#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1via s LEU 3 N 0.00 4.17 0.60 1.04 1.02 -1.26 -4.27 118.68 119.98 1via s LEU 3 Ca 0.00 0.35 -0.17 0.00 0.02 0.00 0.00 54.13 54.34 1via s LEU 3 Cb 0.00 -2.11 -0.03 0.00 0.02 0.00 0.00 46.19 44.07 1via s LEU 3 CO 0.00 0.37 1.11 0.00 0.02 0.00 0.00 176.35 177.85 1via s ALA 4 N -1.05 2.59 -1.47 4.21 0.00 -0.67 -4.87 121.76 120.50 1via s ALA 4 Ca 0.17 0.64 -0.13 0.00 0.00 0.00 0.00 51.96 52.63 1via s ALA 4 Cb -0.12 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.71 1via s ALA 4 CO 0.07 -1.01 2.31 1.17 0.00 0.00 0.00 175.76 178.29 1via n LYS 5 N -1.92 3.01 -4.29 0.00 4.81 -1.26 -3.94 118.16 114.57 1via n LYS 5 Ca 0.11 -2.60 -0.15 0.00 -0.87 0.00 0.00 58.31 54.79 1via n LYS 5 Cb 0.52 -3.20 -0.10 0.00 0.02 0.00 0.00 35.03 32.26 1via n LYS 5 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1via s ASN 6 N 2.93 1.62 -0.16 3.14 0.01 -1.26 -1.04 114.94 120.18 1via s ASN 6 Ca 0.50 -1.17 -0.04 0.00 -0.71 0.00 0.00 52.86 51.43 1via s ASN 6 Cb 0.14 0.04 -0.03 0.00 0.41 0.00 0.00 41.25 41.82 1via s ASN 6 CO -0.08 -0.50 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.34 1via s ILE 7 N -3.48 3.90 -0.15 0.60 1.01 -0.29 -0.83 121.20 121.95 1via s ILE 7 Ca 0.25 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.56 1via s ILE 7 Cb 0.05 -2.71 0.02 0.00 0.01 0.00 0.00 42.46 39.83 1via s ILE 7 CO 0.06 0.49 -0.18 -0.69 0.00 0.00 0.00 174.94 174.62 1via s VAL 8 N 0.44 1.82 -0.18 2.92 1.01 0.15 -0.21 120.40 126.36 1via s VAL 8 Ca -0.03 -0.81 -0.15 0.00 0.00 0.00 0.00 61.98 60.99 1via s VAL 8 Cb -0.14 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1via s VAL 8 CO 0.03 0.50 0.34 -0.36 0.00 0.00 0.00 175.10 175.61 1via s PHE 9 N 1.21 3.43 0.19 5.22 0.40 0.11 -0.20 117.98 128.33 1via s PHE 9 Ca 0.01 0.61 0.08 0.00 -0.60 0.00 0.00 56.93 57.03 1via s PHE 9 Cb -0.14 -2.43 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 1via s PHE 9 CO -0.08 0.13 -0.15 0.96 0.70 0.00 0.00 175.22 176.77 1via s ILE 10 N 0.83 1.70 0.00 0.64 -4.36 0.01 -2.63 121.20 117.40 1via s ILE 10 Ca 0.18 -2.11 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 1via s ILE 10 Cb -0.14 -1.96 0.00 0.00 1.25 0.00 0.00 42.46 41.62 1via s ILE 10 CO 0.06 -0.53 0.00 0.61 0.24 0.00 0.00 174.94 175.32 1via n GLY 11 N -0.17 0.72 0.00 6.27 0.00 -1.26 -1.11 105.19 109.64 1via n GLY 11 Ca -0.10 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1via n GLY 11 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1via n PHE 12 N -1.50 0.00 -0.11 1.61 7.35 -1.26 -4.08 117.46 119.48 1via n PHE 12 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1via n PHE 12 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1via n PHE 12 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1via n GLY 14 N 3.41 0.00 0.14 7.13 0.00 -1.26 -4.70 105.19 109.91 1via n GLY 14 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 1via n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1via n SER 15 N 0.00 0.46 0.00 1.61 3.41 -1.26 -4.88 113.62 112.97 1via n SER 15 Ca 0.00 -1.05 0.00 0.00 -0.26 0.00 0.00 58.87 57.56 1via n SER 15 Cb 0.00 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 1via n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1via n GLY 16 N 1.09 0.42 0.17 5.00 0.00 -1.26 -4.95 105.19 105.67 1via n GLY 16 Ca 0.21 -0.90 -0.10 0.00 0.00 0.00 0.00 46.02 45.24 1via n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1via h LYS 17 N 0.00 0.52 -0.36 1.61 1.57 -1.90 -1.07 116.57 116.93 1via h LYS 17 Ca 0.00 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1via h LYS 17 Cb 0.78 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1via h LYS 17 CO 0.00 0.56 0.12 0.77 -0.57 0.00 0.00 179.45 180.33 1via h SER 18 N 0.38 0.51 -0.16 0.86 0.02 -1.93 -0.23 113.55 113.00 1via h SER 18 Ca 0.11 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1via h SER 18 Cb 0.26 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1via h SER 18 CO -0.00 0.56 0.09 0.74 -1.14 0.00 0.00 176.83 177.09 1via h THR 19 N 0.43 1.02 -0.26 -2.27 2.02 -1.95 -1.11 112.91 110.79 1via h THR 19 Ca 0.12 -0.07 -0.18 0.00 0.77 0.00 0.00 66.41 67.05 1via h THR 19 Cb 0.23 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1via h THR 19 CO -0.01 0.04 -0.55 0.25 0.37 0.00 0.00 175.52 175.62 1via h LEU 20 N 0.20 0.90 -0.67 2.58 5.85 -1.13 -0.98 115.31 122.05 1via h LEU 20 Ca 0.06 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 1via h LEU 20 Cb -0.01 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 1via h LEU 20 CO -0.03 1.26 0.37 0.00 -0.34 0.00 0.00 178.44 179.71 1via h ALA 21 N 0.75 0.86 -0.35 1.25 0.00 -0.97 0.03 119.26 120.82 1via h ALA 21 Ca 0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1via h ALA 21 Cb 1.15 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1via h ALA 21 CO 0.12 0.37 0.06 -0.09 0.00 0.00 0.00 179.25 179.71 1via h ARG 22 N 0.92 0.58 -0.75 0.00 2.43 -1.10 -0.54 114.38 115.93 1via h ARG 22 Ca 0.24 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1via h ARG 22 Cb 0.04 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1via h ARG 22 CO -0.04 0.65 0.30 0.00 -1.51 0.00 0.00 179.97 179.38 1via h ALA 23 N 0.91 0.97 -0.45 2.80 0.00 -0.80 -1.11 119.26 121.58 1via h ALA 23 Ca 0.11 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1via h ALA 23 Cb 0.35 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1via h ALA 23 CO 0.01 0.59 -0.22 1.25 0.00 0.00 0.00 179.25 180.87 1via h LEU 24 N 1.07 0.93 -0.23 0.00 5.85 -0.89 -0.30 115.31 121.75 1via h LEU 24 Ca 0.25 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1via h LEU 24 Cb 0.20 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1via h LEU 24 CO -0.02 1.11 0.15 0.00 -0.34 0.00 0.00 178.44 179.34 1via h ALA 25 N 0.95 0.29 -0.50 1.25 0.00 -0.70 0.13 119.26 120.69 1via h ALA 25 Ca 0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1via h ALA 25 Cb 0.78 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1via h ALA 25 CO 0.06 -0.22 0.22 -0.22 0.00 0.00 0.00 179.25 179.09 1via h LYS 26 N 0.30 0.73 -0.81 0.00 3.64 -1.13 0.20 116.57 119.49 1via h LYS 26 Ca 0.08 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1via h LYS 26 Cb -0.01 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.65 1via h LYS 26 CO -0.02 0.63 0.46 0.22 -2.27 0.00 0.00 179.45 178.47 1via h ASP 27 N 0.66 1.00 -0.06 4.20 3.58 -0.74 -2.76 116.42 122.30 1via h ASP 27 Ca 0.17 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.53 1via h ASP 27 Cb 0.16 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 40.95 1via h ASP 27 CO -0.02 0.80 0.00 0.18 -2.88 0.00 0.00 179.24 177.32 1via n LEU 28 N -4.43 2.85 -3.46 2.28 4.77 0.01 -4.97 117.00 114.05 1via n LEU 28 Ca 0.08 -0.98 -0.18 0.00 -0.03 0.00 0.00 56.01 54.91 1via n LEU 28 Cb 0.08 -0.02 0.09 0.00 -2.33 0.00 0.00 43.42 41.24 1via n LEU 28 CO 0.38 0.49 0.12 -0.67 -1.33 0.00 0.00 177.39 176.37 1via n ASP 29 N 1.22 -2.41 -4.80 -1.43 2.03 0.48 -5.03 116.55 106.61 1via n ASP 29 Ca 0.15 -0.62 -0.23 0.00 0.52 0.00 0.00 54.79 54.61 1via n ASP 29 Cb 0.57 -5.07 -0.05 0.00 -0.72 0.00 0.00 41.12 35.85 1via n ASP 29 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1via s LEU 30 N -6.46 3.28 0.22 -2.67 1.43 0.17 -5.02 118.68 109.63 1via s LEU 30 Ca 0.06 -0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 52.00 1via s LEU 30 Cb -0.02 -1.77 -0.09 0.00 0.03 0.00 0.00 46.19 44.34 1via s LEU 30 CO 0.73 -0.53 0.92 -0.69 0.23 0.00 0.00 176.35 177.01 1via s VAL 31 N -2.50 4.14 -0.30 -1.59 1.01 -0.96 -4.55 120.40 115.64 1via s VAL 31 Ca 0.43 2.03 -0.11 0.00 0.00 0.00 0.00 61.98 64.33 1via s VAL 31 Cb -0.01 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 1via s VAL 31 CO 0.25 0.50 0.18 0.12 0.00 0.00 0.00 175.10 176.14 1via s PHE 32 N -1.12 3.19 0.02 5.22 5.36 -1.26 -0.14 117.98 129.25 1via s PHE 32 Ca 0.40 -0.23 0.06 0.00 -0.96 0.00 0.00 56.93 56.21 1via s PHE 32 Cb -0.25 -2.38 -0.03 0.00 -0.34 0.00 0.00 43.02 40.01 1via s PHE 32 CO 0.31 -0.32 -0.16 -0.51 -1.46 0.00 0.00 175.22 173.07 1via s LEU 33 N 1.69 2.67 -0.14 6.12 1.43 -0.34 -4.97 118.68 125.14 1via s LEU 33 Ca 0.06 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1via s LEU 33 Cb -0.17 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.54 1via s LEU 33 CO 0.09 0.27 -0.01 -0.62 0.23 0.00 0.00 176.35 176.31 1via s ASP 34 N -1.30 2.37 0.22 2.29 -1.08 -1.26 -0.60 116.67 117.31 1via s ASP 34 Ca 0.14 -0.48 -0.08 0.00 -0.52 0.00 0.00 52.55 51.61 1via s ASP 34 Cb -0.11 -0.66 0.26 0.00 -1.46 0.00 0.00 42.92 40.95 1via s ASP 34 CO 0.05 -0.22 1.82 0.77 0.52 0.00 0.00 175.17 178.12 1via h SER 35 N 8.23 0.65 -0.11 -0.34 4.64 -1.53 -0.76 113.55 124.33 1via h SER 35 Ca -0.21 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1via h SER 35 Cb 1.12 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.10 1via h SER 35 CO 0.34 0.42 0.07 0.44 -0.87 0.00 0.00 176.83 177.22 1via h ASP 36 N 0.78 0.13 -0.83 4.97 3.32 -1.94 -0.78 116.42 122.07 1via h ASP 36 Ca 0.32 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.33 1via h ASP 36 Cb 0.16 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 1via h ASP 36 CO -0.17 0.12 0.52 0.15 -1.72 0.00 0.00 179.24 178.14 1via h PHE 37 N 0.12 1.08 -0.37 4.55 3.57 -1.80 -0.14 116.94 123.95 1via h PHE 37 Ca 0.04 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.44 1via h PHE 37 Cb 0.02 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 1via h PHE 37 CO -0.06 0.71 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.45 1via h LEU 38 N 1.15 0.72 -0.26 0.59 3.38 -0.93 0.52 115.31 120.47 1via h LEU 38 Ca 0.30 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1via h LEU 38 Cb -0.07 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 1via h LEU 38 CO -0.06 0.92 -0.24 0.40 0.09 0.00 0.00 178.44 179.56 1via h ILE 39 N 0.63 1.31 -0.58 1.22 2.04 -0.78 -1.29 117.51 120.07 1via h ILE 39 Ca 0.09 -1.39 0.05 0.00 1.00 0.00 0.00 64.86 64.61 1via h ILE 39 Cb 0.70 1.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.35 1via h ILE 39 CO 0.05 0.44 0.30 -0.33 0.00 0.00 0.00 178.15 178.61 1via h GLU 40 N 0.34 0.54 -0.59 2.37 5.08 -0.75 -2.21 114.58 119.37 1via h GLU 40 Ca 0.04 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1via h GLU 40 Cb 0.79 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1via h GLU 40 CO 0.06 0.36 0.16 1.96 -1.00 0.00 0.00 179.01 180.55 1via h GLN 41 N 0.56 0.94 -0.74 2.33 1.08 -0.65 0.18 115.11 118.81 1via h GLN 41 Ca 0.26 -0.22 -0.02 0.00 -1.45 0.00 0.00 58.65 57.22 1via h GLN 41 Cb 0.17 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.44 1via h GLN 41 CO -0.18 0.85 0.38 -0.22 -0.95 0.00 0.00 178.83 178.72 1via h LYS 42 N 0.85 1.04 -0.02 1.46 3.64 -0.88 -3.11 116.57 119.56 1via h LYS 42 Ca 0.19 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1via h LYS 42 Cb 0.33 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1via h LYS 42 CO -0.00 0.78 -0.45 1.19 -2.27 0.00 0.00 179.45 178.71 1via n PHE 43 N -4.34 0.00 -3.75 1.91 3.72 -0.86 -4.99 117.46 109.15 1via n PHE 43 Ca 0.07 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.23 1via n PHE 43 Cb 0.12 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.70 1via n PHE 43 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1via n ASN 44 N 0.07 -3.19 -3.68 4.37 5.15 0.61 -4.98 115.26 113.62 1via n ASN 44 Ca 0.09 -0.76 -0.14 0.00 -0.60 0.00 0.00 54.58 53.18 1via n ASN 44 Cb 0.48 -4.19 -0.07 0.00 -0.53 0.00 0.00 39.78 35.47 1via n ASN 44 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1via s GLN 45 N -6.21 0.85 0.52 1.20 -0.21 -1.09 -5.07 119.66 109.65 1via s GLN 45 Ca 0.32 -0.21 -0.19 0.00 0.02 0.00 0.00 55.36 55.30 1via s GLN 45 Cb -0.15 0.38 -0.07 0.00 1.00 0.00 0.00 33.01 34.17 1via s GLN 45 CO 0.80 -0.27 1.04 0.15 -2.12 0.00 0.00 175.29 174.89 1via s LYS 46 N -1.88 3.69 0.27 2.91 -0.14 -1.26 -4.32 119.74 119.00 1via s LYS 46 Ca -0.09 1.29 -0.01 0.00 -1.36 0.00 0.00 55.97 55.80 1via s LYS 46 Cb -0.02 -2.08 0.59 0.00 -1.68 0.00 0.00 37.83 34.63 1via s LYS 46 CO 0.02 -0.52 1.70 0.28 -0.76 0.00 0.00 175.35 176.07 1via h VAL 47 N 1.22 0.51 -0.98 3.17 2.07 -1.96 -0.86 116.25 119.42 1via h VAL 47 Ca -0.49 -0.12 0.06 0.00 0.82 0.00 0.00 66.70 66.97 1via h VAL 47 Cb 1.22 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 1via h VAL 47 CO 0.59 0.06 0.64 0.77 0.02 0.00 0.00 177.57 179.65 1via h SER 48 N 0.36 1.03 -0.31 0.57 4.64 -1.99 -0.09 113.55 117.76 1via h SER 48 Ca 0.48 0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.64 1via h SER 48 Cb 0.86 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1via h SER 48 CO -0.51 0.67 -0.45 -0.33 -0.87 0.00 0.00 176.83 175.34 1via h GLU 49 N 1.17 0.85 -0.44 4.77 5.08 -1.58 -0.99 114.58 123.44 1via h GLU 49 Ca 0.42 -0.50 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1via h GLU 49 Cb 0.12 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1via h GLU 49 CO -0.16 1.14 0.22 0.82 -1.00 0.00 0.00 179.01 180.03 1via h ILE 50 N 0.63 1.17 -0.45 3.13 2.04 -0.56 -0.85 117.51 122.62 1via h ILE 50 Ca 0.03 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1via h ILE 50 Cb 1.05 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1via h ILE 50 CO 0.10 0.19 0.28 -0.26 0.00 0.00 0.00 178.15 178.46 1via h PHE 51 N 0.57 0.58 -0.51 1.37 0.04 -0.99 0.11 116.94 118.11 1via h PHE 51 Ca 0.15 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.93 1via h PHE 51 Cb 0.10 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 1via h PHE 51 CO -0.01 0.39 0.32 1.49 -0.60 0.00 0.00 178.31 179.89 1via h GLU 52 N 0.60 0.68 0.13 1.51 4.57 -0.87 -0.75 114.58 120.45 1via h GLU 52 Ca 0.16 -0.05 -0.31 0.00 -1.18 0.00 0.00 59.36 57.98 1via h GLU 52 Cb -0.03 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.41 1via h GLU 52 CO -0.03 0.47 -1.61 1.96 -1.18 0.00 0.00 179.01 178.63 1via h GLN 53 N 0.68 0.28 0.00 1.92 4.20 -1.05 -3.39 115.11 117.76 1via h GLN 53 Ca 0.18 -0.48 0.00 0.00 0.06 0.00 0.00 58.65 58.42 1via h GLN 53 Cb -0.04 0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1via h GLN 53 CO -0.04 1.23 -1.32 1.63 -0.67 0.00 0.00 178.83 179.66 1via n LYS 54 N -3.78 0.28 -0.24 1.46 4.76 0.36 -5.10 118.16 115.91 1via n LYS 54 Ca -0.27 -0.07 0.03 0.00 -2.87 0.00 0.00 58.31 55.14 1via n LYS 54 Cb 0.96 -1.53 -0.01 0.00 -1.84 0.00 0.00 35.03 32.62 1via n LYS 54 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1via n ARG 55 N -1.85 -0.51 -0.15 1.97 5.12 -0.29 -4.29 116.66 116.67 1via n ARG 55 Ca 0.01 0.39 -0.06 0.00 -1.93 0.00 0.00 57.85 56.25 1via n ARG 55 Cb 0.43 -0.61 0.03 0.00 -1.16 0.00 0.00 32.46 31.14 1via n ARG 55 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 1via h GLU 56 N -0.23 0.50 -0.90 5.56 4.81 -1.91 -2.84 114.58 119.57 1via h GLU 56 Ca -0.01 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1via h GLU 56 Cb 0.22 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.43 1via h GLU 56 CO 0.01 0.33 0.58 -0.91 -0.73 0.00 0.00 179.01 178.29 1via h ASN 57 N 0.52 0.95 -0.56 1.04 2.35 -1.98 0.60 115.58 118.49 1via h ASN 57 Ca 0.18 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1via h ASN 57 Cb 0.03 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1via h ASN 57 CO -0.09 0.63 0.23 0.15 -1.65 0.00 0.00 177.43 176.70 1via h PHE 58 N 1.10 0.85 -0.41 1.19 3.04 -1.71 -0.86 116.94 120.15 1via h PHE 58 Ca 0.37 -0.06 -0.02 0.00 3.98 0.00 0.00 57.97 62.24 1via h PHE 58 Cb 0.07 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.30 1via h PHE 58 CO -0.02 0.69 0.16 0.35 -2.02 0.00 0.00 178.31 177.47 1via h PHE 59 N 0.77 0.63 -0.38 0.41 3.57 -1.08 -1.81 116.94 119.04 1via h PHE 59 Ca 0.19 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1via h PHE 59 Cb 0.19 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1via h PHE 59 CO 0.01 0.55 0.18 0.00 -2.23 0.00 0.00 178.31 176.82 1via h ARG 60 N 0.52 0.53 -0.75 1.11 2.47 -0.59 -0.20 114.38 117.47 1via h ARG 60 Ca 0.14 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.77 1via h ARG 60 Cb 0.19 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.37 1via h ARG 60 CO -0.01 0.42 0.35 0.93 0.56 0.00 0.00 179.97 182.22 1via h GLU 61 N 0.53 1.09 -0.30 0.04 5.08 -0.73 -0.46 114.58 119.83 1via h GLU 61 Ca 0.14 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1via h GLU 61 Cb 0.07 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1via h GLU 61 CO -0.02 0.86 -0.21 1.96 -1.00 0.00 0.00 179.01 180.60 1via h GLN 62 N 1.06 0.57 -0.23 2.33 1.08 -0.53 -1.70 115.11 117.69 1via h GLN 62 Ca 0.26 -0.21 -0.08 0.00 -1.45 0.00 0.00 58.65 57.17 1via h GLN 62 Cb 0.13 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 1via h GLN 62 CO -0.03 0.75 -0.20 0.93 -0.95 0.00 0.00 178.83 179.33 1via h GLU 63 N 0.51 0.41 -0.46 1.46 5.08 -0.59 -2.37 114.58 118.62 1via h GLU 63 Ca 0.08 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 1via h GLU 63 Cb 0.65 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1via h GLU 63 CO 0.05 0.60 -0.14 0.37 -1.00 0.00 0.00 179.01 178.88 1via h GLN 64 N 0.37 0.86 -1.63 2.33 5.75 -0.60 0.72 115.11 122.91 1via h GLN 64 Ca 0.06 -0.31 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 1via h GLN 64 Cb 0.57 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.06 1via h GLN 64 CO 0.04 0.94 0.00 1.63 -2.65 0.00 0.00 178.83 178.79 1via n LYS 65 N -4.14 0.22 0.00 1.69 5.02 -0.69 -1.04 118.16 119.23 1via n LYS 65 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1via n LYS 65 Cb 0.40 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 1via n LYS 65 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1via n ALA 67 N 0.84 0.00 -0.15 7.82 0.00 0.24 -1.26 120.51 128.01 1via n ALA 67 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1via n ALA 67 Cb 0.11 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.59 1via n ALA 67 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1via h ASP 68 N 0.00 0.35 -0.80 0.00 3.32 -1.35 -1.72 116.42 116.22 1via h ASP 68 Ca 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1via h ASP 68 Cb 0.00 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 1via h ASP 68 CO 0.00 0.25 0.45 0.15 -1.72 0.00 0.00 179.24 178.37 1via h PHE 69 N 0.47 1.10 -0.06 4.55 3.57 -1.44 -2.64 116.94 122.49 1via h PHE 69 Ca 0.20 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 1via h PHE 69 Cb 0.09 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 1via h PHE 69 CO -0.10 0.75 -0.35 0.74 -2.23 0.00 0.00 178.31 177.12 1via h PHE 70 N 1.13 0.12 0.00 0.41 0.04 -1.75 -1.10 116.94 115.79 1via h PHE 70 Ca 0.29 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.03 1via h PHE 70 Cb 0.01 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.13 1via h PHE 70 CO 0.01 0.45 0.00 0.66 -0.60 0.00 0.00 178.31 178.83 1via h SER 71 N 0.10 0.00 0.26 2.17 4.64 -0.95 -2.68 113.55 117.09 1via h SER 71 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1via h SER 71 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1via h SER 71 CO 0.05 0.00 -0.80 -1.54 -0.87 0.00 0.00 176.83 173.67 1via n SER 72 N -2.70 0.74 -4.85 4.97 3.41 -0.43 -4.64 113.62 110.12 1via n SER 72 Ca 0.01 -0.59 -0.29 0.00 -0.26 0.00 0.00 58.87 57.75 1via n SER 72 Cb 0.25 0.67 -0.03 0.00 -0.26 0.00 0.00 64.21 64.84 1via n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1via s GLU 74 N -4.13 0.75 -1.23 0.00 -1.05 -1.26 -4.25 118.70 107.52 1via s GLU 74 Ca 0.23 -0.96 -0.07 0.00 -0.15 0.00 0.00 54.97 54.02 1via s GLU 74 Cb -0.01 0.30 0.01 0.00 -0.44 0.00 0.00 34.13 33.98 1via s GLU 74 CO 0.14 -0.21 1.07 1.63 0.95 0.00 0.00 175.26 178.84 1via n LYS 75 N 0.14 -7.18 -4.40 -4.83 5.02 -0.21 -4.95 118.16 101.76 1via n LYS 75 Ca -0.16 0.77 -0.27 0.00 -2.02 0.00 0.00 58.31 56.63 1via n LYS 75 Cb 0.61 -5.64 -0.12 0.00 -0.02 0.00 0.00 35.03 29.87 1via n LYS 75 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1via s ALA 76 N -3.30 2.54 -0.24 7.82 0.00 -1.26 -2.27 121.76 125.04 1via s ALA 76 Ca 0.44 -1.58 -0.04 0.00 0.00 0.00 0.00 51.96 50.78 1via s ALA 76 Cb -0.19 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.54 1via s ALA 76 CO 0.68 0.46 -0.02 0.00 0.00 0.00 0.00 175.76 176.88 1via s ILE 78 N 1.46 2.18 -0.06 0.00 1.01 0.71 -1.20 121.20 125.30 1via s ILE 78 Ca 0.04 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.69 1via s ILE 78 Cb -0.15 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 1via s ILE 78 CO -0.02 0.55 0.09 0.00 0.00 0.00 0.00 174.94 175.56 1via s ALA 79 N 0.45 3.63 0.13 9.38 0.00 0.23 0.04 121.76 135.63 1via s ALA 79 Ca -0.15 -0.77 0.07 0.00 0.00 0.00 0.00 51.96 51.10 1via s ALA 79 Cb -0.17 -1.70 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 1via s ALA 79 CO 0.06 0.64 -0.15 0.95 0.00 0.00 0.00 175.76 177.26 1via s THR 80 N -1.07 1.48 0.92 0.00 -4.23 -1.08 -1.20 115.64 110.46 1via s THR 80 Ca 0.18 -1.78 -0.12 0.00 -1.18 0.00 0.00 61.69 58.79 1via s THR 80 Cb -0.12 -1.63 0.15 0.00 1.34 0.00 0.00 72.50 72.24 1via s THR 80 CO 0.08 -0.39 1.11 -0.83 -0.54 0.00 0.00 174.62 174.05 1via s GLY 81 N -2.52 1.59 0.40 3.99 0.00 -1.26 -4.77 107.32 104.74 1via s GLY 81 Ca 0.11 -0.34 0.08 0.00 0.00 0.00 0.00 44.72 44.57 1via s GLY 81 CO 0.04 0.21 2.02 -1.33 0.00 0.00 0.00 173.10 174.04 1via h GLY 82 N -1.59 0.67 -0.73 0.20 0.00 -1.89 -1.34 103.07 98.38 1via h GLY 82 Ca -0.51 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1via h GLY 82 CO 0.59 0.20 0.00 0.61 0.00 0.00 0.00 176.54 177.93 1via n GLY 83 N -1.48 0.20 0.27 4.60 0.00 -1.26 -4.20 105.19 103.32 1via n GLY 83 Ca 0.06 -0.39 0.15 0.00 0.00 0.00 0.00 46.02 45.84 1via n GLY 83 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1via h PHE 84 N 2.03 0.00 0.00 1.61 3.04 -1.59 -1.72 116.94 120.31 1via h PHE 84 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1via h PHE 84 Cb 0.45 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.96 1via h PHE 84 CO 0.10 0.09 0.00 -0.24 -2.02 0.00 0.00 178.31 176.24 1via h VAL 85 N 0.00 0.00 0.00 1.41 3.04 -1.78 -1.44 116.25 117.48 1via h VAL 85 Ca -0.00 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 1via h VAL 85 Cb 0.48 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 30.54 1via h VAL 85 CO 0.01 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.16 1via n ASN 86 N -2.68 0.00 -4.75 3.17 5.03 -0.65 -4.85 115.26 110.53 1via n ASN 86 Ca -0.02 0.14 -0.31 0.00 0.87 0.00 0.00 54.58 55.27 1via n ASN 86 Cb 0.07 -0.36 0.11 0.00 -1.02 0.00 0.00 39.78 38.57 1via n ASN 86 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 1via s VAL 87 N -2.73 3.11 0.25 2.41 -7.23 -0.54 -5.03 120.40 110.64 1via s VAL 87 Ca 0.19 0.36 -0.12 0.00 -1.81 0.00 0.00 61.98 60.60 1via s VAL 87 Cb 0.16 -2.84 -0.08 0.00 0.56 0.00 0.00 36.38 34.18 1via s VAL 87 CO 0.40 -0.47 0.62 -0.44 -0.31 0.00 0.00 175.10 174.90 1via s SER 88 N -3.40 6.72 -1.42 4.85 0.01 -1.26 -4.26 113.70 114.94 1via s SER 88 Ca 0.62 1.08 -0.10 0.00 1.31 0.00 0.00 55.95 58.86 1via s SER 88 Cb -0.17 -2.29 0.04 0.00 0.21 0.00 0.00 66.02 63.80 1via s SER 88 CO 0.56 -0.09 1.08 0.59 0.41 0.00 0.00 173.24 175.79 1via n ASN 89 N -0.08 -5.36 -0.13 2.44 3.02 -1.26 -4.87 115.26 109.03 1via n ASN 89 Ca 0.01 -0.65 0.04 0.00 -0.03 0.00 0.00 54.58 53.95 1via n ASN 89 Cb 0.53 -4.56 0.34 0.00 -0.61 0.00 0.00 39.78 35.48 1via n ASN 89 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1via h LEU 90 N -2.40 0.66 -2.02 3.41 5.85 -1.93 -1.91 115.31 116.96 1via h LEU 90 Ca -0.58 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.22 1via h LEU 90 Cb 1.37 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1via h LEU 90 CO 0.60 0.46 0.22 1.05 -0.34 0.00 0.00 178.44 180.44 1via h GLU 91 N 0.77 0.00 0.00 1.25 9.09 -1.89 -1.16 114.58 122.64 1via h GLU 91 Ca 0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.65 1via h GLU 91 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.13 1via h GLU 91 CO -0.06 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.63 1via n LYS 92 N -4.38 0.19 0.23 1.06 5.02 -0.72 -2.97 118.16 116.59 1via n LYS 92 Ca 0.04 0.40 0.12 0.00 -2.02 0.00 0.00 58.31 56.85 1via n LYS 92 Cb 0.39 -1.85 0.33 0.00 -0.02 0.00 0.00 35.03 33.89 1via n LYS 92 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1via h ALA 93 N 2.29 0.96 0.00 7.82 0.00 -1.35 -1.78 119.26 127.21 1via h ALA 93 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1via h ALA 93 Cb 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1via h ALA 93 CO 0.00 0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.78 1via n GLY 94 N 0.69 -0.11 3.61 0.00 0.00 -1.16 -4.40 105.19 103.82 1via n GLY 94 Ca 0.02 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 1via n GLY 94 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1via s PHE 95 N -2.21 2.26 -0.19 1.61 5.36 -0.01 -4.80 117.98 120.00 1via s PHE 95 Ca 0.00 0.67 -0.21 0.00 -0.96 0.00 0.00 56.93 56.43 1via s PHE 95 Cb 0.00 -4.16 -0.02 0.00 -0.34 0.00 0.00 43.02 38.49 1via s PHE 95 CO 0.00 -2.31 0.64 0.00 -1.46 0.00 0.00 175.22 172.09 1via s ILE 97 N 1.89 3.89 -0.36 0.00 1.01 0.72 -0.14 121.20 128.21 1via s ILE 97 Ca 0.29 -0.46 -0.20 0.00 0.00 0.00 0.00 60.65 60.28 1via s ILE 97 Cb -0.16 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.44 1via s ILE 97 CO 0.10 0.27 0.61 -0.47 0.00 0.00 0.00 174.94 175.46 1via s TYR 98 N 1.53 3.15 -0.64 3.97 5.04 -0.33 -0.81 117.35 129.26 1via s TYR 98 Ca 0.05 0.26 -0.25 0.00 -2.44 0.00 0.00 57.07 54.69 1via s TYR 98 Cb -0.16 -3.11 0.05 0.00 0.35 0.00 0.00 41.96 39.09 1via s TYR 98 CO 0.01 -0.64 1.06 -0.51 -1.34 0.00 0.00 175.55 174.13 1via s LEU 99 N 2.65 3.92 -0.14 6.97 1.43 -0.27 -0.81 118.68 132.42 1via s LEU 99 Ca 0.23 -0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 52.65 1via s LEU 99 Cb -0.15 -2.63 -0.05 0.00 0.03 0.00 0.00 46.19 43.40 1via s LEU 99 CO 0.15 -1.49 0.18 -0.75 0.23 0.00 0.00 176.35 174.67 1via s LYS 100 N 4.53 3.83 0.09 1.70 2.20 0.14 -4.53 119.74 127.69 1via s LYS 100 Ca 0.29 -0.09 -0.24 0.00 -0.36 0.00 0.00 55.97 55.57 1via s LYS 100 Cb -0.13 -3.30 0.06 0.00 -1.51 0.00 0.00 37.83 32.96 1via s LYS 100 CO 0.15 0.54 0.58 0.00 -0.36 0.00 0.00 175.35 176.27 1via s ALA 101 N -0.38 -1.53 0.61 3.13 0.00 -1.26 -1.20 121.76 121.14 1via s ALA 101 Ca 0.14 0.65 -0.18 0.00 0.00 0.00 0.00 51.96 52.56 1via s ALA 101 Cb -0.12 0.57 -0.03 0.00 0.00 0.00 0.00 23.12 23.54 1via s ALA 101 CO 0.03 -0.62 1.21 -0.51 0.00 0.00 0.00 175.76 175.87 1via s ASP 102 N -2.25 5.05 0.35 0.00 1.01 -1.26 -4.86 116.67 114.71 1via s ASP 102 Ca -0.03 2.40 0.05 0.00 0.71 0.00 0.00 52.55 55.68 1via s ASP 102 Cb -0.00 -2.60 0.69 0.00 1.01 0.00 0.00 42.92 42.02 1via s ASP 102 CO -0.05 -1.69 1.94 0.15 0.21 0.00 0.00 175.17 175.73 1via h PHE 103 N 0.74 0.84 0.00 4.23 3.57 -2.00 0.01 116.94 124.33 1via h PHE 103 Ca -0.50 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 60.98 1via h PHE 103 Cb 1.30 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 1via h PHE 103 CO 0.46 0.43 -0.21 0.93 -2.23 0.00 0.00 178.31 177.69 1via h GLU 104 N 0.82 0.00 0.17 1.11 3.07 -2.00 -0.37 114.58 117.39 1via h GLU 104 Ca 0.34 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.97 1via h GLU 104 Cb 0.28 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.21 1via h GLU 104 CO -0.12 0.21 -1.00 -0.92 -1.40 0.00 0.00 179.01 175.78 1via h TYR 105 N 0.00 0.68 -0.34 4.33 3.20 -1.41 -3.35 116.97 120.08 1via h TYR 105 Ca -0.00 -0.49 -0.10 0.00 3.14 0.00 0.00 58.73 61.28 1via h TYR 105 Cb 0.57 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 1via h TYR 105 CO 0.00 1.38 -0.19 -0.07 -1.64 0.00 0.00 178.16 177.64 1via h LEU 106 N -0.22 0.63 -1.94 2.82 3.38 -0.77 -2.87 115.31 116.34 1via h LEU 106 Ca -0.17 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1via h LEU 106 Cb 1.79 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 42.37 1via h LEU 106 CO 0.19 0.83 -0.09 0.07 0.09 0.00 0.00 178.44 179.53 1via h LYS 107 N 0.57 0.00 -0.01 1.13 2.10 -1.21 -1.28 116.57 117.87 1via h LYS 107 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 1via h LYS 107 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1via h LYS 107 CO 0.05 0.09 0.00 1.63 -2.00 0.00 0.00 179.45 179.22 1via n LYS 108 N -3.46 1.18 -0.09 0.07 5.02 -1.08 -3.91 118.16 115.88 1via n LYS 108 Ca -0.01 -0.26 -0.17 0.00 -2.02 0.00 0.00 58.31 55.84 1via n LYS 108 Cb 0.24 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.73 1via n LYS 108 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1via n ARG 109 N -0.65 0.46 -3.64 1.97 1.74 -0.50 -5.14 116.66 110.90 1via n ARG 109 Ca 0.21 0.19 -0.06 0.00 -0.77 0.00 0.00 57.85 57.43 1via n ARG 109 Cb 0.17 -1.29 -0.07 0.00 -1.02 0.00 0.00 32.46 30.26 1via n ARG 109 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1via s LEU 110 N -7.45 -0.93 0.00 0.55 1.43 -1.12 -5.12 118.68 106.03 1via s LEU 110 Ca -0.28 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 1via s LEU 110 Cb 0.08 2.31 0.00 0.00 0.03 0.00 0.00 46.19 48.61 1via s LEU 110 CO 0.38 -0.22 0.00 -1.22 0.23 0.00 0.00 176.35 175.51 1via n TYR 122 N 4.42 0.00 -3.36 0.29 0.53 -1.26 -4.66 117.16 113.12 1via n TYR 122 Ca -0.19 0.00 -0.45 0.00 -1.02 0.00 0.00 57.90 56.24 1via n TYR 122 Cb 0.57 0.00 -0.05 0.00 -1.03 0.00 0.00 39.34 38.84 1via n TYR 122 CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 1via s ASP 123 N 1.68 6.30 0.51 7.72 -1.08 -1.26 -4.93 116.67 125.61 1via s ASP 123 Ca 0.00 -2.16 0.16 0.00 -0.52 0.00 0.00 52.55 50.04 1via s ASP 123 Cb 0.00 -2.18 1.25 0.00 -1.46 0.00 0.00 42.92 40.53 1via s ASP 123 CO 0.00 -0.72 2.12 -0.33 0.52 0.00 0.00 175.17 176.75 1via h GLU 124 N 8.39 0.05 -0.20 4.34 5.08 -2.04 0.43 114.58 130.62 1via h GLU 124 Ca -0.14 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1via h GLU 124 Cb 1.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1via h GLU 124 CO 0.91 0.03 -0.02 0.82 -1.00 0.00 0.00 179.01 179.75 1via h ILE 125 N 0.05 1.27 -0.31 3.13 2.04 -2.00 -1.42 117.51 120.28 1via h ILE 125 Ca 0.05 -0.95 -0.15 0.00 1.00 0.00 0.00 64.86 64.81 1via h ILE 125 Cb 0.14 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1via h ILE 125 CO -0.00 0.29 -0.42 0.11 0.00 0.00 0.00 178.15 178.13 1via h LYS 126 N 0.11 0.77 -0.57 2.37 1.79 -1.80 -2.55 116.57 116.70 1via h LYS 126 Ca 0.05 -0.41 -0.02 0.00 -2.18 0.00 0.00 60.65 58.09 1via h LYS 126 Cb 0.45 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.09 1via h LYS 126 CO 0.02 1.04 0.28 0.00 -1.08 0.00 0.00 179.45 179.71 1via h ALA 127 N 0.90 0.73 -0.49 3.86 0.00 -0.90 -1.50 119.26 121.86 1via h ALA 127 Ca 0.05 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1via h ALA 127 Cb 0.97 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1via h ALA 127 CO 0.09 0.28 -0.01 -0.22 0.00 0.00 0.00 179.25 179.40 1via h LYS 128 N 0.77 0.82 -0.74 0.00 3.64 -1.18 0.12 116.57 120.00 1via h LYS 128 Ca 0.20 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1via h LYS 128 Cb 0.10 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1via h LYS 128 CO -0.03 0.83 0.42 -0.22 -2.27 0.00 0.00 179.45 178.19 1via h LYS 129 N 0.76 1.02 -0.40 1.90 3.64 -1.08 0.86 116.57 123.27 1via h LYS 129 Ca 0.15 -0.11 -0.15 0.00 -1.27 0.00 0.00 60.65 59.27 1via h LYS 129 Cb 0.47 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1via h LYS 129 CO 0.02 0.74 -0.33 1.25 -2.27 0.00 0.00 179.45 178.86 1via h LEU 130 N 1.01 0.96 -0.04 5.20 5.85 -0.76 -2.23 115.31 125.31 1via h LEU 130 Ca 0.26 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1via h LEU 130 Cb 0.00 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1via h LEU 130 CO -0.05 1.20 -0.03 0.22 -0.34 0.00 0.00 178.44 179.44 1via h TYR 131 N 0.76 -0.08 -0.94 1.25 5.03 -0.39 -1.78 116.97 120.82 1via h TYR 131 Ca 0.07 0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.45 1via h TYR 131 Cb 0.91 0.04 -0.06 0.00 1.55 0.00 0.00 36.73 39.17 1via h TYR 131 CO 0.06 -0.06 0.61 -0.91 -1.32 0.00 0.00 178.16 176.54 1via h ASN 132 N -0.04 0.95 0.58 -2.11 2.35 -0.73 -1.77 115.58 114.81 1via h ASN 132 Ca 0.03 0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.70 1via h ASN 132 Cb 0.08 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1via h ASN 132 CO -0.06 0.61 -0.40 -0.33 -1.65 0.00 0.00 177.43 175.60 1via h GLU 133 N 1.08 0.00 0.00 0.81 5.08 -0.94 -3.24 114.58 117.37 1via h GLU 133 Ca 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1via h GLU 133 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1via h GLU 133 CO -0.15 0.40 -1.08 0.54 -1.00 0.00 0.00 179.01 177.71 1via n ARG 134 N -3.80 0.60 -0.21 2.33 1.74 -0.71 -4.45 116.66 112.16 1via n ARG 134 Ca -0.01 0.10 -0.01 0.00 -0.77 0.00 0.00 57.85 57.15 1via n ARG 134 Cb 0.47 -1.80 0.06 0.00 -1.02 0.00 0.00 32.46 30.16 1via n ARG 134 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1via h LEU 135 N 0.00 -0.67 -1.61 0.55 3.38 -1.44 -0.60 115.31 114.92 1via h LEU 135 Ca 0.00 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1via h LEU 135 Cb 0.99 0.42 -0.02 0.00 0.09 0.00 0.00 40.66 42.15 1via h LEU 135 CO 0.00 -0.23 0.23 0.77 0.09 0.00 0.00 178.44 179.31 1via h SER 136 N -0.03 0.43 -0.05 -0.43 4.64 -1.80 -0.86 113.55 115.46 1via h SER 136 Ca 0.30 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.58 1via h SER 136 Cb 0.48 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1via h SER 136 CO -0.66 0.33 -0.04 0.11 -0.87 0.00 0.00 176.83 175.70 1via h LYS 137 N 0.51 0.11 -0.37 4.77 1.57 -1.40 -0.84 116.57 120.92 1via h LYS 137 Ca 0.14 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1via h LYS 137 Cb -0.04 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.23 1via h LYS 137 CO -0.03 0.55 0.09 1.88 -0.57 0.00 0.00 179.45 181.37 1via h TYR 138 N -0.32 0.15 -0.61 -1.35 0.05 -1.02 -1.57 116.97 112.30 1via h TYR 138 Ca 0.01 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.75 1via h TYR 138 Cb 0.52 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.23 1via h TYR 138 CO 0.09 0.03 0.17 0.93 -1.05 0.00 0.00 178.16 178.32 1via h GLU 139 N 0.22 0.97 -0.04 4.88 5.08 -1.13 -2.38 114.58 122.18 1via h GLU 139 Ca 0.18 -0.23 -0.14 0.00 -1.00 0.00 0.00 59.36 58.18 1via h GLU 139 Cb 0.20 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1via h GLU 139 CO -0.22 0.88 -0.59 -0.56 -1.00 0.00 0.00 179.01 177.51 1via h GLN 140 N 0.89 0.13 -0.01 2.33 3.07 -0.97 -3.19 115.11 117.37 1via h GLN 140 Ca 0.19 -0.09 0.00 0.00 0.09 0.00 0.00 58.65 58.85 1via h GLN 140 Cb 0.33 0.01 0.00 0.00 0.08 0.00 0.00 27.48 27.90 1via h GLN 140 CO -0.00 0.69 -0.32 1.63 0.09 0.00 0.00 178.83 180.92 1via n LYS 141 N -3.86 0.71 -2.52 0.06 5.02 -0.61 -4.92 118.16 112.05 1via n LYS 141 Ca -0.02 -0.43 -0.41 0.00 -2.02 0.00 0.00 58.31 55.43 1via n LYS 141 Cb 0.60 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.08 1via n LYS 141 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1via s ALA 142 N -2.59 3.36 -0.16 7.82 0.00 -0.90 -4.70 121.76 124.60 1via s ALA 142 Ca 0.22 0.80 0.17 0.00 0.00 0.00 0.00 51.96 53.15 1via s ALA 142 Cb 0.19 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.89 1via s ALA 142 CO 0.56 -0.23 1.02 -0.91 0.00 0.00 0.00 175.76 176.20 1via h ASN 143 N 5.37 0.00 -3.02 0.00 4.21 -0.89 -3.46 115.58 117.79 1via h ASN 143 Ca -0.44 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 56.91 1via h ASN 143 Cb 1.21 0.00 -0.29 0.00 -1.12 0.00 0.00 38.32 38.12 1via h ASN 143 CO 0.73 0.46 -0.42 0.12 -1.29 0.00 0.00 177.43 177.03 1via s PHE 144 N -3.01 -0.52 -0.31 1.19 5.36 -0.85 -4.99 117.98 114.84 1via s PHE 144 Ca -0.01 1.12 -0.12 0.00 -0.96 0.00 0.00 56.93 56.96 1via s PHE 144 Cb 0.08 0.14 -0.03 0.00 -0.34 0.00 0.00 43.02 42.87 1via s PHE 144 CO 0.79 -0.34 0.21 0.42 -1.46 0.00 0.00 175.22 174.84 1via s ILE 145 N 1.87 5.23 -0.33 3.12 1.01 -1.26 -1.19 121.20 129.65 1via s ILE 145 Ca -0.05 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 1via s ILE 145 Cb -0.11 -3.61 0.04 0.00 0.01 0.00 0.00 42.46 38.79 1via s ILE 145 CO -0.11 0.10 0.09 -0.22 0.00 0.00 0.00 174.94 174.80 1via s LEU 146 N 1.73 4.25 -0.20 2.97 2.96 0.01 -4.97 118.68 125.43 1via s LEU 146 Ca 0.06 -1.13 -0.29 0.00 -0.22 0.00 0.00 54.13 52.55 1via s LEU 146 Cb -0.17 -1.85 -0.00 0.00 0.50 0.00 0.00 46.19 44.67 1via s LEU 146 CO 0.10 -0.31 1.19 0.21 -1.32 0.00 0.00 176.35 176.22 1via s ASN 147 N 1.39 6.98 0.00 3.68 3.84 -1.26 -0.69 114.94 128.88 1via s ASN 147 Ca -0.02 1.55 0.26 0.00 0.21 0.00 0.00 52.86 54.86 1via s ASN 147 Cb -0.19 -2.54 0.69 0.00 -0.55 0.00 0.00 41.25 38.66 1via s ASN 147 CO 0.02 -0.76 1.53 2.30 -2.79 0.00 0.00 177.10 177.41 1via n ILE 148 N 5.42 0.00 -1.98 -5.21 -5.35 -0.34 -4.91 119.36 106.99 1via n ILE 148 Ca 0.13 -0.06 -0.41 0.00 -0.27 0.00 0.00 62.75 62.14 1via n ILE 148 Cb 0.45 0.27 -0.02 0.00 -1.74 0.00 0.00 39.64 38.61 1via n ILE 148 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1via s GLU 149 N -2.73 4.25 -1.68 6.28 2.02 -1.26 -2.71 118.70 122.87 1via s GLU 149 Ca 0.18 2.36 -0.02 0.00 0.02 0.00 0.00 54.97 57.51 1via s GLU 149 Cb 0.19 -3.05 0.00 0.00 0.10 0.00 0.00 34.13 31.36 1via s GLU 149 CO 0.60 -0.37 0.30 0.09 0.02 0.00 0.00 175.26 175.89 1via n ASN 150 N 1.26 -6.05 -4.06 -0.19 3.02 -1.26 -5.00 115.26 102.98 1via n ASN 150 Ca 0.03 -0.15 -0.24 0.00 -0.03 0.00 0.00 54.58 54.19 1via n ASN 150 Cb 0.40 -4.95 -0.16 0.00 -0.61 0.00 0.00 39.78 34.46 1via n ASN 150 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1via s LYS 151 N -5.37 1.51 0.74 3.52 1.02 -1.10 -5.14 119.74 114.92 1via s LYS 151 Ca 0.15 -0.46 -0.07 0.00 0.02 0.00 0.00 55.97 55.61 1via s LYS 151 Cb -0.07 -1.31 0.09 0.00 -0.52 0.00 0.00 37.83 36.02 1via s LYS 151 CO 0.18 0.15 1.04 0.54 -0.92 0.00 0.00 175.35 176.35 1via s ASN 152 N 0.25 4.51 0.23 2.83 2.20 -1.26 -4.86 114.94 118.84 1via s ASN 152 Ca -0.06 0.27 -0.07 0.00 -0.94 0.00 0.00 52.86 52.05 1via s ASN 152 Cb -0.12 -0.80 0.27 0.00 -2.00 0.00 0.00 41.25 38.60 1via s ASN 152 CO 0.02 -1.79 1.85 -0.29 -2.94 0.00 0.00 177.10 173.95 1via h ILE 153 N -0.71 1.06 -0.85 0.54 6.09 -1.99 -1.20 117.51 120.45 1via h ILE 153 Ca -0.43 -0.31 -0.01 0.00 -1.37 0.00 0.00 64.86 62.74 1via h ILE 153 Cb 1.30 0.07 -0.04 0.00 0.47 0.00 0.00 36.82 38.61 1via h ILE 153 CO 0.53 0.17 0.50 0.44 -3.07 0.00 0.00 178.15 176.72 1via h ASP 154 N 0.91 1.03 -0.50 2.19 3.32 -1.99 -0.02 116.42 121.36 1via h ASP 154 Ca 0.33 -0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 1via h ASP 154 Cb 0.11 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1via h ASP 154 CO -0.15 0.80 0.07 -0.33 -1.72 0.00 0.00 179.24 177.91 1via h GLU 155 N 1.17 0.83 -0.44 3.56 5.08 -1.74 -1.01 114.58 122.03 1via h GLU 155 Ca 0.30 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1via h GLU 155 Cb -0.02 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1via h GLU 155 CO -0.05 0.83 0.15 -0.07 -1.00 0.00 0.00 179.01 178.86 1via h LEU 156 N 0.70 0.63 -0.57 1.33 3.38 -0.79 -1.57 115.31 118.43 1via h LEU 156 Ca 0.15 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1via h LEU 156 Cb 0.41 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1via h LEU 156 CO 0.01 0.66 0.34 -0.07 0.09 0.00 0.00 178.44 179.48 1via h LEU 157 N 0.57 0.56 -0.55 1.67 3.38 -0.89 -0.89 115.31 119.15 1via h LEU 157 Ca 0.14 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1via h LEU 157 Cb 0.25 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1via h LEU 157 CO -0.01 0.39 0.36 0.28 0.09 0.00 0.00 178.44 179.56 1via h SER 158 N 0.68 0.62 -0.81 -0.43 0.02 -1.01 -0.20 113.55 112.43 1via h SER 158 Ca 0.23 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.13 1via h SER 158 Cb 0.03 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1via h SER 158 CO -0.10 0.45 0.36 -0.08 -1.14 0.00 0.00 176.83 176.32 1via h GLU 159 N 0.74 1.18 -0.28 3.45 4.81 -0.88 -1.78 114.58 121.82 1via h GLU 159 Ca 0.20 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 1via h GLU 159 Cb -0.08 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.09 1via h GLU 159 CO -0.05 0.93 -0.14 0.82 -0.73 0.00 0.00 179.01 179.85 1via h ILE 160 N 1.16 1.30 -0.09 2.32 2.04 -0.78 -2.55 117.51 120.90 1via h ILE 160 Ca 0.27 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.89 1via h ILE 160 Cb 0.16 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1via h ILE 160 CO -0.03 0.39 -0.01 0.11 0.00 0.00 0.00 178.15 178.61 1via h LYS 161 N 0.33 0.13 -0.37 2.37 1.57 -0.91 -0.53 116.57 119.16 1via h LYS 161 Ca 0.06 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 1via h LYS 161 Cb 0.65 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1via h LYS 161 CO 0.04 0.15 -0.16 -0.22 -0.57 0.00 0.00 179.45 178.69 1via h LYS 162 N 0.13 0.77 -0.29 3.15 1.63 -1.16 0.24 116.57 121.04 1via h LYS 162 Ca 0.03 -0.33 -0.01 0.00 -0.85 0.00 0.00 60.65 59.49 1via h LYS 162 Cb 0.11 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1via h LYS 162 CO 0.00 0.95 0.14 0.28 -3.45 0.00 0.00 179.45 177.37 1via h VAL 163 N 0.57 1.15 -0.01 2.00 2.07 -0.83 -2.78 116.25 118.42 1via h VAL 163 Ca 0.09 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1via h VAL 163 Cb 0.70 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1via h VAL 163 CO 0.05 0.15 -0.03 2.30 0.02 0.00 0.00 177.57 180.06 1via n ILE 164 N -4.79 0.00 -2.94 4.57 -5.35 -0.32 -4.93 119.36 105.60 1via n ILE 164 Ca -0.02 -0.14 -0.12 0.00 -0.27 0.00 0.00 62.75 62.20 1via n ILE 164 Cb 0.10 0.11 0.06 0.00 -1.74 0.00 0.00 39.64 38.17 1via n ILE 164 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1via n LYS 165 N -0.39 -3.26 0.00 6.28 5.02 -0.21 -5.06 118.16 120.53 1via n LYS 165 Ca 0.19 0.65 0.10 0.00 -2.02 0.00 0.00 58.31 57.23 1via n LYS 165 Cb 0.27 -4.90 0.08 0.00 -0.02 0.00 0.00 35.03 30.46 1via n LYS 165 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27