#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o6g n LYS 5 N 0.00 -4.69 -2.03 0.54 4.81 -1.26 -4.96 118.16 110.57 2o6g n LYS 5 Ca 0.00 3.42 -0.37 0.00 -0.87 0.00 0.00 58.31 60.49 2o6g n LYS 5 Cb 0.00 -3.83 0.02 0.00 0.02 0.00 0.00 35.03 31.24 2o6g n LYS 5 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2o6g s PRO 6 N -0.92 3.39 0.04 1.64 0.02 -1.26 -5.01 135.00 132.89 2o6g s PRO 6 Ca 0.00 1.97 -0.15 0.00 0.02 0.00 0.00 61.00 62.85 2o6g s PRO 6 Cb 0.00 -2.27 -0.06 0.00 0.02 0.00 0.00 34.50 32.19 2o6g s PRO 6 CO 0.00 -0.91 0.45 1.03 -0.33 0.00 0.00 177.00 177.24 2o6g s ARG 7 N -2.88 3.94 0.21 5.54 3.00 -1.26 -5.01 118.95 122.49 2o6g s ARG 7 Ca 0.69 0.43 -0.09 0.00 0.00 0.00 0.00 55.73 56.76 2o6g s ARG 7 Cb -0.34 -3.15 0.16 0.00 0.00 0.00 0.00 34.95 31.62 2o6g s ARG 7 CO 0.40 0.64 1.84 0.97 0.00 0.00 0.00 175.30 179.14 2o6g h ILE 8 N 3.43 1.23 -0.28 1.52 2.10 -1.98 -2.27 117.51 121.25 2o6g h ILE 8 Ca -0.51 -0.54 -0.06 0.00 1.08 0.00 0.00 64.86 64.83 2o6g h ILE 8 Cb 1.21 0.17 -0.01 0.00 -1.09 0.00 0.00 36.82 37.10 2o6g h ILE 8 CO 0.63 0.25 -0.07 -0.07 -1.08 0.00 0.00 178.15 177.81 2o6g h LEU 9 N 1.07 0.55 -0.84 2.19 3.38 -1.98 0.20 115.31 119.88 2o6g h LEU 9 Ca 0.28 -0.37 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 2o6g h LEU 9 Cb 0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2o6g h LEU 9 CO -0.05 0.79 -0.06 -0.65 0.09 0.00 0.00 178.44 178.56 2o6g h PRO 10 N 0.31 0.80 -0.63 1.13 0.11 -1.99 -1.20 132.00 130.53 2o6g h PRO 10 Ca 0.07 -0.25 -0.04 0.00 0.11 0.00 0.00 66.00 65.89 2o6g h PRO 10 Cb 0.55 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 2o6g h PRO 10 CO 0.03 0.85 0.22 2.35 -0.21 0.00 0.00 178.00 181.24 2o6g h TRP 11 N 0.73 0.99 -0.42 0.65 7.01 -1.18 -1.91 115.95 121.82 2o6g h TRP 11 Ca 0.13 -0.09 -0.08 0.00 2.11 0.00 0.00 58.89 60.97 2o6g h TRP 11 Cb 0.54 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 27.29 2o6g h TRP 11 CO 0.03 0.80 -0.03 1.25 -2.79 0.00 0.00 178.44 177.70 2o6g h LEU 12 N 0.90 0.76 -1.00 0.65 6.46 -0.24 -2.03 115.31 120.80 2o6g h LEU 12 Ca 0.21 -0.33 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 2o6g h LEU 12 Cb 0.26 -0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 39.94 2o6g h LEU 12 CO -0.01 0.90 0.47 0.58 -0.62 0.00 0.00 178.44 179.77 2o6g h VAL 13 N 0.59 1.24 -0.68 1.05 2.07 -1.07 -0.74 116.25 118.72 2o6g h VAL 13 Ca 0.11 -0.59 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 2o6g h VAL 13 Cb 0.53 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2o6g h VAL 13 CO 0.03 0.27 0.27 -1.28 0.02 0.00 0.00 177.57 176.88 2o6g h SER 14 N 1.18 0.95 -0.81 0.57 0.87 -0.95 0.07 113.55 115.44 2o6g h SER 14 Ca 0.30 -0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 2o6g h SER 14 Cb 0.01 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 61.69 2o6g h SER 14 CO -0.05 0.86 0.34 1.56 -0.53 0.00 0.00 176.83 179.01 2o6g h GLN 15 N 0.97 1.20 -0.62 2.24 1.08 -0.58 -0.09 115.11 119.31 2o6g h GLN 15 Ca 0.23 -0.21 -0.04 0.00 -1.45 0.00 0.00 58.65 57.18 2o6g h GLN 15 Cb 0.22 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 2o6g h GLN 15 CO -0.02 0.96 0.24 -0.07 -0.95 0.00 0.00 178.83 178.99 2o6g h LEU 16 N 1.17 0.85 -0.33 1.46 3.38 -0.37 0.18 115.31 121.65 2o6g h LEU 16 Ca 0.27 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 2o6g h LEU 16 Cb 0.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2o6g h LEU 16 CO -0.02 0.80 -0.29 0.44 0.09 0.00 0.00 178.44 179.45 2o6g h ASP 17 N 0.86 0.83 -0.24 -0.43 3.32 -0.50 -3.10 116.42 117.15 2o6g h ASP 17 Ca 0.20 -0.46 -0.09 0.00 0.02 0.00 0.00 57.03 56.70 2o6g h ASP 17 Cb 0.21 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2o6g h ASP 17 CO -0.02 1.11 -0.16 -0.07 -1.72 0.00 0.00 179.24 178.39 2o6g h LEU 18 N 0.55 0.66 -1.24 1.55 -0.00 -0.89 -3.47 115.31 112.48 2o6g h LEU 18 Ca 0.06 -0.21 -0.38 0.00 -0.00 0.00 0.00 57.88 57.35 2o6g h LEU 18 Cb 0.87 -0.18 0.13 0.00 -0.00 0.00 0.00 40.66 41.48 2o6g h LEU 18 CO 0.07 0.84 -0.73 0.61 -0.00 0.00 0.00 178.44 179.23 2o6g n GLY 19 N -0.43 -0.45 0.06 0.83 0.00 0.61 -4.94 105.19 100.87 2o6g n GLY 19 Ca 0.01 0.18 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 2o6g n GLY 19 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2o6g h GLN 20 N -2.29 -0.01 -7.19 1.61 5.75 -1.86 -3.46 115.11 107.65 2o6g h GLN 20 Ca -0.58 0.00 -0.53 0.00 -0.15 0.00 0.00 58.65 57.39 2o6g h GLN 20 Cb 1.36 0.00 0.15 0.00 1.07 0.00 0.00 27.48 30.06 2o6g h GLN 20 CO 0.55 0.13 0.38 -0.51 -2.65 0.00 0.00 178.83 176.72 2o6g s LEU 21 N -8.52 3.30 -0.10 -2.39 1.43 -1.26 -5.01 118.68 106.12 2o6g s LEU 21 Ca -0.03 2.25 -0.05 0.00 -1.03 0.00 0.00 54.13 55.28 2o6g s LEU 21 Cb -0.00 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.60 2o6g s LEU 21 CO 0.10 -2.17 0.07 -1.61 0.23 0.00 0.00 176.35 172.98 2o6g s GLU 22 N -4.02 3.23 0.00 1.70 2.02 -1.26 -3.98 118.70 116.40 2o6g s GLU 22 Ca 0.72 -0.26 0.00 0.00 0.02 0.00 0.00 54.97 55.45 2o6g s GLU 22 Cb -0.26 -3.01 0.00 0.00 0.10 0.00 0.00 34.13 30.96 2o6g s GLU 22 CO 0.45 0.74 0.00 0.41 0.02 0.00 0.00 175.26 176.88 2o6g n GLY 23 N 2.07 0.75 2.86 -1.39 0.00 -1.26 -4.80 105.19 103.42 2o6g n GLY 23 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2o6g n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o6g s VAL 24 N -2.63 1.82 0.25 1.61 1.01 -1.26 -2.95 120.40 118.25 2o6g s VAL 24 Ca 0.00 -2.43 -0.22 0.00 0.00 0.00 0.00 61.98 59.34 2o6g s VAL 24 Cb 0.00 -2.31 0.05 0.00 0.00 0.00 0.00 36.38 34.12 2o6g s VAL 24 CO 0.00 -0.74 0.84 0.00 0.00 0.00 0.00 175.10 175.20 2o6g s ALA 25 N 0.63 -1.33 0.01 5.51 0.00 -1.22 -4.74 121.76 120.63 2o6g s ALA 25 Ca 0.14 -0.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 2o6g s ALA 25 Cb -0.22 0.74 -0.06 0.00 0.00 0.00 0.00 23.12 23.59 2o6g s ALA 25 CO -0.08 -1.04 1.42 -1.58 0.00 0.00 0.00 175.76 174.49 2o6g s TRP 26 N -3.29 2.82 -0.54 0.00 0.23 -1.26 -1.73 118.94 115.17 2o6g s TRP 26 Ca 0.13 0.78 0.02 0.00 -2.03 0.00 0.00 56.10 55.00 2o6g s TRP 26 Cb -0.04 -3.69 0.44 0.00 0.03 0.00 0.00 33.47 30.21 2o6g s TRP 26 CO 0.06 -2.56 1.68 1.33 0.96 0.00 0.00 176.95 178.42 2o6g n VAL 27 N 4.65 3.16 -3.64 4.03 0.24 -0.89 -4.90 118.33 120.98 2o6g n VAL 27 Ca 0.13 -3.63 -0.08 0.00 -2.04 0.00 0.00 64.34 58.72 2o6g n VAL 27 Cb 0.43 -1.17 -0.07 0.00 -1.47 0.00 0.00 33.84 31.57 2o6g n VAL 27 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2o6g s ASN 28 N -2.50 -0.44 0.46 -1.34 3.84 -1.26 -4.85 114.94 108.86 2o6g s ASN 28 Ca 0.58 0.81 0.26 0.00 0.21 0.00 0.00 52.86 54.72 2o6g s ASN 28 Cb 0.46 0.89 0.86 0.00 -0.55 0.00 0.00 41.25 42.91 2o6g s ASN 28 CO -0.04 -0.14 1.79 0.50 -2.79 0.00 0.00 177.10 176.42 2o6g h LYS 29 N 4.47 0.00 0.00 0.43 3.11 -1.96 -2.66 116.57 119.96 2o6g h LYS 29 Ca -0.28 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.56 2o6g h LYS 29 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.41 2o6g h LYS 29 CO 0.13 0.13 -0.19 0.66 -2.81 0.00 0.00 179.45 177.37 2o6g h SER 30 N 0.00 0.00 -3.91 4.20 4.64 -1.99 -3.49 113.55 113.00 2o6g h SER 30 Ca -0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2o6g h SER 30 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2o6g h SER 30 CO 0.02 0.01 -0.27 0.54 -0.87 0.00 0.00 176.83 176.25 2o6g n ARG 31 N -2.76 -1.14 0.00 4.77 1.74 -1.01 -5.03 116.66 113.24 2o6g n ARG 31 Ca 0.04 1.26 0.00 0.00 -0.77 0.00 0.00 57.85 58.38 2o6g n ARG 31 Cb 0.50 -3.07 0.00 0.00 -1.02 0.00 0.00 32.46 28.87 2o6g n ARG 31 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 2o6g n THR 32 N -0.18 0.00 -4.66 0.55 5.66 -1.26 -5.01 114.28 109.39 2o6g n THR 32 Ca 0.03 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.70 2o6g n THR 32 Cb 0.12 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.79 2o6g n THR 32 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2o6g s ARG 33 N -0.60 2.59 0.04 1.09 0.52 -1.26 -0.78 118.95 120.55 2o6g s ARG 33 Ca 0.00 -0.66 -0.06 0.00 -0.52 0.00 0.00 55.73 54.49 2o6g s ARG 33 Cb 0.00 -2.48 -0.01 0.00 0.52 0.00 0.00 34.95 32.98 2o6g s ARG 33 CO 0.00 0.63 0.10 -0.59 0.02 0.00 0.00 175.30 175.46 2o6g s PHE 34 N -0.84 0.18 0.10 -0.53 -0.12 0.25 -2.11 117.98 114.92 2o6g s PHE 34 Ca 0.13 -0.47 0.03 0.00 -0.05 0.00 0.00 56.93 56.58 2o6g s PHE 34 Cb -0.11 -0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.11 2o6g s PHE 34 CO 0.03 -0.36 0.11 -0.98 -0.05 0.00 0.00 175.22 173.96 2o6g s ARG 35 N -2.55 2.94 -0.06 1.99 1.70 -0.71 0.48 118.95 122.74 2o6g s ARG 35 Ca -0.05 -0.72 -0.02 0.00 -0.47 0.00 0.00 55.73 54.47 2o6g s ARG 35 Cb -0.01 -2.73 0.04 0.00 -0.57 0.00 0.00 34.95 31.67 2o6g s ARG 35 CO -0.04 0.55 0.11 0.42 -1.08 0.00 0.00 175.30 175.25 2o6g s ILE 36 N -1.49 -0.14 1.06 4.99 -1.09 0.78 -3.38 121.20 121.92 2o6g s ILE 36 Ca 0.30 0.30 -0.14 0.00 -2.23 0.00 0.00 60.65 58.88 2o6g s ILE 36 Cb -0.12 -0.21 0.14 0.00 -1.58 0.00 0.00 42.46 40.70 2o6g s ILE 36 CO 0.23 0.13 0.58 -2.65 -1.23 0.00 0.00 174.94 172.00 2o6g n PRO 37 N 4.82 -1.29 -2.37 2.79 -0.02 -1.15 -0.92 135.00 136.85 2o6g n PRO 37 Ca -0.14 -0.34 -0.03 0.00 -2.02 0.00 0.00 63.50 60.97 2o6g n PRO 37 Cb 0.50 -1.99 0.06 0.00 -0.02 0.00 0.00 33.50 32.06 2o6g n PRO 37 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 2o6g n TRP 38 N -4.33 -1.26 -1.81 6.00 -0.00 -1.10 -4.63 117.44 110.31 2o6g n TRP 38 Ca 0.05 -1.10 -0.42 0.00 -0.00 0.00 0.00 57.50 56.03 2o6g n TRP 38 Cb 0.56 1.23 -0.03 0.00 -0.00 0.00 0.00 31.31 33.07 2o6g n TRP 38 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 177.69 177.90 2o6g s LYS 39 N 0.09 4.16 0.53 5.87 2.20 -1.26 -4.61 119.74 126.71 2o6g s LYS 39 Ca 0.08 2.45 -0.21 0.00 -0.36 0.00 0.00 55.97 57.93 2o6g s LYS 39 Cb 0.24 -4.03 -0.07 0.00 -1.51 0.00 0.00 37.83 32.46 2o6g s LYS 39 CO -0.06 -0.90 1.10 1.58 -0.36 0.00 0.00 175.35 176.71 2o6g n HIS 40 N 7.16 1.38 -0.36 4.03 -0.00 -1.26 -4.92 115.22 121.26 2o6g n HIS 40 Ca 0.19 0.47 0.03 0.00 -0.00 0.00 0.00 57.72 58.40 2o6g n HIS 40 Cb 0.41 -2.24 0.19 0.00 -0.00 0.00 0.00 29.99 28.35 2o6g n HIS 40 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 2o6g h GLY 41 N 1.12 1.51 2.00 1.57 0.00 -1.98 -3.16 103.07 104.12 2o6g h GLY 41 Ca -0.48 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.37 2o6g h GLY 41 CO 0.55 0.33 -0.07 1.41 0.00 0.00 0.00 176.54 178.75 2o6g h LEU 42 N 1.16 0.00 -9.74 3.11 3.38 -1.97 -3.46 115.31 107.79 2o6g h LEU 42 Ca 0.43 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.84 2o6g h LEU 42 Cb 0.18 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.02 2o6g h LEU 42 CO -0.17 0.07 0.70 0.54 0.09 0.00 0.00 178.44 179.67 2o6g n ARG 43 N -3.19 2.37 -0.34 1.13 1.74 -1.20 -4.90 116.66 112.27 2o6g n ARG 43 Ca 0.01 0.84 0.03 0.00 -0.77 0.00 0.00 57.85 57.96 2o6g n ARG 43 Cb 0.36 -2.53 0.21 0.00 -1.02 0.00 0.00 32.46 29.48 2o6g n ARG 43 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2o6g h GLN 44 N 3.84 1.08 -0.19 5.56 1.08 -1.92 -2.17 115.11 122.38 2o6g h GLN 44 Ca -0.47 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 56.67 2o6g h GLN 44 Cb 1.26 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 28.44 2o6g h GLN 44 CO 0.72 0.71 0.00 -0.40 -0.95 0.00 0.00 178.83 178.92 2o6g n ASP 45 N -4.49 0.19 -4.50 1.46 5.75 -1.26 -4.79 116.55 108.91 2o6g n ASP 45 Ca 0.14 -1.93 -0.43 0.00 -0.01 0.00 0.00 54.79 52.57 2o6g n ASP 45 Cb 0.19 -0.10 -0.08 0.00 -1.03 0.00 0.00 41.12 40.10 2o6g n ASP 45 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2o6g s ALA 46 N -1.80 3.42 0.24 2.12 0.00 -0.82 -5.03 121.76 119.89 2o6g s ALA 46 Ca 0.00 -1.43 0.02 0.00 0.00 0.00 0.00 51.96 50.55 2o6g s ALA 46 Cb 0.00 -3.07 0.02 0.00 0.00 0.00 0.00 23.12 20.07 2o6g s ALA 46 CO 0.00 -1.57 0.17 1.04 0.00 0.00 0.00 175.76 175.40 2o6g n GLN 47 N 5.68 1.15 0.00 0.00 6.02 -1.26 -4.99 117.38 123.98 2o6g n GLN 47 Ca -0.06 -1.48 0.14 0.00 -0.01 0.00 0.00 57.00 55.59 2o6g n GLN 47 Cb 0.48 0.16 0.68 0.00 1.02 0.00 0.00 30.24 32.58 2o6g n GLN 47 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2o6g n GLN 48 N -1.04 0.49 0.24 -1.09 10.64 -1.26 -2.70 117.38 122.66 2o6g n GLN 48 Ca -0.01 -0.08 0.15 0.00 -1.83 0.00 0.00 57.00 55.23 2o6g n GLN 48 Cb 0.27 -1.50 0.55 0.00 -0.86 0.00 0.00 30.24 28.70 2o6g n GLN 48 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 2o6g h GLU 49 N 0.21 0.00 -0.07 2.61 4.81 -1.99 -2.37 114.58 117.78 2o6g h GLU 49 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2o6g h GLU 49 Cb 0.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2o6g h GLU 49 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.03 2o6g n ASP 50 N -2.92 1.37 -1.53 1.04 9.92 -1.10 -3.40 116.55 119.93 2o6g n ASP 50 Ca 0.02 -1.54 -0.04 0.00 -0.53 0.00 0.00 54.79 52.70 2o6g n ASP 50 Cb 0.34 -0.04 0.09 0.00 -0.64 0.00 0.00 41.12 40.87 2o6g n ASP 50 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2o6g n PHE 51 N 0.09 0.97 -0.18 1.24 3.01 -0.89 -4.53 117.46 117.16 2o6g n PHE 51 Ca 0.18 -1.60 -0.08 0.00 1.01 0.00 0.00 57.45 56.96 2o6g n PHE 51 Cb 0.31 -0.25 0.02 0.00 -0.01 0.00 0.00 39.48 39.55 2o6g n PHE 51 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2o6g h GLY 52 N 1.58 0.81 1.00 1.37 0.00 -1.61 0.10 103.07 106.33 2o6g h GLY 52 Ca 0.04 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.86 2o6g h GLY 52 CO 0.26 0.39 -0.14 -2.22 0.00 0.00 0.00 176.54 174.83 2o6g h ILE 53 N 0.70 1.28 -0.80 2.60 5.03 -1.90 0.37 117.51 124.78 2o6g h ILE 53 Ca 0.18 -1.25 -0.01 0.00 -0.12 0.00 0.00 64.86 63.66 2o6g h ILE 53 Cb 0.13 1.24 -0.04 0.00 -3.03 0.00 0.00 36.82 35.11 2o6g h ILE 53 CO -0.02 0.42 0.47 -0.26 -0.68 0.00 0.00 178.15 178.08 2o6g h PHE 54 N 0.62 1.07 -0.37 1.37 0.04 -1.83 0.95 116.94 118.80 2o6g h PHE 54 Ca 0.10 -0.01 -0.14 0.00 2.80 0.00 0.00 57.97 60.72 2o6g h PHE 54 Cb 0.68 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 38.47 2o6g h PHE 54 CO 0.05 0.72 -0.32 0.37 -0.60 0.00 0.00 178.31 178.53 2o6g h GLN 55 N 1.11 0.81 -0.73 1.51 4.15 -0.44 -2.35 115.11 119.16 2o6g h GLN 55 Ca 0.29 -0.38 -0.04 0.00 0.77 0.00 0.00 58.65 59.29 2o6g h GLN 55 Cb -0.02 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 2o6g h GLN 55 CO -0.05 1.02 0.32 0.00 -1.93 0.00 0.00 178.83 178.19 2o6g h ALA 56 N 0.95 0.95 -0.55 3.38 0.00 0.85 0.12 119.26 124.97 2o6g h ALA 56 Ca 0.07 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2o6g h ALA 56 Cb 0.87 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2o6g h ALA 56 CO 0.08 0.55 0.02 2.35 0.00 0.00 0.00 179.25 182.25 2o6g h TRP 57 N 1.04 1.04 -0.46 0.00 -0.00 -0.79 0.13 115.95 116.91 2o6g h TRP 57 Ca 0.25 -0.17 -0.06 0.00 -0.00 0.00 0.00 58.89 58.90 2o6g h TRP 57 Cb 0.17 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.04 2o6g h TRP 57 CO 0.01 0.94 0.05 0.00 -0.00 0.00 0.00 178.44 179.44 2o6g h ALA 58 N 0.97 0.62 -0.49 2.65 0.00 -0.89 -0.41 119.26 121.71 2o6g h ALA 58 Ca 0.16 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2o6g h ALA 58 Cb 0.51 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2o6g h ALA 58 CO 0.02 0.37 -0.05 0.93 0.00 0.00 0.00 179.25 180.53 2o6g h GLU 59 N 0.65 0.85 -0.58 0.00 5.08 -0.83 0.17 114.58 119.92 2o6g h GLU 59 Ca 0.14 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 2o6g h GLU 59 Cb 0.43 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 2o6g h GLU 59 CO 0.01 0.88 0.13 0.00 -1.00 0.00 0.00 179.01 179.03 2o6g h ALA 60 N 1.16 1.13 -0.16 3.43 0.00 -0.25 -2.78 119.26 121.79 2o6g h ALA 60 Ca 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2o6g h ALA 60 Cb 0.53 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2o6g h ALA 60 CO 0.03 0.58 0.00 0.25 0.00 0.00 0.00 179.25 180.11 2o6g n THR 61 N -4.25 0.20 -0.75 0.00 -2.24 -0.21 -4.70 114.28 102.33 2o6g n THR 61 Ca 0.04 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2o6g n THR 61 Cb 0.25 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.93 2o6g n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2o6g n GLY 62 N 1.17 1.03 0.27 3.38 0.00 -1.05 -4.90 105.19 105.08 2o6g n GLY 62 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 2o6g n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o6g h ALA 63 N 0.00 0.68 -3.41 4.61 0.00 -1.27 -3.42 119.26 116.44 2o6g h ALA 63 Ca 0.00 -0.32 -0.66 0.00 0.00 0.00 0.00 54.91 53.93 2o6g h ALA 63 Cb 0.00 -0.18 -0.24 0.00 0.00 0.00 0.00 17.79 17.38 2o6g h ALA 63 CO 0.00 0.55 -0.72 -0.47 0.00 0.00 0.00 179.25 178.61 2o6g s TYR 64 N -4.89 2.90 -0.18 0.00 5.04 -0.41 -4.97 117.35 114.84 2o6g s TYR 64 Ca -0.12 -0.39 -0.03 0.00 -2.44 0.00 0.00 57.07 54.09 2o6g s TYR 64 Cb 0.12 -1.85 0.06 0.00 0.35 0.00 0.00 41.96 40.64 2o6g s TYR 64 CO 0.84 -0.04 0.04 0.08 -1.34 0.00 0.00 175.55 175.13 2o6g s VAL 65 N 0.11 0.41 0.26 3.14 1.01 -1.26 -4.00 120.40 120.07 2o6g s VAL 65 Ca -0.04 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.18 2o6g s VAL 65 Cb -0.14 -0.93 -0.12 0.00 0.00 0.00 0.00 36.38 35.19 2o6g s VAL 65 CO 0.04 -0.20 1.59 -2.65 0.00 0.00 0.00 175.10 173.88 2o6g n PRO 66 N 5.10 2.58 0.00 2.72 -0.02 -1.26 -1.99 135.00 142.12 2o6g n PRO 66 Ca -0.08 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 2o6g n PRO 66 Cb 0.48 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 2o6g n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o6g n GLY 67 N 2.61 3.09 0.07 -1.23 0.00 -1.26 -4.82 105.19 103.65 2o6g n GLY 67 Ca 0.11 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 2o6g n GLY 67 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2o6g h ARG 68 N 0.00 0.01 -6.45 1.61 2.43 -1.85 -3.46 114.38 106.67 2o6g h ARG 68 Ca 0.00 -0.01 -0.65 0.00 -0.81 0.00 0.00 59.98 58.51 2o6g h ARG 68 Cb 0.00 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 29.42 2o6g h ARG 68 CO 0.00 0.89 -0.70 -0.51 -1.51 0.00 0.00 179.97 178.14 2o6g s ASP 69 N -6.12 4.71 0.57 -3.80 1.01 -1.08 -5.06 116.67 106.90 2o6g s ASP 69 Ca -0.18 -0.29 -0.18 0.00 0.71 0.00 0.00 52.55 52.60 2o6g s ASP 69 Cb -0.02 -1.01 -0.05 0.00 1.01 0.00 0.00 42.92 42.85 2o6g s ASP 69 CO 0.69 0.17 1.12 -1.59 0.21 0.00 0.00 175.17 175.77 2o6g s LYS 70 N -2.32 3.25 0.33 8.23 0.00 -1.26 -4.77 119.74 123.20 2o6g s LYS 70 Ca 0.24 1.54 -0.27 0.00 0.00 0.00 0.00 55.97 57.48 2o6g s LYS 70 Cb -0.11 -2.00 -0.09 0.00 0.00 0.00 0.00 37.83 35.63 2o6g s LYS 70 CO 0.16 -0.92 1.04 -1.25 0.00 0.00 0.00 175.35 174.38 2o6g s PRO 71 N -3.49 4.45 -0.25 1.78 0.04 -1.26 -5.01 135.00 131.26 2o6g s PRO 71 Ca 0.71 1.58 -0.02 0.00 0.04 0.00 0.00 61.00 63.30 2o6g s PRO 71 Cb -0.22 -2.86 0.08 0.00 0.04 0.00 0.00 34.50 31.53 2o6g s PRO 71 CO 0.30 0.10 0.07 0.34 0.04 0.00 0.00 177.00 177.85 2o6g s ASP 72 N -1.31 3.38 0.08 6.66 -1.08 -1.26 -5.05 116.67 118.08 2o6g s ASP 72 Ca 0.51 -1.16 -0.17 0.00 -0.52 0.00 0.00 52.55 51.21 2o6g s ASP 72 Cb -0.25 -0.66 -0.12 0.00 -1.46 0.00 0.00 42.92 40.43 2o6g s ASP 72 CO 0.32 -0.36 1.36 -0.07 0.52 0.00 0.00 175.17 176.94 2o6g h LEU 73 N 8.21 0.65 -0.96 -1.34 -0.00 -2.00 -3.14 115.31 116.73 2o6g h LEU 73 Ca -0.16 -0.51 -0.00 0.00 -0.00 0.00 0.00 57.88 57.21 2o6g h LEU 73 Cb 1.07 -0.18 -0.05 0.00 -0.00 0.00 0.00 40.66 41.50 2o6g h LEU 73 CO 0.40 1.03 0.59 -0.65 -0.00 0.00 0.00 178.44 179.81 2o6g h PRO 74 N 0.28 1.29 -0.45 1.13 0.11 -2.00 -2.08 132.00 130.28 2o6g h PRO 74 Ca 0.02 -0.11 -0.11 0.00 0.11 0.00 0.00 66.00 65.92 2o6g h PRO 74 Cb 0.89 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 2o6g h PRO 74 CO 0.07 0.89 -0.13 1.15 -0.21 0.00 0.00 178.00 179.77 2o6g h THR 75 N 1.31 1.27 -0.80 -1.15 2.02 -2.00 -1.00 112.91 112.57 2o6g h THR 75 Ca 0.35 -1.26 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 2o6g h THR 75 Cb -0.08 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 2o6g h THR 75 CO -0.07 0.43 0.43 -0.50 0.37 0.00 0.00 175.52 176.18 2o6g h TRP 76 N 0.71 1.10 -0.19 3.16 6.55 -1.40 0.21 115.95 126.10 2o6g h TRP 76 Ca 0.11 -0.03 -0.07 0.00 0.95 0.00 0.00 58.89 59.86 2o6g h TRP 76 Cb 0.68 -0.35 -0.00 0.00 -0.86 0.00 0.00 29.16 28.63 2o6g h TRP 76 CO 0.05 0.77 -0.14 -0.22 -1.05 0.00 0.00 178.44 177.85 2o6g h LYS 77 N 1.11 0.43 -0.48 0.49 3.64 -1.20 -0.66 116.57 119.89 2o6g h LYS 77 Ca 0.28 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2o6g h LYS 77 Cb 0.04 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2o6g h LYS 77 CO -0.04 0.76 0.12 0.07 -2.27 0.00 0.00 179.45 178.08 2o6g h ARG 78 N 0.10 0.73 -0.44 1.90 0.11 -0.94 0.24 114.38 116.07 2o6g h ARG 78 Ca 0.03 -0.14 -0.06 0.00 0.10 0.00 0.00 59.98 59.91 2o6g h ARG 78 Cb 0.66 -0.12 -0.02 0.00 1.11 0.00 0.00 29.97 31.61 2o6g h ARG 78 CO 0.04 0.66 0.03 -0.91 0.10 0.00 0.00 179.97 179.89 2o6g h ASN 79 N 0.71 0.74 -0.50 0.08 4.21 -0.87 -0.87 115.58 119.07 2o6g h ASN 79 Ca 0.16 -0.29 -0.05 0.00 1.21 0.00 0.00 56.30 57.33 2o6g h ASN 79 Cb 0.26 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 37.25 2o6g h ASN 79 CO -0.00 0.84 0.13 0.15 -1.29 0.00 0.00 177.43 177.26 2o6g h PHE 80 N 0.61 0.84 -0.34 1.19 3.57 -0.02 -2.62 116.94 120.16 2o6g h PHE 80 Ca 0.13 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 2o6g h PHE 80 Cb 0.45 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2o6g h PHE 80 CO 0.03 0.75 0.13 -0.09 -2.23 0.00 0.00 178.31 176.90 2o6g h ARG 81 N 0.69 0.51 -0.35 1.11 2.43 -0.84 -2.76 114.38 115.17 2o6g h ARG 81 Ca 0.16 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.16 2o6g h ARG 81 Cb 0.33 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2o6g h ARG 81 CO 0.00 0.52 -0.09 0.77 -1.51 0.00 0.00 179.97 179.66 2o6g h SER 82 N 0.40 0.58 -0.71 -3.80 0.02 -1.08 -1.84 113.55 107.11 2o6g h SER 82 Ca 0.11 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2o6g h SER 82 Cb 0.20 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 2o6g h SER 82 CO -0.01 0.72 0.33 0.00 -1.14 0.00 0.00 176.83 176.73 2o6g h ALA 83 N 1.34 0.92 -0.24 3.77 0.00 -1.32 -2.85 119.26 120.88 2o6g h ALA 83 Ca 0.10 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 2o6g h ALA 83 Cb 0.50 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2o6g h ALA 83 CO 0.03 0.50 -0.42 -0.07 0.00 0.00 0.00 179.25 179.28 2o6g h LEU 84 N 1.00 0.62 -0.76 0.00 3.38 -1.15 -3.32 115.31 115.08 2o6g h LEU 84 Ca 0.24 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2o6g h LEU 84 Cb 0.14 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 2o6g h LEU 84 CO -0.03 0.97 0.50 0.78 0.09 0.00 0.00 178.44 180.75 2o6g h ASN 85 N 0.48 0.86 1.10 -0.43 2.35 -1.11 -2.09 115.58 116.74 2o6g h ASN 85 Ca 0.04 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2o6g h ASN 85 Cb 0.93 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 2o6g h ASN 85 CO 0.08 0.61 -0.04 0.03 -1.65 0.00 0.00 177.43 176.46 2o6g h ARG 86 N 1.01 0.00 -6.17 0.81 3.08 -1.65 -3.44 114.38 108.03 2o6g h ARG 86 Ca 0.29 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.75 2o6g h ARG 86 Cb -0.08 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2o6g h ARG 86 CO -0.07 0.04 1.35 0.15 -1.07 0.00 0.00 179.97 180.37 2o6g s LYS 87 N -3.62 3.28 0.86 0.04 -0.14 -0.79 -4.98 119.74 114.39 2o6g s LYS 87 Ca 0.02 1.67 -0.11 0.00 -1.36 0.00 0.00 55.97 56.19 2o6g s LYS 87 Cb 0.09 -4.26 0.11 0.00 -1.68 0.00 0.00 37.83 32.09 2o6g s LYS 87 CO 0.57 -1.93 1.10 -1.21 -0.76 0.00 0.00 175.35 173.12 2o6g s GLU 88 N 5.88 1.49 -1.31 1.68 0.41 -1.26 -3.46 118.70 122.14 2o6g s GLU 88 Ca 0.88 1.11 -0.02 0.00 -0.41 0.00 0.00 54.97 56.53 2o6g s GLU 88 Cb -0.27 -1.81 0.00 0.00 -1.78 0.00 0.00 34.13 30.27 2o6g s GLU 88 CO 0.34 -2.16 0.24 0.41 -0.49 0.00 0.00 175.26 173.60 2o6g n GLY 89 N -0.78 -0.28 3.37 -1.39 0.00 -1.26 -4.97 105.19 99.88 2o6g n GLY 89 Ca 0.09 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 45.99 2o6g n GLY 89 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2o6g s LEU 90 N -5.00 -0.75 0.19 0.99 2.96 -1.22 -2.89 118.68 112.96 2o6g s LEU 90 Ca 0.12 0.85 0.09 0.00 -0.22 0.00 0.00 54.13 54.96 2o6g s LEU 90 Cb -0.05 1.78 -0.04 0.00 0.50 0.00 0.00 46.19 48.37 2o6g s LEU 90 CO 0.15 -0.14 -0.17 0.00 -1.32 0.00 0.00 176.35 174.86 2o6g s ARG 91 N 2.66 1.35 -0.08 1.98 1.70 -0.61 -4.84 118.95 121.11 2o6g s ARG 91 Ca -0.00 -1.52 -0.26 0.00 -0.47 0.00 0.00 55.73 53.48 2o6g s ARG 91 Cb -0.09 -1.32 -0.03 0.00 -0.57 0.00 0.00 34.95 32.94 2o6g s ARG 91 CO -0.17 0.25 0.83 -1.17 -1.08 0.00 0.00 175.30 173.96 2o6g s LEU 92 N -2.99 4.29 0.00 -1.89 2.96 -1.26 -1.99 118.68 117.79 2o6g s LEU 92 Ca 0.20 1.34 0.00 0.00 -0.22 0.00 0.00 54.13 55.45 2o6g s LEU 92 Cb -0.04 -3.29 0.00 0.00 0.50 0.00 0.00 46.19 43.36 2o6g s LEU 92 CO 0.08 -0.25 0.00 0.00 -1.32 0.00 0.00 176.35 174.86 2o6g n ALA 93 N 4.25 0.00 -2.74 5.97 0.00 -0.70 -4.96 120.51 122.34 2o6g n ALA 93 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 2o6g n ALA 93 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 2o6g n ALA 93 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2o6g s GLU 94 N 0.02 2.78 -0.99 0.00 2.02 -1.25 -5.02 118.70 116.27 2o6g s GLU 94 Ca 0.00 -0.71 -0.06 0.00 0.02 0.00 0.00 54.97 54.21 2o6g s GLU 94 Cb 0.00 -2.68 0.25 0.00 0.10 0.00 0.00 34.13 31.80 2o6g s GLU 94 CO 0.00 0.57 0.93 0.34 0.02 0.00 0.00 175.26 177.12 2o6g s ASP 95 N -2.25 6.68 -0.32 -0.19 3.68 -1.26 -3.50 116.67 119.52 2o6g s ASP 95 Ca 0.27 -3.57 0.00 0.00 2.13 0.00 0.00 52.55 51.39 2o6g s ASP 95 Cb -0.12 -2.08 0.31 0.00 -1.45 0.00 0.00 42.92 39.58 2o6g s ASP 95 CO 0.19 -0.27 1.78 0.54 0.13 0.00 0.00 175.17 177.55 2o6g n ARG 96 N 2.66 1.83 0.05 4.34 5.12 -0.19 -4.59 116.66 125.87 2o6g n ARG 96 Ca 0.22 -1.76 -0.13 0.00 -1.93 0.00 0.00 57.85 54.25 2o6g n ARG 96 Cb 0.39 -1.69 -0.09 0.00 -1.16 0.00 0.00 32.46 29.91 2o6g n ARG 96 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2o6g h SER 97 N 1.09 -0.11 -0.00 0.55 4.64 -1.72 1.57 113.55 119.56 2o6g h SER 97 Ca 0.35 -0.33 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2o6g h SER 97 Cb 1.43 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.55 2o6g h SER 97 CO 0.76 0.29 0.00 2.29 -0.87 0.00 0.00 176.83 179.30 2o6g n LYS 98 N -4.97 1.10 -1.63 4.77 0.00 -1.26 -4.29 118.16 111.88 2o6g n LYS 98 Ca -0.09 -0.15 -0.51 0.00 -0.00 0.00 0.00 58.31 57.57 2o6g n LYS 98 Cb 0.23 -1.48 -0.06 0.00 -0.00 0.00 0.00 35.03 33.72 2o6g n LYS 98 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2o6g n ASP 99 N -0.80 2.93 -0.28 -5.58 -0.08 -1.22 -4.89 116.55 106.62 2o6g n ASP 99 Ca 0.22 0.83 0.09 0.00 -1.51 0.00 0.00 54.79 54.43 2o6g n ASP 99 Cb 0.14 -1.31 0.24 0.00 2.34 0.00 0.00 41.12 42.54 2o6g n ASP 99 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2o6g h PRO 100 N 9.81 0.31 0.00 -0.67 0.11 -1.92 -2.71 132.00 136.93 2o6g h PRO 100 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2o6g h PRO 100 Cb 1.29 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2o6g h PRO 100 CO 0.97 0.20 -0.45 1.58 -0.21 0.00 0.00 178.00 180.09 2o6g n HIS 101 N -5.12 0.65 -3.83 0.65 -0.00 -1.26 -4.75 115.22 101.56 2o6g n HIS 101 Ca 0.18 0.28 -0.31 0.00 0.46 0.00 0.00 57.72 58.34 2o6g n HIS 101 Cb 0.56 -0.63 -0.11 0.00 -0.12 0.00 0.00 29.99 29.69 2o6g n HIS 101 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 2o6g s ASP 102 N -5.31 5.08 0.26 0.26 2.15 -1.26 -5.07 116.67 112.78 2o6g s ASP 102 Ca -0.13 -3.64 -0.30 0.00 0.43 0.00 0.00 52.55 48.91 2o6g s ASP 102 Cb 0.02 -1.72 -0.09 0.00 -0.30 0.00 0.00 42.92 40.82 2o6g s ASP 102 CO 0.19 -0.15 1.09 -2.16 -0.17 0.00 0.00 175.17 173.98 2o6g s PRO 103 N -1.18 4.64 -0.03 4.34 0.04 -1.02 -4.82 135.00 136.97 2o6g s PRO 103 Ca 0.24 1.78 -0.15 0.00 0.04 0.00 0.00 61.00 62.90 2o6g s PRO 103 Cb -0.09 -3.21 0.05 0.00 0.04 0.00 0.00 34.50 31.29 2o6g s PRO 103 CO -0.12 0.19 0.68 -2.39 0.04 0.00 0.00 177.00 175.40 2o6g n HIS 104 N 1.45 -0.15 -3.90 0.56 1.44 0.54 -2.72 115.22 112.45 2o6g n HIS 104 Ca -0.00 -0.32 -0.10 0.00 -2.01 0.00 0.00 57.72 55.29 2o6g n HIS 104 Cb 0.45 0.14 -0.09 0.00 0.12 0.00 0.00 29.99 30.61 2o6g n HIS 104 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2o6g s LYS 105 N -2.00 0.56 -0.11 -1.40 1.02 -0.10 -1.02 119.74 116.69 2o6g s LYS 105 Ca 0.16 -0.61 0.03 0.00 0.02 0.00 0.00 55.97 55.58 2o6g s LYS 105 Cb -0.00 0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.54 2o6g s LYS 105 CO -0.01 -0.14 -0.21 0.96 -0.92 0.00 0.00 175.35 175.03 2o6g s ILE 106 N -2.15 1.91 0.12 2.17 -4.36 -1.23 -0.16 121.20 117.50 2o6g s ILE 106 Ca -0.09 -0.91 0.06 0.00 -0.26 0.00 0.00 60.65 59.45 2o6g s ILE 106 Cb -0.04 -1.67 -0.04 0.00 1.25 0.00 0.00 42.46 41.96 2o6g s ILE 106 CO -0.02 0.52 -0.01 -0.31 0.24 0.00 0.00 174.94 175.37 2o6g s TYR 107 N 0.59 2.92 0.00 1.37 1.51 0.18 -1.72 117.35 122.21 2o6g s TYR 107 Ca -0.13 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 55.87 2o6g s TYR 107 Cb -0.17 -1.48 -0.01 0.00 -0.11 0.00 0.00 41.96 40.20 2o6g s TYR 107 CO 0.04 0.49 -0.05 -2.00 -1.11 0.00 0.00 175.55 172.91 2o6g s GLU 108 N -2.53 0.43 -0.05 -0.62 2.12 -0.84 0.86 118.70 118.07 2o6g s GLU 108 Ca 0.26 -0.25 -0.25 0.00 0.36 0.00 0.00 54.97 55.10 2o6g s GLU 108 Cb -0.11 -0.39 -0.04 0.00 0.26 0.00 0.00 34.13 33.86 2o6g s GLU 108 CO 0.18 0.10 0.75 -0.06 -0.54 0.00 0.00 175.26 175.70 2o6g s PHE 109 N -0.26 3.60 0.48 5.30 0.08 0.04 -1.57 117.98 125.65 2o6g s PHE 109 Ca 0.01 1.33 0.02 0.00 0.12 0.00 0.00 56.93 58.41 2o6g s PHE 109 Cb -0.03 -2.86 -0.01 0.00 -0.57 0.00 0.00 43.02 39.55 2o6g s PHE 109 CO -0.00 0.07 0.06 0.14 -0.10 0.00 0.00 175.22 175.40 2o6g s VAL 110 N 0.82 0.83 -0.09 -0.44 -7.23 -1.14 -4.93 120.40 108.22 2o6g s VAL 110 Ca 0.40 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.58 2o6g s VAL 110 Cb -0.18 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.60 2o6g s VAL 110 CO 0.20 0.00 0.52 0.59 -0.31 0.00 0.00 175.10 176.10