#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b8q s LEU 1 N 0.00 4.41 0.28 0.99 0.20 -1.26 -1.32 118.68 121.97 2b8q s LEU 1 Ca 0.00 2.19 0.03 0.00 0.69 0.00 0.00 54.13 57.04 2b8q s LEU 1 Cb 0.00 -3.60 -0.04 0.00 -0.43 0.00 0.00 46.19 42.13 2b8q s LEU 1 CO 0.00 -0.45 0.18 -1.10 -0.29 0.00 0.00 176.35 174.70 2b8q s GLN 2 N 0.33 1.51 -0.04 1.98 -0.21 -0.26 -4.89 119.66 118.07 2b8q s GLN 2 Ca 0.56 -1.85 0.00 0.00 0.02 0.00 0.00 55.36 54.10 2b8q s GLN 2 Cb -0.32 0.15 0.03 0.00 1.00 0.00 0.00 33.01 33.86 2b8q s GLN 2 CO 0.34 -0.49 -0.01 1.03 -2.12 0.00 0.00 175.29 174.04 2b8q s ARG 3 N -3.83 0.56 0.24 2.91 0.52 -1.26 -1.62 118.95 116.48 2b8q s ARG 3 Ca 0.38 0.03 0.08 0.00 -0.52 0.00 0.00 55.73 55.70 2b8q s ARG 3 Cb 0.05 -0.73 -0.05 0.00 0.52 0.00 0.00 34.95 34.74 2b8q s ARG 3 CO 0.19 -0.16 -0.13 -0.08 0.02 0.00 0.00 175.30 175.14 2b8q s THR 4 N 1.24 1.82 -0.12 0.02 -1.32 -0.44 -4.81 115.64 112.03 2b8q s THR 4 Ca -0.06 -2.21 -0.05 0.00 -1.21 0.00 0.00 61.69 58.15 2b8q s THR 4 Cb -0.13 -2.21 -0.04 0.00 -1.51 0.00 0.00 72.50 68.61 2b8q s THR 4 CO -0.02 -0.47 0.06 -0.22 -2.21 0.00 0.00 174.62 171.76 2b8q s LEU 5 N -3.39 3.91 -0.02 9.08 2.96 -1.26 -1.25 118.68 128.71 2b8q s LEU 5 Ca 0.26 0.24 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 2b8q s LEU 5 Cb 0.00 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 2b8q s LEU 5 CO 0.10 0.34 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.63 2b8q s VAL 6 N -0.66 1.20 -0.11 1.68 1.01 0.76 -2.04 120.40 122.25 2b8q s VAL 6 Ca 0.12 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.50 2b8q s VAL 6 Cb -0.12 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.25 2b8q s VAL 6 CO 0.02 0.34 -0.23 -0.76 0.00 0.00 0.00 175.10 174.47 2b8q s LEU 7 N -0.24 2.10 -0.35 3.92 1.43 -0.51 -0.16 118.68 124.87 2b8q s LEU 7 Ca 0.03 -0.56 -0.14 0.00 -1.03 0.00 0.00 54.13 52.43 2b8q s LEU 7 Cb -0.07 -1.42 -0.01 0.00 0.03 0.00 0.00 46.19 44.72 2b8q s LEU 7 CO -0.00 0.14 0.29 -0.63 0.23 0.00 0.00 176.35 176.38 2b8q s ILE 8 N 0.43 5.25 0.60 -0.59 1.01 0.46 -1.03 121.20 127.33 2b8q s ILE 8 Ca -0.17 -0.23 -0.16 0.00 0.00 0.00 0.00 60.65 60.10 2b8q s ILE 8 Cb -0.17 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.48 2b8q s ILE 8 CO 0.07 -0.09 1.06 -0.54 0.00 0.00 0.00 174.94 175.43 2b8q s LYS 9 N 1.80 3.29 0.32 2.79 1.02 0.08 -2.15 119.74 126.89 2b8q s LYS 9 Ca 0.07 1.20 0.07 0.00 0.02 0.00 0.00 55.97 57.34 2b8q s LYS 9 Cb -0.17 -2.03 0.90 0.00 -0.52 0.00 0.00 37.83 36.01 2b8q s LYS 9 CO 0.11 -0.83 1.61 -1.35 -0.92 0.00 0.00 175.35 173.97 2b8q h PRO 10 N 0.39 0.12 0.00 -1.68 0.11 -1.81 0.63 132.00 129.76 2b8q h PRO 10 Ca -0.47 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2b8q h PRO 10 Cb 1.22 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2b8q h PRO 10 CO 0.57 0.08 -0.00 0.38 -0.21 0.00 0.00 178.00 178.82 2b8q h ASP 11 N 0.12 0.00 0.11 -2.05 2.03 -1.92 0.16 116.42 114.88 2b8q h ASP 11 Ca 0.65 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.76 2b8q h ASP 11 Cb 1.46 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.95 2b8q h ASP 11 CO -0.75 0.00 -0.70 0.00 -1.03 0.00 0.00 179.24 176.76 2b8q h ALA 12 N 2.00 0.55 0.00 4.15 0.00 -0.01 -1.61 119.26 124.34 2b8q h ALA 12 Ca -0.00 -0.58 -0.25 0.00 0.00 0.00 0.00 54.91 54.07 2b8q h ALA 12 Cb 0.02 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.77 2b8q h ALA 12 CO 0.00 0.73 -1.01 0.74 0.00 0.00 0.00 179.25 179.71 2b8q h PHE 13 N 0.37 0.90 -0.64 0.00 -1.00 -0.80 0.12 116.94 115.89 2b8q h PHE 13 Ca -0.03 -0.49 0.04 0.00 2.81 0.00 0.00 57.97 60.30 2b8q h PHE 13 Cb 1.28 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 40.69 2b8q h PHE 13 CO 0.05 1.32 0.38 1.49 -1.61 0.00 0.00 178.31 179.95 2b8q h GLU 14 N 0.34 0.72 -0.55 1.51 4.57 -0.85 -2.66 114.58 117.65 2b8q h GLU 14 Ca -0.11 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 2b8q h GLU 14 Cb 1.66 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 30.09 2b8q h GLU 14 CO 0.19 0.47 0.00 0.54 -1.18 0.00 0.00 179.01 179.03 2b8q n ARG 15 N -4.74 2.34 -3.67 1.92 1.74 -0.61 -4.96 116.66 108.67 2b8q n ARG 15 Ca 0.07 -2.07 -0.24 0.00 -0.77 0.00 0.00 57.85 54.84 2b8q n ARG 15 Cb 0.11 -1.46 0.06 0.00 -1.02 0.00 0.00 32.46 30.15 2b8q n ARG 15 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2b8q n SER 16 N 1.20 -3.81 -0.47 0.55 7.64 -0.80 -4.90 113.62 113.02 2b8q n SER 16 Ca 0.19 -0.69 0.04 0.00 1.01 0.00 0.00 58.87 59.43 2b8q n SER 16 Cb 0.50 -4.52 0.12 0.00 -1.01 0.00 0.00 64.21 59.29 2b8q n SER 16 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2b8q n LEU 17 N -4.57 2.70 0.09 -3.43 4.77 0.34 -4.72 117.00 112.18 2b8q n LEU 17 Ca -0.12 -2.03 -0.12 0.00 -0.03 0.00 0.00 56.01 53.71 2b8q n LEU 17 Cb 0.60 -0.18 -0.05 0.00 -2.33 0.00 0.00 43.42 41.46 2b8q n LEU 17 CO 0.68 0.67 0.74 0.58 -1.33 0.00 0.00 177.39 178.73 2b8q h VAL 18 N 1.48 0.59 -0.45 4.08 2.07 -1.90 -0.95 116.25 121.15 2b8q h VAL 18 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2b8q h VAL 18 Cb 0.69 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2b8q h VAL 18 CO 0.01 0.00 -0.15 0.00 0.02 0.00 0.00 177.57 177.44 2b8q h ALA 19 N 0.52 0.87 -0.47 1.67 0.00 -1.93 -1.35 119.26 118.56 2b8q h ALA 19 Ca 0.03 -0.35 0.07 0.00 0.00 0.00 0.00 54.91 54.66 2b8q h ALA 19 Cb 0.36 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 2b8q h ALA 19 CO -0.11 0.64 0.15 1.49 0.00 0.00 0.00 179.25 181.41 2b8q h GLU 20 N 0.77 0.30 -0.17 0.00 4.57 -1.80 0.36 114.58 118.61 2b8q h GLU 20 Ca 0.12 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.23 2b8q h GLU 20 Cb 0.68 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.20 2b8q h GLU 20 CO 0.05 0.20 -0.08 0.82 -1.18 0.00 0.00 179.01 178.82 2b8q h ILE 21 N 0.31 1.31 -0.24 2.32 2.04 -0.90 -2.68 117.51 119.66 2b8q h ILE 21 Ca 0.23 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 2b8q h ILE 21 Cb 0.25 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2b8q h ILE 21 CO -0.25 0.33 -0.05 0.24 0.00 0.00 0.00 178.15 178.42 2b8q h MET 22 N 0.03 0.37 -0.45 2.37 2.86 -0.90 -2.53 114.93 116.68 2b8q h MET 22 Ca 0.04 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 2b8q h MET 22 Cb 0.55 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 2b8q h MET 22 CO 0.02 0.44 -0.04 0.78 1.06 0.00 0.00 176.91 179.17 2b8q h GLY 23 N 0.75 0.82 1.39 8.32 0.00 -0.16 -0.17 103.07 114.02 2b8q h GLY 23 Ca 0.08 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 46.77 2b8q h GLY 23 CO 0.01 0.52 0.02 3.21 0.00 0.00 0.00 176.54 180.30 2b8q h ARG 24 N 0.70 0.75 -0.03 4.80 3.08 -1.11 -0.40 114.38 122.16 2b8q h ARG 24 Ca 0.13 -0.19 -0.13 0.00 0.07 0.00 0.00 59.98 59.87 2b8q h ARG 24 Cb 0.49 -0.09 0.01 0.00 0.08 0.00 0.00 29.97 30.46 2b8q h ARG 24 CO 0.03 0.75 -0.47 0.82 -1.07 0.00 0.00 179.97 180.03 2b8q h ILE 25 N 0.70 1.43 -0.99 2.04 2.04 -1.38 -3.14 117.51 118.23 2b8q h ILE 25 Ca 0.14 -1.94 0.04 0.00 1.00 0.00 0.00 64.86 64.11 2b8q h ILE 25 Cb 0.41 2.50 -0.06 0.00 -0.74 0.00 0.00 36.82 38.93 2b8q h ILE 25 CO 0.01 0.56 0.65 -0.08 0.00 0.00 0.00 178.15 179.29 2b8q h GLU 26 N -0.14 1.20 0.00 2.37 4.81 -0.88 -1.95 114.58 120.00 2b8q h GLU 26 Ca -0.05 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2b8q h GLU 26 Cb 1.16 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 30.27 2b8q h GLU 26 CO 0.09 0.79 0.00 1.63 -0.73 0.00 0.00 179.01 180.80 2b8q n LYS 27 N -4.45 0.22 -0.14 1.92 5.02 -0.18 -1.28 118.16 119.27 2b8q n LYS 27 Ca 0.14 0.41 0.09 0.00 -2.02 0.00 0.00 58.31 56.92 2b8q n LYS 27 Cb 0.11 -1.89 0.28 0.00 -0.02 0.00 0.00 35.03 33.50 2b8q n LYS 27 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2b8q n LYS 28 N -2.29 1.89 -2.60 1.97 3.00 -0.74 -4.93 118.16 114.46 2b8q n LYS 28 Ca 0.02 -1.36 -0.10 0.00 -0.00 0.00 0.00 58.31 56.88 2b8q n LYS 28 Cb 0.26 -1.37 0.02 0.00 0.00 0.00 0.00 35.03 33.94 2b8q n LYS 28 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2b8q n ASN 29 N 0.58 -3.57 -4.88 3.14 4.05 -0.41 -5.06 115.26 109.11 2b8q n ASN 29 Ca 0.15 -0.13 -0.35 0.00 0.45 0.00 0.00 54.58 54.70 2b8q n ASN 29 Cb 0.36 -2.47 -0.06 0.00 1.23 0.00 0.00 39.78 38.84 2b8q n ASN 29 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2b8q s PHE 30 N -2.82 3.56 0.16 1.20 0.40 -1.18 -4.95 117.98 114.36 2b8q s PHE 30 Ca 0.14 0.44 0.04 0.00 -0.60 0.00 0.00 56.93 56.95 2b8q s PHE 30 Cb -0.06 -1.88 -0.04 0.00 0.51 0.00 0.00 43.02 41.55 2b8q s PHE 30 CO 0.17 0.69 0.20 0.15 0.70 0.00 0.00 175.22 177.13 2b8q s LYS 31 N -1.45 3.14 -0.29 0.44 -0.14 -0.81 -4.47 119.74 116.16 2b8q s LYS 31 Ca 0.21 -0.76 -0.21 0.00 -1.36 0.00 0.00 55.97 53.85 2b8q s LYS 31 Cb -0.12 -2.78 -0.01 0.00 -1.68 0.00 0.00 37.83 33.23 2b8q s LYS 31 CO 0.11 0.50 0.67 0.42 -0.76 0.00 0.00 175.35 176.29 2b8q s ILE 32 N -1.76 4.91 -0.11 2.17 1.01 -1.26 -1.06 121.20 125.11 2b8q s ILE 32 Ca 0.33 1.01 0.07 0.00 0.00 0.00 0.00 60.65 62.05 2b8q s ILE 32 Cb -0.10 -4.02 -0.24 0.00 0.01 0.00 0.00 42.46 38.11 2b8q s ILE 32 CO 0.26 -0.13 0.41 0.52 0.00 0.00 0.00 174.94 175.99 2b8q n VAL 33 N 5.38 1.61 -3.49 2.92 0.31 0.18 -4.97 118.33 120.27 2b8q n VAL 33 Ca 0.00 -0.75 -0.11 0.00 -0.01 0.00 0.00 64.34 63.47 2b8q n VAL 33 Cb 0.49 -1.17 -0.03 0.00 -0.91 0.00 0.00 33.84 32.22 2b8q n VAL 33 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2b8q s SER 34 N -6.29 -0.47 -0.27 4.52 1.04 -1.18 -4.99 113.70 106.06 2b8q s SER 34 Ca -0.13 0.16 -0.24 0.00 0.48 0.00 0.00 55.95 56.21 2b8q s SER 34 Cb 0.07 0.46 0.09 0.00 0.10 0.00 0.00 66.02 66.74 2b8q s SER 34 CO 0.79 -0.69 0.80 -0.32 0.98 0.00 0.00 173.24 174.81 2b8q s MET 35 N -2.76 0.74 0.02 4.02 0.00 -1.26 -1.31 119.30 118.75 2b8q s MET 35 Ca 0.01 0.90 0.04 0.00 0.00 0.00 0.00 55.69 56.64 2b8q s MET 35 Cb -0.01 0.35 -0.02 0.00 0.00 0.00 0.00 34.83 35.15 2b8q s MET 35 CO -0.06 -0.09 -0.12 0.15 0.00 0.00 0.00 175.02 174.90 2b8q s LYS 36 N 0.42 0.87 -0.13 4.11 1.02 -0.06 -4.99 119.74 120.98 2b8q s LYS 36 Ca 0.00 -0.60 -0.02 0.00 0.02 0.00 0.00 55.97 55.37 2b8q s LYS 36 Cb -0.05 -0.84 -0.03 0.00 -0.52 0.00 0.00 37.83 36.39 2b8q s LYS 36 CO -0.02 0.22 -0.05 0.12 -0.92 0.00 0.00 175.35 174.70 2b8q s PHE 37 N -0.64 3.00 -0.17 3.18 5.36 -1.26 -1.05 117.98 126.40 2b8q s PHE 37 Ca 0.02 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 55.78 2b8q s PHE 37 Cb -0.06 -1.88 0.04 0.00 -0.34 0.00 0.00 43.02 40.77 2b8q s PHE 37 CO 0.00 0.08 -0.09 -1.58 -1.46 0.00 0.00 175.22 172.17 2b8q s TRP 38 N -0.01 2.04 0.28 10.12 0.52 -0.41 -4.98 118.94 126.49 2b8q s TRP 38 Ca 0.01 -1.26 -0.04 0.00 0.02 0.00 0.00 56.10 54.83 2b8q s TRP 38 Cb -0.13 -1.49 0.37 0.00 -1.15 0.00 0.00 33.47 31.07 2b8q s TRP 38 CO 0.03 -0.66 1.94 0.66 0.02 0.00 0.00 176.95 178.94 2b8q h SER 39 N 8.06 1.02 -1.96 2.95 4.64 -1.90 -1.89 113.55 124.47 2b8q h SER 39 Ca -0.29 -0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 60.92 2b8q h SER 39 Cb 1.11 -0.26 -0.26 0.00 -0.31 0.00 0.00 62.40 62.68 2b8q h SER 39 CO 0.46 0.75 -0.37 -0.75 -0.87 0.00 0.00 176.83 176.05 2b8q s LYS 40 N -5.94 0.40 0.32 4.77 2.20 -1.26 -2.85 119.74 117.37 2b8q s LYS 40 Ca -0.12 0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 56.08 2b8q s LYS 40 Cb 0.18 0.11 -0.10 0.00 -1.51 0.00 0.00 37.83 36.51 2b8q s LYS 40 CO 0.80 -0.46 1.32 0.00 -0.36 0.00 0.00 175.35 176.65 2b8q s ALA 41 N 2.66 3.51 0.14 3.13 0.00 -1.26 -4.94 121.76 125.00 2b8q s ALA 41 Ca 0.07 1.26 -0.31 0.00 0.00 0.00 0.00 51.96 52.98 2b8q s ALA 41 Cb -0.14 -3.49 -0.10 0.00 0.00 0.00 0.00 23.12 19.39 2b8q s ALA 41 CO -0.16 -0.65 1.67 -2.14 0.00 0.00 0.00 175.76 174.48 2b8q s PRO 42 N -1.55 4.18 0.47 0.00 0.02 -1.26 -4.86 135.00 132.01 2b8q s PRO 42 Ca 0.50 2.44 0.24 0.00 0.02 0.00 0.00 61.00 64.21 2b8q s PRO 42 Cb -0.40 -3.34 1.27 0.00 0.02 0.00 0.00 34.50 32.06 2b8q s PRO 42 CO 0.51 -0.71 1.86 -0.09 -0.33 0.00 0.00 177.00 178.24 2b8q h ARG 43 N 7.53 0.21 0.37 5.54 2.43 -1.98 -1.73 114.38 126.74 2b8q h ARG 43 Ca -0.43 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 2b8q h ARG 43 Cb 1.21 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.68 2b8q h ARG 43 CO 0.93 0.14 -0.51 -0.97 -1.51 0.00 0.00 179.97 178.05 2b8q h ASN 44 N 0.21 -1.45 -0.77 -3.80 -0.00 -2.00 -1.30 115.58 106.47 2b8q h ASN 44 Ca 0.46 0.13 0.18 0.00 -0.00 0.00 0.00 56.30 57.07 2b8q h ASN 44 Cb 1.46 0.50 -0.12 0.00 -0.00 0.00 0.00 38.32 40.17 2b8q h ASN 44 CO -0.11 -0.63 0.20 -0.07 -0.00 0.00 0.00 177.43 176.82 2b8q h LEU 45 N -0.92 0.03 -0.31 0.34 4.07 -1.70 -0.83 115.31 116.00 2b8q h LEU 45 Ca -0.04 0.16 -0.00 0.00 0.08 0.00 0.00 57.88 58.07 2b8q h LEU 45 Cb 0.83 0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.76 2b8q h LEU 45 CO -0.14 -0.05 0.18 0.40 -1.08 0.00 0.00 178.44 177.75 2b8q h ILE 46 N 0.27 1.11 -0.75 1.22 1.08 -1.36 0.12 117.51 119.20 2b8q h ILE 46 Ca 0.45 -0.28 -0.01 0.00 -0.39 0.00 0.00 64.86 64.63 2b8q h ILE 46 Cb 0.79 0.74 -0.04 0.00 -3.07 0.00 0.00 36.82 35.24 2b8q h ILE 46 CO -0.54 0.11 0.42 -0.33 -0.69 0.00 0.00 178.15 177.13 2b8q h GLU 47 N 0.39 1.04 0.11 2.37 5.08 -0.11 -1.83 114.58 121.63 2b8q h GLU 47 Ca 0.11 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2b8q h GLU 47 Cb 0.02 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2b8q h GLU 47 CO -0.02 0.76 -0.05 1.96 -1.00 0.00 0.00 179.01 180.66 2b8q h GLN 48 N 1.03 -0.14 -0.79 2.33 4.20 -0.91 -1.23 115.11 119.60 2b8q h GLN 48 Ca 0.27 0.01 0.18 0.00 0.06 0.00 0.00 58.65 59.16 2b8q h GLN 48 Cb 0.02 0.03 -0.12 0.00 0.30 0.00 0.00 27.48 27.71 2b8q h GLN 48 CO -0.04 0.01 0.25 1.25 -0.67 0.00 0.00 178.83 179.62 2b8q h HIS 49 N -0.25 0.40 -0.70 2.96 2.76 -0.39 -1.14 115.15 118.79 2b8q h HIS 49 Ca -0.01 0.04 -0.31 0.00 -2.20 0.00 0.00 60.37 57.89 2b8q h HIS 49 Cb 0.21 -0.05 -0.18 0.00 1.55 0.00 0.00 27.41 28.93 2b8q h HIS 49 CO -0.04 -0.07 0.31 0.66 -1.30 0.00 0.00 177.93 177.49 2b8q n TYR 50 N -5.12 2.24 -0.29 5.26 0.53 -0.72 -4.75 117.16 114.30 2b8q n TYR 50 Ca 0.17 -1.52 -0.02 0.00 -1.02 0.00 0.00 57.90 55.50 2b8q n TYR 50 Cb 0.52 -0.71 0.03 0.00 -1.03 0.00 0.00 39.34 38.15 2b8q n TYR 50 CO 0.00 0.00 0.00 1.57 -1.02 0.00 0.00 176.86 177.41 2b8q h LYS 51 N 1.56 -0.07 0.00 -0.72 2.10 0.05 0.19 116.57 119.68 2b8q h LYS 51 Ca 0.38 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 2b8q h LYS 51 Cb 2.31 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 33.65 2b8q h LYS 51 CO 0.75 -0.05 0.30 0.39 -2.00 0.00 0.00 179.45 178.84 2b8q n GLU 52 N -5.46 0.07 0.00 0.07 1.02 -1.26 -0.78 120.64 114.29 2b8q n GLU 52 Ca 0.08 0.50 0.08 0.00 -0.02 0.00 0.00 57.16 57.80 2b8q n GLU 52 Cb 0.38 -2.01 -0.05 0.00 -0.02 0.00 0.00 31.44 29.74 2b8q n GLU 52 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2b8q n HIS 53 N -1.85 0.00 -0.21 -0.32 8.25 0.67 -4.63 115.22 117.13 2b8q n HIS 53 Ca -0.01 0.00 0.30 0.00 -0.26 0.00 0.00 57.72 57.75 2b8q n HIS 53 Cb 0.31 0.00 0.57 0.00 1.12 0.00 0.00 29.99 31.99 2b8q n HIS 53 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2b8q h SER 54 N 0.91 0.00 0.60 0.41 4.64 -0.96 0.52 113.55 119.66 2b8q h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b8q h SER 54 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2b8q h SER 54 CO 0.00 0.00 -0.79 -0.62 -0.87 0.00 0.00 176.83 174.55 2b8q n GLU 55 N -3.47 0.24 -1.67 4.77 4.71 -1.26 -4.92 120.64 119.04 2b8q n GLU 55 Ca 0.22 0.03 -0.32 0.00 -0.01 0.00 0.00 57.16 57.08 2b8q n GLU 55 Cb 1.37 -1.61 0.05 0.00 -1.01 0.00 0.00 31.44 30.24 2b8q n GLU 55 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2b8q s GLN 56 N -3.15 2.83 0.47 3.49 -1.52 0.18 -4.95 119.66 117.01 2b8q s GLN 56 Ca 0.06 1.20 0.27 0.00 -1.95 0.00 0.00 55.36 54.93 2b8q s GLN 56 Cb 0.15 -1.97 0.89 0.00 -0.22 0.00 0.00 33.01 31.86 2b8q s GLN 56 CO 0.76 -1.20 1.81 0.66 -0.25 0.00 0.00 175.29 177.06 2b8q h SER 57 N -0.30 0.00 -0.03 5.90 4.64 -1.92 -3.07 113.55 118.77 2b8q h SER 57 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2b8q h SER 57 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2b8q h SER 57 CO 0.55 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.63 2b8q n TYR 58 N -3.21 0.02 0.23 4.77 0.18 -1.26 -4.56 117.16 113.34 2b8q n TYR 58 Ca 0.01 -0.01 -0.17 0.00 1.88 0.00 0.00 57.90 59.61 2b8q n TYR 58 Cb 0.43 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.29 2b8q n TYR 58 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 2b8q h PHE 59 N 2.66 -1.42 -0.31 -3.48 3.04 -1.78 -1.95 116.94 113.70 2b8q h PHE 59 Ca 0.00 0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.01 2b8q h PHE 59 Cb 0.57 0.57 -0.04 0.00 2.56 0.00 0.00 35.95 39.61 2b8q h PHE 59 CO 0.01 -0.64 0.09 -0.91 -2.02 0.00 0.00 178.31 174.84 2b8q h ASN 60 N -0.91 0.07 -0.71 0.41 2.35 -1.84 -1.59 115.58 113.35 2b8q h ASN 60 Ca -0.05 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 2b8q h ASN 60 Cb 0.82 0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.20 2b8q h ASN 60 CO -0.13 0.07 0.34 0.44 -1.65 0.00 0.00 177.43 176.51 2b8q h ASP 61 N 0.21 0.93 -0.55 5.81 3.32 -1.86 -0.93 116.42 123.36 2b8q h ASP 61 Ca 0.14 -0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.09 2b8q h ASP 61 Cb 0.13 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 2b8q h ASP 61 CO -0.17 0.81 0.32 -1.13 -1.72 0.00 0.00 179.24 177.35 2b8q h ASN 62 N 1.00 0.52 -0.47 6.45 -0.00 -1.03 -0.24 115.58 121.80 2b8q h ASN 62 Ca 0.24 0.01 -0.01 0.00 -0.00 0.00 0.00 56.30 56.55 2b8q h ASN 62 Cb 0.12 -0.10 -0.02 0.00 -0.00 0.00 0.00 38.32 38.32 2b8q h ASN 62 CO -0.03 0.36 0.27 0.00 -0.00 0.00 0.00 177.43 178.03 2b8q h ASP 64 N 0.62 0.30 -0.24 0.00 3.32 -0.50 -2.31 116.42 117.60 2b8q h ASP 64 Ca 0.17 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 2b8q h ASP 64 Cb 0.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2b8q h ASP 64 CO -0.03 0.20 0.02 0.15 -1.72 0.00 0.00 179.24 177.86 2b8q h PHE 65 N 0.46 0.45 0.00 4.55 3.04 -0.70 -2.12 116.94 122.62 2b8q h PHE 65 Ca 0.26 -0.07 0.00 0.00 3.98 0.00 0.00 57.97 62.14 2b8q h PHE 65 Cb 0.24 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 38.63 2b8q h PHE 65 CO -0.13 0.56 0.00 -1.33 -2.02 0.00 0.00 178.31 175.39 2b8q n MET 66 N -4.67 0.01 0.00 1.11 2.81 0.07 -1.23 117.12 115.23 2b8q n MET 66 Ca -0.03 0.39 0.00 0.00 -1.81 0.00 0.00 57.70 56.25 2b8q n MET 66 Cb 0.22 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 2b8q n MET 66 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 2b8q n VAL 67 N -1.42 0.39 1.47 2.03 3.14 -0.91 -4.65 118.33 118.37 2b8q n VAL 67 Ca 0.01 -0.65 0.02 0.00 -2.96 0.00 0.00 64.34 60.76 2b8q n VAL 67 Cb 0.02 0.86 0.06 0.00 -1.06 0.00 0.00 33.84 33.72 2b8q n VAL 67 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2b8q n SER 68 N -0.19 0.85 -2.22 6.55 3.41 -0.36 -4.76 113.62 116.89 2b8q n SER 68 Ca 0.00 -2.02 0.01 0.00 -0.26 0.00 0.00 58.87 56.60 2b8q n SER 68 Cb 0.13 -0.14 0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2b8q n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b8q n GLY 69 N 0.65 0.54 3.82 5.00 0.00 -1.26 -5.05 105.19 108.89 2b8q n GLY 69 Ca 0.05 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 2b8q n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2b8q s PRO 70 N -2.01 2.26 0.01 1.61 0.02 -1.13 -4.43 135.00 131.33 2b8q s PRO 70 Ca 0.13 0.62 -0.17 0.00 0.02 0.00 0.00 61.00 61.60 2b8q s PRO 70 Cb -0.01 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.60 2b8q s PRO 70 CO 0.00 -1.49 0.37 0.96 -0.33 0.00 0.00 177.00 176.51 2b8q s ILE 71 N -3.19 0.06 -0.10 2.83 -4.36 -0.71 -2.65 121.20 113.08 2b8q s ILE 71 Ca 0.60 -0.48 0.03 0.00 -0.26 0.00 0.00 60.65 60.54 2b8q s ILE 71 Cb -0.14 -0.83 -0.00 0.00 1.25 0.00 0.00 42.46 42.74 2b8q s ILE 71 CO 0.54 -0.27 -0.22 -0.63 0.24 0.00 0.00 174.94 174.61 2b8q s ILE 72 N -1.97 2.29 -0.18 8.37 1.01 -0.91 -1.29 121.20 128.52 2b8q s ILE 72 Ca -0.09 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 59.54 2b8q s ILE 72 Cb -0.02 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 2b8q s ILE 72 CO 0.01 0.55 0.07 -0.94 0.00 0.00 0.00 174.94 174.63 2b8q s SER 73 N 0.27 5.71 -0.02 3.58 1.04 -0.22 -0.40 113.70 123.66 2b8q s SER 73 Ca -0.15 0.10 0.02 0.00 0.48 0.00 0.00 55.95 56.40 2b8q s SER 73 Cb -0.17 -1.98 0.00 0.00 0.10 0.00 0.00 66.02 63.97 2b8q s SER 73 CO 0.08 0.18 -0.05 -0.63 0.98 0.00 0.00 173.24 173.79 2b8q s ILE 74 N 0.35 0.49 -0.28 -1.02 1.01 0.77 -0.88 121.20 121.63 2b8q s ILE 74 Ca 0.04 -0.21 -0.07 0.00 0.00 0.00 0.00 60.65 60.41 2b8q s ILE 74 Cb -0.12 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 41.90 2b8q s ILE 74 CO -0.00 0.16 0.07 -0.69 0.00 0.00 0.00 174.94 174.48 2b8q s VAL 75 N 0.17 4.01 -0.02 2.92 1.01 -0.42 -0.17 120.40 127.90 2b8q s VAL 75 Ca -0.02 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 2b8q s VAL 75 Cb -0.06 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2b8q s VAL 75 CO -0.00 0.15 0.07 -0.31 0.00 0.00 0.00 175.10 175.01 2b8q s TYR 76 N 1.52 3.26 0.10 5.22 1.51 -0.38 -0.65 117.35 127.93 2b8q s TYR 76 Ca 0.04 0.20 0.09 0.00 -1.01 0.00 0.00 57.07 56.39 2b8q s TYR 76 Cb -0.17 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.91 2b8q s TYR 76 CO 0.02 0.54 -0.23 -2.00 -1.11 0.00 0.00 175.55 172.77 2b8q s GLU 77 N -1.61 1.31 0.00 -0.62 2.12 -0.22 -1.33 118.70 118.35 2b8q s GLU 77 Ca 0.21 -1.19 0.00 0.00 0.36 0.00 0.00 54.97 54.35 2b8q s GLU 77 Cb -0.12 -1.62 0.00 0.00 0.26 0.00 0.00 34.13 32.65 2b8q s GLU 77 CO 0.12 0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.64 2b8q n GLY 78 N 1.19 1.30 3.69 -1.50 0.00 -0.64 -1.92 105.19 107.31 2b8q n GLY 78 Ca -0.18 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 2b8q n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b8q s THR 79 N -2.00 3.42 -1.82 2.61 2.01 -1.26 -1.10 115.64 117.51 2b8q s THR 79 Ca 0.00 0.85 0.00 0.00 0.31 0.00 0.00 61.69 62.85 2b8q s THR 79 Cb 0.00 -3.54 0.00 0.00 0.01 0.00 0.00 72.50 68.97 2b8q s THR 79 CO 0.00 0.00 0.00 -0.67 -0.69 0.00 0.00 174.62 173.26 2b8q n ASP 80 N 5.39 -5.64 -0.25 3.53 4.64 -0.44 -4.88 116.55 118.91 2b8q n ASP 80 Ca 0.14 0.12 0.02 0.00 -1.38 0.00 0.00 54.79 53.68 2b8q n ASP 80 Cb 0.42 -4.77 0.10 0.00 -1.04 0.00 0.00 41.12 35.83 2b8q n ASP 80 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2b8q h ALA 81 N 0.79 0.53 0.62 -1.67 0.00 -1.76 -0.35 119.26 117.42 2b8q h ALA 81 Ca -0.46 0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2b8q h ALA 81 Cb 1.34 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 19.65 2b8q h ALA 81 CO 0.57 -0.42 -0.36 0.82 0.00 0.00 0.00 179.25 179.86 2b8q h ILE 82 N 0.02 0.26 -0.17 0.00 2.04 -1.88 -0.56 117.51 117.22 2b8q h ILE 82 Ca 0.36 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.23 2b8q h ILE 82 Cb 0.56 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2b8q h ILE 82 CO -0.72 0.00 0.08 -1.28 0.00 0.00 0.00 178.15 176.23 2b8q h SER 83 N -0.92 0.12 -0.28 1.72 0.87 -1.84 -2.17 113.55 111.05 2b8q h SER 83 Ca -0.08 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.46 2b8q h SER 83 Cb 0.74 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 2b8q h SER 83 CO 0.09 0.10 0.05 0.11 -0.53 0.00 0.00 176.83 176.65 2b8q h LYS 84 N 0.18 0.46 -0.16 2.24 1.79 -1.02 -1.86 116.57 118.19 2b8q h LYS 84 Ca 0.07 -0.12 -0.07 0.00 -2.18 0.00 0.00 60.65 58.34 2b8q h LYS 84 Cb 0.01 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.60 2b8q h LYS 84 CO -0.05 0.56 -0.23 0.82 -1.08 0.00 0.00 179.45 179.47 2b8q h ILE 85 N 0.28 1.24 -0.49 1.86 2.04 -1.11 0.18 117.51 121.50 2b8q h ILE 85 Ca 0.09 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 2b8q h ILE 85 Cb 0.32 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 2b8q h ILE 85 CO 0.00 0.34 0.18 0.03 0.00 0.00 0.00 178.15 178.71 2b8q h ARG 86 N 0.25 0.74 -0.25 2.37 2.47 -1.21 0.20 114.38 118.97 2b8q h ARG 86 Ca 0.04 -0.14 -0.09 0.00 -1.26 0.00 0.00 59.98 58.53 2b8q h ARG 86 Cb 0.56 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.75 2b8q h ARG 86 CO 0.04 0.67 -0.25 -0.09 0.56 0.00 0.00 179.97 180.91 2b8q h ARG 87 N 0.66 0.47 -0.39 0.04 2.43 -0.71 -1.46 114.38 115.42 2b8q h ARG 87 Ca 0.16 -0.17 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 2b8q h ARG 87 Cb 0.22 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 2b8q h ARG 87 CO -0.01 0.68 -0.26 1.25 -1.51 0.00 0.00 179.97 180.12 2b8q h LEU 88 N 0.42 0.83 -0.82 3.80 5.85 -0.00 -2.67 115.31 122.71 2b8q h LEU 88 Ca 0.06 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 2b8q h LEU 88 Cb 0.66 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 2b8q h LEU 88 CO 0.05 1.05 0.42 -0.61 -0.34 0.00 0.00 178.44 179.01 2b8q h GLN 89 N 0.69 1.16 0.00 1.25 4.15 -0.05 -1.29 115.11 121.02 2b8q h GLN 89 Ca 0.09 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.35 2b8q h GLN 89 Cb 0.80 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.27 2b8q h GLN 89 CO 0.07 0.88 0.00 0.41 -1.93 0.00 0.00 178.83 178.25 2b8q n GLY 90 N -1.05 1.91 3.38 2.39 0.00 -0.60 -2.17 105.19 109.04 2b8q n GLY 90 Ca 0.08 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 2b8q n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b8q s ASN 91 N -4.00 -0.14 0.00 1.61 2.20 -1.26 -4.84 114.94 108.50 2b8q s ASN 91 Ca 0.00 -0.53 0.05 0.00 -0.94 0.00 0.00 52.86 51.43 2b8q s ASN 91 Cb 0.00 0.48 0.29 0.00 -2.00 0.00 0.00 41.25 40.02 2b8q s ASN 91 CO 0.00 -0.91 0.68 2.30 -2.94 0.00 0.00 177.10 176.23 2b8q n ILE 92 N -0.24 0.00 -0.13 0.54 -5.35 -1.26 -2.06 119.36 110.85 2b8q n ILE 92 Ca -0.12 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.14 2b8q n ILE 92 Cb 0.63 -0.52 -0.11 0.00 -1.74 0.00 0.00 39.64 37.90 2b8q n ILE 92 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2b8q n LEU 93 N -0.70 2.57 -4.54 7.28 4.77 -1.26 -4.77 117.00 120.35 2b8q n LEU 93 Ca 0.04 0.04 -0.43 0.00 -0.03 0.00 0.00 56.01 55.63 2b8q n LEU 93 Cb 0.02 -0.85 -0.07 0.00 -2.33 0.00 0.00 43.42 40.19 2b8q n LEU 93 CO 0.03 0.79 0.39 -0.89 -1.33 0.00 0.00 177.39 176.38 2b8q s THR 94 N -2.50 4.84 0.73 -5.08 2.01 -1.17 -5.00 115.64 109.46 2b8q s THR 94 Ca -0.35 0.29 -0.15 0.00 0.31 0.00 0.00 61.69 61.79 2b8q s THR 94 Cb 0.11 -4.17 0.04 0.00 0.01 0.00 0.00 72.50 68.49 2b8q s THR 94 CO 0.54 -0.51 1.22 -2.84 -0.69 0.00 0.00 174.62 172.35 2b8q s PRO 95 N 2.81 2.13 0.00 4.92 0.02 -1.26 -3.56 135.00 140.06 2b8q s PRO 95 Ca 0.24 1.82 0.00 0.00 0.02 0.00 0.00 61.00 63.07 2b8q s PRO 95 Cb -0.14 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.55 2b8q s PRO 95 CO 0.18 -1.86 0.00 0.41 -0.33 0.00 0.00 177.00 175.40 2b8q n GLY 96 N 0.50 2.94 4.00 0.52 0.00 -1.26 -4.94 105.19 106.96 2b8q n GLY 96 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 2b8q n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b8q s THR 97 N -2.61 2.43 0.05 2.61 -4.23 -1.23 -4.93 115.64 107.72 2b8q s THR 97 Ca 0.00 -1.07 -0.26 0.00 -1.18 0.00 0.00 61.69 59.18 2b8q s THR 97 Cb 0.00 -2.50 -0.17 0.00 1.34 0.00 0.00 72.50 71.17 2b8q s THR 97 CO 0.00 0.00 1.53 0.40 -0.54 0.00 0.00 174.62 176.01 2b8q h ILE 98 N 0.46 0.89 -0.16 2.99 2.04 -1.32 -1.33 117.51 121.08 2b8q h ILE 98 Ca -0.35 -0.34 -0.14 0.00 1.00 0.00 0.00 64.86 65.03 2b8q h ILE 98 Cb 1.28 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 2b8q h ILE 98 CO 0.45 0.08 -0.52 0.03 0.00 0.00 0.00 178.15 178.19 2b8q h ARG 99 N -0.40 0.44 -0.03 2.37 3.08 -1.68 -1.06 114.38 117.10 2b8q h ARG 99 Ca -0.02 -0.26 -0.03 0.00 0.07 0.00 0.00 59.98 59.73 2b8q h ARG 99 Cb 0.31 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2b8q h ARG 99 CO 0.04 0.85 -0.13 0.78 -1.07 0.00 0.00 179.97 180.44 2b8q h GLY 100 N 1.18 0.04 0.00 0.04 0.00 -1.28 -0.65 103.07 102.39 2b8q h GLY 100 Ca 0.01 -0.02 -0.19 0.00 0.00 0.00 0.00 47.33 47.13 2b8q h GLY 100 CO 0.09 0.02 -2.13 1.22 0.00 0.00 0.00 176.54 175.74 2b8q n ASP 101 N -4.36 0.34 -0.00 0.19 8.00 -0.52 -4.27 116.55 115.93 2b8q n ASP 101 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2b8q n ASP 101 Cb 0.21 1.41 -0.00 0.00 -0.02 0.00 0.00 41.12 42.72 2b8q n ASP 101 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2b8q n LEU 102 N -2.48 0.00 -4.87 0.64 4.77 -0.41 -5.07 117.00 109.59 2b8q n LEU 102 Ca -0.18 -0.05 -0.21 0.00 -0.03 0.00 0.00 56.01 55.53 2b8q n LEU 102 Cb 0.85 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.90 2b8q n LEU 102 CO 0.41 0.00 -0.12 0.00 -1.33 0.00 0.00 177.39 176.36 2b8q s ALA 103 N -1.91 3.73 0.00 -1.18 0.00 -0.26 -5.01 121.76 117.13 2b8q s ALA 103 Ca -0.00 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 50.58 2b8q s ALA 103 Cb 0.00 -1.41 0.03 0.00 0.00 0.00 0.00 23.12 21.74 2b8q s ALA 103 CO 0.01 0.21 0.81 -1.71 0.00 0.00 0.00 175.76 175.08 2b8q n ASN 104 N -1.28 -0.37 -4.03 0.00 5.15 -1.26 -4.74 115.26 108.72 2b8q n ASN 104 Ca -0.07 -1.60 -0.12 0.00 -0.60 0.00 0.00 54.58 52.19 2b8q n ASN 104 Cb 0.58 0.10 -0.11 0.00 -0.53 0.00 0.00 39.78 39.81 2b8q n ASN 104 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2b8q s ASP 105 N -0.68 0.64 0.47 1.20 -1.08 -1.26 -5.03 116.67 110.92 2b8q s ASP 105 Ca 0.03 -0.53 0.26 0.00 -0.52 0.00 0.00 52.55 51.79 2b8q s ASP 105 Cb 0.03 0.06 0.75 0.00 -1.46 0.00 0.00 42.92 42.30 2b8q s ASP 105 CO -0.01 -0.24 1.75 -0.29 0.52 0.00 0.00 175.17 176.90 2b8q h ILE 106 N 4.55 0.14 0.00 4.11 2.10 -2.02 -3.37 117.51 123.03 2b8q h ILE 106 Ca -0.34 -0.95 -0.31 0.00 1.08 0.00 0.00 64.86 64.33 2b8q h ILE 106 Cb 1.20 1.84 -0.05 0.00 -1.09 0.00 0.00 36.82 38.73 2b8q h ILE 106 CO 0.41 0.07 -2.02 -1.14 -1.08 0.00 0.00 178.15 174.39 2b8q n ARG 107 N -3.14 0.40 -2.81 2.19 0.63 -1.26 -4.78 116.66 107.89 2b8q n ARG 107 Ca 0.02 0.18 -0.43 0.00 -0.92 0.00 0.00 57.85 56.69 2b8q n ARG 107 Cb 0.46 -1.18 -0.01 0.00 0.45 0.00 0.00 32.46 32.18 2b8q n ARG 107 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2b8q s GLU 108 N -2.36 3.96 -0.26 -0.14 2.02 -1.26 -4.75 118.70 115.90 2b8q s GLU 108 Ca -0.26 -2.19 0.10 0.00 0.02 0.00 0.00 54.97 52.64 2b8q s GLU 108 Cb 0.10 -5.20 0.49 0.00 0.10 0.00 0.00 34.13 29.62 2b8q s GLU 108 CO 0.33 -1.94 1.43 0.27 0.02 0.00 0.00 175.26 175.37 2b8q n ASN 109 N 6.82 2.55 0.00 -0.19 0.23 -1.26 -4.04 115.26 119.37 2b8q n ASN 109 Ca 0.38 -3.68 0.00 0.00 -0.53 0.00 0.00 54.58 50.75 2b8q n ASN 109 Cb 0.45 -0.61 0.00 0.00 -2.08 0.00 0.00 39.78 37.54 2b8q n ASN 109 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2b8q n LEU 110 N -1.07 0.00 -3.89 -4.53 4.77 -1.26 -4.81 117.00 106.21 2b8q n LEU 110 Ca 0.30 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.18 2b8q n LEU 110 Cb 0.97 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.97 2b8q n LEU 110 CO 0.16 0.00 -0.17 -0.51 -1.33 0.00 0.00 177.39 175.53 2b8q s ILE 111 N 0.00 0.11 0.01 -0.08 2.07 -1.26 -0.74 121.20 121.30 2b8q s ILE 111 Ca 0.00 -0.88 0.07 0.00 -1.41 0.00 0.00 60.65 58.43 2b8q s ILE 111 Cb 0.00 -0.70 -0.02 0.00 0.13 0.00 0.00 42.46 41.87 2b8q s ILE 111 CO 0.00 -0.49 -0.22 -2.28 -1.91 0.00 0.00 174.94 170.05 2b8q s HIS 112 N -2.08 1.94 -0.03 3.50 5.65 -0.19 -4.97 115.29 119.10 2b8q s HIS 112 Ca -0.09 -0.37 -0.02 0.00 0.25 0.00 0.00 55.06 54.83 2b8q s HIS 112 Cb -0.04 -1.21 0.02 0.00 -1.18 0.00 0.00 32.58 30.18 2b8q s HIS 112 CO -0.02 0.03 0.08 0.00 -0.65 0.00 0.00 174.74 174.18 2b8q s ALA 113 N -0.64 -0.11 0.65 1.58 0.00 -1.26 -1.43 121.76 120.56 2b8q s ALA 113 Ca 0.08 0.37 -0.17 0.00 0.00 0.00 0.00 51.96 52.24 2b8q s ALA 113 Cb -0.09 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 2b8q s ALA 113 CO 0.00 -0.09 0.69 0.43 0.00 0.00 0.00 175.76 176.79 2b8q n SER 114 N 3.77 -0.47 -0.28 0.00 7.64 -0.86 -4.93 113.62 118.49 2b8q n SER 114 Ca -0.22 0.69 0.03 0.00 1.01 0.00 0.00 58.87 60.38 2b8q n SER 114 Cb 0.54 -1.27 0.05 0.00 -1.01 0.00 0.00 64.21 62.52 2b8q n SER 114 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2b8q n ASP 115 N -0.40 1.91 -3.60 6.43 5.75 -1.26 -4.67 116.55 120.71 2b8q n ASP 115 Ca 0.12 -1.56 -0.07 0.00 -0.01 0.00 0.00 54.79 53.27 2b8q n ASP 115 Cb 0.49 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.51 2b8q n ASP 115 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2b8q s SER 116 N -0.70 -0.31 0.22 -1.12 1.04 -1.26 -4.98 113.70 106.58 2b8q s SER 116 Ca 0.09 -0.18 -0.08 0.00 0.48 0.00 0.00 55.95 56.27 2b8q s SER 116 Cb 0.06 0.46 0.27 0.00 0.10 0.00 0.00 66.02 66.91 2b8q s SER 116 CO 0.08 -0.80 1.83 -0.33 0.98 0.00 0.00 173.24 175.00 2b8q h GLU 117 N 2.00 0.80 0.66 4.02 5.08 -1.98 -1.11 114.58 124.05 2b8q h GLU 117 Ca -0.24 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.04 2b8q h GLU 117 Cb 1.25 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 30.32 2b8q h GLU 117 CO 0.29 0.53 -0.32 -0.44 -1.00 0.00 0.00 179.01 178.07 2b8q h ASP 118 N 0.82 -0.75 0.09 1.42 5.19 -2.00 -2.40 116.42 118.79 2b8q h ASP 118 Ca 0.33 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.72 2b8q h ASP 118 Cb 0.16 0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.86 2b8q h ASP 118 CO -0.17 -0.47 -0.04 0.77 -3.12 0.00 0.00 179.24 176.21 2b8q h SER 119 N -1.00 0.00 0.11 6.45 4.64 -1.94 -1.65 113.55 120.15 2b8q h SER 119 Ca -0.09 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 2b8q h SER 119 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2b8q h SER 119 CO 0.15 0.04 -0.05 0.00 -0.87 0.00 0.00 176.83 176.10 2b8q h ALA 120 N 1.96 -0.15 -0.86 5.18 0.00 -1.03 0.30 119.26 124.67 2b8q h ALA 120 Ca -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2b8q h ALA 120 Cb 0.10 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2b8q h ALA 120 CO 0.01 -0.44 0.53 0.28 0.00 0.00 0.00 179.25 179.63 2b8q h VAL 121 N -0.44 1.23 0.01 0.00 2.07 -0.90 -0.09 116.25 118.13 2b8q h VAL 121 Ca -0.01 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 2b8q h VAL 121 Cb 0.36 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2b8q h VAL 121 CO 0.02 0.24 -0.00 -0.78 0.02 0.00 0.00 177.57 177.07 2b8q h ASP 122 N 1.17 -0.01 -0.95 0.57 3.58 -1.23 -2.51 116.42 117.05 2b8q h ASP 122 Ca 0.31 -0.41 0.03 0.00 0.42 0.00 0.00 57.03 57.38 2b8q h ASP 122 Cb -0.06 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 40.94 2b8q h ASP 122 CO -0.06 0.40 0.62 -0.33 -2.88 0.00 0.00 179.24 177.00 2b8q h GLU 123 N -0.42 1.20 -0.33 0.28 5.08 -0.24 -1.67 114.58 118.48 2b8q h GLU 123 Ca -0.00 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2b8q h GLU 123 Cb 0.41 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2b8q h GLU 123 CO 0.00 0.79 -0.04 0.82 -1.00 0.00 0.00 179.01 179.58 2b8q h ILE 124 N 1.23 1.21 -0.02 3.13 2.04 -1.01 -2.35 117.51 121.75 2b8q h ILE 124 Ca 0.37 -0.86 -0.12 0.00 1.00 0.00 0.00 64.86 65.25 2b8q h ILE 124 Cb -0.05 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2b8q h ILE 124 CO -0.11 0.29 -0.54 0.77 0.00 0.00 0.00 178.15 178.57 2b8q h SER 125 N 0.50 0.06 -0.23 1.72 4.64 -0.87 0.96 113.55 120.33 2b8q h SER 125 Ca 0.10 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.32 2b8q h SER 125 Cb 0.39 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2b8q h SER 125 CO 0.02 0.59 -0.14 0.40 -0.87 0.00 0.00 176.83 176.83 2b8q h ILE 126 N 0.04 1.31 0.00 0.95 2.04 -0.82 -2.71 117.51 118.32 2b8q h ILE 126 Ca -0.00 -1.24 0.00 0.00 1.00 0.00 0.00 64.86 64.62 2b8q h ILE 126 Cb 0.97 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 2b8q h ILE 126 CO 0.07 0.38 -1.12 0.79 0.00 0.00 0.00 178.15 178.27 2b8q n TRP 127 N -4.48 0.42 -3.15 1.37 7.02 -1.03 -4.48 117.44 113.11 2b8q n TRP 127 Ca -0.04 0.12 -0.20 0.00 -1.02 0.00 0.00 57.50 56.35 2b8q n TRP 127 Cb 0.36 -0.59 -0.04 0.00 -2.42 0.00 0.00 31.31 28.63 2b8q n TRP 127 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2b8q n PHE 128 N -2.18 0.93 -0.31 -5.99 3.72 0.33 -4.94 117.46 109.00 2b8q n PHE 128 Ca 0.01 -3.84 0.22 0.00 -0.05 0.00 0.00 57.45 53.79 2b8q n PHE 128 Cb 0.48 -0.43 0.50 0.00 -0.94 0.00 0.00 39.48 39.09 2b8q n PHE 128 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2b8q h PRO 129 N 3.11 0.40 -5.02 -1.08 0.11 -1.65 -3.34 132.00 124.54 2b8q h PRO 129 Ca 0.11 -0.02 -0.37 0.00 0.11 0.00 0.00 66.00 65.82 2b8q h PRO 129 Cb 0.87 -0.09 0.08 0.00 0.11 0.00 0.00 31.00 31.97 2b8q h PRO 129 CO 0.56 0.26 0.90 -1.91 -0.21 0.00 0.00 178.00 177.61 2b8q n GLU 130 N -4.61 0.16 0.00 1.05 4.07 -1.26 -5.03 120.64 115.02 2b8q n GLU 130 Ca 0.24 -1.35 0.00 0.00 -0.06 0.00 0.00 57.16 55.99 2b8q n GLU 130 Cb 0.84 -3.10 0.00 0.00 -0.06 0.00 0.00 31.44 29.13 2b8q n GLU 130 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48