#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgj n GLY 4 N 0.00 0.00 0.36 0.00 0.00 -1.26 -2.35 105.19 101.94 2dgj n GLY 4 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 2dgj n GLY 4 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2dgj h GLN 5 N 0.00 1.09 -0.44 1.61 4.20 -2.00 0.58 115.11 120.15 2dgj h GLN 5 Ca 0.00 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.57 2dgj h GLN 5 Cb 0.00 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.52 2dgj h GLN 5 CO 0.00 0.72 -0.01 1.25 -0.67 0.00 0.00 178.83 180.12 2dgj h LEU 6 N 1.12 0.77 -1.16 1.46 5.85 -1.81 -1.08 115.31 120.45 2dgj h LEU 6 Ca 0.34 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 2dgj h LEU 6 Cb -0.04 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 2dgj h LEU 6 CO -0.09 0.90 0.36 -0.61 -0.34 0.00 0.00 178.44 178.66 2dgj h GLN 7 N 0.62 0.94 -0.45 1.25 5.75 -1.66 -1.90 115.11 119.66 2dgj h GLN 7 Ca 0.12 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2dgj h GLN 7 Cb 0.51 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 2dgj h GLN 7 CO 0.03 0.70 0.25 1.25 -2.65 0.00 0.00 178.83 178.40 2dgj h HIS 8 N 0.95 0.62 -0.87 3.99 2.76 -0.36 0.71 115.15 122.93 2dgj h HIS 8 Ca 0.24 -0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.42 2dgj h HIS 8 Cb 0.04 -0.20 -0.05 0.00 1.55 0.00 0.00 27.41 28.75 2dgj h HIS 8 CO 0.01 0.47 0.57 0.78 -1.30 0.00 0.00 177.93 178.45 2dgj h GLY 9 N 0.59 1.26 0.99 5.26 0.00 -0.49 -0.48 103.07 110.21 2dgj h GLY 9 Ca 0.16 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 2dgj h GLY 9 CO -0.03 0.38 -0.13 -2.22 0.00 0.00 0.00 176.54 174.55 2dgj h ILE 10 N 1.11 1.28 -0.59 2.60 2.04 -0.93 -3.07 117.51 119.95 2dgj h ILE 10 Ca 0.34 -1.24 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 2dgj h ILE 10 Cb -0.02 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 2dgj h ILE 10 CO -0.11 0.41 0.24 0.44 0.00 0.00 0.00 178.15 179.14 2dgj h ASP 11 N 0.60 0.77 0.05 1.72 3.32 -0.32 -2.65 116.42 119.90 2dgj h ASP 11 Ca 0.10 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dgj h ASP 11 Cb 0.67 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2dgj h ASP 11 CO 0.05 0.69 0.00 -0.67 -1.72 0.00 0.00 179.24 177.59 2dgj n ASP 12 N -4.33 0.00 0.08 6.45 2.03 -0.24 -4.29 116.55 116.25 2dgj n ASP 12 Ca 0.05 -0.91 -0.06 0.00 0.52 0.00 0.00 54.79 54.40 2dgj n ASP 12 Cb 0.16 -0.02 -0.03 0.00 -0.72 0.00 0.00 41.12 40.51 2dgj n ASP 12 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2dgj h GLU 13 N 0.00 -0.29 -0.79 -0.67 4.81 -1.41 0.13 114.58 116.35 2dgj h GLU 13 Ca 0.00 0.02 0.18 0.00 -0.13 0.00 0.00 59.36 59.43 2dgj h GLU 13 Cb 0.02 0.07 -0.12 0.00 0.63 0.00 0.00 28.75 29.35 2dgj h GLU 13 CO 0.00 -0.20 0.23 -0.97 -0.73 0.00 0.00 179.01 177.35 2dgj h ASN 14 N -0.30 0.08 -0.16 1.04 -0.73 -1.82 0.15 115.58 113.84 2dgj h ASN 14 Ca -0.02 0.15 -0.01 0.00 1.87 0.00 0.00 56.30 58.30 2dgj h ASN 14 Cb 0.27 0.19 -0.01 0.00 0.27 0.00 0.00 38.32 39.04 2dgj h ASN 14 CO -0.04 -0.04 0.07 0.00 -0.37 0.00 0.00 177.43 177.05 2dgj h ALA 15 N 1.65 0.21 -0.74 1.57 0.00 -1.78 -2.19 119.26 117.99 2dgj h ALA 15 Ca 0.46 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.29 2dgj h ALA 15 Cb 0.83 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2dgj h ALA 15 CO -0.53 -0.20 0.49 1.15 0.00 0.00 0.00 179.25 180.16 2dgj h THR 16 N 0.11 1.16 0.00 0.00 2.02 0.68 -1.29 112.91 115.59 2dgj h THR 16 Ca 0.05 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.91 2dgj h THR 16 Cb 0.17 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 2dgj h THR 16 CO -0.00 0.17 0.00 0.11 0.37 0.00 0.00 175.52 176.17 2dgj h LYS 17 N 0.95 0.00 0.00 6.66 1.57 -0.40 -2.73 116.57 122.63 2dgj h LYS 17 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2dgj h LYS 17 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2dgj h LYS 17 CO -0.07 0.00 -0.58 1.96 -0.57 0.00 0.00 179.45 180.19 2dgj h GLN 18 N 0.00 0.00 -7.19 3.15 1.08 -0.62 -3.41 115.11 108.13 2dgj h GLN 18 Ca 0.00 0.00 -0.48 0.00 -1.45 0.00 0.00 58.65 56.72 2dgj h GLN 18 Cb 0.51 0.00 0.04 0.00 -0.05 0.00 0.00 27.48 27.98 2dgj h GLN 18 CO 0.00 0.00 0.38 0.95 -0.95 0.00 0.00 178.83 179.21 2dgj s THR 19 N -3.22 4.09 0.34 -0.54 -4.23 -1.03 -4.92 115.64 106.13 2dgj s THR 19 Ca 0.05 1.02 0.12 0.00 -1.18 0.00 0.00 61.69 61.70 2dgj s THR 19 Cb 0.11 -3.52 0.05 0.00 1.34 0.00 0.00 72.50 70.49 2dgj s THR 19 CO 0.72 -0.55 1.76 -0.61 -0.54 0.00 0.00 174.62 175.39 2dgj h GLN 20 N 0.71 0.00 -0.86 3.99 -0.00 -1.91 -0.94 115.11 116.11 2dgj h GLN 20 Ca -0.47 -0.00 0.04 0.00 -0.00 0.00 0.00 58.65 58.22 2dgj h GLN 20 Cb 1.21 -0.00 -0.05 0.00 0.00 0.00 0.00 27.48 28.64 2dgj h GLN 20 CO 0.59 0.46 0.56 -0.22 0.00 0.00 0.00 178.83 180.22 2dgj h LYS 21 N 0.00 1.00 0.00 1.69 3.64 -1.89 -2.10 116.57 118.91 2dgj h LYS 21 Ca -0.00 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2dgj h LYS 21 Cb 0.80 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 2dgj h LYS 21 CO 0.06 0.66 -0.22 -0.92 -2.27 0.00 0.00 179.45 176.76 2dgj h TYR 22 N 1.03 0.00 -0.67 1.91 3.20 -1.69 0.13 116.97 120.87 2dgj h TYR 22 Ca 0.35 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.28 2dgj h TYR 22 Cb 0.09 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 38.28 2dgj h TYR 22 CO -0.00 0.33 -0.40 -2.13 -1.64 0.00 0.00 178.16 174.32 2dgj n ARG 23 N -4.68 -0.30 -0.07 1.82 3.00 -0.38 -0.95 116.66 115.10 2dgj n ARG 23 Ca -0.06 1.19 0.09 0.00 -0.00 0.00 0.00 57.85 59.06 2dgj n ARG 23 Cb 0.21 -1.76 0.35 0.00 0.00 0.00 0.00 32.46 31.27 2dgj n ARG 23 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2dgj n ASP 24 N -4.60 1.17 -4.66 6.15 8.00 -0.80 -4.92 116.55 116.90 2dgj n ASP 24 Ca 0.01 -1.71 -0.30 0.00 0.71 0.00 0.00 54.79 53.51 2dgj n ASP 24 Cb 0.17 -0.09 0.17 0.00 -0.02 0.00 0.00 41.12 41.35 2dgj n ASP 24 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dgj s ALA 25 N -1.81 1.12 0.35 2.24 0.00 -0.12 -4.39 121.76 119.14 2dgj s ALA 25 Ca 0.27 0.07 -0.27 0.00 0.00 0.00 0.00 51.96 52.03 2dgj s ALA 25 Cb 0.14 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.91 2dgj s ALA 25 CO 0.21 -2.74 1.24 -1.21 0.00 0.00 0.00 175.76 173.26 2dgj s GLU 26 N -4.77 4.26 0.20 0.00 2.02 -1.26 -4.80 118.70 114.35 2dgj s GLU 26 Ca 0.65 2.04 -0.22 0.00 0.02 0.00 0.00 54.97 57.46 2dgj s GLU 26 Cb -0.20 -2.94 0.13 0.00 0.10 0.00 0.00 34.13 31.21 2dgj s GLU 26 CO 0.59 -0.21 1.55 0.37 0.02 0.00 0.00 175.26 177.58 2dgj h GLN 27 N 3.14 -0.02 -0.96 1.61 4.15 -1.95 0.51 115.11 121.59 2dgj h GLN 27 Ca -0.49 0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.08 2dgj h GLN 27 Cb 1.23 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.84 2dgj h GLN 27 CO 0.64 -0.01 0.61 0.66 -1.93 0.00 0.00 178.83 178.80 2dgj h SER 28 N -0.02 0.80 0.10 -0.69 4.64 -1.99 0.59 113.55 116.98 2dgj h SER 28 Ca 0.27 0.05 -0.16 0.00 -0.47 0.00 0.00 61.79 61.49 2dgj h SER 28 Cb 0.54 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 2dgj h SER 28 CO -0.95 0.39 -0.58 0.11 -0.87 0.00 0.00 176.83 174.94 2dgj h LYS 29 N 0.84 0.49 -0.47 4.77 1.57 -1.30 -0.45 116.57 122.02 2dgj h LYS 29 Ca 0.49 -0.32 -0.13 0.00 -1.87 0.00 0.00 60.65 58.81 2dgj h LYS 29 Cb 0.65 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2dgj h LYS 29 CO -0.26 0.93 -0.22 0.87 -0.57 0.00 0.00 179.45 180.20 2dgj h LYS 30 N 0.37 0.98 -0.27 3.15 1.57 -0.33 -2.63 116.57 119.41 2dgj h LYS 30 Ca 0.00 -0.43 -0.08 0.00 -1.87 0.00 0.00 60.65 58.28 2dgj h LYS 30 Cb 1.12 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 2dgj h LYS 30 CO 0.11 1.10 -0.13 1.15 -0.57 0.00 0.00 179.45 181.10 2dgj h THR 31 N 0.83 1.30 -0.64 -0.16 2.02 -0.82 -1.75 112.91 113.69 2dgj h THR 31 Ca 0.11 -1.22 0.03 0.00 0.77 0.00 0.00 66.41 66.10 2dgj h THR 31 Cb 0.80 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 68.68 2dgj h THR 31 CO 0.07 0.38 0.39 0.00 0.37 0.00 0.00 175.52 176.73 2dgj h ALA 32 N 0.74 0.83 0.11 6.16 0.00 -1.07 0.17 119.26 126.20 2dgj h ALA 32 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2dgj h ALA 32 Cb 0.64 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2dgj h ALA 32 CO 0.04 0.12 -0.05 -0.92 0.00 0.00 0.00 179.25 178.44 2dgj h TYR 33 N 0.75 -0.13 -0.96 0.00 3.20 -1.43 -0.90 116.97 117.50 2dgj h TYR 33 Ca 0.26 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.23 2dgj h TYR 33 Cb 0.05 0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.29 2dgj h TYR 33 CO -0.06 0.03 0.60 0.22 -1.64 0.00 0.00 178.16 177.31 2dgj h ASP 34 N -0.27 0.90 0.77 -2.11 3.58 -0.85 -0.55 116.42 117.89 2dgj h ASP 34 Ca -0.01 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.39 2dgj h ASP 34 Cb 0.22 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 2dgj h ASP 34 CO 0.02 0.52 -0.38 1.56 -2.88 0.00 0.00 179.24 178.08 2dgj h GLN 35 N 1.00 0.00 -0.18 0.28 1.08 -0.43 -2.29 115.11 114.56 2dgj h GLN 35 Ca 0.46 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.51 2dgj h GLN 35 Cb 0.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 2dgj h GLN 35 CO -0.23 0.38 -0.44 0.00 -0.95 0.00 0.00 178.83 177.59 2dgj h ALA 36 N 1.62 0.30 -0.26 3.87 0.00 0.30 -1.61 119.26 123.48 2dgj h ALA 36 Ca -0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2dgj h ALA 36 Cb 0.87 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2dgj h ALA 36 CO 0.05 0.43 0.14 0.28 0.00 0.00 0.00 179.25 180.15 2dgj h VAL 37 N 0.30 1.13 -0.76 0.00 2.07 -1.16 0.13 116.25 117.96 2dgj h VAL 37 Ca -0.00 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.17 2dgj h VAL 37 Cb 1.05 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 2dgj h VAL 37 CO 0.10 0.13 0.49 0.00 0.02 0.00 0.00 177.57 178.31 2dgj h ALA 38 N 1.01 0.99 -0.50 1.67 0.00 -1.42 -0.76 119.26 120.24 2dgj h ALA 38 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2dgj h ALA 38 Cb 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2dgj h ALA 38 CO -0.01 0.33 0.23 0.00 0.00 0.00 0.00 179.25 179.80 2dgj h ALA 39 N 1.30 0.65 -0.20 0.00 0.00 -0.89 -2.67 119.26 117.45 2dgj h ALA 39 Ca 0.29 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2dgj h ALA 39 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2dgj h ALA 39 CO -0.09 0.22 0.05 0.00 0.00 0.00 0.00 179.25 179.44 2dgj h ALA 40 N 1.07 0.21 -0.25 0.00 0.00 0.04 -0.47 119.26 119.87 2dgj h ALA 40 Ca 0.17 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.17 2dgj h ALA 40 Cb 0.14 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 2dgj h ALA 40 CO -0.02 -0.37 -0.13 0.87 0.00 0.00 0.00 179.25 179.59 2dgj h LYS 41 N 0.14 -0.10 -0.26 0.00 1.57 -1.02 0.41 116.57 117.32 2dgj h LYS 41 Ca 0.09 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2dgj h LYS 41 Cb 0.07 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2dgj h LYS 41 CO -0.10 -0.07 0.13 0.00 -0.57 0.00 0.00 179.45 178.83 2dgj h ALA 42 N 1.09 0.31 -0.60 3.86 0.00 -1.16 -0.00 119.26 122.76 2dgj h ALA 42 Ca 0.14 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2dgj h ALA 42 Cb 0.31 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2dgj h ALA 42 CO -0.32 -0.27 0.26 0.82 0.00 0.00 0.00 179.25 179.74 2dgj h ILE 43 N 0.27 1.22 -0.39 0.00 2.04 -0.51 -2.09 117.51 118.06 2dgj h ILE 43 Ca 0.11 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.24 2dgj h ILE 43 Cb 0.03 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 2dgj h ILE 43 CO -0.07 0.26 0.02 0.25 0.00 0.00 0.00 178.15 178.61 2dgj h LEU 44 N 0.83 0.58 -0.35 1.44 5.85 0.14 -2.80 115.31 120.99 2dgj h LEU 44 Ca 0.20 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 2dgj h LEU 44 Cb 0.17 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2dgj h LEU 44 CO -0.02 0.64 0.13 -1.13 -0.34 0.00 0.00 178.44 177.72 2dgj h ASN 45 N 0.59 0.49 -0.96 1.25 -1.24 -0.51 -2.98 115.58 112.21 2dgj h ASN 45 Ca 0.12 -0.18 0.22 0.00 0.71 0.00 0.00 56.30 57.17 2dgj h ASN 45 Cb 0.35 -0.13 -0.12 0.00 0.73 0.00 0.00 38.32 39.15 2dgj h ASN 45 CO 0.01 0.54 0.53 0.11 -1.29 0.00 0.00 177.43 177.33 2dgj h LYS 46 N 0.42 0.56 -7.57 6.67 1.57 -1.11 -3.51 116.57 113.59 2dgj h LYS 46 Ca 0.12 -0.03 -0.45 0.00 -1.87 0.00 0.00 60.65 58.41 2dgj h LYS 46 Cb 0.21 -0.13 0.14 0.00 0.08 0.00 0.00 32.23 32.53 2dgj h LYS 46 CO -0.01 0.37 0.33 -0.65 -0.57 0.00 0.00 179.45 178.92 2dgj s GLN 47 N -5.83 0.98 -1.15 3.15 1.11 -1.13 -5.14 119.66 111.64 2dgj s GLN 47 Ca -0.11 0.09 -0.10 0.00 0.01 0.00 0.00 55.36 55.25 2dgj s GLN 47 Cb 0.26 -1.84 -0.03 0.00 -1.01 0.00 0.00 33.01 30.39 2dgj s GLN 47 CO 0.79 -2.27 0.83 -0.25 0.01 0.00 0.00 175.29 174.40 2dgj n ASP 53 N -3.78 -4.66 0.00 5.90 8.00 -1.26 -4.99 116.55 115.77 2dgj n ASP 53 Ca 0.09 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.75 2dgj n ASP 53 Cb 0.60 -4.26 0.00 0.00 -0.02 0.00 0.00 41.12 37.43 2dgj n ASP 53 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2dgj n LYS 54 N -3.87 0.55 0.19 -1.24 4.81 -1.26 -4.57 118.16 112.77 2dgj n LYS 54 Ca -0.14 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.37 2dgj n LYS 54 Cb 0.63 -0.31 0.27 0.00 0.02 0.00 0.00 35.03 35.63 2dgj n LYS 54 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dgj h ALA 55 N 0.00 0.89 -0.06 3.14 0.00 -2.05 -2.04 119.26 119.14 2dgj h ALA 55 Ca 0.00 -0.28 -0.20 0.00 0.00 0.00 0.00 54.91 54.42 2dgj h ALA 55 Cb 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2dgj h ALA 55 CO 0.00 0.39 -0.81 0.00 0.00 0.00 0.00 179.25 178.83 2dgj h ALA 56 N 1.69 0.48 -0.22 0.00 0.00 -2.00 -1.88 119.26 117.33 2dgj h ALA 56 Ca -0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 54.91 54.14 2dgj h ALA 56 Cb 1.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2dgj h ALA 56 CO 0.04 0.77 -0.39 0.28 0.00 0.00 0.00 179.25 179.95 2dgj h VAL 57 N 0.29 1.30 0.00 0.00 2.07 -1.73 -2.34 116.25 115.85 2dgj h VAL 57 Ca -0.05 -1.53 -0.25 0.00 0.82 0.00 0.00 66.70 65.69 2dgj h VAL 57 Cb 1.41 1.55 0.01 0.00 -1.52 0.00 0.00 31.29 32.75 2dgj h VAL 57 CO 0.14 0.48 -1.01 -0.78 0.02 0.00 0.00 177.57 176.42 2dgj h ASP 58 N 0.42 0.76 -0.26 0.57 3.58 -1.31 -1.18 116.42 119.00 2dgj h ASP 58 Ca 0.04 -0.61 -0.06 0.00 0.42 0.00 0.00 57.03 56.81 2dgj h ASP 58 Cb 0.86 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 2dgj h ASP 58 CO 0.07 1.41 -0.03 0.03 -2.88 0.00 0.00 179.24 177.85 2dgj h ARG 59 N 0.33 0.61 -0.31 0.28 3.08 -1.33 0.45 114.38 117.49 2dgj h ARG 59 Ca -0.11 -0.15 -0.10 0.00 0.07 0.00 0.00 59.98 59.68 2dgj h ARG 59 Cb 1.65 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.62 2dgj h ARG 59 CO 0.19 0.65 -0.21 0.00 -1.07 0.00 0.00 179.97 179.54 2dgj h ALA 60 N 1.40 0.45 -0.15 0.04 0.00 -1.35 -1.76 119.26 117.88 2dgj h ALA 60 Ca 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2dgj h ALA 60 Cb 0.41 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2dgj h ALA 60 CO 0.02 0.40 0.05 1.25 0.00 0.00 0.00 179.25 180.97 2dgj h LEU 61 N 0.46 0.22 -0.98 0.00 5.85 -0.65 -1.98 115.31 118.22 2dgj h LEU 61 Ca 0.06 -0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.70 2dgj h LEU 61 Cb 0.75 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.64 2dgj h LEU 61 CO 0.06 0.35 0.61 -0.61 -0.34 0.00 0.00 178.44 178.51 2dgj h GLN 62 N 0.07 0.95 -0.10 1.25 -0.00 -0.04 -0.49 115.11 116.76 2dgj h GLN 62 Ca 0.05 -0.06 -0.15 0.00 -0.00 0.00 0.00 58.65 58.49 2dgj h GLN 62 Cb 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 2dgj h GLN 62 CO -0.00 0.63 -0.58 1.96 0.00 0.00 0.00 178.83 180.84 2dgj h GLN 63 N 0.98 0.33 -0.27 1.69 4.20 -1.07 0.40 115.11 121.35 2dgj h GLN 63 Ca 0.48 -0.21 -0.19 0.00 0.06 0.00 0.00 58.65 58.79 2dgj h GLN 63 Cb 0.45 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.26 2dgj h GLN 63 CO -0.26 0.81 -0.57 0.28 -0.67 0.00 0.00 178.83 178.42 2dgj h VAL 64 N 0.25 1.27 -0.39 -0.54 2.07 -0.58 -1.81 116.25 116.52 2dgj h VAL 64 Ca -0.00 -1.75 -0.16 0.00 0.82 0.00 0.00 66.70 65.61 2dgj h VAL 64 Cb 1.09 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2dgj h VAL 64 CO 0.09 0.57 -0.38 0.74 0.02 0.00 0.00 177.57 178.62 2dgj h THR 65 N 0.65 1.27 0.29 2.57 2.02 -1.05 -2.24 112.91 116.43 2dgj h THR 65 Ca 0.01 -1.55 -0.01 0.00 0.77 0.00 0.00 66.41 65.62 2dgj h THR 65 Cb 1.19 1.37 0.00 0.00 -1.74 0.00 0.00 68.15 68.96 2dgj h THR 65 CO 0.13 0.52 -0.14 0.28 0.37 0.00 0.00 175.52 176.68 2dgj h SER 66 N 0.77 -0.33 -0.45 4.18 0.02 -0.91 -1.84 113.55 114.99 2dgj h SER 66 Ca 0.06 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 2dgj h SER 66 Cb 0.97 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 2dgj h SER 66 CO 0.09 0.04 0.26 0.71 -1.14 0.00 0.00 176.83 176.79 2dgj h THR 67 N -0.73 1.15 -0.07 -2.27 1.35 -1.41 -1.07 112.91 109.84 2dgj h THR 67 Ca -0.04 -0.37 -0.01 0.00 -0.55 0.00 0.00 66.41 65.44 2dgj h THR 67 Cb 0.49 0.51 -0.00 0.00 -1.73 0.00 0.00 68.15 67.42 2dgj h THR 67 CO 0.06 0.16 -0.00 0.50 -0.25 0.00 0.00 175.52 176.00 2dgj h LYS 68 N 0.65 0.12 -0.34 4.72 3.64 -1.37 -2.71 116.57 121.28 2dgj h LYS 68 Ca 0.17 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 2dgj h LYS 68 Cb 0.02 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2dgj h LYS 68 CO -0.03 0.40 0.23 -0.44 -2.27 0.00 0.00 179.45 177.34 2dgj h ASP 69 N -0.16 0.38 0.40 4.20 3.32 -0.99 -1.65 116.42 121.92 2dgj h ASP 69 Ca 0.02 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 2dgj h ASP 69 Cb 0.34 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2dgj h ASP 69 CO 0.00 0.27 -0.17 0.00 -1.72 0.00 0.00 179.24 177.62 2dgj h ALA 70 N 1.79 1.32 -1.65 3.45 0.00 -0.91 -3.43 119.26 119.82 2dgj h ALA 70 Ca 0.13 -0.16 -0.70 0.00 0.00 0.00 0.00 54.91 54.18 2dgj h ALA 70 Cb -0.02 -0.03 0.04 0.00 0.00 0.00 0.00 17.79 17.78 2dgj h ALA 70 CO -0.03 0.22 0.67 1.28 0.00 0.00 0.00 179.25 181.39 2dgj n LEU 71 N -3.76 2.06 -0.49 0.00 4.32 -0.62 -4.86 117.00 113.65 2dgj n LEU 71 Ca -0.02 1.09 0.07 0.00 -0.02 0.00 0.00 56.01 57.14 2dgj n LEU 71 Cb 0.28 -1.18 0.20 0.00 -1.62 0.00 0.00 43.42 41.09 2dgj n LEU 71 CO 0.32 -0.74 0.40 -0.46 -1.22 0.00 0.00 177.39 175.70 2dgj n ASN 72 N 3.87 1.84 -0.34 -1.43 6.94 -1.25 -4.77 115.26 120.12 2dgj n ASN 72 Ca 0.22 -3.74 0.05 0.00 -0.02 0.00 0.00 54.58 51.08 2dgj n ASN 72 Cb 0.17 -0.51 0.20 0.00 -2.36 0.00 0.00 39.78 37.28 2dgj n ASN 72 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 2dgj h GLY 73 N 0.80 1.49 1.16 4.83 0.00 -0.94 -0.52 103.07 109.89 2dgj h GLY 73 Ca -0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 2dgj h GLY 73 CO 0.00 0.19 0.28 1.29 0.00 0.00 0.00 176.54 178.30 2dgj h ASP 74 N 0.96 0.98 -0.10 0.19 2.03 -1.76 -0.01 116.42 118.71 2dgj h ASP 74 Ca 0.45 -0.15 -0.09 0.00 -0.73 0.00 0.00 57.03 56.51 2dgj h ASP 74 Cb 0.37 -0.25 -0.01 0.00 -0.83 0.00 0.00 39.33 38.60 2dgj h ASP 74 CO -0.24 0.88 -0.23 0.00 -1.03 0.00 0.00 179.24 178.62 2dgj h ALA 75 N 1.26 1.09 0.00 4.15 0.00 -1.59 -2.10 119.26 122.08 2dgj h ALA 75 Ca 0.24 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2dgj h ALA 75 Cb 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2dgj h ALA 75 CO -0.02 0.56 -0.40 0.87 0.00 0.00 0.00 179.25 180.26 2dgj h LYS 76 N 0.46 0.00 -0.17 0.00 1.79 -0.30 -2.32 116.57 116.03 2dgj h LYS 76 Ca 0.07 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.36 2dgj h LYS 76 Cb 0.65 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.31 2dgj h LYS 76 CO 0.05 0.40 -0.61 1.25 -1.08 0.00 0.00 179.45 179.46 2dgj h LEU 77 N 0.00 0.83 -0.72 2.94 5.85 -0.42 -1.56 115.31 122.23 2dgj h LEU 77 Ca -0.00 -0.61 -0.04 0.00 0.84 0.00 0.00 57.88 58.06 2dgj h LEU 77 Cb 0.87 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2dgj h LEU 77 CO 0.05 1.29 0.28 0.00 -0.34 0.00 0.00 178.44 179.72 2dgj h ALA 78 N 0.55 0.94 -0.24 1.25 0.00 -1.26 -0.92 119.26 119.58 2dgj h ALA 78 Ca -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2dgj h ALA 78 Cb 1.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2dgj h ALA 78 CO 0.13 0.57 0.09 1.49 0.00 0.00 0.00 179.25 181.53 2dgj h GLU 79 N 1.04 0.36 -0.41 0.00 4.81 -1.39 -0.77 114.58 118.22 2dgj h GLU 79 Ca 0.24 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2dgj h GLU 79 Cb 0.23 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2dgj h GLU 79 CO -0.02 0.42 0.26 0.00 -0.73 0.00 0.00 179.01 178.94 2dgj h ALA 80 N 0.92 0.52 -0.89 2.92 0.00 -1.03 0.03 119.26 121.74 2dgj h ALA 80 Ca 0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2dgj h ALA 80 Cb 0.20 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2dgj h ALA 80 CO -0.00 -0.05 0.50 0.87 0.00 0.00 0.00 179.25 180.56 2dgj h LYS 81 N 0.53 1.23 -0.58 0.00 1.57 -1.04 -0.12 116.57 118.16 2dgj h LYS 81 Ca 0.16 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2dgj h LYS 81 Cb -0.03 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.01 2dgj h LYS 81 CO -0.05 0.90 0.31 0.00 -0.57 0.00 0.00 179.45 180.03 2dgj h ALA 82 N 1.30 0.75 -0.71 3.86 0.00 -0.46 -0.52 119.26 123.48 2dgj h ALA 82 Ca 0.31 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2dgj h ALA 82 Cb 0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2dgj h ALA 82 CO -0.05 0.28 0.37 0.00 0.00 0.00 0.00 179.25 179.85 2dgj h ALA 83 N 1.14 0.92 -0.48 0.00 0.00 -0.27 -1.43 119.26 119.13 2dgj h ALA 83 Ca 0.20 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2dgj h ALA 83 Cb 0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2dgj h ALA 83 CO -0.03 0.45 0.06 0.00 0.00 0.00 0.00 179.25 179.72 2dgj h ALA 84 N 1.19 0.64 -0.75 0.00 0.00 -0.58 -1.30 119.26 118.46 2dgj h ALA 84 Ca 0.25 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2dgj h ALA 84 Cb 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2dgj h ALA 84 CO -0.04 0.39 0.26 0.00 0.00 0.00 0.00 179.25 179.87 2dgj h ARG 85 N 0.68 1.13 -0.37 0.00 3.08 -0.85 0.32 114.38 118.37 2dgj h ARG 85 Ca 0.14 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 2dgj h ARG 85 Cb 0.42 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2dgj h ARG 85 CO 0.01 0.94 0.18 0.37 -1.07 0.00 0.00 179.97 180.41 2dgj h GLN 86 N 1.10 0.54 -0.40 0.04 5.75 -1.03 -2.46 115.11 118.65 2dgj h GLN 86 Ca 0.25 -0.08 -0.07 0.00 -0.15 0.00 0.00 58.65 58.60 2dgj h GLN 86 Cb 0.26 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2dgj h GLN 86 CO -0.01 0.48 -0.01 -0.97 -2.65 0.00 0.00 178.83 175.66 2dgj h ASN 87 N 0.47 0.70 -0.92 -0.69 -1.24 -0.80 -3.05 115.58 110.04 2dgj h ASN 87 Ca 0.13 -0.32 0.14 0.00 0.71 0.00 0.00 56.30 56.96 2dgj h ASN 87 Cb 0.12 -0.19 -0.08 0.00 0.73 0.00 0.00 38.32 38.91 2dgj h ASN 87 CO -0.02 0.85 0.59 0.25 -1.29 0.00 0.00 177.43 177.81 2dgj h LEU 88 N 0.53 0.72 0.00 0.34 5.85 -0.16 -0.89 115.31 121.71 2dgj h LEU 88 Ca 0.11 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2dgj h LEU 88 Cb 0.50 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.43 2dgj h LEU 88 CO 0.02 0.37 0.00 0.61 -0.34 0.00 0.00 178.44 179.10 2dgj n GLY 89 N -1.41 -0.91 0.55 3.75 0.00 -0.95 -2.40 105.19 103.81 2dgj n GLY 89 Ca 0.18 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.25 2dgj n GLY 89 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dgj n THR 90 N -1.39 0.00 -2.70 2.61 -2.24 -0.34 -4.81 114.28 105.41 2dgj n THR 90 Ca 0.06 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.13 2dgj n THR 90 Cb 0.15 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 2dgj n THR 90 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dgj s LEU 91 N -2.34 3.76 0.00 3.22 1.02 -1.01 -4.89 118.68 118.44 2dgj s LEU 91 Ca 0.23 -0.66 0.15 0.00 0.02 0.00 0.00 54.13 53.88 2dgj s LEU 91 Cb 0.19 -2.53 0.71 0.00 0.02 0.00 0.00 46.19 44.58 2dgj s LEU 91 CO 0.48 -1.62 1.49 0.59 0.02 0.00 0.00 176.35 177.31 2dgj n ASN 92 N 8.51 0.77 -0.02 2.29 3.02 -1.26 -4.23 115.26 124.35 2dgj n ASN 92 Ca 0.00 -1.68 -0.00 0.00 -0.03 0.00 0.00 54.58 52.87 2dgj n ASN 92 Cb 0.47 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.54 2dgj n ASN 92 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2dgj n HIS 93 N -0.22 0.00 -1.75 3.10 8.25 -1.26 -5.03 115.22 118.31 2dgj n HIS 93 Ca 0.12 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.24 2dgj n HIS 93 Cb 0.17 -0.21 0.06 0.00 1.12 0.00 0.00 29.99 31.13 2dgj n HIS 93 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2dgj s ILE 94 N -2.25 2.74 0.67 1.59 -4.36 -1.26 -4.87 121.20 113.46 2dgj s ILE 94 Ca -0.02 0.39 -0.10 0.00 -0.26 0.00 0.00 60.65 60.66 2dgj s ILE 94 Cb 0.02 -2.99 0.01 0.00 1.25 0.00 0.00 42.46 40.75 2dgj s ILE 94 CO 0.23 -0.17 1.03 0.42 0.24 0.00 0.00 174.94 176.69 2dgj s THR 95 N -1.97 3.55 0.26 8.37 -4.23 -1.26 -4.82 115.64 115.52 2dgj s THR 95 Ca 0.73 0.31 -0.03 0.00 -1.18 0.00 0.00 61.69 61.52 2dgj s THR 95 Cb -0.26 -3.47 0.24 0.00 1.34 0.00 0.00 72.50 70.35 2dgj s THR 95 CO 0.39 -0.57 1.84 0.78 -0.54 0.00 0.00 174.62 176.52 2dgj h ASN 96 N -0.49 0.85 -0.84 3.99 2.35 -1.44 0.19 115.58 120.19 2dgj h ASN 96 Ca -0.45 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.30 2dgj h ASN 96 Cb 1.25 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 39.44 2dgj h ASN 96 CO 0.63 0.51 0.42 0.00 -1.65 0.00 0.00 177.43 177.34 2dgj h ALA 97 N 1.46 1.08 -0.41 -0.83 0.00 -1.77 -0.41 119.26 118.37 2dgj h ALA 97 Ca 0.42 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 2dgj h ALA 97 Cb 0.30 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2dgj h ALA 97 CO -0.21 0.63 -0.30 1.96 0.00 0.00 0.00 179.25 181.32 2dgj h GLN 98 N 1.19 0.91 -0.25 0.00 4.20 -1.42 -2.49 115.11 117.24 2dgj h GLN 98 Ca 0.29 -0.43 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 2dgj h GLN 98 Cb 0.09 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2dgj h GLN 98 CO -0.04 1.08 0.12 -0.09 -0.67 0.00 0.00 178.83 179.23 2dgj h ARG 99 N 0.76 0.37 -0.12 1.46 2.43 -0.08 -1.77 114.38 117.43 2dgj h ARG 99 Ca 0.08 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.12 2dgj h ARG 99 Cb 0.88 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 2dgj h ARG 99 CO 0.08 0.37 -0.28 1.79 -1.51 0.00 0.00 179.97 180.42 2dgj h THR 100 N 0.28 1.25 -0.23 0.20 1.35 -1.08 0.13 112.91 114.80 2dgj h THR 100 Ca 0.09 -1.18 -0.06 0.00 -0.55 0.00 0.00 66.41 64.71 2dgj h THR 100 Cb 0.13 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 2dgj h THR 100 CO -0.01 0.36 -0.08 0.00 -0.25 0.00 0.00 175.52 175.53 2dgj h ALA 101 N 1.51 0.32 -0.29 6.62 0.00 -1.26 0.13 119.26 126.30 2dgj h ALA 101 Ca 0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2dgj h ALA 101 Cb 0.61 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2dgj h ALA 101 CO 0.04 0.14 0.12 -0.07 0.00 0.00 0.00 179.25 179.49 2dgj h LEU 102 N 0.19 0.40 -1.50 0.00 4.07 -1.05 0.12 115.31 117.53 2dgj h LEU 102 Ca 0.06 -0.16 0.04 0.00 0.08 0.00 0.00 57.88 57.90 2dgj h LEU 102 Cb 0.56 -0.10 -0.03 0.00 1.08 0.00 0.00 40.66 42.17 2dgj h LEU 102 CO 0.03 0.45 0.39 -0.08 -1.08 0.00 0.00 178.44 178.14 2dgj h GLU 103 N 0.32 0.62 -0.17 1.13 4.57 -0.64 0.73 114.58 121.14 2dgj h GLU 103 Ca 0.10 -0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 58.11 2dgj h GLU 103 Cb 0.17 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2dgj h GLU 103 CO -0.01 0.41 -0.41 0.78 -1.18 0.00 0.00 179.01 178.60 2dgj h GLY 104 N 0.64 0.63 1.92 1.92 0.00 0.03 -2.16 103.07 106.06 2dgj h GLY 104 Ca 0.24 -0.78 -0.05 0.00 0.00 0.00 0.00 47.33 46.74 2dgj h GLY 104 CO -0.07 0.70 -0.21 1.46 0.00 0.00 0.00 176.54 178.43 2dgj h GLN 105 N 0.23 0.09 -0.18 4.80 4.20 0.03 0.61 115.11 124.89 2dgj h GLN 105 Ca -0.00 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 2dgj h GLN 105 Cb 1.02 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 2dgj h GLN 105 CO 0.09 0.30 -0.06 0.82 -0.67 0.00 0.00 178.83 179.31 2dgj h ILE 106 N 0.09 1.30 -0.06 2.54 2.04 -0.79 -1.18 117.51 121.44 2dgj h ILE 106 Ca 0.02 -1.06 -0.08 0.00 1.00 0.00 0.00 64.86 64.74 2dgj h ILE 106 Cb 0.42 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 2dgj h ILE 106 CO 0.03 0.32 -0.32 0.78 0.00 0.00 0.00 178.15 178.96 2dgj h ASN 107 N 0.05 0.10 1.06 1.72 2.35 -0.85 -2.88 115.58 117.14 2dgj h ASN 107 Ca 0.04 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2dgj h ASN 107 Cb 0.51 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.85 2dgj h ASN 107 CO 0.02 0.43 -0.30 0.00 -1.65 0.00 0.00 177.43 175.93 2dgj n GLN 108 N -4.13 0.21 -1.86 0.81 3.00 0.16 -4.89 117.38 110.67 2dgj n GLN 108 Ca -0.02 0.11 -0.42 0.00 -0.01 0.00 0.00 57.00 56.67 2dgj n GLN 108 Cb 0.39 -1.68 -0.02 0.00 0.00 0.00 0.00 30.24 28.92 2dgj n GLN 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2dgj s ALA 109 N -3.10 3.77 -0.84 -1.58 0.00 -0.46 -4.92 121.76 114.63 2dgj s ALA 109 Ca 0.09 1.46 0.19 0.00 0.00 0.00 0.00 51.96 53.70 2dgj s ALA 109 Cb 0.14 -3.63 -0.21 0.00 0.00 0.00 0.00 23.12 19.42 2dgj s ALA 109 CO 0.65 -0.86 0.78 0.25 0.00 0.00 0.00 175.76 176.58 2dgj n THR 110 N 3.16 0.00 -4.25 0.00 -2.24 -1.26 -4.93 114.28 104.75 2dgj n THR 110 Ca 0.11 -0.08 -0.15 0.00 -2.27 0.00 0.00 64.05 61.66 2dgj n THR 110 Cb 0.38 0.94 -0.10 0.00 -2.10 0.00 0.00 70.33 69.45 2dgj n THR 110 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2dgj s THR 111 N -2.82 1.23 0.27 4.28 -4.23 -1.26 -4.92 115.64 108.19 2dgj s THR 111 Ca 0.06 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.55 2dgj s THR 111 Cb 0.14 -1.80 0.14 0.00 1.34 0.00 0.00 72.50 72.33 2dgj s THR 111 CO 0.78 -0.68 1.81 0.58 -0.54 0.00 0.00 174.62 176.56 2dgj h VAL 112 N 2.90 1.23 -0.63 2.29 2.07 -1.93 -1.59 116.25 120.59 2dgj h VAL 112 Ca -0.37 -0.87 -0.08 0.00 0.82 0.00 0.00 66.70 66.20 2dgj h VAL 112 Cb 1.19 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2dgj h VAL 112 CO 0.61 0.32 0.08 0.44 0.02 0.00 0.00 177.57 179.04 2dgj h ASP 113 N 0.79 1.00 -0.32 0.57 3.32 -1.99 -1.96 116.42 117.84 2dgj h ASP 113 Ca 0.17 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2dgj h ASP 113 Cb 0.34 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2dgj h ASP 113 CO 0.00 1.01 0.14 1.23 -1.72 0.00 0.00 179.24 179.91 2dgj h GLY 114 N 1.03 0.51 0.79 2.75 0.00 -1.82 -0.38 103.07 105.95 2dgj h GLY 114 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 2dgj h GLY 114 CO 0.02 0.25 -0.29 -2.08 0.00 0.00 0.00 176.54 174.44 2dgj h VAL 115 N 0.38 0.40 -0.83 4.60 2.07 -1.13 -0.01 116.25 121.72 2dgj h VAL 115 Ca 0.11 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.72 2dgj h VAL 115 Cb 0.15 0.40 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 2dgj h VAL 115 CO -0.01 0.00 0.54 0.78 0.02 0.00 0.00 177.57 178.90 2dgj h ASN 116 N -0.67 0.74 -0.53 0.57 2.35 -1.30 0.47 115.58 117.21 2dgj h ASN 116 Ca -0.04 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.67 2dgj h ASN 116 Cb 0.58 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.78 2dgj h ASN 116 CO 0.01 0.45 0.13 0.74 -1.65 0.00 0.00 177.43 177.11 2dgj h THR 117 N 0.83 1.24 -0.16 2.81 2.02 -0.52 0.27 112.91 119.40 2dgj h THR 117 Ca 0.38 -0.86 -0.16 0.00 0.77 0.00 0.00 66.41 66.53 2dgj h THR 117 Cb 0.37 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2dgj h THR 117 CO -0.15 0.32 -0.58 0.58 0.37 0.00 0.00 175.52 176.07 2dgj h VAL 118 N 0.86 1.33 -0.22 3.16 2.07 0.13 -1.42 116.25 122.16 2dgj h VAL 118 Ca 0.19 -1.86 -0.10 0.00 0.82 0.00 0.00 66.70 65.75 2dgj h VAL 118 Cb 0.32 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2dgj h VAL 118 CO 0.00 0.57 -0.28 0.50 0.02 0.00 0.00 177.57 178.38 2dgj h LYS 119 N 0.38 0.42 -0.21 1.57 3.64 0.52 -1.91 116.57 120.99 2dgj h LYS 119 Ca 0.00 -0.17 -0.07 0.00 -1.27 0.00 0.00 60.65 59.14 2dgj h LYS 119 Cb 1.12 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2dgj h LYS 119 CO 0.11 0.67 -0.15 1.15 -2.27 0.00 0.00 179.45 178.96 2dgj h THR 120 N 0.37 1.32 -0.32 1.00 2.02 -0.18 -2.77 112.91 114.34 2dgj h THR 120 Ca 0.05 -1.27 -0.07 0.00 0.77 0.00 0.00 66.41 65.90 2dgj h THR 120 Cb 0.69 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.77 2dgj h THR 120 CO 0.05 0.39 -0.09 0.78 0.37 0.00 0.00 175.52 177.02 2dgj h ASN 121 N 0.17 0.52 -0.65 4.18 2.35 -1.16 -2.11 115.58 118.88 2dgj h ASN 121 Ca 0.04 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 2dgj h ASN 121 Cb 0.67 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 2dgj h ASN 121 CO 0.04 0.65 0.29 0.00 -1.65 0.00 0.00 177.43 176.76 2dgj h ALA 122 N 1.41 0.84 -0.36 -0.83 0.00 -1.28 0.21 119.26 119.25 2dgj h ALA 122 Ca 0.10 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 2dgj h ALA 122 Cb 0.46 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2dgj h ALA 122 CO 0.03 0.43 -0.41 -0.91 0.00 0.00 0.00 179.25 178.39 2dgj h ASN 123 N 0.90 0.96 -0.09 0.00 4.21 -1.28 -1.64 115.58 118.65 2dgj h ASN 123 Ca 0.22 -0.45 -0.01 0.00 1.21 0.00 0.00 56.30 57.28 2dgj h ASN 123 Cb 0.16 -0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 37.09 2dgj h ASN 123 CO -0.02 1.24 0.03 0.74 -1.29 0.00 0.00 177.43 178.13 2dgj h THR 124 N 0.73 1.15 -0.36 2.81 2.02 -1.15 0.32 112.91 118.43 2dgj h THR 124 Ca 0.05 -0.44 0.01 0.00 0.77 0.00 0.00 66.41 66.81 2dgj h THR 124 Cb 1.00 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 2dgj h THR 124 CO 0.10 0.13 0.21 0.25 0.37 0.00 0.00 175.52 176.57 2dgj h LEU 125 N -0.02 0.34 -1.03 2.58 5.85 -0.95 -0.39 115.31 121.68 2dgj h LEU 125 Ca 0.03 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2dgj h LEU 125 Cb 0.17 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 2dgj h LEU 125 CO -0.00 0.25 0.53 -0.78 -0.34 0.00 0.00 178.44 178.09 2dgj h ASP 126 N 0.43 1.06 -0.76 1.25 3.58 -1.19 -2.11 116.42 118.67 2dgj h ASP 126 Ca 0.14 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 2dgj h ASP 126 Cb -0.00 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 40.75 2dgj h ASP 126 CO -0.06 0.81 0.37 1.23 -2.88 0.00 0.00 179.24 178.71 2dgj h GLY 127 N 1.22 1.16 -1.74 -0.78 0.00 -0.05 0.14 103.07 103.03 2dgj h GLY 127 Ca 0.32 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2dgj h GLY 127 CO -0.06 0.54 0.00 0.00 0.00 0.00 0.00 176.54 177.02 2dgj n ALA 128 N -2.38 1.81 0.00 3.60 0.00 -0.24 -1.70 120.51 121.60 2dgj n ALA 128 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2dgj n ALA 128 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2dgj n ALA 128 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2dgj n ASN 130 N 0.68 0.00 -0.12 0.00 4.05 0.04 -0.82 115.26 119.09 2dgj n ASN 130 Ca 0.00 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 54.92 2dgj n ASN 130 Cb 0.17 0.00 -0.03 0.00 1.23 0.00 0.00 39.78 41.15 2dgj n ASN 130 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 2dgj h SER 131 N 0.00 0.65 -0.39 1.20 0.02 -1.58 -1.43 113.55 112.02 2dgj h SER 131 Ca 0.00 -0.35 -0.05 0.00 -0.84 0.00 0.00 61.79 60.55 2dgj h SER 131 Cb 0.00 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2dgj h SER 131 CO 0.00 0.85 0.09 0.25 -1.14 0.00 0.00 176.83 176.88 2dgj h LEU 132 N 0.44 0.66 -0.50 5.07 5.85 -1.26 -0.88 115.31 124.68 2dgj h LEU 132 Ca 0.09 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 2dgj h LEU 132 Cb 0.55 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2dgj h LEU 132 CO 0.03 0.67 -0.05 -0.61 -0.34 0.00 0.00 178.44 178.14 2dgj h GLN 133 N 0.68 0.92 -0.24 1.25 5.75 -1.77 -3.00 115.11 118.70 2dgj h GLN 133 Ca 0.15 -0.32 -0.11 0.00 -0.15 0.00 0.00 58.65 58.22 2dgj h GLN 133 Cb 0.29 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 2dgj h GLN 133 CO 0.00 0.97 -0.32 0.78 -2.65 0.00 0.00 178.83 177.61 2dgj h GLY 134 N 0.78 0.55 2.00 2.39 0.00 -0.71 -2.77 103.07 105.31 2dgj h GLY 134 Ca 0.14 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2dgj h GLY 134 CO 0.04 0.45 -0.03 0.00 0.00 0.00 0.00 176.54 176.99 2dgj h ALA 135 N 1.22 1.39 -0.08 3.60 0.00 -1.04 -2.77 119.26 121.58 2dgj h ALA 135 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2dgj h ALA 135 Cb 0.77 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2dgj h ALA 135 CO 0.06 0.04 0.00 0.44 0.00 0.00 0.00 179.25 179.79 2dgj n ILE 136 N -3.68 1.78 0.38 0.00 -5.35 -1.09 -4.63 119.36 106.76 2dgj n ILE 136 Ca -0.03 -1.88 0.14 0.00 -0.27 0.00 0.00 62.75 60.71 2dgj n ILE 136 Cb 0.12 -0.07 0.50 0.00 -1.74 0.00 0.00 39.64 38.45 2dgj n ILE 136 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2dgj h ASN 137 N 0.56 0.00 -0.50 7.28 2.35 -1.22 -2.53 115.58 121.52 2dgj h ASN 137 Ca 0.00 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.66 2dgj h ASN 137 Cb 1.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.32 2dgj h ASN 137 CO 0.05 0.00 0.09 -0.90 -1.65 0.00 0.00 177.43 175.02 2dgj n ASP 138 N -2.61 4.47 0.01 5.81 5.68 -1.26 -4.75 116.55 123.90 2dgj n ASP 138 Ca 0.02 -3.15 -0.04 0.00 -0.50 0.00 0.00 54.79 51.12 2dgj n ASP 138 Cb 0.32 -0.65 -0.03 0.00 -1.14 0.00 0.00 41.12 39.62 2dgj n ASP 138 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2dgj h LYS 139 N 2.48 -0.16 -0.74 0.11 3.64 -1.77 -1.02 116.57 119.10 2dgj h LYS 139 Ca 0.11 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.65 2dgj h LYS 139 Cb 1.89 0.04 -0.10 0.00 -0.41 0.00 0.00 32.23 33.65 2dgj h LYS 139 CO 0.48 -0.11 0.28 -0.44 -2.27 0.00 0.00 179.45 177.39 2dgj h ASP 140 N -0.16 0.24 -0.36 4.20 3.32 -1.85 -1.47 116.42 120.33 2dgj h ASP 140 Ca 0.01 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2dgj h ASP 140 Cb 0.18 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 2dgj h ASP 140 CO -0.10 0.09 0.15 0.00 -1.72 0.00 0.00 179.24 177.66 2dgj h ALA 141 N 1.55 0.47 -0.90 3.45 0.00 -1.88 -2.51 119.26 119.43 2dgj h ALA 141 Ca 0.41 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.22 2dgj h ALA 141 Cb 0.62 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2dgj h ALA 141 CO -0.41 0.06 0.59 1.15 0.00 0.00 0.00 179.25 180.64 2dgj h THR 142 N 0.44 1.18 -0.02 0.00 2.02 -0.48 -2.14 112.91 113.91 2dgj h THR 142 Ca 0.12 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 66.85 2dgj h THR 142 Cb 0.17 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.48 2dgj h THR 142 CO -0.01 0.21 -0.24 -0.07 0.37 0.00 0.00 175.52 175.78 2dgj h LEU 143 N 1.17 0.03 -0.69 2.58 4.07 -1.03 -2.43 115.31 119.01 2dgj h LEU 143 Ca 0.35 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.30 2dgj h LEU 143 Cb -0.06 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2dgj h LEU 143 CO -0.10 0.27 -0.18 0.54 -1.08 0.00 0.00 178.44 177.89 2dgj n ARG 144 N -4.24 1.14 -3.24 1.13 1.74 -0.86 -4.53 116.66 107.81 2dgj n ARG 144 Ca -0.02 -0.69 -0.36 0.00 -0.77 0.00 0.00 57.85 56.00 2dgj n ARG 144 Cb 0.30 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 2dgj n ARG 144 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2dgj s ASN 145 N -2.34 6.98 0.54 0.55 3.84 -0.90 -4.95 114.94 118.67 2dgj s ASN 145 Ca 0.28 1.26 0.25 0.00 0.21 0.00 0.00 52.86 54.86 2dgj s ASN 145 Cb 0.20 -2.36 1.43 0.00 -0.55 0.00 0.00 41.25 39.97 2dgj s ASN 145 CO 0.46 0.12 2.02 -0.61 -2.79 0.00 0.00 177.10 176.30 2dgj h GLN 146 N 3.76 0.00 0.00 0.43 -0.00 -1.91 -0.39 115.11 117.00 2dgj h GLN 146 Ca -0.49 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.10 2dgj h GLN 146 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.67 2dgj h GLN 146 CO 0.65 0.00 -0.30 -0.97 0.00 0.00 0.00 178.83 178.21 2dgj h ASN 147 N 0.00 0.00 0.00 -0.69 -1.24 -1.88 0.02 115.58 111.79 2dgj h ASN 147 Ca 0.20 0.00 -0.15 0.00 0.71 0.00 0.00 56.30 57.06 2dgj h ASN 147 Cb 0.87 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.89 2dgj h ASN 147 CO -0.00 0.30 -0.91 0.22 -1.29 0.00 0.00 177.43 175.75 2dgj h TYR 148 N 0.00 0.00 -0.52 0.67 3.20 -1.31 -0.64 116.97 118.37 2dgj h TYR 148 Ca -0.00 0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.97 2dgj h TYR 148 Cb 0.59 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 38.77 2dgj h TYR 148 CO 0.00 1.12 -0.06 -0.07 -1.64 0.00 0.00 178.16 177.51 2dgj h LEU 149 N -1.00 -0.34 -2.21 2.82 4.07 -1.17 -1.02 115.31 116.46 2dgj h LEU 149 Ca -0.23 0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.87 2dgj h LEU 149 Cb 1.08 0.27 0.00 0.00 1.08 0.00 0.00 40.66 43.09 2dgj h LEU 149 CO -0.14 -0.13 0.00 0.47 -1.08 0.00 0.00 178.44 177.57 2dgj n ASP 150 N -5.30 3.31 -4.83 -0.43 8.00 -0.01 -4.91 116.55 112.37 2dgj n ASP 150 Ca 0.06 -2.37 -0.33 0.00 0.71 0.00 0.00 54.79 52.86 2dgj n ASP 150 Cb 0.29 -0.51 -0.04 0.00 -0.02 0.00 0.00 41.12 40.83 2dgj n ASP 150 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dgj s ALA 151 N -1.84 3.01 0.25 2.24 0.00 -0.39 -3.90 121.76 121.13 2dgj s ALA 151 Ca 0.31 0.33 -0.30 0.00 0.00 0.00 0.00 51.96 52.29 2dgj s ALA 151 Cb 0.21 -3.15 -0.14 0.00 0.00 0.00 0.00 23.12 20.04 2dgj s ALA 151 CO 0.12 -0.15 1.17 -0.25 0.00 0.00 0.00 175.76 176.65 2dgj n ASP 152 N -1.20 1.77 -0.34 0.00 8.00 -1.26 -4.61 116.55 118.91 2dgj n ASP 152 Ca 0.07 1.16 0.17 0.00 0.71 0.00 0.00 54.79 56.90 2dgj n ASP 152 Cb 0.54 -1.32 0.37 0.00 -0.02 0.00 0.00 41.12 40.69 2dgj n ASP 152 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2dgj h GLU 153 N 2.92 0.51 -0.51 -1.24 4.81 -1.94 0.24 114.58 119.37 2dgj h GLU 153 Ca -0.42 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.72 2dgj h GLU 153 Cb 1.32 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 2dgj h GLU 153 CO 0.67 0.34 0.11 0.66 -0.73 0.00 0.00 179.01 180.05 2dgj h SER 154 N 0.53 0.74 -0.23 1.04 4.64 -1.99 -0.93 113.55 117.34 2dgj h SER 154 Ca 0.63 -0.13 -0.09 0.00 -0.47 0.00 0.00 61.79 61.72 2dgj h SER 154 Cb 1.21 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2dgj h SER 154 CO -0.49 0.74 -0.22 0.11 -0.87 0.00 0.00 176.83 176.09 2dgj h LYS 155 N 0.76 0.56 -0.95 4.77 1.57 -0.92 -1.73 116.57 120.62 2dgj h LYS 155 Ca 0.17 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 2dgj h LYS 155 Cb 0.31 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.58 2dgj h LYS 155 CO 0.00 0.88 0.62 0.00 -0.57 0.00 0.00 179.45 180.38 2dgj h ARG 156 N 0.26 1.26 -0.43 3.15 3.08 -0.84 -2.08 114.38 118.78 2dgj h ARG 156 Ca 0.04 -0.09 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 2dgj h ARG 156 Cb 0.77 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 2dgj h ARG 156 CO 0.06 0.85 -0.18 -0.91 -1.07 0.00 0.00 179.97 178.71 2dgj h ASN 157 N 1.29 0.83 -0.54 7.04 4.21 -1.11 -1.77 115.58 125.53 2dgj h ASN 157 Ca 0.35 -0.29 -0.07 0.00 1.21 0.00 0.00 56.30 57.51 2dgj h ASN 157 Cb -0.13 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 36.82 2dgj h ASN 157 CO -0.07 1.00 0.10 0.00 -1.29 0.00 0.00 177.43 177.17 2dgj h ALA 158 N 1.07 1.08 -0.03 -0.83 0.00 -0.84 -1.29 119.26 118.41 2dgj h ALA 158 Ca 0.11 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2dgj h ALA 158 Cb 0.69 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2dgj h ALA 158 CO 0.05 0.60 -0.03 -0.92 0.00 0.00 0.00 179.25 178.96 2dgj h TYR 159 N 0.89 0.08 -0.84 0.00 3.20 -1.21 -1.53 116.97 117.56 2dgj h TYR 159 Ca 0.18 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.10 2dgj h TYR 159 Cb 0.38 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 2dgj h TYR 159 CO 0.02 0.54 0.55 1.15 -1.64 0.00 0.00 178.16 178.78 2dgj h THR 160 N -0.40 1.04 0.19 1.81 2.02 -1.22 -1.62 112.91 114.74 2dgj h THR 160 Ca 0.00 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.86 2dgj h THR 160 Cb 0.52 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2dgj h THR 160 CO 0.01 0.17 -0.09 -0.61 0.37 0.00 0.00 175.52 175.36 2dgj h GLN 161 N 0.92 -0.25 -0.37 6.66 4.15 -1.18 -1.56 115.11 123.47 2dgj h GLN 161 Ca 0.36 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.88 2dgj h GLN 161 Cb 0.24 0.06 -0.09 0.00 0.21 0.00 0.00 27.48 27.90 2dgj h GLN 161 CO -0.13 0.08 -0.24 0.00 -1.93 0.00 0.00 178.83 176.61 2dgj h ALA 162 N 0.11 -0.01 -0.78 3.38 0.00 -0.80 -0.08 119.26 121.08 2dgj h ALA 162 Ca -0.03 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2dgj h ALA 162 Cb 0.44 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2dgj h ALA 162 CO 0.04 -0.62 0.32 -0.39 0.00 0.00 0.00 179.25 178.60 2dgj h VAL 163 N -0.18 1.26 -0.18 0.00 -1.51 -1.34 -0.17 116.25 114.13 2dgj h VAL 163 Ca 0.18 -0.80 0.03 0.00 -1.23 0.00 0.00 66.70 64.88 2dgj h VAL 163 Cb 0.46 0.32 -0.03 0.00 -2.13 0.00 0.00 31.29 29.91 2dgj h VAL 163 CO -0.48 0.33 -0.02 0.74 -1.23 0.00 0.00 177.57 176.91 2dgj h THR 164 N 1.13 0.86 -0.23 7.19 2.02 -0.18 0.36 112.91 124.05 2dgj h THR 164 Ca 0.26 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.42 2dgj h THR 164 Cb 0.20 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2dgj h THR 164 CO -0.02 0.01 0.12 0.00 0.37 0.00 0.00 175.52 176.00 2dgj h ALA 165 N 1.16 0.30 -0.42 6.16 0.00 -0.79 -1.92 119.26 123.75 2dgj h ALA 165 Ca 0.08 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.00 2dgj h ALA 165 Cb 0.11 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 2dgj h ALA 165 CO -0.16 -0.16 -0.00 0.00 0.00 0.00 0.00 179.25 178.93 2dgj h ALA 166 N 1.00 0.39 -0.57 0.00 0.00 -0.40 -0.93 119.26 118.75 2dgj h ALA 166 Ca 0.08 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2dgj h ALA 166 Cb 0.08 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2dgj h ALA 166 CO -0.01 -0.39 0.31 0.93 0.00 0.00 0.00 179.25 180.09 2dgj h GLU 167 N 0.11 0.79 -0.58 0.00 5.08 -0.06 0.60 114.58 120.51 2dgj h GLU 167 Ca 0.21 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.39 2dgj h GLU 167 Cb 0.30 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 2dgj h GLU 167 CO -0.35 0.58 -0.02 0.78 -1.00 0.00 0.00 179.01 179.00 2dgj h GLY 168 N 0.86 1.12 1.56 -3.84 0.00 -0.42 -1.01 103.07 101.34 2dgj h GLY 168 Ca 0.20 -0.84 -0.13 0.00 0.00 0.00 0.00 47.33 46.57 2dgj h GLY 168 CO -0.03 0.77 -0.43 -2.22 0.00 0.00 0.00 176.54 174.63 2dgj h ILE 169 N 0.92 1.31 -0.10 2.60 2.04 -0.60 -3.29 117.51 120.39 2dgj h ILE 169 Ca 0.16 -1.60 -0.21 0.00 1.00 0.00 0.00 64.86 64.21 2dgj h ILE 169 Cb 0.58 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 2dgj h ILE 169 CO 0.03 0.50 -0.79 -0.07 0.00 0.00 0.00 178.15 177.82 2dgj h LEU 170 N 0.40 0.72 -8.57 1.44 4.07 -0.65 -3.44 115.31 109.29 2dgj h LEU 170 Ca 0.03 -0.49 -0.70 0.00 0.08 0.00 0.00 57.88 56.80 2dgj h LEU 170 Cb 0.91 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.42 2dgj h LEU 170 CO 0.08 1.27 1.32 -3.20 -1.08 0.00 0.00 178.44 176.82 2dgj n ASN 171 N -3.87 2.00 0.06 -0.43 2.85 -0.40 -4.77 115.26 110.69 2dgj n ASN 171 Ca -0.06 0.57 0.00 0.00 -0.11 0.00 0.00 54.58 54.98 2dgj n ASN 171 Cb 0.75 -1.19 0.31 0.00 1.24 0.00 0.00 39.78 40.89 2dgj n ASN 171 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 2dgj h LYS 172 N 11.00 0.37 0.06 1.20 1.57 -1.90 0.82 116.57 129.69 2dgj h LYS 172 Ca -0.28 -0.10 -0.27 0.00 -1.87 0.00 0.00 60.65 58.13 2dgj h LYS 172 Cb 1.33 -0.04 0.02 0.00 0.08 0.00 0.00 32.23 33.62 2dgj h LYS 172 CO 1.02 0.50 -1.11 1.96 -0.57 0.00 0.00 179.45 181.25 2dgj h GLN 173 N 0.34 0.54 0.00 3.15 4.20 -1.97 -1.03 115.11 120.35 2dgj h GLN 173 Ca 0.07 -0.66 0.00 0.00 0.06 0.00 0.00 58.65 58.11 2dgj h GLN 173 Cb 0.45 0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.43 2dgj h GLN 173 CO 0.03 1.27 -0.21 0.25 -0.67 0.00 0.00 178.83 179.50 2dgj n THR 174 N -3.76 0.00 -2.05 -0.54 -2.24 -1.20 -4.91 114.28 99.58 2dgj n THR 174 Ca -0.10 -0.40 -0.42 0.00 -2.27 0.00 0.00 64.05 60.86 2dgj n THR 174 Cb 0.92 0.98 -0.03 0.00 -2.10 0.00 0.00 70.33 70.11 2dgj n THR 174 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2dgj s GLY 175 N -1.39 1.94 0.84 3.38 0.00 0.28 -5.00 107.32 107.37 2dgj s GLY 175 Ca 0.01 1.26 -0.14 0.00 0.00 0.00 0.00 44.72 45.85 2dgj s GLY 175 CO 0.16 2.41 0.91 0.61 0.00 0.00 0.00 173.10 177.19 2dgj n GLY 176 N 3.19 -2.11 2.41 0.20 0.00 -1.26 -4.17 105.19 103.45 2dgj n GLY 176 Ca 0.11 -1.58 -0.39 0.00 0.00 0.00 0.00 46.02 44.16 2dgj n GLY 176 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2dgj n ASN 177 N -4.06 7.67 -4.72 1.61 5.15 -1.26 -4.42 115.26 115.22 2dgj n ASN 177 Ca 0.12 -2.61 -0.40 0.00 -0.60 0.00 0.00 54.58 51.09 2dgj n ASN 177 Cb 0.44 -1.55 0.02 0.00 -0.53 0.00 0.00 39.78 38.16 2dgj n ASN 177 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2dgj n THR 178 N 3.91 3.03 -2.29 -0.44 -1.04 -1.26 -4.94 114.28 111.25 2dgj n THR 178 Ca 0.72 -0.50 -0.28 0.00 -2.04 0.00 0.00 64.05 61.96 2dgj n THR 178 Cb 0.26 -1.63 0.03 0.00 -1.82 0.00 0.00 70.33 67.17 2dgj n THR 178 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2dgj s SER 179 N -0.67 5.65 0.19 8.00 1.04 -1.26 -4.90 113.70 121.75 2dgj s SER 179 Ca 0.65 0.85 -0.12 0.00 0.48 0.00 0.00 55.95 57.80 2dgj s SER 179 Cb -0.46 -1.83 0.16 0.00 0.10 0.00 0.00 66.02 63.98 2dgj s SER 179 CO 0.55 -1.07 1.79 0.50 0.98 0.00 0.00 173.24 175.99 2dgj h LYS 180 N -0.24 0.52 -0.71 4.02 1.63 -1.95 -0.58 116.57 119.25 2dgj h LYS 180 Ca -0.45 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 59.34 2dgj h LYS 180 Cb 1.25 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 32.72 2dgj h LYS 180 CO 0.61 0.34 0.45 0.00 -3.45 0.00 0.00 179.45 177.40 2dgj h ALA 181 N 1.29 0.93 -0.21 5.00 0.00 -1.99 -0.50 119.26 123.79 2dgj h ALA 181 Ca 0.24 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 2dgj h ALA 181 Cb 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2dgj h ALA 181 CO -0.17 0.23 -0.53 -0.44 0.00 0.00 0.00 179.25 178.34 2dgj h ASP 182 N 0.88 0.67 -0.27 0.00 3.32 -1.82 -0.41 116.42 118.79 2dgj h ASP 182 Ca 0.28 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2dgj h ASP 182 Cb 0.01 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2dgj h ASP 182 CO -0.11 1.07 0.17 0.58 -1.72 0.00 0.00 179.24 179.23 2dgj h VAL 183 N 0.47 1.08 -0.53 -1.35 2.07 -0.65 0.17 116.25 117.51 2dgj h VAL 183 Ca 0.01 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 2dgj h VAL 183 Cb 1.08 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 2dgj h VAL 183 CO 0.10 0.08 0.18 0.44 0.02 0.00 0.00 177.57 178.40 2dgj h ASP 184 N 0.35 0.71 -0.56 0.57 3.32 -0.94 0.15 116.42 120.02 2dgj h ASP 184 Ca 0.10 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2dgj h ASP 184 Cb -0.01 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 2dgj h ASP 184 CO -0.02 0.66 0.16 0.78 -1.72 0.00 0.00 179.24 179.10 2dgj h ASN 185 N 0.76 0.82 -0.53 6.45 2.35 -0.24 -1.21 115.58 123.99 2dgj h ASN 185 Ca 0.18 -0.22 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 2dgj h ASN 185 Cb 0.19 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2dgj h ASN 185 CO -0.01 0.83 0.14 0.00 -1.65 0.00 0.00 177.43 176.73 2dgj h ALA 186 N 1.03 0.70 0.12 -0.83 0.00 0.13 -1.81 119.26 118.59 2dgj h ALA 186 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2dgj h ALA 186 Cb 0.31 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2dgj h ALA 186 CO -0.00 0.38 -0.11 1.25 0.00 0.00 0.00 179.25 180.77 2dgj h LEU 187 N 0.74 -0.29 -1.20 0.00 5.85 -0.44 -2.17 115.31 117.80 2dgj h LEU 187 Ca 0.17 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.99 2dgj h LEU 187 Cb 0.32 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 2dgj h LEU 187 CO -0.00 -0.17 0.57 0.78 -0.34 0.00 0.00 178.44 179.28 2dgj h ASN 188 N -0.25 0.83 -0.13 1.25 2.35 -1.13 -1.53 115.58 116.98 2dgj h ASN 188 Ca 0.00 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2dgj h ASN 188 Cb 0.23 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 2dgj h ASN 188 CO -0.02 0.52 -0.02 0.00 -1.65 0.00 0.00 177.43 176.26 2dgj h ALA 189 N 1.54 0.09 0.11 -0.83 0.00 -0.73 -0.60 119.26 118.84 2dgj h ALA 189 Ca 0.39 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.34 2dgj h ALA 189 Cb 0.29 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2dgj h ALA 189 CO -0.15 -0.47 -0.05 0.28 0.00 0.00 0.00 179.25 178.85 2dgj h VAL 190 N 0.02 0.98 0.04 0.00 2.07 -0.87 -1.74 116.25 116.75 2dgj h VAL 190 Ca 0.06 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.25 2dgj h VAL 190 Cb 0.08 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 2dgj h VAL 190 CO -0.12 0.09 -0.28 0.74 0.02 0.00 0.00 177.57 178.02 2dgj h THR 191 N -0.32 0.38 -0.27 2.57 2.02 -1.14 -0.06 112.91 116.09 2dgj h THR 191 Ca -0.02 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.05 2dgj h THR 191 Cb 0.26 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2dgj h THR 191 CO 0.03 0.00 -0.32 0.03 0.37 0.00 0.00 175.52 175.63 2dgj h ARG 192 N -0.44 0.58 -0.44 6.66 3.08 -1.16 -1.64 114.38 121.02 2dgj h ARG 192 Ca 0.05 -0.26 -0.12 0.00 0.07 0.00 0.00 59.98 59.73 2dgj h ARG 192 Cb 0.51 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 2dgj h ARG 192 CO -0.22 0.83 -0.19 0.00 -1.07 0.00 0.00 179.97 179.32 2dgj h ALA 193 N 1.16 0.61 -0.42 0.04 0.00 -1.13 -2.39 119.26 117.13 2dgj h ALA 193 Ca 0.06 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 2dgj h ALA 193 Cb 0.79 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2dgj h ALA 193 CO 0.06 0.57 -0.28 -0.22 0.00 0.00 0.00 179.25 179.38 2dgj h LYS 194 N 0.73 0.93 0.00 0.00 3.64 -0.95 -2.48 116.57 118.45 2dgj h LYS 194 Ca 0.10 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 2dgj h LYS 194 Cb 0.75 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 2dgj h LYS 194 CO 0.06 1.10 0.00 0.00 -2.27 0.00 0.00 179.45 178.34 2dgj n ALA 195 N -2.52 1.83 0.02 5.00 0.00 -0.62 -2.56 120.51 121.66 2dgj n ALA 195 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 53.44 53.32 2dgj n ALA 195 Cb 0.49 -1.28 -0.10 0.00 0.00 0.00 0.00 19.45 18.56 2dgj n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dgj h ALA 196 N 2.65 0.67 -1.34 0.00 0.00 -0.95 -3.47 119.26 116.82 2dgj h ALA 196 Ca 0.00 -1.06 -0.76 0.00 0.00 0.00 0.00 54.91 53.09 2dgj h ALA 196 Cb 0.27 0.29 0.04 0.00 0.00 0.00 0.00 17.79 18.38 2dgj h ALA 196 CO 0.00 1.18 0.48 1.28 0.00 0.00 0.00 179.25 182.19 2dgj n LEU 197 N -3.02 1.26 -0.52 0.00 7.99 -1.06 -4.87 117.00 116.78 2dgj n LEU 197 Ca -0.10 1.13 0.06 0.00 -0.01 0.00 0.00 56.01 57.09 2dgj n LEU 197 Cb 0.92 -1.05 0.14 0.00 -0.11 0.00 0.00 43.42 43.32 2dgj n LEU 197 CO 0.44 -1.12 0.38 -0.46 -1.51 0.00 0.00 177.39 175.12 2dgj n ASN 198 N 3.10 1.66 -0.30 -1.43 6.94 -1.25 -4.79 115.26 119.19 2dgj n ASN 198 Ca 0.23 -3.18 0.08 0.00 -0.02 0.00 0.00 54.58 51.69 2dgj n ASN 198 Cb 0.10 -0.43 0.29 0.00 -2.36 0.00 0.00 39.78 37.38 2dgj n ASN 198 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 2dgj h GLY 199 N 0.55 1.37 0.95 4.83 0.00 -1.22 0.76 103.07 110.30 2dgj h GLY 199 Ca -0.03 -0.37 0.01 0.00 0.00 0.00 0.00 47.33 46.94 2dgj h GLY 199 CO 0.01 0.18 0.31 0.00 0.00 0.00 0.00 176.54 177.04 2dgj h ALA 200 N 1.55 0.62 -0.20 3.60 0.00 -1.79 -1.80 119.26 121.25 2dgj h ALA 200 Ca 0.44 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 55.15 2dgj h ALA 200 Cb 0.47 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2dgj h ALA 200 CO -0.20 0.03 -0.60 0.93 0.00 0.00 0.00 179.25 179.40 2dgj h GLU 201 N 0.63 0.66 -0.37 0.00 3.07 -1.59 -2.89 114.58 114.09 2dgj h GLU 201 Ca 0.19 -0.45 -0.03 0.00 -0.50 0.00 0.00 59.36 58.56 2dgj h GLU 201 Cb -0.03 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 2dgj h GLU 201 CO -0.06 1.07 0.08 -0.91 -1.40 0.00 0.00 179.01 177.79 2dgj h ASN 202 N 0.49 0.50 -0.34 1.42 2.35 -0.66 -2.03 115.58 117.32 2dgj h ASN 202 Ca -0.00 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 55.52 2dgj h ASN 202 Cb 1.18 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.42 2dgj h ASN 202 CO 0.12 0.51 -0.39 0.25 -1.65 0.00 0.00 177.43 176.27 2dgj h LEU 203 N 0.53 0.93 -0.30 1.61 5.85 -1.28 0.13 115.31 122.78 2dgj h LEU 203 Ca 0.12 -0.48 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 2dgj h LEU 203 Cb 0.22 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2dgj h LEU 203 CO -0.00 1.22 0.12 -0.09 -0.34 0.00 0.00 178.44 179.35 2dgj h ARG 204 N 0.65 0.44 -0.37 1.25 9.65 -1.28 -0.16 114.38 124.57 2dgj h ARG 204 Ca 0.05 -0.08 -0.11 0.00 -1.10 0.00 0.00 59.98 58.73 2dgj h ARG 204 Cb 0.99 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.48 2dgj h ARG 204 CO 0.09 0.46 -0.23 -0.91 2.80 0.00 0.00 179.97 182.18 2dgj h ASN 205 N 0.33 0.74 -0.40 -3.80 2.35 -1.35 -2.25 115.58 111.20 2dgj h ASN 205 Ca 0.10 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2dgj h ASN 205 Cb 0.18 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2dgj h ASN 205 CO -0.01 0.95 0.24 0.00 -1.65 0.00 0.00 177.43 176.96 2dgj h ALA 206 N 1.10 0.51 -0.26 -0.83 0.00 -0.42 -1.42 119.26 117.95 2dgj h ALA 206 Ca 0.09 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2dgj h ALA 206 Cb 0.73 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2dgj h ALA 206 CO 0.06 0.02 -0.18 0.87 0.00 0.00 0.00 179.25 180.02 2dgj h LYS 207 N 0.53 0.46 -0.04 0.00 1.57 -0.91 -1.71 116.57 116.46 2dgj h LYS 207 Ca 0.14 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2dgj h LYS 207 Cb 0.02 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2dgj h LYS 207 CO -0.03 0.62 -0.03 1.15 -0.57 0.00 0.00 179.45 180.60 2dgj h THR 208 N 0.42 1.35 -0.24 -0.16 2.02 -1.00 -1.40 112.91 113.90 2dgj h THR 208 Ca 0.07 -1.10 -0.12 0.00 0.77 0.00 0.00 66.41 66.03 2dgj h THR 208 Cb 0.55 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 68.96 2dgj h THR 208 CO 0.04 0.30 -0.36 0.77 0.37 0.00 0.00 175.52 176.64 2dgj h SER 209 N -0.34 0.55 -0.49 4.18 4.64 -1.25 -1.44 113.55 119.40 2dgj h SER 209 Ca 0.01 -0.23 -0.13 0.00 -0.47 0.00 0.00 61.79 60.97 2dgj h SER 209 Cb 0.49 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 2dgj h SER 209 CO 0.01 0.86 -0.20 0.00 -0.87 0.00 0.00 176.83 176.63 2dgj h ALA 210 N 1.17 0.69 -0.37 5.18 0.00 -1.34 -0.16 119.26 124.43 2dgj h ALA 210 Ca 0.05 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 2dgj h ALA 210 Cb 0.83 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2dgj h ALA 210 CO 0.07 0.67 -0.10 1.15 0.00 0.00 0.00 179.25 181.04 2dgj h THR 211 N 0.87 1.28 -0.15 0.00 2.02 -1.08 -1.01 112.91 114.84 2dgj h THR 211 Ca 0.12 -1.18 -0.11 0.00 0.77 0.00 0.00 66.41 66.00 2dgj h THR 211 Cb 0.78 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 2dgj h THR 211 CO 0.06 0.39 -0.40 0.78 0.37 0.00 0.00 175.52 176.72 2dgj h ASN 212 N 0.52 0.35 -0.25 4.18 2.35 -1.20 -1.91 115.58 119.62 2dgj h ASN 212 Ca 0.09 -0.15 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 2dgj h ASN 212 Cb 0.62 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.89 2dgj h ASN 212 CO 0.04 0.72 -0.34 0.71 -1.65 0.00 0.00 177.43 176.91 2dgj h THR 213 N 0.28 1.31 -0.42 2.81 1.35 -0.88 -2.94 112.91 114.41 2dgj h THR 213 Ca 0.03 -1.53 -0.01 0.00 -0.55 0.00 0.00 66.41 64.35 2dgj h THR 213 Cb 0.83 1.70 -0.02 0.00 -1.73 0.00 0.00 68.15 68.93 2dgj h THR 213 CO 0.07 0.48 0.24 0.40 -0.25 0.00 0.00 175.52 176.46 2dgj h ILE 214 N 0.39 1.15 -0.43 6.82 2.04 -1.07 -2.36 117.51 124.04 2dgj h ILE 214 Ca 0.03 -0.38 0.11 0.00 1.00 0.00 0.00 64.86 65.62 2dgj h ILE 214 Cb 0.92 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 2dgj h ILE 214 CO 0.08 0.16 0.31 0.78 0.00 0.00 0.00 178.15 179.47 2dgj h ASN 215 N 0.55 0.10 -0.24 1.72 2.35 -1.33 -2.04 115.58 116.69 2dgj h ASN 215 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2dgj h ASN 215 Cb 0.04 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.39 2dgj h ASN 215 CO -0.02 0.06 0.00 0.61 -1.65 0.00 0.00 177.43 176.42 2dgj n GLY 216 N -1.59 0.86 3.74 2.83 0.00 -0.91 -4.95 105.19 105.17 2dgj n GLY 216 Ca 0.07 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 2dgj n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dgj s LEU 217 N -1.58 4.47 0.27 0.99 1.02 -0.77 -4.96 118.68 118.12 2dgj s LEU 217 Ca 0.34 2.15 0.14 0.00 0.02 0.00 0.00 54.13 56.79 2dgj s LEU 217 Cb 0.20 -3.60 0.11 0.00 0.02 0.00 0.00 46.19 42.91 2dgj s LEU 217 CO 0.29 -0.30 1.46 1.55 0.02 0.00 0.00 176.35 179.37 2dgj h PRO 218 N 5.23 0.00 -0.03 1.29 0.13 -1.92 -3.31 132.00 133.39 2dgj h PRO 218 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dgj h PRO 218 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dgj h PRO 218 CO 0.74 0.55 0.00 0.27 -0.23 0.00 0.00 178.00 179.33 2dgj n ASN 219 N -3.28 0.70 -4.54 1.44 6.94 -1.26 -4.88 115.26 110.37 2dgj n ASN 219 Ca 0.01 -1.32 -0.33 0.00 -0.02 0.00 0.00 54.58 52.93 2dgj n ASN 219 Cb 0.73 -0.01 -0.12 0.00 -2.36 0.00 0.00 39.78 38.02 2dgj n ASN 219 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2dgj s LEU 220 N -1.88 2.99 0.79 -4.53 1.02 -1.25 -4.60 118.68 111.22 2dgj s LEU 220 Ca 0.40 -0.10 -0.12 0.00 0.02 0.00 0.00 54.13 54.33 2dgj s LEU 220 Cb 0.20 -1.64 0.06 0.00 0.02 0.00 0.00 46.19 44.83 2dgj s LEU 220 CO 0.32 0.35 1.12 0.42 0.02 0.00 0.00 176.35 178.58 2dgj s THR 221 N -0.80 2.83 0.14 5.49 -4.23 -1.26 -4.89 115.64 112.92 2dgj s THR 221 Ca 0.12 0.27 -0.15 0.00 -1.18 0.00 0.00 61.69 60.75 2dgj s THR 221 Cb -0.11 -3.15 0.01 0.00 1.34 0.00 0.00 72.50 70.59 2dgj s THR 221 CO 0.02 -0.35 1.67 -0.61 -0.54 0.00 0.00 174.62 174.80 2dgj h GLN 222 N -1.00 0.68 0.00 3.99 4.15 -1.99 -2.21 115.11 118.74 2dgj h GLN 222 Ca -0.47 -0.14 -0.06 0.00 0.77 0.00 0.00 58.65 58.75 2dgj h GLN 222 Cb 1.29 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.86 2dgj h GLN 222 CO 0.63 0.65 -0.29 1.37 -1.93 0.00 0.00 178.83 179.25 2dgj h LEU 223 N 0.58 0.00 -0.80 -2.39 8.10 -1.99 -0.83 115.31 117.98 2dgj h LEU 223 Ca 0.14 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 58.03 2dgj h LEU 223 Cb 0.25 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.45 2dgj h LEU 223 CO -0.01 0.29 -0.21 1.56 -4.11 0.00 0.00 178.44 175.97 2dgj h GLN 224 N 0.00 0.68 -0.42 0.17 4.20 -1.86 -1.06 115.11 116.82 2dgj h GLN 224 Ca -0.00 -0.26 -0.11 0.00 0.06 0.00 0.00 58.65 58.34 2dgj h GLN 224 Cb 0.58 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2dgj h GLN 224 CO 0.04 0.84 -0.18 0.87 -0.67 0.00 0.00 178.83 179.72 2dgj h LYS 225 N 0.60 0.81 0.22 1.46 1.57 -0.66 -2.15 116.57 118.42 2dgj h LYS 225 Ca 0.09 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 2dgj h LYS 225 Cb 0.68 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2dgj h LYS 225 CO 0.05 0.93 -0.11 -0.44 -0.57 0.00 0.00 179.45 179.31 2dgj h ASP 226 N 0.71 -0.25 -0.00 0.86 3.32 -0.62 0.19 116.42 120.63 2dgj h ASP 226 Ca 0.11 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.12 2dgj h ASP 226 Cb 0.69 0.07 -0.06 0.00 0.22 0.00 0.00 39.33 40.25 2dgj h ASP 226 CO 0.05 -0.10 -0.50 -1.13 -1.72 0.00 0.00 179.24 175.85 2dgj h ASN 227 N -0.40 -1.53 -0.74 6.45 -1.24 -1.11 0.99 115.58 117.99 2dgj h ASN 227 Ca -0.03 0.18 0.06 0.00 0.71 0.00 0.00 56.30 57.22 2dgj h ASN 227 Cb 0.30 0.59 -0.06 0.00 0.73 0.00 0.00 38.32 39.88 2dgj h ASN 227 CO 0.05 -0.51 0.44 -0.07 -1.29 0.00 0.00 177.43 176.05 2dgj h LEU 228 N -0.64 0.67 -1.20 0.34 4.07 -1.33 -0.25 115.31 116.96 2dgj h LEU 228 Ca 0.03 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 2dgj h LEU 228 Cb 0.71 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.30 2dgj h LEU 228 CO -0.35 0.43 0.38 0.11 -1.08 0.00 0.00 178.44 177.93 2dgj h LYS 229 N 0.80 0.93 -0.31 1.13 1.57 0.01 -0.44 116.57 120.26 2dgj h LYS 229 Ca 0.33 -0.09 -0.14 0.00 -1.87 0.00 0.00 60.65 58.87 2dgj h LYS 229 Cb 0.18 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2dgj h LYS 229 CO -0.18 0.68 -0.39 1.25 -0.57 0.00 0.00 179.45 180.24 2dgj h HIS 230 N 0.94 0.88 -0.17 -1.35 2.76 0.21 -1.10 115.15 117.32 2dgj h HIS 230 Ca 0.24 -0.26 -0.05 0.00 -2.20 0.00 0.00 60.37 58.11 2dgj h HIS 230 Cb 0.01 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.77 2dgj h HIS 230 CO 0.01 1.01 -0.10 1.96 -1.30 0.00 0.00 177.93 179.50 2dgj h GLN 231 N 0.60 0.26 -0.26 5.26 4.20 -0.13 -1.21 115.11 123.85 2dgj h GLN 231 Ca 0.05 -0.06 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 2dgj h GLN 231 Cb 0.93 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.67 2dgj h GLN 231 CO 0.08 0.38 -0.58 0.28 -0.67 0.00 0.00 178.83 178.32 2dgj h VAL 232 N 0.25 1.28 -0.78 -0.54 2.07 -0.73 -2.25 116.25 115.55 2dgj h VAL 232 Ca 0.05 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 65.80 2dgj h VAL 232 Cb 0.35 1.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 2dgj h VAL 232 CO 0.02 0.57 0.50 -0.08 0.02 0.00 0.00 177.57 178.61 2dgj h GLU 233 N 0.62 1.03 0.00 1.57 4.22 -0.21 -2.71 114.58 119.11 2dgj h GLU 233 Ca 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.38 2dgj h GLU 233 Cb 1.18 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2dgj h GLU 233 CO 0.12 0.69 -0.55 1.04 -2.18 0.00 0.00 179.01 178.14 2dgj n GLN 234 N -4.41 0.11 -1.71 1.92 6.02 -0.55 -4.93 117.38 113.83 2dgj n GLN 234 Ca 0.08 0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.69 2dgj n GLN 234 Cb 0.04 -1.57 0.01 0.00 1.02 0.00 0.00 30.24 29.74 2dgj n GLN 234 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2dgj n ALA 235 N -1.63 1.45 0.44 -1.58 0.00 -0.85 -4.93 120.51 113.41 2dgj n ALA 235 Ca 0.05 0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.87 2dgj n ALA 235 Cb 0.38 -2.29 -0.15 0.00 0.00 0.00 0.00 19.45 17.39 2dgj n ALA 235 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2dgj n GLN 236 N 0.07 0.38 -4.05 0.00 6.02 -1.26 -4.96 117.38 113.58 2dgj n GLN 236 Ca 0.06 -0.11 -0.10 0.00 -0.01 0.00 0.00 57.00 56.84 2dgj n GLN 236 Cb 0.39 -1.51 -0.07 0.00 1.02 0.00 0.00 30.24 30.07 2dgj n GLN 236 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2dgj s ASN 237 N -3.83 0.04 0.13 1.08 4.22 -1.26 -5.02 114.94 110.29 2dgj s ASN 237 Ca -0.01 -1.05 -0.28 0.00 -2.14 0.00 0.00 52.86 49.38 2dgj s ASN 237 Cb 0.15 0.47 -0.05 0.00 1.28 0.00 0.00 41.25 43.09 2dgj s ASN 237 CO 0.89 -0.96 1.60 0.58 -2.04 0.00 0.00 177.10 177.17 2dgj h VAL 238 N 2.48 0.25 -0.50 3.54 2.07 -1.92 -1.80 116.25 120.37 2dgj h VAL 238 Ca -0.31 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.28 2dgj h VAL 238 Cb 1.24 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 2dgj h VAL 238 CO 0.46 0.00 0.34 -0.37 0.02 0.00 0.00 177.57 178.01 2dgj h VAL 239 N -0.49 0.94 -0.63 2.57 -1.51 -1.98 0.86 116.25 116.02 2dgj h VAL 239 Ca 0.07 -0.13 -0.05 0.00 -1.23 0.00 0.00 66.70 65.36 2dgj h VAL 239 Cb 0.59 0.53 -0.03 0.00 -2.13 0.00 0.00 31.29 30.25 2dgj h VAL 239 CO -0.30 0.07 0.20 1.23 -1.23 0.00 0.00 177.57 177.54 2dgj h GLY 240 N 0.38 1.05 0.78 5.19 0.00 -1.77 -0.06 103.07 108.63 2dgj h GLY 240 Ca 0.22 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2dgj h GLY 240 CO -0.05 0.58 -0.06 -2.08 0.00 0.00 0.00 176.54 174.93 2dgj h VAL 241 N 0.90 1.01 0.00 4.60 2.07 -0.17 -2.97 116.25 121.69 2dgj h VAL 241 Ca 0.20 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2dgj h VAL 241 Cb 0.29 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 2dgj h VAL 241 CO -0.01 0.12 -0.06 0.78 0.02 0.00 0.00 177.57 178.42 2dgj h ASN 242 N -0.38 0.00 -0.27 0.57 -0.26 -0.91 -1.76 115.58 112.57 2dgj h ASN 242 Ca -0.02 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.58 2dgj h ASN 242 Cb 0.31 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 2dgj h ASN 242 CO 0.03 0.06 -0.37 1.23 -1.06 0.00 0.00 177.43 177.32 2dgj h GLY 243 N 0.46 0.88 0.85 2.83 0.00 -0.85 -1.21 103.07 106.03 2dgj h GLY 243 Ca -0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 47.33 46.37 2dgj h GLY 243 CO 0.01 0.79 -0.17 -2.08 0.00 0.00 0.00 176.54 175.10 2dgj h VAL 244 N 0.67 1.31 -0.33 4.60 2.07 -1.24 -1.87 116.25 121.46 2dgj h VAL 244 Ca 0.06 -1.29 0.03 0.00 0.82 0.00 0.00 66.70 66.32 2dgj h VAL 244 Cb 0.93 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.32 2dgj h VAL 244 CO 0.09 0.40 0.13 0.50 0.02 0.00 0.00 177.57 178.70 2dgj h LYS 245 N 0.22 0.27 -0.92 1.57 3.11 -1.27 -0.87 116.57 118.68 2dgj h LYS 245 Ca 0.04 -0.02 0.01 0.00 -2.81 0.00 0.00 60.65 57.87 2dgj h LYS 245 Cb 0.69 -0.06 -0.05 0.00 -1.00 0.00 0.00 32.23 31.81 2dgj h LYS 245 CO 0.04 0.18 0.60 -0.44 -2.81 0.00 0.00 179.45 177.02 2dgj h ASP 246 N 0.28 1.07 -0.15 4.20 3.32 -1.18 -0.19 116.42 123.77 2dgj h ASP 246 Ca 0.14 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2dgj h ASP 246 Cb 0.09 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 2dgj h ASP 246 CO -0.13 0.79 0.08 0.50 -1.72 0.00 0.00 179.24 178.76 2dgj h LYS 247 N 1.26 0.24 -0.02 3.56 3.64 -0.53 -1.33 116.57 123.39 2dgj h LYS 247 Ca 0.34 -0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 59.53 2dgj h LYS 247 Cb -0.12 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2dgj h LYS 247 CO -0.07 0.19 -0.75 0.78 -2.27 0.00 0.00 179.45 177.33 2dgj h GLY 248 N 0.33 0.16 2.00 5.01 0.00 0.30 -2.86 103.07 108.01 2dgj h GLY 248 Ca 0.06 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 2dgj h GLY 248 CO -0.01 0.22 -0.16 3.43 0.00 0.00 0.00 176.54 180.02 2dgj h ASN 249 N 0.09 0.00 0.21 0.19 -0.26 -0.29 -3.17 115.58 112.36 2dgj h ASN 249 Ca -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 2dgj h ASN 249 Cb 1.32 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.58 2dgj h ASN 249 CO 0.11 0.16 -1.07 0.18 -1.06 0.00 0.00 177.43 175.75 2dgj n LEU 250 N -3.20 0.68 -4.71 1.61 4.32 -0.94 -4.95 117.00 109.81 2dgj n LEU 250 Ca 0.02 -0.21 -0.42 0.00 -0.02 0.00 0.00 56.01 55.38 2dgj n LEU 250 Cb 0.51 -0.06 -0.03 0.00 -1.62 0.00 0.00 43.42 42.21 2dgj n LEU 250 CO 0.34 0.13 1.16 -1.61 -1.22 0.00 0.00 177.39 176.19 2dgj s GLU 251 N -3.13 4.26 0.00 3.23 2.02 -1.08 -5.11 118.70 118.89 2dgj s GLU 251 Ca 0.05 2.20 0.00 0.00 0.02 0.00 0.00 54.97 57.24 2dgj s GLU 251 Cb 0.15 -3.29 0.00 0.00 0.10 0.00 0.00 34.13 31.10 2dgj s GLU 251 CO 0.83 -0.55 0.00 0.72 0.02 0.00 0.00 175.26 176.28