#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 0.02 -0.11 6.31 -1.04 -1.26 -4.29 114.28 113.91 2q80 n THR 7 Ca 0.00 -0.04 -0.05 0.00 -2.04 0.00 0.00 64.05 61.92 2q80 n THR 7 Cb 0.00 -0.23 0.03 0.00 -1.82 0.00 0.00 70.33 68.30 2q80 n THR 7 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2q80 h VAL 8 N 0.30 0.81 -0.07 12.58 2.07 -2.05 -2.19 116.25 127.70 2q80 h VAL 8 Ca 0.00 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.47 2q80 h VAL 8 Cb 0.06 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2q80 h VAL 8 CO 0.00 0.04 0.06 1.56 0.02 0.00 0.00 177.57 179.25 2q80 h GLN 9 N 0.21 0.00 0.11 1.57 1.08 -1.99 -1.09 115.11 115.01 2q80 h GLN 9 Ca 0.18 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.38 2q80 h GLN 9 Cb 0.21 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 2q80 h GLN 9 CO -0.24 0.00 -0.05 -0.09 -0.95 0.00 0.00 178.83 177.50 2q80 h ARG 10 N 0.00 -0.14 -0.09 1.46 9.65 -1.68 -2.34 114.38 121.23 2q80 h ARG 10 Ca 0.03 0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.91 2q80 h ARG 10 Cb 0.15 0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.76 2q80 h ARG 10 CO -0.00 0.10 -0.01 0.82 2.80 0.00 0.00 179.97 183.68 2q80 h ILE 11 N -0.37 1.27 0.00 1.20 1.08 -1.33 -2.58 117.51 116.78 2q80 h ILE 11 Ca -0.02 -0.86 -0.00 0.00 -0.39 0.00 0.00 64.86 63.59 2q80 h ILE 11 Cb 0.31 1.67 -0.00 0.00 -3.07 0.00 0.00 36.82 35.73 2q80 h ILE 11 CO 0.03 0.24 -0.02 -0.07 -0.69 0.00 0.00 178.15 177.63 2q80 h LEU 12 N -0.15 0.00 -1.14 1.44 3.38 -1.29 -2.60 115.31 114.95 2q80 h LEU 12 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2q80 h LEU 12 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2q80 h LEU 12 CO 0.01 0.02 -0.28 0.18 0.09 0.00 0.00 178.44 178.46 2q80 n LEU 13 N -4.43 2.05 -0.06 1.67 4.77 -0.88 -4.52 117.00 115.59 2q80 n LEU 13 Ca -0.03 -0.71 -0.07 0.00 -0.03 0.00 0.00 56.01 55.17 2q80 n LEU 13 Cb 0.11 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 2q80 n LEU 13 CO 0.34 0.36 0.82 -0.08 -1.33 0.00 0.00 177.39 177.50 2q80 h GLU 14 N 2.79 0.00 -0.92 3.23 4.81 -1.06 0.19 114.58 123.62 2q80 h GLU 14 Ca 0.00 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 2q80 h GLU 14 Cb 0.75 -0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.05 2q80 h GLU 14 CO 0.00 0.00 0.56 -1.35 -0.73 0.00 0.00 179.01 177.49 2q80 h PRO 15 N 0.00 0.91 0.87 0.92 0.11 -1.81 0.13 132.00 133.14 2q80 h PRO 15 Ca 0.13 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.14 2q80 h PRO 15 Cb 0.19 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.10 2q80 h PRO 15 CO -0.27 0.61 -0.42 -0.92 -0.21 0.00 0.00 178.00 176.79 2q80 h TYR 16 N 0.94 -1.08 -1.10 0.65 3.20 -1.48 -2.52 116.97 115.57 2q80 h TYR 16 Ca 0.44 -0.03 0.30 0.00 3.14 0.00 0.00 58.73 62.58 2q80 h TYR 16 Cb 0.36 0.36 -0.09 0.00 1.54 0.00 0.00 36.73 38.90 2q80 h TYR 16 CO -0.03 -0.67 0.73 -0.22 -1.64 0.00 0.00 178.16 176.32 2q80 h LYS 17 N -1.24 0.27 0.01 1.82 1.63 -0.40 0.52 116.57 119.18 2q80 h LYS 17 Ca -0.12 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.66 2q80 h LYS 17 Cb 0.90 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 2q80 h LYS 17 CO 0.20 0.18 -0.01 -0.92 -3.45 0.00 0.00 179.45 175.45 2q80 h TYR 18 N 0.28 -0.02 0.00 1.91 3.20 -0.77 -3.06 116.97 118.51 2q80 h TYR 18 Ca 0.61 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.46 2q80 h TYR 18 Cb 1.78 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 40.05 2q80 h TYR 18 CO -0.00 0.06 -0.09 1.25 -1.64 0.00 0.00 178.16 177.73 2q80 h LEU 19 N -0.08 0.00 -1.91 2.82 5.85 0.48 -1.28 115.31 121.18 2q80 h LEU 19 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2q80 h LEU 19 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 2q80 h LEU 19 CO 0.00 0.09 0.00 -0.07 -0.34 0.00 0.00 178.44 178.12 2q80 h LEU 20 N 0.00 0.00 -2.07 2.25 3.38 -1.37 -1.50 115.31 116.01 2q80 h LEU 20 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2q80 h LEU 20 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2q80 h LEU 20 CO 0.01 0.00 -0.08 1.56 0.09 0.00 0.00 178.44 180.02 2q80 h GLN 21 N 0.00 0.00 -7.05 1.13 4.20 -1.35 -3.45 115.11 108.58 2q80 h GLN 21 Ca 0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 2q80 h GLN 21 Cb 0.24 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.08 2q80 h GLN 21 CO 0.00 0.08 0.45 -0.51 -0.67 0.00 0.00 178.83 178.18 2q80 s LEU 22 N -7.21 3.86 0.82 1.46 1.02 -0.57 -5.03 118.68 113.03 2q80 s LEU 22 Ca -0.03 2.21 -0.12 0.00 0.02 0.00 0.00 54.13 56.21 2q80 s LEU 22 Cb 0.13 -4.45 0.09 0.00 0.02 0.00 0.00 46.19 41.98 2q80 s LEU 22 CO 0.56 -1.08 1.17 -2.84 0.02 0.00 0.00 176.35 174.18 2q80 s PRO 23 N -3.05 1.64 0.00 1.29 0.02 -1.26 -4.63 135.00 129.00 2q80 s PRO 23 Ca 0.69 1.60 0.00 0.00 0.02 0.00 0.00 61.00 63.31 2q80 s PRO 23 Cb -0.25 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.48 2q80 s PRO 23 CO 0.29 -2.18 0.00 0.41 -0.33 0.00 0.00 177.00 175.19 2q80 n GLY 24 N 0.14 0.92 0.12 0.52 0.00 -1.26 -4.97 105.19 100.66 2q80 n GLY 24 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 2q80 n GLY 24 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2q80 h LYS 25 N 0.00 0.29 -0.99 1.61 -0.00 -1.97 -2.98 116.57 112.53 2q80 h LYS 25 Ca 0.00 -0.08 0.23 0.00 -0.00 0.00 0.00 60.65 60.80 2q80 h LYS 25 Cb 0.00 -0.03 -0.08 0.00 -0.00 0.00 0.00 32.23 32.11 2q80 h LYS 25 CO 0.00 0.48 0.64 0.37 -0.00 0.00 0.00 179.45 180.94 2q80 h GLN 26 N 0.07 0.43 -0.03 0.07 -0.00 -1.96 0.47 115.11 114.15 2q80 h GLN 26 Ca 0.05 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.65 58.64 2q80 h GLN 26 Cb 0.34 -0.10 0.00 0.00 0.00 0.00 0.00 27.48 27.72 2q80 h GLN 26 CO 0.01 0.28 -0.12 0.28 0.00 0.00 0.00 178.83 179.28 2q80 h VAL 27 N 0.44 1.48 -0.72 2.39 2.07 -1.99 -2.54 116.25 117.39 2q80 h VAL 27 Ca 0.55 -1.58 0.11 0.00 0.82 0.00 0.00 66.70 66.60 2q80 h VAL 27 Cb 1.32 2.44 -0.05 0.00 -1.52 0.00 0.00 31.29 33.48 2q80 h VAL 27 CO -0.26 0.43 0.47 0.03 0.02 0.00 0.00 177.57 178.26 2q80 h ARG 28 N -0.44 0.51 -0.11 1.57 3.08 -0.10 0.21 114.38 119.10 2q80 h ARG 28 Ca -0.01 -0.03 -0.23 0.00 0.07 0.00 0.00 59.98 59.78 2q80 h ARG 28 Cb 0.76 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.71 2q80 h ARG 28 CO 0.03 0.34 -0.84 1.15 -1.07 0.00 0.00 179.97 179.57 2q80 h THR 29 N 0.53 1.28 -0.13 2.04 2.02 -0.61 -2.69 112.91 115.35 2q80 h THR 29 Ca 0.34 -2.04 -0.09 0.00 0.77 0.00 0.00 66.41 65.38 2q80 h THR 29 Cb 0.60 2.11 -0.01 0.00 -1.74 0.00 0.00 68.15 69.11 2q80 h THR 29 CO -0.11 0.64 -0.33 0.11 0.37 0.00 0.00 175.52 176.20 2q80 h LYS 30 N 0.47 0.26 -0.07 6.66 1.79 -0.87 -2.01 116.57 122.81 2q80 h LYS 30 Ca -0.08 -0.11 -0.01 0.00 -2.18 0.00 0.00 60.65 58.28 2q80 h LYS 30 Cb 1.48 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 32.12 2q80 h LYS 30 CO 0.17 0.57 0.01 -0.07 -1.08 0.00 0.00 179.45 179.05 2q80 h LEU 31 N 0.23 0.11 -0.44 2.94 3.38 -1.03 -1.51 115.31 118.99 2q80 h LEU 31 Ca 0.03 -0.26 0.08 0.00 0.09 0.00 0.00 57.88 57.83 2q80 h LEU 31 Cb 0.70 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.35 2q80 h LEU 31 CO 0.05 0.34 -0.01 -1.28 0.09 0.00 0.00 178.44 177.63 2q80 h SER 32 N -0.13 -0.21 -0.45 -0.43 0.87 -1.19 -0.32 113.55 111.70 2q80 h SER 32 Ca 0.02 0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 2q80 h SER 32 Cb 0.28 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2q80 h SER 32 CO 0.00 -0.07 0.19 1.56 -0.53 0.00 0.00 176.83 177.99 2q80 h GLN 33 N 0.09 0.66 -0.24 2.24 4.20 -1.38 -0.24 115.11 120.44 2q80 h GLN 33 Ca 0.22 -0.11 0.04 0.00 0.06 0.00 0.00 58.65 58.86 2q80 h GLN 33 Cb 0.32 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 2q80 h GLN 33 CO -0.37 0.59 -0.00 0.00 -0.67 0.00 0.00 178.83 178.37 2q80 h ALA 34 N 1.04 0.21 -0.05 3.87 0.00 -0.30 -1.19 119.26 122.84 2q80 h ALA 34 Ca 0.15 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 2q80 h ALA 34 Cb 0.16 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2q80 h ALA 34 CO -0.01 -0.42 -0.61 0.74 0.00 0.00 0.00 179.25 178.94 2q80 h PHE 35 N 0.07 0.22 0.00 0.00 0.04 -0.94 -2.53 116.94 113.81 2q80 h PHE 35 Ca 0.11 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.80 2q80 h PHE 35 Cb 0.15 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.26 2q80 h PHE 35 CO -0.19 0.74 0.00 -1.71 -0.60 0.00 0.00 178.31 176.54 2q80 n ASN 36 N -3.85 0.00 -0.26 2.17 5.15 -0.12 -0.73 115.26 117.62 2q80 n ASN 36 Ca -0.02 0.42 -0.04 0.00 -0.60 0.00 0.00 54.58 54.34 2q80 n ASN 36 Cb 0.62 -0.46 0.12 0.00 -0.53 0.00 0.00 39.78 39.52 2q80 n ASN 36 CO 0.00 0.00 0.00 -0.74 1.40 0.00 0.00 177.26 177.92 2q80 h HIS 37 N 0.00 1.13 0.00 1.20 2.76 -0.78 -2.36 115.15 117.10 2q80 h HIS 37 Ca 0.00 -0.06 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 2q80 h HIS 37 Cb 0.25 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 2q80 h HIS 37 CO 0.00 0.83 -0.36 -1.49 -1.30 0.00 0.00 177.93 175.61 2q80 h TRP 38 N 1.11 0.00 0.00 5.26 6.55 -1.31 -3.41 115.95 124.15 2q80 h TRP 38 Ca 0.26 0.00 -0.07 0.00 0.95 0.00 0.00 58.89 60.03 2q80 h TRP 38 Cb 0.15 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.44 2q80 h TRP 38 CO 0.02 0.59 -0.34 -0.07 -1.05 0.00 0.00 178.44 177.58 2q80 h LEU 39 N -1.00 0.00 -3.51 -4.49 3.38 -1.05 -3.44 115.31 105.20 2q80 h LEU 39 Ca -0.07 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.35 2q80 h LEU 39 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2q80 h LEU 39 CO -0.04 0.34 -0.99 0.29 0.09 0.00 0.00 178.44 178.13 2q80 n LYS 40 N -3.36 -0.70 -2.73 1.13 5.02 -0.89 -4.38 118.16 112.25 2q80 n LYS 40 Ca 0.01 0.19 -0.41 0.00 -2.02 0.00 0.00 58.31 56.08 2q80 n LYS 40 Cb 0.55 -3.13 -0.04 0.00 -0.02 0.00 0.00 35.03 32.39 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 -3.59 4.62 0.49 -0.18 1.01 -1.26 -4.90 120.40 116.59 2q80 s VAL 41 Ca 0.43 2.05 -0.23 0.00 0.00 0.00 0.00 61.98 64.23 2q80 s VAL 41 Cb -0.21 -4.31 -0.07 0.00 0.00 0.00 0.00 36.38 31.78 2q80 s VAL 41 CO 0.94 0.27 1.23 -2.65 0.00 0.00 0.00 175.10 174.89 2q80 n PRO 42 N 3.11 1.65 -0.27 2.72 -0.02 -1.26 -4.70 135.00 136.22 2q80 n PRO 42 Ca 0.03 0.60 -0.06 0.00 -2.02 0.00 0.00 63.50 62.05 2q80 n PRO 42 Cb 0.50 -2.38 0.06 0.00 -0.02 0.00 0.00 33.50 31.65 2q80 n PRO 42 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2q80 h GLU 43 N 1.58 1.05 -0.68 -0.52 9.09 -1.98 -0.54 114.58 122.58 2q80 h GLU 43 Ca -0.49 -0.15 -0.05 0.00 0.05 0.00 0.00 59.36 58.72 2q80 h GLU 43 Cb 1.31 -0.19 -0.03 0.00 -1.65 0.00 0.00 28.75 28.19 2q80 h GLU 43 CO 0.57 0.81 0.22 0.38 0.05 0.00 0.00 179.01 181.05 2q80 h ASP 44 N 1.02 0.99 -0.39 3.06 2.03 -2.00 0.22 116.42 121.35 2q80 h ASP 44 Ca 0.25 -0.20 -0.13 0.00 -0.73 0.00 0.00 57.03 56.22 2q80 h ASP 44 Cb 0.10 -0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 38.33 2q80 h ASP 44 CO -0.03 0.93 -0.23 0.11 -1.03 0.00 0.00 179.24 178.98 2q80 h LYS 45 N 0.99 0.89 -0.47 4.15 1.79 -1.84 -3.08 116.57 119.00 2q80 h LYS 45 Ca 0.22 -0.38 -0.13 0.00 -2.18 0.00 0.00 60.65 58.18 2q80 h LYS 45 Cb 0.29 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 2q80 h LYS 45 CO -0.01 1.03 -0.21 1.25 -1.08 0.00 0.00 179.45 180.43 2q80 h LEU 46 N 0.77 1.01 -0.85 2.94 5.85 -0.48 -2.01 115.31 122.55 2q80 h LEU 46 Ca 0.10 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.44 2q80 h LEU 46 Cb 0.78 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2q80 h LEU 46 CO 0.06 1.18 0.56 1.56 -0.34 0.00 0.00 178.44 181.46 2q80 h GLN 47 N 0.83 1.10 -0.68 1.25 1.08 -1.00 -1.68 115.11 116.01 2q80 h GLN 47 Ca 0.11 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.20 2q80 h GLN 47 Cb 0.79 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 27.94 2q80 h GLN 47 CO 0.07 0.73 0.28 0.82 -0.95 0.00 0.00 178.83 179.78 2q80 h ILE 48 N 1.13 1.24 -0.24 2.54 5.03 -1.41 -1.99 117.51 123.82 2q80 h ILE 48 Ca 0.32 -0.74 -0.01 0.00 -0.12 0.00 0.00 64.86 64.31 2q80 h ILE 48 Cb -0.11 0.45 -0.01 0.00 -3.03 0.00 0.00 36.82 34.12 2q80 h ILE 48 CO -0.08 0.30 0.12 0.40 -0.68 0.00 0.00 178.15 178.21 2q80 h ILE 49 N 0.97 1.13 -0.51 -0.67 2.04 -1.03 -0.82 117.51 118.63 2q80 h ILE 49 Ca 0.23 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.72 2q80 h ILE 49 Cb 0.19 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2q80 h ILE 49 CO -0.02 0.13 0.33 0.40 0.00 0.00 0.00 178.15 178.99 2q80 h ILE 50 N 0.25 1.11 -1.00 -0.67 2.04 -1.13 0.20 117.51 118.31 2q80 h ILE 50 Ca 0.08 -0.23 0.03 0.00 1.00 0.00 0.00 64.86 65.74 2q80 h ILE 50 Cb 0.10 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.52 2q80 h ILE 50 CO -0.01 0.12 0.66 -0.33 0.00 0.00 0.00 178.15 178.59 2q80 h GLU 51 N 0.66 1.26 0.04 2.37 5.08 -1.26 -0.17 114.58 122.56 2q80 h GLU 51 Ca 0.19 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2q80 h GLU 51 Cb -0.05 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 28.91 2q80 h GLU 51 CO -0.05 0.83 -0.02 0.28 -1.00 0.00 0.00 179.01 179.05 2q80 h VAL 52 N 1.30 1.22 -0.39 3.13 2.07 -0.27 -2.12 116.25 121.20 2q80 h VAL 52 Ca 0.38 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 67.12 2q80 h VAL 52 Cb -0.06 1.79 -0.09 0.00 -1.52 0.00 0.00 31.29 31.40 2q80 h VAL 52 CO -0.11 0.22 -0.41 0.74 0.02 0.00 0.00 177.57 178.03 2q80 h THR 53 N -0.43 0.14 -0.41 2.57 2.02 -0.52 -1.93 112.91 114.35 2q80 h THR 53 Ca -0.01 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.25 2q80 h THR 53 Cb 0.39 0.14 -0.07 0.00 -1.74 0.00 0.00 68.15 66.87 2q80 h THR 53 CO 0.01 0.00 -0.01 -0.08 0.37 0.00 0.00 175.52 175.80 2q80 h GLU 54 N -0.32 0.09 -0.32 6.66 4.81 -0.98 0.69 114.58 125.21 2q80 h GLU 54 Ca 0.14 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2q80 h GLU 54 Cb 0.58 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 2q80 h GLU 54 CO -0.56 0.06 0.20 0.52 -0.73 0.00 0.00 179.01 178.50 2q80 h MET 55 N 0.09 0.43 0.03 1.92 2.86 -0.98 -0.17 114.93 119.11 2q80 h MET 55 Ca 0.20 -0.04 -0.23 0.00 -2.06 0.00 0.00 59.70 57.58 2q80 h MET 55 Cb 0.29 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 2q80 h MET 55 CO -0.35 0.32 -0.98 -0.07 1.06 0.00 0.00 176.91 176.89 2q80 h LEU 56 N 0.42 0.43 -0.43 1.22 3.38 -1.01 0.00 115.31 119.33 2q80 h LEU 56 Ca 0.12 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2q80 h LEU 56 Cb -0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2q80 h LEU 56 CO -0.02 1.19 0.06 -0.74 0.09 0.00 0.00 178.44 179.02 2q80 h HIS 57 N 0.17 0.76 -0.22 1.13 2.76 -0.80 -1.81 115.15 117.12 2q80 h HIS 57 Ca -0.08 -0.11 -0.05 0.00 -2.20 0.00 0.00 60.37 57.94 2q80 h HIS 57 Cb 1.64 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 30.38 2q80 h HIS 57 CO 0.05 0.73 -0.04 -0.91 -1.30 0.00 0.00 177.93 176.46 2q80 h ASN 58 N 0.57 0.43 -0.68 3.26 2.35 -0.96 -2.27 115.58 118.28 2q80 h ASN 58 Ca 0.13 -0.35 0.11 0.00 -0.55 0.00 0.00 56.30 55.63 2q80 h ASN 58 Cb 0.39 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.60 2q80 h ASN 58 CO 0.01 0.68 0.45 0.00 -1.65 0.00 0.00 177.43 176.92 2q80 h ALA 59 N 0.76 1.96 0.00 -0.83 0.00 -0.99 -0.51 119.26 119.65 2q80 h ALA 59 Ca 0.06 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 2q80 h ALA 59 Cb 0.49 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2q80 h ALA 59 CO 0.02 -0.11 -0.89 0.66 0.00 0.00 0.00 179.25 178.93 2q80 h SER 60 N 0.50 0.00 0.45 0.00 4.64 -1.23 -2.85 113.55 115.06 2q80 h SER 60 Ca 0.32 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.48 2q80 h SER 60 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2q80 h SER 60 CO -0.10 0.89 -0.67 -0.07 -0.87 0.00 0.00 176.83 176.00 2q80 h LEU 61 N 0.00 0.24 -0.33 5.97 3.38 -0.56 -1.35 115.31 122.66 2q80 h LEU 61 Ca -0.01 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2q80 h LEU 61 Cb 1.64 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 2q80 h LEU 61 CO 0.12 0.84 0.14 -0.07 0.09 0.00 0.00 178.44 179.56 2q80 h LEU 62 N 0.14 0.44 -0.37 1.67 3.38 -1.10 -2.05 115.31 117.43 2q80 h LEU 62 Ca -0.01 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 2q80 h LEU 62 Cb 1.21 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2q80 h LEU 62 CO 0.10 0.47 -0.07 0.40 0.09 0.00 0.00 178.44 179.43 2q80 h ILE 63 N 0.39 1.27 -0.48 1.22 1.08 -1.46 -3.17 117.51 116.36 2q80 h ILE 63 Ca 0.11 -1.12 0.09 0.00 -0.39 0.00 0.00 64.86 63.55 2q80 h ILE 63 Cb 0.15 1.25 -0.08 0.00 -3.07 0.00 0.00 36.82 35.08 2q80 h ILE 63 CO -0.01 0.37 0.02 -0.78 -0.69 0.00 0.00 178.15 177.06 2q80 h ASP 64 N 0.50 -0.17 -0.39 1.72 3.58 -1.11 0.51 116.42 121.05 2q80 h ASP 64 Ca 0.10 0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.68 2q80 h ASP 64 Cb 0.57 0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 2q80 h ASP 64 CO 0.03 -0.05 0.26 0.44 -2.88 0.00 0.00 179.24 177.04 2q80 h ASP 65 N 0.13 0.38 -0.03 2.28 3.32 -1.36 0.80 116.42 121.95 2q80 h ASP 65 Ca 0.24 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 2q80 h ASP 65 Cb 0.35 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2q80 h ASP 65 CO -0.39 0.27 -0.06 0.40 -1.72 0.00 0.00 179.24 177.74 2q80 h ILE 66 N 0.44 1.45 -0.58 0.35 2.04 -1.30 -1.64 117.51 118.27 2q80 h ILE 66 Ca 0.16 -1.43 0.09 0.00 1.00 0.00 0.00 64.86 64.68 2q80 h ILE 66 Cb 0.08 2.35 -0.07 0.00 -0.74 0.00 0.00 36.82 38.44 2q80 h ILE 66 CO -0.04 0.38 0.20 -0.33 0.00 0.00 0.00 178.15 178.37 2q80 h GLU 67 N -0.46 0.37 -0.13 2.37 5.08 -0.11 -2.86 114.58 118.82 2q80 h GLU 67 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2q80 h GLU 67 Cb 0.66 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2q80 h GLU 67 CO 0.01 0.24 0.00 -0.25 -1.00 0.00 0.00 179.01 178.02 2q80 n ASP 68 N -5.02 1.53 -4.05 1.42 10.43 0.27 -4.93 116.55 116.20 2q80 n ASP 68 Ca 0.08 -1.65 -0.27 0.00 2.57 0.00 0.00 54.79 55.51 2q80 n ASP 68 Cb 0.26 -0.08 -0.04 0.00 1.84 0.00 0.00 41.12 43.10 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 0.22 -0.18 -4.92 -2.24 5.15 -0.70 -4.57 115.26 108.02 2q80 n ASN 69 Ca 0.16 -1.07 -0.26 0.00 -0.60 0.00 0.00 54.58 52.82 2q80 n ASN 69 Cb 0.32 -2.71 -0.01 0.00 -0.53 0.00 0.00 39.78 36.84 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 -4.32 6.31 -0.21 1.20 0.01 -0.73 -4.83 113.70 111.14 2q80 s SER 70 Ca 0.04 0.71 -0.08 0.00 1.31 0.00 0.00 55.95 57.93 2q80 s SER 70 Cb -0.02 -2.15 -0.10 0.00 0.21 0.00 0.00 66.02 63.96 2q80 s SER 70 CO 0.92 -0.40 -0.25 0.29 0.41 0.00 0.00 173.24 174.20 2q80 n LYS 71 N -1.84 0.46 -4.45 12.44 4.76 -1.26 -4.79 118.16 123.49 2q80 n LYS 71 Ca -0.02 0.18 -0.30 0.00 -2.87 0.00 0.00 58.31 55.30 2q80 n LYS 71 Cb 0.55 -1.29 -0.12 0.00 -1.84 0.00 0.00 35.03 32.34 2q80 n LYS 71 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2q80 s LEU 72 N -6.94 2.59 -0.13 -0.35 1.43 -1.26 -0.54 118.68 113.48 2q80 s LEU 72 Ca -0.29 -0.55 -0.03 0.00 -1.03 0.00 0.00 54.13 52.23 2q80 s LEU 72 Cb 0.10 -1.48 0.05 0.00 0.03 0.00 0.00 46.19 44.90 2q80 s LEU 72 CO 0.39 0.20 0.04 -0.60 0.23 0.00 0.00 176.35 176.62 2q80 s ARG 73 N -1.89 0.41 -1.45 1.70 3.52 0.92 -4.33 118.95 117.84 2q80 s ARG 73 Ca 0.16 -0.07 -0.09 0.00 -0.13 0.00 0.00 55.73 55.59 2q80 s ARG 73 Cb -0.10 -1.49 0.05 0.00 -1.56 0.00 0.00 34.95 31.85 2q80 s ARG 73 CO 0.08 -0.50 0.93 0.54 -0.81 0.00 0.00 175.30 175.54 2q80 n ARG 74 N 5.17 -5.65 -0.93 5.12 5.12 -1.26 -2.54 116.66 121.67 2q80 n ARG 74 Ca -0.07 0.63 0.00 0.00 -1.93 0.00 0.00 57.85 56.48 2q80 n ARG 74 Cb 0.49 -5.46 0.00 0.00 -1.16 0.00 0.00 32.46 26.33 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 -1.69 0.86 3.86 -0.13 0.00 -1.26 -4.75 105.19 102.08 2q80 n GLY 75 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.57 3.23 0.43 1.61 0.08 -1.05 -5.00 117.98 113.71 2q80 s PHE 76 Ca 0.00 -0.04 -0.26 0.00 0.12 0.00 0.00 56.93 56.75 2q80 s PHE 76 Cb 0.00 -1.50 -0.09 0.00 -0.57 0.00 0.00 43.02 40.87 2q80 s PHE 76 CO 0.00 0.50 1.38 -2.14 -0.10 0.00 0.00 175.22 174.87 2q80 s PRO 77 N -3.61 3.83 0.41 0.24 0.02 -1.26 -0.05 135.00 134.58 2q80 s PRO 77 Ca 0.33 2.33 -0.26 0.00 0.02 0.00 0.00 61.00 63.42 2q80 s PRO 77 Cb -0.09 -2.72 -0.09 0.00 0.02 0.00 0.00 34.50 31.62 2q80 s PRO 77 CO 0.26 -0.66 1.27 0.14 -0.33 0.00 0.00 177.00 177.68 2q80 s VAL 78 N -1.22 2.73 0.25 3.83 -7.23 0.30 -4.68 120.40 114.37 2q80 s VAL 78 Ca 0.59 0.64 -0.04 0.00 -1.81 0.00 0.00 61.98 61.36 2q80 s VAL 78 Cb -0.42 -3.37 0.24 0.00 0.56 0.00 0.00 36.38 33.39 2q80 s VAL 78 CO 0.54 0.09 1.70 0.00 -0.31 0.00 0.00 175.10 177.11 2q80 h ALA 79 N 2.66 1.04 0.00 1.32 0.00 -1.92 -0.29 119.26 122.06 2q80 h ALA 79 Ca -0.49 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2q80 h ALA 79 Cb 1.24 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2q80 h ALA 79 CO 0.62 -0.31 0.00 1.12 0.00 0.00 0.00 179.25 180.68 2q80 h HIS 80 N 0.32 0.00 0.00 0.00 2.07 -1.91 0.12 115.15 115.74 2q80 h HIS 80 Ca 0.43 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.92 2q80 h HIS 80 Cb 0.74 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.71 2q80 h HIS 80 CO -0.23 0.00 -0.14 0.66 -3.07 0.00 0.00 177.93 175.15 2q80 h SER 81 N 0.00 0.00 0.00 3.10 4.64 -1.36 0.24 113.55 120.17 2q80 h SER 81 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2q80 h SER 81 Cb 0.62 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.67 2q80 h SER 81 CO 0.00 0.14 -1.59 -0.38 -0.87 0.00 0.00 176.83 174.14 2q80 n ILE 82 N -3.24 1.52 0.77 0.95 5.41 -0.26 -4.64 119.36 119.86 2q80 n ILE 82 Ca 0.01 -0.10 0.11 0.00 1.00 0.00 0.00 62.75 63.77 2q80 n ILE 82 Cb 0.43 -2.06 0.08 0.00 -0.71 0.00 0.00 39.64 37.38 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 -4.40 0.16 0.00 1.39 4.01 0.25 -5.07 117.16 113.49 2q80 n TYR 83 Ca -0.35 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 2q80 n TYR 83 Cb 0.69 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 39.39 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 1.43 0.41 0.25 2.72 0.00 0.85 -4.57 105.19 106.27 2q80 n GLY 84 Ca 0.03 -1.64 -0.15 0.00 0.00 0.00 0.00 46.02 44.26 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 0.58 -0.50 -0.61 2.04 -1.94 -3.02 117.51 114.07 2q80 h ILE 85 Ca 0.00 -0.15 0.10 0.00 1.00 0.00 0.00 64.86 65.81 2q80 h ILE 85 Cb 0.00 0.66 -0.10 0.00 -0.74 0.00 0.00 36.82 36.64 2q80 h ILE 85 CO 0.00 0.03 -0.25 -0.65 0.00 0.00 0.00 178.15 177.28 2q80 h PRO 86 N -0.65 -0.14 -0.58 2.37 0.11 -1.95 -0.88 132.00 130.29 2q80 h PRO 86 Ca -0.06 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.06 2q80 h PRO 86 Cb 0.48 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.59 2q80 h PRO 86 CO 0.10 -0.09 0.36 0.77 -0.21 0.00 0.00 178.00 178.93 2q80 h SER 87 N -0.14 0.67 0.14 -2.05 0.02 -1.80 -2.01 113.55 108.37 2q80 h SER 87 Ca 0.22 -0.03 -0.25 0.00 -0.84 0.00 0.00 61.79 60.90 2q80 h SER 87 Cb 0.50 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 62.88 2q80 h SER 87 CO -0.58 0.50 -1.01 0.58 -1.14 0.00 0.00 176.83 175.19 2q80 h VAL 88 N 0.79 1.33 -0.31 2.27 2.07 -1.27 -0.67 116.25 120.46 2q80 h VAL 88 Ca 0.21 -2.33 0.07 0.00 0.82 0.00 0.00 66.70 65.47 2q80 h VAL 88 Cb -0.06 2.40 -0.06 0.00 -1.52 0.00 0.00 31.29 32.04 2q80 h VAL 88 CO -0.04 0.71 -0.12 0.40 0.02 0.00 0.00 177.57 178.54 2q80 h ILE 89 N 0.33 0.60 -0.68 4.57 2.04 -0.59 0.51 117.51 124.29 2q80 h ILE 89 Ca -0.11 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.67 2q80 h ILE 89 Cb 1.65 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 2q80 h ILE 89 CO 0.19 0.00 0.13 -1.13 0.00 0.00 0.00 178.15 177.34 2q80 h ASN 90 N -0.06 1.06 -0.07 1.72 -1.24 -1.35 -1.92 115.58 113.71 2q80 h ASN 90 Ca 0.15 -0.25 -0.13 0.00 0.71 0.00 0.00 56.30 56.78 2q80 h ASN 90 Cb 0.30 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 2q80 h ASN 90 CO -0.35 1.04 -0.38 -1.28 -1.29 0.00 0.00 177.43 175.18 2q80 h SER 91 N 1.04 0.62 0.40 1.15 0.87 -0.45 -1.43 113.55 115.75 2q80 h SER 91 Ca 0.21 -0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.49 2q80 h SER 91 Cb 0.42 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2q80 h SER 91 CO 0.01 0.93 -0.19 0.00 -0.53 0.00 0.00 176.83 177.05 2q80 h ALA 92 N 1.10 -0.54 -0.98 6.23 0.00 0.11 -2.47 119.26 122.71 2q80 h ALA 92 Ca 0.05 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.84 2q80 h ALA 92 Cb 0.87 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 2q80 h ALA 92 CO 0.08 -0.65 0.63 -0.91 0.00 0.00 0.00 179.25 178.40 2q80 h ASN 93 N -0.84 1.01 -0.50 0.00 2.35 -1.34 -1.52 115.58 114.73 2q80 h ASN 93 Ca -0.06 0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.76 2q80 h ASN 93 Cb 0.55 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.66 2q80 h ASN 93 CO 0.09 0.64 0.23 0.22 -1.65 0.00 0.00 177.43 176.96 2q80 h TYR 94 N 1.14 0.42 -0.51 1.19 3.20 -1.29 -2.57 116.97 118.55 2q80 h TYR 94 Ca 0.42 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.24 2q80 h TYR 94 Cb 0.18 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 2q80 h TYR 94 CO -0.00 0.18 0.02 0.28 -1.64 0.00 0.00 178.16 177.00 2q80 h VAL 95 N 0.45 1.25 -0.71 1.81 2.07 -0.81 -0.81 116.25 119.50 2q80 h VAL 95 Ca 0.23 -1.00 0.13 0.00 0.82 0.00 0.00 66.70 66.88 2q80 h VAL 95 Cb 0.18 0.83 -0.13 0.00 -1.52 0.00 0.00 31.29 30.64 2q80 h VAL 95 CO -0.19 0.36 -0.27 1.88 0.02 0.00 0.00 177.57 179.37 2q80 h TYR 96 N 0.79 -0.69 0.00 1.57 0.05 -0.98 0.24 116.97 117.95 2q80 h TYR 96 Ca 0.16 0.07 -0.09 0.00 0.05 0.00 0.00 58.73 58.91 2q80 h TYR 96 Cb 0.45 0.41 -0.01 0.00 1.01 0.00 0.00 36.73 38.58 2q80 h TYR 96 CO 0.03 -0.36 -0.49 0.74 -1.05 0.00 0.00 178.16 177.03 2q80 h PHE 97 N -0.07 0.00 -0.41 4.88 0.04 -1.23 0.50 116.94 120.65 2q80 h PHE 97 Ca 0.31 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 61.00 2q80 h PHE 97 Cb 0.56 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.69 2q80 h PHE 97 CO -0.64 0.44 -0.08 -0.07 -0.60 0.00 0.00 178.31 177.36 2q80 h LEU 98 N 0.00 0.69 -0.40 1.54 3.38 -0.74 -2.07 115.31 117.72 2q80 h LEU 98 Ca -0.01 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 2q80 h LEU 98 Cb 1.35 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2q80 h LEU 98 CO 0.06 0.81 0.06 1.23 0.09 0.00 0.00 178.44 180.69 2q80 h GLY 99 N 0.97 0.71 0.52 0.83 0.00 0.44 -1.57 103.07 104.96 2q80 h GLY 99 Ca 0.12 -0.48 0.13 0.00 0.00 0.00 0.00 47.33 47.10 2q80 h GLY 99 CO 0.03 0.44 0.60 -2.00 0.00 0.00 0.00 176.54 175.62 2q80 h LEU 100 N 0.51 0.81 -0.37 3.11 5.85 -0.89 -1.49 115.31 122.83 2q80 h LEU 100 Ca 0.12 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 2q80 h LEU 100 Cb 0.38 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2q80 h LEU 100 CO 0.01 0.43 -0.15 -0.08 -0.34 0.00 0.00 178.44 178.31 2q80 h GLU 101 N 0.87 0.76 -0.53 1.25 4.81 -0.93 -2.49 114.58 118.32 2q80 h GLU 101 Ca 0.47 -0.32 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 2q80 h GLU 101 Cb 0.57 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 2q80 h GLU 101 CO -0.24 0.93 -0.05 -0.22 -0.73 0.00 0.00 179.01 178.71 2q80 h LYS 102 N 0.55 0.97 -0.95 1.92 1.63 -1.05 -2.23 116.57 117.41 2q80 h LYS 102 Ca 0.09 -0.33 0.19 0.00 -0.85 0.00 0.00 60.65 59.74 2q80 h LYS 102 Cb 0.68 -0.08 -0.11 0.00 -0.60 0.00 0.00 32.23 32.13 2q80 h LYS 102 CO 0.05 1.00 0.53 0.28 -3.45 0.00 0.00 179.45 177.86 2q80 h VAL 103 N 0.84 0.66 0.00 2.00 2.07 -1.10 -0.20 116.25 120.52 2q80 h VAL 103 Ca 0.14 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2q80 h VAL 103 Cb 0.59 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2q80 h VAL 103 CO 0.04 0.12 0.00 -0.07 0.02 0.00 0.00 177.57 177.68 2q80 h LEU 104 N 0.66 0.00 -0.66 2.57 3.38 -0.94 -2.61 115.31 117.71 2q80 h LEU 104 Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.52 2q80 h LEU 104 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2q80 h LEU 104 CO -0.41 0.00 0.00 0.71 0.09 0.00 0.00 178.44 178.83 2q80 h THR 105 N 0.00 0.00 0.00 0.22 1.35 -0.97 -3.08 112.91 110.43 2q80 h THR 105 Ca 0.00 -0.66 -0.01 0.00 -0.55 0.00 0.00 66.41 65.19 2q80 h THR 105 Cb 0.36 1.63 -0.00 0.00 -1.73 0.00 0.00 68.15 68.41 2q80 h THR 105 CO 0.00 0.00 -0.06 -0.07 -0.25 0.00 0.00 175.52 175.14 2q80 h LEU 106 N 0.00 0.00 -1.80 3.87 3.38 -1.53 -3.47 115.31 115.76 2q80 h LEU 106 Ca 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 2q80 h LEU 106 Cb 0.71 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.47 2q80 h LEU 106 CO 0.00 0.06 -0.85 -0.90 0.09 0.00 0.00 178.44 176.84 2q80 n ASP 107 N -3.60 -0.96 -4.24 -0.43 3.85 -1.17 -5.00 116.55 104.99 2q80 n ASP 107 Ca -0.02 -0.88 -0.33 0.00 -0.71 0.00 0.00 54.79 52.85 2q80 n ASP 107 Cb 0.17 -3.71 -0.16 0.00 -1.35 0.00 0.00 41.12 36.06 2q80 n ASP 107 CO 0.00 0.00 0.00 -2.28 -1.01 0.00 0.00 177.20 173.91 2q80 s HIS 108 N -3.76 2.69 -0.30 2.11 5.04 -1.26 -5.03 115.29 114.78 2q80 s HIS 108 Ca 0.02 -1.08 0.22 0.00 -1.54 0.00 0.00 55.06 52.68 2q80 s HIS 108 Cb -0.01 -1.81 1.09 0.00 0.04 0.00 0.00 32.58 31.89 2q80 s HIS 108 CO 0.84 -0.47 1.67 -0.35 -2.34 0.00 0.00 174.74 174.09 2q80 n PRO 109 N 3.84 0.16 -0.22 2.88 -0.04 -1.26 -1.46 135.00 138.91 2q80 n PRO 109 Ca -0.19 0.57 0.11 0.00 -0.04 0.00 0.00 63.50 63.94 2q80 n PRO 109 Cb 0.52 -1.93 0.22 0.00 -0.04 0.00 0.00 33.50 32.28 2q80 n PRO 109 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2q80 n ASP 110 N -2.24 3.42 -0.04 3.54 8.00 -1.26 -4.69 116.55 123.27 2q80 n ASP 110 Ca -0.00 -1.96 -0.14 0.00 0.71 0.00 0.00 54.79 53.40 2q80 n ASP 110 Cb 0.10 -0.28 -0.08 0.00 -0.02 0.00 0.00 41.12 40.83 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 3.99 0.18 -0.11 2.24 0.00 -1.63 -2.32 119.26 121.60 2q80 h ALA 111 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 2q80 h ALA 111 Cb 0.92 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2q80 h ALA 111 CO 0.00 0.12 -0.44 0.28 0.00 0.00 0.00 179.25 179.22 2q80 h VAL 112 N -0.09 1.32 -0.21 0.00 2.07 -1.84 -0.10 116.25 117.41 2q80 h VAL 112 Ca 0.01 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 65.93 2q80 h VAL 112 Cb 0.79 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 2q80 h VAL 112 CO 0.05 0.48 0.10 0.50 0.02 0.00 0.00 177.57 178.71 2q80 h LYS 113 N 0.21 0.29 -0.11 1.57 3.64 -1.83 0.29 116.57 120.64 2q80 h LYS 113 Ca 0.02 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2q80 h LYS 113 Cb 0.86 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.63 2q80 h LYS 113 CO 0.07 0.31 -0.06 1.25 -2.27 0.00 0.00 179.45 178.75 2q80 h LEU 114 N 0.21 0.24 -0.55 5.20 6.46 -1.31 -1.40 115.31 124.15 2q80 h LEU 114 Ca 0.07 -0.43 0.09 0.00 -0.12 0.00 0.00 57.88 57.49 2q80 h LEU 114 Cb 0.11 -0.07 -0.11 0.00 -0.73 0.00 0.00 40.66 39.87 2q80 h LEU 114 CO -0.01 0.62 -0.36 0.15 -0.62 0.00 0.00 178.44 178.22 2q80 h PHE 115 N -0.14 -1.03 -0.25 1.25 3.57 -0.96 -1.77 116.94 117.61 2q80 h PHE 115 Ca 0.02 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.60 2q80 h PHE 115 Cb 0.54 0.53 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 2q80 h PHE 115 CO 0.07 -0.40 0.14 1.15 -2.23 0.00 0.00 178.31 177.04 2q80 h THR 116 N -0.20 1.02 -1.00 4.41 2.02 -0.83 -2.15 112.91 116.18 2q80 h THR 116 Ca 0.20 -0.10 0.06 0.00 0.77 0.00 0.00 66.41 67.35 2q80 h THR 116 Cb 0.56 0.71 -0.07 0.00 -1.74 0.00 0.00 68.15 67.60 2q80 h THR 116 CO -0.65 0.05 0.65 -0.09 0.37 0.00 0.00 175.52 175.85 2q80 h ARG 117 N 0.29 1.15 0.00 6.66 2.43 -0.73 -1.85 114.38 122.33 2q80 h ARG 117 Ca 0.10 -0.07 -0.24 0.00 -0.81 0.00 0.00 59.98 58.95 2q80 h ARG 117 Cb 0.00 -0.26 0.01 0.00 -0.42 0.00 0.00 29.97 29.31 2q80 h ARG 117 CO -0.05 0.76 -0.99 1.96 -1.51 0.00 0.00 179.97 180.14 2q80 h GLN 118 N 1.18 0.54 -0.21 0.20 1.08 -1.12 -1.65 115.11 115.14 2q80 h GLN 118 Ca 0.43 -0.58 -0.08 0.00 -1.45 0.00 0.00 58.65 56.97 2q80 h GLN 118 Cb 0.16 0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2q80 h GLN 118 CO -0.17 1.21 -0.17 -0.07 -0.95 0.00 0.00 178.83 178.68 2q80 h LEU 119 N 0.30 0.51 -0.50 1.46 3.38 -1.20 -0.98 115.31 118.28 2q80 h LEU 119 Ca -0.10 -0.46 0.10 0.00 0.09 0.00 0.00 57.88 57.51 2q80 h LEU 119 Cb 1.63 -0.14 -0.10 0.00 0.09 0.00 0.00 40.66 42.15 2q80 h LEU 119 CO 0.18 0.86 -0.13 -0.07 0.09 0.00 0.00 178.44 179.37 2q80 h LEU 120 N 0.16 -0.49 -0.48 1.67 3.38 -1.41 -1.15 115.31 117.00 2q80 h LEU 120 Ca 0.04 0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.23 2q80 h LEU 120 Cb 0.70 0.32 -0.06 0.00 0.09 0.00 0.00 40.66 41.71 2q80 h LEU 120 CO 0.04 -0.17 0.14 -0.08 0.09 0.00 0.00 178.44 178.46 2q80 h GLU 121 N -0.01 0.28 -0.76 1.13 4.57 -1.10 -1.48 114.58 117.21 2q80 h GLU 121 Ca 0.24 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.42 2q80 h GLU 121 Cb 0.38 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.86 2q80 h GLU 121 CO -0.52 0.19 0.51 1.25 -1.18 0.00 0.00 179.01 179.25 2q80 h LEU 122 N 0.29 0.87 0.00 1.64 5.85 -0.61 -2.77 115.31 120.58 2q80 h LEU 122 Ca 0.24 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 2q80 h LEU 122 Cb 0.28 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2q80 h LEU 122 CO -0.27 0.62 -0.34 0.45 -0.34 0.00 0.00 178.44 178.56 2q80 h HIS 123 N 1.02 0.00 -0.33 1.25 3.86 -0.53 -2.18 115.15 118.24 2q80 h HIS 123 Ca 0.28 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.40 2q80 h HIS 123 Cb -0.10 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 2q80 h HIS 123 CO -0.00 0.26 -0.16 1.96 0.86 0.00 0.00 177.93 180.85 2q80 h GLN 124 N 0.00 0.70 -0.12 2.45 4.20 -1.04 -1.80 115.11 119.50 2q80 h GLN 124 Ca -0.01 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 2q80 h GLN 124 Cb 1.21 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 2q80 h GLN 124 CO 0.03 0.90 0.05 0.78 -0.67 0.00 0.00 178.83 179.92 2q80 h GLY 125 N 0.47 0.19 0.76 3.46 0.00 -1.39 -2.90 103.07 103.66 2q80 h GLY 125 Ca 0.08 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.33 2q80 h GLY 125 CO 0.05 0.10 -0.02 1.46 0.00 0.00 0.00 176.54 178.13 2q80 h GLN 126 N 0.05 0.02 -0.75 4.80 1.08 -1.45 -2.10 115.11 116.77 2q80 h GLN 126 Ca 0.04 -0.00 0.13 0.00 -1.45 0.00 0.00 58.65 57.37 2q80 h GLN 126 Cb 0.16 -0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.53 2q80 h GLN 126 CO -0.00 0.01 0.49 0.78 -0.95 0.00 0.00 178.83 179.16 2q80 h GLY 127 N 0.02 0.80 1.06 3.46 0.00 -1.33 -1.21 103.07 105.87 2q80 h GLY 127 Ca 0.06 -0.22 -0.21 0.00 0.00 0.00 0.00 47.33 46.96 2q80 h GLY 127 CO -0.13 0.10 -0.81 1.41 0.00 0.00 0.00 176.54 177.11 2q80 h LEU 128 N 0.51 0.80 -0.04 3.11 3.38 -1.22 0.30 115.31 122.15 2q80 h LEU 128 Ca 0.36 -0.70 0.03 0.00 0.09 0.00 0.00 57.88 57.65 2q80 h LEU 128 Cb 0.69 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2q80 h LEU 128 CO -0.12 1.39 -0.14 -0.78 0.09 0.00 0.00 178.44 178.87 2q80 h ASP 129 N 0.28 -0.42 -0.11 -0.43 3.58 -0.99 -0.50 116.42 117.84 2q80 h ASP 129 Ca -0.09 0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.44 2q80 h ASP 129 Cb 1.47 0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.69 2q80 h ASP 129 CO 0.16 -0.19 0.04 0.40 -2.88 0.00 0.00 179.24 176.77 2q80 h ILE 130 N -0.21 0.98 -0.48 2.25 2.04 -1.19 -2.28 117.51 118.62 2q80 h ILE 130 Ca 0.06 -0.03 0.07 0.00 1.00 0.00 0.00 64.86 65.96 2q80 h ILE 130 Cb 0.30 0.87 -0.06 0.00 -0.74 0.00 0.00 36.82 37.19 2q80 h ILE 130 CO -0.17 0.02 0.15 0.22 0.00 0.00 0.00 178.15 178.37 2q80 h TYR 131 N 0.10 0.26 0.08 1.37 3.20 -0.01 -1.25 116.97 120.71 2q80 h TYR 131 Ca 0.05 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 2q80 h TYR 131 Cb 0.02 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.25 2q80 h TYR 131 CO -0.10 0.07 -0.04 -1.49 -1.64 0.00 0.00 178.16 174.96 2q80 h TRP 132 N 0.31 -0.10 -0.18 -3.82 6.55 -0.77 -1.68 115.95 116.25 2q80 h TRP 132 Ca 0.23 -0.00 0.03 0.00 0.95 0.00 0.00 58.89 60.10 2q80 h TRP 132 Cb 0.26 0.03 -0.06 0.00 -0.86 0.00 0.00 29.16 28.53 2q80 h TRP 132 CO -0.18 0.21 -0.50 -0.09 -1.05 0.00 0.00 178.44 176.83 2q80 h ARG 133 N -0.40 -0.47 -0.00 0.49 2.43 -1.20 -0.72 114.38 114.52 2q80 h ARG 133 Ca -0.01 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2q80 h ARG 133 Cb 0.34 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2q80 h ARG 133 CO 0.02 -0.31 -0.02 -0.25 -1.51 0.00 0.00 179.97 177.89 2q80 n ASP 134 N -5.14 0.03 -0.38 -3.80 8.00 -0.49 -2.77 116.55 111.99 2q80 n ASP 134 Ca -0.05 0.37 0.04 0.00 0.71 0.00 0.00 54.79 55.86 2q80 n ASP 134 Cb 0.33 -0.44 0.07 0.00 -0.02 0.00 0.00 41.12 41.06 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 -1.47 2.10 -3.51 -2.24 3.02 -0.64 -5.02 115.26 107.51 2q80 n ASN 135 Ca 0.08 -1.62 -0.19 0.00 -0.03 0.00 0.00 54.58 52.82 2q80 n ASN 135 Cb 0.33 -0.07 0.07 0.00 -0.61 0.00 0.00 39.78 39.49 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 0.36 -2.12 -4.00 3.10 4.01 -0.32 -4.98 117.16 113.21 2q80 n TYR 136 Ca 0.06 0.87 -0.31 0.00 -0.16 0.00 0.00 57.90 58.37 2q80 n TYR 136 Cb 0.28 -4.66 -0.15 0.00 -0.31 0.00 0.00 39.34 34.50 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 -3.47 2.16 0.23 -0.72 2.01 -0.90 -5.07 115.64 109.87 2q80 s THR 137 Ca 0.08 -2.25 -0.31 0.00 0.31 0.00 0.00 61.69 59.53 2q80 s THR 137 Cb -0.02 -2.59 -0.10 0.00 0.01 0.00 0.00 72.50 69.80 2q80 s THR 137 CO 0.76 -0.59 1.52 0.00 -0.69 0.00 0.00 174.62 175.63 2q80 s PRO 139 N 0.15 2.19 0.43 0.00 0.04 -1.26 -5.06 135.00 131.49 2q80 s PRO 139 Ca 0.64 0.28 -0.13 0.00 0.04 0.00 0.00 61.00 61.83 2q80 s PRO 139 Cb -0.44 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 2q80 s PRO 139 CO 0.40 -1.47 0.84 0.95 0.04 0.00 0.00 177.00 177.76 2q80 s THR 140 N -3.45 4.67 0.26 1.26 -4.23 -1.26 -4.89 115.64 108.00 2q80 s THR 140 Ca 0.61 0.89 -0.04 0.00 -1.18 0.00 0.00 61.69 61.97 2q80 s THR 140 Cb -0.12 -3.71 0.28 0.00 1.34 0.00 0.00 72.50 70.30 2q80 s THR 140 CO 0.51 -0.52 1.64 -0.08 -0.54 0.00 0.00 174.62 175.63 2q80 h GLU 141 N 1.30 0.14 -0.26 3.99 4.81 -1.97 -0.35 114.58 122.24 2q80 h GLU 141 Ca -0.47 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.71 2q80 h GLU 141 Cb 1.18 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2q80 h GLU 141 CO 0.63 0.10 0.02 0.93 -0.73 0.00 0.00 179.01 179.96 2q80 h GLU 142 N 0.15 0.44 -0.41 1.92 3.07 -1.99 -0.55 114.58 117.21 2q80 h GLU 142 Ca 0.45 -0.13 0.08 0.00 -0.50 0.00 0.00 59.36 59.26 2q80 h GLU 142 Cb 0.83 -0.05 -0.08 0.00 -0.84 0.00 0.00 28.75 28.61 2q80 h GLU 142 CO -0.65 0.59 -0.10 0.93 -1.40 0.00 0.00 179.01 178.38 2q80 h GLU 143 N 0.24 0.01 0.26 2.33 5.08 -1.62 -0.45 114.58 120.42 2q80 h GLU 143 Ca 0.08 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2q80 h GLU 143 Cb 0.37 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2q80 h GLU 143 CO 0.01 0.00 -0.17 -0.92 -1.00 0.00 0.00 179.01 176.93 2q80 h TYR 144 N 0.01 -0.44 -1.00 4.33 3.20 -0.77 -0.47 116.97 121.82 2q80 h TYR 144 Ca 0.20 -0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.27 2q80 h TYR 144 Cb 0.30 0.16 -0.11 0.00 1.54 0.00 0.00 36.73 38.62 2q80 h TYR 144 CO -0.36 -0.26 0.61 0.87 -1.64 0.00 0.00 178.16 177.38 2q80 h LYS 145 N -0.42 0.68 -0.17 1.82 1.57 -0.74 -0.24 116.57 119.07 2q80 h LYS 145 Ca -0.02 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2q80 h LYS 145 Cb 0.35 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2q80 h LYS 145 CO 0.02 0.45 0.04 0.00 -0.57 0.00 0.00 179.45 179.39 2q80 h ALA 146 N 1.67 0.23 -0.38 3.86 0.00 0.50 -2.56 119.26 122.59 2q80 h ALA 146 Ca 0.60 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 55.25 2q80 h ALA 146 Cb 1.01 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2q80 h ALA 146 CO -0.41 -0.12 -0.22 0.00 0.00 0.00 0.00 179.25 178.50 2q80 h MET 147 N 0.09 0.74 -0.81 0.00 -0.00 -0.29 -2.63 114.93 112.04 2q80 h MET 147 Ca 0.05 -0.30 0.10 0.00 -0.00 0.00 0.00 59.70 59.56 2q80 h MET 147 Cb 0.27 -0.04 -0.08 0.00 -0.00 0.00 0.00 31.60 31.76 2q80 h MET 147 CO 0.00 0.90 0.45 0.28 -0.00 0.00 0.00 176.91 178.54 2q80 h VAL 148 N 0.65 0.88 -0.86 -0.10 2.07 -1.02 0.23 116.25 118.10 2q80 h VAL 148 Ca 0.09 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.37 2q80 h VAL 148 Cb 0.72 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2q80 h VAL 148 CO 0.06 0.13 0.56 -0.07 0.02 0.00 0.00 177.57 178.28 2q80 h LEU 149 N 0.74 0.97 -0.36 2.57 3.38 -1.09 0.22 115.31 121.73 2q80 h LEU 149 Ca 0.40 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.28 2q80 h LEU 149 Cb 0.40 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2q80 h LEU 149 CO -0.26 0.69 -0.05 1.56 0.09 0.00 0.00 178.44 180.47 2q80 h GLN 150 N 1.14 0.67 0.75 1.13 4.20 -0.83 0.33 115.11 122.51 2q80 h GLN 150 Ca 0.32 -0.24 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2q80 h GLN 150 Cb -0.11 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 27.63 2q80 h GLN 150 CO -0.08 0.81 -0.36 -0.22 -0.67 0.00 0.00 178.83 178.31 2q80 h LYS 151 N 0.47 -0.97 0.01 1.46 3.64 -0.22 -1.51 116.57 119.45 2q80 h LYS 151 Ca 0.10 0.07 -0.18 0.00 -1.27 0.00 0.00 60.65 59.36 2q80 h LYS 151 Cb 0.54 0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2q80 h LYS 151 CO 0.03 -0.63 -0.70 1.79 -2.27 0.00 0.00 179.45 177.67 2q80 h THR 152 N -1.12 1.41 -1.03 1.00 1.35 -1.07 -3.15 112.91 110.30 2q80 h THR 152 Ca -0.10 -2.15 0.26 0.00 -0.55 0.00 0.00 66.41 63.87 2q80 h THR 152 Cb 0.79 2.61 -0.11 0.00 -1.73 0.00 0.00 68.15 69.71 2q80 h THR 152 CO 0.17 0.63 0.63 1.23 -0.25 0.00 0.00 175.52 177.93 2q80 h GLY 153 N -0.04 1.60 -0.12 5.82 0.00 -1.04 -0.86 103.07 108.42 2q80 h GLY 153 Ca -0.09 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 46.99 2q80 h GLY 153 CO 0.14 -0.21 -0.08 -1.33 0.00 0.00 0.00 176.54 175.06 2q80 h GLY 154 N 0.48 -2.32 0.30 4.60 0.00 -1.22 0.83 103.07 105.74 2q80 h GLY 154 Ca 0.63 1.05 -0.00 0.00 0.00 0.00 0.00 47.33 49.01 2q80 h GLY 154 CO -0.40 -0.83 -0.00 1.41 0.00 0.00 0.00 176.54 176.71 2q80 h LEU 155 N -0.01 -0.00 -0.88 3.11 3.38 -1.53 -2.83 115.31 116.54 2q80 h LEU 155 Ca 0.02 -0.69 0.18 0.00 0.09 0.00 0.00 57.88 57.48 2q80 h LEU 155 Cb 0.06 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.65 2q80 h LEU 155 CO -0.12 0.69 -0.20 -0.26 0.09 0.00 0.00 178.44 178.64 2q80 h PHE 156 N -0.70 -0.43 0.00 1.13 0.04 -1.22 -0.88 116.94 114.87 2q80 h PHE 156 Ca -0.00 0.08 -0.08 0.00 2.80 0.00 0.00 57.97 60.77 2q80 h PHE 156 Cb 0.69 0.33 -0.01 0.00 2.20 0.00 0.00 35.95 39.16 2q80 h PHE 156 CO 0.17 -0.38 -0.39 0.78 -0.60 0.00 0.00 178.31 177.89 2q80 h GLY 157 N 0.00 0.00 0.81 -1.45 0.00 -0.86 -2.12 103.07 99.47 2q80 h GLY 157 Ca 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.69 2q80 h GLY 157 CO -0.90 0.00 -0.16 -2.00 0.00 0.00 0.00 176.54 173.48 2q80 h LEU 158 N 0.00 0.48 0.94 3.11 5.85 -0.93 0.27 115.31 125.04 2q80 h LEU 158 Ca -0.00 -0.46 -0.05 0.00 0.84 0.00 0.00 57.88 58.21 2q80 h LEU 158 Cb 0.89 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.79 2q80 h LEU 158 CO 0.05 0.84 -0.45 0.00 -0.34 0.00 0.00 178.44 178.53 2q80 h ALA 159 N 0.66 -1.34 -0.01 1.25 0.00 -1.16 -1.59 119.26 117.07 2q80 h ALA 159 Ca 0.04 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 2q80 h ALA 159 Cb 0.69 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2q80 h ALA 159 CO 0.04 -1.25 -0.41 0.28 0.00 0.00 0.00 179.25 177.91 2q80 h VAL 160 N -1.27 1.30 -0.29 0.00 2.07 -1.46 -2.02 116.25 114.58 2q80 h VAL 160 Ca -0.13 -1.42 -0.08 0.00 0.82 0.00 0.00 66.70 65.89 2q80 h VAL 160 Cb 0.97 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 2q80 h VAL 160 CO 0.21 0.41 -0.14 1.23 0.02 0.00 0.00 177.57 179.30 2q80 h GLY 161 N 1.24 0.65 1.08 2.17 0.00 -0.43 -1.39 103.07 106.39 2q80 h GLY 161 Ca -0.00 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.66 2q80 h GLY 161 CO 0.05 0.53 0.10 1.41 0.00 0.00 0.00 176.54 178.64 2q80 h LEU 162 N 0.35 1.08 -1.26 3.11 3.38 -1.11 -2.43 115.31 118.43 2q80 h LEU 162 Ca 0.06 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 2q80 h LEU 162 Cb 0.65 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2q80 h LEU 162 CO 0.04 1.07 0.30 0.24 0.09 0.00 0.00 178.44 180.18 2q80 h MET 163 N 1.05 0.81 0.00 1.13 2.86 -1.28 -2.74 114.93 116.76 2q80 h MET 163 Ca 0.20 -0.09 -0.13 0.00 -2.06 0.00 0.00 59.70 57.62 2q80 h MET 163 Cb 0.46 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 2q80 h MET 163 CO 0.01 0.61 -0.62 0.37 1.06 0.00 0.00 176.91 178.35 2q80 h GLN 164 N 0.81 0.00 -0.64 1.72 4.15 -0.93 -2.57 115.11 117.65 2q80 h GLN 164 Ca 0.21 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.70 2q80 h GLN 164 Cb 0.05 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 2q80 h GLN 164 CO -0.03 0.62 0.42 -0.07 -1.93 0.00 0.00 178.83 177.84 2q80 h LEU 165 N 0.00 0.51 -3.64 -2.39 3.38 -1.12 -2.24 115.31 109.82 2q80 h LEU 165 Ca -0.01 0.01 -0.34 0.00 0.09 0.00 0.00 57.88 57.62 2q80 h LEU 165 Cb 1.10 -0.10 -0.20 0.00 0.09 0.00 0.00 40.66 41.54 2q80 h LEU 165 CO 0.08 0.33 0.23 0.49 0.09 0.00 0.00 178.44 179.65 2q80 n PHE 166 N -4.48 2.00 -4.33 1.13 3.72 -0.99 -5.00 117.46 109.52 2q80 n PHE 166 Ca 0.10 -1.78 -0.25 0.00 -0.05 0.00 0.00 57.45 55.46 2q80 n PHE 166 Cb 0.28 -0.71 -0.12 0.00 -0.94 0.00 0.00 39.48 37.98 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 -2.06 2.81 0.00 4.37 0.15 -0.84 -4.49 113.70 113.64 2q80 s SER 167 Ca 0.51 -0.73 0.26 0.00 0.70 0.00 0.00 55.95 56.68 2q80 s SER 167 Cb 0.44 -0.17 0.62 0.00 -1.71 0.00 0.00 66.02 65.20 2q80 s SER 167 CO 0.04 0.09 1.48 -0.90 1.20 0.00 0.00 173.24 175.15 2q80 n ASP 168 N 0.92 0.63 -4.57 5.45 3.85 -1.26 -4.83 116.55 116.74 2q80 n ASP 168 Ca -0.18 -0.42 -0.41 0.00 -0.71 0.00 0.00 54.79 53.07 2q80 n ASP 168 Cb 0.54 0.19 -0.03 0.00 -1.35 0.00 0.00 41.12 40.47 2q80 n ASP 168 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 2q80 s TYR 169 N -2.85 2.11 -1.19 2.11 5.04 -1.26 -4.86 117.35 116.45 2q80 s TYR 169 Ca 0.15 0.54 0.19 0.00 -2.44 0.00 0.00 57.07 55.51 2q80 s TYR 169 Cb 0.18 -4.31 0.71 0.00 0.35 0.00 0.00 41.96 38.90 2q80 s TYR 169 CO 0.64 -2.16 1.62 0.36 -1.34 0.00 0.00 175.55 174.67 2q80 n LYS 170 N 8.73 3.64 -2.28 4.97 2.85 -1.26 -4.99 118.16 129.82 2q80 n LYS 170 Ca 0.15 -2.87 -0.33 0.00 -1.05 0.00 0.00 58.31 54.21 2q80 n LYS 170 Cb 0.49 -1.86 -0.02 0.00 -0.65 0.00 0.00 35.03 33.00 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 -1.77 3.64 -0.18 -1.58 2.02 -1.26 -4.99 118.70 114.58 2q80 s GLU 171 Ca 0.51 1.16 -0.27 0.00 0.02 0.00 0.00 54.97 56.38 2q80 s GLU 171 Cb 0.32 -2.08 -0.01 0.00 0.10 0.00 0.00 34.13 32.46 2q80 s GLU 171 CO 0.25 -0.54 0.92 0.34 0.02 0.00 0.00 175.26 176.25 2q80 s ASP 172 N -2.69 7.03 -0.02 -0.19 2.15 -1.26 -4.94 116.67 116.75 2q80 s ASP 172 Ca 0.63 1.28 0.16 0.00 0.43 0.00 0.00 52.55 55.05 2q80 s ASP 172 Cb -0.14 -2.49 -0.25 0.00 -0.30 0.00 0.00 42.92 39.74 2q80 s ASP 172 CO 0.31 -0.49 0.36 0.18 -0.17 0.00 0.00 175.17 175.36 2q80 n LEU 173 N 5.57 0.01 -0.18 -1.34 4.77 -1.26 -4.69 117.00 119.88 2q80 n LEU 173 Ca 0.07 -0.01 0.14 0.00 -0.03 0.00 0.00 56.01 56.18 2q80 n LEU 173 Cb 0.48 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 42.04 2q80 n LEU 173 CO 0.50 0.00 1.21 0.50 -1.33 0.00 0.00 177.39 178.27 2q80 h LYS 174 N 0.00 0.48 -0.86 3.23 3.64 -1.99 0.11 116.57 121.18 2q80 h LYS 174 Ca 0.00 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2q80 h LYS 174 Cb 0.74 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.41 2q80 h LYS 174 CO 0.00 0.31 0.56 -1.35 -2.27 0.00 0.00 179.45 176.70 2q80 h PRO 175 N 0.49 1.13 -0.03 1.90 0.11 -2.00 -0.26 132.00 133.34 2q80 h PRO 175 Ca 0.37 -0.07 -0.19 0.00 0.11 0.00 0.00 66.00 66.22 2q80 h PRO 175 Cb 0.76 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2q80 h PRO 175 CO -0.13 0.76 -0.81 1.25 -0.21 0.00 0.00 178.00 178.86 2q80 h LEU 176 N 1.16 0.37 -0.54 2.35 5.85 -1.13 -2.28 115.31 121.09 2q80 h LEU 176 Ca 0.31 -0.27 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 2q80 h LEU 176 Cb -0.12 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 2q80 h LEU 176 CO -0.07 1.03 0.08 -0.07 -0.34 0.00 0.00 178.44 179.07 2q80 h LEU 177 N 0.19 0.87 -0.64 2.25 3.38 -1.17 -2.07 115.31 118.11 2q80 h LEU 177 Ca -0.04 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 2q80 h LEU 177 Cb 1.41 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 2q80 h LEU 177 CO 0.13 0.91 0.26 0.78 0.09 0.00 0.00 178.44 180.62 2q80 h ASN 178 N 0.78 0.88 -0.13 -0.43 4.21 -0.97 0.29 115.58 120.21 2q80 h ASN 178 Ca 0.16 -0.17 0.00 0.00 1.21 0.00 0.00 56.30 57.50 2q80 h ASN 178 Cb 0.42 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.39 2q80 h ASN 178 CO 0.01 0.81 0.08 0.74 -1.29 0.00 0.00 177.43 177.78 2q80 h THR 179 N 0.90 1.05 -0.46 2.81 2.02 -1.26 -2.61 112.91 115.36 2q80 h THR 179 Ca 0.21 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.29 2q80 h THR 179 Cb 0.20 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2q80 h THR 179 CO -0.02 0.05 0.30 -0.07 0.37 0.00 0.00 175.52 176.15 2q80 h LEU 180 N 0.16 0.52 -0.23 2.58 3.38 -1.06 -0.67 115.31 120.00 2q80 h LEU 180 Ca 0.05 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.06 2q80 h LEU 180 Cb 0.00 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 2q80 h LEU 180 CO -0.01 0.37 -0.20 1.23 0.09 0.00 0.00 178.44 179.92 2q80 h GLY 181 N 0.61 -0.10 0.71 0.83 0.00 -0.18 0.34 103.07 105.29 2q80 h GLY 181 Ca 0.17 0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.79 2q80 h GLY 181 CO -0.04 -0.18 0.05 1.41 0.00 0.00 0.00 176.54 177.77 2q80 h LEU 182 N -0.21 0.01 -0.20 3.11 3.38 -1.41 -2.17 115.31 117.83 2q80 h LEU 182 Ca 0.13 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.19 2q80 h LEU 182 Cb 0.41 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 2q80 h LEU 182 CO -0.35 0.04 -0.09 0.15 0.09 0.00 0.00 178.44 178.28 2q80 h PHE 183 N 0.15 -0.20 -0.79 1.13 3.57 -0.13 0.59 116.94 121.25 2q80 h PHE 183 Ca 0.12 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.65 2q80 h PHE 183 Cb 0.12 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 2q80 h PHE 183 CO -0.16 -0.14 0.52 0.74 -2.23 0.00 0.00 178.31 177.05 2q80 h PHE 184 N -0.06 0.99 -0.02 0.41 0.04 -0.24 -1.31 116.94 116.74 2q80 h PHE 184 Ca 0.11 0.02 -0.25 0.00 2.80 0.00 0.00 57.97 60.65 2q80 h PHE 184 Cb 0.22 -0.33 0.02 0.00 2.20 0.00 0.00 35.95 38.05 2q80 h PHE 184 CO -0.25 0.62 -0.97 0.37 -0.60 0.00 0.00 178.31 177.48 2q80 h GLN 185 N 1.07 0.70 -0.10 1.51 5.75 -1.02 -2.48 115.11 120.54 2q80 h GLN 185 Ca 0.29 -0.72 -0.22 0.00 -0.15 0.00 0.00 58.65 57.85 2q80 h GLN 185 Cb -0.11 0.20 0.01 0.00 1.07 0.00 0.00 27.48 28.64 2q80 h GLN 185 CO -0.07 1.30 -0.83 0.82 -2.65 0.00 0.00 178.83 177.41 2q80 h ILE 186 N 0.38 1.30 -0.77 2.39 2.04 -0.83 0.29 117.51 122.32 2q80 h ILE 186 Ca -0.11 -2.08 0.12 0.00 1.00 0.00 0.00 64.86 63.78 2q80 h ILE 186 Cb 1.63 2.10 -0.05 0.00 -0.74 0.00 0.00 36.82 39.76 2q80 h ILE 186 CO 0.19 0.65 0.51 -0.09 0.00 0.00 0.00 178.15 179.41 2q80 h ARG 187 N 0.45 0.59 0.19 2.37 2.43 -1.31 -1.17 114.38 117.93 2q80 h ARG 187 Ca -0.06 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 2q80 h ARG 187 Cb 1.45 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 2q80 h ARG 187 CO 0.16 0.39 -0.09 0.22 -1.51 0.00 0.00 179.97 179.14 2q80 h ASP 188 N 0.60 -0.22 -0.70 -3.80 -0.00 -0.91 -2.56 116.42 108.83 2q80 h ASP 188 Ca 0.37 -0.23 0.15 0.00 -0.00 0.00 0.00 57.03 57.31 2q80 h ASP 188 Cb 0.59 0.06 -0.04 0.00 -0.00 0.00 0.00 39.33 39.94 2q80 h ASP 188 CO -0.14 0.13 0.48 0.44 -0.00 0.00 0.00 179.24 180.16 2q80 h ASP 189 N -0.60 0.28 0.00 2.28 3.32 -0.31 -0.49 116.42 120.90 2q80 h ASP 189 Ca -0.03 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 2q80 h ASP 189 Cb 0.44 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.96 2q80 h ASP 189 CO 0.04 0.15 -0.35 0.22 -1.72 0.00 0.00 179.24 177.58 2q80 h TYR 190 N 0.30 0.35 0.56 4.55 3.20 -1.26 -3.18 116.97 121.49 2q80 h TYR 190 Ca 0.34 -0.19 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2q80 h TYR 190 Cb 0.92 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.14 2q80 h TYR 190 CO -0.00 1.00 -0.34 0.00 -1.64 0.00 0.00 178.16 177.19 2q80 h ALA 191 N 0.26 -0.86 -0.96 1.82 0.00 -0.97 0.22 119.26 118.78 2q80 h ALA 191 Ca -0.04 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 54.99 2q80 h ALA 191 Cb 1.10 0.41 -0.16 0.00 0.00 0.00 0.00 17.79 19.14 2q80 h ALA 191 CO 0.07 -1.00 0.27 -0.97 0.00 0.00 0.00 179.25 177.62 2q80 h ASN 192 N -0.85 -0.03 0.11 0.00 -0.73 -1.22 -1.48 115.58 111.39 2q80 h ASN 192 Ca -0.07 0.24 0.00 0.00 1.87 0.00 0.00 56.30 58.34 2q80 h ASN 192 Cb 0.69 0.33 0.00 0.00 0.27 0.00 0.00 38.32 39.60 2q80 h ASN 192 CO 0.07 -0.28 -1.44 0.18 -0.37 0.00 0.00 177.43 175.59 2q80 n LEU 193 N -5.30 0.48 -0.00 0.34 4.77 -1.05 -3.53 117.00 112.72 2q80 n LEU 193 Ca 0.27 -0.16 0.05 0.00 -0.03 0.00 0.00 56.01 56.14 2q80 n LEU 193 Cb 0.88 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.88 2q80 n LEU 193 CO 0.01 0.09 -0.12 1.57 -1.33 0.00 0.00 177.39 177.60 2q80 n HIS 194 N -1.96 0.00 0.00 -1.77 -0.00 0.75 -4.93 115.22 107.32 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 0.46 -0.04 0.00 0.00 -0.12 0.00 0.00 29.99 30.29 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 -1.36 0.00 -1.56 0.26 3.41 -0.89 -5.03 113.62 108.44 2q80 n SER 195 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2q80 n SER 195 Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 2q80 n SER 195 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2q80 n LYS 202 N 0.00 -3.60 -0.41 4.33 4.01 -1.26 -5.02 118.16 116.21 2q80 n LYS 202 Ca 0.00 2.68 -0.07 0.00 -0.51 0.00 0.00 58.31 60.41 2q80 n LYS 202 Cb 0.00 -3.15 0.05 0.00 -0.51 0.00 0.00 35.03 31.42 2q80 n LYS 202 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2q80 n SER 203 N -0.78 -0.25 -4.62 4.39 3.41 -1.26 -4.88 113.62 109.62 2q80 n SER 203 Ca 0.00 -1.01 -0.43 0.00 -0.26 0.00 0.00 58.87 57.17 2q80 n SER 203 Cb 0.00 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 2q80 n SER 203 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2q80 s PHE 204 N -1.64 1.75 -1.35 7.33 5.36 -1.26 -3.48 117.98 124.68 2q80 s PHE 204 Ca 0.18 0.41 -0.02 0.00 -0.96 0.00 0.00 56.93 56.54 2q80 s PHE 204 Cb -0.01 -4.03 -0.00 0.00 -0.34 0.00 0.00 43.02 38.64 2q80 s PHE 204 CO 0.13 -3.55 0.54 0.00 -1.46 0.00 0.00 175.22 170.88 2q80 h GLU 206 N -1.85 0.08 -0.93 0.00 5.08 -1.77 -1.68 114.58 113.52 2q80 h GLU 206 Ca -0.63 -0.00 0.12 0.00 -1.00 0.00 0.00 59.36 57.85 2q80 h GLU 206 Cb 1.37 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.53 2q80 h GLU 206 CO 0.59 0.05 0.59 -0.44 -1.00 0.00 0.00 179.01 178.81 2q80 h ASP 207 N 0.08 0.79 -0.48 1.42 5.19 -1.87 -0.68 116.42 120.87 2q80 h ASP 207 Ca 0.06 0.04 -0.13 0.00 -0.62 0.00 0.00 57.03 56.37 2q80 h ASP 207 Cb 0.15 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.52 2q80 h ASP 207 CO -0.01 0.43 -0.21 -0.07 -3.12 0.00 0.00 179.24 176.26 2q80 h LEU 208 N 0.86 1.02 -0.76 1.55 3.38 -1.61 -2.45 115.31 117.31 2q80 h LEU 208 Ca 0.45 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2q80 h LEU 208 Cb 0.54 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2q80 h LEU 208 CO -0.21 1.19 0.40 0.74 0.09 0.00 0.00 178.44 180.65 2q80 h THR 209 N 0.86 1.23 -0.98 0.22 2.02 -1.21 -2.64 112.91 112.41 2q80 h THR 209 Ca 0.11 -0.60 0.07 0.00 0.77 0.00 0.00 66.41 66.75 2q80 h THR 209 Cb 0.80 0.25 -0.07 0.00 -1.74 0.00 0.00 68.15 67.39 2q80 h THR 209 CO 0.07 0.26 0.63 -0.08 0.37 0.00 0.00 175.52 176.78 2q80 h GLU 210 N 1.05 1.11 0.00 6.66 4.81 -1.09 -3.38 114.58 123.73 2q80 h GLU 210 Ca 0.26 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2q80 h GLU 210 Cb 0.06 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.19 2q80 h GLU 210 CO -0.04 0.73 0.00 0.41 -0.73 0.00 0.00 179.01 179.38 2q80 n GLY 211 N -1.37 0.77 3.81 1.92 0.00 -0.94 -4.95 105.19 104.44 2q80 n GLY 211 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.80 3.60 -0.47 1.61 -2.85 -1.12 -4.80 119.74 114.90 2q80 s LYS 212 Ca 0.00 1.16 -0.22 0.00 -1.00 0.00 0.00 55.97 55.92 2q80 s LYS 212 Cb 0.00 -2.07 0.03 0.00 -2.06 0.00 0.00 37.83 33.73 2q80 s LYS 212 CO 0.00 -0.58 0.73 -0.06 0.10 0.00 0.00 175.35 175.54 2q80 s PHE 213 N -2.41 2.99 0.30 1.78 0.08 -1.26 -4.81 117.98 114.66 2q80 s PHE 213 Ca 0.63 -0.08 0.10 0.00 0.12 0.00 0.00 56.93 57.69 2q80 s PHE 213 Cb -0.14 -3.60 -0.05 0.00 -0.57 0.00 0.00 43.02 38.66 2q80 s PHE 213 CO 0.32 -1.02 -0.01 -1.54 -0.10 0.00 0.00 175.22 172.87 2q80 s SER 214 N 2.31 4.29 0.24 1.36 1.04 -1.26 -4.92 113.70 116.77 2q80 s SER 214 Ca 0.24 -0.84 -0.12 0.00 0.48 0.00 0.00 55.95 55.72 2q80 s SER 214 Cb -0.14 -0.64 0.32 0.00 0.10 0.00 0.00 66.02 65.66 2q80 s SER 214 CO 0.19 -0.11 1.58 0.15 0.98 0.00 0.00 173.24 176.03 2q80 h PHE 215 N 1.88 -0.58 -0.22 5.02 3.57 -1.93 -1.06 116.94 123.62 2q80 h PHE 215 Ca -0.43 0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.14 2q80 h PHE 215 Cb 1.25 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 40.36 2q80 h PHE 215 CO 0.70 -0.37 0.09 -1.35 -2.23 0.00 0.00 178.31 175.15 2q80 h PRO 216 N -0.02 0.33 -0.60 6.41 0.11 -1.88 -1.85 132.00 134.50 2q80 h PRO 216 Ca 0.38 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.37 2q80 h PRO 216 Cb 0.61 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.64 2q80 h PRO 216 CO -0.86 0.38 0.15 1.79 -0.21 0.00 0.00 178.00 179.25 2q80 h THR 217 N 0.21 1.24 -0.15 -1.15 1.35 -1.69 -0.91 112.91 111.79 2q80 h THR 217 Ca 0.07 -0.86 0.02 0.00 -0.55 0.00 0.00 66.41 65.09 2q80 h THR 217 Cb 0.17 0.62 -0.02 0.00 -1.73 0.00 0.00 68.15 67.19 2q80 h THR 217 CO -0.01 0.33 0.03 0.40 -0.25 0.00 0.00 175.52 176.02 2q80 h ILE 218 N 0.89 0.94 -0.15 6.82 2.04 -1.06 0.22 117.51 127.21 2q80 h ILE 218 Ca 0.19 -0.03 0.04 0.00 1.00 0.00 0.00 64.86 66.06 2q80 h ILE 218 Cb 0.31 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.18 2q80 h ILE 218 CO -0.00 0.02 -0.15 -0.74 0.00 0.00 0.00 178.15 177.28 2q80 h HIS 219 N 0.10 -0.38 -0.84 1.37 2.76 -0.97 -2.07 115.15 115.13 2q80 h HIS 219 Ca 0.07 0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.38 2q80 h HIS 219 Cb 0.06 0.19 -0.08 0.00 1.55 0.00 0.00 27.41 29.12 2q80 h HIS 219 CO -0.13 -0.22 0.45 0.00 -1.30 0.00 0.00 177.93 176.74 2q80 h ALA 220 N 0.90 1.23 0.35 5.26 0.00 -0.53 0.31 119.26 126.78 2q80 h ALA 220 Ca 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2q80 h ALA 220 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2q80 h ALA 220 CO -0.25 -0.01 -0.17 0.82 0.00 0.00 0.00 179.25 179.64 2q80 h ILE 221 N 0.70 0.66 0.00 0.00 2.04 -0.04 -2.97 117.51 117.90 2q80 h ILE 221 Ca 0.43 -0.10 -0.15 0.00 1.00 0.00 0.00 64.86 66.04 2q80 h ILE 221 Cb 0.52 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 2q80 h ILE 221 CO -0.31 0.02 -0.73 -0.50 0.00 0.00 0.00 178.15 176.63 2q80 h TRP 222 N -0.52 0.00 0.00 1.37 4.06 -1.05 -3.19 115.95 116.62 2q80 h TRP 222 Ca -0.05 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.89 2q80 h TRP 222 Cb 0.39 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.55 2q80 h TRP 222 CO -0.04 0.73 -0.08 1.03 -3.56 0.00 0.00 178.44 176.53 2q80 h SER 223 N 0.00 0.00 -1.74 -3.49 0.87 -0.36 -3.34 113.55 105.48 2q80 h SER 223 Ca -0.01 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.05 2q80 h SER 223 Cb 1.31 0.00 -0.34 0.00 -0.44 0.00 0.00 62.40 62.93 2q80 h SER 223 CO 0.10 0.08 -0.97 -1.14 -0.53 0.00 0.00 176.83 174.37 2q80 n ARG 224 N -3.51 0.60 0.25 2.24 0.63 -1.13 -5.00 116.66 110.75 2q80 n ARG 224 Ca -0.02 -2.94 0.12 0.00 -0.92 0.00 0.00 57.85 54.09 2q80 n ARG 224 Cb 0.21 -1.35 0.65 0.00 0.45 0.00 0.00 32.46 32.41 2q80 n ARG 224 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2q80 h PRO 225 N 4.38 0.00 -0.16 -0.14 0.13 -1.70 -2.10 132.00 132.41 2q80 h PRO 225 Ca 0.08 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.25 2q80 h PRO 225 Cb 0.92 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 2q80 h PRO 225 CO 0.40 0.16 0.15 1.05 -0.23 0.00 0.00 178.00 179.53 2q80 h GLU 226 N 0.00 0.00 -5.99 0.86 9.09 -1.94 -3.42 114.58 113.18 2q80 h GLU 226 Ca -0.00 0.00 -0.61 0.00 0.05 0.00 0.00 59.36 58.80 2q80 h GLU 226 Cb 0.45 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.50 2q80 h GLU 226 CO 0.02 0.00 -0.21 0.45 0.05 0.00 0.00 179.01 179.32 2q80 s SER 227 N -6.18 6.79 -0.17 3.06 0.15 -0.79 -4.98 113.70 111.59 2q80 s SER 227 Ca -0.05 0.94 0.14 0.00 0.70 0.00 0.00 55.95 57.69 2q80 s SER 227 Cb 0.16 -2.25 0.37 0.00 -1.71 0.00 0.00 66.02 62.59 2q80 s SER 227 CO 0.60 0.31 1.19 0.35 1.20 0.00 0.00 173.24 176.89 2q80 n THR 228 N 1.91 1.95 -0.00 6.45 -2.24 -1.26 -4.84 114.28 116.24 2q80 n THR 228 Ca -0.14 -2.75 -0.17 0.00 -2.27 0.00 0.00 64.05 58.72 2q80 n THR 228 Cb 0.52 -0.17 -0.14 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.65 0.19 -0.33 -0.78 4.15 -1.93 -1.00 115.11 116.06 2q80 h GLN 229 Ca -0.01 -0.30 -0.03 0.00 0.77 0.00 0.00 58.65 59.08 2q80 h GLN 229 Cb 1.05 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.83 2q80 h GLN 229 CO 0.00 1.12 0.06 0.28 -1.93 0.00 0.00 178.83 178.37 2q80 h VAL 230 N -0.59 1.17 -0.15 2.39 2.07 -1.96 -0.14 116.25 119.03 2q80 h VAL 230 Ca -0.08 -0.60 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 2q80 h VAL 230 Cb 1.34 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2q80 h VAL 230 CO 0.09 0.21 -0.13 1.56 0.02 0.00 0.00 177.57 179.32 2q80 h GLN 231 N 0.48 0.35 -0.49 1.57 7.50 -1.89 -1.58 115.11 121.06 2q80 h GLN 231 Ca 0.11 -0.18 -0.03 0.00 0.50 0.00 0.00 58.65 59.05 2q80 h GLN 231 Cb 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.73 2q80 h GLN 231 CO -0.00 0.73 0.17 -0.91 -1.50 0.00 0.00 178.83 177.32 2q80 h ASN 232 N -0.01 0.69 0.23 1.46 2.35 -0.94 -0.51 115.58 118.85 2q80 h ASN 232 Ca 0.03 -0.19 0.01 0.00 -0.55 0.00 0.00 56.30 55.60 2q80 h ASN 232 Cb 0.65 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.82 2q80 h ASN 232 CO 0.03 0.69 -0.28 0.40 -1.65 0.00 0.00 177.43 176.62 2q80 h ILE 233 N 0.65 0.40 -0.49 2.81 2.04 -1.03 -2.00 117.51 119.89 2q80 h ILE 233 Ca 0.16 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.11 2q80 h ILE 233 Cb 0.23 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2q80 h ILE 233 CO -0.01 0.00 0.33 -0.07 0.00 0.00 0.00 178.15 178.40 2q80 h LEU 234 N -0.56 0.26 -1.24 1.44 3.38 -1.06 0.13 115.31 117.66 2q80 h LEU 234 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2q80 h LEU 234 Cb 0.54 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2q80 h LEU 234 CO -0.10 0.16 -0.30 -0.09 0.09 0.00 0.00 178.44 178.21 2q80 h ARG 235 N 0.29 0.13 0.00 1.13 2.43 -0.66 -3.04 114.38 114.66 2q80 h ARG 235 Ca 0.22 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2q80 h ARG 235 Cb 0.50 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2q80 h ARG 235 CO -0.05 0.43 -0.03 1.96 -1.51 0.00 0.00 179.97 180.76 2q80 h GLN 236 N 0.12 0.00 -6.67 0.20 1.08 0.01 -3.46 115.11 106.38 2q80 h GLN 236 Ca 0.02 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.68 2q80 h GLN 236 Cb 0.60 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 27.94 2q80 h GLN 236 CO 0.04 0.03 -0.92 0.54 -0.95 0.00 0.00 178.83 177.57 2q80 n ARG 237 N -3.26 -2.23 -3.40 1.46 5.12 -1.15 -4.91 116.66 108.30 2q80 n ARG 237 Ca -0.02 0.30 -0.32 0.00 -1.93 0.00 0.00 57.85 55.88 2q80 n ARG 237 Cb 0.19 -4.08 -0.05 0.00 -1.16 0.00 0.00 32.46 27.36 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 -4.01 4.91 -1.34 0.55 -1.32 -1.26 -4.91 115.64 108.26 2q80 s THR 238 Ca 0.08 0.54 0.22 0.00 -1.21 0.00 0.00 61.69 61.32 2q80 s THR 238 Cb -0.03 -3.63 -0.15 0.00 -1.51 0.00 0.00 72.50 67.17 2q80 s THR 238 CO 0.92 -0.02 0.97 -0.62 -2.21 0.00 0.00 174.62 173.67 2q80 n GLU 239 N 0.02 0.40 -1.57 7.08 1.02 -1.26 -4.08 120.64 122.24 2q80 n GLU 239 Ca -0.00 -0.33 -0.44 0.00 -0.02 0.00 0.00 57.16 56.37 2q80 n GLU 239 Cb 0.52 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.41 2q80 n GLU 239 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2q80 n ASN 240 N -1.02 3.02 -0.16 1.62 2.85 -1.26 -4.87 115.26 115.44 2q80 n ASN 240 Ca 0.06 0.17 0.24 0.00 -0.11 0.00 0.00 54.58 54.95 2q80 n ASN 240 Cb 0.38 -1.52 0.66 0.00 1.24 0.00 0.00 39.78 40.54 2q80 n ASN 240 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 2q80 h ILE 241 N 7.20 0.62 -0.00 -1.44 5.03 -1.98 -2.07 117.51 124.87 2q80 h ILE 241 Ca -0.38 -0.04 -0.20 0.00 -0.12 0.00 0.00 64.86 64.12 2q80 h ILE 241 Cb 1.25 0.50 -0.01 0.00 -3.03 0.00 0.00 36.82 35.54 2q80 h ILE 241 CO 0.98 0.02 -0.88 0.44 -0.68 0.00 0.00 178.15 178.04 2q80 h ASP 242 N 0.11 0.32 -0.02 1.72 3.32 -1.99 -0.08 116.42 119.81 2q80 h ASP 242 Ca 0.40 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 2q80 h ASP 242 Cb 1.42 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.88 2q80 h ASP 242 CO -0.05 1.05 -0.03 0.40 -1.72 0.00 0.00 179.24 178.89 2q80 h ILE 243 N 0.14 1.45 -0.25 0.35 2.04 -1.79 -1.68 117.51 117.77 2q80 h ILE 243 Ca -0.05 -1.36 0.06 0.00 1.00 0.00 0.00 64.86 64.51 2q80 h ILE 243 Cb 1.50 2.33 -0.08 0.00 -0.74 0.00 0.00 36.82 39.83 2q80 h ILE 243 CO 0.14 0.36 -0.39 0.11 0.00 0.00 0.00 178.15 178.37 2q80 h LYS 244 N -0.50 -0.38 -0.58 2.37 1.57 -1.44 -0.72 116.57 116.90 2q80 h LYS 244 Ca 0.00 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.92 2q80 h LYS 244 Cb 0.60 0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.91 2q80 h LYS 244 CO 0.01 -0.25 0.06 0.87 -0.57 0.00 0.00 179.45 179.56 2q80 h LYS 245 N -0.39 0.17 -0.10 3.15 1.57 -0.99 -0.08 116.57 119.90 2q80 h LYS 245 Ca 0.11 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 2q80 h LYS 245 Cb 0.59 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.80 2q80 h LYS 245 CO -0.47 0.11 -0.30 -0.92 -0.57 0.00 0.00 179.45 177.31 2q80 h TYR 246 N 0.17 -0.81 -0.10 -1.35 3.20 -0.68 -1.50 116.97 115.90 2q80 h TYR 246 Ca 0.30 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.25 2q80 h TYR 246 Cb 0.47 0.37 -0.05 0.00 1.54 0.00 0.00 36.73 39.06 2q80 h TYR 246 CO -0.30 -0.38 -0.23 0.00 -1.64 0.00 0.00 178.16 175.61 2q80 h VAL 248 N -0.31 0.79 -0.85 0.00 2.07 -0.79 0.16 116.25 117.31 2q80 h VAL 248 Ca 0.09 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2q80 h VAL 248 Cb 0.44 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 2q80 h VAL 248 CO -0.28 0.13 0.47 0.45 0.02 0.00 0.00 177.57 178.36 2q80 h HIS 249 N 0.69 1.16 -0.59 1.57 -0.00 -0.73 -1.91 115.15 115.34 2q80 h HIS 249 Ca 0.45 -0.02 -0.08 0.00 -0.00 0.00 0.00 60.37 60.71 2q80 h HIS 249 Cb 0.56 -0.37 -0.02 0.00 -0.00 0.00 0.00 27.41 27.58 2q80 h HIS 249 CO -0.08 0.80 0.05 -0.92 -0.00 0.00 0.00 177.93 177.78 2q80 h TYR 250 N 1.19 1.05 -0.33 2.45 3.20 0.51 -0.81 116.97 124.24 2q80 h TYR 250 Ca 0.30 -0.15 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2q80 h TYR 250 Cb 0.02 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 2q80 h TYR 250 CO 0.01 0.92 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.35 2q80 h LEU 251 N 0.92 0.59 -1.33 2.82 3.38 -0.69 -1.80 115.31 119.20 2q80 h LEU 251 Ca 0.18 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2q80 h LEU 251 Cb 0.47 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 2q80 h LEU 251 CO 0.02 0.77 0.47 -0.08 0.09 0.00 0.00 178.44 179.71 2q80 h GLU 252 N 0.39 0.87 -0.09 1.13 4.57 -1.12 -1.02 114.58 119.31 2q80 h GLU 252 Ca 0.09 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.08 2q80 h GLU 252 Cb 0.48 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 2q80 h GLU 252 CO 0.02 0.58 -0.57 -0.44 -1.18 0.00 0.00 179.01 177.42 2q80 h ASP 253 N 0.90 0.33 1.04 1.04 3.32 -0.69 -2.77 116.42 119.58 2q80 h ASP 253 Ca 0.27 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2q80 h ASP 253 Cb -0.00 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2q80 h ASP 253 CO -0.07 0.83 -0.08 0.52 -1.72 0.00 0.00 179.24 178.72 2q80 n VAL 254 N -3.91 0.13 -0.61 -1.35 0.31 -0.72 -4.93 118.33 107.25 2q80 n VAL 254 Ca -0.02 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2q80 n VAL 254 Cb 0.59 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 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 1.46 0.63 0.16 2.92 0.00 -0.73 -4.97 105.19 104.65 2q80 n GLY 255 Ca 0.06 -0.60 -0.03 0.00 0.00 0.00 0.00 46.02 45.45 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 0.15 -0.10 1.61 0.02 -1.46 0.63 113.55 114.40 2q80 h SER 256 Ca 0.00 -0.08 -0.22 0.00 -0.84 0.00 0.00 61.79 60.64 2q80 h SER 256 Cb 0.00 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.51 2q80 h SER 256 CO 0.00 0.69 -0.81 -0.26 -1.14 0.00 0.00 176.83 175.32 2q80 h PHE 257 N 0.10 1.01 -0.18 3.45 0.04 -1.89 -0.87 116.94 118.60 2q80 h PHE 257 Ca -0.00 -0.48 0.04 0.00 2.80 0.00 0.00 57.97 60.33 2q80 h PHE 257 Cb 1.05 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 39.01 2q80 h PHE 257 CO 0.01 1.31 -0.07 1.49 -0.60 0.00 0.00 178.31 180.45 2q80 h GLU 258 N 0.43 -0.04 -0.47 1.51 4.57 -1.90 -0.14 114.58 118.54 2q80 h GLU 258 Ca -0.07 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.15 2q80 h GLU 258 Cb 1.45 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 30.01 2q80 h GLU 258 CO 0.16 -0.03 0.24 -0.92 -1.18 0.00 0.00 179.01 177.29 2q80 h TYR 259 N -0.04 0.45 -0.76 0.92 3.20 -0.76 -0.37 116.97 119.61 2q80 h TYR 259 Ca 0.10 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 2q80 h TYR 259 Cb 0.18 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2q80 h TYR 259 CO -0.23 0.23 0.25 1.15 -1.64 0.00 0.00 178.16 177.93 2q80 h THR 260 N 0.48 1.26 -0.68 1.81 2.02 -0.99 -2.33 112.91 114.48 2q80 h THR 260 Ca 0.20 -0.89 0.01 0.00 0.77 0.00 0.00 66.41 66.50 2q80 h THR 260 Cb 0.10 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 2q80 h THR 260 CO -0.14 0.35 0.45 0.03 0.37 0.00 0.00 175.52 176.58 2q80 h ARG 261 N 1.12 0.88 -0.08 6.66 3.08 0.38 -0.37 114.38 126.05 2q80 h ARG 261 Ca 0.25 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 60.13 2q80 h ARG 261 Cb 0.29 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2q80 h ARG 261 CO -0.01 0.58 -0.47 -0.91 -1.07 0.00 0.00 179.97 178.10 2q80 h ASN 262 N 0.91 0.20 -0.10 7.04 2.35 -0.95 -0.63 115.58 124.40 2q80 h ASN 262 Ca 0.25 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2q80 h ASN 262 Cb -0.09 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 2q80 h ASN 262 CO -0.06 0.64 0.02 0.74 -1.65 0.00 0.00 177.43 177.12 2q80 h THR 263 N 0.15 1.21 -0.88 2.81 2.02 -0.87 -0.83 112.91 116.53 2q80 h THR 263 Ca 0.01 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.52 2q80 h THR 263 Cb 0.88 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 68.71 2q80 h THR 263 CO 0.07 0.19 0.49 -0.07 0.37 0.00 0.00 175.52 176.57 2q80 h LEU 264 N -0.06 1.09 -0.62 2.58 3.38 -0.88 0.39 115.31 121.17 2q80 h LEU 264 Ca 0.03 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2q80 h LEU 264 Cb 0.28 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2q80 h LEU 264 CO 0.00 0.87 0.39 0.11 0.09 0.00 0.00 178.44 179.89 2q80 h LYS 265 N 1.23 0.84 -0.48 1.13 1.57 -0.98 0.88 116.57 120.76 2q80 h LYS 265 Ca 0.31 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2q80 h LYS 265 Cb 0.01 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 2q80 h LYS 265 CO -0.05 0.59 0.32 0.93 -0.57 0.00 0.00 179.45 180.67 2q80 h GLU 266 N 0.85 0.63 -0.61 3.15 5.08 -0.39 -2.24 114.58 121.05 2q80 h GLU 266 Ca 0.23 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.49 2q80 h GLU 266 Cb -0.04 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 2q80 h GLU 266 CO -0.04 0.42 0.16 -0.07 -1.00 0.00 0.00 179.01 178.48 2q80 h LEU 267 N 0.65 0.91 -0.26 1.33 3.38 -0.59 -1.42 115.31 119.31 2q80 h LEU 267 Ca 0.18 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.96 2q80 h LEU 267 Cb -0.08 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.40 2q80 h LEU 267 CO -0.04 0.89 0.04 -0.08 0.09 0.00 0.00 178.44 179.34 2q80 h GLU 268 N 0.88 0.13 -0.18 1.13 4.81 -0.68 -0.96 114.58 119.70 2q80 h GLU 268 Ca 0.19 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.30 2q80 h GLU 268 Cb 0.33 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2q80 h GLU 268 CO -0.00 0.08 -0.39 0.00 -0.73 0.00 0.00 179.01 177.97 2q80 h ALA 269 N 1.20 0.99 -0.26 2.92 0.00 -1.24 -2.42 119.26 120.45 2q80 h ALA 269 Ca 0.12 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2q80 h ALA 269 Cb 0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2q80 h ALA 269 CO -0.17 0.61 0.16 -0.22 0.00 0.00 0.00 179.25 179.64 2q80 h LYS 270 N 0.35 0.34 -0.45 0.00 3.64 -1.07 -2.53 116.57 116.84 2q80 h LYS 270 Ca 0.03 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.48 2q80 h LYS 270 Cb 0.84 -0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 32.49 2q80 h LYS 270 CO 0.07 0.24 -0.20 0.00 -2.27 0.00 0.00 179.45 177.29 2q80 h ALA 271 N 1.08 0.13 -0.85 5.00 0.00 -0.72 0.89 119.26 124.80 2q80 h ALA 271 Ca 0.09 0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.18 2q80 h ALA 271 Cb -0.02 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2q80 h ALA 271 CO -0.02 -0.55 0.56 1.88 0.00 0.00 0.00 179.25 181.12 2q80 h TYR 272 N -0.11 1.05 0.29 0.00 0.05 -1.26 0.47 116.97 117.46 2q80 h TYR 272 Ca 0.22 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.01 2q80 h TYR 272 Cb 0.44 -0.35 -0.00 0.00 1.01 0.00 0.00 36.73 37.83 2q80 h TYR 272 CO -0.47 0.65 -0.18 -0.22 -1.05 0.00 0.00 178.16 176.89 2q80 h LYS 273 N 1.12 -0.43 -0.96 4.88 3.64 -0.93 -0.88 116.57 123.01 2q80 h LYS 273 Ca 0.32 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.78 2q80 h LYS 273 Cb -0.09 0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.77 2q80 h LYS 273 CO -0.08 -0.29 0.62 1.96 -2.27 0.00 0.00 179.45 179.39 2q80 h GLN 274 N -0.45 1.12 -0.40 1.90 4.20 -0.14 0.23 115.11 121.57 2q80 h GLN 274 Ca -0.03 -0.07 -0.12 0.00 0.06 0.00 0.00 58.65 58.50 2q80 h GLN 274 Cb 0.37 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2q80 h GLN 274 CO 0.03 0.74 -0.23 0.82 -0.67 0.00 0.00 178.83 179.53 2q80 h ILE 275 N 1.16 1.27 -0.24 2.54 2.04 -0.85 -2.55 117.51 120.89 2q80 h ILE 275 Ca 0.40 -1.35 -0.17 0.00 1.00 0.00 0.00 64.86 64.74 2q80 h ILE 275 Cb 0.10 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2q80 h ILE 275 CO -0.15 0.45 -0.55 -0.78 0.00 0.00 0.00 178.15 177.12 2q80 h ASP 276 N 0.69 0.80 -0.94 1.72 3.58 -0.23 0.39 116.42 122.43 2q80 h ASP 276 Ca 0.09 -0.43 0.23 0.00 0.42 0.00 0.00 57.03 57.35 2q80 h ASP 276 Cb 0.75 -0.23 -0.13 0.00 1.72 0.00 0.00 39.33 41.44 2q80 h ASP 276 CO 0.06 1.19 0.48 0.00 -2.88 0.00 0.00 179.24 178.08 2q80 h ALA 277 N 0.83 1.59 -0.13 -0.78 0.00 -0.42 -1.30 119.26 119.05 2q80 h ALA 277 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2q80 h ALA 277 Cb 1.13 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2q80 h ALA 277 CO 0.11 -0.32 0.00 0.54 0.00 0.00 0.00 179.25 179.58 2q80 n ARG 278 N -4.98 1.51 0.00 0.00 5.12 -0.97 -4.87 116.66 112.46 2q80 n ARG 278 Ca 0.24 -0.77 0.00 0.00 -1.93 0.00 0.00 57.85 55.39 2q80 n ARG 278 Cb 0.70 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.65 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 1.01 0.81 0.00 -0.13 0.00 -0.49 -5.00 105.19 101.40 2q80 n GLY 279 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.41 -1.74 2.87 -0.02 0.00 0.13 -4.95 105.19 100.08 2q80 n GLY 280 Ca 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.49 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 -3.62 -0.73 0.19 1.61 3.84 -1.26 -4.94 114.94 110.03 2q80 s ASN 281 Ca 0.00 -0.48 -0.12 0.00 0.21 0.00 0.00 52.86 52.46 2q80 s ASN 281 Cb 0.00 0.93 0.19 0.00 -0.55 0.00 0.00 41.25 41.83 2q80 s ASN 281 CO 0.00 -0.07 1.74 -0.65 -2.79 0.00 0.00 177.10 175.33 2q80 h PRO 282 N 5.60 0.34 -0.83 0.43 0.11 -1.97 -0.32 132.00 135.35 2q80 h PRO 282 Ca -0.00 -0.02 0.13 0.00 0.11 0.00 0.00 66.00 66.22 2q80 h PRO 282 Cb 1.20 -0.08 -0.09 0.00 0.11 0.00 0.00 31.00 32.14 2q80 h PRO 282 CO -0.03 0.22 0.43 0.93 -0.21 0.00 0.00 178.00 179.35 2q80 h GLU 283 N 0.35 0.62 0.07 1.05 5.08 -1.97 0.22 114.58 120.00 2q80 h GLU 283 Ca 0.25 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 58.30 2q80 h GLU 283 Cb 0.29 -0.14 0.02 0.00 0.50 0.00 0.00 28.75 29.42 2q80 h GLU 283 CO -0.27 0.41 -1.13 1.25 -1.00 0.00 0.00 179.01 178.27 2q80 h LEU 284 N 0.64 0.79 -0.26 1.33 5.85 -1.63 -2.17 115.31 119.87 2q80 h LEU 284 Ca 0.44 -0.69 0.05 0.00 0.84 0.00 0.00 57.88 58.52 2q80 h LEU 284 Cb 0.59 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2q80 h LEU 284 CO -0.34 1.50 -0.08 0.58 -0.34 0.00 0.00 178.44 179.76 2q80 h VAL 285 N 0.29 0.70 -0.86 1.05 2.07 -0.56 -0.51 116.25 118.43 2q80 h VAL 285 Ca -0.15 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.41 2q80 h VAL 285 Cb 1.80 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 32.22 2q80 h VAL 285 CO 0.21 0.00 0.56 0.00 0.02 0.00 0.00 177.57 178.37 2q80 h ALA 286 N 1.22 1.47 -0.30 1.67 0.00 -0.55 0.24 119.26 123.01 2q80 h ALA 286 Ca 0.13 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2q80 h ALA 286 Cb 0.22 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2q80 h ALA 286 CO -0.28 0.45 -0.10 1.25 0.00 0.00 0.00 179.25 180.56 2q80 h LEU 287 N 1.07 0.61 -0.29 0.00 5.85 -1.02 -1.33 115.31 120.19 2q80 h LEU 287 Ca 0.34 -0.38 -0.10 0.00 0.84 0.00 0.00 57.88 58.57 2q80 h LEU 287 Cb 0.03 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 2q80 h LEU 287 CO -0.10 0.85 -0.22 0.58 -0.34 0.00 0.00 178.44 179.21 2q80 h VAL 288 N 0.35 1.30 -0.27 1.05 2.07 -0.50 -1.66 116.25 118.60 2q80 h VAL 288 Ca 0.07 -1.37 0.04 0.00 0.82 0.00 0.00 66.70 66.26 2q80 h VAL 288 Cb 0.60 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 2q80 h VAL 288 CO 0.04 0.44 0.03 0.50 0.02 0.00 0.00 177.57 178.59 2q80 h LYS 289 N 0.41 0.12 -0.13 1.57 3.64 -0.52 -0.30 116.57 121.37 2q80 h LYS 289 Ca 0.06 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2q80 h LYS 289 Cb 0.78 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 2q80 h LYS 289 CO 0.06 0.08 -0.08 1.25 -2.27 0.00 0.00 179.45 178.49 2q80 h HIS 290 N 0.12 -0.18 0.00 1.91 2.76 -1.09 -1.17 115.15 117.50 2q80 h HIS 290 Ca 0.13 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 2q80 h HIS 290 Cb 0.14 0.10 -0.00 0.00 1.55 0.00 0.00 27.41 29.20 2q80 h HIS 290 CO -0.18 -0.12 -0.04 -0.07 -1.30 0.00 0.00 177.93 176.22 2q80 h LEU 291 N -0.07 0.00 -0.09 0.26 3.38 -0.87 -1.46 115.31 116.46 2q80 h LEU 291 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2q80 h LEU 291 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2q80 h LEU 291 CO -0.18 0.04 0.00 -1.20 0.09 0.00 0.00 178.44 177.19 2q80 n SER 292 N -3.38 0.71 0.34 -0.43 7.64 -0.16 -3.53 113.62 114.81 2q80 n SER 292 Ca -0.02 0.58 0.22 0.00 1.01 0.00 0.00 58.87 60.66 2q80 n SER 292 Cb 0.17 -0.77 1.18 0.00 -1.01 0.00 0.00 64.21 63.78 2q80 n SER 292 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2q80 h LYS 293 N 0.00 0.00 0.00 1.43 1.57 -1.11 -2.45 116.57 116.01 2q80 h LYS 293 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2q80 h LYS 293 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2q80 h LYS 293 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 2q80 n MET 294 N -3.11 0.89 0.00 3.15 0.00 -1.23 -5.17 117.12 111.64 2q80 n MET 294 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.67 2q80 n MET 294 Cb 0.10 -1.10 0.00 0.00 0.00 0.00 0.00 33.22 32.22 2q80 n MET 294 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 175.97 177.94