.08 0.00 0.13 0.00 0.00 57.88 57.44 1ipf h LEU 228 Cb 1.18 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 41.31 1ipf h LEU 228 CO 0.10 0.66 0.24 0.00 -0.13 0.00 0.00 178.44 179.32 1ipf h ALA 229 N 0.05 2.06 -0.33 1.25 0.00 -1.25 -1.50 119.26 119.54 1ipf h ALA 229 Ca -0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1ipf h ALA 229 Cb 0.68 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1ipf h ALA 229 CO 0.01 -0.39 -0.08 0.00 0.00 0.00 0.00 179.25 178.79 1ipf h ALA 230 N 1.77 1.24 -0.19 0.00 0.00 -1.34 -0.35 119.26 120.39 1ipf h ALA 230 Ca 0.13 -0.26 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 1ipf h ALA 230 Cb 0.62 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ipf h ALA 230 CO -0.00 0.50 -0.71 1.98 0.00 0.00 0.00 179.25 181.02 1ipf h MET 231 N 0.51 0.81 -0.70 0.00 1.85 -1.40 -2.22 114.93 113.78 1ipf h MET 231 Ca 0.10 -0.61 -0.03 0.00 -0.61 0.00 0.00 59.70 58.55 1ipf h MET 231 Cb 0.46 0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.57 1ipf h MET 231 CO 0.02 1.23 0.32 0.28 -0.40 0.00 0.00 176.91 178.36 1ipf h VAL 232 N 0.58 1.23 -0.01 -5.77 2.07 -1.34 -2.49 116.25 110.53 1ipf h VAL 232 Ca -0.03 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1ipf h VAL 232 Cb 1.33 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1ipf h VAL 232 CO 0.15 0.28 0.00 0.00 0.02 0.00 0.00 177.57 178.02 1ipf h ALA 233 N 1.15 0.01 -0.56 1.67 0.00 -1.01 -3.08 119.26 117.44 1ipf h ALA 233 Ca 0.24 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.13 1ipf h ALA 233 Cb 0.14 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.85 1ipf h ALA 233 CO -0.03 -0.38 0.14 0.35 0.00 0.00 0.00 179.25 179.34 1ipf h PHE 234 N -0.20 0.24 0.00 0.00 3.57 -1.30 0.99 116.94 120.24 1ipf h PHE 234 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1ipf h PHE 234 Cb 0.22 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1ipf h PHE 234 CO -0.00 0.02 0.10 -0.07 -2.23 0.00 0.00 178.31 176.12 1ipf h LEU 235 N 0.29 0.00 0.00 0.59 3.38 -1.36 -1.30 115.31 116.90 1ipf h LEU 235 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1ipf h LEU 235 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1ipf h LEU 235 CO -0.34 0.00 -1.31 0.00 0.09 0.00 0.00 178.44 176.88 1ipf s PHE 237 N -3.32 2.19 -1.09 0.00 0.08 -0.49 -4.86 117.98 110.48 1ipf s PHE 237 Ca -0.01 1.63 0.17 0.00 0.12 0.00 0.00 56.93 58.84 1ipf s PHE 237 Cb 0.13 -3.26 0.74 0.00 -0.57 0.00 0.00 43.02 40.07 1ipf s PHE 237 CO 0.83 -2.26 1.53 -2.30 -0.10 0.00 0.00 175.22 172.92 1ipf n PRO 238 N -3.32 0.05 0.19 0.24 -0.02 -1.25 -2.40 135.00 128.50 1ipf n PRO 238 Ca 0.11 0.20 0.05 0.00 -2.02 0.00 0.00 63.50 61.84 1ipf n PRO 238 Cb 0.52 -1.50 0.33 0.00 -0.02 0.00 0.00 33.50 32.83 1ipf n PRO 238 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ipf h ALA 239 N 2.62 1.00 -0.43 3.55 0.00 -1.83 -3.09 119.26 121.08 1ipf h ALA 239 Ca 0.00 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.39 1ipf h ALA 239 Cb 0.26 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.89 1ipf h ALA 239 CO 0.00 0.48 0.21 0.00 0.00 0.00 0.00 179.25 179.95 1ipf n ALA 240 N -2.30 3.75 -0.27 0.00 0.00 -1.01 -4.62 120.51 116.06 1ipf n ALA 240 Ca -0.00 -1.28 0.16 0.00 0.00 0.00 0.00 53.44 52.32 1ipf n ALA 240 Cb 0.51 -1.17 0.44 0.00 0.00 0.00 0.00 19.45 19.23 1ipf n ALA 240 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ipf h SER 241 N 1.03 0.55 -0.10 0.00 4.64 -1.74 -1.28 113.55 116.65 1ipf h SER 241 Ca 0.21 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1ipf h SER 241 Cb 1.70 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.73 1ipf h SER 241 CO 0.45 0.24 0.00 0.00 -0.87 0.00 0.00 176.83 176.64 1ipf n TYR 242 N -4.57 0.12 -3.28 4.77 9.36 -1.26 -4.81 117.16 117.48 1ipf n TYR 242 Ca 0.19 -0.06 -0.44 0.00 3.32 0.00 0.00 57.90 60.92 1ipf n TYR 242 Cb 0.60 0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 39.24 1ipf n TYR 242 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1ipf s VAL 243 N -1.88 5.05 0.05 2.97 1.01 -0.48 -5.03 120.40 122.08 1ipf s VAL 243 Ca 0.35 -0.58 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 1ipf s VAL 243 Cb 0.19 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.43 1ipf s VAL 243 CO 0.30 -0.59 0.24 0.28 0.00 0.00 0.00 175.10 175.33 1ipf s THR 244 N 2.18 0.10 -0.33 3.92 -1.32 -1.26 -4.72 115.64 114.21 1ipf s THR 244 Ca 0.11 -0.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.75 1ipf s THR 244 Cb -0.20 -0.99 0.00 0.00 -1.51 0.00 0.00 72.50 69.81 1ipf s THR 244 CO 0.11 -0.47 0.00 0.61 -2.21 0.00 0.00 174.62 172.67 1ipf n GLY 245 N 0.52 0.48 3.88 6.08 0.00 0.11 -4.97 105.19 111.29 1ipf n GLY 245 Ca -0.18 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1ipf n GLY 245 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ipf s GLN 246 N -1.68 3.61 -0.31 1.61 -1.52 -1.25 -4.66 119.66 115.46 1ipf s GLN 246 Ca 0.00 -0.05 -0.03 0.00 -1.95 0.00 0.00 55.36 53.33 1ipf s GLN 246 Cb 0.00 -3.04 0.05 0.00 -0.22 0.00 0.00 33.01 29.80 1ipf s GLN 246 CO 0.00 0.61 0.03 0.42 -0.25 0.00 0.00 175.29 176.10 1ipf s ILE 247 N -1.36 3.20 -0.11 1.08 -1.09 -1.26 -0.32 121.20 121.34 1ipf s ILE 247 Ca 0.30 -1.30 -0.00 0.00 -2.23 0.00 0.00 60.65 57.42 1ipf s ILE 247 Cb -0.13 -2.83 -0.02 0.00 -1.58 0.00 0.00 42.46 37.90 1ipf s ILE 247 CO 0.18 -0.12 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.04 1ipf s ILE 248 N 1.30 3.36 -0.16 2.92 1.01 -0.31 -4.90 121.20 124.41 1ipf s ILE 248 Ca -0.04 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 59.96 1ipf s ILE 248 Cb -0.20 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 1ipf s ILE 248 CO -0.00 0.54 0.10 -0.31 0.00 0.00 0.00 174.94 175.28 1ipf s TYR 249 N -0.05 3.41 -0.67 3.97 1.51 -1.26 0.50 117.35 124.75 1ipf s TYR 249 Ca -0.01 0.32 0.01 0.00 -1.01 0.00 0.00 57.07 56.38 1ipf s TYR 249 Cb -0.14 -2.04 0.17 0.00 -0.11 0.00 0.00 41.96 39.84 1ipf s TYR 249 CO 0.03 0.41 0.47 0.08 -1.11 0.00 0.00 175.55 175.44 1ipf s VAL 250 N -0.19 3.30 -0.02 0.71 1.01 -0.90 -4.84 120.40 119.47 1ipf s VAL 250 Ca 0.09 -3.62 0.03 0.00 0.00 0.00 0.00 61.98 58.49 1ipf s VAL 250 Cb -0.12 -3.16 0.05 0.00 0.00 0.00 0.00 36.38 33.16 1ipf s VAL 250 CO 0.01 -0.93 0.88 -0.90 0.00 0.00 0.00 175.10 174.15 1ipf n ASP 251 N 2.71 1.15 -2.38 3.32 5.68 -1.26 -1.88 116.55 123.89 1ipf n ASP 251 Ca 0.13 -1.90 -0.20 0.00 -0.50 0.00 0.00 54.79 52.33 1ipf n ASP 251 Cb 0.35 -0.11 0.01 0.00 -1.14 0.00 0.00 41.12 40.23 1ipf n ASP 251 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ipf n GLY 252 N -0.44 -0.42 1.91 6.12 0.00 -1.26 -2.47 105.19 108.62 1ipf n GLY 252 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1ipf n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ipf n GLY 253 N -1.17 0.81 0.33 -0.02 0.00 -1.26 -1.25 105.19 102.63 1ipf n GLY 253 Ca -0.19 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.05 1ipf n GLY 253 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ipf h LEU 254 N 0.00 0.00 0.00 0.99 5.85 -1.72 -2.09 115.31 118.34 1ipf h LEU 254 Ca 0.00 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.56 1ipf h LEU 254 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1ipf h LEU 254 CO 0.00 0.00 -0.84 0.24 -0.34 0.00 0.00 178.44 177.50 1ipf h MET 255 N 0.00 0.00 -0.00 1.25 2.86 -1.91 -3.27 114.93 113.86 1ipf h MET 255 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1ipf h MET 255 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 1ipf h MET 255 CO -0.00 0.67 -0.13 0.00 1.06 0.00 0.00 176.91 178.51 1ipf n ALA 256 N -2.31 2.79 -2.23 6.32 0.00 -0.79 -4.92 120.51 119.37 1ipf n ALA 256 Ca -0.01 -0.26 -0.30 0.00 0.00 0.00 0.00 53.44 52.87 1ipf n ALA 256 Cb 0.84 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.94 1ipf n ALA 256 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ipf s ASN 257 N -2.56 6.47 0.29 0.00 2.47 -1.21 -4.97 114.94 115.44 1ipf s ASN 257 Ca 0.26 1.05 0.00 0.00 0.42 0.00 0.00 52.86 54.59 1ipf s ASN 257 Cb 0.20 -2.29 0.00 0.00 -1.45 0.00 0.00 41.25 37.71 1ipf s ASN 257 CO 0.50 -0.41 0.00 0.00 -3.72 0.00 0.00 177.10 173.47 1ipf n GLY 259 N 0.06 1.89 0.43 0.00 0.00 -1.26 -5.19 105.19 101.12 1ipf n GLY 259 Ca 0.00 -0.29 0.14 0.00 0.00 0.00 0.00 46.02 45.88 1ipf n GLY 259 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01