#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dg8 n GLN 9 N 0.00 0.00 -0.07 -0.52 0.00 -1.26 -4.85 117.38 110.69 2dg8 n GLN 9 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 57.00 56.88 2dg8 n GLN 9 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 30.24 30.14 2dg8 n GLN 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2dg8 h ARG 10 N 0.00 0.80 0.26 2.61 3.08 -2.05 -1.70 114.38 117.38 2dg8 h ARG 10 Ca 0.00 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2dg8 h ARG 10 Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2dg8 h ARG 10 CO 0.00 1.10 -0.28 -0.09 -1.07 0.00 0.00 179.97 179.63 2dg8 h ARG 11 N 0.63 -0.55 -0.08 0.04 9.65 -2.00 -2.22 114.38 119.85 2dg8 h ARG 11 Ca 0.03 0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 2dg8 h ARG 11 Cb 1.07 0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.77 2dg8 h ARG 11 CO 0.11 -0.37 -0.03 0.93 2.80 0.00 0.00 179.97 183.40 2dg8 h GLU 12 N -0.57 0.11 -0.32 0.20 4.39 -1.87 -1.59 114.58 114.92 2dg8 h GLU 12 Ca -0.00 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.59 2dg8 h GLU 12 Cb 0.54 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2dg8 h GLU 12 CO -0.07 0.16 -0.18 0.00 -1.16 0.00 0.00 179.01 177.75 2dg8 h ARG 13 N 0.11 0.60 0.11 2.33 3.08 -0.86 0.12 114.38 119.87 2dg8 h ARG 13 Ca 0.03 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 2dg8 h ARG 13 Cb 0.14 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2dg8 h ARG 13 CO 0.01 0.75 -0.05 0.82 -1.07 0.00 0.00 179.97 180.42 2dg8 h ILE 14 N 0.54 1.10 -0.39 2.04 1.08 -0.73 -1.85 117.51 119.30 2dg8 h ILE 14 Ca 0.09 -1.04 0.05 0.00 -0.39 0.00 0.00 64.86 63.56 2dg8 h ILE 14 Cb 0.62 1.74 -0.04 0.00 -3.07 0.00 0.00 36.82 36.07 2dg8 h ILE 14 CO 0.04 0.24 0.14 -0.07 -0.69 0.00 0.00 178.15 177.81 2dg8 h LEU 15 N -0.65 0.15 -0.80 1.44 3.38 -1.29 0.29 115.31 117.83 2dg8 h LEU 15 Ca -0.01 0.04 0.15 0.00 0.09 0.00 0.00 57.88 58.14 2dg8 h LEU 15 Cb 0.51 0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.19 2dg8 h LEU 15 CO 0.02 0.12 0.37 0.00 0.09 0.00 0.00 178.44 179.05 2dg8 h ALA 16 N 1.25 1.18 -0.22 1.53 0.00 -0.75 -0.43 119.26 121.81 2dg8 h ALA 16 Ca 0.18 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.05 2dg8 h ALA 16 Cb 0.15 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2dg8 h ALA 16 CO -0.18 -0.16 -0.44 0.00 0.00 0.00 0.00 179.25 178.47 2dg8 h ALA 17 N 1.56 0.82 -0.38 0.00 0.00 -0.29 -2.84 119.26 118.12 2dg8 h ALA 17 Ca 0.44 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2dg8 h ALA 17 Cb 0.66 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2dg8 h ALA 17 CO -0.39 0.66 -0.19 1.79 0.00 0.00 0.00 179.25 181.12 2dg8 h THR 18 N 0.45 1.28 -0.65 0.00 1.35 0.53 -0.49 112.91 115.39 2dg8 h THR 18 Ca 0.03 -1.32 0.02 0.00 -0.55 0.00 0.00 66.41 64.59 2dg8 h THR 18 Cb 0.95 1.32 -0.04 0.00 -1.73 0.00 0.00 68.15 68.65 2dg8 h THR 18 CO 0.08 0.44 0.42 -0.07 -0.25 0.00 0.00 175.52 176.14 2dg8 h LEU 19 N 0.60 0.70 -0.60 3.87 -0.00 -1.18 0.32 115.31 119.02 2dg8 h LEU 19 Ca 0.08 -0.01 0.02 0.00 -0.00 0.00 0.00 57.88 57.97 2dg8 h LEU 19 Cb 0.74 -0.16 -0.03 0.00 -0.00 0.00 0.00 40.66 41.21 2dg8 h LEU 19 CO 0.06 0.49 0.39 0.44 -0.00 0.00 0.00 178.44 179.82 2dg8 h ASP 20 N 0.83 0.65 -0.24 -0.43 5.19 -1.31 0.20 116.42 121.31 2dg8 h ASP 20 Ca 0.25 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.64 2dg8 h ASP 20 Cb -0.03 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 2dg8 h ASP 20 CO -0.08 0.46 0.11 0.25 -3.12 0.00 0.00 179.24 176.86 2dg8 h LEU 21 N 0.77 0.31 0.04 1.55 5.85 -0.01 -0.14 115.31 123.68 2dg8 h LEU 21 Ca 0.23 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2dg8 h LEU 21 Cb -0.03 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.92 2dg8 h LEU 21 CO -0.08 0.36 -0.02 0.40 -0.34 0.00 0.00 178.44 178.77 2dg8 h ILE 22 N 0.24 0.98 -0.29 4.05 2.04 0.03 0.33 117.51 124.89 2dg8 h ILE 22 Ca 0.08 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 2dg8 h ILE 22 Cb 0.14 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2dg8 h ILE 22 CO -0.01 0.01 0.16 0.00 0.00 0.00 0.00 178.15 178.31 2dg8 h ALA 23 N 0.88 1.72 0.01 1.87 0.00 -0.52 0.30 119.26 123.53 2dg8 h ALA 23 Ca -0.01 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 2dg8 h ALA 23 Cb 0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2dg8 h ALA 23 CO 0.01 0.23 -1.03 0.93 0.00 0.00 0.00 179.25 179.40 2dg8 h GLU 24 N 0.40 0.03 -0.01 0.00 5.08 -0.63 -3.42 114.58 116.03 2dg8 h GLU 24 Ca 0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2dg8 h GLU 24 Cb 0.02 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2dg8 h GLU 24 CO -0.02 1.03 -0.08 0.39 -1.00 0.00 0.00 179.01 179.33 2dg8 n GLU 25 N -4.39 1.15 0.00 2.33 1.02 0.11 -5.09 120.64 115.77 2dg8 n GLU 25 Ca -0.27 -0.81 0.00 0.00 -0.02 0.00 0.00 57.16 56.06 2dg8 n GLU 25 Cb 0.67 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 2dg8 n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dg8 n GLY 26 N 0.66 0.51 0.39 0.62 0.00 0.09 -4.49 105.19 102.97 2dg8 n GLY 26 Ca 0.04 -1.63 0.18 0.00 0.00 0.00 0.00 46.02 44.61 2dg8 n GLY 26 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2dg8 h ILE 27 N 0.00 0.68 -0.77 -0.61 6.09 -1.87 -2.57 117.51 118.47 2dg8 h ILE 27 Ca 0.00 -0.17 0.03 0.00 -1.37 0.00 0.00 64.86 63.35 2dg8 h ILE 27 Cb 0.00 0.13 -0.04 0.00 0.47 0.00 0.00 36.82 37.38 2dg8 h ILE 27 CO 0.00 0.09 0.51 0.00 -3.07 0.00 0.00 178.15 175.68 2dg8 h ALA 28 N 1.61 1.54 0.00 0.18 0.00 -1.96 -2.53 119.26 118.11 2dg8 h ALA 28 Ca 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2dg8 h ALA 28 Cb 1.11 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2dg8 h ALA 28 CO -0.23 0.39 0.00 0.54 0.00 0.00 0.00 179.25 179.95 2dg8 n ARG 29 N -4.45 0.81 -2.52 0.00 1.74 -0.97 -4.82 116.66 106.46 2dg8 n ARG 29 Ca 0.10 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.75 2dg8 n ARG 29 Cb 0.11 -1.13 -0.02 0.00 -1.02 0.00 0.00 32.46 30.40 2dg8 n ARG 29 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2dg8 s VAL 30 N -2.00 4.44 -0.06 1.55 1.01 -0.95 -4.88 120.40 119.51 2dg8 s VAL 30 Ca 0.10 1.74 -0.26 0.00 0.00 0.00 0.00 61.98 63.57 2dg8 s VAL 30 Cb 0.05 -4.12 0.06 0.00 0.00 0.00 0.00 36.38 32.36 2dg8 s VAL 30 CO 0.08 -0.12 0.58 -0.94 0.00 0.00 0.00 175.10 174.70 2dg8 s SER 31 N 1.60 -0.54 0.18 3.32 1.04 -1.26 -5.04 113.70 112.99 2dg8 s SER 31 Ca 0.51 0.62 -0.20 0.00 0.48 0.00 0.00 55.95 57.36 2dg8 s SER 31 Cb -0.20 0.57 0.11 0.00 0.10 0.00 0.00 66.02 66.60 2dg8 s SER 31 CO 0.13 -0.52 1.61 0.45 0.98 0.00 0.00 173.24 175.88 2dg8 h HIS 32 N 3.47 -0.74 -0.38 5.02 3.86 -1.97 0.17 115.15 124.57 2dg8 h HIS 32 Ca -0.28 0.06 0.05 0.00 -1.16 0.00 0.00 60.37 59.04 2dg8 h HIS 32 Cb 1.15 0.40 -0.05 0.00 1.06 0.00 0.00 27.41 29.97 2dg8 h HIS 32 CO 0.42 -0.35 0.11 0.07 0.86 0.00 0.00 177.93 179.04 2dg8 h ARG 33 N -0.17 0.24 -0.19 2.45 -0.00 -1.97 0.25 114.38 114.99 2dg8 h ARG 33 Ca 0.21 -0.01 -0.15 0.00 -0.00 0.00 0.00 59.98 60.03 2dg8 h ARG 33 Cb 0.51 -0.06 -0.01 0.00 -0.00 0.00 0.00 29.97 30.42 2dg8 h ARG 33 CO -0.58 0.16 -0.49 -0.09 -0.00 0.00 0.00 179.97 178.98 2dg8 h ARG 34 N 0.25 0.52 -0.21 0.08 2.43 -1.70 -3.01 114.38 112.73 2dg8 h ARG 34 Ca 0.18 -0.30 -0.18 0.00 -0.81 0.00 0.00 59.98 58.87 2dg8 h ARG 34 Cb 0.19 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2dg8 h ARG 34 CO -0.21 0.89 -0.59 0.82 -1.51 0.00 0.00 179.97 179.37 2dg8 h ILE 35 N 0.41 1.29 -0.49 1.20 2.04 -0.38 -3.02 117.51 118.57 2dg8 h ILE 35 Ca 0.02 -1.80 0.08 0.00 1.00 0.00 0.00 64.86 64.16 2dg8 h ILE 35 Cb 1.01 1.85 -0.07 0.00 -0.74 0.00 0.00 36.82 38.87 2dg8 h ILE 35 CO 0.09 0.57 0.11 0.00 0.00 0.00 0.00 178.15 178.93 2dg8 h ALA 36 N 0.60 0.55 -0.62 1.87 0.00 -0.51 -0.93 119.26 120.23 2dg8 h ALA 36 Ca -0.01 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.06 2dg8 h ALA 36 Cb 1.21 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 2dg8 h ALA 36 CO 0.13 -0.29 0.30 1.96 0.00 0.00 0.00 179.25 181.34 2dg8 h GLN 37 N 0.25 0.53 0.49 0.00 4.20 -1.52 -1.14 115.11 117.93 2dg8 h GLN 37 Ca 0.24 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.90 2dg8 h GLN 37 Cb 0.31 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2dg8 h GLN 37 CO -0.30 0.35 -0.24 0.00 -0.67 0.00 0.00 178.83 177.97 2dg8 h ARG 38 N 0.55 -0.64 0.00 1.46 3.08 -1.09 -3.12 114.38 114.61 2dg8 h ARG 38 Ca 0.29 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.38 2dg8 h ARG 38 Cb 0.26 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2dg8 h ARG 38 CO -0.22 -0.42 0.00 0.00 -1.07 0.00 0.00 179.97 178.25 2dg8 n ALA 39 N -2.36 1.20 -2.71 0.04 0.00 -0.48 -4.87 120.51 111.32 2dg8 n ALA 39 Ca -0.08 0.04 -0.07 0.00 0.00 0.00 0.00 53.44 53.33 2dg8 n ALA 39 Cb 0.26 -1.15 0.03 0.00 0.00 0.00 0.00 19.45 18.59 2dg8 n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dg8 n GLY 40 N -1.03 -0.72 3.14 0.00 0.00 -0.48 -5.01 105.19 101.10 2dg8 n GLY 40 Ca 0.01 0.33 -0.09 0.00 0.00 0.00 0.00 46.02 46.26 2dg8 n GLY 40 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dg8 s VAL 41 N -3.19 0.13 0.60 1.61 -7.23 -0.92 -5.07 120.40 106.33 2dg8 s VAL 41 Ca 0.22 -1.09 -0.20 0.00 -1.81 0.00 0.00 61.98 59.10 2dg8 s VAL 41 Cb -0.03 -0.97 -0.03 0.00 0.56 0.00 0.00 36.38 35.91 2dg8 s VAL 41 CO 0.54 -0.60 1.29 -2.65 -0.31 0.00 0.00 175.10 173.37 2dg8 n PRO 42 N 0.64 1.36 0.31 4.82 -0.02 -1.26 -4.58 135.00 136.28 2dg8 n PRO 42 Ca -0.18 0.52 0.19 0.00 -2.02 0.00 0.00 63.50 62.01 2dg8 n PRO 42 Cb 0.59 -2.52 1.00 0.00 -0.02 0.00 0.00 33.50 32.55 2dg8 n PRO 42 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2dg8 h LEU 43 N 0.95 0.00 -0.34 2.45 6.46 -1.94 0.11 115.31 123.00 2dg8 h LEU 43 Ca -0.51 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.25 2dg8 h LEU 43 Cb 1.33 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.26 2dg8 h LEU 43 CO 0.55 0.02 0.00 0.61 -0.62 0.00 0.00 178.44 179.00 2dg8 n GLY 44 N -0.80 -1.34 0.09 3.75 0.00 -1.26 -2.76 105.19 102.87 2dg8 n GLY 44 Ca -0.02 0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2dg8 n GLY 44 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dg8 h SER 45 N 0.00 0.24 -0.17 1.61 4.64 -1.30 -2.60 113.55 115.96 2dg8 h SER 45 Ca 0.00 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 2dg8 h SER 45 Cb 0.44 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 2dg8 h SER 45 CO 0.00 1.18 0.08 0.24 -0.87 0.00 0.00 176.83 177.45 2dg8 h MET 46 N 0.05 0.25 -0.35 4.77 2.07 -1.61 -1.48 114.93 118.63 2dg8 h MET 46 Ca -0.08 -0.04 -0.09 0.00 -2.07 0.00 0.00 59.70 57.42 2dg8 h MET 46 Cb 1.84 -0.04 -0.02 0.00 -1.87 0.00 0.00 31.60 31.51 2dg8 h MET 46 CO 0.17 0.30 -0.16 0.00 1.07 0.00 0.00 176.91 178.29 2dg8 h THR 47 N 0.14 1.26 -0.47 2.22 1.03 -1.64 0.32 112.91 115.76 2dg8 h THR 47 Ca 0.06 -1.18 -0.10 0.00 -0.01 0.00 0.00 66.41 65.18 2dg8 h THR 47 Cb 0.14 1.17 -0.02 0.00 -1.07 0.00 0.00 68.15 68.37 2dg8 h THR 47 CO -0.01 0.39 -0.11 0.22 -0.01 0.00 0.00 175.52 176.01 2dg8 h TYR 48 N 0.57 0.94 0.00 0.00 5.03 -1.22 -3.29 116.97 119.00 2dg8 h TYR 48 Ca 0.09 -0.18 -0.27 0.00 2.58 0.00 0.00 58.73 60.96 2dg8 h TYR 48 Cb 0.61 -0.24 -0.05 0.00 1.55 0.00 0.00 36.73 38.60 2dg8 h TYR 48 CO 0.03 0.91 -1.71 0.72 -1.32 0.00 0.00 178.16 176.78 2dg8 n HIS 49 N -4.16 0.89 -4.85 -3.82 8.25 -0.58 -4.93 115.22 106.02 2dg8 n HIS 49 Ca 0.01 0.32 -0.27 0.00 -0.26 0.00 0.00 57.72 57.52 2dg8 n HIS 49 Cb 0.38 -1.14 -0.17 0.00 1.12 0.00 0.00 29.99 30.18 2dg8 n HIS 49 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2dg8 s PHE 50 N -2.67 1.88 -0.75 4.41 0.08 0.09 -4.99 117.98 116.03 2dg8 s PHE 50 Ca -0.05 -0.70 0.18 0.00 0.12 0.00 0.00 56.93 56.49 2dg8 s PHE 50 Cb 0.08 -1.30 0.77 0.00 -0.57 0.00 0.00 43.02 42.00 2dg8 s PHE 50 CO 0.82 -0.30 1.56 0.25 -0.10 0.00 0.00 175.22 177.45 2dg8 n THR 51 N 3.57 0.96 0.00 0.64 -2.24 -1.26 -4.50 114.28 111.46 2dg8 n THR 51 Ca -0.21 0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2dg8 n THR 51 Cb 0.52 -1.11 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 2dg8 n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dg8 n GLY 52 N -0.10 -0.79 0.06 3.38 0.00 -1.26 -5.01 105.19 101.47 2dg8 n GLY 52 Ca 0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 46.02 45.73 2dg8 n GLY 52 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dg8 n ILE 53 N 1.69 0.74 -0.06 -0.61 -0.00 -1.26 -4.12 119.36 115.73 2dg8 n ILE 53 Ca 0.00 -0.61 -0.11 0.00 -0.00 0.00 0.00 62.75 62.03 2dg8 n ILE 53 Cb 0.00 -0.32 -0.04 0.00 -0.00 0.00 0.00 39.64 39.28 2dg8 n ILE 53 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 2dg8 h GLU 54 N 0.00 0.32 -0.63 0.38 3.07 -1.99 -1.35 114.58 114.38 2dg8 h GLU 54 Ca -0.29 -0.07 -0.07 0.00 -0.50 0.00 0.00 59.36 58.42 2dg8 h GLU 54 Cb 1.60 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 29.44 2dg8 h GLU 54 CO 0.02 0.42 0.11 0.37 -1.40 0.00 0.00 179.01 178.53 2dg8 h GLN 55 N 0.16 1.05 -0.56 2.33 4.15 -1.97 -1.56 115.11 118.71 2dg8 h GLN 55 Ca 0.07 -0.28 0.01 0.00 0.77 0.00 0.00 58.65 59.22 2dg8 h GLN 55 Cb 0.24 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 2dg8 h GLN 55 CO -0.00 0.97 0.37 1.25 -1.93 0.00 0.00 178.83 179.49 2dg8 h LEU 56 N 0.96 0.63 0.04 -2.39 5.85 -1.67 -2.24 115.31 116.49 2dg8 h LEU 56 Ca 0.19 -0.01 -0.28 0.00 0.84 0.00 0.00 57.88 58.62 2dg8 h LEU 56 Cb 0.43 -0.16 0.02 0.00 0.37 0.00 0.00 40.66 41.33 2dg8 h LEU 56 CO 0.01 0.45 -1.13 -0.07 -0.34 0.00 0.00 178.44 177.36 2dg8 h LEU 57 N 0.74 0.87 -1.53 2.25 4.07 -0.89 -1.74 115.31 119.08 2dg8 h LEU 57 Ca 0.21 -0.74 -0.04 0.00 0.08 0.00 0.00 57.88 57.39 2dg8 h LEU 57 Cb -0.05 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.41 2dg8 h LEU 57 CO -0.05 1.54 -0.07 0.03 -1.08 0.00 0.00 178.44 178.82 2dg8 h ARG 58 N 0.33 0.22 0.14 1.13 3.08 -0.98 -2.33 114.38 115.96 2dg8 h ARG 58 Ca -0.15 -0.04 -0.23 0.00 0.07 0.00 0.00 59.98 59.63 2dg8 h ARG 58 Cb 1.79 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 31.82 2dg8 h ARG 58 CO 0.22 0.30 -1.08 0.93 -1.07 0.00 0.00 179.97 179.28 2dg8 h GLU 59 N 0.21 0.29 0.20 0.04 5.08 -1.42 -2.41 114.58 116.57 2dg8 h GLU 59 Ca 0.05 -0.50 0.01 0.00 -1.00 0.00 0.00 59.36 57.91 2dg8 h GLU 59 Cb 0.27 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2dg8 h GLU 59 CO 0.01 1.24 -0.24 0.00 -1.00 0.00 0.00 179.01 179.02 2dg8 h ALA 60 N 0.04 -0.47 -0.19 3.43 0.00 -1.22 -0.72 119.26 120.13 2dg8 h ALA 60 Ca -0.21 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 2dg8 h ALA 60 Cb 1.72 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.86 2dg8 h ALA 60 CO 0.13 -0.80 -0.09 0.74 0.00 0.00 0.00 179.25 179.23 2dg8 h PHE 61 N -0.50 0.30 -0.87 0.00 0.04 -1.57 -1.35 116.94 112.98 2dg8 h PHE 61 Ca 0.01 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 2dg8 h PHE 61 Cb 0.48 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.50 2dg8 h PHE 61 CO -0.19 0.38 0.53 0.78 -0.60 0.00 0.00 178.31 179.21 2dg8 h GLY 62 N 0.72 1.27 1.02 -1.45 0.00 -0.88 0.21 103.07 103.96 2dg8 h GLY 62 Ca 0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 2dg8 h GLY 62 CO 0.02 0.51 0.13 -0.09 0.00 0.00 0.00 176.54 177.10 2dg8 h ARG 63 N 1.20 0.96 -0.34 4.80 9.65 -0.12 -0.83 114.38 129.71 2dg8 h ARG 63 Ca 0.31 -0.24 -0.05 0.00 -1.10 0.00 0.00 59.98 58.90 2dg8 h ARG 63 Cb -0.06 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.38 2dg8 h ARG 63 CO -0.06 0.89 -0.02 0.35 2.80 0.00 0.00 179.97 183.93 2dg8 h PHE 64 N 0.87 0.56 -0.07 2.20 3.57 -0.35 -2.39 116.94 121.33 2dg8 h PHE 64 Ca 0.19 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2dg8 h PHE 64 Cb 0.37 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.95 2dg8 h PHE 64 CO 0.03 0.56 0.00 1.15 -2.23 0.00 0.00 178.31 177.82 2dg8 h THR 65 N 0.51 1.24 -0.84 4.41 2.02 -0.19 -2.31 112.91 117.75 2dg8 h THR 65 Ca 0.11 -0.76 0.18 0.00 0.77 0.00 0.00 66.41 66.71 2dg8 h THR 65 Cb 0.36 1.62 -0.11 0.00 -1.74 0.00 0.00 68.15 68.28 2dg8 h THR 65 CO 0.01 0.21 0.37 0.44 0.37 0.00 0.00 175.52 176.92 2dg8 h ASP 66 N -0.16 0.34 -0.20 4.18 3.45 -0.88 0.36 116.42 123.51 2dg8 h ASP 66 Ca 0.02 0.13 0.00 0.00 0.43 0.00 0.00 57.03 57.61 2dg8 h ASP 66 Cb 0.33 0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 2dg8 h ASP 66 CO 0.00 0.07 0.12 -0.74 -1.57 0.00 0.00 179.24 177.13 2dg8 h HIS 67 N 0.45 0.23 -0.49 4.55 2.76 -1.19 -1.97 115.15 119.50 2dg8 h HIS 67 Ca 0.49 0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.54 2dg8 h HIS 67 Cb 0.84 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 2dg8 h HIS 67 CO -0.14 0.14 -0.18 0.82 -1.30 0.00 0.00 177.93 177.26 2dg8 h ILE 68 N 0.25 1.27 -0.55 6.26 1.08 -0.60 -2.58 117.51 122.64 2dg8 h ILE 68 Ca 0.07 -1.34 0.01 0.00 -0.39 0.00 0.00 64.86 63.21 2dg8 h ILE 68 Cb -0.02 1.08 -0.03 0.00 -3.07 0.00 0.00 36.82 34.78 2dg8 h ILE 68 CO -0.03 0.47 0.36 0.58 -0.69 0.00 0.00 178.15 178.84 2dg8 h VAL 69 N 0.86 1.13 -0.49 1.67 2.07 -0.88 -1.99 116.25 118.62 2dg8 h VAL 69 Ca 0.12 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2dg8 h VAL 69 Cb 0.75 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2dg8 h VAL 69 CO 0.06 0.13 0.21 0.00 0.02 0.00 0.00 177.57 178.00 2dg8 h ALA 70 N 1.66 0.63 -0.85 1.67 0.00 -0.98 -0.31 119.26 121.09 2dg8 h ALA 70 Ca 0.20 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.99 2dg8 h ALA 70 Cb -0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2dg8 h ALA 70 CO -0.04 0.22 0.56 0.28 0.00 0.00 0.00 179.25 180.27 2dg8 h VAL 71 N 0.65 1.19 0.54 0.00 2.07 -1.06 0.50 116.25 120.13 2dg8 h VAL 71 Ca 0.16 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2dg8 h VAL 71 Cb 0.16 -0.02 0.01 0.00 -1.52 0.00 0.00 31.29 29.92 2dg8 h VAL 71 CO -0.02 0.20 -0.26 -0.26 0.02 0.00 0.00 177.57 177.26 2dg8 h PHE 72 N 1.11 -0.67 -0.97 1.57 0.04 -0.91 -2.44 116.94 114.68 2dg8 h PHE 72 Ca 0.32 -0.02 0.15 0.00 2.80 0.00 0.00 57.97 61.23 2dg8 h PHE 72 Cb -0.07 0.22 -0.10 0.00 2.20 0.00 0.00 35.95 38.20 2dg8 h PHE 72 CO -0.00 -0.35 0.58 0.22 -0.60 0.00 0.00 178.31 178.17 2dg8 h ASP 73 N -0.92 0.79 -0.47 2.17 3.58 -0.79 0.22 116.42 120.99 2dg8 h ASP 73 Ca -0.07 0.08 0.03 0.00 0.42 0.00 0.00 57.03 57.48 2dg8 h ASP 73 Cb 0.62 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 2dg8 h ASP 73 CO 0.12 0.35 0.27 -0.08 -2.88 0.00 0.00 179.24 177.02 2dg8 h GLU 74 N 0.83 0.52 0.01 0.28 4.81 -0.78 0.61 114.58 120.85 2dg8 h GLU 74 Ca 0.52 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.66 2dg8 h GLU 74 Cb 0.68 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.95 2dg8 h GLU 74 CO -0.33 0.35 -0.24 0.45 -0.73 0.00 0.00 179.01 178.51 2dg8 h HIS 75 N 0.54 0.22 0.00 0.92 3.86 -0.74 -3.33 115.15 116.63 2dg8 h HIS 75 Ca 0.19 -0.13 -0.11 0.00 -1.16 0.00 0.00 60.37 59.16 2dg8 h HIS 75 Cb 0.04 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 2dg8 h HIS 75 CO -0.08 0.95 -0.54 -0.07 0.86 0.00 0.00 177.93 179.06 2dg8 h LEU 76 N -0.56 0.00 -1.04 2.43 -0.00 -0.61 -3.25 115.31 112.27 2dg8 h LEU 76 Ca -0.03 0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.75 2dg8 h LEU 76 Cb 1.02 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.67 2dg8 h LEU 76 CO 0.05 0.54 -0.43 1.23 -0.00 0.00 0.00 178.44 179.83 2dg8 h GLY 77 N 2.25 0.12 1.94 0.83 0.00 0.09 -3.04 103.07 105.26 2dg8 h GLY 77 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2dg8 h GLY 77 CO 0.07 0.10 -0.04 0.00 0.00 0.00 0.00 176.54 176.67 2dg8 n ALA 78 N -2.46 2.36 -2.58 3.60 0.00 -1.23 -4.81 120.51 115.38 2dg8 n ALA 78 Ca -0.02 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 2dg8 n ALA 78 Cb 0.47 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 2dg8 n ALA 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dg8 s ALA 79 N -3.06 3.27 0.03 0.00 0.00 -1.15 -4.94 121.76 115.91 2dg8 s ALA 79 Ca 0.12 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.76 2dg8 s ALA 79 Cb 0.15 -3.39 -0.25 0.00 0.00 0.00 0.00 23.12 19.63 2dg8 s ALA 79 CO 0.58 -0.34 0.95 0.00 0.00 0.00 0.00 175.76 176.95 2dg8 h ALA 80 N 6.83 0.37 -4.32 0.00 0.00 -1.89 -3.47 119.26 116.79 2dg8 h ALA 80 Ca -0.41 -1.11 -0.33 0.00 0.00 0.00 0.00 54.91 53.06 2dg8 h ALA 80 Cb 1.21 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 2dg8 h ALA 80 CO 0.78 1.24 -0.32 -0.40 0.00 0.00 0.00 179.25 180.55 2dg8 n ASP 81 N -3.36 -0.37 -0.30 0.00 5.68 -1.26 -5.05 116.55 111.88 2dg8 n ASP 81 Ca -0.12 -2.52 -0.02 0.00 -0.50 0.00 0.00 54.79 51.63 2dg8 n ASP 81 Cb 1.02 1.13 0.10 0.00 -1.14 0.00 0.00 41.12 42.22 2dg8 n ASP 81 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 2dg8 h ARG 82 N 0.00 1.04 -0.38 0.11 2.43 -1.94 0.11 114.38 115.75 2dg8 h ARG 82 Ca -0.17 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 58.84 2dg8 h ARG 82 Cb 0.83 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2dg8 h ARG 82 CO 0.24 0.69 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.79 2dg8 h ASP 83 N 1.07 0.81 0.11 -3.80 3.32 -1.97 -1.42 116.42 114.54 2dg8 h ASP 83 Ca 0.32 -0.40 -0.09 0.00 0.02 0.00 0.00 57.03 56.89 2dg8 h ASP 83 Cb -0.04 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 2dg8 h ASP 83 CO -0.10 1.02 -0.29 -0.33 -1.72 0.00 0.00 179.24 177.83 2dg8 h GLU 84 N 0.59 0.28 -0.68 3.56 5.08 -1.91 -2.74 114.58 118.76 2dg8 h GLU 84 Ca 0.09 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2dg8 h GLU 84 Cb 0.71 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 2dg8 h GLU 84 CO 0.05 0.55 0.26 0.00 -1.00 0.00 0.00 179.01 178.88 2dg8 h ALA 85 N 1.45 0.89 -0.54 3.43 0.00 -0.40 0.82 119.26 124.91 2dg8 h ALA 85 Ca 0.04 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2dg8 h ALA 85 Cb 0.64 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2dg8 h ALA 85 CO 0.05 0.52 0.14 0.00 0.00 0.00 0.00 179.25 179.95 2dg8 h ARG 86 N 0.98 0.86 -0.51 0.00 3.08 -1.01 0.67 114.38 118.44 2dg8 h ARG 86 Ca 0.23 -0.20 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 2dg8 h ARG 86 Cb 0.22 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2dg8 h ARG 86 CO -0.02 0.80 0.01 0.93 -1.07 0.00 0.00 179.97 180.63 2dg8 h GLU 87 N 0.76 0.85 -0.44 0.04 4.39 -1.20 -1.85 114.58 117.12 2dg8 h GLU 87 Ca 0.17 -0.23 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 2dg8 h GLU 87 Cb 0.33 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 2dg8 h GLU 87 CO 0.00 0.84 -0.10 0.00 -1.16 0.00 0.00 179.01 178.60 2dg8 h ALA 88 N 1.22 1.01 -0.27 3.43 0.00 -0.31 -1.06 119.26 123.27 2dg8 h ALA 88 Ca 0.15 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 2dg8 h ALA 88 Cb 0.46 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2dg8 h ALA 88 CO 0.02 0.60 -0.32 0.28 0.00 0.00 0.00 179.25 179.83 2dg8 h VAL 89 N 0.70 1.28 -0.65 0.00 2.07 -0.54 -0.05 116.25 119.07 2dg8 h VAL 89 Ca 0.12 -1.43 -0.08 0.00 0.82 0.00 0.00 66.70 66.13 2dg8 h VAL 89 Cb 0.57 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2dg8 h VAL 89 CO 0.04 0.46 0.08 0.00 0.02 0.00 0.00 177.57 178.16 2dg8 h ALA 90 N 1.16 0.90 -0.61 1.67 0.00 -0.90 0.23 119.26 121.71 2dg8 h ALA 90 Ca 0.06 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 2dg8 h ALA 90 Cb 0.79 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2dg8 h ALA 90 CO 0.06 0.67 0.08 -0.44 0.00 0.00 0.00 179.25 179.63 2dg8 h ASP 91 N 1.02 0.99 -0.34 0.00 3.32 -0.85 -2.49 116.42 118.07 2dg8 h ASP 91 Ca 0.20 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2dg8 h ASP 91 Cb 0.47 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2dg8 h ASP 91 CO 0.02 1.01 0.17 0.25 -1.72 0.00 0.00 179.24 178.96 2dg8 h LEU 92 N 0.93 0.44 -0.59 1.55 5.85 -0.60 -0.11 115.31 122.78 2dg8 h LEU 92 Ca 0.18 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2dg8 h LEU 92 Cb 0.45 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2dg8 h LEU 92 CO 0.02 0.44 0.34 0.58 -0.34 0.00 0.00 178.44 179.48 2dg8 h VAL 93 N 0.42 1.02 -0.23 1.05 2.07 -0.79 -0.02 116.25 119.76 2dg8 h VAL 93 Ca 0.12 -0.23 -0.14 0.00 0.82 0.00 0.00 66.70 67.27 2dg8 h VAL 93 Cb 0.11 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2dg8 h VAL 93 CO -0.02 0.12 -0.41 0.45 0.02 0.00 0.00 177.57 177.73 2dg8 h HIS 94 N 0.66 0.86 -0.54 1.57 3.86 -1.27 -2.03 115.15 118.27 2dg8 h HIS 94 Ca 0.25 -0.30 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2dg8 h HIS 94 Cb 0.08 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.36 2dg8 h HIS 94 CO -0.07 1.08 0.35 1.49 0.86 0.00 0.00 177.93 181.64 2dg8 h GLU 95 N 0.40 0.72 0.00 2.45 4.81 -0.83 -2.02 114.58 120.12 2dg8 h GLU 95 Ca 0.01 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2dg8 h GLU 95 Cb 1.01 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.23 2dg8 h GLU 95 CO 0.09 0.49 -0.05 -0.07 -0.73 0.00 0.00 179.01 178.74 2dg8 h LEU 96 N 0.74 0.00 -1.22 1.64 4.07 -0.94 -1.62 115.31 117.97 2dg8 h LEU 96 Ca 0.20 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2dg8 h LEU 96 Cb -0.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2dg8 h LEU 96 CO -0.04 0.05 -0.19 -1.54 -1.08 0.00 0.00 178.44 175.65 2dg8 n SER 97 N -3.35 1.97 0.00 -0.43 3.41 -0.77 -4.69 113.62 109.76 2dg8 n SER 97 Ca -0.02 -1.48 0.00 0.00 -0.26 0.00 0.00 58.87 57.11 2dg8 n SER 97 Cb 0.20 0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2dg8 n SER 97 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dg8 n GLU 98 N 0.35 2.24 0.07 4.33 1.02 -0.82 -4.13 120.64 123.70 2dg8 n GLU 98 Ca 0.08 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.14 2dg8 n GLU 98 Cb 0.37 -0.80 0.05 0.00 -0.02 0.00 0.00 31.44 31.04 2dg8 n GLU 98 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2dg8 h ASP 99 N 0.00 0.37 -3.16 1.62 3.45 -1.49 -3.45 116.42 113.77 2dg8 h ASP 99 Ca 0.00 -0.24 -0.49 0.00 0.43 0.00 0.00 57.03 56.73 2dg8 h ASP 99 Cb 0.61 -0.11 -0.40 0.00 -0.56 0.00 0.00 39.33 38.86 2dg8 h ASP 99 CO 0.00 0.97 -0.76 -0.55 -1.57 0.00 0.00 179.24 177.33 2dg8 s SER 100 N -6.94 2.59 0.19 6.45 0.15 -1.26 -4.96 113.70 109.93 2dg8 s SER 100 Ca -0.05 -0.70 -0.12 0.00 0.70 0.00 0.00 55.95 55.79 2dg8 s SER 100 Cb 0.11 -0.41 0.15 0.00 -1.71 0.00 0.00 66.02 64.15 2dg8 s SER 100 CO 0.82 -0.33 1.84 -0.61 1.20 0.00 0.00 173.24 176.17 2dg8 h GLN 101 N 8.34 0.76 0.03 5.44 5.75 -1.97 -2.32 115.11 131.13 2dg8 h GLN 101 Ca -0.16 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.33 2dg8 h GLN 101 Cb 1.14 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 29.46 2dg8 h GLN 101 CO 0.31 0.50 -0.44 -0.09 -2.65 0.00 0.00 178.83 176.46 2dg8 h ARG 102 N 0.78 -0.59 -0.24 1.69 2.43 -1.95 -1.45 114.38 115.05 2dg8 h ARG 102 Ca 0.25 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 2dg8 h ARG 102 Cb -0.00 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2dg8 h ARG 102 CO -0.09 -0.40 0.11 -0.44 -1.51 0.00 0.00 179.97 177.65 2dg8 h ASP 103 N -0.62 0.28 -0.22 -3.80 3.32 -1.92 -1.12 116.42 112.34 2dg8 h ASP 103 Ca 0.04 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 2dg8 h ASP 103 Cb 0.68 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2dg8 h ASP 103 CO -0.31 0.25 -0.00 0.25 -1.72 0.00 0.00 179.24 177.70 2dg8 h LEU 104 N 0.32 0.39 -0.02 1.55 5.85 -0.86 -1.06 115.31 121.48 2dg8 h LEU 104 Ca 0.08 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2dg8 h LEU 104 Cb 0.04 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 2dg8 h LEU 104 CO -0.01 0.60 0.01 0.58 -0.34 0.00 0.00 178.44 179.28 2dg8 h VAL 105 N 0.16 1.17 -0.99 1.05 2.07 -0.81 -1.30 116.25 117.60 2dg8 h VAL 105 Ca 0.06 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.10 2dg8 h VAL 105 Cb 0.41 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.61 2dg8 h VAL 105 CO 0.01 0.14 0.65 -0.07 0.02 0.00 0.00 177.57 178.32 2dg8 h LEU 106 N -0.18 1.10 -0.00 2.57 3.38 -1.23 0.68 115.31 121.63 2dg8 h LEU 106 Ca 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2dg8 h LEU 106 Cb 0.22 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2dg8 h LEU 106 CO -0.00 0.77 0.00 0.74 0.09 0.00 0.00 178.44 180.04 2dg8 h THR 107 N 1.29 1.01 -0.57 0.22 2.02 -1.05 0.33 112.91 116.16 2dg8 h THR 107 Ca 0.38 -0.04 -0.06 0.00 0.77 0.00 0.00 66.41 67.46 2dg8 h THR 107 Cb -0.05 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2dg8 h THR 107 CO -0.11 0.01 0.13 1.56 0.37 0.00 0.00 175.52 177.48 2dg8 h GLN 108 N -0.01 0.93 -0.77 6.66 1.08 -0.31 -1.12 115.11 121.56 2dg8 h GLN 108 Ca 0.00 -0.23 0.06 0.00 -1.45 0.00 0.00 58.65 57.03 2dg8 h GLN 108 Cb 0.02 -0.12 -0.06 0.00 -0.05 0.00 0.00 27.48 27.27 2dg8 h GLN 108 CO -0.00 0.86 0.46 0.93 -0.95 0.00 0.00 178.83 180.14 2dg8 h GLU 109 N 0.83 0.84 -0.52 1.46 4.39 0.58 -1.84 114.58 120.32 2dg8 h GLU 109 Ca 0.18 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 2dg8 h GLU 109 Cb 0.36 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2dg8 h GLU 109 CO 0.00 0.55 0.18 1.25 -1.16 0.00 0.00 179.01 179.84 2dg8 h LEU 110 N 0.86 0.73 -0.88 1.33 6.46 -0.38 -2.50 115.31 120.93 2dg8 h LEU 110 Ca 0.33 -0.19 -0.03 0.00 -0.12 0.00 0.00 57.88 57.87 2dg8 h LEU 110 Cb 0.15 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 39.85 2dg8 h LEU 110 CO -0.16 0.72 0.42 1.88 -0.62 0.00 0.00 178.44 180.68 2dg8 h TYR 111 N 0.70 1.22 -0.48 1.25 0.05 -0.70 -1.43 116.97 117.58 2dg8 h TYR 111 Ca 0.17 -0.06 -0.06 0.00 0.05 0.00 0.00 58.73 58.83 2dg8 h TYR 111 Cb 0.24 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.58 2dg8 h TYR 111 CO 0.01 0.88 0.05 1.15 -1.05 0.00 0.00 178.16 179.20 2dg8 h THR 112 N 1.22 1.25 0.03 -2.88 2.02 -1.25 -1.23 112.91 112.07 2dg8 h THR 112 Ca 0.29 -0.97 0.01 0.00 0.77 0.00 0.00 66.41 66.52 2dg8 h THR 112 Cb 0.11 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 2dg8 h THR 112 CO -0.04 0.34 -0.11 0.25 0.37 0.00 0.00 175.52 176.33 2dg8 h LEU 113 N 0.68 -0.32 -1.56 2.58 5.85 -1.10 0.78 115.31 122.23 2dg8 h LEU 113 Ca 0.14 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 2dg8 h LEU 113 Cb 0.43 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2dg8 h LEU 113 CO 0.01 -0.17 -0.16 0.00 -0.34 0.00 0.00 178.44 177.79 2dg8 h ALA 114 N 0.73 1.63 -0.12 1.25 0.00 -1.18 0.35 119.26 121.92 2dg8 h ALA 114 Ca 0.03 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2dg8 h ALA 114 Cb 0.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2dg8 h ALA 114 CO -0.09 0.27 -0.32 0.00 0.00 0.00 0.00 179.25 179.11 2dg8 h ALA 115 N 1.76 0.20 -0.29 0.00 0.00 -0.62 -3.27 119.26 117.05 2dg8 h ALA 115 Ca 0.02 -0.43 -0.18 0.00 0.00 0.00 0.00 54.91 54.31 2dg8 h ALA 115 Cb 0.34 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2dg8 h ALA 115 CO 0.02 0.25 -0.54 -0.09 0.00 0.00 0.00 179.25 178.88 2dg8 h ARG 116 N 0.02 0.86 -3.72 0.00 2.43 -0.51 -3.40 114.38 110.06 2dg8 h ARG 116 Ca -0.01 -0.54 -0.63 0.00 -0.81 0.00 0.00 59.98 57.99 2dg8 h ARG 116 Cb 0.93 0.06 -0.40 0.00 -0.42 0.00 0.00 29.97 30.14 2dg8 h ARG 116 CO 0.07 1.18 -0.71 -0.65 -1.51 0.00 0.00 179.97 178.35 2dg8 s GLN 117 N -4.13 1.44 0.42 0.20 -0.21 0.12 -4.98 119.66 112.52 2dg8 s GLN 117 Ca -0.10 -1.97 0.06 0.00 0.02 0.00 0.00 55.36 53.36 2dg8 s GLN 117 Cb 0.10 -2.82 0.30 0.00 1.00 0.00 0.00 33.01 31.60 2dg8 s GLN 117 CO 0.89 -1.05 1.02 -1.00 -2.12 0.00 0.00 175.29 173.03 2dg8 h PRO 118 N 7.18 0.00 -0.18 2.91 0.13 -1.78 0.48 132.00 140.74 2dg8 h PRO 118 Ca -0.06 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.03 2dg8 h PRO 118 Cb 0.96 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 2dg8 h PRO 118 CO 0.55 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.29 2dg8 h ALA 119 N 0.38 0.25 0.00 -0.56 0.00 -1.92 -2.70 119.26 114.71 2dg8 h ALA 119 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2dg8 h ALA 119 Cb 1.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2dg8 h ALA 119 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 2dg8 n TYR 120 N -4.67 0.00 0.43 0.00 4.01 0.16 -1.76 117.16 115.33 2dg8 n TYR 120 Ca -0.05 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.82 2dg8 n TYR 120 Cb 0.26 -0.29 0.49 0.00 -0.31 0.00 0.00 39.34 39.49 2dg8 n TYR 120 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dg8 h ARG 121 N 0.00 0.00 -0.47 -0.72 3.08 -1.58 -1.30 114.38 113.38 2dg8 h ARG 121 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2dg8 h ARG 121 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2dg8 h ARG 121 CO 0.00 0.00 -0.03 0.93 -1.07 0.00 0.00 179.97 179.80 2dg8 h GLU 122 N 0.00 0.80 -0.26 0.04 4.39 -1.51 0.65 114.58 118.71 2dg8 h GLU 122 Ca 0.00 -0.23 -0.11 0.00 0.34 0.00 0.00 59.36 59.35 2dg8 h GLU 122 Cb 0.44 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2dg8 h GLU 122 CO 0.00 0.83 -0.28 1.25 -1.16 0.00 0.00 179.01 179.65 2dg8 h LEU 123 N 0.74 0.69 -0.89 1.33 5.85 -1.44 -2.67 115.31 118.93 2dg8 h LEU 123 Ca 0.14 -0.48 -0.11 0.00 0.84 0.00 0.00 57.88 58.26 2dg8 h LEU 123 Cb 0.50 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2dg8 h LEU 123 CO 0.03 1.04 -0.37 0.71 -0.34 0.00 0.00 178.44 179.51 2dg8 h THR 124 N 0.36 1.29 -0.26 1.05 1.35 -1.34 -1.93 112.91 113.44 2dg8 h THR 124 Ca 0.04 -1.46 -0.03 0.00 -0.55 0.00 0.00 66.41 64.41 2dg8 h THR 124 Cb 0.85 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 68.83 2dg8 h THR 124 CO 0.07 0.45 0.06 -0.74 -0.25 0.00 0.00 175.52 175.11 2dg8 h HIS 125 N 0.31 0.44 -0.24 4.73 -0.00 -0.83 -1.31 115.15 118.24 2dg8 h HIS 125 Ca 0.03 -0.05 -0.05 0.00 -0.00 0.00 0.00 60.37 60.30 2dg8 h HIS 125 Cb 0.79 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 28.07 2dg8 h HIS 125 CO 0.02 0.50 -0.08 1.49 -0.00 0.00 0.00 177.93 179.86 2dg8 h GLU 126 N 0.25 0.38 -0.01 5.26 4.57 -1.37 -0.28 114.58 123.38 2dg8 h GLU 126 Ca 0.08 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2dg8 h GLU 126 Cb 0.28 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2dg8 h GLU 126 CO 0.00 0.47 0.00 2.35 -1.18 0.00 0.00 179.01 180.65 2dg8 h TRP 127 N 0.36 0.02 -0.62 0.92 7.01 -1.04 -1.61 115.95 120.99 2dg8 h TRP 127 Ca 0.08 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.06 2dg8 h TRP 127 Cb 0.37 -0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.39 2dg8 h TRP 127 CO 0.01 0.25 0.33 0.52 -2.79 0.00 0.00 178.44 176.76 2dg8 h MET 128 N -0.21 0.88 0.02 2.65 2.86 -0.89 -1.43 114.93 118.82 2dg8 h MET 128 Ca 0.00 -0.11 0.02 0.00 -2.06 0.00 0.00 59.70 57.56 2dg8 h MET 128 Cb 0.23 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 2dg8 h MET 128 CO 0.00 0.68 -0.17 -0.09 1.06 0.00 0.00 176.91 178.38 2dg8 h ARG 129 N 0.85 -0.28 -0.85 1.72 2.43 -0.95 0.65 114.38 117.95 2dg8 h ARG 129 Ca 0.22 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.44 2dg8 h ARG 129 Cb 0.06 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.63 2dg8 h ARG 129 CO -0.03 -0.19 0.56 0.00 -1.51 0.00 0.00 179.97 178.79 2dg8 h ARG 130 N -0.29 1.03 0.00 0.20 3.08 -1.11 -0.65 114.38 116.64 2dg8 h ARG 130 Ca 0.05 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2dg8 h ARG 130 Cb 0.35 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2dg8 h ARG 130 CO -0.15 0.68 -0.00 0.77 -1.07 0.00 0.00 179.97 180.20 2dg8 h SER 131 N 1.06 -0.00 -0.53 7.04 0.02 -0.53 -2.85 113.55 117.77 2dg8 h SER 131 Ca 0.33 -0.13 0.01 0.00 -0.84 0.00 0.00 61.79 61.16 2dg8 h SER 131 Cb 0.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 2dg8 h SER 131 CO -0.10 0.13 0.35 0.03 -1.14 0.00 0.00 176.83 176.10 2dg8 h ARG 132 N -0.13 0.67 -0.89 3.45 3.08 -0.25 -2.12 114.38 118.19 2dg8 h ARG 132 Ca -0.00 -0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.14 2dg8 h ARG 132 Cb 0.13 -0.15 -0.09 0.00 0.08 0.00 0.00 29.97 29.94 2dg8 h ARG 132 CO 0.00 0.44 0.50 0.28 -1.07 0.00 0.00 179.97 180.12 2dg8 h VAL 133 N 0.69 0.81 -0.02 2.04 2.07 -0.89 0.46 116.25 121.41 2dg8 h VAL 133 Ca 0.20 -0.26 -0.19 0.00 0.82 0.00 0.00 66.70 67.27 2dg8 h VAL 133 Cb -0.04 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.71 2dg8 h VAL 133 CO -0.04 0.14 -0.82 0.45 0.02 0.00 0.00 177.57 177.32 2dg8 h HIS 134 N 0.75 0.34 -0.25 1.57 3.86 -1.36 -3.16 115.15 116.91 2dg8 h HIS 134 Ca 0.46 -0.17 -0.16 0.00 -1.16 0.00 0.00 60.37 59.34 2dg8 h HIS 134 Cb 0.57 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 2dg8 h HIS 134 CO -0.06 0.95 -0.49 -0.07 0.86 0.00 0.00 177.93 179.12 2dg8 h LEU 135 N 0.14 0.74 0.00 2.43 3.38 -0.81 -2.72 115.31 118.48 2dg8 h LEU 135 Ca -0.04 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2dg8 h LEU 135 Cb 1.42 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2dg8 h LEU 135 CO 0.13 1.11 0.00 -0.62 0.09 0.00 0.00 178.44 179.15 2dg8 n GLU 136 N -4.00 0.07 0.25 1.13 1.02 0.15 -0.98 120.64 118.28 2dg8 n GLU 136 Ca -0.03 0.27 0.15 0.00 -0.02 0.00 0.00 57.16 57.54 2dg8 n GLU 136 Cb 0.58 -1.50 0.51 0.00 -0.02 0.00 0.00 31.44 31.01 2dg8 n GLU 136 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2dg8 h LYS 137 N 0.00 0.00 0.00 3.49 1.63 -1.49 -3.32 116.57 116.87 2dg8 h LYS 137 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2dg8 h LYS 137 Cb 0.09 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 2dg8 h LYS 137 CO 0.00 0.00 -0.23 0.72 -3.45 0.00 0.00 179.45 176.49 2dg8 n HIS 138 N -3.06 0.00 -4.20 1.91 8.25 -0.36 -5.05 115.22 112.70 2dg8 n HIS 138 Ca 0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.33 2dg8 n HIS 138 Cb 0.38 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.38 2dg8 n HIS 138 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2dg8 s PHE 139 N -0.75 1.16 0.57 4.41 0.08 -0.15 -4.80 117.98 118.51 2dg8 s PHE 139 Ca 0.00 -0.65 -0.19 0.00 0.12 0.00 0.00 56.93 56.21 2dg8 s PHE 139 Cb 0.00 -0.62 -0.04 0.00 -0.57 0.00 0.00 43.02 41.78 2dg8 s PHE 139 CO 0.00 0.04 1.15 0.16 -0.10 0.00 0.00 175.22 176.47 2dg8 s ASP 140 N -2.57 5.50 0.26 1.36 1.47 -1.26 -4.03 116.67 117.39 2dg8 s ASP 140 Ca 0.08 2.20 -0.07 0.00 1.18 0.00 0.00 52.55 55.94 2dg8 s ASP 140 Cb -0.02 -2.58 0.45 0.00 -0.34 0.00 0.00 42.92 40.43 2dg8 s ASP 140 CO 0.01 -1.37 1.61 1.55 0.68 0.00 0.00 175.17 177.64 2dg8 h PRO 141 N 0.95 0.04 0.00 2.11 0.13 -1.96 0.50 132.00 133.78 2dg8 h PRO 141 Ca -0.50 -0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.65 2dg8 h PRO 141 Cb 1.27 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 2dg8 h PRO 141 CO 0.56 0.03 -0.08 0.78 -0.23 0.00 0.00 178.00 179.06 2dg8 h GLY 142 N 0.05 -0.09 0.97 1.56 0.00 -2.01 -2.08 103.07 101.46 2dg8 h GLY 142 Ca 0.43 0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.88 2dg8 h GLY 142 CO -0.78 -0.09 0.60 -0.84 0.00 0.00 0.00 176.54 175.43 2dg8 h THR 143 N -0.15 1.21 -0.78 4.70 2.02 -1.61 -2.61 112.91 115.69 2dg8 h THR 143 Ca 0.03 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 2dg8 h THR 143 Cb 0.18 -0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.46 2dg8 h THR 143 CO -0.08 0.22 0.40 0.00 0.37 0.00 0.00 175.52 176.43 2dg8 h ALA 144 N 1.35 1.23 -0.35 6.16 0.00 -0.62 0.92 119.26 127.96 2dg8 h ALA 144 Ca 0.34 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 2dg8 h ALA 144 Cb -0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 2dg8 h ALA 144 CO -0.09 0.60 -0.37 -0.09 0.00 0.00 0.00 179.25 179.31 2dg8 h ARG 145 N 1.10 0.82 -0.29 0.00 2.43 -1.12 -0.22 114.38 117.10 2dg8 h ARG 145 Ca 0.27 -0.42 -0.07 0.00 -0.81 0.00 0.00 59.98 58.96 2dg8 h ARG 145 Cb 0.07 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2dg8 h ARG 145 CO -0.04 1.05 -0.08 1.96 -1.51 0.00 0.00 179.97 181.35 2dg8 h GLN 146 N 0.67 0.57 -0.80 0.20 4.20 -1.08 -2.64 115.11 116.23 2dg8 h GLN 146 Ca 0.06 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.53 2dg8 h GLN 146 Cb 0.93 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.64 2dg8 h GLN 146 CO 0.09 0.77 0.42 1.25 -0.67 0.00 0.00 178.83 180.69 2dg8 h LEU 147 N 0.33 1.01 -0.68 1.46 5.85 -0.72 -0.74 115.31 121.82 2dg8 h LEU 147 Ca 0.07 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2dg8 h LEU 147 Cb 0.56 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2dg8 h LEU 147 CO 0.03 0.83 0.44 -0.78 -0.34 0.00 0.00 178.44 178.62 2dg8 h ASP 148 N 1.11 0.79 -0.54 1.25 3.58 -0.96 0.31 116.42 121.97 2dg8 h ASP 148 Ca 0.28 -0.03 -0.03 0.00 0.42 0.00 0.00 57.03 57.67 2dg8 h ASP 148 Cb 0.06 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 2dg8 h ASP 148 CO -0.04 0.59 0.23 0.00 -2.88 0.00 0.00 179.24 177.14 2dg8 h ALA 149 N 1.24 0.69 -0.32 -0.78 0.00 -1.06 -1.57 119.26 117.46 2dg8 h ALA 149 Ca 0.25 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2dg8 h ALA 149 Cb -0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2dg8 h ALA 149 CO -0.05 0.29 0.21 1.25 0.00 0.00 0.00 179.25 180.95 2dg8 h LEU 150 N 0.72 0.37 -0.64 0.00 6.46 -0.25 -1.75 115.31 120.22 2dg8 h LEU 150 Ca 0.18 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.99 2dg8 h LEU 150 Cb 0.17 -0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 39.96 2dg8 h LEU 150 CO -0.02 0.26 0.35 0.40 -0.62 0.00 0.00 178.44 178.82 2dg8 h ILE 151 N 0.43 0.97 -0.19 4.05 2.04 -0.18 0.74 117.51 125.38 2dg8 h ILE 151 Ca 0.12 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.78 2dg8 h ILE 151 Cb -0.05 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 2dg8 h ILE 151 CO -0.03 0.12 0.04 -0.08 0.00 0.00 0.00 178.15 178.20 2dg8 h GLU 152 N 0.65 0.11 -0.38 2.37 4.57 -0.90 -1.06 114.58 119.95 2dg8 h GLU 152 Ca 0.28 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.36 2dg8 h GLU 152 Cb 0.17 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 2dg8 h GLU 152 CO -0.17 0.07 -0.12 0.78 -1.18 0.00 0.00 179.01 178.38 2dg8 h GLY 153 N 0.11 0.83 1.30 1.92 0.00 -0.72 -2.34 103.07 104.17 2dg8 h GLY 153 Ca 0.08 -0.70 -0.09 0.00 0.00 0.00 0.00 47.33 46.62 2dg8 h GLY 153 CO -0.11 0.64 -0.05 1.41 0.00 0.00 0.00 176.54 178.43 2dg8 h LEU 154 N 0.57 0.82 -0.05 3.11 3.38 -0.81 -2.05 115.31 120.29 2dg8 h LEU 154 Ca 0.09 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2dg8 h LEU 154 Cb 0.65 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2dg8 h LEU 154 CO 0.04 0.92 0.01 0.74 0.09 0.00 0.00 178.44 180.24 2dg8 h THR 155 N 0.77 1.21 -0.19 0.22 2.02 -1.11 -2.02 112.91 113.82 2dg8 h THR 155 Ca 0.14 -0.64 0.02 0.00 0.77 0.00 0.00 66.41 66.70 2dg8 h THR 155 Cb 0.53 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.48 2dg8 h THR 155 CO 0.03 0.18 0.06 0.25 0.37 0.00 0.00 175.52 176.41 2dg8 h LEU 156 N -0.17 0.07 -0.70 2.58 5.85 -1.35 -0.24 115.31 121.35 2dg8 h LEU 156 Ca 0.01 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2dg8 h LEU 156 Cb 0.27 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2dg8 h LEU 156 CO 0.00 0.07 0.43 0.45 -0.34 0.00 0.00 178.44 179.05 2dg8 h HIS 157 N 0.15 0.90 -0.47 1.25 3.86 -1.35 -1.48 115.15 118.02 2dg8 h HIS 157 Ca 0.08 0.01 -0.13 0.00 -1.16 0.00 0.00 60.37 59.17 2dg8 h HIS 157 Cb 0.05 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.21 2dg8 h HIS 157 CO -0.12 0.60 -0.22 0.00 0.86 0.00 0.00 177.93 179.05 2dg8 h ARG 158 N 0.95 0.98 -0.73 2.45 3.08 -1.16 -1.91 114.38 118.03 2dg8 h ARG 158 Ca 0.25 -0.42 -0.03 0.00 0.07 0.00 0.00 59.98 59.85 2dg8 h ARG 158 Cb -0.06 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 2dg8 h ARG 158 CO -0.05 1.09 0.33 0.00 -1.07 0.00 0.00 179.97 180.27 2dg8 h ALA 159 N 0.86 1.20 -0.55 0.04 0.00 -0.72 -3.09 119.26 117.00 2dg8 h ALA 159 Ca 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dg8 h ALA 159 Cb 0.80 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2dg8 h ALA 159 CO 0.07 0.60 0.00 1.28 0.00 0.00 0.00 179.25 181.20 2dg8 n LEU 160 N -4.31 3.62 -4.83 0.00 4.77 -0.59 -4.99 117.00 110.68 2dg8 n LEU 160 Ca 0.07 -1.79 -0.32 0.00 -0.03 0.00 0.00 56.01 53.94 2dg8 n LEU 160 Cb 0.15 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 40.86 2dg8 n LEU 160 CO 0.39 0.86 0.69 0.00 -1.33 0.00 0.00 177.39 178.00 2dg8 s ALA 161 N -1.18 2.96 0.04 -1.18 0.00 -0.72 -4.97 121.76 116.71 2dg8 s ALA 161 Ca 0.42 0.26 -0.17 0.00 0.00 0.00 0.00 51.96 52.46 2dg8 s ALA 161 Cb 0.23 -3.16 -0.20 0.00 0.00 0.00 0.00 23.12 19.99 2dg8 s ALA 161 CO 0.30 -0.42 1.19 -0.09 0.00 0.00 0.00 175.76 176.74 2dg8 h ARG 162 N 0.77 0.55 -2.88 0.00 2.43 -1.90 -3.39 114.38 109.97 2dg8 h ARG 162 Ca -0.47 -0.51 -0.60 0.00 -0.81 0.00 0.00 59.98 57.59 2dg8 h ARG 162 Cb 1.20 0.13 -0.40 0.00 -0.42 0.00 0.00 29.97 30.47 2dg8 h ARG 162 CO 0.60 1.14 -0.77 -2.00 -1.51 0.00 0.00 179.97 177.43 2dg8 s GLU 163 N -3.48 1.17 0.14 0.20 2.12 -1.26 -5.11 118.70 112.48 2dg8 s GLU 163 Ca -0.12 -1.94 -0.35 0.00 0.36 0.00 0.00 54.97 52.92 2dg8 s GLU 163 Cb 0.05 -2.13 -0.15 0.00 0.26 0.00 0.00 34.13 32.16 2dg8 s GLU 163 CO 0.85 -1.19 1.37 -0.35 -0.54 0.00 0.00 175.26 175.40 2dg8 n PRO 164 N 3.53 1.50 -0.76 4.30 -0.04 -1.26 -4.92 135.00 137.35 2dg8 n PRO 164 Ca 0.11 0.54 -0.32 0.00 -0.04 0.00 0.00 63.50 63.79 2dg8 n PRO 164 Cb 0.36 -2.19 0.15 0.00 -0.04 0.00 0.00 33.50 31.78 2dg8 n PRO 164 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2dg8 n HIS 165 N 2.47 0.28 -1.56 0.54 1.44 -1.26 -4.98 115.22 112.15 2dg8 n HIS 165 Ca 0.17 0.36 -0.30 0.00 -2.01 0.00 0.00 57.72 55.93 2dg8 n HIS 165 Cb 0.24 -1.95 0.09 0.00 0.12 0.00 0.00 29.99 28.48 2dg8 n HIS 165 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2dg8 s GLY 166 N -2.40 1.63 0.38 -1.39 0.00 -1.26 -4.95 107.32 99.33 2dg8 s GLY 166 Ca 0.65 -0.17 0.05 0.00 0.00 0.00 0.00 44.72 45.25 2dg8 s GLY 166 CO 0.60 0.24 2.00 -0.09 0.00 0.00 0.00 173.10 175.84 2dg8 h ARG 167 N -1.05 0.61 -0.77 2.90 2.43 -1.98 -2.46 114.38 114.06 2dg8 h ARG 167 Ca -0.47 -0.06 0.11 0.00 -0.81 0.00 0.00 59.98 58.75 2dg8 h ARG 167 Cb 1.26 -0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 30.61 2dg8 h ARG 167 CO 0.59 0.46 0.40 0.00 -1.51 0.00 0.00 179.97 179.91 2dg8 h ALA 168 N 1.64 1.09 -0.36 2.80 0.00 -1.99 0.16 119.26 122.61 2dg8 h ALA 168 Ca 0.16 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 2dg8 h ALA 168 Cb 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2dg8 h ALA 168 CO -0.02 -0.03 -0.38 1.25 0.00 0.00 0.00 179.25 180.06 2dg8 h LEU 169 N 0.64 0.92 -0.32 0.00 6.46 -1.82 -1.88 115.31 119.31 2dg8 h LEU 169 Ca 0.39 -0.42 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2dg8 h LEU 169 Cb 0.44 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.10 2dg8 h LEU 169 CO -0.29 1.19 0.21 0.74 -0.62 0.00 0.00 178.44 179.67 2dg8 h THR 170 N 0.71 1.08 -0.17 1.05 2.02 -1.04 -1.42 112.91 115.14 2dg8 h THR 170 Ca 0.06 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.09 2dg8 h THR 170 Cb 0.96 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 2dg8 h THR 170 CO 0.09 0.08 0.11 0.25 0.37 0.00 0.00 175.52 176.42 2dg8 h LEU 171 N 0.43 0.20 -0.23 2.58 6.46 -0.67 -2.30 115.31 121.78 2dg8 h LEU 171 Ca 0.12 -0.02 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 2dg8 h LEU 171 Cb -0.05 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 39.81 2dg8 h LEU 171 CO -0.03 0.16 0.10 -0.08 -0.62 0.00 0.00 178.44 177.97 2dg8 h GLU 172 N 0.23 0.21 -0.67 1.25 4.57 -1.15 0.13 114.58 119.15 2dg8 h GLU 172 Ca 0.06 -0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.27 2dg8 h GLU 172 Cb -0.01 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.48 2dg8 h GLU 172 CO -0.01 0.14 0.40 0.00 -1.18 0.00 0.00 179.01 178.35 2dg8 h ALA 173 N 1.13 0.88 -0.33 2.92 0.00 -1.13 0.14 119.26 122.87 2dg8 h ALA 173 Ca 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2dg8 h ALA 173 Cb 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2dg8 h ALA 173 CO -0.09 0.13 0.14 0.82 0.00 0.00 0.00 179.25 180.26 2dg8 h ILE 174 N 0.77 1.17 -0.99 0.00 2.04 -1.03 -1.19 117.51 118.28 2dg8 h ILE 174 Ca 0.28 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2dg8 h ILE 174 Cb 0.08 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.01 2dg8 h ILE 174 CO -0.13 0.18 0.65 0.00 0.00 0.00 0.00 178.15 178.85 2dg8 h ALA 175 N 0.99 1.29 -0.28 1.87 0.00 -0.02 -1.71 119.26 121.40 2dg8 h ALA 175 Ca 0.11 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2dg8 h ALA 175 Cb 0.16 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2dg8 h ALA 175 CO -0.01 0.60 -0.18 0.00 0.00 0.00 0.00 179.25 179.66 2dg8 h ARG 176 N 1.30 0.61 0.00 0.00 3.08 -0.59 -2.87 114.38 115.92 2dg8 h ARG 176 Ca 0.38 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 2dg8 h ARG 176 Cb -0.08 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2dg8 h ARG 176 CO -0.10 0.87 -0.19 0.97 -1.07 0.00 0.00 179.97 180.45 2dg8 h ILE 177 N 0.34 0.52 -0.59 2.04 6.09 -1.08 -2.73 117.51 122.09 2dg8 h ILE 177 Ca 0.06 -0.96 0.00 0.00 -1.37 0.00 0.00 64.86 62.58 2dg8 h ILE 177 Cb 0.72 1.66 0.00 0.00 0.47 0.00 0.00 36.82 39.67 2dg8 h ILE 177 CO 0.05 0.19 0.00 0.35 -3.07 0.00 0.00 178.15 175.67 2dg8 n THR 178 N -3.41 2.35 -3.17 2.19 -2.24 -0.66 -4.82 114.28 104.52 2dg8 n THR 178 Ca -0.00 -1.35 -0.43 0.00 -2.27 0.00 0.00 64.05 60.00 2dg8 n THR 178 Cb 0.38 -0.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.44 2dg8 n THR 178 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2dg8 s THR 179 N -2.38 4.90 -0.30 4.28 2.01 -1.03 -5.02 115.64 118.10 2dg8 s THR 179 Ca 0.53 -0.16 -0.07 0.00 0.31 0.00 0.00 61.69 62.30 2dg8 s THR 179 Cb 0.38 -4.19 0.01 0.00 0.01 0.00 0.00 72.50 68.71 2dg8 s THR 179 CO 0.19 -0.61 0.09 0.42 -0.69 0.00 0.00 174.62 174.02 2dg8 s THR 180 N 2.61 3.95 -1.57 -0.82 -4.23 -1.26 -5.00 115.64 109.32 2dg8 s THR 180 Ca 0.18 -0.77 -0.10 0.00 -1.18 0.00 0.00 61.69 59.81 2dg8 s THR 180 Cb -0.16 -3.08 -0.05 0.00 1.34 0.00 0.00 72.50 70.56 2dg8 s THR 180 CO 0.16 0.03 2.77 0.47 -0.54 0.00 0.00 174.62 177.51 2dg8 n ASP 181 N 4.86 7.78 -2.79 3.99 9.92 -1.26 -4.56 116.55 134.48 2dg8 n ASP 181 Ca -0.14 -2.67 -0.06 0.00 -0.53 0.00 0.00 54.79 51.38 2dg8 n ASP 181 Cb 0.47 -1.56 0.01 0.00 -0.64 0.00 0.00 41.12 39.40 2dg8 n ASP 181 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2dg8 n ARG 182 N 3.91 0.59 0.00 -1.24 3.00 -1.26 -5.36 116.66 116.30 2dg8 n ARG 182 Ca 0.72 -2.03 0.15 0.00 -0.00 0.00 0.00 57.85 56.69 2dg8 n ARG 182 Cb 0.26 -1.47 0.71 0.00 0.00 0.00 0.00 32.46 31.95 2dg8 n ARG 182 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33