#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q80 n THR 7 N 0.00 0.46 -0.48 2.62 -2.24 -1.26 -3.60 114.28 109.78 2q80 n THR 7 Ca 0.00 -0.10 0.39 0.00 -2.27 0.00 0.00 64.05 62.07 2q80 n THR 7 Cb 0.00 -0.65 0.69 0.00 -2.10 0.00 0.00 70.33 68.27 2q80 n THR 7 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2q80 h VAL 8 N 0.00 0.15 0.00 2.28 2.07 -2.05 0.37 116.25 119.07 2q80 h VAL 8 Ca 0.00 -0.03 -0.13 0.00 0.82 0.00 0.00 66.70 67.37 2q80 h VAL 8 Cb 0.59 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2q80 h VAL 8 CO 0.00 0.01 -0.61 1.56 0.02 0.00 0.00 177.57 178.55 2q80 h GLN 9 N 0.08 0.00 -0.27 1.57 4.20 -1.99 -2.11 115.11 116.59 2q80 h GLN 9 Ca 0.81 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 59.45 2q80 h GLN 9 Cb 2.74 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 30.51 2q80 h GLN 9 CO -0.28 0.61 -0.08 -0.09 -0.67 0.00 0.00 178.83 178.32 2q80 h ARG 10 N 0.00 0.52 -0.45 1.46 2.43 -0.52 -0.38 114.38 117.44 2q80 h ARG 10 Ca -0.01 -0.21 -0.05 0.00 -0.81 0.00 0.00 59.98 58.90 2q80 h ARG 10 Cb 1.20 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 2q80 h ARG 10 CO 0.08 0.75 0.08 0.82 -1.51 0.00 0.00 179.97 180.18 2q80 h ILE 11 N 0.27 1.24 -0.68 1.20 2.04 -1.45 -1.85 117.51 118.29 2q80 h ILE 11 Ca 0.07 -0.89 0.01 0.00 1.00 0.00 0.00 64.86 65.05 2q80 h ILE 11 Cb 0.56 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2q80 h ILE 11 CO 0.03 0.31 0.45 -0.07 0.00 0.00 0.00 178.15 178.87 2q80 h LEU 12 N 0.61 0.76 -1.30 1.44 3.38 -1.35 -3.04 115.31 115.80 2q80 h LEU 12 Ca 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2q80 h LEU 12 Cb 0.37 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2q80 h LEU 12 CO 0.01 0.55 0.00 0.18 0.09 0.00 0.00 178.44 179.26 2q80 n LEU 13 N -4.63 1.97 -0.10 1.67 4.77 -0.16 -4.41 117.00 116.11 2q80 n LEU 13 Ca 0.06 -0.81 -0.12 0.00 -0.03 0.00 0.00 56.01 55.12 2q80 n LEU 13 Cb 0.03 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 2q80 n LEU 13 CO 0.35 0.40 0.69 -0.08 -1.33 0.00 0.00 177.39 177.43 2q80 h GLU 14 N 2.65 0.55 -0.56 3.23 4.81 -1.22 0.32 114.58 124.37 2q80 h GLU 14 Ca 0.00 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 58.98 2q80 h GLU 14 Cb 0.58 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 2q80 h GLU 14 CO 0.00 0.77 0.24 -1.35 -0.73 0.00 0.00 179.01 177.94 2q80 h PRO 15 N 0.31 0.80 -0.23 0.92 0.11 -1.80 0.23 132.00 132.33 2q80 h PRO 15 Ca 0.07 -0.11 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 2q80 h PRO 15 Cb 0.58 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 2q80 h PRO 15 CO 0.03 0.64 -0.09 -0.92 -0.21 0.00 0.00 178.00 177.45 2q80 h TYR 16 N 0.79 0.53 -0.85 0.65 3.20 -1.77 -1.29 116.97 118.24 2q80 h TYR 16 Ca 0.19 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2q80 h TYR 16 Cb 0.13 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 2q80 h TYR 16 CO 0.01 0.73 0.54 0.87 -1.64 0.00 0.00 178.16 178.66 2q80 h LYS 17 N 0.19 1.14 -0.63 1.82 1.57 -0.53 -1.11 116.57 119.01 2q80 h LYS 17 Ca 0.05 -0.09 0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2q80 h LYS 17 Cb 0.58 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 2q80 h LYS 17 CO 0.03 0.77 0.35 -0.92 -0.57 0.00 0.00 179.45 179.12 2q80 h TYR 18 N 1.16 0.65 -0.13 -1.35 3.20 -0.04 -2.13 116.97 118.33 2q80 h TYR 18 Ca 0.31 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.16 2q80 h TYR 18 Cb -0.09 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 37.97 2q80 h TYR 18 CO 0.00 0.32 -0.12 1.25 -1.64 0.00 0.00 178.16 177.97 2q80 h LEU 19 N 0.66 0.19 -1.12 2.82 5.85 -0.07 -2.71 115.31 120.94 2q80 h LEU 19 Ca 0.28 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2q80 h LEU 19 Cb 0.16 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2q80 h LEU 19 CO -0.17 0.34 0.00 0.18 -0.34 0.00 0.00 178.44 178.45 2q80 n LEU 20 N -4.30 0.45 0.25 2.25 4.77 -0.80 -1.40 117.00 118.23 2q80 n LEU 20 Ca -0.01 0.71 0.14 0.00 -0.03 0.00 0.00 56.01 56.82 2q80 n LEU 20 Cb 0.25 -0.76 0.55 0.00 -2.33 0.00 0.00 43.42 41.14 2q80 n LEU 20 CO 0.37 -0.85 0.91 1.56 -1.33 0.00 0.00 177.39 178.05 2q80 h GLN 21 N 0.00 0.00 -7.06 3.23 4.20 -1.57 -3.46 115.11 110.45 2q80 h GLN 21 Ca 0.00 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.22 2q80 h GLN 21 Cb 0.01 0.00 0.05 0.00 0.30 0.00 0.00 27.48 27.84 2q80 h GLN 21 CO 0.00 0.08 0.42 -0.51 -0.67 0.00 0.00 178.83 178.15 2q80 s LEU 22 N -6.40 3.86 0.65 1.46 1.02 -0.49 -5.04 118.68 113.74 2q80 s LEU 22 Ca 0.01 2.08 -0.18 0.00 0.02 0.00 0.00 54.13 56.07 2q80 s LEU 22 Cb 0.09 -4.50 -0.01 0.00 0.02 0.00 0.00 46.19 41.79 2q80 s LEU 22 CO 0.59 -0.94 1.18 -2.65 0.02 0.00 0.00 176.35 174.55 2q80 n PRO 23 N -0.96 0.97 0.00 1.29 -0.02 -1.26 -4.55 135.00 130.48 2q80 n PRO 23 Ca 0.10 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2q80 n PRO 23 Cb 0.51 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2q80 n PRO 23 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q80 n GLY 24 N 1.02 1.21 0.30 -1.23 0.00 -1.26 -4.94 105.19 100.29 2q80 n GLY 24 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 2q80 n GLY 24 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2q80 h LYS 25 N 0.00 0.97 -0.51 1.61 3.64 -1.97 -3.10 116.57 117.21 2q80 h LYS 25 Ca 0.00 -0.31 0.07 0.00 -1.27 0.00 0.00 60.65 59.14 2q80 h LYS 25 Cb 0.00 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 2q80 h LYS 25 CO 0.00 0.98 0.17 0.37 -2.27 0.00 0.00 179.45 178.70 2q80 h GLN 26 N 0.89 0.33 -0.30 1.90 4.15 -1.95 -0.25 115.11 119.88 2q80 h GLN 26 Ca 0.16 -0.02 -0.14 0.00 0.77 0.00 0.00 58.65 59.41 2q80 h GLN 26 Cb 0.56 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.17 2q80 h GLN 26 CO 0.03 0.22 -0.39 0.28 -1.93 0.00 0.00 178.83 177.05 2q80 h VAL 27 N 0.34 1.29 -0.67 2.39 2.07 -1.99 -2.04 116.25 117.63 2q80 h VAL 27 Ca 0.25 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.20 2q80 h VAL 27 Cb 0.28 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 2q80 h VAL 27 CO -0.26 0.50 0.39 0.03 0.02 0.00 0.00 177.57 178.25 2q80 h ARG 28 N 0.59 0.92 -0.71 1.57 3.08 -1.32 -2.08 114.38 116.43 2q80 h ARG 28 Ca 0.05 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2q80 h ARG 28 Cb 0.92 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 2q80 h ARG 28 CO 0.08 0.67 0.28 1.15 -1.07 0.00 0.00 179.97 181.09 2q80 h THR 29 N 0.92 1.25 -0.39 2.04 2.02 -0.83 -2.34 112.91 115.58 2q80 h THR 29 Ca 0.24 -0.78 -0.03 0.00 0.77 0.00 0.00 66.41 66.60 2q80 h THR 29 Cb 0.00 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 2q80 h THR 29 CO -0.04 0.31 0.12 0.11 0.37 0.00 0.00 175.52 176.39 2q80 h LYS 30 N 1.02 0.61 -0.88 6.66 1.79 -1.00 -2.02 116.57 122.75 2q80 h LYS 30 Ca 0.24 -0.13 -0.02 0.00 -2.18 0.00 0.00 60.65 58.56 2q80 h LYS 30 Cb 0.22 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.74 2q80 h LYS 30 CO -0.02 0.61 0.48 -0.07 -1.08 0.00 0.00 179.45 179.38 2q80 h LEU 31 N 0.49 1.10 0.04 2.94 3.38 -1.28 0.14 115.31 122.11 2q80 h LEU 31 Ca 0.13 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2q80 h LEU 31 Cb 0.26 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2q80 h LEU 31 CO -0.00 0.88 -0.02 -1.28 0.09 0.00 0.00 178.44 178.10 2q80 h SER 32 N 1.23 -0.05 -0.44 -0.43 0.87 -1.19 -0.96 113.55 112.57 2q80 h SER 32 Ca 0.31 -0.08 0.06 0.00 -1.23 0.00 0.00 61.79 60.85 2q80 h SER 32 Cb 0.03 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 61.95 2q80 h SER 32 CO -0.05 0.05 0.14 1.56 -0.53 0.00 0.00 176.83 178.00 2q80 h GLN 33 N -0.14 0.30 -0.12 2.24 4.20 -1.10 -1.43 115.11 119.04 2q80 h GLN 33 Ca -0.01 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2q80 h GLN 33 Cb 0.13 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2q80 h GLN 33 CO 0.01 0.20 0.06 0.00 -0.67 0.00 0.00 178.83 178.42 2q80 h ALA 34 N 1.30 0.16 0.00 3.87 0.00 -0.47 -2.31 119.26 121.81 2q80 h ALA 34 Ca 0.21 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2q80 h ALA 34 Cb 0.22 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2q80 h ALA 34 CO -0.23 -0.27 -0.08 0.74 0.00 0.00 0.00 179.25 179.41 2q80 h PHE 35 N 0.07 0.00 0.00 0.00 0.04 -1.10 -2.01 116.94 113.94 2q80 h PHE 35 Ca 0.04 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 2q80 h PHE 35 Cb 0.13 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.28 2q80 h PHE 35 CO -0.03 0.08 -0.08 -0.97 -0.60 0.00 0.00 178.31 176.71 2q80 h ASN 36 N 0.00 0.00 -0.94 2.17 -1.24 -0.73 -0.80 115.58 114.05 2q80 h ASN 36 Ca -0.00 0.00 0.24 0.00 0.71 0.00 0.00 56.30 57.25 2q80 h ASN 36 Cb 0.56 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 39.55 2q80 h ASN 36 CO 0.01 0.08 0.64 -0.74 -1.29 0.00 0.00 177.43 176.13 2q80 h HIS 37 N 0.00 0.35 0.00 0.67 -0.00 -0.92 0.16 115.15 115.41 2q80 h HIS 37 Ca -0.00 0.01 -0.26 0.00 -0.00 0.00 0.00 60.37 60.12 2q80 h HIS 37 Cb 0.82 -0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 28.08 2q80 h HIS 37 CO 0.00 0.07 -1.50 0.91 -0.00 0.00 0.00 177.93 177.41 2q80 n TRP 38 N -4.43 0.69 0.20 5.26 8.01 -0.96 -4.62 117.44 121.58 2q80 n TRP 38 Ca 0.20 0.30 0.09 0.00 -1.31 0.00 0.00 57.50 56.78 2q80 n TRP 38 Cb 0.85 -1.01 0.16 0.00 -2.01 0.00 0.00 31.31 29.30 2q80 n TRP 38 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 2q80 h LEU 39 N -1.00 0.00 -3.75 -0.99 3.38 -1.06 -3.44 115.31 108.44 2q80 h LEU 39 Ca -0.39 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.04 2q80 h LEU 39 Cb 1.28 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.04 2q80 h LEU 39 CO -0.23 0.17 -1.00 0.29 0.09 0.00 0.00 178.44 177.76 2q80 n LYS 40 N -3.15 -0.58 -3.05 1.13 5.02 0.54 -4.57 118.16 113.50 2q80 n LYS 40 Ca 0.03 0.24 -0.40 0.00 -2.02 0.00 0.00 58.31 56.16 2q80 n LYS 40 Cb 0.58 -2.86 -0.05 0.00 -0.02 0.00 0.00 35.03 32.68 2q80 n LYS 40 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2q80 s VAL 41 N -3.45 4.86 0.29 -0.18 1.01 -1.26 -4.88 120.40 116.79 2q80 s VAL 41 Ca 0.44 1.49 -0.29 0.00 0.00 0.00 0.00 61.98 63.62 2q80 s VAL 41 Cb -0.22 -4.05 -0.13 0.00 0.00 0.00 0.00 36.38 31.97 2q80 s VAL 41 CO 0.94 0.34 1.17 -2.65 0.00 0.00 0.00 175.10 174.91 2q80 n PRO 42 N 3.06 1.70 0.19 2.72 -0.02 -1.26 -4.64 135.00 136.76 2q80 n PRO 42 Ca -0.03 0.60 0.04 0.00 -2.02 0.00 0.00 63.50 62.09 2q80 n PRO 42 Cb 0.51 -2.09 0.46 0.00 -0.02 0.00 0.00 33.50 32.36 2q80 n PRO 42 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2q80 h GLU 43 N 2.59 0.06 0.22 -0.52 3.07 -1.97 0.16 114.58 118.19 2q80 h GLU 43 Ca -0.43 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.42 2q80 h GLU 43 Cb 1.31 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 29.19 2q80 h GLU 43 CO 0.64 0.25 -0.26 0.38 -1.40 0.00 0.00 179.01 178.62 2q80 h ASP 44 N 0.06 -0.70 -0.51 1.42 2.03 -2.01 -1.27 116.42 115.45 2q80 h ASP 44 Ca 0.01 0.07 -0.10 0.00 -0.73 0.00 0.00 57.03 56.28 2q80 h ASP 44 Cb 0.36 0.25 -0.02 0.00 -0.83 0.00 0.00 39.33 39.09 2q80 h ASP 44 CO 0.02 -0.37 -0.07 0.11 -1.03 0.00 0.00 179.24 177.90 2q80 h LYS 45 N -0.53 0.94 -0.64 4.15 1.79 -1.71 -3.15 116.57 117.43 2q80 h LYS 45 Ca 0.00 -0.34 -0.02 0.00 -2.18 0.00 0.00 60.65 58.11 2q80 h LYS 45 Cb 0.50 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 2q80 h LYS 45 CO -0.08 1.00 0.31 1.25 -1.08 0.00 0.00 179.45 180.85 2q80 h LEU 46 N 0.81 0.84 -0.51 2.94 5.85 -0.58 -1.08 115.31 123.57 2q80 h LEU 46 Ca 0.13 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.79 2q80 h LEU 46 Cb 0.62 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 2q80 h LEU 46 CO 0.04 0.73 0.19 1.56 -0.34 0.00 0.00 178.44 180.62 2q80 h GLN 47 N 0.88 0.35 -0.62 1.25 1.08 -1.21 -1.26 115.11 115.59 2q80 h GLN 47 Ca 0.22 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.39 2q80 h GLN 47 Cb 0.12 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 2q80 h GLN 47 CO -0.03 0.23 0.37 0.82 -0.95 0.00 0.00 178.83 179.28 2q80 h ILE 48 N 0.37 1.18 -0.29 2.54 1.08 -1.36 -1.48 117.51 119.56 2q80 h ILE 48 Ca 0.24 -0.41 -0.02 0.00 -0.39 0.00 0.00 64.86 64.28 2q80 h ILE 48 Cb 0.26 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 34.34 2q80 h ILE 48 CO -0.25 0.19 0.11 0.40 -0.69 0.00 0.00 178.15 177.92 2q80 h ILE 49 N 0.84 1.18 -0.29 -0.67 2.04 -0.75 -1.16 117.51 118.70 2q80 h ILE 49 Ca 0.22 -0.54 0.03 0.00 1.00 0.00 0.00 64.86 65.57 2q80 h ILE 49 Cb -0.02 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2q80 h ILE 49 CO -0.04 0.18 0.11 0.40 0.00 0.00 0.00 178.15 178.80 2q80 h ILE 50 N 0.31 0.94 -0.99 -0.67 2.04 -1.06 0.22 117.51 118.31 2q80 h ILE 50 Ca 0.10 -0.09 0.09 0.00 1.00 0.00 0.00 64.86 65.96 2q80 h ILE 50 Cb 0.18 0.67 -0.08 0.00 -0.74 0.00 0.00 36.82 36.86 2q80 h ILE 50 CO -0.01 0.05 0.63 -0.33 0.00 0.00 0.00 178.15 178.49 2q80 h GLU 51 N 0.25 1.04 -0.20 2.37 5.08 -1.05 0.07 114.58 122.14 2q80 h GLU 51 Ca 0.13 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 2q80 h GLU 51 Cb 0.08 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2q80 h GLU 51 CO -0.12 0.69 -0.45 0.28 -1.00 0.00 0.00 179.01 178.41 2q80 h VAL 52 N 1.07 1.32 -0.40 3.13 2.07 -0.74 -2.12 116.25 120.59 2q80 h VAL 52 Ca 0.46 -1.68 0.07 0.00 0.82 0.00 0.00 66.70 66.36 2q80 h VAL 52 Cb 0.32 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.91 2q80 h VAL 52 CO -0.22 0.53 0.05 0.74 0.02 0.00 0.00 177.57 178.69 2q80 h THR 53 N 0.35 0.76 -0.59 2.57 2.02 0.03 -2.60 112.91 115.45 2q80 h THR 53 Ca -0.00 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2q80 h THR 53 Cb 1.06 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 2q80 h THR 53 CO 0.10 0.03 0.24 -0.08 0.37 0.00 0.00 175.52 176.18 2q80 h GLU 54 N 0.17 0.89 0.41 6.66 4.81 -0.91 -1.37 114.58 125.24 2q80 h GLU 54 Ca 0.19 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2q80 h GLU 54 Cb 0.25 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2q80 h GLU 54 CO -0.28 0.76 -0.20 0.52 -0.73 0.00 0.00 179.01 179.08 2q80 h MET 55 N 0.82 -0.53 -0.10 1.92 2.86 -1.09 -1.71 114.93 117.10 2q80 h MET 55 Ca 0.20 0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.79 2q80 h MET 55 Cb 0.20 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 2q80 h MET 55 CO -0.02 -0.31 -0.31 -0.07 1.06 0.00 0.00 176.91 177.27 2q80 h LEU 56 N -0.62 0.19 0.37 1.22 4.07 -1.44 -0.38 115.31 118.71 2q80 h LEU 56 Ca -0.06 -0.06 -0.02 0.00 0.08 0.00 0.00 57.88 57.82 2q80 h LEU 56 Cb 0.46 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.15 2q80 h LEU 56 CO 0.09 0.50 -0.18 -0.74 -1.08 0.00 0.00 178.44 177.04 2q80 h HIS 57 N 0.17 -0.46 0.10 1.13 2.76 -1.11 -1.81 115.15 115.94 2q80 h HIS 57 Ca 0.02 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.19 2q80 h HIS 57 Cb 0.63 0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.72 2q80 h HIS 57 CO 0.01 -0.12 -0.16 -0.91 -1.30 0.00 0.00 177.93 175.44 2q80 h ASN 58 N -0.86 -0.44 -0.92 3.26 2.35 -1.22 -1.51 115.58 116.24 2q80 h ASN 58 Ca -0.05 0.05 0.23 0.00 -0.55 0.00 0.00 56.30 55.98 2q80 h ASN 58 Cb 0.54 0.17 -0.13 0.00 0.05 0.00 0.00 38.32 38.95 2q80 h ASN 58 CO 0.08 -0.24 0.43 0.00 -1.65 0.00 0.00 177.43 176.05 2q80 h ALA 59 N 0.53 1.51 0.00 -0.83 0.00 -1.12 0.15 119.26 119.49 2q80 h ALA 59 Ca 0.02 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 2q80 h ALA 59 Cb 0.33 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2q80 h ALA 59 CO -0.08 -0.35 -0.39 0.66 0.00 0.00 0.00 179.25 179.09 2q80 h SER 60 N 0.42 0.00 0.28 0.00 4.64 -0.51 -2.73 113.55 115.65 2q80 h SER 60 Ca 0.58 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.89 2q80 h SER 60 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2q80 h SER 60 CO -0.53 0.39 -0.14 -0.07 -0.87 0.00 0.00 176.83 175.61 2q80 h LEU 61 N 0.00 -0.32 -0.55 5.97 3.38 0.21 -0.88 115.31 123.11 2q80 h LEU 61 Ca -0.00 -0.17 0.10 0.00 0.09 0.00 0.00 57.88 57.90 2q80 h LEU 61 Cb 0.92 0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.65 2q80 h LEU 61 CO 0.05 0.16 -0.16 0.18 0.09 0.00 0.00 178.44 178.76 2q80 n LEU 62 N -5.03 -0.25 -0.05 1.67 4.77 -0.56 0.48 117.00 118.02 2q80 n LEU 62 Ca -0.07 0.96 -0.12 0.00 -0.03 0.00 0.00 56.01 56.74 2q80 n LEU 62 Cb 0.24 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 2q80 n LEU 62 CO 0.21 -0.90 0.68 0.40 -1.33 0.00 0.00 177.39 176.46 2q80 h ILE 63 N 0.00 1.30 -0.88 -0.08 1.08 -1.45 -3.11 117.51 114.37 2q80 h ILE 63 Ca 0.24 -1.06 0.03 0.00 -0.39 0.00 0.00 64.86 63.68 2q80 h ILE 63 Cb 0.38 1.68 -0.05 0.00 -3.07 0.00 0.00 36.82 35.76 2q80 h ILE 63 CO -0.56 0.31 0.57 -0.78 -0.69 0.00 0.00 178.15 177.00 2q80 h ASP 64 N -0.00 0.94 -0.58 1.72 3.58 0.15 -0.37 116.42 121.86 2q80 h ASP 64 Ca 0.04 -0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.51 2q80 h ASP 64 Cb 0.51 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 41.32 2q80 h ASP 64 CO 0.02 0.65 0.38 0.44 -2.88 0.00 0.00 179.24 177.85 2q80 h ASP 65 N 1.10 0.58 -0.05 2.28 3.32 -0.19 0.40 116.42 123.86 2q80 h ASP 65 Ca 0.35 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.32 2q80 h ASP 65 Cb 0.00 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.42 2q80 h ASP 65 CO -0.12 0.40 -0.23 0.40 -1.72 0.00 0.00 179.24 177.97 2q80 h ILE 66 N 0.67 1.45 -0.71 0.35 2.04 -1.18 -1.62 117.51 118.51 2q80 h ILE 66 Ca 0.23 -1.68 0.04 0.00 1.00 0.00 0.00 64.86 64.45 2q80 h ILE 66 Cb 0.09 2.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.52 2q80 h ILE 66 CO -0.06 0.47 0.47 -0.33 0.00 0.00 0.00 178.15 178.70 2q80 h GLU 67 N -0.29 0.82 -0.35 2.37 5.08 -0.63 -2.86 114.58 118.72 2q80 h GLU 67 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2q80 h GLU 67 Cb 0.89 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2q80 h GLU 67 CO 0.05 0.54 0.00 -0.25 -1.00 0.00 0.00 179.01 178.35 2q80 n ASP 68 N -4.46 3.27 -3.10 1.42 10.43 0.14 -4.96 116.55 119.28 2q80 n ASP 68 Ca 0.09 -1.97 -0.20 0.00 2.57 0.00 0.00 54.79 55.28 2q80 n ASP 68 Cb 0.14 -0.22 -0.00 0.00 1.84 0.00 0.00 41.12 42.87 2q80 n ASP 68 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 2q80 n ASN 69 N 1.38 -3.73 -4.80 -2.24 5.15 -0.66 -4.66 115.26 105.69 2q80 n ASN 69 Ca 0.19 -0.22 -0.32 0.00 -0.60 0.00 0.00 54.58 53.64 2q80 n ASN 69 Cb 0.58 -3.11 0.05 0.00 -0.53 0.00 0.00 39.78 36.77 2q80 n ASN 69 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2q80 s SER 70 N -2.53 5.29 -0.13 1.20 0.01 -0.88 -4.94 113.70 111.72 2q80 s SER 70 Ca 0.29 1.73 -0.01 0.00 1.31 0.00 0.00 55.95 59.27 2q80 s SER 70 Cb -0.15 -2.51 -0.08 0.00 0.21 0.00 0.00 66.02 63.48 2q80 s SER 70 CO 0.35 -1.50 -0.13 0.29 0.41 0.00 0.00 173.24 172.66 2q80 n LYS 71 N -2.89 0.32 -4.43 12.44 5.02 -1.26 -4.83 118.16 122.53 2q80 n LYS 71 Ca 0.08 0.09 -0.25 0.00 -2.02 0.00 0.00 58.31 56.21 2q80 n LYS 71 Cb 0.53 -1.22 -0.11 0.00 -0.02 0.00 0.00 35.03 34.22 2q80 n LYS 71 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2q80 s LEU 72 N -5.96 2.51 -0.06 -0.35 1.43 -1.26 -1.47 118.68 113.51 2q80 s LEU 72 Ca -0.18 -0.94 -0.03 0.00 -1.03 0.00 0.00 54.13 51.95 2q80 s LEU 72 Cb 0.05 -1.09 0.04 0.00 0.03 0.00 0.00 46.19 45.23 2q80 s LEU 72 CO 0.29 0.06 0.12 -0.60 0.23 0.00 0.00 176.35 176.46 2q80 s ARG 73 N -3.09 0.02 -1.62 1.70 3.52 0.74 -4.61 118.95 115.61 2q80 s ARG 73 Ca 0.24 0.43 -0.11 0.00 -0.13 0.00 0.00 55.73 56.16 2q80 s ARG 73 Cb -0.06 -0.29 0.10 0.00 -1.56 0.00 0.00 34.95 33.14 2q80 s ARG 73 CO 0.12 -0.26 0.54 0.54 -0.81 0.00 0.00 175.30 175.43 2q80 n ARG 74 N 4.89 -2.53 -0.14 5.12 5.12 -1.05 -1.27 116.66 126.80 2q80 n ARG 74 Ca -0.13 0.31 0.00 0.00 -1.93 0.00 0.00 57.85 56.10 2q80 n ARG 74 Cb 0.50 -4.65 0.00 0.00 -1.16 0.00 0.00 32.46 27.15 2q80 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2q80 n GLY 75 N -1.71 1.99 3.88 -0.13 0.00 0.42 -4.68 105.19 104.96 2q80 n GLY 75 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 2q80 n GLY 75 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q80 s PHE 76 N -2.88 3.42 0.63 1.61 0.08 -0.40 -4.92 117.98 115.52 2q80 s PHE 76 Ca 0.00 0.20 -0.18 0.00 0.12 0.00 0.00 56.93 57.07 2q80 s PHE 76 Cb 0.00 -1.72 -0.03 0.00 -0.57 0.00 0.00 43.02 40.70 2q80 s PHE 76 CO 0.00 0.57 1.04 -2.30 -0.10 0.00 0.00 175.22 174.43 2q80 n PRO 77 N 0.35 0.88 -2.62 0.24 -0.02 -1.26 -0.19 135.00 132.39 2q80 n PRO 77 Ca -0.06 0.35 -0.37 0.00 -2.02 0.00 0.00 63.50 61.39 2q80 n PRO 77 Cb 0.51 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.68 2q80 n PRO 77 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2q80 s VAL 78 N -1.52 3.86 0.26 -1.45 -7.23 -0.54 -4.61 120.40 109.15 2q80 s VAL 78 Ca 0.78 1.53 -0.02 0.00 -1.81 0.00 0.00 61.98 62.46 2q80 s VAL 78 Cb -0.40 -3.85 0.24 0.00 0.56 0.00 0.00 36.38 32.93 2q80 s VAL 78 CO 0.45 0.12 1.78 0.00 -0.31 0.00 0.00 175.10 177.13 2q80 h ALA 79 N 2.96 1.26 0.00 1.32 0.00 -1.92 -1.37 119.26 121.50 2q80 h ALA 79 Ca -0.47 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2q80 h ALA 79 Cb 1.21 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2q80 h ALA 79 CO 0.64 -0.03 -0.06 1.12 0.00 0.00 0.00 179.25 180.91 2q80 h HIS 80 N 0.68 0.00 0.00 0.00 2.07 -1.91 -0.61 115.15 115.38 2q80 h HIS 80 Ca 0.45 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.97 2q80 h HIS 80 Cb 0.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.55 2q80 h HIS 80 CO -0.08 0.06 0.00 0.66 -3.07 0.00 0.00 177.93 175.50 2q80 h SER 81 N 0.00 0.00 0.00 3.10 4.64 -1.57 0.24 113.55 119.95 2q80 h SER 81 Ca -0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 2q80 h SER 81 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2q80 h SER 81 CO 0.01 0.00 -1.20 -0.38 -0.87 0.00 0.00 176.83 174.38 2q80 n ILE 82 N -2.60 1.49 1.13 0.95 5.41 -0.47 -4.75 119.36 120.52 2q80 n ILE 82 Ca 0.03 0.02 0.12 0.00 1.00 0.00 0.00 62.75 63.92 2q80 n ILE 82 Cb 0.36 -2.19 0.19 0.00 -0.71 0.00 0.00 39.64 37.29 2q80 n ILE 82 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2q80 n TYR 83 N -4.46 0.00 0.00 1.39 4.01 -0.36 -5.07 117.16 112.66 2q80 n TYR 83 Ca -0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 2q80 n TYR 83 Cb 0.55 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.53 2q80 n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2q80 n GLY 84 N 1.37 -0.61 0.21 2.72 0.00 0.83 -4.39 105.19 105.33 2q80 n GLY 84 Ca 0.11 -1.45 -0.12 0.00 0.00 0.00 0.00 46.02 44.56 2q80 n GLY 84 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2q80 h ILE 85 N 0.00 0.61 -0.71 -0.61 2.04 -1.94 -2.94 117.51 113.96 2q80 h ILE 85 Ca 0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 2q80 h ILE 85 Cb 0.00 0.61 -0.07 0.00 -0.74 0.00 0.00 36.82 36.61 2q80 h ILE 85 CO 0.00 0.00 0.34 -0.65 0.00 0.00 0.00 178.15 177.84 2q80 h PRO 86 N -0.33 0.55 -0.78 2.37 0.11 -1.94 -1.91 132.00 130.07 2q80 h PRO 86 Ca 0.02 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2q80 h PRO 86 Cb 0.35 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.30 2q80 h PRO 86 CO -0.09 0.37 0.49 0.77 -0.21 0.00 0.00 178.00 179.33 2q80 h SER 87 N 0.57 0.91 0.69 -2.05 0.02 -1.74 -2.89 113.55 109.05 2q80 h SER 87 Ca 0.35 -0.04 -0.22 0.00 -0.84 0.00 0.00 61.79 61.04 2q80 h SER 87 Cb 0.40 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2q80 h SER 87 CO -0.29 0.68 -1.02 0.58 -1.14 0.00 0.00 176.83 175.64 2q80 h VAL 88 N 1.06 1.54 -0.30 2.27 2.07 -1.27 0.64 116.25 122.26 2q80 h VAL 88 Ca 0.28 -2.93 0.03 0.00 0.82 0.00 0.00 66.70 64.90 2q80 h VAL 88 Cb -0.09 2.70 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 2q80 h VAL 88 CO -0.06 0.85 0.10 0.40 0.02 0.00 0.00 177.57 178.89 2q80 h ILE 89 N 0.08 0.92 -0.26 4.57 2.04 -1.35 0.11 117.51 123.61 2q80 h ILE 89 Ca -0.06 -0.08 -0.16 0.00 1.00 0.00 0.00 64.86 65.55 2q80 h ILE 89 Cb 1.71 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2q80 h ILE 89 CO 0.16 0.04 -0.50 -1.13 0.00 0.00 0.00 178.15 176.72 2q80 h ASN 90 N 0.23 0.78 -0.26 1.72 -0.73 -1.36 -1.11 115.58 114.84 2q80 h ASN 90 Ca 0.13 -0.39 -0.02 0.00 1.87 0.00 0.00 56.30 57.89 2q80 h ASN 90 Cb 0.10 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 38.46 2q80 h ASN 90 CO -0.14 1.14 0.10 -1.28 -0.37 0.00 0.00 177.43 176.88 2q80 h SER 91 N 0.56 0.36 0.02 1.15 0.87 -0.70 -0.83 113.55 114.97 2q80 h SER 91 Ca 0.02 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.41 2q80 h SER 91 Cb 1.06 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 2q80 h SER 91 CO 0.10 0.44 -0.01 0.00 -0.53 0.00 0.00 176.83 176.84 2q80 h ALA 92 N 0.93 -0.02 -0.94 6.23 0.00 -0.67 -1.07 119.26 123.72 2q80 h ALA 92 Ca 0.09 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.05 2q80 h ALA 92 Cb 0.20 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 2q80 h ALA 92 CO -0.01 -0.49 0.61 -0.91 0.00 0.00 0.00 179.25 178.45 2q80 h ASN 93 N -0.07 0.90 0.33 0.00 4.21 -1.12 -0.85 115.58 118.99 2q80 h ASN 93 Ca -0.00 0.02 -0.01 0.00 1.21 0.00 0.00 56.30 57.52 2q80 h ASN 93 Cb 0.06 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.09 2q80 h ASN 93 CO 0.00 0.54 -0.20 0.22 -1.29 0.00 0.00 177.43 176.71 2q80 h TYR 94 N 1.01 -0.51 -0.82 1.19 3.20 -0.65 -2.93 116.97 117.46 2q80 h TYR 94 Ca 0.43 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.39 2q80 h TYR 94 Cb 0.32 0.18 -0.08 0.00 1.54 0.00 0.00 36.73 38.70 2q80 h TYR 94 CO -0.00 -0.31 0.46 0.28 -1.64 0.00 0.00 178.16 176.95 2q80 h VAL 95 N -0.50 0.88 -0.89 1.81 2.07 -0.46 0.39 116.25 119.54 2q80 h VAL 95 Ca -0.04 -0.26 0.23 0.00 0.82 0.00 0.00 66.70 67.46 2q80 h VAL 95 Cb 0.41 0.05 -0.13 0.00 -1.52 0.00 0.00 31.29 30.10 2q80 h VAL 95 CO 0.04 0.14 0.35 1.88 0.02 0.00 0.00 177.57 180.00 2q80 h TYR 96 N 0.76 0.56 0.00 1.57 0.05 -0.99 0.12 116.97 119.04 2q80 h TYR 96 Ca 0.41 0.04 -0.18 0.00 0.05 0.00 0.00 58.73 59.05 2q80 h TYR 96 Cb 0.41 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.02 2q80 h TYR 96 CO -0.07 -0.12 -1.14 0.74 -1.05 0.00 0.00 178.16 176.52 2q80 h PHE 97 N 0.32 0.00 -0.93 4.88 0.04 -0.25 -1.54 116.94 119.45 2q80 h PHE 97 Ca 0.57 0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.42 2q80 h PHE 97 Cb 1.12 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 39.21 2q80 h PHE 97 CO -0.17 0.69 0.60 -0.07 -0.60 0.00 0.00 178.31 178.76 2q80 h LEU 98 N 0.00 0.90 -0.20 1.54 3.38 -0.45 -1.21 115.31 119.27 2q80 h LEU 98 Ca -0.11 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2q80 h LEU 98 Cb 1.62 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 2q80 h LEU 98 CO 0.07 0.55 0.13 1.23 0.09 0.00 0.00 178.44 180.51 2q80 h GLY 99 N 1.00 0.27 1.00 0.83 0.00 -0.06 -1.39 103.07 104.73 2q80 h GLY 99 Ca 0.42 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.65 2q80 h GLY 99 CO -0.18 0.10 0.37 -2.00 0.00 0.00 0.00 176.54 174.83 2q80 h LEU 100 N 0.26 0.66 -1.41 3.11 5.85 -1.04 -0.29 115.31 122.45 2q80 h LEU 100 Ca 0.07 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2q80 h LEU 100 Cb -0.03 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 2q80 h LEU 100 CO -0.02 0.48 0.33 -0.08 -0.34 0.00 0.00 178.44 178.82 2q80 h GLU 101 N 0.77 0.73 -0.01 1.25 4.81 -0.91 -2.32 114.58 118.90 2q80 h GLU 101 Ca 0.21 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2q80 h GLU 101 Cb -0.08 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.14 2q80 h GLU 101 CO -0.04 0.51 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.51 2q80 h LYS 102 N 0.75 0.02 -1.07 1.92 1.63 -0.63 -3.13 116.57 116.06 2q80 h LYS 102 Ca 0.20 -0.01 0.29 0.00 -0.85 0.00 0.00 60.65 60.27 2q80 h LYS 102 Cb -0.04 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 31.51 2q80 h LYS 102 CO -0.04 0.55 0.71 0.28 -3.45 0.00 0.00 179.45 177.50 2q80 h VAL 103 N -0.51 0.49 0.00 2.00 2.07 -0.69 0.25 116.25 119.86 2q80 h VAL 103 Ca 0.00 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 2q80 h VAL 103 Cb 0.55 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2q80 h VAL 103 CO 0.00 0.05 -0.14 -0.07 0.02 0.00 0.00 177.57 177.43 2q80 h LEU 104 N 0.27 0.00 0.00 2.57 3.38 -1.37 -2.71 115.31 117.45 2q80 h LEU 104 Ca 0.58 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.55 2q80 h LEU 104 Cb 1.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.45 2q80 h LEU 104 CO -0.21 0.14 0.00 0.35 0.09 0.00 0.00 178.44 178.81 2q80 n THR 105 N -3.32 0.41 0.29 0.22 -2.24 0.88 -2.66 114.28 107.86 2q80 n THR 105 Ca 0.00 0.10 0.16 0.00 -2.27 0.00 0.00 64.05 62.04 2q80 n THR 105 Cb 0.37 -0.73 0.57 0.00 -2.10 0.00 0.00 70.33 68.44 2q80 n THR 105 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2q80 h LEU 106 N 0.00 0.00 -1.26 3.22 3.38 -1.56 -3.48 115.31 115.62 2q80 h LEU 106 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 2q80 h LEU 106 Cb 0.30 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.07 2q80 h LEU 106 CO 0.00 0.00 -0.77 -0.67 0.09 0.00 0.00 178.44 177.09 2q80 n ASP 107 N -2.99 -3.67 -4.30 -0.43 2.03 -1.09 -5.00 116.55 101.11 2q80 n ASP 107 Ca 0.01 -0.76 -0.32 0.00 0.52 0.00 0.00 54.79 54.24 2q80 n ASP 107 Cb 0.34 -4.11 -0.16 0.00 -0.72 0.00 0.00 41.12 36.47 2q80 n ASP 107 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2q80 s HIS 108 N -3.43 2.66 -0.18 -0.67 2.46 -1.26 -5.01 115.29 109.86 2q80 s HIS 108 Ca 0.41 -0.80 0.26 0.00 0.47 0.00 0.00 55.06 55.40 2q80 s HIS 108 Cb -0.20 -1.75 1.26 0.00 -0.13 0.00 0.00 32.58 31.76 2q80 s HIS 108 CO 0.81 -0.28 1.79 -1.00 -2.47 0.00 0.00 174.74 173.59 2q80 h PRO 109 N 6.56 0.00 -0.15 2.88 0.13 -2.00 -1.85 132.00 137.57 2q80 h PRO 109 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2q80 h PRO 109 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2q80 h PRO 109 CO 0.51 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.03 2q80 n ASP 110 N -2.42 2.52 -0.05 1.44 8.00 -1.26 -4.69 116.55 120.08 2q80 n ASP 110 Ca -0.00 -1.73 -0.12 0.00 0.71 0.00 0.00 54.79 53.65 2q80 n ASP 110 Cb 0.13 -0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.08 2q80 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2q80 h ALA 111 N 2.82 0.21 -0.27 2.24 0.00 -1.70 -2.78 119.26 119.78 2q80 h ALA 111 Ca 0.00 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.54 2q80 h ALA 111 Cb 0.67 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2q80 h ALA 111 CO 0.00 -0.06 -0.45 0.28 0.00 0.00 0.00 179.25 179.02 2q80 h VAL 112 N 0.01 1.30 -0.64 0.00 2.07 -1.84 -1.35 116.25 115.80 2q80 h VAL 112 Ca 0.04 -1.64 0.13 0.00 0.82 0.00 0.00 66.70 66.05 2q80 h VAL 112 Cb 0.42 1.57 -0.10 0.00 -1.52 0.00 0.00 31.29 31.66 2q80 h VAL 112 CO 0.01 0.53 0.08 0.50 0.02 0.00 0.00 177.57 178.71 2q80 h LYS 113 N 0.55 0.19 0.09 1.57 3.64 -1.83 0.68 116.57 121.45 2q80 h LYS 113 Ca 0.04 -0.01 -0.29 0.00 -1.27 0.00 0.00 60.65 59.12 2q80 h LYS 113 Cb 1.00 -0.04 0.03 0.00 -0.41 0.00 0.00 32.23 32.80 2q80 h LYS 113 CO 0.09 0.13 -1.19 1.25 -2.27 0.00 0.00 179.45 177.46 2q80 h LEU 114 N 0.20 0.86 -0.14 5.20 6.46 -1.33 -1.45 115.31 125.11 2q80 h LEU 114 Ca 0.35 -0.76 0.03 0.00 -0.12 0.00 0.00 57.88 57.38 2q80 h LEU 114 Cb 0.56 -0.27 -0.07 0.00 -0.73 0.00 0.00 40.66 40.15 2q80 h LEU 114 CO -0.49 1.57 -0.51 0.15 -0.62 0.00 0.00 178.44 178.54 2q80 h PHE 115 N 0.30 -1.50 -0.26 1.25 3.57 -1.04 -1.42 116.94 117.84 2q80 h PHE 115 Ca -0.17 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.44 2q80 h PHE 115 Cb 1.85 0.68 -0.05 0.00 2.79 0.00 0.00 35.95 41.22 2q80 h PHE 115 CO 0.11 -0.53 -0.06 1.15 -2.23 0.00 0.00 178.31 176.74 2q80 h THR 116 N -0.56 0.74 -0.89 4.41 2.02 -0.79 -1.88 112.91 115.95 2q80 h THR 116 Ca 0.05 -0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.35 2q80 h THR 116 Cb 0.67 0.74 -0.07 0.00 -1.74 0.00 0.00 68.15 67.75 2q80 h THR 116 CO -0.43 0.00 0.58 -0.09 0.37 0.00 0.00 175.52 175.94 2q80 h ARG 117 N 0.00 0.76 0.16 6.66 2.43 -1.08 -1.81 114.38 121.50 2q80 h ARG 117 Ca 0.12 -0.05 -0.30 0.00 -0.81 0.00 0.00 59.98 58.95 2q80 h ARG 117 Cb 0.19 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2q80 h ARG 117 CO -0.26 0.50 -1.38 1.96 -1.51 0.00 0.00 179.97 179.28 2q80 h GLN 118 N 0.78 0.34 -0.38 0.20 1.08 -0.49 -2.87 115.11 113.76 2q80 h GLN 118 Ca 0.44 -0.58 -0.10 0.00 -1.45 0.00 0.00 58.65 56.96 2q80 h GLN 118 Cb 0.58 0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 28.22 2q80 h GLN 118 CO -0.20 1.26 -0.14 -0.07 -0.95 0.00 0.00 178.83 178.73 2q80 h LEU 119 N 0.09 0.78 -1.12 1.46 3.38 -1.20 0.54 115.31 119.24 2q80 h LEU 119 Ca -0.19 -0.39 0.15 0.00 0.09 0.00 0.00 57.88 57.54 2q80 h LEU 119 Cb 2.03 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 42.49 2q80 h LEU 119 CO 0.21 0.99 0.61 -0.07 0.09 0.00 0.00 178.44 180.27 2q80 h LEU 120 N 0.57 0.78 -0.10 1.67 3.38 -1.42 0.52 115.31 120.70 2q80 h LEU 120 Ca 0.09 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 2q80 h LEU 120 Cb 0.67 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2q80 h LEU 120 CO 0.05 0.37 -0.26 -0.08 0.09 0.00 0.00 178.44 178.61 2q80 h GLU 121 N 0.82 0.35 -0.75 1.13 4.81 -1.24 -2.45 114.58 117.24 2q80 h GLU 121 Ca 0.50 -0.25 0.15 0.00 -0.13 0.00 0.00 59.36 59.63 2q80 h GLU 121 Cb 0.70 0.04 -0.10 0.00 0.63 0.00 0.00 28.75 30.02 2q80 h GLU 121 CO -0.27 0.86 0.28 1.25 -0.73 0.00 0.00 179.01 180.40 2q80 h LEU 122 N -0.09 0.23 -1.26 1.64 5.85 -0.41 -1.74 115.31 119.53 2q80 h LEU 122 Ca -0.00 0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2q80 h LEU 122 Cb 0.87 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 2q80 h LEU 122 CO 0.06 0.08 -0.32 0.45 -0.34 0.00 0.00 178.44 178.36 2q80 h HIS 123 N 0.41 0.00 -0.22 1.25 3.86 -0.85 -1.67 115.15 117.93 2q80 h HIS 123 Ca 0.42 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.48 2q80 h HIS 123 Cb 0.65 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 2q80 h HIS 123 CO -0.18 0.32 -0.47 1.96 0.86 0.00 0.00 177.93 180.42 2q80 h GLN 124 N 0.00 0.58 0.09 2.45 4.20 -0.83 -1.86 115.11 119.73 2q80 h GLN 124 Ca -0.00 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.37 2q80 h GLN 124 Cb 0.70 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.50 2q80 h GLN 124 CO 0.04 0.93 -0.04 0.78 -0.67 0.00 0.00 178.83 179.87 2q80 h GLY 125 N 1.04 -0.12 1.05 3.46 0.00 -0.90 -2.07 103.07 105.53 2q80 h GLY 125 Ca 0.03 0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.41 2q80 h GLY 125 CO 0.09 -0.04 0.63 1.46 0.00 0.00 0.00 176.54 178.68 2q80 h GLN 126 N -0.45 1.25 -0.18 4.80 1.08 -1.41 -2.08 115.11 118.13 2q80 h GLN 126 Ca -0.01 -0.08 0.04 0.00 -1.45 0.00 0.00 58.65 57.15 2q80 h GLN 126 Cb 0.38 -0.28 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 2q80 h GLN 126 CO 0.02 0.83 -0.08 0.78 -0.95 0.00 0.00 178.83 179.43 2q80 h GLY 127 N 1.29 0.09 1.28 3.46 0.00 -1.10 0.24 103.07 108.32 2q80 h GLY 127 Ca 0.35 0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.71 2q80 h GLY 127 CO -0.08 -0.10 0.03 1.41 0.00 0.00 0.00 176.54 177.80 2q80 h LEU 128 N -0.05 0.84 0.58 3.11 3.38 -1.21 0.81 115.31 122.77 2q80 h LEU 128 Ca 0.10 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2q80 h LEU 128 Cb 0.20 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2q80 h LEU 128 CO -0.22 0.89 -0.32 -0.78 0.09 0.00 0.00 178.44 178.11 2q80 h ASP 129 N 0.82 -0.78 -0.27 -0.43 3.58 -0.58 -2.37 116.42 116.39 2q80 h ASP 129 Ca 0.16 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.66 2q80 h ASP 129 Cb 0.45 0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.70 2q80 h ASP 129 CO 0.02 -0.52 0.14 0.40 -2.88 0.00 0.00 179.24 176.41 2q80 h ILE 130 N -0.83 1.01 -0.39 2.25 2.04 -0.45 -2.91 117.51 118.22 2q80 h ILE 130 Ca -0.07 -0.10 0.08 0.00 1.00 0.00 0.00 64.86 65.76 2q80 h ILE 130 Cb 0.66 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.36 2q80 h ILE 130 CO 0.10 0.05 -0.04 0.22 0.00 0.00 0.00 178.15 178.48 2q80 h TYR 131 N 0.30 -0.10 -0.58 1.37 3.20 -0.73 -0.26 116.97 120.16 2q80 h TYR 131 Ca 0.11 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 2q80 h TYR 131 Cb 0.01 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 2q80 h TYR 131 CO -0.09 -0.12 0.23 -1.49 -1.64 0.00 0.00 178.16 175.06 2q80 h TRP 132 N 0.06 0.89 0.26 -3.82 6.55 -1.32 0.38 115.95 118.94 2q80 h TRP 132 Ca 0.19 -0.07 -0.01 0.00 0.95 0.00 0.00 58.89 59.95 2q80 h TRP 132 Cb 0.29 -0.26 0.00 0.00 -0.86 0.00 0.00 29.16 28.32 2q80 h TRP 132 CO -0.30 0.71 -0.12 -0.09 -1.05 0.00 0.00 178.44 177.59 2q80 h ARG 133 N 0.80 -0.33 -0.00 0.49 2.43 -1.25 -1.48 114.38 115.04 2q80 h ARG 133 Ca 0.19 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2q80 h ARG 133 Cb 0.20 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 2q80 h ARG 133 CO -0.02 -0.11 -0.20 -0.25 -1.51 0.00 0.00 179.97 177.88 2q80 n ASP 134 N -5.17 0.22 -0.42 -3.80 8.00 -0.15 -2.80 116.55 112.42 2q80 n ASP 134 Ca -0.10 0.15 0.06 0.00 0.71 0.00 0.00 54.79 55.62 2q80 n ASP 134 Cb 0.21 -0.18 0.15 0.00 -0.02 0.00 0.00 41.12 41.27 2q80 n ASP 134 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2q80 n ASN 135 N -1.48 2.84 -3.97 -2.24 3.02 0.11 -5.00 115.26 108.54 2q80 n ASN 135 Ca 0.07 -2.57 -0.28 0.00 -0.03 0.00 0.00 54.58 51.77 2q80 n ASN 135 Cb 0.33 -0.32 -0.01 0.00 -0.61 0.00 0.00 39.78 39.18 2q80 n ASN 135 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2q80 n TYR 136 N -0.50 -1.82 -3.84 3.10 4.01 -0.72 -4.96 117.16 112.43 2q80 n TYR 136 Ca 0.13 0.80 -0.36 0.00 -0.16 0.00 0.00 57.90 58.31 2q80 n TYR 136 Cb 0.57 -3.69 -0.13 0.00 -0.31 0.00 0.00 39.34 35.78 2q80 n TYR 136 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2q80 s THR 137 N -3.66 3.60 -0.04 -0.72 2.01 -0.64 -5.05 115.64 111.15 2q80 s THR 137 Ca 0.28 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 2q80 s THR 137 Cb -0.15 -2.80 -0.03 0.00 0.01 0.00 0.00 72.50 69.53 2q80 s THR 137 CO 0.88 0.19 1.01 0.00 -0.69 0.00 0.00 174.62 176.00 2q80 s PRO 139 N 1.41 3.79 0.99 0.00 0.04 -1.26 -5.06 135.00 134.91 2q80 s PRO 139 Ca 0.51 0.88 -0.12 0.00 0.04 0.00 0.00 61.00 62.31 2q80 s PRO 139 Cb -0.21 -2.11 0.18 0.00 0.04 0.00 0.00 34.50 32.41 2q80 s PRO 139 CO 0.24 -0.41 1.10 0.95 0.04 0.00 0.00 177.00 178.92 2q80 s THR 140 N -2.85 2.06 0.09 1.26 -4.23 -1.26 -4.82 115.64 105.90 2q80 s THR 140 Ca 0.57 0.02 -0.17 0.00 -1.18 0.00 0.00 61.69 60.93 2q80 s THR 140 Cb -0.10 -2.55 -0.08 0.00 1.34 0.00 0.00 72.50 71.11 2q80 s THR 140 CO 0.41 -0.03 1.49 -0.08 -0.54 0.00 0.00 174.62 175.87 2q80 h GLU 141 N -1.85 0.53 -0.87 3.99 4.81 -1.97 -0.35 114.58 118.86 2q80 h GLU 141 Ca -0.54 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 58.48 2q80 h GLU 141 Cb 1.33 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.64 2q80 h GLU 141 CO 0.58 0.72 0.50 0.93 -0.73 0.00 0.00 179.01 181.01 2q80 h GLU 142 N 0.29 1.20 -1.00 1.92 4.39 -1.99 -0.79 114.58 118.60 2q80 h GLU 142 Ca 0.07 -0.13 0.04 0.00 0.34 0.00 0.00 59.36 59.69 2q80 h GLU 142 Cb 0.52 -0.24 -0.06 0.00 -0.10 0.00 0.00 28.75 28.87 2q80 h GLU 142 CO 0.03 0.87 0.65 0.93 -1.16 0.00 0.00 179.01 180.33 2q80 h GLU 143 N 1.21 1.21 0.07 2.33 5.08 -1.82 -1.04 114.58 121.62 2q80 h GLU 143 Ca 0.31 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2q80 h GLU 143 Cb -0.00 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 28.98 2q80 h GLU 143 CO -0.05 0.80 -0.03 -0.92 -1.00 0.00 0.00 179.01 177.80 2q80 h TYR 144 N 1.24 -0.08 -0.94 4.33 3.20 -0.37 -2.49 116.97 121.86 2q80 h TYR 144 Ca 0.41 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.38 2q80 h TYR 144 Cb 0.05 0.03 -0.08 0.00 1.54 0.00 0.00 36.73 38.27 2q80 h TYR 144 CO -0.00 0.38 0.58 0.87 -1.64 0.00 0.00 178.16 178.34 2q80 h LYS 145 N -0.58 0.92 -0.67 1.82 1.57 -1.07 0.95 116.57 119.51 2q80 h LYS 145 Ca -0.01 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2q80 h LYS 145 Cb 0.50 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.55 2q80 h LYS 145 CO 0.01 0.61 0.40 0.00 -0.57 0.00 0.00 179.45 179.90 2q80 h ALA 146 N 1.50 0.88 -0.02 3.86 0.00 -0.99 -1.87 119.26 122.62 2q80 h ALA 146 Ca 0.45 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.14 2q80 h ALA 146 Cb 0.40 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2q80 h ALA 146 CO -0.25 0.13 -0.88 0.00 0.00 0.00 0.00 179.25 178.26 2q80 h MET 147 N 0.77 0.40 -0.97 0.00 -0.00 -0.84 -3.08 114.93 111.21 2q80 h MET 147 Ca 0.28 -0.40 0.10 0.00 -0.00 0.00 0.00 59.70 59.68 2q80 h MET 147 Cb 0.08 0.11 -0.07 0.00 -0.00 0.00 0.00 31.60 31.71 2q80 h MET 147 CO -0.13 1.06 0.62 0.28 -0.00 0.00 0.00 176.91 178.74 2q80 h VAL 148 N 0.24 0.98 -0.01 -0.10 2.07 -0.39 0.29 116.25 119.33 2q80 h VAL 148 Ca -0.06 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 2q80 h VAL 148 Cb 1.50 -0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2q80 h VAL 148 CO 0.15 0.18 -0.13 -0.07 0.02 0.00 0.00 177.57 177.72 2q80 h LEU 149 N 1.00 0.01 0.14 2.57 3.38 -1.27 0.45 115.31 121.60 2q80 h LEU 149 Ca 0.45 -0.00 -0.30 0.00 0.09 0.00 0.00 57.88 58.12 2q80 h LEU 149 Cb 0.39 -0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.15 2q80 h LEU 149 CO -0.21 0.15 -1.30 1.56 0.09 0.00 0.00 178.44 178.73 2q80 h GLN 150 N 0.01 0.45 0.35 1.13 4.20 -1.04 -1.25 115.11 118.95 2q80 h GLN 150 Ca 0.00 -0.70 -0.02 0.00 0.06 0.00 0.00 58.65 58.00 2q80 h GLN 150 Cb 0.25 0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2q80 h GLN 150 CO 0.02 1.32 -0.17 -0.22 -0.67 0.00 0.00 178.83 179.11 2q80 h LYS 151 N 0.15 -0.45 0.09 1.46 3.64 -0.74 -2.26 116.57 118.47 2q80 h LYS 151 Ca -0.18 0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 58.98 2q80 h LYS 151 Cb 2.00 0.10 0.02 0.00 -0.41 0.00 0.00 32.23 33.94 2q80 h LYS 151 CO 0.23 -0.13 -1.02 1.79 -2.27 0.00 0.00 179.45 178.05 2q80 h THR 152 N -0.93 1.35 -0.13 1.00 1.35 -1.07 -3.13 112.91 111.35 2q80 h THR 152 Ca -0.05 -2.38 0.04 0.00 -0.55 0.00 0.00 66.41 63.47 2q80 h THR 152 Cb 0.53 2.75 -0.01 0.00 -1.73 0.00 0.00 68.15 69.69 2q80 h THR 152 CO 0.08 0.71 0.18 1.23 -0.25 0.00 0.00 175.52 177.47 2q80 h GLY 153 N 0.09 0.00 0.19 5.82 0.00 -1.35 -1.72 103.07 106.10 2q80 h GLY 153 Ca -0.15 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.18 2q80 h GLY 153 CO 0.20 0.00 -0.49 -1.33 0.00 0.00 0.00 176.54 174.92 2q80 h GLY 154 N 0.00 -1.19 1.52 4.60 0.00 -1.34 -1.15 103.07 105.51 2q80 h GLY 154 Ca 0.06 0.63 -0.29 0.00 0.00 0.00 0.00 47.33 47.73 2q80 h GLY 154 CO -0.00 -0.30 -1.32 1.41 0.00 0.00 0.00 176.54 176.33 2q80 h LEU 155 N -0.75 0.50 0.48 3.11 3.38 -1.58 -2.63 115.31 117.83 2q80 h LEU 155 Ca -0.02 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.38 2q80 h LEU 155 Cb 0.73 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2q80 h LEU 155 CO -0.22 1.44 -0.24 -0.26 0.09 0.00 0.00 178.44 179.24 2q80 h PHE 156 N 0.09 -0.64 -0.16 1.13 0.04 -1.43 -2.02 116.94 113.95 2q80 h PHE 156 Ca -0.17 -0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.63 2q80 h PHE 156 Cb 2.02 0.21 -0.01 0.00 2.20 0.00 0.00 35.95 40.37 2q80 h PHE 156 CO 0.08 -0.39 0.13 0.78 -0.60 0.00 0.00 178.31 178.31 2q80 h GLY 157 N -0.67 0.00 0.48 -1.45 0.00 -1.27 -0.40 103.07 99.77 2q80 h GLY 157 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 2q80 h GLY 157 CO 0.10 0.00 -0.04 -2.00 0.00 0.00 0.00 176.54 174.59 2q80 h LEU 158 N 0.00 -0.10 0.20 3.11 5.85 -1.26 0.29 115.31 123.41 2q80 h LEU 158 Ca 0.08 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 2q80 h LEU 158 Cb 0.34 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2q80 h LEU 158 CO -0.00 0.40 -0.10 0.00 -0.34 0.00 0.00 178.44 178.40 2q80 h ALA 159 N 0.18 -0.28 -0.00 1.25 0.00 -0.56 -1.30 119.26 118.56 2q80 h ALA 159 Ca -0.01 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 2q80 h ALA 159 Cb 0.52 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2q80 h ALA 159 CO 0.02 -0.65 -0.78 0.28 0.00 0.00 0.00 179.25 178.12 2q80 h VAL 160 N -0.29 1.54 -0.41 0.00 2.07 -1.21 -2.56 116.25 115.39 2q80 h VAL 160 Ca -0.03 -2.63 -0.08 0.00 0.82 0.00 0.00 66.70 64.78 2q80 h VAL 160 Cb 0.22 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 2q80 h VAL 160 CO 0.05 0.75 -0.06 1.23 0.02 0.00 0.00 177.57 179.56 2q80 h GLY 161 N 2.24 0.83 0.89 2.17 0.00 -0.24 -1.42 103.07 107.54 2q80 h GLY 161 Ca -0.01 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 2q80 h GLY 161 CO 0.10 0.60 0.09 1.41 0.00 0.00 0.00 176.54 178.74 2q80 h LEU 162 N 0.59 0.39 -0.97 3.11 3.38 -1.23 -2.79 115.31 117.78 2q80 h LEU 162 Ca 0.11 -0.20 0.13 0.00 0.09 0.00 0.00 57.88 58.00 2q80 h LEU 162 Cb 0.57 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.14 2q80 h LEU 162 CO 0.03 0.49 0.59 0.24 0.09 0.00 0.00 178.44 179.88 2q80 h MET 163 N 0.27 0.88 0.00 1.13 2.86 -1.39 -0.30 114.93 118.38 2q80 h MET 163 Ca 0.09 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 2q80 h MET 163 Cb 0.24 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2q80 h MET 163 CO -0.00 0.58 -0.12 0.37 1.06 0.00 0.00 176.91 178.80 2q80 h GLN 164 N 0.91 0.00 0.00 1.72 4.15 -1.02 -2.21 115.11 118.66 2q80 h GLN 164 Ca 0.49 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.88 2q80 h GLN 164 Cb 0.54 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.22 2q80 h GLN 164 CO -0.29 0.12 -0.13 -0.07 -1.93 0.00 0.00 178.83 176.53 2q80 h LEU 165 N 0.00 0.00 -3.54 -2.39 3.38 -0.79 -3.03 115.31 108.95 2q80 h LEU 165 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 2q80 h LEU 165 Cb 0.50 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.03 2q80 h LEU 165 CO 0.02 0.13 -0.19 0.49 0.09 0.00 0.00 178.44 178.97 2q80 n PHE 166 N -4.24 1.80 -4.11 1.13 3.72 -0.84 -5.04 117.46 109.89 2q80 n PHE 166 Ca -0.03 -1.98 -0.12 0.00 -0.05 0.00 0.00 57.45 55.28 2q80 n PHE 166 Cb 0.20 -0.57 -0.11 0.00 -0.94 0.00 0.00 39.48 38.07 2q80 n PHE 166 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2q80 s SER 167 N -2.79 0.94 0.00 4.37 0.15 -1.14 -4.54 113.70 110.68 2q80 s SER 167 Ca 0.49 -0.76 0.24 0.00 0.70 0.00 0.00 55.95 56.62 2q80 s SER 167 Cb 0.42 0.07 0.50 0.00 -1.71 0.00 0.00 66.02 65.30 2q80 s SER 167 CO 0.00 -0.33 1.44 0.47 1.20 0.00 0.00 173.24 176.02 2q80 n ASP 168 N 0.79 2.69 -4.59 5.45 8.00 -1.26 -4.91 116.55 122.71 2q80 n ASP 168 Ca -0.18 -1.87 -0.42 0.00 0.71 0.00 0.00 54.79 53.03 2q80 n ASP 168 Cb 0.57 -0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.54 2q80 n ASP 168 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2q80 s TYR 169 N -1.79 1.92 -2.08 1.24 5.04 -1.26 -4.86 117.35 115.55 2q80 s TYR 169 Ca 0.34 0.66 0.26 0.00 -2.44 0.00 0.00 57.07 55.89 2q80 s TYR 169 Cb 0.21 -4.17 0.74 0.00 0.35 0.00 0.00 41.96 39.09 2q80 s TYR 169 CO 0.30 -2.59 1.56 0.36 -1.34 0.00 0.00 175.55 173.84 2q80 n LYS 170 N 8.52 1.22 -2.60 4.97 2.85 -1.26 -4.97 118.16 126.88 2q80 n LYS 170 Ca 0.21 -0.77 -0.33 0.00 -1.05 0.00 0.00 58.31 56.37 2q80 n LYS 170 Cb 0.48 -1.48 -0.05 0.00 -0.65 0.00 0.00 35.03 33.33 2q80 n LYS 170 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2q80 s GLU 171 N -2.32 4.06 -0.17 -1.58 2.02 -1.26 -5.00 118.70 114.45 2q80 s GLU 171 Ca 0.28 1.07 -0.22 0.00 0.02 0.00 0.00 54.97 56.12 2q80 s GLU 171 Cb 0.20 -2.15 -0.02 0.00 0.10 0.00 0.00 34.13 32.25 2q80 s GLU 171 CO 0.46 -0.18 0.69 0.34 0.02 0.00 0.00 175.26 176.58 2q80 s ASP 172 N -2.56 6.80 -0.00 -0.19 -1.08 -1.26 -4.96 116.67 113.42 2q80 s ASP 172 Ca 0.61 0.97 0.17 0.00 -0.52 0.00 0.00 52.55 53.78 2q80 s ASP 172 Cb -0.10 -2.38 -0.20 0.00 -1.46 0.00 0.00 42.92 38.78 2q80 s ASP 172 CO 0.22 -0.27 0.70 0.18 0.52 0.00 0.00 175.17 176.51 2q80 n LEU 173 N 4.87 0.72 -0.20 -1.34 4.77 -1.26 -4.66 117.00 119.91 2q80 n LEU 173 Ca -0.00 -0.44 -0.01 0.00 -0.03 0.00 0.00 56.01 55.53 2q80 n LEU 173 Cb 0.50 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.68 2q80 n LEU 173 CO 0.45 0.18 1.02 0.50 -1.33 0.00 0.00 177.39 178.21 2q80 h LYS 174 N 0.00 0.48 -0.60 3.23 3.64 -1.98 -0.99 116.57 120.35 2q80 h LYS 174 Ca 0.00 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 2q80 h LYS 174 Cb 0.46 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 2q80 h LYS 174 CO 0.00 0.32 0.30 -1.35 -2.27 0.00 0.00 179.45 176.45 2q80 h PRO 175 N 0.49 0.54 -0.47 1.90 0.11 -1.99 0.39 132.00 132.97 2q80 h PRO 175 Ca 0.29 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.30 2q80 h PRO 175 Cb 0.29 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 2q80 h PRO 175 CO -0.25 0.36 0.02 1.25 -0.21 0.00 0.00 178.00 179.17 2q80 h LEU 176 N 0.55 0.80 -1.01 2.35 5.85 -1.66 -1.10 115.31 121.10 2q80 h LEU 176 Ca 0.28 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2q80 h LEU 176 Cb 0.23 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2q80 h LEU 176 CO -0.21 0.90 0.45 -0.07 -0.34 0.00 0.00 178.44 179.17 2q80 h LEU 177 N 0.68 1.02 -0.16 2.25 3.38 -0.93 0.11 115.31 121.67 2q80 h LEU 177 Ca 0.14 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2q80 h LEU 177 Cb 0.48 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2q80 h LEU 177 CO 0.02 0.82 0.10 0.78 0.09 0.00 0.00 178.44 180.25 2q80 h ASN 178 N 1.15 0.17 -0.63 -0.43 2.35 0.07 0.27 115.58 118.52 2q80 h ASN 178 Ca 0.29 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 2q80 h ASN 178 Cb 0.03 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 2q80 h ASN 178 CO -0.05 0.12 0.40 0.74 -1.65 0.00 0.00 177.43 177.00 2q80 h THR 179 N 0.20 1.18 -0.44 2.81 2.02 -0.61 -1.43 112.91 116.64 2q80 h THR 179 Ca 0.06 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 2q80 h THR 179 Cb -0.02 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 2q80 h THR 179 CO -0.02 0.17 0.17 -0.07 0.37 0.00 0.00 175.52 176.14 2q80 h LEU 180 N 0.86 0.61 -0.28 2.58 3.38 -0.60 -1.50 115.31 120.36 2q80 h LEU 180 Ca 0.23 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.07 2q80 h LEU 180 Cb -0.06 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.46 2q80 h LEU 180 CO -0.05 0.61 -0.53 1.23 0.09 0.00 0.00 178.44 179.80 2q80 h GLY 181 N 0.56 -1.08 0.54 0.83 0.00 0.45 -0.66 103.07 103.70 2q80 h GLY 181 Ca 0.14 0.71 0.04 0.00 0.00 0.00 0.00 47.33 48.22 2q80 h GLY 181 CO -0.01 -0.18 -0.12 1.41 0.00 0.00 0.00 176.54 177.64 2q80 h LEU 182 N -0.45 -0.38 -0.39 3.11 3.38 -1.23 -2.31 115.31 117.04 2q80 h LEU 182 Ca 0.05 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.18 2q80 h LEU 182 Cb 0.60 0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.45 2q80 h LEU 182 CO -0.51 -0.16 -0.24 0.15 0.09 0.00 0.00 178.44 177.77 2q80 h PHE 183 N -0.15 -0.63 -0.42 1.13 3.57 -0.58 0.18 116.94 120.05 2q80 h PHE 183 Ca 0.09 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2q80 h PHE 183 Cb 0.27 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 2q80 h PHE 183 CO -0.24 -0.32 0.21 0.74 -2.23 0.00 0.00 178.31 176.47 2q80 h PHE 184 N -0.18 0.59 -0.25 0.41 0.04 -0.78 -1.01 116.94 115.76 2q80 h PHE 184 Ca 0.19 -0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.89 2q80 h PHE 184 Cb 0.47 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 2q80 h PHE 184 CO -0.46 0.48 -0.02 0.37 -0.60 0.00 0.00 178.31 178.07 2q80 h GLN 185 N 0.53 0.46 -0.17 1.51 5.75 -0.85 -2.08 115.11 120.26 2q80 h GLN 185 Ca 0.14 -0.16 -0.15 0.00 -0.15 0.00 0.00 58.65 58.34 2q80 h GLN 185 Cb 0.10 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.62 2q80 h GLN 185 CO -0.02 0.65 -0.48 0.82 -2.65 0.00 0.00 178.83 177.14 2q80 h ILE 186 N 0.23 1.33 -0.78 2.39 2.04 -0.58 -1.07 117.51 121.06 2q80 h ILE 186 Ca 0.07 -1.74 0.14 0.00 1.00 0.00 0.00 64.86 64.33 2q80 h ILE 186 Cb 0.45 1.97 -0.14 0.00 -0.74 0.00 0.00 36.82 38.36 2q80 h ILE 186 CO 0.02 0.54 -0.29 -0.09 0.00 0.00 0.00 178.15 178.32 2q80 h ARG 187 N 0.30 -0.05 -0.16 2.37 2.43 -1.23 -0.01 114.38 118.02 2q80 h ARG 187 Ca -0.01 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2q80 h ARG 187 Cb 1.10 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.60 2q80 h ARG 187 CO 0.10 -0.04 -0.25 0.22 -1.51 0.00 0.00 179.97 178.49 2q80 h ASP 188 N -0.06 -0.80 -0.76 -3.80 3.58 -0.94 -0.11 116.42 113.53 2q80 h ASP 188 Ca 0.33 0.13 0.07 0.00 0.42 0.00 0.00 57.03 57.98 2q80 h ASP 188 Cb 0.58 0.36 -0.05 0.00 1.72 0.00 0.00 39.33 41.94 2q80 h ASP 188 CO -0.82 -0.30 0.50 0.44 -2.88 0.00 0.00 179.24 176.18 2q80 h ASP 189 N -0.31 0.71 0.35 2.28 3.32 -0.48 0.89 116.42 123.19 2q80 h ASP 189 Ca 0.11 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2q80 h ASP 189 Cb 0.47 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2q80 h ASP 189 CO -0.34 0.45 -0.17 0.22 -1.72 0.00 0.00 179.24 177.69 2q80 h TYR 190 N 0.80 -0.44 -0.50 4.55 3.20 -0.64 -3.19 116.97 120.76 2q80 h TYR 190 Ca 0.33 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.29 2q80 h TYR 190 Cb 0.27 0.15 -0.10 0.00 1.54 0.00 0.00 36.73 38.58 2q80 h TYR 190 CO -0.00 -0.17 -0.17 0.00 -1.64 0.00 0.00 178.16 176.18 2q80 h ALA 191 N -0.86 0.24 -0.96 1.82 0.00 -0.79 0.11 119.26 118.84 2q80 h ALA 191 Ca -0.05 0.19 0.25 0.00 0.00 0.00 0.00 54.91 55.30 2q80 h ALA 191 Cb 0.47 0.46 -0.13 0.00 0.00 0.00 0.00 17.79 18.59 2q80 h ALA 191 CO 0.08 -0.49 0.49 -0.97 0.00 0.00 0.00 179.25 178.36 2q80 h ASN 192 N -0.06 0.47 0.00 0.00 -0.73 -0.92 -2.71 115.58 111.63 2q80 h ASN 192 Ca 0.24 0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.57 2q80 h ASN 192 Cb 0.42 0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.12 2q80 h ASN 192 CO -0.54 -0.00 -1.44 0.18 -0.37 0.00 0.00 177.43 175.25 2q80 n LEU 193 N -5.00 0.45 -0.03 0.34 4.77 -0.55 -3.52 117.00 113.46 2q80 n LEU 193 Ca 0.26 -0.24 0.04 0.00 -0.03 0.00 0.00 56.01 56.04 2q80 n LEU 193 Cb 0.76 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.70 2q80 n LEU 193 CO 0.13 0.11 -0.83 1.57 -1.33 0.00 0.00 177.39 177.04 2q80 n HIS 194 N -1.84 0.00 0.00 -1.77 -0.00 0.28 -4.92 115.22 106.97 2q80 n HIS 194 Ca -0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2q80 n HIS 194 Cb 0.42 -0.57 0.00 0.00 -0.12 0.00 0.00 29.99 29.73 2q80 n HIS 194 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2q80 n SER 195 N -2.31 0.00 0.00 0.26 3.41 -1.11 -5.06 113.62 108.82 2q80 n SER 195 Ca -0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.50 2q80 n SER 195 Cb 0.67 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 2q80 n SER 195 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2q80 n ASN 201 N 0.00 0.00 -4.86 4.04 3.02 -1.26 -4.98 115.26 111.21 2q80 n ASN 201 Ca 0.00 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.23 2q80 n ASN 201 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2q80 n ASN 201 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2q80 s LYS 202 N 0.00 3.91 0.30 3.52 1.02 -1.26 0.16 119.74 127.39 2q80 s LYS 202 Ca 0.00 0.49 -0.05 0.00 0.02 0.00 0.00 55.97 56.43 2q80 s LYS 202 Cb 0.00 -2.53 0.07 0.00 -0.52 0.00 0.00 37.83 34.85 2q80 s LYS 202 CO 0.00 0.23 0.29 0.45 -0.92 0.00 0.00 175.35 175.40 2q80 n SER 203 N -0.26 -1.05 -4.63 2.83 2.88 -1.26 -4.87 113.62 107.27 2q80 n SER 203 Ca 0.02 -0.75 -0.43 0.00 -1.33 0.00 0.00 58.87 56.39 2q80 n SER 203 Cb 0.53 -0.26 -0.03 0.00 -0.75 0.00 0.00 64.21 63.70 2q80 n SER 203 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2q80 s PHE 204 N -1.55 1.44 -1.55 0.66 5.36 -1.26 -3.26 117.98 117.82 2q80 s PHE 204 Ca 0.18 0.19 -0.12 0.00 -0.96 0.00 0.00 56.93 56.22 2q80 s PHE 204 Cb -0.02 -4.06 0.09 0.00 -0.34 0.00 0.00 43.02 38.70 2q80 s PHE 204 CO 0.14 -4.32 0.78 0.00 -1.46 0.00 0.00 175.22 170.36 2q80 h GLU 206 N -1.81 0.10 -0.26 0.00 5.08 -1.77 -1.14 114.58 114.79 2q80 h GLU 206 Ca -0.60 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 57.75 2q80 h GLU 206 Cb 1.38 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 2q80 h GLU 206 CO 0.69 0.07 0.12 -0.44 -1.00 0.00 0.00 179.01 178.45 2q80 h ASP 207 N 0.11 0.32 0.13 1.42 5.19 -1.87 0.16 116.42 121.88 2q80 h ASP 207 Ca 0.33 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.71 2q80 h ASP 207 Cb 1.15 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.58 2q80 h ASP 207 CO -0.04 0.28 -0.06 -0.07 -3.12 0.00 0.00 179.24 176.23 2q80 h LEU 208 N 0.37 -0.15 -1.35 1.55 3.38 -1.52 -1.24 115.31 116.34 2q80 h LEU 208 Ca 0.09 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.97 2q80 h LEU 208 Cb 0.05 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2q80 h LEU 208 CO -0.01 0.06 0.49 0.74 0.09 0.00 0.00 178.44 179.80 2q80 h THR 209 N -0.37 1.04 -0.82 0.22 2.02 -0.97 0.71 112.91 114.75 2q80 h THR 209 Ca -0.02 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 2q80 h THR 209 Cb 0.30 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.84 2q80 h THR 209 CO 0.03 0.15 0.38 -0.08 0.37 0.00 0.00 175.52 176.36 2q80 h GLU 210 N 0.80 1.19 0.00 6.66 4.81 -0.65 -3.39 114.58 124.00 2q80 h GLU 210 Ca 0.31 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2q80 h GLU 210 Cb 0.22 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2q80 h GLU 210 CO -0.10 0.93 0.00 0.41 -0.73 0.00 0.00 179.01 179.52 2q80 n GLY 211 N -0.99 0.78 3.84 1.92 0.00 0.24 -4.91 105.19 106.07 2q80 n GLY 211 Ca 0.08 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 2q80 n GLY 211 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q80 s LYS 212 N -0.64 3.86 -0.43 1.61 -2.85 -0.96 -4.81 119.74 115.52 2q80 s LYS 212 Ca 0.00 0.99 -0.20 0.00 -1.00 0.00 0.00 55.97 55.76 2q80 s LYS 212 Cb 0.00 -2.12 0.02 0.00 -2.06 0.00 0.00 37.83 33.67 2q80 s LYS 212 CO 0.00 -0.35 0.59 -0.06 0.10 0.00 0.00 175.35 175.63 2q80 s PHE 213 N -2.61 3.10 0.47 1.78 0.08 -1.26 -4.82 117.98 114.71 2q80 s PHE 213 Ca 0.59 -0.11 0.05 0.00 0.12 0.00 0.00 56.93 57.59 2q80 s PHE 213 Cb -0.11 -3.22 -0.02 0.00 -0.57 0.00 0.00 43.02 39.10 2q80 s PHE 213 CO 0.32 -0.81 0.17 -1.54 -0.10 0.00 0.00 175.22 173.27 2q80 s SER 214 N 1.94 4.35 0.16 1.36 1.04 -1.26 -4.93 113.70 116.36 2q80 s SER 214 Ca 0.20 -1.28 -0.22 0.00 0.48 0.00 0.00 55.95 55.12 2q80 s SER 214 Cb -0.15 -0.02 0.05 0.00 0.10 0.00 0.00 66.02 66.00 2q80 s SER 214 CO 0.17 -0.74 1.62 0.15 0.98 0.00 0.00 173.24 175.42 2q80 h PHE 215 N 1.28 -0.72 -0.57 5.02 3.57 -1.93 -0.55 116.94 123.05 2q80 h PHE 215 Ca -0.42 0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.03 2q80 h PHE 215 Cb 1.28 0.36 -0.02 0.00 2.79 0.00 0.00 35.95 40.36 2q80 h PHE 215 CO 0.94 -0.34 -0.02 -1.35 -2.23 0.00 0.00 178.31 175.30 2q80 h PRO 216 N -0.24 1.02 -0.78 6.41 0.11 -1.88 -1.76 132.00 134.88 2q80 h PRO 216 Ca 0.16 -0.34 -0.04 0.00 0.11 0.00 0.00 66.00 65.89 2q80 h PRO 216 Cb 0.49 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.48 2q80 h PRO 216 CO -0.46 1.02 0.33 1.79 -0.21 0.00 0.00 178.00 180.48 2q80 h THR 217 N 0.90 1.25 -0.15 -1.15 1.35 -1.84 -0.99 112.91 112.28 2q80 h THR 217 Ca 0.16 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 2q80 h THR 217 Cb 0.58 0.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.29 2q80 h THR 217 CO 0.03 0.32 0.10 0.40 -0.25 0.00 0.00 175.52 176.12 2q80 h ILE 218 N 1.12 1.04 -0.27 6.82 2.04 -0.84 -0.10 117.51 127.31 2q80 h ILE 218 Ca 0.26 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 66.06 2q80 h ILE 218 Cb 0.18 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2q80 h ILE 218 CO -0.03 0.04 0.17 -0.74 0.00 0.00 0.00 178.15 177.60 2q80 h HIS 219 N 0.21 0.33 -0.20 1.37 2.76 -1.10 -2.71 115.15 115.80 2q80 h HIS 219 Ca 0.06 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.21 2q80 h HIS 219 Cb -0.02 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 2q80 h HIS 219 CO -0.07 0.20 0.01 0.00 -1.30 0.00 0.00 177.93 176.77 2q80 h ALA 220 N 1.11 1.65 0.15 5.26 0.00 -0.86 -1.08 119.26 125.48 2q80 h ALA 220 Ca 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2q80 h ALA 220 Cb -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2q80 h ALA 220 CO -0.03 0.27 -0.07 0.82 0.00 0.00 0.00 179.25 180.23 2q80 h ILE 221 N 0.28 0.98 0.00 0.00 2.04 -0.71 -3.17 117.51 116.94 2q80 h ILE 221 Ca 0.07 -0.73 -0.14 0.00 1.00 0.00 0.00 64.86 65.05 2q80 h ILE 221 Cb 0.19 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2q80 h ILE 221 CO 0.00 0.17 -0.66 -0.50 0.00 0.00 0.00 178.15 177.16 2q80 h TRP 222 N -0.57 0.00 0.00 1.37 4.06 -1.46 -3.28 115.95 116.07 2q80 h TRP 222 Ca -0.02 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.86 2q80 h TRP 222 Cb 0.43 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.58 2q80 h TRP 222 CO 0.04 0.66 -0.33 1.03 -3.56 0.00 0.00 178.44 176.29 2q80 h SER 223 N 0.00 0.00 -2.61 -3.49 0.87 -1.28 -3.33 113.55 103.70 2q80 h SER 223 Ca -0.01 0.00 -0.60 0.00 -1.23 0.00 0.00 61.79 59.95 2q80 h SER 223 Cb 1.29 0.00 -0.39 0.00 -0.44 0.00 0.00 62.40 62.86 2q80 h SER 223 CO 0.09 0.33 -0.83 0.54 -0.53 0.00 0.00 176.83 176.42 2q80 n ARG 224 N -3.91 0.81 0.28 2.24 5.12 -1.20 -4.99 116.66 115.00 2q80 n ARG 224 Ca -0.02 -3.66 0.16 0.00 -1.93 0.00 0.00 57.85 52.41 2q80 n ARG 224 Cb 0.39 -1.89 0.74 0.00 -1.16 0.00 0.00 32.46 30.54 2q80 n ARG 224 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2q80 h PRO 225 N 5.50 0.00 0.00 5.56 0.13 -1.68 -2.72 132.00 138.79 2q80 h PRO 225 Ca 0.22 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.34 2q80 h PRO 225 Cb 0.85 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 2q80 h PRO 225 CO 0.50 0.05 -0.05 1.05 -0.23 0.00 0.00 178.00 179.32 2q80 h GLU 226 N 0.00 0.00 -5.95 0.86 9.09 -1.94 -3.43 114.58 113.21 2q80 h GLU 226 Ca -0.00 0.00 -0.62 0.00 0.05 0.00 0.00 59.36 58.79 2q80 h GLU 226 Cb 0.45 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.49 2q80 h GLU 226 CO 0.01 0.05 -0.29 0.45 0.05 0.00 0.00 179.01 179.28 2q80 s SER 227 N -5.94 6.65 -0.11 3.06 0.15 -1.03 -4.97 113.70 111.51 2q80 s SER 227 Ca 0.03 0.78 0.14 0.00 0.70 0.00 0.00 55.95 57.59 2q80 s SER 227 Cb 0.08 -2.18 0.28 0.00 -1.71 0.00 0.00 66.02 62.50 2q80 s SER 227 CO 0.60 0.29 1.14 0.35 1.20 0.00 0.00 173.24 176.82 2q80 n THR 228 N 1.52 1.41 0.06 6.45 -2.24 -1.26 -4.85 114.28 115.37 2q80 n THR 228 Ca -0.13 -1.96 -0.12 0.00 -2.27 0.00 0.00 64.05 59.57 2q80 n THR 228 Cb 0.53 0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.78 2q80 n THR 228 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2q80 h GLN 229 N 0.37 0.41 -0.05 -0.78 4.15 -1.95 -1.72 115.11 115.54 2q80 h GLN 229 Ca -0.03 -0.40 -0.06 0.00 0.77 0.00 0.00 58.65 58.94 2q80 h GLN 229 Cb 1.17 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.97 2q80 h GLN 229 CO 0.01 1.05 -0.19 0.28 -1.93 0.00 0.00 178.83 178.05 2q80 h VAL 230 N 0.25 1.45 -0.62 2.39 2.07 -1.96 -0.71 116.25 119.12 2q80 h VAL 230 Ca -0.06 -1.63 0.11 0.00 0.82 0.00 0.00 66.70 65.95 2q80 h VAL 230 Cb 1.47 2.38 -0.08 0.00 -1.52 0.00 0.00 31.29 33.54 2q80 h VAL 230 CO 0.15 0.45 0.18 1.56 0.02 0.00 0.00 177.57 179.93 2q80 h GLN 231 N -0.33 0.32 -0.45 1.57 7.50 -1.92 -0.50 115.11 121.30 2q80 h GLN 231 Ca -0.01 -0.02 -0.14 0.00 0.50 0.00 0.00 58.65 58.99 2q80 h GLN 231 Cb 0.83 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.28 2q80 h GLN 231 CO 0.04 0.21 -0.24 -0.91 -1.50 0.00 0.00 178.83 176.42 2q80 h ASN 232 N 0.33 1.00 -0.17 1.46 2.35 -1.30 -1.40 115.58 117.84 2q80 h ASN 232 Ca 0.33 -0.41 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2q80 h ASN 232 Cb 0.47 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 2q80 h ASN 232 CO -0.38 1.19 0.07 0.40 -1.65 0.00 0.00 177.43 177.07 2q80 h ILE 233 N 0.81 1.15 -0.72 2.81 2.04 -0.63 -2.68 117.51 120.29 2q80 h ILE 233 Ca 0.10 -0.43 0.11 0.00 1.00 0.00 0.00 64.86 65.64 2q80 h ILE 233 Cb 0.83 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 2q80 h ILE 233 CO 0.07 0.14 0.48 -0.07 0.00 0.00 0.00 178.15 178.77 2q80 h LEU 234 N 0.13 0.49 -1.15 1.44 3.38 -1.02 -1.83 115.31 116.75 2q80 h LEU 234 Ca 0.06 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2q80 h LEU 234 Cb 0.15 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2q80 h LEU 234 CO -0.01 0.28 -0.38 -0.09 0.09 0.00 0.00 178.44 178.33 2q80 h ARG 235 N 0.54 0.00 0.00 1.13 2.43 -0.94 -2.97 114.38 114.57 2q80 h ARG 235 Ca 0.34 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 2q80 h ARG 235 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2q80 h ARG 235 CO -0.12 0.38 0.00 1.96 -1.51 0.00 0.00 179.97 180.69 2q80 h GLN 236 N 0.00 0.00 -6.56 0.20 1.08 -1.01 -3.47 115.11 105.35 2q80 h GLN 236 Ca -0.00 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.68 2q80 h GLN 236 Cb 0.77 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.09 2q80 h GLN 236 CO 0.05 0.00 -0.84 0.54 -0.95 0.00 0.00 178.83 177.63 2q80 n ARG 237 N -2.87 -3.63 -3.24 1.46 5.12 -1.12 -4.89 116.66 107.50 2q80 n ARG 237 Ca 0.01 0.43 -0.35 0.00 -1.93 0.00 0.00 57.85 56.00 2q80 n ARG 237 Cb 0.26 -4.93 -0.06 0.00 -1.16 0.00 0.00 32.46 26.57 2q80 n ARG 237 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2q80 s THR 238 N -3.57 4.74 -2.17 0.55 -1.32 -1.26 -4.87 115.64 107.73 2q80 s THR 238 Ca 0.41 0.97 0.20 0.00 -1.21 0.00 0.00 61.69 62.06 2q80 s THR 238 Cb -0.22 -3.74 0.49 0.00 -1.51 0.00 0.00 72.50 67.52 2q80 s THR 238 CO 0.89 0.13 1.45 -0.62 -2.21 0.00 0.00 174.62 174.26 2q80 n GLU 239 N 0.48 2.34 -2.12 7.08 1.02 -1.26 -4.10 120.64 124.08 2q80 n GLU 239 Ca -0.02 -2.06 -0.43 0.00 -0.02 0.00 0.00 57.16 54.63 2q80 n GLU 239 Cb 0.52 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.44 2q80 n GLU 239 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2q80 s ASN 240 N -1.21 6.54 0.43 1.62 3.84 -1.26 -4.89 114.94 120.00 2q80 s ASN 240 Ca 0.39 1.81 0.16 0.00 0.21 0.00 0.00 52.86 55.43 2q80 s ASN 240 Cb 0.21 -2.53 0.95 0.00 -0.55 0.00 0.00 41.25 39.33 2q80 s ASN 240 CO 0.28 -1.09 1.94 0.40 -2.79 0.00 0.00 177.10 175.84 2q80 h ILE 241 N 5.89 1.10 -0.19 -5.21 5.03 -1.99 -2.39 117.51 119.75 2q80 h ILE 241 Ca -0.34 -0.87 -0.19 0.00 -0.12 0.00 0.00 64.86 63.34 2q80 h ILE 241 Cb 1.15 1.48 0.00 0.00 -3.03 0.00 0.00 36.82 36.42 2q80 h ILE 241 CO 0.98 0.24 -0.64 0.44 -0.68 0.00 0.00 178.15 178.49 2q80 h ASP 242 N 0.00 0.80 -0.45 1.72 3.32 -1.99 -0.68 116.42 119.14 2q80 h ASP 242 Ca -0.00 -0.47 -0.13 0.00 0.02 0.00 0.00 57.03 56.45 2q80 h ASP 242 Cb 0.46 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 2q80 h ASP 242 CO 0.03 1.24 -0.22 0.40 -1.72 0.00 0.00 179.24 178.97 2q80 h ILE 243 N 0.51 1.27 0.02 0.35 2.04 -1.90 0.45 117.51 120.24 2q80 h ILE 243 Ca -0.01 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.47 2q80 h ILE 243 Cb 1.23 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2q80 h ILE 243 CO 0.13 0.47 -0.01 0.11 0.00 0.00 0.00 178.15 178.85 2q80 h LYS 244 N 0.83 -0.02 -0.56 2.37 1.57 -1.39 -0.02 116.57 119.35 2q80 h LYS 244 Ca 0.11 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.98 2q80 h LYS 244 Cb 0.79 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.03 2q80 h LYS 244 CO 0.07 0.18 0.19 0.87 -0.57 0.00 0.00 179.45 180.18 2q80 h LYS 245 N -0.22 0.34 -0.78 3.15 1.57 -1.05 -0.75 116.57 118.82 2q80 h LYS 245 Ca -0.00 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.82 2q80 h LYS 245 Cb 0.22 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.39 2q80 h LYS 245 CO 0.00 0.23 0.47 -0.92 -0.57 0.00 0.00 179.45 178.66 2q80 h TYR 246 N 0.35 0.86 -0.44 -1.35 3.20 -0.69 -2.34 116.97 116.57 2q80 h TYR 246 Ca 0.28 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.09 2q80 h TYR 246 Cb 0.35 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2q80 h TYR 246 CO -0.18 0.41 -0.06 0.00 -1.64 0.00 0.00 178.16 176.69 2q80 h VAL 248 N 0.65 1.22 -0.68 0.00 2.07 -0.96 -1.77 116.25 116.78 2q80 h VAL 248 Ca 0.12 -0.95 0.05 0.00 0.82 0.00 0.00 66.70 66.74 2q80 h VAL 248 Cb 0.58 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 2q80 h VAL 248 CO 0.03 0.31 0.40 0.45 0.02 0.00 0.00 177.57 178.78 2q80 h HIS 249 N 0.46 0.73 -0.24 1.57 -0.00 -1.23 -1.14 115.15 115.30 2q80 h HIS 249 Ca 0.09 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.44 2q80 h HIS 249 Cb 0.45 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.62 2q80 h HIS 249 CO 0.01 0.37 -0.02 -0.92 -0.00 0.00 0.00 177.93 177.38 2q80 h TYR 250 N 0.74 0.49 -0.95 2.45 3.20 -0.97 0.60 116.97 122.53 2q80 h TYR 250 Ca 0.29 -0.09 0.09 0.00 3.14 0.00 0.00 58.73 62.16 2q80 h TYR 250 Cb 0.13 -0.13 -0.07 0.00 1.54 0.00 0.00 36.73 38.21 2q80 h TYR 250 CO -0.06 0.63 0.61 -0.07 -1.64 0.00 0.00 178.16 177.63 2q80 h LEU 251 N 0.21 0.92 -0.32 2.82 3.38 -1.12 0.21 115.31 121.40 2q80 h LEU 251 Ca 0.07 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 2q80 h LEU 251 Cb 0.45 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2q80 h LEU 251 CO 0.02 0.55 -0.36 -0.08 0.09 0.00 0.00 178.44 178.66 2q80 h GLU 252 N 1.02 0.80 -0.90 1.13 4.57 -0.94 0.12 114.58 120.38 2q80 h GLU 252 Ca 0.43 -0.44 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 2q80 h GLU 252 Cb 0.32 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.90 2q80 h GLU 252 CO -0.19 1.07 0.48 -0.44 -1.18 0.00 0.00 179.01 178.75 2q80 h ASP 253 N 0.57 1.13 1.05 1.04 3.32 -0.02 -2.91 116.42 120.60 2q80 h ASP 253 Ca 0.04 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2q80 h ASP 253 Cb 0.95 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2q80 h ASP 253 CO 0.09 0.92 -0.16 0.52 -1.72 0.00 0.00 179.24 178.88 2q80 n VAL 254 N -4.32 0.23 -0.53 -1.35 0.31 -0.02 -4.94 118.33 107.70 2q80 n VAL 254 Ca 0.09 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2q80 n VAL 254 Cb 0.11 -0.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.67 2q80 n VAL 254 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2q80 n GLY 255 N 1.42 0.68 0.19 2.92 0.00 -0.89 -4.98 105.19 104.54 2q80 n GLY 255 Ca 0.06 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.65 2q80 n GLY 255 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2q80 h SER 256 N 0.00 0.00 0.73 1.61 0.02 -1.03 -1.83 113.55 113.05 2q80 h SER 256 Ca 0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 2q80 h SER 256 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2q80 h SER 256 CO 0.00 0.36 -1.07 -0.26 -1.14 0.00 0.00 176.83 174.71 2q80 h PHE 257 N 0.00 0.29 -0.40 3.45 0.04 -1.89 -2.09 116.94 116.34 2q80 h PHE 257 Ca -0.00 -0.20 -0.09 0.00 2.80 0.00 0.00 57.97 60.47 2q80 h PHE 257 Cb 0.78 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 2q80 h PHE 257 CO 0.00 1.12 -0.13 1.49 -0.60 0.00 0.00 178.31 180.19 2q80 h GLU 258 N 0.06 0.73 -0.23 1.51 4.57 -1.86 -1.50 114.58 117.86 2q80 h GLU 258 Ca -0.07 -0.24 -0.11 0.00 -1.18 0.00 0.00 59.36 57.75 2q80 h GLU 258 Cb 1.79 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 30.32 2q80 h GLU 258 CO 0.16 0.83 -0.28 -0.92 -1.18 0.00 0.00 179.01 177.62 2q80 h TYR 259 N 0.66 0.73 -0.83 0.92 3.20 -1.29 -1.98 116.97 118.38 2q80 h TYR 259 Ca 0.11 -0.23 -0.04 0.00 3.14 0.00 0.00 58.73 61.71 2q80 h TYR 259 Cb 0.59 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 2q80 h TYR 259 CO 0.03 0.95 0.37 1.15 -1.64 0.00 0.00 178.16 179.02 2q80 h THR 260 N 0.30 1.26 -0.78 1.81 2.02 -1.32 -1.79 112.91 114.42 2q80 h THR 260 Ca 0.03 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 2q80 h THR 260 Cb 0.85 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 2q80 h THR 260 CO 0.07 0.33 0.31 0.03 0.37 0.00 0.00 175.52 176.63 2q80 h ARG 261 N 1.20 1.16 -0.20 6.66 3.08 -0.98 -1.50 114.38 123.78 2q80 h ARG 261 Ca 0.28 -0.21 -0.14 0.00 0.07 0.00 0.00 59.98 59.98 2q80 h ARG 261 Cb 0.16 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2q80 h ARG 261 CO -0.03 0.94 -0.47 -0.91 -1.07 0.00 0.00 179.97 178.42 2q80 h ASN 262 N 1.12 0.57 -0.26 7.04 2.35 -1.02 -1.37 115.58 124.02 2q80 h ASN 262 Ca 0.26 -0.28 0.02 0.00 -0.55 0.00 0.00 56.30 55.75 2q80 h ASN 262 Cb 0.21 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2q80 h ASN 262 CO -0.02 0.96 0.13 0.74 -1.65 0.00 0.00 177.43 177.58 2q80 h THR 263 N 0.42 0.99 -0.23 2.81 2.02 -1.03 0.52 112.91 118.41 2q80 h THR 263 Ca 0.02 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2q80 h THR 263 Cb 0.99 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2q80 h THR 263 CO 0.09 0.05 0.03 -0.07 0.37 0.00 0.00 175.52 175.99 2q80 h LEU 264 N 0.27 0.30 -0.07 2.58 3.38 -1.09 0.40 115.31 121.08 2q80 h LEU 264 Ca 0.10 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2q80 h LEU 264 Cb 0.03 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2q80 h LEU 264 CO -0.07 0.34 -0.14 0.11 0.09 0.00 0.00 178.44 178.76 2q80 h LYS 265 N 0.33 0.22 -0.47 1.13 1.57 -0.85 -2.08 116.57 116.42 2q80 h LYS 265 Ca 0.08 -0.14 0.09 0.00 -1.87 0.00 0.00 60.65 58.81 2q80 h LYS 265 Cb 0.18 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.43 2q80 h LYS 265 CO 0.00 0.73 0.00 0.93 -0.57 0.00 0.00 179.45 180.54 2q80 h GLU 266 N -0.26 0.11 -0.42 3.15 5.08 -0.56 -1.00 114.58 120.67 2q80 h GLU 266 Ca 0.00 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2q80 h GLU 266 Cb 0.73 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 2q80 h GLU 266 CO 0.03 0.07 0.24 -0.07 -1.00 0.00 0.00 179.01 178.29 2q80 h LEU 267 N 0.11 0.52 -0.63 1.33 3.38 -0.92 -0.66 115.31 118.44 2q80 h LEU 267 Ca 0.24 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.19 2q80 h LEU 267 Cb 0.35 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 2q80 h LEU 267 CO -0.39 0.44 0.35 -0.08 0.09 0.00 0.00 178.44 178.85 2q80 h GLU 268 N 0.56 0.64 -0.47 1.13 4.81 -0.99 -0.32 114.58 119.93 2q80 h GLU 268 Ca 0.15 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2q80 h GLU 268 Cb 0.03 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 2q80 h GLU 268 CO -0.03 0.42 0.29 0.00 -0.73 0.00 0.00 179.01 178.97 2q80 h ALA 269 N 1.33 0.60 -0.33 2.92 0.00 -0.72 -2.31 119.26 120.75 2q80 h ALA 269 Ca 0.28 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2q80 h ALA 269 Cb 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2q80 h ALA 269 CO -0.17 0.00 0.17 -0.22 0.00 0.00 0.00 179.25 179.04 2q80 h LYS 270 N 0.60 0.47 -0.52 0.00 3.64 -0.31 -1.44 116.57 119.01 2q80 h LYS 270 Ca 0.18 -0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.56 2q80 h LYS 270 Cb -0.03 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.65 2q80 h LYS 270 CO -0.06 0.42 0.23 0.00 -2.27 0.00 0.00 179.45 177.76 2q80 h ALA 271 N 1.03 0.66 -0.68 5.00 0.00 -0.98 0.39 119.26 124.68 2q80 h ALA 271 Ca 0.12 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2q80 h ALA 271 Cb 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2q80 h ALA 271 CO -0.02 -0.15 0.40 1.88 0.00 0.00 0.00 179.25 181.36 2q80 h TYR 272 N 0.43 0.91 -0.19 0.00 0.05 -1.07 0.12 116.97 117.22 2q80 h TYR 272 Ca 0.24 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 59.00 2q80 h TYR 272 Cb 0.22 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.66 2q80 h TYR 272 CO -0.13 0.62 0.06 -0.22 -1.05 0.00 0.00 178.16 177.44 2q80 h LYS 273 N 0.93 0.30 -0.47 4.88 1.63 -0.57 -1.90 116.57 121.37 2q80 h LYS 273 Ca 0.24 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.91 2q80 h LYS 273 Cb -0.01 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2q80 h LYS 273 CO -0.04 0.39 -0.02 1.96 -3.45 0.00 0.00 179.45 178.29 2q80 h GLN 274 N 0.14 0.78 -0.72 1.90 4.20 -0.07 -1.16 115.11 120.18 2q80 h GLN 274 Ca 0.06 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.53 2q80 h GLN 274 Cb 0.22 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 2q80 h GLN 274 CO -0.00 0.80 0.37 0.82 -0.67 0.00 0.00 178.83 180.14 2q80 h ILE 275 N 0.73 1.23 -0.25 2.54 2.04 -0.74 -2.89 117.51 120.17 2q80 h ILE 275 Ca 0.14 -0.63 -0.08 0.00 1.00 0.00 0.00 64.86 65.30 2q80 h ILE 275 Cb 0.47 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 2q80 h ILE 275 CO 0.02 0.27 -0.17 -0.78 0.00 0.00 0.00 178.15 177.48 2q80 h ASP 276 N 1.01 0.43 0.29 1.72 3.58 -0.87 -0.86 116.42 121.73 2q80 h ASP 276 Ca 0.25 -0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.54 2q80 h ASP 276 Cb 0.09 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 2q80 h ASP 276 CO -0.03 0.63 -0.18 0.00 -2.88 0.00 0.00 179.24 176.77 2q80 h ALA 277 N 1.41 1.47 -0.39 -0.78 0.00 -1.01 -2.06 119.26 117.91 2q80 h ALA 277 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2q80 h ALA 277 Cb 0.54 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2q80 h ALA 277 CO 0.04 0.23 0.00 0.54 0.00 0.00 0.00 179.25 180.05 2q80 n ARG 278 N -3.99 3.38 -1.58 0.00 5.12 -0.94 -4.89 116.66 113.75 2q80 n ARG 278 Ca -0.02 -2.02 0.00 0.00 -1.93 0.00 0.00 57.85 53.88 2q80 n ARG 278 Cb 0.27 -1.93 0.00 0.00 -1.16 0.00 0.00 32.46 29.64 2q80 n ARG 278 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2q80 n GLY 279 N 0.51 0.46 0.24 -0.13 0.00 -0.77 -4.92 105.19 100.58 2q80 n GLY 279 Ca 0.18 -0.89 0.02 0.00 0.00 0.00 0.00 46.02 45.33 2q80 n GLY 279 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q80 n GLY 280 N -1.59 -2.79 2.81 -0.02 0.00 -0.37 -4.98 105.19 98.26 2q80 n GLY 280 Ca 0.00 -1.36 -0.01 0.00 0.00 0.00 0.00 46.02 44.65 2q80 n GLY 280 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2q80 s ASN 281 N -4.35 -0.81 0.46 1.61 3.84 -1.26 -4.92 114.94 109.51 2q80 s ASN 281 Ca 0.00 -0.73 0.16 0.00 0.21 0.00 0.00 52.86 52.51 2q80 s ASN 281 Cb 0.00 1.05 1.08 0.00 -0.55 0.00 0.00 41.25 42.83 2q80 s ASN 281 CO 0.00 -0.06 2.01 -0.65 -2.79 0.00 0.00 177.10 175.61 2q80 h PRO 282 N 5.20 0.00 -0.00 0.43 0.11 -1.98 -1.30 132.00 134.46 2q80 h PRO 282 Ca 0.01 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.92 2q80 h PRO 282 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2q80 h PRO 282 CO -0.03 0.17 -0.88 1.49 -0.21 0.00 0.00 178.00 178.54 2q80 h GLU 283 N 0.00 0.27 -0.20 1.05 4.81 -1.97 -1.03 114.58 117.52 2q80 h GLU 283 Ca -0.00 -0.28 -0.17 0.00 -0.13 0.00 0.00 59.36 58.78 2q80 h GLU 283 Cb 0.32 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2q80 h GLU 283 CO 0.02 0.99 -0.57 1.25 -0.73 0.00 0.00 179.01 179.97 2q80 h LEU 284 N 0.15 0.69 -0.46 1.64 5.85 -1.61 -2.53 115.31 119.05 2q80 h LEU 284 Ca -0.05 -0.38 -0.05 0.00 0.84 0.00 0.00 57.88 58.24 2q80 h LEU 284 Cb 1.50 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 2q80 h LEU 284 CO 0.14 1.12 0.10 0.58 -0.34 0.00 0.00 178.44 180.04 2q80 h VAL 285 N 0.47 1.24 -0.61 1.05 2.07 -1.27 0.92 116.25 120.12 2q80 h VAL 285 Ca 0.00 -0.84 0.11 0.00 0.82 0.00 0.00 66.70 66.80 2q80 h VAL 285 Cb 1.14 0.91 -0.09 0.00 -1.52 0.00 0.00 31.29 31.73 2q80 h VAL 285 CO 0.11 0.30 0.13 0.00 0.02 0.00 0.00 177.57 178.13 2q80 h ALA 286 N 0.97 0.73 -0.33 1.67 0.00 -1.13 0.18 119.26 121.34 2q80 h ALA 286 Ca 0.14 0.13 -0.12 0.00 0.00 0.00 0.00 54.91 55.06 2q80 h ALA 286 Cb 0.34 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2q80 h ALA 286 CO 0.00 -0.30 -0.26 1.25 0.00 0.00 0.00 179.25 179.94 2q80 h LEU 287 N 0.26 0.81 -0.55 0.00 5.85 -0.95 0.64 115.31 121.38 2q80 h LEU 287 Ca 0.32 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 2q80 h LEU 287 Cb 0.48 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2q80 h LEU 287 CO -0.41 1.08 0.25 0.58 -0.34 0.00 0.00 178.44 179.61 2q80 h VAL 288 N 0.54 1.21 -0.41 1.05 2.07 -0.38 -0.71 116.25 119.61 2q80 h VAL 288 Ca 0.06 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 2q80 h VAL 288 Cb 0.83 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2q80 h VAL 288 CO 0.07 0.24 0.06 0.50 0.02 0.00 0.00 177.57 178.45 2q80 h LYS 289 N 0.74 0.69 -0.40 1.57 3.11 -0.43 -1.17 116.57 120.68 2q80 h LYS 289 Ca 0.19 -0.19 0.01 0.00 -2.81 0.00 0.00 60.65 57.84 2q80 h LYS 289 Cb 0.14 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.27 2q80 h LYS 289 CO -0.02 0.74 0.26 1.25 -2.81 0.00 0.00 179.45 178.87 2q80 h HIS 290 N 0.54 0.49 0.00 1.91 6.17 -0.73 -2.21 115.15 121.32 2q80 h HIS 290 Ca 0.12 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.22 2q80 h HIS 290 Cb 0.39 -0.17 0.00 0.00 2.52 0.00 0.00 27.41 30.16 2q80 h HIS 290 CO 0.03 0.31 0.00 1.28 0.71 0.00 0.00 177.93 180.26 2q80 n LEU 291 N -4.82 0.00 0.11 0.26 4.77 -0.28 -2.80 117.00 114.24 2q80 n LEU 291 Ca 0.01 0.50 0.10 0.00 -0.03 0.00 0.00 56.01 56.58 2q80 n LEU 291 Cb 0.03 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.63 2q80 n LEU 291 CO 0.34 -0.20 0.08 0.28 -1.33 0.00 0.00 177.39 176.57 2q80 h SER 292 N 0.00 0.00 -1.19 -1.43 0.02 -0.58 -3.35 113.55 107.02 2q80 h SER 292 Ca 0.00 0.00 0.38 0.00 -0.84 0.00 0.00 61.79 61.33 2q80 h SER 292 Cb 0.30 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 62.71 2q80 h SER 292 CO 0.00 0.07 0.74 0.11 -1.14 0.00 0.00 176.83 176.61 2q80 h LYS 293 N 0.00 0.17 0.00 3.45 1.57 -1.47 -1.92 116.57 118.37 2q80 h LYS 293 Ca -0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2q80 h LYS 293 Cb 1.07 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.34 2q80 h LYS 293 CO 0.01 0.11 0.19 -0.12 -0.57 0.00 0.00 179.45 179.07 2q80 n MET 294 N -4.79 0.00 0.00 3.15 1.56 -1.26 -5.19 117.12 110.59 2q80 n MET 294 Ca 0.34 0.17 0.00 0.00 -0.27 0.00 0.00 57.70 57.94 2q80 n MET 294 Cb 1.24 -1.69 0.00 0.00 2.15 0.00 0.00 33.22 34.92 2q80 n MET 294 CO 0.00 0.00 0.00 1.97 -0.73 0.00 0.00 175.97 177.21