#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1arh n PHE 6 N 0.00 0.18 -0.32 2.03 3.72 -1.26 -4.64 117.46 117.18 1arh n PHE 6 Ca 0.00 -0.12 0.04 0.00 -0.05 0.00 0.00 57.45 57.31 1arh n PHE 6 Cb 0.00 -0.00 0.18 0.00 -0.94 0.00 0.00 39.48 38.72 1arh n PHE 6 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1arh h GLU 7 N 3.47 0.89 -0.02 -1.08 3.07 -2.12 -2.94 114.58 115.85 1arh h GLU 7 Ca 0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1arh h GLU 7 Cb 0.78 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1arh h GLU 7 CO 0.00 0.59 0.00 -1.71 -1.40 0.00 0.00 179.01 176.49 1arh n ASN 8 N -4.66 1.64 -4.75 1.42 4.05 -1.26 -4.96 115.26 106.74 1arh n ASN 8 Ca 0.15 -1.55 -0.41 0.00 0.45 0.00 0.00 54.58 53.21 1arh n ASN 8 Cb 0.27 -0.00 -0.02 0.00 1.23 0.00 0.00 39.78 41.26 1arh n ASN 8 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1arh s ILE 9 N -1.99 2.10 0.12 -1.44 1.01 -1.11 -4.98 121.20 114.91 1arh s ILE 9 Ca 0.37 0.09 -0.12 0.00 0.00 0.00 0.00 60.65 60.98 1arh s ILE 9 Cb 0.21 -3.06 -0.06 0.00 0.01 0.00 0.00 42.46 39.56 1arh s ILE 9 CO 0.33 0.01 0.49 0.42 0.00 0.00 0.00 174.94 176.20 1arh s THR 10 N 0.01 4.95 0.44 2.92 -4.23 -1.26 -5.04 115.64 113.42 1arh s THR 10 Ca 0.63 0.67 -0.25 0.00 -1.18 0.00 0.00 61.69 61.56 1arh s THR 10 Cb -0.47 -3.70 -0.08 0.00 1.34 0.00 0.00 72.50 69.59 1arh s THR 10 CO 0.47 0.25 1.34 0.00 -0.54 0.00 0.00 174.62 176.14 1arh s ALA 11 N -1.45 3.19 0.13 3.99 0.00 -1.26 -4.96 121.76 121.40 1arh s ALA 11 Ca 0.36 1.30 -0.21 0.00 0.00 0.00 0.00 51.96 53.41 1arh s ALA 11 Cb -0.14 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.38 1arh s ALA 11 CO 0.19 -0.98 0.66 0.00 0.00 0.00 0.00 175.76 175.63 1arh s ALA 12 N -1.27 3.52 0.46 0.00 0.00 -1.26 -5.01 121.76 118.20 1arh s ALA 12 Ca 0.60 0.16 -0.24 0.00 0.00 0.00 0.00 51.96 52.48 1arh s ALA 12 Cb -0.39 -2.77 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 1arh s ALA 12 CO 0.50 0.36 1.20 -0.35 0.00 0.00 0.00 175.76 177.46 1arh n PRO 13 N 1.49 1.66 -2.03 0.00 -0.04 -1.26 -4.93 135.00 129.90 1arh n PRO 13 Ca -0.07 0.60 -0.35 0.00 -0.04 0.00 0.00 63.50 63.63 1arh n PRO 13 Cb 0.50 -2.32 0.03 0.00 -0.04 0.00 0.00 33.50 31.67 1arh n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1arh s ALA 14 N -1.26 2.56 -0.01 0.55 0.00 -1.26 -4.94 121.76 117.39 1arh s ALA 14 Ca 0.65 0.88 -0.30 0.00 0.00 0.00 0.00 51.96 53.19 1arh s ALA 14 Cb -0.49 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.17 1arh s ALA 14 CO 0.55 -1.09 1.31 0.34 0.00 0.00 0.00 175.76 176.87 1arh s ASP 15 N -1.80 6.94 0.45 0.00 -1.08 -1.26 -4.87 116.67 115.05 1arh s ASP 15 Ca 0.74 2.00 0.26 0.00 -0.52 0.00 0.00 52.55 55.04 1arh s ASP 15 Cb -0.27 -2.56 1.30 0.00 -1.46 0.00 0.00 42.92 39.93 1arh s ASP 15 CO 0.33 -0.65 1.75 -0.65 0.52 0.00 0.00 175.17 176.47 1arh h PRO 16 N 7.60 0.21 0.00 4.34 0.11 -1.98 1.16 132.00 143.44 1arh h PRO 16 Ca -0.37 -0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.51 1arh h PRO 16 Cb 1.18 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 1arh h PRO 16 CO 0.89 0.14 -1.71 -0.89 -0.21 0.00 0.00 178.00 176.22 1arh n ILE 17 N -4.49 1.51 -0.35 4.15 -0.00 -1.26 -4.24 119.36 114.68 1arh n ILE 17 Ca 0.28 -0.10 -0.02 0.00 -0.00 0.00 0.00 62.75 62.90 1arh n ILE 17 Cb 1.10 -2.13 0.10 0.00 -0.00 0.00 0.00 39.64 38.71 1arh n ILE 17 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1arh h LEU 18 N -1.00 1.08 -0.30 1.39 4.07 -1.94 -2.78 115.31 115.83 1arh h LEU 18 Ca -0.33 -0.03 0.05 0.00 0.08 0.00 0.00 57.88 57.66 1arh h LEU 18 Cb 1.28 -0.27 -0.04 0.00 1.08 0.00 0.00 40.66 42.71 1arh h LEU 18 CO -0.20 0.78 0.02 1.23 -1.08 0.00 0.00 178.44 179.20 1arh h GLY 19 N 1.28 0.32 1.69 0.83 0.00 0.12 -1.69 103.07 105.60 1arh h GLY 19 Ca 0.35 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.71 1arh h GLY 19 CO -0.08 -0.05 0.18 1.41 0.00 0.00 0.00 176.54 178.00 1arh h LEU 20 N 0.12 0.25 -0.30 3.11 3.38 -1.61 -2.39 115.31 117.87 1arh h LEU 20 Ca 0.14 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1arh h LEU 20 Cb 0.18 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1arh h LEU 20 CO -0.22 0.18 -0.25 0.00 0.09 0.00 0.00 178.44 178.24 1arh h ALA 21 N 1.84 0.44 -0.63 1.53 0.00 -1.12 -2.33 119.26 118.99 1arh h ALA 21 Ca 0.10 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.70 1arh h ALA 21 Cb 0.05 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 1arh h ALA 21 CO -0.02 0.42 0.32 -0.44 0.00 0.00 0.00 179.25 179.53 1arh h ASP 22 N 0.45 0.44 0.50 0.00 3.32 -0.91 -0.77 116.42 119.45 1arh h ASP 22 Ca 0.05 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1arh h ASP 22 Cb 0.81 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1arh h ASP 22 CO 0.06 0.28 -0.23 0.17 -1.72 0.00 0.00 179.24 177.81 1arh h LEU 23 N 0.58 0.00 -0.64 1.55 8.10 -1.39 -2.81 115.31 120.71 1arh h LEU 23 Ca 0.29 0.00 0.01 0.00 0.11 0.00 0.00 57.88 58.29 1arh h LEU 23 Cb 0.23 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.42 1arh h LEU 23 CO -0.21 0.23 0.42 0.15 -4.11 0.00 0.00 178.44 174.93 1arh h PHE 24 N 0.00 0.80 0.76 0.17 3.57 -0.57 -0.38 116.94 121.30 1arh h PHE 24 Ca -0.00 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1arh h PHE 24 Cb 0.55 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1arh h PHE 24 CO 0.00 0.50 -0.40 -0.09 -2.23 0.00 0.00 178.31 176.10 1arh h ARG 25 N 0.87 -1.03 -0.23 1.11 2.43 -1.36 -2.68 114.38 113.49 1arh h ARG 25 Ca 0.24 0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.54 1arh h ARG 25 Cb -0.10 0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1arh h ARG 25 CO -0.05 -0.68 0.23 0.00 -1.51 0.00 0.00 179.97 177.96 1arh h ALA 26 N -0.85 1.90 -2.07 2.80 0.00 -1.46 -3.38 119.26 116.21 1arh h ALA 26 Ca -0.10 -0.01 -0.56 0.00 0.00 0.00 0.00 54.91 54.24 1arh h ALA 26 Cb 0.83 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1arh h ALA 26 CO 0.15 -0.35 1.22 0.34 0.00 0.00 0.00 179.25 180.60 1arh s ASP 27 N -5.81 6.19 -0.15 0.00 2.15 -0.17 -4.78 116.67 114.10 1arh s ASP 27 Ca -0.05 1.82 0.16 0.00 0.43 0.00 0.00 52.55 54.91 1arh s ASP 27 Cb 0.16 -2.53 0.74 0.00 -0.30 0.00 0.00 42.92 40.99 1arh s ASP 27 CO 0.57 -1.38 1.65 1.21 -0.17 0.00 0.00 175.17 177.04 1arh n GLU 28 N 7.88 4.07 -2.56 4.34 2.13 -1.26 -4.94 120.64 130.30 1arh n GLU 28 Ca 0.21 -2.89 -0.41 0.00 0.66 0.00 0.00 57.16 54.73 1arh n GLU 28 Cb 0.45 -2.01 -0.04 0.00 0.27 0.00 0.00 31.44 30.10 1arh n GLU 28 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1arh s ARG 29 N -2.15 4.60 0.00 5.31 6.06 -1.26 -4.99 118.95 126.52 1arh s ARG 29 Ca 0.51 1.65 0.00 0.00 -2.50 0.00 0.00 55.73 55.39 1arh s ARG 29 Cb 0.35 -3.32 0.00 0.00 0.06 0.00 0.00 34.95 32.04 1arh s ARG 29 CO 0.21 0.06 0.18 -2.30 -2.50 0.00 0.00 175.30 170.95 1arh n PRO 30 N 2.72 0.00 -0.18 5.12 -0.02 -1.26 -3.38 135.00 138.00 1arh n PRO 30 Ca 0.03 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1arh n PRO 30 Cb 0.47 -0.67 0.00 0.00 -0.02 0.00 0.00 33.50 33.28 1arh n PRO 30 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1arh n GLY 31 N -0.35 1.80 3.69 -1.23 0.00 -1.26 -4.92 105.19 102.92 1arh n GLY 31 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1arh n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1arh s LYS 32 N 0.31 4.40 0.71 1.61 -2.85 -1.22 -4.98 119.74 117.72 1arh s LYS 32 Ca 0.00 1.46 -0.08 0.00 -1.00 0.00 0.00 55.97 56.35 1arh s LYS 32 Cb 0.00 -3.55 0.05 0.00 -2.06 0.00 0.00 37.83 32.27 1arh s LYS 32 CO 0.00 -0.35 1.04 0.42 0.10 0.00 0.00 175.35 176.56 1arh s ILE 33 N 2.08 2.60 -0.41 3.79 1.01 -1.12 -4.98 121.20 124.17 1arh s ILE 33 Ca 0.50 -0.07 0.04 0.00 0.00 0.00 0.00 60.65 61.12 1arh s ILE 33 Cb -0.20 -3.14 0.16 0.00 0.01 0.00 0.00 42.46 39.30 1arh s ILE 33 CO 0.19 -0.16 0.39 0.21 0.00 0.00 0.00 174.94 175.57 1arh s ASN 34 N -4.48 1.15 -0.29 3.58 2.47 -1.26 -3.52 114.94 112.59 1arh s ASN 34 Ca 0.59 -2.36 0.08 0.00 0.42 0.00 0.00 52.86 51.59 1arh s ASN 34 Cb -0.11 0.18 0.65 0.00 -1.45 0.00 0.00 41.25 40.52 1arh s ASN 34 CO 0.47 -0.20 1.68 0.18 -3.72 0.00 0.00 177.10 175.51 1arh n LEU 35 N 3.39 5.64 -2.86 3.21 4.77 -0.28 -4.73 117.00 126.15 1arh n LEU 35 Ca 0.21 -2.94 -0.29 0.00 -0.03 0.00 0.00 56.01 52.96 1arh n LEU 35 Cb 0.47 -0.72 -0.01 0.00 -2.33 0.00 0.00 43.42 40.82 1arh n LEU 35 CO 0.08 0.76 0.40 0.61 -1.33 0.00 0.00 177.39 177.91 1arh n GLY 36 N -0.13 5.80 3.57 -0.72 0.00 0.15 -1.14 105.19 112.72 1arh n GLY 36 Ca 0.37 -2.74 -0.00 0.00 0.00 0.00 0.00 46.02 43.65 1arh n GLY 36 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1arh s ILE 37 N -4.86 -0.10 0.00 -0.61 2.07 -1.26 -4.69 121.20 111.75 1arh s ILE 37 Ca 0.48 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.72 1arh s ILE 37 Cb 0.32 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.91 1arh s ILE 37 CO -0.18 0.00 0.12 0.61 -1.91 0.00 0.00 174.94 173.59 1arh n GLY 38 N 3.89 0.37 3.78 1.50 0.00 -1.26 -4.81 105.19 108.66 1arh n GLY 38 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1arh n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1arh s VAL 39 N 1.26 4.68 0.39 1.61 1.01 -1.26 -5.01 120.40 123.08 1arh s VAL 39 Ca 0.00 -0.51 -0.25 0.00 0.00 0.00 0.00 61.98 61.22 1arh s VAL 39 Cb 0.00 -3.17 -0.09 0.00 0.00 0.00 0.00 36.38 33.12 1arh s VAL 39 CO 0.00 0.28 1.07 -0.47 0.00 0.00 0.00 175.10 175.98 1arh s TYR 40 N -1.25 3.26 0.02 5.22 5.04 -1.26 -4.74 117.35 123.64 1arh s TYR 40 Ca 0.25 1.64 0.02 0.00 -2.44 0.00 0.00 57.07 56.54 1arh s TYR 40 Cb -0.12 -3.18 -0.02 0.00 0.35 0.00 0.00 41.96 38.99 1arh s TYR 40 CO 0.16 -0.72 -0.07 0.15 -1.34 0.00 0.00 175.55 173.73 1arh s LYS 41 N -2.38 0.49 0.48 4.97 1.02 -1.19 -4.46 119.74 118.68 1arh s LYS 41 Ca 0.57 -0.55 0.06 0.00 0.02 0.00 0.00 55.97 56.07 1arh s LYS 41 Cb -0.24 -0.34 0.03 0.00 -0.52 0.00 0.00 37.83 36.76 1arh s LYS 41 CO 0.30 0.07 0.67 0.16 -0.92 0.00 0.00 175.35 175.63 1arh s ASP 42 N -1.04 5.44 0.62 2.83 1.47 0.11 -4.83 116.67 121.27 1arh s ASP 42 Ca -0.05 -0.36 0.11 0.00 1.18 0.00 0.00 52.55 53.43 1arh s ASP 42 Cb -0.07 -0.58 0.62 0.00 -0.34 0.00 0.00 42.92 42.55 1arh s ASP 42 CO 0.00 -0.97 1.32 -0.08 0.68 0.00 0.00 175.17 176.12 1arh h GLU 43 N 0.39 0.00 -0.16 2.11 4.81 -1.90 2.73 114.58 122.56 1arh h GLU 43 Ca -0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1arh h GLU 43 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1arh h GLU 43 CO 0.46 0.00 0.00 0.25 -0.73 0.00 0.00 179.01 178.99 1arh n THR 44 N -2.55 0.22 -1.07 0.32 -2.24 -1.26 -4.80 114.28 102.90 1arh n THR 44 Ca -0.01 -0.61 -0.00 0.00 -2.27 0.00 0.00 64.05 61.16 1arh n THR 44 Cb 0.72 1.22 -0.00 0.00 -2.10 0.00 0.00 70.33 70.17 1arh n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1arh n GLY 45 N 1.19 0.40 3.51 3.38 0.00 0.91 -5.04 105.19 109.55 1arh n GLY 45 Ca 0.14 -1.07 -0.24 0.00 0.00 0.00 0.00 46.02 44.85 1arh n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1arh s LYS 46 N -2.16 1.80 -0.63 1.61 1.02 -1.25 -4.73 119.74 115.40 1arh s LYS 46 Ca 0.00 -1.76 -0.00 0.00 0.02 0.00 0.00 55.97 54.22 1arh s LYS 46 Cb 0.00 -1.81 0.16 0.00 -0.52 0.00 0.00 37.83 35.66 1arh s LYS 46 CO 0.00 0.28 0.43 0.99 -0.92 0.00 0.00 175.35 176.13 1arh s THR 47 N -2.51 3.39 0.76 2.17 2.01 -1.26 0.08 115.64 120.27 1arh s THR 47 Ca 0.31 -3.27 -0.10 0.00 0.31 0.00 0.00 61.69 58.94 1arh s THR 47 Cb -0.03 -3.23 0.07 0.00 0.01 0.00 0.00 72.50 69.31 1arh s THR 47 CO 0.16 -0.89 1.10 -2.16 -0.69 0.00 0.00 174.62 172.14 1arh s PRO 48 N -0.39 2.13 -0.05 4.92 0.04 -1.26 -5.04 135.00 135.35 1arh s PRO 48 Ca 0.19 -0.03 -0.26 0.00 0.04 0.00 0.00 61.00 60.94 1arh s PRO 48 Cb -0.19 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 1arh s PRO 48 CO -0.04 -1.40 0.81 0.08 0.04 0.00 0.00 177.00 176.49 1arh s VAL 49 N -3.42 4.97 0.64 -0.36 1.01 -1.26 -4.93 120.40 117.06 1arh s VAL 49 Ca 0.61 1.68 -0.18 0.00 0.00 0.00 0.00 61.98 64.08 1arh s VAL 49 Cb -0.11 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 1arh s VAL 49 CO 0.47 0.20 1.30 0.18 0.00 0.00 0.00 175.10 177.26 1arh n LEU 50 N 3.91 6.06 -0.19 3.92 4.32 -1.26 -4.87 117.00 128.89 1arh n LEU 50 Ca 0.02 0.84 -0.10 0.00 -0.02 0.00 0.00 56.01 56.74 1arh n LEU 50 Cb 0.51 -1.56 0.01 0.00 -1.62 0.00 0.00 43.42 40.76 1arh n LEU 50 CO 0.49 -0.96 0.76 0.74 -1.22 0.00 0.00 177.39 177.20 1arh h THR 51 N 0.58 1.27 -0.99 -5.08 2.02 -1.97 -1.93 112.91 106.81 1arh h THR 51 Ca -0.51 -1.23 0.07 0.00 0.77 0.00 0.00 66.41 65.51 1arh h THR 51 Cb 1.34 0.95 -0.07 0.00 -1.74 0.00 0.00 68.15 68.62 1arh h THR 51 CO 0.53 0.44 0.64 0.77 0.37 0.00 0.00 175.52 178.27 1arh h SER 52 N 0.90 1.01 0.16 4.18 4.64 -1.91 -2.12 113.55 120.40 1arh h SER 52 Ca 0.15 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 1arh h SER 52 Cb 0.64 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1arh h SER 52 CO 0.04 0.64 -0.07 0.58 -0.87 0.00 0.00 176.83 177.14 1arh h VAL 53 N 1.14 0.96 -0.84 0.95 2.07 -1.85 -0.05 116.25 118.63 1arh h VAL 53 Ca 0.43 -0.55 0.11 0.00 0.82 0.00 0.00 66.70 67.52 1arh h VAL 53 Cb 0.20 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 1arh h VAL 53 CO -0.18 0.13 0.54 0.50 0.02 0.00 0.00 177.57 178.58 1arh h LYS 54 N -0.47 0.71 -0.25 1.57 1.63 -1.12 -0.15 116.57 118.48 1arh h LYS 54 Ca -0.02 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.67 1arh h LYS 54 Cb 0.37 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 1arh h LYS 54 CO 0.04 0.47 -0.10 0.87 -3.45 0.00 0.00 179.45 177.27 1arh h LYS 55 N 0.73 0.52 0.00 1.90 1.57 -1.23 -2.46 116.57 117.60 1arh h LYS 55 Ca 0.40 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 1arh h LYS 55 Cb 0.54 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1arh h LYS 55 CO -0.16 0.76 -0.12 0.00 -0.57 0.00 0.00 179.45 179.35 1arh h ALA 56 N 0.74 1.32 0.01 3.86 0.00 -0.08 -2.68 119.26 122.43 1arh h ALA 56 Ca 0.06 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 1arh h ALA 56 Cb 0.59 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1arh h ALA 56 CO 0.03 0.15 -0.88 0.93 0.00 0.00 0.00 179.25 179.49 1arh h GLU 57 N 0.00 0.07 -0.21 0.00 5.08 -0.66 -1.80 114.58 117.06 1arh h GLU 57 Ca -0.00 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 1arh h GLU 57 Cb 0.33 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1arh h GLU 57 CO 0.02 0.90 -0.09 0.37 -1.00 0.00 0.00 179.01 179.21 1arh h GLN 58 N 0.04 0.43 -0.11 2.33 5.75 -1.12 -0.99 115.11 121.44 1arh h GLN 58 Ca -0.03 -0.18 0.05 0.00 -0.15 0.00 0.00 58.65 58.34 1arh h GLN 58 Cb 1.53 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 30.01 1arh h GLN 58 CO 0.12 0.71 -0.26 -0.92 -2.65 0.00 0.00 178.83 175.83 1arh h TYR 59 N 0.14 -0.70 -0.25 3.99 5.03 -1.53 0.46 116.97 124.11 1arh h TYR 59 Ca 0.05 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.34 1arh h TYR 59 Cb 0.57 0.33 -0.01 0.00 1.55 0.00 0.00 36.73 39.16 1arh h TYR 59 CO 0.06 -0.34 -0.06 -0.07 -1.32 0.00 0.00 178.16 176.43 1arh h LEU 60 N -0.34 0.37 -0.66 2.82 3.38 -1.26 0.33 115.31 119.96 1arh h LEU 60 Ca 0.10 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1arh h LEU 60 Cb 0.48 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1arh h LEU 60 CO -0.31 0.48 0.32 0.25 0.09 0.00 0.00 178.44 179.27 1arh h LEU 61 N 0.38 0.86 -0.24 1.67 6.46 0.25 -1.86 115.31 122.83 1arh h LEU 61 Ca 0.08 -0.13 -0.21 0.00 -0.12 0.00 0.00 57.88 57.50 1arh h LEU 61 Cb 0.34 -0.22 0.01 0.00 -0.73 0.00 0.00 40.66 40.06 1arh h LEU 61 CO 0.01 0.74 -0.71 -0.33 -0.62 0.00 0.00 178.44 177.53 1arh h GLU 62 N 0.91 0.75 0.00 1.25 5.08 -0.43 -3.38 114.58 118.76 1arh h GLU 62 Ca 0.23 -0.58 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1arh h GLU 62 Cb 0.11 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1arh h GLU 62 CO -0.03 1.19 -1.61 0.09 -1.00 0.00 0.00 179.01 177.65 1arh n ASN 63 N -3.94 0.32 -4.73 1.42 4.13 0.06 -4.95 115.26 107.56 1arh n ASN 63 Ca -0.06 -0.04 -0.42 0.00 1.68 0.00 0.00 54.58 55.74 1arh n ASN 63 Cb 0.71 1.48 -0.03 0.00 -1.54 0.00 0.00 39.78 40.40 1arh n ASN 63 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1arh s GLU 64 N -3.41 4.43 0.00 3.52 2.02 -0.70 -4.88 118.70 119.67 1arh s GLU 64 Ca -0.04 1.91 0.03 0.00 0.02 0.00 0.00 54.97 56.89 1arh s GLU 64 Cb 0.13 -3.26 0.01 0.00 0.10 0.00 0.00 34.13 31.11 1arh s GLU 64 CO 0.87 -0.22 0.44 0.25 0.02 0.00 0.00 175.26 176.62 1arh n THR 66 N 3.12 0.00 -3.51 3.63 -2.24 -1.26 -5.01 114.28 109.01 1arh n THR 66 Ca 0.07 -0.48 -0.14 0.00 -2.27 0.00 0.00 64.05 61.23 1arh n THR 66 Cb 0.44 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.67 1arh n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1arh s THR 67 N -0.57 0.01 -0.20 4.28 -1.32 -1.26 -5.02 115.64 111.56 1arh s THR 67 Ca 0.03 -0.10 0.12 0.00 -1.21 0.00 0.00 61.69 60.53 1arh s THR 67 Cb 0.02 -1.00 0.43 0.00 -1.51 0.00 0.00 72.50 70.44 1arh s THR 67 CO 0.06 -0.05 1.21 0.29 -2.21 0.00 0.00 174.62 173.92 1arh n LYS 68 N 0.26 1.66 -2.17 7.08 5.02 -1.26 -5.05 118.16 123.69 1arh n LYS 68 Ca -0.18 -3.28 -0.36 0.00 -2.02 0.00 0.00 58.31 52.48 1arh n LYS 68 Cb 0.61 -1.53 0.01 0.00 -0.02 0.00 0.00 35.03 34.10 1arh n LYS 68 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1arh s ASN 69 N -3.16 5.62 0.28 4.39 2.47 -1.26 -4.90 114.94 118.38 1arh s ASN 69 Ca 0.39 2.28 -0.27 0.00 0.42 0.00 0.00 52.86 55.67 1arh s ASN 69 Cb 0.38 -2.59 -0.14 0.00 -1.45 0.00 0.00 41.25 37.44 1arh s ASN 69 CO -0.07 -1.30 0.87 -1.22 -3.72 0.00 0.00 177.10 171.66 1arh n TYR 70 N -1.25 0.75 -1.92 0.43 4.01 -1.26 -4.99 117.16 112.93 1arh n TYR 70 Ca 0.12 0.75 -0.29 0.00 -0.16 0.00 0.00 57.90 58.31 1arh n TYR 70 Cb 0.50 -2.17 0.14 0.00 -0.31 0.00 0.00 39.34 37.50 1arh n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1arh s LEU 71 N 1.08 2.61 0.56 7.72 1.43 -1.26 -5.05 118.68 125.77 1arh s LEU 71 Ca 0.60 0.51 -0.09 0.00 -1.03 0.00 0.00 54.13 54.12 1arh s LEU 71 Cb -0.74 -2.77 -0.04 0.00 0.03 0.00 0.00 46.19 42.67 1arh s LEU 71 CO 0.59 -2.33 0.93 -0.83 0.23 0.00 0.00 176.35 174.94 1arh s GLY 72 N -4.74 1.63 0.38 -3.19 0.00 -1.26 -4.89 107.32 95.25 1arh s GLY 72 Ca 0.68 -0.23 0.21 0.00 0.00 0.00 0.00 44.72 45.38 1arh s GLY 72 CO 0.51 -0.00 1.64 -2.22 0.00 0.00 0.00 173.10 173.03 1arh h ILE 73 N -0.02 0.21 -0.01 0.90 2.04 -1.97 0.67 117.51 119.34 1arh h ILE 73 Ca -0.45 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1arh h ILE 73 Cb 1.19 -0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1arh h ILE 73 CO 0.62 0.04 -0.17 -0.90 0.00 0.00 0.00 178.15 177.73 1arh n ASP 74 N -4.93 0.74 0.00 1.72 5.75 -1.26 -4.43 116.55 114.13 1arh n ASP 74 Ca 0.34 -0.73 0.00 0.00 -0.01 0.00 0.00 54.79 54.39 1arh n ASP 74 Cb 1.18 0.02 0.00 0.00 -1.03 0.00 0.00 41.12 41.29 1arh n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1arh n GLY 75 N 1.30 -0.97 3.66 6.12 0.00 0.23 -0.34 105.19 115.20 1arh n GLY 75 Ca 0.14 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1arh n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1arh s ILE 76 N 0.00 4.20 0.19 -0.61 1.01 -1.26 -4.34 121.20 120.39 1arh s ILE 76 Ca 0.00 1.44 -0.12 0.00 0.00 0.00 0.00 60.65 61.97 1arh s ILE 76 Cb 0.00 -3.97 0.11 0.00 0.01 0.00 0.00 42.46 38.61 1arh s ILE 76 CO 0.00 -0.18 1.72 -0.65 0.00 0.00 0.00 174.94 175.84 1arh h PRO 77 N 8.49 0.25 -0.43 2.79 0.11 -1.98 -0.02 132.00 141.20 1arh h PRO 77 Ca -0.27 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.85 1arh h PRO 77 Cb 1.11 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1arh h PRO 77 CO 0.98 0.17 0.29 0.93 -0.21 0.00 0.00 178.00 180.15 1arh h GLU 78 N 0.26 0.47 -0.19 1.05 3.07 -1.99 0.31 114.58 117.57 1arh h GLU 78 Ca 0.25 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 59.10 1arh h GLU 78 Cb 0.33 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.12 1arh h GLU 78 CO -0.32 0.31 0.07 0.35 -1.40 0.00 0.00 179.01 178.03 1arh h PHE 79 N 0.49 0.13 -0.11 4.33 3.57 -1.37 0.98 116.94 124.95 1arh h PHE 79 Ca 0.17 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 1arh h PHE 79 Cb 0.09 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1arh h PHE 79 CO -0.00 0.06 0.07 0.78 -2.23 0.00 0.00 178.31 176.99 1arh h GLY 80 N 0.16 0.15 1.14 2.40 0.00 -0.27 -1.56 103.07 105.09 1arh h GLY 80 Ca 0.08 -0.06 -0.07 0.00 0.00 0.00 0.00 47.33 47.27 1arh h GLY 80 CO -0.08 0.06 0.10 0.07 0.00 0.00 0.00 176.54 176.70 1arh h ARG 81 N 0.12 1.05 -0.63 4.80 0.11 -0.93 -2.07 114.38 116.83 1arh h ARG 81 Ca 0.04 -0.27 -0.00 0.00 0.10 0.00 0.00 59.98 59.84 1arh h ARG 81 Cb 0.02 -0.13 -0.03 0.00 1.11 0.00 0.00 29.97 30.94 1arh h ARG 81 CO -0.01 0.96 0.38 0.00 0.10 0.00 0.00 179.97 181.40 1arh h THR 83 N 0.85 1.19 -0.77 0.00 1.35 -1.03 -2.07 112.91 112.43 1arh h THR 83 Ca 0.22 -0.59 0.06 0.00 -0.55 0.00 0.00 66.41 65.56 1arh h THR 83 Cb -0.03 1.05 -0.05 0.00 -1.73 0.00 0.00 68.15 67.39 1arh h THR 83 CO -0.04 0.20 0.50 1.56 -0.25 0.00 0.00 175.52 177.49 1arh h GLN 84 N 0.30 0.81 -0.36 4.72 4.20 -1.22 0.14 115.11 123.69 1arh h GLN 84 Ca 0.09 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 1arh h GLN 84 Cb 0.21 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1arh h GLN 84 CO -0.01 0.53 0.12 0.93 -0.67 0.00 0.00 178.83 179.74 1arh h GLU 85 N 0.83 0.55 -0.25 1.46 5.08 -1.12 0.27 114.58 121.40 1arh h GLU 85 Ca 0.33 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1arh h GLU 85 Cb 0.22 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1arh h GLU 85 CO -0.11 0.56 0.13 1.25 -1.00 0.00 0.00 179.01 179.84 1arh h LEU 86 N 0.43 0.32 0.40 1.33 5.85 -0.64 0.41 115.31 123.41 1arh h LEU 86 Ca 0.12 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1arh h LEU 86 Cb 0.23 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1arh h LEU 86 CO -0.01 0.33 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.16 1arh h LEU 87 N 0.29 -0.46 0.00 2.25 4.07 -0.61 -3.38 115.31 117.48 1arh h LEU 87 Ca 0.09 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.06 1arh h LEU 87 Cb 0.09 0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1arh h LEU 87 CO -0.01 -0.23 -0.77 -0.26 -1.08 0.00 0.00 178.44 176.09 1arh h PHE 88 N -0.72 0.00 0.00 1.13 0.04 -0.56 -3.45 116.94 113.38 1arh h PHE 88 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1arh h PHE 88 Cb 0.41 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.56 1arh h PHE 88 CO 0.07 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.19 1arh n GLY 89 N 1.25 2.51 0.18 -1.45 0.00 0.14 -4.57 105.19 103.25 1arh n GLY 89 Ca 0.02 -1.71 -0.06 0.00 0.00 0.00 0.00 46.02 44.26 1arh n GLY 89 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1arh h LYS 90 N 0.00 0.44 -1.03 1.61 3.64 -1.91 -2.88 116.57 116.43 1arh h LYS 90 Ca 0.00 -0.03 -0.40 0.00 -1.27 0.00 0.00 60.65 58.95 1arh h LYS 90 Cb 0.00 -0.10 -0.23 0.00 -0.41 0.00 0.00 32.23 31.49 1arh h LYS 90 CO 0.00 0.29 0.51 0.41 -2.27 0.00 0.00 179.45 178.39 1arh n GLY 91 N -1.23 4.02 3.77 5.01 0.00 -1.26 -4.97 105.19 110.52 1arh n GLY 91 Ca 0.03 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.71 1arh n GLY 91 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1arh s SER 92 N -0.73 6.73 0.38 1.61 0.15 -1.09 -4.88 113.70 115.86 1arh s SER 92 Ca 0.43 2.69 0.13 0.00 0.70 0.00 0.00 55.95 59.90 1arh s SER 92 Cb 0.36 -2.65 0.74 0.00 -1.71 0.00 0.00 66.02 62.76 1arh s SER 92 CO 0.07 -0.57 1.84 0.00 1.20 0.00 0.00 173.24 175.78 1arh h ALA 93 N 3.31 1.41 -0.95 5.45 0.00 -1.93 0.49 119.26 127.03 1arh h ALA 93 Ca -0.49 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.09 1arh h ALA 93 Cb 1.23 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1arh h ALA 93 CO 0.65 0.45 0.58 -0.07 0.00 0.00 0.00 179.25 180.86 1arh h LEU 94 N 0.01 1.13 -0.01 0.00 4.07 -1.96 1.31 115.31 119.86 1arh h LEU 94 Ca -0.00 -0.06 -0.12 0.00 0.08 0.00 0.00 57.88 57.78 1arh h LEU 94 Cb 0.63 -0.28 0.01 0.00 1.08 0.00 0.00 40.66 42.09 1arh h LEU 94 CO 0.05 0.86 -0.46 0.40 -1.08 0.00 0.00 178.44 178.20 1arh h ILE 95 N 1.30 1.47 -0.86 1.22 2.04 -1.65 -1.24 117.51 119.79 1arh h ILE 95 Ca 0.34 -2.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.20 1arh h ILE 95 Cb -0.07 2.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 1arh h ILE 95 CO -0.07 0.57 0.53 0.78 0.00 0.00 0.00 178.15 179.97 1arh h ASN 96 N -0.23 1.02 -0.01 1.72 -0.26 0.55 -1.86 115.58 116.50 1arh h ASN 96 Ca -0.06 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.63 1arh h ASN 96 Cb 1.18 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 38.19 1arh h ASN 96 CO 0.09 0.77 0.00 0.47 -1.06 0.00 0.00 177.43 177.70 1arh n ASP 97 N -4.44 0.08 -3.91 5.81 9.92 0.44 -4.86 116.55 119.60 1arh n ASP 97 Ca 0.09 -1.77 -0.29 0.00 -0.53 0.00 0.00 54.79 52.30 1arh n ASP 97 Cb 0.04 -0.01 -0.01 0.00 -0.64 0.00 0.00 41.12 40.51 1arh n ASP 97 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1arh n LYS 98 N -0.57 -2.48 0.00 -1.24 0.00 -0.70 -4.38 118.16 108.79 1arh n LYS 98 Ca 0.06 0.38 0.09 0.00 0.00 0.00 0.00 58.31 58.84 1arh n LYS 98 Cb 0.04 -4.25 -0.05 0.00 0.00 0.00 0.00 35.03 30.77 1arh n LYS 98 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1arh n ARG 99 N -4.41 1.11 -4.28 1.64 0.63 -0.48 -3.66 116.66 107.22 1arh n ARG 99 Ca -0.25 -0.51 -0.21 0.00 -0.92 0.00 0.00 57.85 55.96 1arh n ARG 99 Cb 0.66 -1.40 -0.12 0.00 0.45 0.00 0.00 32.46 32.05 1arh n ARG 99 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1arh s ALA 100 N -2.49 1.74 -0.01 5.13 0.00 -1.25 -2.06 121.76 122.83 1arh s ALA 100 Ca 0.12 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1arh s ALA 100 Cb 0.15 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.11 1arh s ALA 100 CO 0.63 0.23 -0.01 1.03 0.00 0.00 0.00 175.76 177.64 1arh s ARG 101 N -2.42 0.13 -0.01 0.00 1.81 -0.91 -5.00 118.95 112.54 1arh s ARG 101 Ca 0.10 -0.01 0.07 0.00 -1.72 0.00 0.00 55.73 54.17 1arh s ARG 101 Cb -0.07 -0.18 -0.02 0.00 -0.45 0.00 0.00 34.95 34.23 1arh s ARG 101 CO 0.05 -0.01 -0.23 0.99 -0.68 0.00 0.00 175.30 175.41 1arh s THR 102 N 0.23 1.82 -0.08 0.02 2.01 -1.26 -1.62 115.64 116.76 1arh s THR 102 Ca -0.02 -1.01 0.04 0.00 0.31 0.00 0.00 61.69 61.01 1arh s THR 102 Cb -0.04 -1.52 -0.01 0.00 0.01 0.00 0.00 72.50 70.95 1arh s THR 102 CO -0.01 0.49 -0.23 0.00 -0.69 0.00 0.00 174.62 174.19 1arh s ALA 103 N -0.56 2.23 0.01 7.40 0.00 -0.34 -4.89 121.76 125.60 1arh s ALA 103 Ca 0.09 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.76 1arh s ALA 103 Cb -0.09 -0.81 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 1arh s ALA 103 CO -0.01 0.34 0.98 -1.14 0.00 0.00 0.00 175.76 175.94 1arh s GLN 104 N 0.11 4.57 0.28 0.00 0.74 0.54 -0.32 119.66 125.57 1arh s GLN 104 Ca -0.11 1.42 0.03 0.00 0.05 0.00 0.00 55.36 56.76 1arh s GLN 104 Cb -0.16 -3.46 -0.06 0.00 1.10 0.00 0.00 33.01 30.44 1arh s GLN 104 CO 0.06 -0.04 0.05 0.95 -0.55 0.00 0.00 175.29 175.76 1arh s THR 105 N 0.97 1.01 -1.14 -0.34 -4.23 -0.76 -4.62 115.64 106.53 1arh s THR 105 Ca 0.52 -2.01 -0.21 0.00 -1.18 0.00 0.00 61.69 58.80 1arh s THR 105 Cb -0.21 -2.64 0.02 0.00 1.34 0.00 0.00 72.50 71.01 1arh s THR 105 CO 0.28 -0.09 1.71 -2.16 -0.54 0.00 0.00 174.62 173.83 1arh s PRO 106 N -3.91 3.41 0.01 3.99 0.05 -1.26 -2.64 135.00 134.65 1arh s PRO 106 Ca 0.35 -1.36 0.00 0.00 0.05 0.00 0.00 61.00 60.04 1arh s PRO 106 Cb 0.08 -5.37 0.00 0.00 0.05 0.00 0.00 34.50 29.26 1arh s PRO 106 CO 0.13 -2.70 0.00 0.41 0.05 0.00 0.00 177.00 174.89 1arh n GLY 107 N 6.11 -1.45 0.23 0.56 0.00 -0.80 -2.68 105.19 107.16 1arh n GLY 107 Ca 0.42 -1.52 -0.05 0.00 0.00 0.00 0.00 46.02 44.88 1arh n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1arh h GLY 108 N -0.05 0.56 0.91 -0.02 0.00 -1.79 -2.90 103.07 99.78 1arh h GLY 108 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 1arh h GLY 108 CO 0.00 0.45 -0.02 -0.84 0.00 0.00 0.00 176.54 176.13 1arh h THR 109 N 0.44 1.02 -0.67 4.70 2.02 -1.91 -2.52 112.91 115.99 1arh h THR 109 Ca 0.06 -0.20 0.13 0.00 0.77 0.00 0.00 66.41 67.16 1arh h THR 109 Cb 0.76 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 68.29 1arh h THR 109 CO 0.06 0.05 0.45 1.23 0.37 0.00 0.00 175.52 177.69 1arh h GLY 110 N -0.14 0.57 1.00 2.16 0.00 -1.42 -1.03 103.07 104.22 1arh h GLY 110 Ca -0.01 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.04 1arh h GLY 110 CO 0.01 0.07 -0.34 0.00 0.00 0.00 0.00 176.54 176.27 1arh h ALA 111 N 1.67 0.43 0.06 3.60 0.00 -1.27 -0.50 119.26 123.25 1arh h ALA 111 Ca 0.32 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1arh h ALA 111 Cb 0.76 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1arh h ALA 111 CO -0.09 0.49 -0.07 -0.07 0.00 0.00 0.00 179.25 179.51 1arh h LEU 112 N 0.48 -0.18 -0.14 0.00 -0.00 -0.97 0.54 115.31 115.04 1arh h LEU 112 Ca 0.04 0.02 0.03 0.00 -0.00 0.00 0.00 57.88 57.97 1arh h LEU 112 Cb 0.92 0.07 -0.03 0.00 -0.00 0.00 0.00 40.66 41.63 1arh h LEU 112 CO 0.08 -0.11 -0.03 -0.09 -0.00 0.00 0.00 178.44 178.30 1arh h ARG 113 N -0.15 0.01 -0.43 1.13 9.65 -1.16 0.27 114.38 123.70 1arh h ARG 113 Ca 0.01 -0.00 0.02 0.00 -1.10 0.00 0.00 59.98 58.90 1arh h ARG 113 Cb 0.15 -0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.70 1arh h ARG 113 CO -0.03 0.01 0.26 0.28 2.80 0.00 0.00 179.97 183.29 1arh h VAL 114 N 0.01 1.06 -0.61 0.20 2.07 -0.80 0.85 116.25 119.03 1arh h VAL 114 Ca 0.07 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 1arh h VAL 114 Cb 0.10 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1arh h VAL 114 CO -0.14 0.10 0.37 0.00 0.02 0.00 0.00 177.57 177.92 1arh h ALA 115 N 1.18 1.50 0.22 1.67 0.00 0.73 -1.54 119.26 123.03 1arh h ALA 115 Ca 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1arh h ALA 115 Cb -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1arh h ALA 115 CO -0.07 0.44 -0.11 0.00 0.00 0.00 0.00 179.25 179.51 1arh h ALA 116 N 1.57 -0.30 -0.83 0.00 0.00 0.11 -2.08 119.26 117.74 1arh h ALA 116 Ca 0.22 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1arh h ALA 116 Cb -0.04 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1arh h ALA 116 CO -0.04 -0.58 0.48 -0.44 0.00 0.00 0.00 179.25 178.67 1arh h ASP 117 N -0.47 1.01 0.05 0.00 3.32 -0.78 -1.57 116.42 117.98 1arh h ASP 117 Ca -0.03 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 56.96 1arh h ASP 117 Cb 0.36 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1arh h ASP 117 CO 0.05 0.79 -0.10 0.15 -1.72 0.00 0.00 179.24 178.41 1arh h PHE 118 N 1.15 -0.24 -0.36 4.55 3.57 -1.14 -2.59 116.94 121.87 1arh h PHE 118 Ca 0.30 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 1arh h PHE 118 Cb -0.02 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1arh h PHE 118 CO 0.01 -0.15 0.05 -0.07 -2.23 0.00 0.00 178.31 175.91 1arh h LEU 119 N -0.19 0.58 -1.26 0.59 3.38 -1.17 -1.93 115.31 115.32 1arh h LEU 119 Ca 0.02 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1arh h LEU 119 Cb 0.21 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1arh h LEU 119 CO -0.06 0.71 0.46 0.00 0.09 0.00 0.00 178.44 179.63 1arh h ALA 120 N 0.90 1.45 0.00 1.53 0.00 -1.24 -1.72 119.26 120.18 1arh h ALA 120 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1arh h ALA 120 Cb 0.38 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1arh h ALA 120 CO 0.01 0.49 -1.40 1.63 0.00 0.00 0.00 179.25 179.98 1arh n LYS 121 N -4.41 0.57 0.00 0.00 4.76 -0.98 -4.52 118.16 113.57 1arh n LYS 121 Ca 0.08 -0.03 0.01 0.00 -2.87 0.00 0.00 58.31 55.50 1arh n LYS 121 Cb 0.05 -1.66 0.01 0.00 -1.84 0.00 0.00 35.03 31.58 1arh n LYS 121 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1arh n ASN 122 N -2.38 0.98 -4.02 4.39 3.02 -0.73 -5.06 115.26 111.46 1arh n ASN 122 Ca -0.01 -0.99 -0.19 0.00 -0.03 0.00 0.00 54.58 53.35 1arh n ASN 122 Cb 0.54 0.24 -0.09 0.00 -0.61 0.00 0.00 39.78 39.86 1arh n ASN 122 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1arh s THR 123 N -0.50 0.39 -2.23 3.41 -4.23 -0.65 -5.02 115.64 106.82 1arh s THR 123 Ca 0.03 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.77 1arh s THR 123 Cb 0.02 -2.51 0.53 0.00 1.34 0.00 0.00 72.50 71.89 1arh s THR 123 CO 0.06 0.00 1.69 -1.54 -0.54 0.00 0.00 174.62 174.28 1arh n SER 124 N -0.96 1.10 -4.72 3.99 3.41 -1.26 -4.75 113.62 110.43 1arh n SER 124 Ca 0.00 -1.54 -0.43 0.00 -0.26 0.00 0.00 58.87 56.65 1arh n SER 124 Cb 0.65 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 1arh n SER 124 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1arh n VAL 125 N -0.08 0.90 0.00 -3.33 0.31 -1.26 -4.91 118.33 109.96 1arh n VAL 125 Ca 0.17 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1arh n VAL 125 Cb 0.25 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.35 1arh n VAL 125 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1arh n LYS 126 N 2.29 2.14 -4.80 5.55 4.76 -1.26 -4.73 118.16 122.11 1arh n LYS 126 Ca 0.10 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.28 1arh n LYS 126 Cb 0.35 -0.85 -0.16 0.00 -1.84 0.00 0.00 35.03 32.53 1arh n LYS 126 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1arh s ARG 129 N -1.70 1.72 -0.09 1.97 3.52 -1.26 0.12 118.95 123.23 1arh s ARG 129 Ca 0.00 -0.59 0.04 0.00 -0.13 0.00 0.00 55.73 55.05 1arh s ARG 129 Cb 0.00 -1.50 -0.01 0.00 -1.56 0.00 0.00 34.95 31.88 1arh s ARG 129 CO 0.00 0.24 -0.22 0.54 -0.81 0.00 0.00 175.30 175.04 1arh s VAL 133 N 0.04 2.25 -0.27 7.11 0.11 0.42 -2.20 120.40 127.86 1arh s VAL 133 Ca -0.04 -0.97 -0.16 0.00 -2.93 0.00 0.00 61.98 57.89 1arh s VAL 133 Cb -0.11 -1.86 -0.03 0.00 -1.53 0.00 0.00 36.38 32.85 1arh s VAL 133 CO 0.02 0.56 0.44 0.26 -3.33 0.00 0.00 175.10 173.05 1arh s TRP 134 N 0.17 3.25 0.38 1.54 0.52 0.15 -0.48 118.94 124.47 1arh s TRP 134 Ca -0.13 0.47 0.08 0.00 0.02 0.00 0.00 56.10 56.54 1arh s TRP 134 Cb -0.16 -2.66 -0.06 0.00 -1.15 0.00 0.00 33.47 29.44 1arh s TRP 134 CO 0.07 -0.28 0.09 0.14 0.02 0.00 0.00 176.95 176.99 1arh s VAL 135 N 2.18 2.42 0.64 4.03 -7.23 -0.45 -0.08 120.40 121.91 1arh s VAL 135 Ca 0.18 -1.84 -0.08 0.00 -1.81 0.00 0.00 61.98 58.43 1arh s VAL 135 Cb -0.16 -2.92 0.02 0.00 0.56 0.00 0.00 36.38 33.87 1arh s VAL 135 CO 0.10 -0.08 0.97 -0.94 -0.31 0.00 0.00 175.10 174.83 1arh s SER 136 N -3.80 5.46 -0.29 4.85 1.04 -1.26 -0.79 113.70 118.91 1arh s SER 136 Ca 0.38 0.81 0.02 0.00 0.48 0.00 0.00 55.95 57.64 1arh s SER 136 Cb 0.03 -1.70 0.07 0.00 0.10 0.00 0.00 66.02 64.51 1arh s SER 136 CO 0.21 -1.20 -0.04 0.21 0.98 0.00 0.00 173.24 173.39 1arh s ASN 137 N -4.34 4.62 0.69 7.02 3.84 -0.29 -3.15 114.94 123.32 1arh s ASN 137 Ca 0.56 -1.58 -0.02 0.00 0.21 0.00 0.00 52.86 52.03 1arh s ASN 137 Cb -0.11 -1.60 0.10 0.00 -0.55 0.00 0.00 41.25 39.09 1arh s ASN 137 CO 0.47 -0.26 0.97 -2.16 -2.79 0.00 0.00 177.10 173.33 1arh s PRO 138 N 1.08 1.90 0.31 0.43 0.04 -1.26 -3.68 135.00 133.81 1arh s PRO 138 Ca -0.03 -0.85 -0.03 0.00 0.04 0.00 0.00 61.00 60.13 1arh s PRO 138 Cb -0.20 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 1arh s PRO 138 CO -0.05 -1.31 0.42 0.45 0.04 0.00 0.00 177.00 176.55 1arh s SER 139 N -4.64 0.69 0.03 6.66 0.15 -1.19 -4.59 113.70 110.82 1arh s SER 139 Ca 0.64 -1.39 -0.30 0.00 0.70 0.00 0.00 55.95 55.59 1arh s SER 139 Cb -0.07 0.61 -0.08 0.00 -1.71 0.00 0.00 66.02 64.77 1arh s SER 139 CO 0.44 -1.20 1.70 0.86 1.20 0.00 0.00 173.24 176.24 1arh s TRP 140 N -3.40 2.16 0.41 3.44 -0.00 -1.12 -4.60 118.94 115.83 1arh s TRP 140 Ca 0.31 0.18 0.20 0.00 -0.00 0.00 0.00 56.10 56.79 1arh s TRP 140 Cb 0.01 -3.99 1.15 0.00 -0.00 0.00 0.00 33.47 30.63 1arh s TRP 140 CO 0.18 -4.10 1.76 -1.35 -0.00 0.00 0.00 176.95 173.44 1arh h PRO 141 N 8.92 0.34 0.00 5.86 0.11 -1.99 -1.74 132.00 143.50 1arh h PRO 141 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1arh h PRO 141 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1arh h PRO 141 CO 0.94 0.23 0.00 -0.97 -0.21 0.00 0.00 178.00 177.98 1arh h ASN 142 N 0.35 0.00 -0.16 -2.05 -1.24 -2.01 -3.15 115.58 107.32 1arh h ASN 142 Ca 0.62 0.00 0.03 0.00 0.71 0.00 0.00 56.30 57.66 1arh h ASN 142 Cb 1.63 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.65 1arh h ASN 142 CO -0.30 0.00 -0.05 0.45 -1.29 0.00 0.00 177.43 176.24 1arh h HIS 143 N 0.00 -0.10 0.05 0.67 3.86 -1.69 -1.40 115.15 116.54 1arh h HIS 143 Ca 0.00 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.24 1arh h HIS 143 Cb 0.17 0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1arh h HIS 143 CO 0.00 -0.08 -0.11 -0.22 0.86 0.00 0.00 177.93 178.38 1arh h LYS 144 N -0.01 -0.21 -0.74 2.45 3.64 -1.76 -1.81 116.57 118.12 1arh h LYS 144 Ca 0.08 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1arh h LYS 144 Cb 0.13 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.95 1arh h LYS 144 CO -0.17 -0.14 0.47 0.77 -2.27 0.00 0.00 179.45 178.11 1arh h SER 145 N -0.22 0.78 0.01 4.20 0.02 -1.66 0.15 113.55 116.83 1arh h SER 145 Ca 0.03 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1arh h SER 145 Cb 0.25 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1arh h SER 145 CO -0.08 0.54 -0.01 -0.37 -1.14 0.00 0.00 176.83 175.78 1arh h VAL 146 N 0.92 1.13 -0.69 2.27 -1.51 -1.00 -0.81 116.25 116.57 1arh h VAL 146 Ca 0.29 -0.42 -0.01 0.00 -1.23 0.00 0.00 66.70 65.33 1arh h VAL 146 Cb 0.00 1.42 -0.03 0.00 -2.13 0.00 0.00 31.29 30.55 1arh h VAL 146 CO -0.10 0.11 0.37 -0.26 -1.23 0.00 0.00 177.57 176.46 1arh h PHE 147 N -0.20 0.96 -0.20 5.19 0.04 -1.15 -1.38 116.94 120.21 1arh h PHE 147 Ca -0.00 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 1arh h PHE 147 Cb 0.19 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.02 1arh h PHE 147 CO -0.01 0.68 0.01 -0.91 -0.60 0.00 0.00 178.31 177.48 1arh h ASN 148 N 0.95 0.26 0.23 2.17 2.35 -0.66 -1.00 115.58 119.88 1arh h ASN 148 Ca 0.24 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.91 1arh h ASN 148 Cb 0.05 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1arh h ASN 148 CO -0.04 0.30 -0.24 0.28 -1.65 0.00 0.00 177.43 176.08 1arh h SER 149 N 0.28 0.02 -0.03 5.81 0.02 0.00 0.08 113.55 119.74 1arh h SER 149 Ca 0.07 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1arh h SER 149 Cb 0.17 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1arh h SER 149 CO 0.00 0.26 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 1arh n ALA 150 N -2.49 2.61 -2.15 3.77 0.00 -0.46 -4.89 120.51 116.90 1arh n ALA 150 Ca -0.02 -0.28 -0.05 0.00 0.00 0.00 0.00 53.44 53.09 1arh n ALA 150 Cb 0.30 -1.31 -0.00 0.00 0.00 0.00 0.00 19.45 18.44 1arh n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1arh n GLY 151 N 1.00 0.21 3.77 0.00 0.00 0.02 -4.81 105.19 105.37 1arh n GLY 151 Ca 0.19 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 1arh n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1arh s LEU 152 N -1.47 3.73 0.27 0.99 1.02 -0.73 -5.01 118.68 117.47 1arh s LEU 152 Ca 0.01 -0.12 -0.22 0.00 0.02 0.00 0.00 54.13 53.83 1arh s LEU 152 Cb -0.01 -2.38 -0.09 0.00 0.02 0.00 0.00 46.19 43.74 1arh s LEU 152 CO 0.01 0.11 0.81 -1.61 0.02 0.00 0.00 176.35 175.70 1arh s GLU 154 N -2.78 4.36 -0.19 1.70 2.02 0.33 -3.89 118.70 120.25 1arh s GLU 154 Ca 0.30 1.03 0.01 0.00 0.02 0.00 0.00 54.97 56.33 1arh s GLU 154 Cb -0.11 -2.80 0.03 0.00 0.10 0.00 0.00 34.13 31.35 1arh s GLU 154 CO 0.22 0.33 -0.16 0.14 0.02 0.00 0.00 175.26 175.81 1arh s VAL 155 N -1.60 1.93 0.54 2.63 -7.23 -1.26 0.16 120.40 115.56 1arh s VAL 155 Ca 0.47 -1.04 0.09 0.00 -1.81 0.00 0.00 61.98 59.69 1arh s VAL 155 Cb -0.17 -1.85 0.07 0.00 0.56 0.00 0.00 36.38 34.99 1arh s VAL 155 CO 0.21 0.35 0.74 -0.13 -0.31 0.00 0.00 175.10 175.96 1arh s ARG 156 N 1.30 2.42 0.03 4.82 1.81 0.36 -4.93 118.95 124.78 1arh s ARG 156 Ca 0.01 -1.51 0.04 0.00 -1.72 0.00 0.00 55.73 52.55 1arh s ARG 156 Cb -0.15 -2.67 -0.02 0.00 -0.45 0.00 0.00 34.95 31.66 1arh s ARG 156 CO -0.10 -0.73 -0.12 -1.21 -0.68 0.00 0.00 175.30 172.46 1arh s GLU 157 N -4.60 0.84 0.16 3.54 2.02 -1.26 -1.34 118.70 118.06 1arh s GLU 157 Ca 0.60 -0.70 0.10 0.00 0.02 0.00 0.00 54.97 54.98 1arh s GLU 157 Cb -0.07 -0.82 -0.04 0.00 0.10 0.00 0.00 34.13 33.30 1arh s GLU 157 CO 0.38 0.20 -0.17 1.52 0.02 0.00 0.00 175.26 177.21 1arh s TYR 158 N -0.84 2.51 0.49 1.61 1.13 0.03 -4.91 117.35 117.36 1arh s TYR 158 Ca 0.00 -0.27 -0.21 0.00 -1.41 0.00 0.00 57.07 55.18 1arh s TYR 158 Cb -0.08 -1.28 -0.07 0.00 -1.10 0.00 0.00 41.96 39.43 1arh s TYR 158 CO 0.01 0.46 1.10 0.00 -2.51 0.00 0.00 175.55 174.61 1arh s ALA 159 N -1.46 2.87 0.21 9.51 0.00 -1.26 -1.14 121.76 130.48 1arh s ALA 159 Ca 0.21 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.94 1arh s ALA 159 Cb -0.09 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1arh s ALA 159 CO 0.12 -0.53 0.00 0.98 0.00 0.00 0.00 175.76 176.33 1arh n TYR 160 N -0.83 -2.20 -3.35 0.00 9.36 -1.24 -3.78 117.16 115.12 1arh n TYR 160 Ca 0.09 0.48 -0.36 0.00 3.32 0.00 0.00 57.90 61.43 1arh n TYR 160 Cb 0.50 1.13 -0.06 0.00 -0.63 0.00 0.00 39.34 40.29 1arh n TYR 160 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1arh s TYR 161 N -2.00 3.63 -0.77 2.98 5.04 -1.24 0.82 117.35 125.81 1arh s TYR 161 Ca 0.00 1.08 -0.05 0.00 -2.44 0.00 0.00 57.07 55.66 1arh s TYR 161 Cb 0.00 -2.38 0.20 0.00 0.35 0.00 0.00 41.96 40.13 1arh s TYR 161 CO 0.00 0.45 0.64 0.34 -1.34 0.00 0.00 175.55 175.64 1arh s ASP 162 N -1.63 5.89 0.53 4.32 -1.08 -0.46 -4.66 116.67 119.57 1arh s ASP 162 Ca 0.36 -3.09 0.42 0.00 -0.52 0.00 0.00 52.55 49.73 1arh s ASP 162 Cb -0.16 -1.97 1.61 0.00 -1.46 0.00 0.00 42.92 40.95 1arh s ASP 162 CO 0.19 -0.36 1.66 0.00 0.52 0.00 0.00 175.17 177.18 1arh h ALA 163 N 6.91 3.40 0.02 3.66 0.00 -1.97 0.51 119.26 131.80 1arh h ALA 163 Ca 0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1arh h ALA 163 Cb 0.93 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1arh h ALA 163 CO 0.77 -1.91 -0.22 1.05 0.00 0.00 0.00 179.25 178.95 1arh h GLU 164 N 0.03 0.04 -0.02 0.00 4.11 -1.97 -3.38 114.58 113.38 1arh h GLU 164 Ca 0.80 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 60.16 1arh h GLU 164 Cb 3.05 0.02 0.00 0.00 0.50 0.00 0.00 28.75 32.32 1arh h GLU 164 CO -0.09 1.03 -0.17 0.09 0.07 0.00 0.00 179.01 179.94 1arh n ASN 165 N -4.53 2.52 -3.62 3.06 4.13 -0.47 -4.99 115.26 111.36 1arh n ASN 165 Ca -0.13 -1.77 -0.20 0.00 1.68 0.00 0.00 54.58 54.16 1arh n ASN 165 Cb 0.54 0.17 0.05 0.00 -1.54 0.00 0.00 39.78 39.00 1arh n ASN 165 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1arh n HIS 166 N 0.75 -1.99 -3.74 3.10 8.25 0.17 -4.97 115.22 116.79 1arh n HIS 166 Ca 0.13 0.85 -0.03 0.00 -0.26 0.00 0.00 57.72 58.41 1arh n HIS 166 Cb 0.53 -4.50 -0.01 0.00 1.12 0.00 0.00 29.99 27.13 1arh n HIS 166 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1arh n THR 167 N -4.19 0.00 -2.85 1.59 -2.24 -1.24 -4.98 114.28 100.36 1arh n THR 167 Ca -0.28 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 60.76 1arh n THR 167 Cb 0.67 0.19 -0.04 0.00 -2.10 0.00 0.00 70.33 69.05 1arh n THR 167 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1arh s LEU 168 N 0.00 4.08 -1.20 3.22 0.20 -1.26 -1.35 118.68 122.36 1arh s LEU 168 Ca 0.05 1.05 -0.15 0.00 0.69 0.00 0.00 54.13 55.77 1arh s LEU 168 Cb -0.00 -3.24 0.14 0.00 -0.43 0.00 0.00 46.19 42.66 1arh s LEU 168 CO 0.04 -0.56 1.48 -0.62 -0.29 0.00 0.00 176.35 176.39 1arh s ASP 169 N 1.36 6.96 0.21 3.68 -1.08 0.24 -4.84 116.67 123.21 1arh s ASP 169 Ca 0.36 -2.73 -0.09 0.00 -0.52 0.00 0.00 52.55 49.57 1arh s ASP 169 Cb -0.15 -2.45 0.31 0.00 -1.46 0.00 0.00 42.92 39.18 1arh s ASP 169 CO 0.08 -0.90 1.71 0.15 0.52 0.00 0.00 175.17 176.73 1arh h PHE 170 N 7.49 0.27 -0.30 -5.34 3.57 -1.94 0.16 116.94 120.86 1arh h PHE 170 Ca 0.33 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.74 1arh h PHE 170 Cb 0.89 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.60 1arh h PHE 170 CO 1.19 -0.00 -0.29 -0.44 -2.23 0.00 0.00 178.31 176.54 1arh h ASP 171 N 0.30 0.77 -0.70 0.41 3.32 -1.98 0.11 116.42 118.66 1arh h ASP 171 Ca 0.33 -0.47 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 1arh h ASP 171 Cb 0.48 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 1arh h ASP 171 CO -0.39 1.08 0.42 0.00 -1.72 0.00 0.00 179.24 178.63 1arh h ALA 172 N 0.72 0.89 0.19 3.45 0.00 -1.83 0.26 119.26 122.94 1arh h ALA 172 Ca 0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1arh h ALA 172 Cb 0.86 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1arh h ALA 172 CO 0.07 0.36 -0.09 1.25 0.00 0.00 0.00 179.25 180.85 1arh h LEU 173 N 0.96 -0.21 -1.78 0.00 5.85 -0.53 -0.78 115.31 118.82 1arh h LEU 173 Ca 0.25 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1arh h LEU 173 Cb -0.03 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 1arh h LEU 173 CO -0.05 -0.05 -0.15 0.40 -0.34 0.00 0.00 178.44 178.25 1arh h ILE 174 N -0.36 0.95 -0.09 4.05 2.04 -0.61 -2.51 117.51 120.98 1arh h ILE 174 Ca -0.03 -0.53 -0.19 0.00 1.00 0.00 0.00 64.86 65.11 1arh h ILE 174 Cb 0.28 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1arh h ILE 174 CO 0.04 0.14 -0.75 0.78 0.00 0.00 0.00 178.15 178.37 1arh h ASN 175 N 0.00 0.55 0.36 1.72 2.35 0.22 -3.16 115.58 117.62 1arh h ASN 175 Ca -0.00 -0.37 -0.14 0.00 -0.55 0.00 0.00 56.30 55.24 1arh h ASN 175 Cb 0.29 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 1arh h ASN 175 CO 0.02 1.12 -0.59 0.77 -1.65 0.00 0.00 177.43 177.10 1arh h SER 176 N 0.31 0.26 0.19 5.81 4.64 -0.86 -2.99 113.55 120.91 1arh h SER 176 Ca -0.04 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1arh h SER 176 Cb 1.33 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1arh h SER 176 CO 0.13 0.79 0.00 -0.07 -0.87 0.00 0.00 176.83 176.81 1arh h LEU 177 N 0.17 0.00 -1.22 5.97 3.38 -1.43 -1.38 115.31 120.81 1arh h LEU 177 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1arh h LEU 177 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1arh h LEU 177 CO 0.09 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.40 1arh h ASN 178 N 0.00 0.00 -0.04 -0.43 2.35 -1.52 -2.81 115.58 113.12 1arh h ASN 178 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1arh h ASN 178 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1arh h ASN 178 CO 0.00 0.00 0.00 1.21 -1.65 0.00 0.00 177.43 176.99 1arh n GLU 179 N -2.86 1.14 -3.55 0.81 4.07 -0.52 -4.81 120.64 114.92 1arh n GLU 179 Ca 0.01 -0.22 -0.37 0.00 -0.06 0.00 0.00 57.16 56.53 1arh n GLU 179 Cb 0.29 -1.22 -0.07 0.00 -0.06 0.00 0.00 31.44 30.38 1arh n GLU 179 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1arh s ALA 180 N -1.94 3.62 0.33 4.31 0.00 -1.06 -5.09 121.76 121.93 1arh s ALA 180 Ca 0.20 -0.44 -0.04 0.00 0.00 0.00 0.00 51.96 51.69 1arh s ALA 180 Cb 0.10 -2.36 -0.05 0.00 0.00 0.00 0.00 23.12 20.81 1arh s ALA 180 CO 0.16 0.17 0.59 -0.65 0.00 0.00 0.00 175.76 176.03 1arh s GLN 181 N 0.18 3.59 0.18 0.00 -0.21 -1.26 -5.00 119.66 117.14 1arh s GLN 181 Ca 0.17 -0.04 -0.32 0.00 0.02 0.00 0.00 55.36 55.19 1arh s GLN 181 Cb -0.13 -2.61 -0.11 0.00 1.00 0.00 0.00 33.01 31.16 1arh s GLN 181 CO 0.05 0.14 1.70 0.00 -2.12 0.00 0.00 175.29 175.05 1arh s ALA 182 N -2.24 3.87 0.00 6.09 0.00 -1.24 -0.83 121.76 127.42 1arh s ALA 182 Ca 0.44 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1arh s ALA 182 Cb -0.10 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.33 1arh s ALA 182 CO 0.33 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.57 1arh n GLY 183 N 3.96 0.69 3.89 0.00 0.00 0.16 -4.97 105.19 108.93 1arh n GLY 183 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1arh n GLY 183 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1arh s ASP 184 N -2.48 6.54 -0.18 1.61 1.01 -0.01 -4.59 116.67 118.56 1arh s ASP 184 Ca 0.00 0.75 -0.16 0.00 0.71 0.00 0.00 52.55 53.85 1arh s ASP 184 Cb 0.00 -2.16 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 1arh s ASP 184 CO 0.00 -0.05 0.41 -0.69 0.21 0.00 0.00 175.17 175.05 1arh s VAL 185 N -1.81 5.21 -0.20 -1.27 1.01 -0.93 -0.61 120.40 121.79 1arh s VAL 185 Ca 0.44 0.75 -0.04 0.00 0.00 0.00 0.00 61.98 63.13 1arh s VAL 185 Cb -0.11 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1arh s VAL 185 CO 0.24 0.28 -0.02 -0.69 0.00 0.00 0.00 175.10 174.91 1arh s VAL 186 N 1.07 3.72 -0.14 2.92 1.01 -0.89 0.35 120.40 128.44 1arh s VAL 186 Ca 0.20 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.64 1arh s VAL 186 Cb -0.15 -2.68 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 1arh s VAL 186 CO 0.08 0.43 0.37 -0.22 0.00 0.00 0.00 175.10 175.75 1arh s LEU 187 N 1.12 4.27 -0.03 3.92 0.20 0.88 -2.17 118.68 126.87 1arh s LEU 187 Ca 0.02 0.64 0.07 0.00 0.69 0.00 0.00 54.13 55.55 1arh s LEU 187 Cb -0.14 -2.50 -0.02 0.00 -0.43 0.00 0.00 46.19 43.10 1arh s LEU 187 CO 0.01 0.08 -0.24 -0.36 -0.29 0.00 0.00 176.35 175.54 1arh s PHE 188 N 0.42 2.22 -0.36 5.38 0.08 -0.21 -4.57 117.98 120.95 1arh s PHE 188 Ca 0.20 -0.50 -0.25 0.00 0.12 0.00 0.00 56.93 56.50 1arh s PHE 188 Cb -0.14 -1.44 0.01 0.00 -0.57 0.00 0.00 43.02 40.88 1arh s PHE 188 CO 0.07 -0.09 0.87 -1.01 -0.10 0.00 0.00 175.22 174.96 1arh s HIS 189 N -0.42 3.11 0.28 0.36 3.76 -1.26 0.65 115.29 121.76 1arh s HIS 189 Ca 0.05 0.73 0.02 0.00 -0.15 0.00 0.00 55.06 55.72 1arh s HIS 189 Cb -0.11 -3.52 0.67 0.00 1.11 0.00 0.00 32.58 30.73 1arh s HIS 189 CO 0.00 -0.76 1.71 0.78 -0.85 0.00 0.00 174.74 175.62 1arh h GLY 190 N 9.89 1.46 -3.06 -2.22 0.00 -1.41 -3.46 103.07 104.27 1arh h GLY 190 Ca -0.24 -0.17 0.21 0.00 0.00 0.00 0.00 47.33 47.13 1arh h GLY 190 CO 0.95 -0.21 0.64 0.00 0.00 0.00 0.00 176.54 177.91 1arh n HIS 193 N -4.04 0.74 -3.79 0.00 -0.00 -1.26 -4.79 115.22 102.08 1arh n HIS 193 Ca -0.16 0.87 -0.37 0.00 0.46 0.00 0.00 57.72 58.53 1arh n HIS 193 Cb 0.63 -2.15 -0.13 0.00 -0.12 0.00 0.00 29.99 28.21 1arh n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1arh s ASN 194 N -0.14 4.99 -0.09 0.26 3.84 -1.26 -1.17 114.94 121.37 1arh s ASN 194 Ca 0.79 -0.58 0.13 0.00 0.21 0.00 0.00 52.86 53.41 1arh s ASN 194 Cb -1.03 -1.86 0.36 0.00 -0.55 0.00 0.00 41.25 38.17 1arh s ASN 194 CO 0.54 -0.14 1.28 -0.81 -2.79 0.00 0.00 177.10 175.19 1arh n PRO 195 N 4.86 2.70 0.04 0.43 -0.04 -1.26 -2.79 135.00 138.94 1arh n PRO 195 Ca -0.15 -2.40 -0.10 0.00 -0.04 0.00 0.00 63.50 60.81 1arh n PRO 195 Cb 0.49 -1.52 -0.13 0.00 -0.04 0.00 0.00 33.50 32.30 1arh n PRO 195 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1arh h THR 196 N 1.42 1.37 0.00 0.52 1.35 -1.85 -3.34 112.91 112.39 1arh h THR 196 Ca 0.00 -3.09 0.00 0.00 -0.55 0.00 0.00 66.41 62.77 1arh h THR 196 Cb 1.05 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 1arh h THR 196 CO 0.10 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.79 1arh n GLY 197 N 1.48 0.68 3.49 5.82 0.00 -0.31 -2.93 105.19 113.40 1arh n GLY 197 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 1arh n GLY 197 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1arh s ILE 198 N -2.64 4.75 0.23 -0.61 1.01 -1.26 -0.54 121.20 122.13 1arh s ILE 198 Ca 0.00 -0.16 0.11 0.00 0.00 0.00 0.00 60.65 60.60 1arh s ILE 198 Cb 0.00 -3.32 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 1arh s ILE 198 CO 0.00 0.20 -0.18 -1.81 0.00 0.00 0.00 174.94 173.15 1arh s ASP 199 N 1.66 3.72 0.79 3.58 1.01 -1.26 -4.43 116.67 121.74 1arh s ASP 199 Ca 0.06 -0.85 -0.11 0.00 0.71 0.00 0.00 52.55 52.35 1arh s ASP 199 Cb -0.16 -0.40 0.07 0.00 1.01 0.00 0.00 42.92 43.44 1arh s ASP 199 CO 0.07 0.08 1.10 -2.84 0.21 0.00 0.00 175.17 173.79 1arh s PRO 200 N -3.07 2.12 0.61 8.23 0.02 -1.26 -4.97 135.00 136.69 1arh s PRO 200 Ca 0.25 0.65 -0.04 0.00 0.02 0.00 0.00 61.00 61.88 1arh s PRO 200 Cb -0.07 -1.92 0.03 0.00 0.02 0.00 0.00 34.50 32.56 1arh s PRO 200 CO 0.13 -1.60 0.90 0.95 -0.33 0.00 0.00 177.00 177.06 1arh s THR 201 N -3.16 2.99 0.24 0.99 -4.23 -1.26 -4.83 115.64 106.39 1arh s THR 201 Ca 0.61 -0.27 -0.04 0.00 -1.18 0.00 0.00 61.69 60.80 1arh s THR 201 Cb -0.14 -3.20 0.21 0.00 1.34 0.00 0.00 72.50 70.71 1arh s THR 201 CO 0.54 -0.19 1.81 0.25 -0.54 0.00 0.00 174.62 176.49 1arh h LEU 202 N -0.24 0.70 -1.18 4.79 7.12 -1.98 0.29 115.31 124.81 1arh h LEU 202 Ca -0.44 0.04 -0.02 0.00 0.13 0.00 0.00 57.88 57.59 1arh h LEU 202 Cb 1.29 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 41.30 1arh h LEU 202 CO 0.59 0.40 0.27 -0.33 -0.13 0.00 0.00 178.44 179.24 1arh h GLU 203 N 0.81 0.85 -0.19 1.25 5.08 -1.99 -0.22 114.58 120.18 1arh h GLU 203 Ca 0.40 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.54 1arh h GLU 203 Cb 0.34 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1arh h GLU 203 CO -0.24 0.67 -0.29 1.96 -1.00 0.00 0.00 179.01 180.11 1arh h GLN 204 N 0.84 0.52 -0.73 2.33 4.20 -1.42 -2.07 115.11 118.78 1arh h GLN 204 Ca 0.21 -0.31 0.08 0.00 0.06 0.00 0.00 58.65 58.69 1arh h GLN 204 Cb 0.11 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.85 1arh h GLN 204 CO -0.03 0.91 0.40 -1.49 -0.67 0.00 0.00 178.83 177.95 1arh h TRP 205 N 0.18 0.72 -0.42 2.96 -0.00 -0.08 0.18 115.95 119.48 1arh h TRP 205 Ca 0.02 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 58.91 1arh h TRP 205 Cb 0.86 -0.21 -0.02 0.00 -0.00 0.00 0.00 29.16 29.79 1arh h TRP 205 CO 0.09 0.30 0.14 1.96 -0.00 0.00 0.00 178.44 180.93 1arh h GLN 206 N 0.69 0.61 -0.18 0.49 4.20 -0.91 0.09 115.11 120.11 1arh h GLN 206 Ca 0.35 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.86 1arh h GLN 206 Cb 0.31 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 1arh h GLN 206 CO -0.23 0.53 -0.30 1.15 -0.67 0.00 0.00 178.83 179.31 1arh h THR 207 N 0.61 1.34 -0.10 -0.54 2.02 -0.38 -2.59 112.91 113.28 1arh h THR 207 Ca 0.15 -1.53 -0.03 0.00 0.77 0.00 0.00 66.41 65.77 1arh h THR 207 Cb 0.17 1.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 1arh h THR 207 CO -0.01 0.46 -0.06 -0.07 0.37 0.00 0.00 175.52 176.21 1arh h LEU 208 N 0.16 0.13 -0.32 2.58 3.38 -0.41 -2.14 115.31 118.69 1arh h LEU 208 Ca 0.01 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1arh h LEU 208 Cb 0.88 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1arh h LEU 208 CO 0.07 0.22 -0.21 0.00 0.09 0.00 0.00 178.44 178.60 1arh h ALA 209 N 1.80 0.46 -0.43 1.53 0.00 -0.81 -1.72 119.26 120.10 1arh h ALA 209 Ca 0.03 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 1arh h ALA 209 Cb 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1arh h ALA 209 CO 0.01 0.42 -0.26 1.96 0.00 0.00 0.00 179.25 181.38 1arh h GLN 210 N 0.48 0.90 -0.32 0.00 4.20 -1.22 -2.98 115.11 116.18 1arh h GLN 210 Ca 0.07 -0.40 0.02 0.00 0.06 0.00 0.00 58.65 58.40 1arh h GLN 210 Cb 0.76 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.49 1arh h GLN 210 CO 0.06 1.05 0.17 1.25 -0.67 0.00 0.00 178.83 180.69 1arh h LEU 211 N 0.77 0.26 -0.52 1.46 5.85 -1.34 -1.28 115.31 120.51 1arh h LEU 211 Ca 0.09 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1arh h LEU 211 Cb 0.82 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 1arh h LEU 211 CO 0.07 0.19 0.24 -1.28 -0.34 0.00 0.00 178.44 177.32 1arh h SER 212 N 0.35 0.33 -0.11 1.25 0.87 -1.28 0.47 113.55 115.43 1arh h SER 212 Ca 0.13 0.04 -0.20 0.00 -1.23 0.00 0.00 61.79 60.53 1arh h SER 212 Cb 0.04 -0.02 0.01 0.00 -0.44 0.00 0.00 62.40 61.99 1arh h SER 212 CO -0.08 0.22 -0.70 -0.37 -0.53 0.00 0.00 176.83 175.37 1arh h VAL 213 N 0.47 1.32 -0.91 2.23 -1.51 -1.38 -1.51 116.25 114.96 1arh h VAL 213 Ca 0.23 -1.96 0.15 0.00 -1.23 0.00 0.00 66.70 63.89 1arh h VAL 213 Cb 0.18 2.14 -0.07 0.00 -2.13 0.00 0.00 31.29 31.40 1arh h VAL 213 CO -0.18 0.61 0.58 -0.08 -1.23 0.00 0.00 177.57 177.27 1arh h GLU 214 N 0.34 0.70 0.00 5.19 4.81 -0.85 -3.03 114.58 121.74 1arh h GLU 214 Ca -0.06 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.08 1arh h GLU 214 Cb 1.35 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1arh h GLU 214 CO 0.14 0.46 -1.26 1.63 -0.73 0.00 0.00 179.01 179.25 1arh n LYS 215 N -4.58 0.62 -0.89 1.92 4.01 0.12 -5.01 118.16 114.36 1arh n LYS 215 Ca 0.18 0.10 0.00 0.00 -0.51 0.00 0.00 58.31 58.08 1arh n LYS 215 Cb 0.47 -1.78 0.00 0.00 -0.51 0.00 0.00 35.03 33.22 1arh n LYS 215 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1arh n GLY 216 N 1.25 0.68 3.83 0.72 0.00 -0.61 -3.63 105.19 107.42 1arh n GLY 216 Ca -0.04 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 44.97 1arh n GLY 216 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1arh s TRP 217 N -2.00 3.23 -0.33 1.61 0.51 -0.93 0.41 118.94 121.44 1arh s TRP 217 Ca 0.00 1.39 -0.04 0.00 -2.12 0.00 0.00 56.10 55.33 1arh s TRP 217 Cb 0.00 -2.85 0.05 0.00 -0.81 0.00 0.00 33.47 29.87 1arh s TRP 217 CO 0.00 -1.11 0.07 -1.17 -0.51 0.00 0.00 176.95 174.23 1arh s LEU 218 N -5.44 4.23 0.21 2.99 2.96 0.22 -4.85 118.68 119.00 1arh s LEU 218 Ca 0.57 -1.31 -0.30 0.00 -0.22 0.00 0.00 54.13 52.88 1arh s LEU 218 Cb -0.13 -1.79 -0.08 0.00 0.50 0.00 0.00 46.19 44.68 1arh s LEU 218 CO 0.54 -0.32 1.21 -2.84 -1.32 0.00 0.00 176.35 173.62 1arh s PRO 219 N 1.30 4.48 -0.19 0.98 0.02 -1.26 -2.09 135.00 138.25 1arh s PRO 219 Ca -0.02 1.92 0.00 0.00 0.02 0.00 0.00 61.00 62.92 1arh s PRO 219 Cb -0.20 -3.22 0.04 0.00 0.02 0.00 0.00 34.50 31.15 1arh s PRO 219 CO 0.00 -0.09 -0.07 -1.17 -0.33 0.00 0.00 177.00 175.34 1arh s LEU 220 N -0.45 1.96 -0.09 -5.54 0.20 -0.92 -1.48 118.68 112.36 1arh s LEU 220 Ca 0.52 -0.80 -0.05 0.00 0.69 0.00 0.00 54.13 54.49 1arh s LEU 220 Cb -0.34 -1.06 -0.04 0.00 -0.43 0.00 0.00 46.19 44.32 1arh s LEU 220 CO 0.38 -0.17 0.13 -0.36 -0.29 0.00 0.00 176.35 176.04 1arh s PHE 221 N 1.52 3.53 -0.34 5.38 0.40 0.30 -1.04 117.98 127.72 1arh s PHE 221 Ca -0.01 0.45 -0.06 0.00 -0.60 0.00 0.00 56.93 56.71 1arh s PHE 221 Cb -0.16 -1.89 0.05 0.00 0.51 0.00 0.00 43.02 41.52 1arh s PHE 221 CO -0.08 0.68 0.10 0.34 0.70 0.00 0.00 175.22 176.96 1arh s ASP 222 N -1.22 5.25 -0.53 1.36 -1.08 0.21 -1.40 116.67 119.26 1arh s ASP 222 Ca 0.18 -1.22 -0.02 0.00 -0.52 0.00 0.00 52.55 50.97 1arh s ASP 222 Cb -0.12 -1.84 0.14 0.00 -1.46 0.00 0.00 42.92 39.63 1arh s ASP 222 CO 0.07 -0.33 0.32 0.12 0.52 0.00 0.00 175.17 175.87 1arh s PHE 223 N 1.37 3.46 -0.94 -5.34 2.19 0.13 -0.96 117.98 117.88 1arh s PHE 223 Ca -0.02 -2.68 0.12 0.00 0.33 0.00 0.00 56.93 54.68 1arh s PHE 223 Cb -0.20 -3.15 -0.03 0.00 -1.31 0.00 0.00 43.02 38.32 1arh s PHE 223 CO 0.02 -0.88 0.64 0.00 1.83 0.00 0.00 175.22 176.83 1arh n ALA 224 N 3.85 3.08 -2.71 11.12 0.00 -1.26 -1.61 120.51 132.97 1arh n ALA 224 Ca 0.04 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1arh n ALA 224 Cb 0.39 -0.42 0.04 0.00 0.00 0.00 0.00 19.45 19.46 1arh n ALA 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1arh n ARG 225 N -0.49 1.36 -1.70 0.00 1.74 -1.26 -4.41 116.66 111.89 1arh n ARG 225 Ca 0.04 -3.15 -0.42 0.00 -0.77 0.00 0.00 57.85 53.55 1arh n ARG 225 Cb 0.23 -1.23 -0.03 0.00 -1.02 0.00 0.00 32.46 30.41 1arh n ARG 225 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1arh n GLN 226 N -0.33 2.78 0.00 5.56 7.27 -1.26 -1.65 117.38 129.74 1arh n GLN 226 Ca 0.08 1.01 0.00 0.00 0.07 0.00 0.00 57.00 58.16 1arh n GLN 226 Cb 0.89 -2.88 0.00 0.00 2.41 0.00 0.00 30.24 30.66 1arh n GLN 226 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1arh n GLY 227 N 4.11 0.58 0.01 1.69 0.00 -1.26 -4.76 105.19 105.55 1arh n GLY 227 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 1arh n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1arh n PHE 228 N -1.27 0.06 0.00 1.61 3.72 -0.66 -4.15 117.46 116.77 1arh n PHE 228 Ca 0.00 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1arh n PHE 228 Cb 0.00 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.34 1arh n PHE 228 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1arh n ALA 229 N -1.65 0.00 -0.06 4.37 0.00 -1.26 -3.70 120.51 118.21 1arh n ALA 229 Ca 0.03 -0.04 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1arh n ALA 229 Cb 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.77 1arh n ALA 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1arh n ARG 230 N -1.50 0.65 0.00 0.00 1.74 -1.26 -4.77 116.66 111.51 1arh n ARG 230 Ca 0.00 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1arh n ARG 230 Cb 0.00 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1arh n ARG 230 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1arh n GLY 231 N 2.85 3.01 0.31 -0.13 0.00 -1.26 -4.96 105.19 105.02 1arh n GLY 231 Ca -0.20 -0.85 0.02 0.00 0.00 0.00 0.00 46.02 44.99 1arh n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1arh n LEU 233 N 0.00 -0.41 -0.04 0.99 4.32 -1.26 -0.90 117.00 119.69 1arh n LEU 233 Ca 0.00 1.44 -0.15 0.00 -0.02 0.00 0.00 56.01 57.28 1arh n LEU 233 Cb 0.00 -0.39 -0.12 0.00 -1.62 0.00 0.00 43.42 41.29 1arh n LEU 233 CO 0.00 -1.34 0.39 -0.33 -1.22 0.00 0.00 177.39 174.89 1arh h GLU 234 N 0.00 0.06 -0.05 3.23 4.39 -1.96 -3.32 114.58 116.93 1arh h GLU 234 Ca 0.35 -0.09 0.04 0.00 0.34 0.00 0.00 59.36 60.00 1arh h GLU 234 Cb 0.56 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.18 1arh h GLU 234 CO -0.84 0.94 -0.29 0.93 -1.16 0.00 0.00 179.01 178.59 1arh h GLU 235 N -0.77 -0.39 0.00 2.33 3.07 -1.82 -0.59 114.58 116.40 1arh h GLU 235 Ca -0.02 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1arh h GLU 235 Cb 1.00 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.00 1arh h GLU 235 CO 0.02 -0.26 0.30 -0.25 -1.40 0.00 0.00 179.01 177.42 1arh n ASP 236 N -5.40 0.22 -0.59 1.42 9.92 -0.08 -0.45 116.55 121.59 1arh n ASP 236 Ca -0.04 0.46 0.07 0.00 -0.53 0.00 0.00 54.79 54.75 1arh n ASP 236 Cb 0.31 -0.41 0.09 0.00 -0.64 0.00 0.00 41.12 40.46 1arh n ASP 236 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1arh n ALA 237 N -1.47 2.42 0.20 2.24 0.00 -0.24 -4.52 120.51 119.14 1arh n ALA 237 Ca -0.01 -0.74 0.09 0.00 0.00 0.00 0.00 53.44 52.79 1arh n ALA 237 Cb 0.31 -0.47 0.63 0.00 0.00 0.00 0.00 19.45 19.92 1arh n ALA 237 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1arh h GLU 238 N 2.58 0.05 0.79 0.00 5.08 -0.71 -1.03 114.58 121.35 1arh h GLU 238 Ca 0.00 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1arh h GLU 238 Cb 0.61 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.85 1arh h GLU 238 CO 0.00 0.04 -0.38 0.78 -1.00 0.00 0.00 179.01 178.45 1arh h GLY 239 N 0.06 -1.11 0.22 -3.84 0.00 -1.79 -0.43 103.07 96.17 1arh h GLY 239 Ca 0.05 0.41 0.15 0.00 0.00 0.00 0.00 47.33 47.94 1arh h GLY 239 CO -0.00 -0.40 0.42 -2.00 0.00 0.00 0.00 176.54 174.55 1arh h LEU 240 N -1.16 0.50 -1.08 3.11 5.85 -1.79 -0.98 115.31 119.76 1arh h LEU 240 Ca -0.11 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1arh h LEU 240 Cb 0.83 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 1arh h LEU 240 CO 0.18 0.21 0.20 0.03 -0.34 0.00 0.00 178.44 178.71 1arh h ARG 241 N 0.60 0.85 -0.46 1.25 -0.00 -1.00 -0.64 114.38 114.97 1arh h ARG 241 Ca 0.46 -0.15 -0.10 0.00 -0.50 0.00 0.00 59.98 59.69 1arh h ARG 241 Cb 0.65 -0.14 -0.02 0.00 0.00 0.00 0.00 29.97 30.46 1arh h ARG 241 CO -0.37 0.72 -0.13 0.00 0.00 0.00 0.00 179.97 180.19 1arh h ALA 242 N 1.39 0.90 -0.16 0.04 0.00 0.28 -2.00 119.26 119.70 1arh h ALA 242 Ca 0.19 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1arh h ALA 242 Cb 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1arh h ALA 242 CO -0.01 0.63 -0.01 0.74 0.00 0.00 0.00 179.25 180.60 1arh h PHE 243 N 0.77 0.32 -0.10 0.00 -1.00 -0.94 -2.96 116.94 113.03 1arh h PHE 243 Ca 0.12 -0.06 0.03 0.00 2.81 0.00 0.00 57.97 60.87 1arh h PHE 243 Cb 0.65 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 40.12 1arh h PHE 243 CO 0.04 0.52 0.09 0.00 -1.61 0.00 0.00 178.31 177.35 1arh h ALA 244 N 0.76 1.78 0.00 2.45 0.00 -1.01 -0.25 119.26 122.99 1arh h ALA 244 Ca 0.05 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1arh h ALA 244 Cb 0.40 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1arh h ALA 244 CO 0.01 -0.14 -0.25 0.00 0.00 0.00 0.00 179.25 178.87 1arh h ALA 245 N 1.90 1.08 0.00 0.00 0.00 -1.18 -3.33 119.26 117.73 1arh h ALA 245 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1arh h ALA 245 Cb 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1arh h ALA 245 CO -0.00 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.56 1arh n MET 246 N -3.51 2.91 -3.53 0.00 -0.00 -0.27 -5.04 117.12 107.69 1arh n MET 246 Ca -0.00 -0.19 -0.34 0.00 -0.00 0.00 0.00 57.70 57.17 1arh n MET 246 Cb 0.41 -0.66 -0.05 0.00 -0.00 0.00 0.00 33.22 32.92 1arh n MET 246 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 1arh s HIS 247 N -0.47 3.53 -0.08 3.17 3.76 -0.27 -4.97 115.29 119.95 1arh s HIS 247 Ca 0.00 0.80 -0.06 0.00 -0.15 0.00 0.00 55.06 55.65 1arh s HIS 247 Cb 0.00 -2.18 -0.27 0.00 1.11 0.00 0.00 32.58 31.23 1arh s HIS 247 CO 0.00 0.43 0.51 0.87 -0.85 0.00 0.00 174.74 175.71 1arh h LYS 248 N 3.27 0.28 -6.42 1.40 1.79 -1.90 -3.46 116.57 111.52 1arh h LYS 248 Ca -0.48 -0.48 -0.63 0.00 -2.18 0.00 0.00 60.65 56.88 1arh h LYS 248 Cb 1.18 0.18 -0.16 0.00 -1.58 0.00 0.00 32.23 31.85 1arh h LYS 248 CO 0.68 1.18 -0.79 -1.21 -1.08 0.00 0.00 179.45 178.23 1arh s GLU 249 N -2.57 1.63 -0.27 3.15 2.02 -1.26 -2.57 118.70 118.82 1arh s GLU 249 Ca -0.18 -1.62 -0.37 0.00 0.02 0.00 0.00 54.97 52.82 1arh s GLU 249 Cb 0.06 -1.83 0.16 0.00 0.10 0.00 0.00 34.13 32.62 1arh s GLU 249 CO 0.80 0.37 1.35 -1.17 0.02 0.00 0.00 175.26 176.64 1arh s LEU 250 N -3.06 -0.04 -0.00 1.80 2.96 -0.96 -4.60 118.68 114.78 1arh s LEU 250 Ca 0.25 0.00 0.01 0.00 -0.22 0.00 0.00 54.13 54.18 1arh s LEU 250 Cb -0.07 1.10 -0.00 0.00 0.50 0.00 0.00 46.19 47.72 1arh s LEU 250 CO 0.12 -0.06 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.43 1arh s ILE 251 N -1.99 0.31 -0.04 6.68 1.01 -0.55 -1.28 121.20 125.33 1arh s ILE 251 Ca 0.11 -0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.60 1arh s ILE 251 Cb -0.01 -0.27 0.01 0.00 0.01 0.00 0.00 42.46 42.21 1arh s ILE 251 CO -0.03 0.07 -0.09 -0.69 0.00 0.00 0.00 174.94 174.20 1arh s VAL 252 N -0.12 0.84 -0.18 2.92 1.01 0.16 -0.54 120.40 124.49 1arh s VAL 252 Ca 0.01 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1arh s VAL 252 Cb -0.02 -0.77 0.02 0.00 0.00 0.00 0.00 36.38 35.61 1arh s VAL 252 CO -0.00 0.28 -0.19 0.00 0.00 0.00 0.00 175.10 175.19 1arh s ALA 253 N 0.52 2.26 0.22 5.51 0.00 -0.49 -0.12 121.76 129.66 1arh s ALA 253 Ca -0.09 -1.19 0.08 0.00 0.00 0.00 0.00 51.96 50.76 1arh s ALA 253 Cb -0.12 -1.18 -0.05 0.00 0.00 0.00 0.00 23.12 21.77 1arh s ALA 253 CO 0.01 -0.39 -0.14 -1.54 0.00 0.00 0.00 175.76 173.71 1arh s SER 254 N 1.32 2.68 0.02 0.00 1.04 -0.03 0.20 113.70 118.92 1arh s SER 254 Ca 0.04 -1.05 0.03 0.00 0.48 0.00 0.00 55.95 55.46 1arh s SER 254 Cb -0.13 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.82 1arh s SER 254 CO -0.12 -0.18 -0.10 -0.55 0.98 0.00 0.00 173.24 173.27 1arh s SER 255 N -3.35 1.14 -0.03 7.02 0.15 -0.63 -0.45 113.70 117.54 1arh s SER 255 Ca 0.24 -0.33 0.10 0.00 0.70 0.00 0.00 55.95 56.66 1arh s SER 255 Cb -0.00 -0.07 0.29 0.00 -1.71 0.00 0.00 66.02 64.53 1arh s SER 255 CO 0.08 0.01 1.24 -1.22 1.20 0.00 0.00 173.24 174.55 1arh n TYR 256 N 2.25 0.46 -0.17 3.44 4.01 0.11 -4.65 117.16 122.61 1arh n TYR 256 Ca -0.17 -0.56 -0.10 0.00 -0.16 0.00 0.00 57.90 56.91 1arh n TYR 256 Cb 0.56 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 1arh n TYR 256 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1arh h SER 257 N 1.70 0.86 0.00 7.72 0.02 -1.85 -2.85 113.55 119.15 1arh h SER 257 Ca 0.00 -0.31 -0.07 0.00 -0.84 0.00 0.00 61.79 60.57 1arh h SER 257 Cb 0.80 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 1arh h SER 257 CO 0.03 0.96 -0.45 0.11 -1.14 0.00 0.00 176.83 176.34 1arh h LYS 258 N 0.74 0.00 -0.01 3.45 6.56 -1.82 -2.95 116.57 122.53 1arh h LYS 258 Ca 0.14 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.73 1arh h LYS 258 Cb 0.53 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.19 1arh h LYS 258 CO 0.03 0.75 0.01 -2.95 -2.06 0.00 0.00 179.45 175.23 1arh h ASN 259 N -1.00 0.00 -0.01 0.86 -0.00 -1.84 -2.83 115.58 110.76 1arh h ASN 259 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.19 1arh h ASN 259 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.22 1arh h ASN 259 CO -0.07 0.00 -0.22 0.49 -0.00 0.00 0.00 177.43 177.63 1arh n PHE 260 N -4.29 0.00 -1.94 4.14 3.01 -1.08 -4.83 117.46 112.48 1arh n PHE 260 Ca -0.03 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.26 1arh n PHE 260 Cb 0.10 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.53 1arh n PHE 260 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1arh n GLY 261 N 0.98 0.61 2.08 1.37 0.00 -1.07 -4.65 105.19 104.51 1arh n GLY 261 Ca 0.06 -0.18 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 1arh n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1arh n LEU 262 N -2.23 6.33 -0.27 0.99 4.32 -1.13 -4.82 117.00 120.19 1arh n LEU 262 Ca -0.19 -3.41 -0.07 0.00 -0.02 0.00 0.00 56.01 52.32 1arh n LEU 262 Cb 0.61 -0.78 -0.06 0.00 -1.62 0.00 0.00 43.42 41.56 1arh n LEU 262 CO 0.25 0.93 0.36 -1.22 -1.22 0.00 0.00 177.39 176.49 1arh n TYR 263 N -0.62 -0.28 1.66 -1.77 4.01 -1.23 -0.99 117.16 117.95 1arh n TYR 263 Ca 0.49 0.80 0.14 0.00 -0.16 0.00 0.00 57.90 59.16 1arh n TYR 263 Cb 1.51 -0.53 0.80 0.00 -0.31 0.00 0.00 39.34 40.80 1arh n TYR 263 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1arh n ASN 264 N -4.61 0.00 0.06 7.72 6.94 -1.26 -3.13 115.26 120.97 1arh n ASN 264 Ca 0.01 -0.78 0.11 0.00 -0.02 0.00 0.00 54.58 53.90 1arh n ASN 264 Cb 0.17 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.56 1arh n ASN 264 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1arh n GLU 265 N -1.03 0.49 -2.45 -3.83 -0.58 -0.16 -5.02 120.64 108.06 1arh n GLU 265 Ca 0.20 0.04 -0.05 0.00 -0.42 0.00 0.00 57.16 56.93 1arh n GLU 265 Cb 0.10 -1.71 0.02 0.00 -0.57 0.00 0.00 31.44 29.29 1arh n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1arh n ARG 266 N -2.36 -1.04 -3.92 3.49 5.12 -1.18 -4.58 116.66 112.18 1arh n ARG 266 Ca 0.00 0.77 -0.35 0.00 -1.93 0.00 0.00 57.85 56.34 1arh n ARG 266 Cb 0.51 -3.97 -0.14 0.00 -1.16 0.00 0.00 32.46 27.70 1arh n ARG 266 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1arh s VAL 267 N -3.12 2.90 0.19 1.55 1.01 -1.26 -1.91 120.40 119.75 1arh s VAL 267 Ca 0.14 -1.44 -0.04 0.00 0.00 0.00 0.00 61.98 60.65 1arh s VAL 267 Cb -0.02 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.69 1arh s VAL 267 CO 0.43 -0.12 0.32 0.61 0.00 0.00 0.00 175.10 176.34 1arh n GLY 268 N 4.60 2.11 3.33 4.51 0.00 -1.08 0.05 105.19 118.70 1arh n GLY 268 Ca -0.13 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 1arh n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1arh s ALA 269 N -1.90 -1.03 -0.27 4.61 0.00 0.40 -1.82 121.76 121.75 1arh s ALA 269 Ca 0.12 0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.43 1arh s ALA 269 Cb -0.01 0.34 0.07 0.00 0.00 0.00 0.00 23.12 23.52 1arh s ALA 269 CO 0.09 -0.46 -0.05 0.00 0.00 0.00 0.00 175.76 175.34 1arh s THR 271 N 1.21 5.37 -0.21 0.00 2.01 0.83 -1.20 115.64 123.66 1arh s THR 271 Ca -0.03 0.18 -0.05 0.00 0.31 0.00 0.00 61.69 62.09 1arh s THR 271 Cb -0.19 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 1arh s THR 271 CO -0.07 0.41 0.01 -0.22 -0.69 0.00 0.00 174.62 174.06 1arh s LEU 272 N 0.60 3.29 -0.08 4.42 1.98 -0.64 0.38 118.68 128.63 1arh s LEU 272 Ca 0.08 -0.20 0.05 0.00 -2.89 0.00 0.00 54.13 51.16 1arh s LEU 272 Cb -0.12 -1.84 -0.01 0.00 0.66 0.00 0.00 46.19 44.88 1arh s LEU 272 CO 0.00 0.05 -0.23 0.68 -1.89 0.00 0.00 176.35 174.96 1arh s VAL 273 N 1.07 2.15 0.28 1.68 -7.23 -0.40 -2.14 120.40 115.81 1arh s VAL 273 Ca 0.02 -1.01 0.05 0.00 -1.81 0.00 0.00 61.98 59.24 1arh s VAL 273 Cb -0.14 -1.81 -0.06 0.00 0.56 0.00 0.00 36.38 34.93 1arh s VAL 273 CO 0.02 0.56 -0.01 0.00 -0.31 0.00 0.00 175.10 175.36 1arh s ALA 274 N 0.12 2.19 0.39 1.32 0.00 -0.87 -2.26 121.76 122.65 1arh s ALA 274 Ca -0.12 -1.91 0.14 0.00 0.00 0.00 0.00 51.96 50.07 1arh s ALA 274 Cb -0.16 0.42 0.98 0.00 0.00 0.00 0.00 23.12 24.35 1arh s ALA 274 CO 0.06 -0.20 1.87 0.00 0.00 0.00 0.00 175.76 177.49 1arh h ALA 275 N 2.28 2.04 -2.88 0.00 0.00 -1.81 -3.45 119.26 115.45 1arh h ALA 275 Ca -0.40 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 1arh h ALA 275 Cb 1.23 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 1arh h ALA 275 CO 0.67 -0.31 -0.04 0.16 0.00 0.00 0.00 179.25 179.73 1arh s ASP 276 N -5.72 0.01 0.25 0.00 1.47 -1.26 -5.03 116.67 106.39 1arh s ASP 276 Ca -0.09 -0.97 -0.05 0.00 1.18 0.00 0.00 52.55 52.63 1arh s ASP 276 Cb 0.22 0.64 0.32 0.00 -0.34 0.00 0.00 42.92 43.76 1arh s ASP 276 CO 0.78 -1.24 1.90 -1.28 0.68 0.00 0.00 175.17 176.01 1arh h SER 277 N 2.18 1.05 0.01 2.11 0.87 -1.76 -1.86 113.55 116.14 1arh h SER 277 Ca -0.26 -0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.21 1arh h SER 277 Cb 1.25 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.96 1arh h SER 277 CO 0.34 0.71 -0.25 -0.08 -0.53 0.00 0.00 176.83 177.03 1arh h GLU 278 N 1.22 0.39 0.07 2.24 4.81 -1.96 -2.17 114.58 119.17 1arh h GLU 278 Ca 0.39 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1arh h GLU 278 Cb 0.02 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1arh h GLU 278 CO -0.13 0.62 -0.03 1.15 -0.73 0.00 0.00 179.01 179.89 1arh h THR 279 N 0.35 1.22 -0.63 0.32 2.02 -1.89 -2.47 112.91 111.83 1arh h THR 279 Ca 0.05 -1.40 0.04 0.00 0.77 0.00 0.00 66.41 65.87 1arh h THR 279 Cb 0.63 2.08 -0.04 0.00 -1.74 0.00 0.00 68.15 69.08 1arh h THR 279 CO 0.05 0.33 0.42 -0.37 0.37 0.00 0.00 175.52 176.31 1arh h VAL 280 N -0.77 1.08 -0.22 3.16 -1.51 -1.36 0.03 116.25 116.66 1arh h VAL 280 Ca -0.01 -0.26 -0.01 0.00 -1.23 0.00 0.00 66.70 65.20 1arh h VAL 280 Cb 0.61 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 30.03 1arh h VAL 280 CO 0.02 0.14 0.10 0.44 -1.23 0.00 0.00 177.57 177.03 1arh h ASP 281 N 0.74 0.29 -0.54 4.19 3.32 -1.41 1.27 116.42 124.30 1arh h ASP 281 Ca 0.25 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1arh h ASP 281 Cb 0.09 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1arh h ASP 281 CO -0.07 0.35 0.29 -0.09 -1.72 0.00 0.00 179.24 178.00 1arh h ARG 282 N 0.21 0.75 -0.14 3.56 2.43 -0.90 -2.54 114.38 117.75 1arh h ARG 282 Ca 0.07 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1arh h ARG 282 Cb 0.14 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1arh h ARG 282 CO -0.01 0.58 -0.04 0.00 -1.51 0.00 0.00 179.97 178.99 1arh h ALA 283 N 1.13 0.20 -0.59 2.80 0.00 -0.84 -3.04 119.26 118.91 1arh h ALA 283 Ca 0.19 -0.24 0.17 0.00 0.00 0.00 0.00 54.91 55.03 1arh h ALA 283 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1arh h ALA 283 CO -0.03 -0.04 0.43 0.35 0.00 0.00 0.00 179.25 179.96 1arh h PHE 284 N -0.03 0.00 -0.40 0.00 3.57 0.18 -1.21 116.94 119.05 1arh h PHE 284 Ca 0.03 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 1arh h PHE 284 Cb 0.48 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 1arh h PHE 284 CO 0.06 0.00 -0.03 0.66 -2.23 0.00 0.00 178.31 176.77 1arh h SER 285 N 0.00 0.62 0.19 0.41 4.64 -1.34 -0.45 113.55 117.63 1arh h SER 285 Ca 0.28 -0.14 -0.22 0.00 -0.47 0.00 0.00 61.79 61.24 1arh h SER 285 Cb 1.13 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1arh h SER 285 CO -0.00 0.71 -0.87 1.56 -0.87 0.00 0.00 176.83 177.36 1arh h GLN 286 N 0.61 0.51 -0.53 4.77 1.08 -1.31 -1.66 115.11 118.58 1arh h GLN 286 Ca 0.12 -0.48 -0.03 0.00 -1.45 0.00 0.00 58.65 56.80 1arh h GLN 286 Cb 0.43 0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.95 1arh h GLN 286 CO 0.02 1.12 0.19 1.98 -0.95 0.00 0.00 178.83 181.19 1arh h MET 287 N 0.32 0.78 -0.16 1.46 4.05 -0.98 -0.82 114.93 119.58 1arh h MET 287 Ca -0.07 -0.13 -0.19 0.00 -0.28 0.00 0.00 59.70 59.03 1arh h MET 287 Cb 1.48 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 32.15 1arh h MET 287 CO 0.16 0.66 -0.68 0.87 0.23 0.00 0.00 176.91 178.15 1arh h LYS 288 N 0.77 0.65 -0.69 0.39 1.57 -0.95 -2.39 116.57 115.92 1arh h LYS 288 Ca 0.18 -0.48 0.01 0.00 -1.87 0.00 0.00 60.65 58.48 1arh h LYS 288 Cb 0.19 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1arh h LYS 288 CO -0.01 1.10 0.46 0.00 -0.57 0.00 0.00 179.45 180.43 1arh h ALA 289 N 0.77 0.88 -0.48 3.86 0.00 -0.69 -0.20 119.26 123.39 1arh h ALA 289 Ca -0.02 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1arh h ALA 289 Cb 1.27 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1arh h ALA 289 CO 0.13 0.30 0.20 0.00 0.00 0.00 0.00 179.25 179.88 1arh h ALA 290 N 1.25 0.60 -0.63 0.00 0.00 -1.00 -2.14 119.26 117.34 1arh h ALA 290 Ca 0.25 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1arh h ALA 290 Cb -0.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1arh h ALA 290 CO -0.05 -0.19 0.28 0.82 0.00 0.00 0.00 179.25 180.11 1arh h ILE 291 N 0.39 1.23 -0.94 0.00 2.04 -0.96 -2.88 117.51 116.38 1arh h ILE 291 Ca 0.23 -0.67 0.09 0.00 1.00 0.00 0.00 64.86 65.50 1arh h ILE 291 Cb 0.20 0.50 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 1arh h ILE 291 CO -0.21 0.27 0.58 -0.09 0.00 0.00 0.00 178.15 178.70 1arh h ARG 292 N 0.87 0.98 -0.03 2.37 9.65 -0.50 -0.75 114.38 126.96 1arh h ARG 292 Ca 0.21 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1arh h ARG 292 Cb 0.16 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1arh h ARG 292 CO -0.02 0.65 0.00 0.00 2.80 0.00 0.00 179.97 183.39 1arh n ALA 293 N -2.36 2.60 -1.38 2.80 0.00 -0.86 -3.57 120.51 117.75 1arh n ALA 293 Ca 0.15 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1arh n ALA 293 Cb 0.25 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1arh n ALA 293 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1arh n ASN 294 N -0.21 0.00 -0.35 0.00 2.85 -0.51 -4.93 115.26 112.11 1arh n ASN 294 Ca 0.20 0.00 0.05 0.00 -0.11 0.00 0.00 54.58 54.72 1arh n ASN 294 Cb 0.26 0.00 0.03 0.00 1.24 0.00 0.00 39.78 41.31 1arh n ASN 294 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1arh n TYR 295 N -0.86 0.00 0.00 1.20 0.18 -0.75 -5.04 117.16 111.89 1arh n TYR 295 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1arh n TYR 295 Cb 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 1arh n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1arh n SER 296 N 0.30 0.00 -3.50 9.48 2.88 -0.41 -4.81 113.62 117.56 1arh n SER 296 Ca 0.05 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.44 1arh n SER 296 Cb 0.24 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.66 1arh n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1arh s ASN 297 N 0.00 -0.57 0.74 -3.46 2.20 -1.26 -4.29 114.94 108.30 1arh s ASN 297 Ca 0.00 0.33 -0.12 0.00 -0.94 0.00 0.00 52.86 52.14 1arh s ASN 297 Cb 0.00 0.55 0.04 0.00 -2.00 0.00 0.00 41.25 39.83 1arh s ASN 297 CO 0.00 -0.76 1.12 -2.16 -2.94 0.00 0.00 177.10 172.37 1arh s PRO 298 N -2.37 2.55 -0.15 3.55 0.04 -1.26 -5.02 135.00 132.34 1arh s PRO 298 Ca -0.06 0.35 -0.29 0.00 0.04 0.00 0.00 61.00 61.04 1arh s PRO 298 Cb -0.01 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 1arh s PRO 298 CO -0.01 -1.23 1.17 -1.25 0.04 0.00 0.00 177.00 175.72 1arh s PRO 299 N -5.43 4.29 0.01 0.56 0.04 -1.26 -4.77 135.00 128.44 1arh s PRO 299 Ca 0.59 1.57 -0.25 0.00 0.04 0.00 0.00 61.00 62.96 1arh s PRO 299 Cb -0.11 -3.67 -0.18 0.00 0.04 0.00 0.00 34.50 30.58 1arh s PRO 299 CO 0.51 -0.59 1.38 0.00 0.04 0.00 0.00 177.00 178.34 1arh h ALA 300 N 7.75 0.02 -0.43 8.56 0.00 -1.95 -3.38 119.26 129.83 1arh h ALA 300 Ca -0.27 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.48 1arh h ALA 300 Cb 1.11 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 1arh h ALA 300 CO 0.94 -0.28 -0.26 1.58 0.00 0.00 0.00 179.25 181.23 1arh n HIS 301 N -4.88 -0.19 0.02 0.00 -0.00 -1.26 -0.58 115.22 108.33 1arh n HIS 301 Ca -0.08 0.54 -0.08 0.00 -0.00 0.00 0.00 57.72 58.10 1arh n HIS 301 Cb 0.21 -0.48 0.08 0.00 -0.00 0.00 0.00 29.99 29.80 1arh n HIS 301 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 1arh h GLY 302 N 0.00 0.52 1.63 1.57 0.00 -1.81 -1.98 103.07 103.00 1arh h GLY 302 Ca 0.07 -0.60 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 1arh h GLY 302 CO -0.41 0.54 -0.39 0.00 0.00 0.00 0.00 176.54 176.28 1arh h ALA 303 N 1.04 0.99 -0.16 3.60 0.00 -1.58 -1.95 119.26 121.20 1arh h ALA 303 Ca 0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1arh h ALA 303 Cb 1.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1arh h ALA 303 CO 0.10 0.61 0.06 1.03 0.00 0.00 0.00 179.25 181.05 1arh h SER 304 N 0.34 0.22 -0.58 0.00 0.87 -0.75 -0.03 113.55 113.62 1arh h SER 304 Ca 0.03 -0.18 0.04 0.00 -1.23 0.00 0.00 61.79 60.46 1arh h SER 304 Cb 0.84 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.71 1arh h SER 304 CO 0.07 0.34 0.38 0.58 -0.53 0.00 0.00 176.83 177.67 1arh h VAL 305 N 0.09 1.05 -0.17 2.23 2.07 -1.19 -1.20 116.25 119.12 1arh h VAL 305 Ca 0.05 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1arh h VAL 305 Cb 0.19 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1arh h VAL 305 CO -0.00 0.12 -0.09 0.58 0.02 0.00 0.00 177.57 178.19 1arh h VAL 306 N 0.63 1.31 -0.41 2.57 2.07 -0.53 -2.06 116.25 119.83 1arh h VAL 306 Ca 0.24 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 1arh h VAL 306 Cb 0.15 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1arh h VAL 306 CO -0.07 0.34 0.24 0.00 0.02 0.00 0.00 177.57 178.11 1arh h ALA 307 N 0.68 0.52 -0.18 1.67 0.00 -0.61 0.51 119.26 121.85 1arh h ALA 307 Ca 0.04 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1arh h ALA 307 Cb 0.57 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1arh h ALA 307 CO 0.03 0.02 -0.09 1.15 0.00 0.00 0.00 179.25 180.36 1arh h THR 308 N 0.54 0.72 -0.40 0.00 2.02 -1.22 0.23 112.91 114.81 1arh h THR 308 Ca 0.15 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.28 1arh h THR 308 Cb 0.01 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 1arh h THR 308 CO -0.03 0.00 0.06 0.40 0.37 0.00 0.00 175.52 176.33 1arh h ILE 309 N -0.06 1.24 0.00 3.11 2.04 -1.12 -1.79 117.51 120.92 1arh h ILE 309 Ca 0.10 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 65.09 1arh h ILE 309 Cb 0.21 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1arh h ILE 309 CO -0.23 0.30 0.00 0.18 0.00 0.00 0.00 178.15 178.40 1arh n LEU 310 N -4.52 0.57 0.00 1.44 4.77 0.15 -2.81 117.00 116.60 1arh n LEU 310 Ca -0.01 0.61 0.07 0.00 -0.03 0.00 0.00 56.01 56.66 1arh n LEU 310 Cb 0.24 -0.50 -0.13 0.00 -2.33 0.00 0.00 43.42 40.69 1arh n LEU 310 CO 0.39 -0.40 -0.64 -1.54 -1.33 0.00 0.00 177.39 173.88 1arh n SER 311 N -2.10 0.22 -4.53 -1.43 3.41 0.04 -4.83 113.62 104.40 1arh n SER 311 Ca 0.03 0.09 -0.41 0.00 -0.26 0.00 0.00 58.87 58.33 1arh n SER 311 Cb 0.27 1.45 -0.10 0.00 -0.26 0.00 0.00 64.21 65.57 1arh n SER 311 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1arh s ASN 312 N -4.89 6.12 0.38 4.04 3.04 -0.70 -4.97 114.94 117.95 1arh s ASN 312 Ca -0.07 -0.35 0.18 0.00 0.04 0.00 0.00 52.86 52.67 1arh s ASN 312 Cb 0.12 -2.17 1.10 0.00 -1.54 0.00 0.00 41.25 38.76 1arh s ASN 312 CO 0.87 -0.29 1.74 0.44 -3.04 0.00 0.00 177.10 176.82 1arh h ASP 313 N 8.48 0.47 0.03 -4.21 5.19 -1.88 0.83 116.42 125.34 1arh h ASP 313 Ca -0.30 0.11 -0.00 0.00 -0.62 0.00 0.00 57.03 56.21 1arh h ASP 313 Cb 1.15 0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.70 1arh h ASP 313 CO 0.67 0.04 -0.01 0.00 -3.12 0.00 0.00 179.24 176.81 1arh h ALA 314 N 1.65 -0.04 -0.17 3.45 0.00 -1.93 -2.72 119.26 119.50 1arh h ALA 314 Ca 0.64 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 1arh h ALA 314 Cb 1.59 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 1arh h ALA 314 CO -0.36 -0.26 0.09 -0.07 0.00 0.00 0.00 179.25 178.64 1arh h LEU 315 N -0.56 0.23 -2.11 0.00 3.38 -1.73 -2.29 115.31 112.22 1arh h LEU 315 Ca -0.00 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.91 1arh h LEU 315 Cb 0.52 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1arh h LEU 315 CO 0.01 0.28 0.18 -0.09 0.09 0.00 0.00 178.44 178.90 1arh h ARG 316 N 0.16 0.00 0.10 1.13 2.43 -0.68 0.92 114.38 118.45 1arh h ARG 316 Ca 0.06 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 58.96 1arh h ARG 316 Cb 0.11 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1arh h ARG 316 CO -0.01 0.00 -1.17 0.00 -1.51 0.00 0.00 179.97 177.28 1arh h ALA 317 N 1.84 0.15 -0.29 2.80 0.00 -1.09 -1.66 119.26 121.02 1arh h ALA 317 Ca 0.10 -0.82 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 1arh h ALA 317 Cb 0.45 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1arh h ALA 317 CO -0.00 0.89 -0.05 0.82 0.00 0.00 0.00 179.25 180.91 1arh h ILE 318 N 0.14 1.27 0.18 0.00 2.04 -0.72 -2.80 117.51 117.62 1arh h ILE 318 Ca -0.13 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 64.70 1arh h ILE 318 Cb 1.87 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 39.29 1arh h ILE 318 CO 0.20 0.33 -0.30 -0.25 0.00 0.00 0.00 178.15 178.14 1arh h TRP 319 N 0.30 -0.80 -0.34 1.37 7.01 -0.84 -0.67 115.95 121.99 1arh h TRP 319 Ca 0.08 0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.19 1arh h TRP 319 Cb 0.51 0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 27.88 1arh h TRP 319 CO 0.05 -0.41 0.26 0.93 -2.79 0.00 0.00 178.44 176.48 1arh h GLU 320 N -0.55 0.00 -0.08 2.65 5.08 -1.32 0.86 114.58 121.21 1arh h GLU 320 Ca 0.02 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.14 1arh h GLU 320 Cb 0.55 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.82 1arh h GLU 320 CO -0.13 0.00 -0.89 0.37 -1.00 0.00 0.00 179.01 177.35 1arh h GLN 321 N 0.00 0.73 -0.55 2.33 5.75 -1.01 -1.65 115.11 120.71 1arh h GLN 321 Ca 0.16 -0.67 -0.03 0.00 -0.15 0.00 0.00 58.65 57.96 1arh h GLN 321 Cb 0.68 0.16 -0.03 0.00 1.07 0.00 0.00 27.48 29.37 1arh h GLN 321 CO -0.00 1.27 0.21 0.93 -2.65 0.00 0.00 178.83 178.58 1arh h GLU 322 N 0.46 0.79 -0.49 1.69 5.08 0.53 -0.91 114.58 121.73 1arh h GLU 322 Ca -0.08 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.09 1arh h GLU 322 Cb 1.53 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 1arh h GLU 322 CO 0.18 0.66 0.04 1.25 -1.00 0.00 0.00 179.01 180.13 1arh h LEU 323 N 0.78 0.81 -1.04 1.33 5.85 -0.87 -1.91 115.31 120.26 1arh h LEU 323 Ca 0.19 -0.29 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 1arh h LEU 323 Cb 0.17 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1arh h LEU 323 CO -0.02 0.90 -0.18 0.74 -0.34 0.00 0.00 178.44 179.55 1arh h THR 324 N 0.70 1.24 -0.30 1.05 2.02 -0.86 -0.93 112.91 115.83 1arh h THR 324 Ca 0.14 -1.11 -0.08 0.00 0.77 0.00 0.00 66.41 66.13 1arh h THR 324 Cb 0.46 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1arh h THR 324 CO 0.02 0.36 -0.13 0.44 0.37 0.00 0.00 175.52 176.58 1arh h ASP 325 N 0.43 0.63 0.40 4.18 3.32 -0.89 0.11 116.42 124.61 1arh h ASP 325 Ca 0.07 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.71 1arh h ASP 325 Cb 0.56 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1arh h ASP 325 CO 0.04 0.89 -0.27 0.24 -1.72 0.00 0.00 179.24 178.42 1arh h MET 326 N 0.37 -0.63 -0.75 3.56 2.86 -1.08 -0.09 114.93 119.18 1arh h MET 326 Ca 0.07 0.04 0.09 0.00 -2.06 0.00 0.00 59.70 57.84 1arh h MET 326 Cb 0.64 0.14 -0.07 0.00 0.06 0.00 0.00 31.60 32.38 1arh h MET 326 CO 0.04 -0.42 0.39 -0.09 1.06 0.00 0.00 176.91 177.89 1arh h ARG 327 N -0.65 0.65 -0.24 1.72 2.43 -1.13 -1.73 114.38 115.43 1arh h ARG 327 Ca -0.04 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 58.96 1arh h ARG 327 Cb 0.55 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1arh h ARG 327 CO 0.03 0.43 -0.38 1.96 -1.51 0.00 0.00 179.97 180.49 1arh h GLN 328 N 0.67 0.54 -0.80 0.20 4.20 -0.68 -2.14 115.11 117.09 1arh h GLN 328 Ca 0.36 -0.26 0.04 0.00 0.06 0.00 0.00 58.65 58.85 1arh h GLN 328 Cb 0.36 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.09 1arh h GLN 328 CO -0.26 0.84 0.50 -0.09 -0.67 0.00 0.00 178.83 179.15 1arh h ARG 329 N 0.45 0.94 0.35 1.46 2.43 -0.15 -1.22 114.38 118.63 1arh h ARG 329 Ca 0.04 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1arh h ARG 329 Cb 0.87 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1arh h ARG 329 CO 0.07 0.62 -0.17 0.82 -1.51 0.00 0.00 179.97 179.81 1arh h ILE 330 N 0.96 0.67 -0.31 1.20 2.04 -1.04 -1.60 117.51 119.43 1arh h ILE 330 Ca 0.33 -0.10 0.09 0.00 1.00 0.00 0.00 64.86 66.18 1arh h ILE 330 Cb 0.06 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1arh h ILE 330 CO -0.13 0.02 0.36 1.56 0.00 0.00 0.00 178.15 179.96 1arh h GLN 331 N -0.52 0.00 -0.02 2.37 4.20 -1.08 0.24 115.11 120.30 1arh h GLN 331 Ca -0.05 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.42 1arh h GLN 331 Cb 0.39 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.19 1arh h GLN 331 CO 0.08 0.00 -0.93 0.00 -0.67 0.00 0.00 178.83 177.30 1arh h ARG 332 N 0.00 0.67 -0.30 1.46 -0.00 -0.42 -3.21 114.38 112.58 1arh h ARG 332 Ca 0.15 -0.69 -0.11 0.00 -0.50 0.00 0.00 59.98 58.83 1arh h ARG 332 Cb 0.87 0.19 -0.01 0.00 0.00 0.00 0.00 29.97 31.02 1arh h ARG 332 CO -0.00 1.28 -0.27 0.52 0.00 0.00 0.00 179.97 181.50 1arh h MET 333 N 0.33 0.60 0.18 0.04 2.86 0.36 -0.73 114.93 118.57 1arh h MET 333 Ca -0.11 -0.25 -0.00 0.00 -2.06 0.00 0.00 59.70 57.28 1arh h MET 333 Cb 1.59 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 33.23 1arh h MET 333 CO 0.18 0.81 -0.11 0.00 1.06 0.00 0.00 176.91 178.85 1arh h ARG 334 N 0.52 -0.28 -0.40 1.72 3.08 -1.37 0.35 114.38 118.01 1arh h ARG 334 Ca 0.07 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1arh h ARG 334 Cb 0.74 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1arh h ARG 334 CO 0.06 -0.18 0.26 0.37 -1.07 0.00 0.00 179.97 179.40 1arh h GLN 335 N -0.29 0.53 -0.49 0.04 5.75 -1.55 -0.34 115.11 118.77 1arh h GLN 335 Ca -0.02 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1arh h GLN 335 Cb 0.24 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 1arh h GLN 335 CO 0.02 0.37 0.19 1.25 -2.65 0.00 0.00 178.83 178.00 1arh h LEU 336 N 0.53 0.63 0.33 -2.39 5.85 -0.87 -1.12 115.31 118.28 1arh h LEU 336 Ca 0.14 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1arh h LEU 336 Cb -0.04 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.83 1arh h LEU 336 CO -0.03 0.58 -0.16 0.15 -0.34 0.00 0.00 178.44 178.64 1arh h PHE 337 N 0.69 -0.41 -0.12 1.25 3.57 0.63 -1.19 116.94 121.37 1arh h PHE 337 Ca 0.17 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1arh h PHE 337 Cb 0.14 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1arh h PHE 337 CO 0.01 -0.09 -0.03 -0.39 -2.23 0.00 0.00 178.31 175.58 1arh h VAL 338 N -0.73 1.10 0.04 1.41 -1.51 -1.00 0.56 116.25 116.12 1arh h VAL 338 Ca -0.04 -0.41 -0.00 0.00 -1.23 0.00 0.00 66.70 65.01 1arh h VAL 338 Cb 0.50 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.70 1arh h VAL 338 CO 0.07 0.13 -0.02 0.78 -1.23 0.00 0.00 177.57 177.31 1arh h ASN 339 N 0.17 -0.04 0.33 4.19 4.21 -1.05 -1.30 115.58 122.10 1arh h ASN 339 Ca 0.04 -0.20 -0.08 0.00 1.21 0.00 0.00 56.30 57.27 1arh h ASN 339 Cb 0.17 0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.37 1arh h ASN 339 CO 0.01 0.18 -0.35 0.74 -1.29 0.00 0.00 177.43 176.71 1arh h THR 340 N -0.26 1.26 0.20 2.81 2.02 -0.92 -0.48 112.91 117.52 1arh h THR 340 Ca -0.01 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 65.93 1arh h THR 340 Cb 0.24 1.65 -0.00 0.00 -1.74 0.00 0.00 68.15 68.30 1arh h THR 340 CO 0.01 0.36 -0.11 -0.07 0.37 0.00 0.00 175.52 176.08 1arh h LEU 341 N 0.03 -0.26 0.59 2.58 4.07 -0.63 -1.11 115.31 120.59 1arh h LEU 341 Ca 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 1arh h LEU 341 Cb 0.64 0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 1arh h LEU 341 CO 0.05 -0.18 -0.40 1.56 -1.08 0.00 0.00 178.44 178.39 1arh h GLN 342 N -0.28 -0.90 0.00 1.13 4.20 -0.69 -1.82 115.11 116.74 1arh h GLN 342 Ca -0.02 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1arh h GLN 342 Cb 0.23 0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1arh h GLN 342 CO 0.03 -0.60 0.02 0.39 -0.67 0.00 0.00 178.83 178.00 1arh n GLU 343 N -4.90 0.00 -0.18 1.46 -0.58 -0.24 -1.64 120.64 114.55 1arh n GLU 343 Ca -0.11 0.20 0.09 0.00 -0.42 0.00 0.00 57.16 56.92 1arh n GLU 343 Cb 0.40 -1.52 0.18 0.00 -0.57 0.00 0.00 31.44 29.93 1arh n GLU 343 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1arh n LYS 344 N -1.18 2.32 0.00 3.49 3.00 -0.42 -4.97 118.16 120.40 1arh n LYS 344 Ca 0.00 -2.09 0.00 0.00 -0.00 0.00 0.00 58.31 56.22 1arh n LYS 344 Cb 0.02 -1.40 0.00 0.00 0.00 0.00 0.00 35.03 33.65 1arh n LYS 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1arh n GLY 345 N 1.08 2.54 3.53 3.14 0.00 -0.65 -4.99 105.19 109.83 1arh n GLY 345 Ca 0.16 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.61 1arh n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1arh n ALA 346 N -0.66 -2.80 -2.72 4.61 0.00 -1.18 -4.87 120.51 112.88 1arh n ALA 346 Ca 0.00 0.57 -0.22 0.00 0.00 0.00 0.00 53.44 53.79 1arh n ALA 346 Cb 0.00 -1.86 -0.01 0.00 0.00 0.00 0.00 19.45 17.58 1arh n ALA 346 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1arh n ASN 347 N 1.83 3.43 -3.89 0.00 3.02 -1.26 -4.78 115.26 113.60 1arh n ASN 347 Ca 0.19 -3.40 -0.11 0.00 -0.03 0.00 0.00 54.58 51.23 1arh n ASN 347 Cb 0.12 -0.52 -0.13 0.00 -0.61 0.00 0.00 39.78 38.64 1arh n ASN 347 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1arh s ARG 348 N -3.29 0.10 -0.15 3.52 3.52 -1.26 -5.13 118.95 116.26 1arh s ARG 348 Ca 0.43 -0.15 -0.25 0.00 -0.13 0.00 0.00 55.73 55.63 1arh s ARG 348 Cb 0.38 0.04 -0.02 0.00 -1.56 0.00 0.00 34.95 33.79 1arh s ARG 348 CO -0.11 -0.02 0.80 0.34 -0.81 0.00 0.00 175.30 175.50 1arh s ASP 349 N -0.40 6.95 -0.22 -2.12 -1.08 -1.26 -4.92 116.67 113.62 1arh s ASP 349 Ca -0.04 1.16 0.15 0.00 -0.52 0.00 0.00 52.55 53.30 1arh s ASP 349 Cb -0.03 -2.44 0.63 0.00 -1.46 0.00 0.00 42.92 39.62 1arh s ASP 349 CO -0.00 -0.34 1.55 0.49 0.52 0.00 0.00 175.17 177.39 1arh n PHE 350 N 4.93 1.42 0.22 -5.34 3.72 -1.26 -4.64 117.46 116.51 1arh n PHE 350 Ca 0.03 -0.94 0.09 0.00 -0.05 0.00 0.00 57.45 56.58 1arh n PHE 350 Cb 0.49 -0.42 0.48 0.00 -0.94 0.00 0.00 39.48 39.09 1arh n PHE 350 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1arh h SER 351 N 2.37 0.00 -0.12 4.37 4.64 -1.93 -2.75 113.55 120.13 1arh h SER 351 Ca 0.05 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.40 1arh h SER 351 Cb 1.71 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.79 1arh h SER 351 CO 0.37 0.25 0.15 2.19 -0.87 0.00 0.00 176.83 178.92 1arh h PHE 352 N 0.00 0.00 -0.40 4.77 -5.15 -1.95 -1.92 116.94 112.29 1arh h PHE 352 Ca -0.00 0.00 0.06 0.00 -0.20 0.00 0.00 57.97 57.82 1arh h PHE 352 Cb 0.69 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.81 1arh h PHE 352 CO 0.00 0.00 0.11 0.82 -2.00 0.00 0.00 178.31 177.24 1arh h ILE 353 N 0.00 0.83 -1.04 0.88 2.04 -1.87 -1.95 117.51 116.41 1arh h ILE 353 Ca 0.06 -0.09 0.27 0.00 1.00 0.00 0.00 64.86 66.10 1arh h ILE 353 Cb 0.35 0.56 -0.11 0.00 -0.74 0.00 0.00 36.82 36.88 1arh h ILE 353 CO -0.00 0.05 0.66 0.40 0.00 0.00 0.00 178.15 179.25 1arh h ILE 354 N 0.26 0.50 0.00 -0.67 1.08 -1.54 0.33 117.51 117.47 1arh h ILE 354 Ca 0.19 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 1arh h ILE 354 Cb 0.20 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 33.99 1arh h ILE 354 CO -0.22 0.08 0.00 0.29 -0.69 0.00 0.00 178.15 177.61 1arh n LYS 355 N -4.71 0.92 -3.26 2.37 4.01 -0.73 -4.86 118.16 111.90 1arh n LYS 355 Ca 0.27 0.00 -0.27 0.00 -0.51 0.00 0.00 58.31 57.79 1arh n LYS 355 Cb 0.87 -1.28 -0.02 0.00 -0.51 0.00 0.00 35.03 34.09 1arh n LYS 355 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1arh s GLN 356 N -2.00 3.58 0.04 1.97 -0.21 0.12 -4.96 119.66 118.20 1arh s GLN 356 Ca 0.25 -0.06 0.08 0.00 0.02 0.00 0.00 55.36 55.65 1arh s GLN 356 Cb 0.11 -2.61 -0.03 0.00 1.00 0.00 0.00 33.01 31.48 1arh s GLN 356 CO 0.19 0.14 -0.23 -0.80 -2.12 0.00 0.00 175.29 172.47 1arh s ASN 357 N -3.51 2.75 0.00 5.90 0.02 0.29 -5.04 114.94 115.35 1arh s ASN 357 Ca 0.43 -0.54 0.00 0.00 -1.02 0.00 0.00 52.86 51.73 1arh s ASN 357 Cb -0.10 -0.24 0.00 0.00 0.02 0.00 0.00 41.25 40.92 1arh s ASN 357 CO 0.33 0.21 0.00 0.61 0.02 0.00 0.00 177.10 178.27 1arh n GLY 358 N 1.88 -1.80 0.07 0.66 0.00 -1.24 -4.48 105.19 100.27 1arh n GLY 358 Ca -0.17 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 1arh n GLY 358 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1arh h MET 359 N 0.00 0.05 -6.17 1.61 2.86 -1.91 -3.46 114.93 107.90 1arh h MET 359 Ca 0.00 -0.09 -0.57 0.00 -2.06 0.00 0.00 59.70 56.98 1arh h MET 359 Cb 0.00 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 1arh h MET 359 CO 0.00 1.00 -0.02 -0.06 1.06 0.00 0.00 176.91 178.89 1arh s PHE 360 N -2.69 3.76 -0.04 -0.22 0.08 -1.26 0.16 117.98 117.76 1arh s PHE 360 Ca -0.00 1.25 0.01 0.00 0.12 0.00 0.00 56.93 58.30 1arh s PHE 360 Cb 0.09 -2.55 0.02 0.00 -0.57 0.00 0.00 43.02 40.02 1arh s PHE 360 CO 0.83 0.49 -0.04 0.45 -0.10 0.00 0.00 175.22 176.85 1arh s SER 361 N -0.71 0.92 -0.72 1.36 0.15 0.21 -3.63 113.70 111.27 1arh s SER 361 Ca 0.30 -0.11 -0.21 0.00 0.70 0.00 0.00 55.95 56.63 1arh s SER 361 Cb -0.19 -0.42 0.09 0.00 -1.71 0.00 0.00 66.02 63.80 1arh s SER 361 CO 0.18 -0.07 0.96 0.12 1.20 0.00 0.00 173.24 175.63 1arh s PHE 362 N 1.00 2.87 0.46 3.44 5.36 -1.15 -0.84 117.98 129.11 1arh s PHE 362 Ca -0.10 -0.87 0.13 0.00 -0.96 0.00 0.00 56.93 55.13 1arh s PHE 362 Cb -0.14 -4.23 1.07 0.00 -0.34 0.00 0.00 43.02 39.37 1arh s PHE 362 CO -0.01 -1.53 2.07 0.66 -1.46 0.00 0.00 175.22 174.95 1arh h SER 363 N 9.28 0.26 0.00 6.13 4.64 -1.93 -3.47 113.55 128.46 1arh h SER 363 Ca -0.17 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1arh h SER 363 Cb 1.06 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1arh h SER 363 CO 1.14 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 177.89 1arh n GLY 364 N -1.52 2.41 3.30 -0.77 0.00 -1.26 -5.07 105.19 102.28 1arh n GLY 364 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1arh n GLY 364 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1arh n LEU 365 N 0.00 -1.95 -4.80 0.99 4.32 -1.26 -5.01 117.00 109.29 1arh n LEU 365 Ca 0.00 0.52 -0.29 0.00 -0.02 0.00 0.00 56.01 56.22 1arh n LEU 365 Cb 0.00 -1.01 -0.06 0.00 -1.62 0.00 0.00 43.42 40.73 1arh n LEU 365 CO 0.00 -4.23 -0.24 -0.89 -1.22 0.00 0.00 177.39 170.82 1arh s THR 366 N -1.97 4.63 0.40 -5.08 2.01 -1.26 -4.87 115.64 109.50 1arh s THR 366 Ca 0.58 -0.80 0.25 0.00 0.31 0.00 0.00 61.69 62.03 1arh s THR 366 Cb -0.36 -3.27 0.42 0.00 0.01 0.00 0.00 72.50 69.30 1arh s THR 366 CO 0.66 0.07 1.60 0.50 -0.69 0.00 0.00 174.62 176.76 1arh h LYS 367 N 3.04 0.06 0.04 4.92 3.64 -1.95 0.55 116.57 126.87 1arh h LYS 367 Ca -0.47 -0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.68 1arh h LYS 367 Cb 1.17 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1arh h LYS 367 CO 0.66 0.04 -0.93 0.93 -2.27 0.00 0.00 179.45 177.89 1arh h GLU 368 N 0.07 0.56 -0.77 1.90 3.07 -1.99 -2.85 114.58 114.57 1arh h GLU 368 Ca 0.84 -0.66 0.10 0.00 -0.50 0.00 0.00 59.36 59.14 1arh h GLU 368 Cb 2.40 0.20 -0.07 0.00 -0.84 0.00 0.00 28.75 30.44 1arh h GLU 368 CO -0.59 1.26 0.41 1.96 -1.40 0.00 0.00 179.01 180.66 1arh h GLN 369 N 0.15 0.66 0.15 2.33 4.20 -0.33 0.14 115.11 122.42 1arh h GLN 369 Ca -0.13 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 1arh h GLN 369 Cb 1.62 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 29.24 1arh h GLN 369 CO 0.18 0.44 -0.09 0.28 -0.67 0.00 0.00 178.83 178.97 1arh h VAL 370 N 0.68 0.80 -0.19 -0.54 2.07 -1.22 0.35 116.25 118.22 1arh h VAL 370 Ca 0.38 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.95 1arh h VAL 370 Cb 0.40 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1arh h VAL 370 CO -0.27 0.00 -0.10 0.25 0.02 0.00 0.00 177.57 177.47 1arh h LEU 371 N -0.24 -0.33 -0.01 2.57 5.85 -1.03 -1.98 115.31 120.14 1arh h LEU 371 Ca -0.01 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.82 1arh h LEU 371 Cb 0.20 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1arh h LEU 371 CO 0.01 -0.13 -0.24 -0.09 -0.34 0.00 0.00 178.44 177.65 1arh h ARG 372 N -0.09 -0.36 -0.80 1.25 1.12 -0.43 0.16 114.38 115.24 1arh h ARG 372 Ca 0.10 0.02 0.19 0.00 -1.11 0.00 0.00 59.98 59.19 1arh h ARG 372 Cb 0.24 0.08 -0.13 0.00 -0.01 0.00 0.00 29.97 30.15 1arh h ARG 372 CO -0.24 -0.24 0.13 -0.07 -3.11 0.00 0.00 179.97 176.44 1arh h LEU 373 N -0.37 -0.13 0.00 3.80 3.38 0.27 -0.95 115.31 121.31 1arh h LEU 373 Ca 0.07 0.18 -0.17 0.00 0.09 0.00 0.00 57.88 58.05 1arh h LEU 373 Cb 0.46 0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1arh h LEU 373 CO -0.23 -0.13 -0.92 0.08 0.09 0.00 0.00 178.44 177.33 1arh h ARG 374 N 0.18 0.00 -0.00 1.13 0.11 -0.90 -1.05 114.38 113.85 1arh h ARG 374 Ca 0.46 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.54 1arh h ARG 374 Cb 0.86 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.94 1arh h ARG 374 CO -0.62 0.66 -0.02 0.93 0.10 0.00 0.00 179.97 181.02 1arh h GLU 375 N 0.00 0.01 0.04 0.08 4.39 0.56 -2.67 114.58 117.00 1arh h GLU 375 Ca -0.05 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.48 1arh h GLU 375 Cb 1.61 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.25 1arh h GLU 375 CO 0.09 0.73 -0.79 0.93 -1.16 0.00 0.00 179.01 178.81 1arh h GLU 376 N -0.70 0.07 0.00 2.33 4.39 -1.44 -3.41 114.58 115.82 1arh h GLU 376 Ca -0.00 -0.13 -0.25 0.00 0.34 0.00 0.00 59.36 59.33 1arh h GLU 376 Cb 0.74 0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.40 1arh h GLU 376 CO 0.00 1.06 -1.42 0.74 -1.16 0.00 0.00 179.01 178.23 1arh h PHE 377 N -0.80 0.00 0.00 4.33 0.04 -1.42 -3.49 116.94 115.60 1arh h PHE 377 Ca -0.19 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.58 1arh h PHE 377 Cb 1.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.46 1arh h PHE 377 CO 0.18 0.93 0.00 0.41 -0.60 0.00 0.00 178.31 179.22 1arh n GLY 378 N 1.46 0.79 3.59 -1.45 0.00 -0.47 -4.82 105.19 104.30 1arh n GLY 378 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1arh n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1arh s VAL 379 N -2.78 4.97 -0.48 1.61 1.01 -0.95 -2.79 120.40 120.99 1arh s VAL 379 Ca 0.00 0.77 -0.14 0.00 0.00 0.00 0.00 61.98 62.61 1arh s VAL 379 Cb 0.00 -3.97 0.09 0.00 0.00 0.00 0.00 36.38 32.51 1arh s VAL 379 CO 0.00 -0.12 0.40 -0.31 0.00 0.00 0.00 175.10 175.08 1arh s TYR 380 N 2.53 3.27 0.63 5.22 1.51 -1.23 -2.38 117.35 126.90 1arh s TYR 380 Ca 0.23 -1.17 0.05 0.00 -1.01 0.00 0.00 57.07 55.18 1arh s TYR 380 Cb -0.15 -3.34 0.12 0.00 -0.11 0.00 0.00 41.96 38.47 1arh s TYR 380 CO 0.12 -0.88 0.87 0.00 -1.11 0.00 0.00 175.55 174.55 1arh n ALA 381 N 5.16 0.79 -1.91 3.71 0.00 -1.26 -0.67 120.51 126.33 1arh n ALA 381 Ca -0.12 -2.02 -0.36 0.00 0.00 0.00 0.00 53.44 50.94 1arh n ALA 381 Cb 0.42 0.46 -0.06 0.00 0.00 0.00 0.00 19.45 20.27 1arh n ALA 381 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1arh s VAL 382 N -2.76 4.36 0.27 0.00 1.01 -0.32 -4.63 120.40 118.33 1arh s VAL 382 Ca 0.62 1.60 -0.03 0.00 0.00 0.00 0.00 61.98 64.17 1arh s VAL 382 Cb -0.04 -3.93 0.34 0.00 0.00 0.00 0.00 36.38 32.74 1arh s VAL 382 CO 0.40 0.14 1.61 0.00 0.00 0.00 0.00 175.10 177.26 1arh h ALA 383 N 3.20 0.94 0.00 5.51 0.00 -1.88 0.89 119.26 127.93 1arh h ALA 383 Ca -0.47 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1arh h ALA 383 Cb 1.19 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1arh h ALA 383 CO 0.65 -0.47 0.04 0.66 0.00 0.00 0.00 179.25 180.13 1arh h SER 384 N 0.07 0.00 0.00 0.00 4.64 -1.94 -3.45 113.55 112.87 1arh h SER 384 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1arh h SER 384 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1arh h SER 384 CO -0.78 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 175.79 1arh n GLY 385 N -1.21 0.47 3.87 -0.77 0.00 0.31 -5.01 105.19 102.86 1arh n GLY 385 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1arh n GLY 385 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1arh s ALA 386 N -2.00 3.33 0.09 4.61 0.00 -1.25 -3.92 121.76 122.62 1arh s ALA 386 Ca 0.00 -0.18 0.10 0.00 0.00 0.00 0.00 51.96 51.88 1arh s ALA 386 Cb 0.00 -2.73 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 1arh s ALA 386 CO 0.00 -0.03 -0.26 0.14 0.00 0.00 0.00 175.76 175.61 1arh s VAL 387 N -2.40 2.16 -0.56 0.00 -7.23 -0.02 -1.17 120.40 111.18 1arh s VAL 387 Ca 0.52 -1.56 -0.20 0.00 -1.81 0.00 0.00 61.98 58.93 1arh s VAL 387 Cb -0.10 -1.88 0.08 0.00 0.56 0.00 0.00 36.38 35.03 1arh s VAL 387 CO 0.32 0.21 0.72 0.21 -0.31 0.00 0.00 175.10 176.25 1arh s ASN 388 N -1.65 6.21 0.56 4.85 2.47 -0.29 -0.62 114.94 126.47 1arh s ASN 388 Ca 0.12 -1.08 0.26 0.00 0.42 0.00 0.00 52.86 52.59 1arh s ASN 388 Cb -0.10 -2.32 1.51 0.00 -1.45 0.00 0.00 41.25 38.89 1arh s ASN 388 CO 0.04 -1.07 2.05 0.58 -3.72 0.00 0.00 177.10 174.98 1arh h VAL 389 N 5.91 0.60 0.00 -5.21 2.07 0.11 -1.52 116.25 118.21 1arh h VAL 389 Ca -0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1arh h VAL 389 Cb 1.09 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1arh h VAL 389 CO 1.05 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.64 1arh n ALA 390 N -2.46 1.72 1.09 1.67 0.00 -1.25 -1.92 120.51 119.37 1arh n ALA 390 Ca 0.05 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.55 1arh n ALA 390 Cb 0.43 -1.24 0.16 0.00 0.00 0.00 0.00 19.45 18.80 1arh n ALA 390 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1arh n GLY 391 N 0.02 0.51 3.83 0.00 0.00 -0.57 -3.17 105.19 105.81 1arh n GLY 391 Ca 0.04 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.08 1arh n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1arh s MET 392 N -2.15 4.09 0.03 1.61 -1.94 -0.81 -4.84 119.30 115.30 1arh s MET 392 Ca 0.27 0.65 -0.04 0.00 -1.71 0.00 0.00 55.69 54.87 1arh s MET 392 Cb 0.20 -2.90 -0.01 0.00 2.01 0.00 0.00 34.83 34.12 1arh s MET 392 CO 0.39 0.44 0.05 0.95 -0.01 0.00 0.00 175.02 176.84 1arh s THR 393 N -1.50 0.12 0.57 2.05 -4.23 -1.26 -4.90 115.64 106.49 1arh s THR 393 Ca 0.40 -1.01 0.30 0.00 -1.18 0.00 0.00 61.69 60.21 1arh s THR 393 Cb -0.16 -0.64 0.43 0.00 1.34 0.00 0.00 72.50 73.47 1arh s THR 393 CO 0.20 -0.55 1.86 -0.65 -0.54 0.00 0.00 174.62 174.93 1arh h PRO 394 N 4.07 0.00 0.01 3.99 0.11 -1.98 0.92 132.00 139.12 1arh h PRO 394 Ca -0.32 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.68 1arh h PRO 394 Cb 1.19 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.31 1arh h PRO 394 CO 0.46 0.00 -0.41 -0.44 -0.21 0.00 0.00 178.00 177.40 1arh h ASP 395 N 0.00 0.35 0.53 -2.05 5.19 -1.95 -3.34 116.42 115.15 1arh h ASP 395 Ca 0.32 -0.79 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 1arh h ASP 395 Cb 1.52 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.92 1arh h ASP 395 CO -0.00 1.09 -0.23 -0.46 -3.12 0.00 0.00 179.24 176.52 1arh n ASN 396 N -4.37 0.45 -0.04 6.45 0.23 0.03 -4.39 115.26 113.61 1arh n ASN 396 Ca -0.10 -0.27 -0.08 0.00 -0.53 0.00 0.00 54.58 53.59 1arh n ASN 396 Cb 0.59 -0.04 -0.03 0.00 -2.08 0.00 0.00 39.78 38.22 1arh n ASN 396 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1arh h MET 397 N 0.34 0.02 0.26 -3.83 4.05 -1.05 -2.30 114.93 112.41 1arh h MET 397 Ca 0.00 -0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1arh h MET 397 Cb 0.45 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.23 1arh h MET 397 CO 0.00 0.01 -0.35 0.00 0.23 0.00 0.00 176.91 176.80 1arh h ALA 398 N 1.19 -0.97 -0.86 0.39 0.00 -1.82 0.28 119.26 117.47 1arh h ALA 398 Ca 0.10 -0.11 0.16 0.00 0.00 0.00 0.00 54.91 55.05 1arh h ALA 398 Cb 0.14 0.64 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 1arh h ALA 398 CO -0.20 -1.02 0.44 -1.35 0.00 0.00 0.00 179.25 177.12 1arh h PRO 399 N -0.63 0.58 -0.38 0.00 0.11 -1.86 0.27 132.00 130.09 1arh h PRO 399 Ca -0.03 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.94 1arh h PRO 399 Cb 0.57 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1arh h PRO 399 CO -0.09 0.38 -0.18 1.25 -0.21 0.00 0.00 178.00 179.15 1arh h LEU 400 N 0.59 0.70 -0.36 2.35 5.85 -1.11 -2.65 115.31 120.69 1arh h LEU 400 Ca 0.48 -0.23 -0.18 0.00 0.84 0.00 0.00 57.88 58.79 1arh h LEU 400 Cb 0.72 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1arh h LEU 400 CO -0.39 0.88 -0.83 0.00 -0.34 0.00 0.00 178.44 177.77 1arh h GLU 402 N 0.05 -0.36 -0.64 0.00 4.39 -0.43 -2.51 114.58 115.08 1arh h GLU 402 Ca -0.02 0.02 0.12 0.00 0.34 0.00 0.00 59.36 59.82 1arh h GLU 402 Cb 1.44 0.08 -0.09 0.00 -0.10 0.00 0.00 28.75 30.09 1arh h GLU 402 CO 0.12 -0.13 0.19 0.00 -1.16 0.00 0.00 179.01 178.03 1arh h ALA 403 N 0.12 0.81 -0.59 3.43 0.00 -1.49 0.15 119.26 121.69 1arh h ALA 403 Ca -0.04 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1arh h ALA 403 Cb 0.40 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1arh h ALA 403 CO 0.06 -0.26 0.08 -0.84 0.00 0.00 0.00 179.25 178.30 1arh h ILE 404 N 0.34 1.25 -0.33 0.00 -0.00 -1.39 -2.65 117.51 114.72 1arh h ILE 404 Ca 0.34 -0.98 -0.01 0.00 -0.00 0.00 0.00 64.86 64.21 1arh h ILE 404 Cb 0.49 0.71 -0.02 0.00 -0.00 0.00 0.00 36.82 38.01 1arh h ILE 404 CO -0.38 0.36 0.17 0.58 -0.00 0.00 0.00 178.15 178.87 1arh h VAL 405 N 0.90 1.15 0.00 0.16 2.07 -0.86 -1.70 116.25 117.96 1arh h VAL 405 Ca 0.18 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1arh h VAL 405 Cb 0.41 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1arh h VAL 405 CO 0.01 0.16 0.08 0.00 0.02 0.00 0.00 177.57 177.84 1arh n ALA 407 N -2.25 0.88 -0.18 1.67 0.00 -0.05 -1.31 120.51 119.28 1arh n ALA 407 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1arh n ALA 407 Cb 0.10 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1arh n ALA 407 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1arh n VAL 408 N -1.19 0.19 1.30 0.00 0.24 -0.65 -5.07 118.33 113.15 1arh n VAL 408 Ca 0.00 -0.50 0.10 0.00 -2.04 0.00 0.00 64.34 61.90 1arh n VAL 408 Cb 0.08 1.05 0.62 0.00 -1.47 0.00 0.00 33.84 34.11 1arh n VAL 408 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87