#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o9a s HIS 2 N 0.00 1.17 -0.21 1.61 5.04 -1.26 -4.86 115.29 116.78 2o9a s HIS 2 Ca 0.00 -0.49 -0.21 0.00 -1.54 0.00 0.00 55.06 52.81 2o9a s HIS 2 Cb 0.00 -1.02 -0.02 0.00 0.04 0.00 0.00 32.58 31.58 2o9a s HIS 2 CO 0.00 -0.39 0.67 -1.64 -2.34 0.00 0.00 174.74 171.04 2o9a s MET 3 N 1.52 4.19 0.22 2.88 -1.94 -1.26 -5.00 119.30 119.91 2o9a s MET 3 Ca 0.00 0.67 0.05 0.00 -1.71 0.00 0.00 55.69 54.70 2o9a s MET 3 Cb -0.13 -3.60 -0.05 0.00 2.01 0.00 0.00 34.83 33.05 2o9a s MET 3 CO -0.05 -0.32 -0.05 -1.54 -0.01 0.00 0.00 175.02 173.05 2o9a s SER 4 N 1.28 2.06 0.36 3.03 1.04 -1.26 -5.03 113.70 115.18 2o9a s SER 4 Ca 0.30 -1.14 0.05 0.00 0.48 0.00 0.00 55.95 55.63 2o9a s SER 4 Cb -0.16 -0.04 0.72 0.00 0.10 0.00 0.00 66.02 66.64 2o9a s SER 4 CO 0.10 -0.40 1.98 -0.09 0.98 0.00 0.00 173.24 175.81 2o9a h ARG 5 N 2.53 0.75 -0.56 4.02 2.43 -1.99 -1.39 114.38 120.17 2o9a h ARG 5 Ca -0.38 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 58.64 2o9a h ARG 5 Cb 1.22 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 2o9a h ARG 5 CO 0.64 0.49 -0.06 -0.97 -1.51 0.00 0.00 179.97 178.57 2o9a h ASN 6 N 0.77 0.99 -0.72 -3.80 -1.24 -1.99 0.10 115.58 109.70 2o9a h ASN 6 Ca 0.27 -0.30 -0.00 0.00 0.71 0.00 0.00 56.30 56.98 2o9a h ASN 6 Cb 0.12 -0.27 -0.03 0.00 0.73 0.00 0.00 38.32 38.87 2o9a h ASN 6 CO -0.08 1.08 0.43 0.25 -1.29 0.00 0.00 177.43 177.82 2o9a h LEU 7 N 0.91 0.86 -0.53 0.34 6.46 -1.84 -1.67 115.31 119.84 2o9a h LEU 7 Ca 0.15 -0.06 -0.08 0.00 -0.12 0.00 0.00 57.88 57.77 2o9a h LEU 7 Cb 0.60 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 2o9a h LEU 7 CO 0.04 0.67 -0.00 -0.07 -0.62 0.00 0.00 178.44 178.46 2o9a h LEU 8 N 0.98 0.91 -0.66 2.25 3.38 -0.66 -1.52 115.31 120.00 2o9a h LEU 8 Ca 0.26 -0.31 0.07 0.00 0.09 0.00 0.00 57.88 57.99 2o9a h LEU 8 Cb -0.03 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.41 2o9a h LEU 8 CO -0.05 1.00 0.34 0.00 0.09 0.00 0.00 178.44 179.83 2o9a h ALA 9 N 0.95 0.89 -0.45 1.53 0.00 -0.63 0.75 119.26 122.30 2o9a h ALA 9 Ca 0.15 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 2o9a h ALA 9 Cb 0.53 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2o9a h ALA 9 CO 0.03 -0.01 -0.13 0.82 0.00 0.00 0.00 179.25 179.96 2o9a h ILE 10 N 0.62 1.27 -0.01 0.00 2.04 -0.66 -3.25 117.51 117.52 2o9a h ILE 10 Ca 0.31 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.91 2o9a h ILE 10 Cb 0.25 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2o9a h ILE 10 CO -0.21 0.43 -0.46 1.33 0.00 0.00 0.00 178.15 179.24 2o9a n VAL 11 N -4.24 0.00 -0.37 1.67 0.24 -0.63 -4.37 118.33 110.63 2o9a n VAL 11 Ca -0.00 -0.14 0.02 0.00 -2.04 0.00 0.00 64.34 62.17 2o9a n VAL 11 Cb 0.40 0.76 0.08 0.00 -1.47 0.00 0.00 33.84 33.60 2o9a n VAL 11 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 2o9a n HIS 12 N -0.65 0.15 0.27 6.34 -0.00 0.24 -1.08 115.22 120.49 2o9a n HIS 12 Ca 0.09 1.21 0.09 0.00 -0.00 0.00 0.00 57.72 59.12 2o9a n HIS 12 Cb 0.39 -0.94 0.69 0.00 -0.00 0.00 0.00 29.99 30.13 2o9a n HIS 12 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2o9a h PRO 13 N 0.00 0.00 -0.29 1.57 0.11 -1.82 0.15 132.00 131.73 2o9a h PRO 13 Ca 0.39 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.48 2o9a h PRO 13 Cb 0.64 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 2o9a h PRO 13 CO -0.99 0.01 0.09 0.82 -0.21 0.00 0.00 178.00 177.71 2o9a h ILE 14 N 0.00 1.20 -0.22 4.15 2.04 -1.41 0.14 117.51 123.41 2o9a h ILE 14 Ca -0.00 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 2o9a h ILE 14 Cb 0.01 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2o9a h ILE 14 CO 0.00 0.22 0.04 -0.07 0.00 0.00 0.00 178.15 178.34 2o9a h LEU 15 N 0.31 0.35 -0.49 1.44 4.07 -0.77 -2.00 115.31 118.22 2o9a h LEU 15 Ca 0.09 -0.25 0.04 0.00 0.08 0.00 0.00 57.88 57.84 2o9a h LEU 15 Cb 0.25 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 41.85 2o9a h LEU 15 CO -0.00 0.52 0.25 -0.09 -1.08 0.00 0.00 178.44 178.04 2o9a h ARG 16 N 0.17 0.48 -0.90 1.13 2.43 -0.72 -0.73 114.38 116.25 2o9a h ARG 16 Ca 0.07 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2o9a h ARG 16 Cb 0.31 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 2o9a h ARG 16 CO 0.00 0.32 0.53 -0.91 -1.51 0.00 0.00 179.97 178.40 2o9a h ASN 17 N 0.49 1.10 -0.67 -3.80 2.35 -0.64 0.20 115.58 114.61 2o9a h ASN 17 Ca 0.21 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 2o9a h ASN 17 Cb 0.12 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 2o9a h ASN 17 CO -0.15 0.86 0.28 0.25 -1.65 0.00 0.00 177.43 177.02 2o9a h LEU 18 N 1.25 0.91 -0.46 1.61 5.85 -0.95 -0.03 115.31 123.48 2o9a h LEU 18 Ca 0.32 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2o9a h LEU 18 Cb -0.02 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 2o9a h LEU 18 CO -0.06 0.82 0.07 -0.03 -0.34 0.00 0.00 178.44 178.91 2o9a h MET 19 N 0.94 0.76 -0.38 1.25 4.05 -0.59 -1.23 114.93 119.72 2o9a h MET 19 Ca 0.22 -0.20 -0.06 0.00 -0.28 0.00 0.00 59.70 59.38 2o9a h MET 19 Cb 0.19 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.88 2o9a h MET 19 CO -0.02 0.77 -0.01 0.93 0.23 0.00 0.00 176.91 178.82 2o9a h GLU 20 N 0.62 0.60 0.10 0.39 5.08 -0.69 0.84 114.58 121.52 2o9a h GLU 20 Ca 0.14 -0.14 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 2o9a h GLU 20 Cb 0.38 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.57 2o9a h GLU 20 CO 0.01 0.63 -0.67 1.49 -1.00 0.00 0.00 179.01 179.47 2o9a h GLU 21 N 0.57 0.28 0.00 2.33 4.81 -0.89 -3.35 114.58 118.32 2o9a h GLU 21 Ca 0.12 -0.43 -0.15 0.00 -0.13 0.00 0.00 59.36 58.77 2o9a h GLU 21 Cb 0.37 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 2o9a h GLU 21 CO 0.01 1.18 -0.72 0.66 -0.73 0.00 0.00 179.01 179.41 2o9a h SER 22 N -0.41 0.00 -0.04 1.04 4.64 -1.24 -3.48 113.55 114.07 2o9a h SER 22 Ca -0.11 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.19 2o9a h SER 22 Cb 1.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.58 2o9a h SER 22 CO 0.13 0.72 -0.01 0.61 -0.87 0.00 0.00 176.83 177.40 2o9a n GLY 23 N 1.09 0.46 3.48 -0.77 0.00 0.28 -5.03 105.19 104.71 2o9a n GLY 23 Ca 0.01 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 2o9a n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o9a s GLU 24 N -0.76 1.67 0.35 1.61 0.41 -1.21 -4.78 118.70 115.98 2o9a s GLU 24 Ca 0.00 -1.87 -0.28 0.00 -0.41 0.00 0.00 54.97 52.41 2o9a s GLU 24 Cb 0.00 -1.29 -0.11 0.00 -1.78 0.00 0.00 34.13 30.95 2o9a s GLU 24 CO 0.00 0.02 1.37 0.99 -0.49 0.00 0.00 175.26 177.15 2o9a s THR 25 N -2.93 2.47 -0.10 3.63 2.01 -1.18 -4.33 115.64 115.22 2o9a s THR 25 Ca 0.32 0.47 0.03 0.00 0.31 0.00 0.00 61.69 62.82 2o9a s THR 25 Cb 0.05 -3.30 0.01 0.00 0.01 0.00 0.00 72.50 69.26 2o9a s THR 25 CO 0.14 0.11 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.29 2o9a s VAL 26 N -1.13 1.82 0.03 3.82 1.01 -0.40 -1.06 120.40 124.49 2o9a s VAL 26 Ca 0.50 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.67 2o9a s VAL 26 Cb -0.42 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 2o9a s VAL 26 CO 0.57 0.51 -0.13 0.20 0.00 0.00 0.00 175.10 176.25 2o9a s ASN 27 N 0.59 4.19 -0.11 3.32 0.01 -0.05 -0.18 114.94 122.71 2o9a s ASN 27 Ca -0.14 -0.30 0.02 0.00 -0.71 0.00 0.00 52.86 51.72 2o9a s ASN 27 Cb -0.17 -0.82 0.01 0.00 0.41 0.00 0.00 41.25 40.68 2o9a s ASN 27 CO 0.04 0.26 -0.16 -0.32 -1.51 0.00 0.00 177.10 175.42 2o9a s MET 28 N -1.49 2.29 0.11 -0.60 1.75 0.14 -0.81 119.30 120.71 2o9a s MET 28 Ca 0.16 -0.59 0.09 0.00 -1.25 0.00 0.00 55.69 54.10 2o9a s MET 28 Cb -0.11 -1.95 -0.04 0.00 2.84 0.00 0.00 34.83 35.57 2o9a s MET 28 CO 0.07 -0.07 -0.18 0.00 -0.65 0.00 0.00 175.02 174.19 2o9a s ALA 29 N 1.00 2.67 0.07 4.11 0.00 -0.37 -0.30 121.76 128.95 2o9a s ALA 29 Ca -0.06 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 50.59 2o9a s ALA 29 Cb -0.15 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 2o9a s ALA 29 CO -0.02 0.59 0.06 0.14 0.00 0.00 0.00 175.76 176.53 2o9a s VAL 30 N -1.13 4.44 -0.23 0.00 -7.23 0.57 -1.06 120.40 115.75 2o9a s VAL 30 Ca 0.18 -0.76 -0.24 0.00 -1.81 0.00 0.00 61.98 59.34 2o9a s VAL 30 Cb -0.11 -3.11 -0.01 0.00 0.56 0.00 0.00 36.38 33.71 2o9a s VAL 30 CO 0.10 0.16 0.82 -0.22 -0.31 0.00 0.00 175.10 175.65 2o9a s LEU 31 N -2.26 4.09 -0.38 1.32 2.96 -0.80 -1.14 118.68 122.48 2o9a s LEU 31 Ca 0.27 1.04 -0.29 0.00 -0.22 0.00 0.00 54.13 54.93 2o9a s LEU 31 Cb -0.12 -3.18 0.02 0.00 0.50 0.00 0.00 46.19 43.41 2o9a s LEU 31 CO 0.20 -0.50 1.12 -0.62 -1.32 0.00 0.00 176.35 175.23 2o9a s ASP 32 N 1.32 6.80 0.05 3.68 3.68 0.40 -4.80 116.67 127.80 2o9a s ASP 32 Ca 0.35 0.85 0.27 0.00 2.13 0.00 0.00 52.55 56.15 2o9a s ASP 32 Cb -0.15 -2.55 0.97 0.00 -1.45 0.00 0.00 42.92 39.74 2o9a s ASP 32 CO 0.08 -1.04 1.77 0.00 0.13 0.00 0.00 175.17 176.11 2o9a n GLN 33 N 7.27 0.07 -0.08 4.34 1.13 -1.26 -1.71 117.38 127.14 2o9a n GLN 33 Ca 0.12 0.05 -0.20 0.00 -1.94 0.00 0.00 57.00 55.03 2o9a n GLN 33 Cb 0.48 -1.58 -0.12 0.00 0.11 0.00 0.00 30.24 29.13 2o9a n GLN 33 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2o9a h SER 34 N 0.00 0.05 -0.25 1.08 0.02 -1.98 -3.40 113.55 109.07 2o9a h SER 34 Ca 0.00 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 2o9a h SER 34 Cb 0.57 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2o9a h SER 34 CO 0.00 1.42 0.00 0.47 -1.14 0.00 0.00 176.83 177.58 2o9a n ASP 35 N -4.38 3.26 -3.62 3.07 8.00 -1.25 -4.99 116.55 116.63 2o9a n ASP 35 Ca -0.27 -1.98 -0.25 0.00 0.71 0.00 0.00 54.79 53.01 2o9a n ASP 35 Cb 0.68 -0.16 0.02 0.00 -0.02 0.00 0.00 41.12 41.64 2o9a n ASP 35 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2o9a n HIS 36 N 1.41 -2.12 -4.22 1.24 8.25 -0.70 -5.02 115.22 114.07 2o9a n HIS 36 Ca 0.17 0.66 -0.13 0.00 -0.26 0.00 0.00 57.72 58.16 2o9a n HIS 36 Cb 0.59 -3.33 -0.10 0.00 1.12 0.00 0.00 29.99 28.28 2o9a n HIS 36 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2o9a s GLU 37 N -5.22 0.97 -0.27 -0.41 2.02 -1.07 -4.83 118.70 109.89 2o9a s GLU 37 Ca 0.25 -1.39 -0.03 0.00 0.02 0.00 0.00 54.97 53.81 2o9a s GLU 37 Cb -0.10 -0.47 0.02 0.00 0.10 0.00 0.00 34.13 33.69 2o9a s GLU 37 CO 0.86 0.04 -0.01 0.00 0.02 0.00 0.00 175.26 176.17 2o9a s ALA 38 N -3.39 2.83 -0.15 5.21 0.00 -1.24 -0.45 121.76 124.58 2o9a s ALA 38 Ca 0.14 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 50.63 2o9a s ALA 38 Cb 0.03 -1.86 -0.00 0.00 0.00 0.00 0.00 23.12 21.29 2o9a s ALA 38 CO -0.01 -0.88 -0.16 0.42 0.00 0.00 0.00 175.76 175.12 2o9a s ILE 39 N 1.38 2.57 -0.13 0.00 1.01 -0.29 -1.02 121.20 124.73 2o9a s ILE 39 Ca 0.01 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.56 2o9a s ILE 39 Cb -0.17 -2.07 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 2o9a s ILE 39 CO -0.02 0.52 1.31 -0.63 0.00 0.00 0.00 174.94 176.12 2o9a s ILE 40 N 0.77 4.16 -0.10 2.92 1.01 0.32 -0.31 121.20 129.97 2o9a s ILE 40 Ca -0.06 1.43 0.01 0.00 0.00 0.00 0.00 60.65 62.03 2o9a s ILE 40 Cb -0.15 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2o9a s ILE 40 CO 0.00 -0.10 0.37 2.30 0.00 0.00 0.00 174.94 177.52 2o9a n ILE 41 N 5.24 0.00 -3.56 2.92 -6.64 0.59 0.43 119.36 118.33 2o9a n ILE 41 Ca 0.14 -0.49 -0.10 0.00 -1.77 0.00 0.00 62.75 60.52 2o9a n ILE 41 Cb 0.45 1.01 -0.02 0.00 -1.44 0.00 0.00 39.64 39.64 2o9a n ILE 41 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 2o9a s ASP 42 N -0.40 -0.46 -0.29 7.28 2.15 -1.02 -4.92 116.67 119.01 2o9a s ASP 42 Ca 0.01 -0.20 -0.19 0.00 0.43 0.00 0.00 52.55 52.60 2o9a s ASP 42 Cb 0.01 0.63 0.14 0.00 -0.30 0.00 0.00 42.92 43.40 2o9a s ASP 42 CO 0.02 -1.08 1.01 -1.58 -0.17 0.00 0.00 175.17 173.37 2o9a s GLN 43 N -3.81 0.39 -0.22 4.34 0.74 -1.26 -0.68 119.66 119.17 2o9a s GLN 43 Ca 0.04 0.62 -0.02 0.00 0.05 0.00 0.00 55.36 56.05 2o9a s GLN 43 Cb -0.02 0.11 0.01 0.00 1.10 0.00 0.00 33.01 34.21 2o9a s GLN 43 CO -0.07 -0.07 -0.09 0.08 -0.55 0.00 0.00 175.29 174.59 2o9a s VAL 44 N 1.02 2.87 0.33 1.34 1.01 0.75 -4.99 120.40 122.73 2o9a s VAL 44 Ca -0.05 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 60.89 2o9a s VAL 44 Cb -0.04 -2.35 -0.10 0.00 0.00 0.00 0.00 36.38 33.89 2o9a s VAL 44 CO -0.13 0.36 0.90 -1.10 0.00 0.00 0.00 175.10 175.14 2o9a s GLN 45 N 1.38 4.44 0.77 2.72 -1.52 -1.26 -1.28 119.66 124.91 2o9a s GLN 45 Ca 0.03 1.19 -0.10 0.00 -1.95 0.00 0.00 55.36 54.54 2o9a s GLN 45 Cb -0.15 -2.68 0.08 0.00 -0.22 0.00 0.00 33.01 30.04 2o9a s GLN 45 CO -0.06 0.24 1.11 0.00 -0.25 0.00 0.00 175.29 176.33 2o9a n THR 47 N -3.16 1.17 -1.96 0.00 -2.24 -1.26 -4.95 114.28 101.87 2o9a n THR 47 Ca 0.08 -0.92 -0.35 0.00 -2.27 0.00 0.00 64.05 60.59 2o9a n THR 47 Cb 0.61 0.27 0.03 0.00 -2.10 0.00 0.00 70.33 69.14 2o9a n THR 47 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2o9a s HIS 48 N -1.44 2.47 0.30 4.78 3.76 -1.26 -4.94 115.29 118.96 2o9a s HIS 48 Ca 0.43 1.54 -0.01 0.00 -0.15 0.00 0.00 55.06 56.88 2o9a s HIS 48 Cb 0.25 -3.36 0.46 0.00 1.11 0.00 0.00 32.58 31.03 2o9a s HIS 48 CO 0.26 -1.97 1.91 -0.07 -0.85 0.00 0.00 174.74 174.02 2o9a h LEU 49 N 0.66 0.83 -8.47 0.89 3.38 -2.03 -3.41 115.31 107.17 2o9a h LEU 49 Ca -0.49 -0.08 -0.66 0.00 0.09 0.00 0.00 57.88 56.74 2o9a h LEU 49 Cb 1.28 -0.21 -0.28 0.00 0.09 0.00 0.00 40.66 41.53 2o9a h LEU 49 CO 0.55 0.69 -0.76 -0.32 0.09 0.00 0.00 178.44 178.69 2o9a s MET 50 N -5.57 3.34 0.16 1.13 1.75 -1.26 -5.09 119.30 113.77 2o9a s MET 50 Ca -0.10 -0.67 -0.23 0.00 -1.25 0.00 0.00 55.69 53.43 2o9a s MET 50 Cb 0.17 -2.78 0.07 0.00 2.84 0.00 0.00 34.83 35.12 2o9a s MET 50 CO 0.79 -0.00 0.62 -0.98 -0.65 0.00 0.00 175.02 174.80 2o9a s ARG 51 N 0.91 1.30 -0.06 4.11 1.70 -1.26 -4.89 118.95 120.77 2o9a s ARG 51 Ca -0.02 -0.51 -0.30 0.00 -0.47 0.00 0.00 55.73 54.44 2o9a s ARG 51 Cb -0.15 0.58 -0.06 0.00 -0.57 0.00 0.00 34.95 34.76 2o9a s ARG 51 CO -0.00 -0.57 1.71 1.41 -1.08 0.00 0.00 175.30 176.76 2o9a s MET 52 N -3.74 4.11 -0.28 3.89 -2.45 -1.26 -4.87 119.30 114.70 2o9a s MET 52 Ca 0.02 2.19 0.11 0.00 -1.25 0.00 0.00 55.69 56.76 2o9a s MET 52 Cb -0.01 -4.03 0.47 0.00 1.25 0.00 0.00 34.83 32.51 2o9a s MET 52 CO -0.11 -0.94 1.17 0.43 1.05 0.00 0.00 175.02 176.62 2o9a n SER 53 N 7.45 4.05 -4.77 1.11 7.64 -1.26 -4.91 113.62 122.94 2o9a n SER 53 Ca 0.18 -3.37 -0.38 0.00 1.01 0.00 0.00 58.87 56.31 2o9a n SER 53 Cb 0.43 -0.38 -0.01 0.00 -1.01 0.00 0.00 64.21 63.24 2o9a n SER 53 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2o9a s ALA 54 N -3.59 3.10 0.63 -0.43 0.00 -1.26 -5.01 121.76 115.19 2o9a s ALA 54 Ca 0.45 1.06 -0.10 0.00 0.00 0.00 0.00 51.96 53.37 2o9a s ALA 54 Cb 0.39 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 2o9a s ALA 54 CO 0.02 -0.72 1.02 -1.25 0.00 0.00 0.00 175.76 174.82 2o9a s PRO 55 N -2.45 3.36 0.30 0.00 0.04 -1.26 -4.97 135.00 130.02 2o9a s PRO 55 Ca 0.60 0.58 -0.29 0.00 0.04 0.00 0.00 61.00 61.93 2o9a s PRO 55 Cb -0.33 -2.10 -0.11 0.00 0.04 0.00 0.00 34.50 32.00 2o9a s PRO 55 CO 0.41 -0.67 1.45 0.42 0.04 0.00 0.00 177.00 178.65 2o9a s ILE 56 N -3.18 2.43 0.00 0.56 -1.09 -1.26 -1.48 121.20 117.18 2o9a s ILE 56 Ca 0.55 0.39 0.00 0.00 -2.23 0.00 0.00 60.65 59.36 2o9a s ILE 56 Cb -0.11 -3.25 0.00 0.00 -1.58 0.00 0.00 42.46 37.52 2o9a s ILE 56 CO 0.52 0.08 0.00 0.61 -1.23 0.00 0.00 174.94 174.92 2o9a n GLY 57 N 1.53 0.98 3.75 6.18 0.00 0.17 -5.02 105.19 112.78 2o9a n GLY 57 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2o9a n GLY 57 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2o9a s GLY 58 N -2.01 2.19 0.16 -0.02 0.00 -0.55 -4.63 107.32 102.46 2o9a s GLY 58 Ca 0.00 0.65 0.07 0.00 0.00 0.00 0.00 44.72 45.44 2o9a s GLY 58 CO 0.00 1.02 0.02 0.54 0.00 0.00 0.00 173.10 174.68 2o9a s LYS 59 N -4.07 2.50 -0.03 2.90 1.02 -1.26 -0.52 119.74 120.28 2o9a s LYS 59 Ca 0.69 -1.04 0.04 0.00 0.02 0.00 0.00 55.97 55.68 2o9a s LYS 59 Cb -0.23 -2.42 -0.00 0.00 -0.52 0.00 0.00 37.83 34.65 2o9a s LYS 59 CO 0.43 0.47 -0.16 -0.51 -0.92 0.00 0.00 175.35 174.66 2o9a s LEU 60 N -2.91 1.93 0.45 3.17 1.43 -0.18 -4.97 118.68 117.60 2o9a s LEU 60 Ca 0.28 -0.33 -0.24 0.00 -1.03 0.00 0.00 54.13 52.81 2o9a s LEU 60 Cb -0.10 -0.91 -0.07 0.00 0.03 0.00 0.00 46.19 45.14 2o9a s LEU 60 CO 0.19 0.16 1.24 -2.16 0.23 0.00 0.00 176.35 176.01 2o9a s PRO 61 N -0.05 3.76 0.18 1.29 0.04 -1.26 -3.64 135.00 135.32 2o9a s PRO 61 Ca -0.01 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 62.89 2o9a s PRO 61 Cb -0.10 -2.52 0.09 0.00 0.04 0.00 0.00 34.50 32.01 2o9a s PRO 61 CO 0.01 -0.61 1.73 0.52 0.04 0.00 0.00 177.00 178.70 2o9a h MET 62 N 2.22 0.97 -0.00 4.56 2.86 -1.88 -3.00 114.93 120.65 2o9a h MET 62 Ca -0.50 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 56.96 2o9a h MET 62 Cb 1.25 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.76 2o9a h MET 62 CO 0.61 0.83 -0.47 -2.39 1.06 0.00 0.00 176.91 176.55 2o9a n HIS 63 N -4.40 0.00 -1.24 -0.22 1.44 -1.26 -2.26 115.22 107.28 2o9a n HIS 63 Ca 0.04 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.77 2o9a n HIS 63 Cb 0.19 -0.17 0.02 0.00 0.12 0.00 0.00 29.99 30.14 2o9a n HIS 63 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2o9a n ALA 64 N -1.16 1.68 -2.32 1.59 0.00 -1.22 -4.64 120.51 114.44 2o9a n ALA 64 Ca 0.08 -1.05 -0.17 0.00 0.00 0.00 0.00 53.44 52.30 2o9a n ALA 64 Cb 0.34 -0.24 -0.10 0.00 0.00 0.00 0.00 19.45 19.46 2o9a n ALA 64 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2o9a s SER 65 N -0.91 1.98 0.09 0.00 1.04 -1.14 -2.75 113.70 112.02 2o9a s SER 65 Ca 0.04 -1.16 -0.30 0.00 0.48 0.00 0.00 55.95 55.01 2o9a s SER 65 Cb 0.04 -0.02 -0.13 0.00 0.10 0.00 0.00 66.02 66.00 2o9a s SER 65 CO 0.00 -0.43 1.62 1.23 0.98 0.00 0.00 173.24 176.65 2o9a h GLY 66 N 2.52 -0.77 0.64 7.32 0.00 -1.89 -1.44 103.07 109.45 2o9a h GLY 66 Ca -0.38 0.37 0.04 0.00 0.00 0.00 0.00 47.33 47.36 2o9a h GLY 66 CO 0.64 -0.28 -0.01 0.00 0.00 0.00 0.00 176.54 176.89 2o9a h ALA 67 N -0.19 0.18 -0.29 3.60 0.00 -1.91 -0.14 119.26 120.51 2o9a h ALA 67 Ca -0.02 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2o9a h ALA 67 Cb 0.62 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.45 2o9a h ALA 67 CO -0.05 -0.44 -0.39 0.78 0.00 0.00 0.00 179.25 179.16 2o9a h GLY 68 N 0.06 -0.52 2.00 0.00 0.00 -1.69 -2.11 103.07 100.81 2o9a h GLY 68 Ca 0.10 0.49 -0.12 0.00 0.00 0.00 0.00 47.33 47.80 2o9a h GLY 68 CO -0.19 -0.20 -0.59 0.50 0.00 0.00 0.00 176.54 176.06 2o9a h LYS 69 N -0.37 0.00 -0.53 4.80 1.57 -0.81 -0.46 116.57 120.78 2o9a h LYS 69 Ca 0.12 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 2o9a h LYS 69 Cb 0.58 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.84 2o9a h LYS 69 CO -0.49 0.59 0.22 0.00 -0.57 0.00 0.00 179.45 179.20 2o9a h ALA 70 N 1.41 0.67 -0.23 3.86 0.00 -0.79 0.41 119.26 124.60 2o9a h ALA 70 Ca -0.01 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2o9a h ALA 70 Cb 1.22 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2o9a h ALA 70 CO 0.08 -0.16 -0.10 0.74 0.00 0.00 0.00 179.25 179.80 2o9a h PHE 71 N 0.42 0.53 -0.47 0.00 0.04 -0.71 -3.22 116.94 113.54 2o9a h PHE 71 Ca 0.25 -0.13 -0.03 0.00 2.80 0.00 0.00 57.97 60.87 2o9a h PHE 71 Cb 0.24 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 2o9a h PHE 71 CO -0.14 0.73 0.18 -0.07 -0.60 0.00 0.00 178.31 178.42 2o9a h LEU 72 N 0.18 0.61 -2.54 1.54 3.38 -0.82 -1.97 115.31 115.68 2o9a h LEU 72 Ca 0.05 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.96 2o9a h LEU 72 Cb 0.59 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2o9a h LEU 72 CO 0.03 0.56 0.11 0.00 0.09 0.00 0.00 178.44 179.23 2o9a h ALA 73 N 1.53 1.35 -0.01 1.53 0.00 -0.92 -1.56 119.26 121.18 2o9a h ALA 73 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2o9a h ALA 73 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2o9a h ALA 73 CO -0.01 -0.13 -0.18 1.04 0.00 0.00 0.00 179.25 179.96 2o9a n GLN 74 N -3.35 0.76 -3.62 0.00 1.13 -0.74 -4.81 117.38 106.75 2o9a n GLN 74 Ca -0.02 -0.37 -0.31 0.00 -1.94 0.00 0.00 57.00 54.37 2o9a n GLN 74 Cb 0.19 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 29.00 2o9a n GLN 74 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2o9a s LEU 75 N -2.49 4.23 0.94 1.08 1.43 -0.59 -5.04 118.68 118.25 2o9a s LEU 75 Ca 0.26 0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 53.88 2o9a s LEU 75 Cb 0.20 -3.37 0.16 0.00 0.03 0.00 0.00 46.19 43.20 2o9a s LEU 75 CO 0.50 0.01 1.09 -0.94 0.23 0.00 0.00 176.35 177.24 2o9a s SER 76 N -2.54 2.95 0.25 2.29 1.04 -1.26 -4.76 113.70 111.65 2o9a s SER 76 Ca 0.42 1.73 -0.06 0.00 0.48 0.00 0.00 55.95 58.52 2o9a s SER 76 Cb -0.12 -2.35 0.28 0.00 0.10 0.00 0.00 66.02 63.93 2o9a s SER 76 CO 0.25 -3.01 1.90 -0.33 0.98 0.00 0.00 173.24 173.04 2o9a h GLU 77 N -1.80 1.19 -0.32 4.02 4.39 -1.98 0.65 114.58 120.73 2o9a h GLU 77 Ca -0.49 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.13 2o9a h GLU 77 Cb 1.28 -0.27 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 2o9a h GLU 77 CO 0.50 0.79 0.17 1.49 -1.16 0.00 0.00 179.01 180.80 2o9a h GLU 78 N 1.23 0.44 -0.54 2.33 4.81 -1.99 -0.32 114.58 120.55 2o9a h GLU 78 Ca 0.37 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.50 2o9a h GLU 78 Cb -0.05 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 2o9a h GLU 78 CO -0.11 0.38 0.17 1.96 -0.73 0.00 0.00 179.01 180.68 2o9a h GLN 79 N 0.39 0.84 -0.07 1.92 4.20 -1.80 -1.57 115.11 119.03 2o9a h GLN 79 Ca 0.11 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 2o9a h GLN 79 Cb 0.06 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 2o9a h GLN 79 CO -0.02 0.77 0.03 0.28 -0.67 0.00 0.00 178.83 179.22 2o9a h VAL 80 N 0.75 1.12 -0.28 -0.54 2.07 -0.74 -1.50 116.25 117.12 2o9a h VAL 80 Ca 0.17 -0.34 0.06 0.00 0.82 0.00 0.00 66.70 67.41 2o9a h VAL 80 Cb 0.28 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 2o9a h VAL 80 CO -0.01 0.10 -0.11 0.74 0.02 0.00 0.00 177.57 178.32 2o9a h THR 81 N -0.03 0.64 -0.81 2.57 2.02 -0.95 -1.18 112.91 115.17 2o9a h THR 81 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 2o9a h THR 81 Cb 0.13 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 2o9a h THR 81 CO -0.00 0.00 0.51 0.11 0.37 0.00 0.00 175.52 176.51 2o9a h LYS 82 N -0.06 1.09 -0.31 6.66 1.79 -1.20 -0.99 116.57 123.54 2o9a h LYS 82 Ca 0.14 -0.08 -0.03 0.00 -2.18 0.00 0.00 60.65 58.50 2o9a h LYS 82 Cb 0.27 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 2o9a h LYS 82 CO -0.32 0.75 0.07 1.25 -1.08 0.00 0.00 179.45 180.12 2o9a h LEU 83 N 1.11 0.47 -1.04 2.94 6.46 -0.87 -2.32 115.31 122.07 2o9a h LEU 83 Ca 0.30 -0.23 -0.10 0.00 -0.12 0.00 0.00 57.88 57.72 2o9a h LEU 83 Cb -0.08 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 39.71 2o9a h LEU 83 CO -0.06 0.58 -0.45 -0.07 -0.62 0.00 0.00 178.44 177.82 2o9a h LEU 84 N 0.34 0.06 -0.96 2.25 3.38 -1.03 0.17 115.31 119.53 2o9a h LEU 84 Ca 0.10 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2o9a h LEU 84 Cb 0.30 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2o9a h LEU 84 CO 0.00 0.51 0.38 0.45 0.09 0.00 0.00 178.44 179.87 2o9a h HIS 85 N 0.05 1.12 0.40 1.13 3.86 -0.99 -0.22 115.15 120.49 2o9a h HIS 85 Ca 0.00 -0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.14 2o9a h HIS 85 Cb 0.82 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.95 2o9a h HIS 85 CO 0.00 0.81 -0.19 -0.09 0.86 0.00 0.00 177.93 179.32 2o9a h ARG 86 N 1.11 -0.51 0.00 2.45 9.65 -0.78 -3.38 114.38 122.92 2o9a h ARG 86 Ca 0.27 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 2o9a h ARG 86 Cb 0.11 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 2o9a h ARG 86 CO -0.03 -0.21 -0.53 1.63 2.80 0.00 0.00 179.97 183.63 2o9a n LYS 87 N -5.16 0.08 -0.35 0.20 4.76 0.52 -5.07 118.16 113.14 2o9a n LYS 87 Ca -0.09 0.02 0.05 0.00 -2.87 0.00 0.00 58.31 55.41 2o9a n LYS 87 Cb 0.28 -1.54 -0.01 0.00 -1.84 0.00 0.00 35.03 31.91 2o9a n LYS 87 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2o9a n GLY 88 N 1.46 -1.70 2.66 0.72 0.00 -0.10 -4.74 105.19 103.49 2o9a n GLY 88 Ca 0.05 -1.43 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 2o9a n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o9a n LEU 89 N -2.25 3.20 -4.65 0.99 4.77 -1.26 -4.88 117.00 112.92 2o9a n LEU 89 Ca -0.00 -5.44 -0.47 0.00 -0.03 0.00 0.00 56.01 50.07 2o9a n LEU 89 Cb 0.16 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2o9a n LEU 89 CO 0.00 2.32 1.11 1.57 -1.33 0.00 0.00 177.39 181.06 2o9a n HIS 90 N 0.01 2.10 -2.79 -1.77 -0.00 -1.26 -4.75 115.22 106.76 2o9a n HIS 90 Ca 0.29 0.37 -0.43 0.00 -0.00 0.00 0.00 57.72 57.95 2o9a n HIS 90 Cb 0.48 -2.49 -0.03 0.00 -0.00 0.00 0.00 29.99 27.95 2o9a n HIS 90 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2o9a s ALA 91 N 0.70 3.10 0.15 1.57 0.00 -1.26 -4.86 121.76 121.16 2o9a s ALA 91 Ca 0.79 -2.42 -0.14 0.00 0.00 0.00 0.00 51.96 50.19 2o9a s ALA 91 Cb -0.73 -4.18 0.03 0.00 0.00 0.00 0.00 23.12 18.24 2o9a s ALA 91 CO 0.41 -3.16 1.70 1.88 0.00 0.00 0.00 175.76 176.58 2o9a h TYR 92 N 9.28 0.77 -4.65 0.00 0.05 -1.88 -3.47 116.97 117.08 2o9a h TYR 92 Ca 0.09 -0.06 -0.36 0.00 0.05 0.00 0.00 58.73 58.44 2o9a h TYR 92 Cb 1.03 -0.23 -0.14 0.00 1.01 0.00 0.00 36.73 38.40 2o9a h TYR 92 CO 1.17 0.66 -0.56 0.95 -1.05 0.00 0.00 178.16 179.33 2o9a s THR 93 N -5.50 0.04 0.10 -2.88 -4.23 -1.26 -4.94 115.64 96.97 2o9a s THR 93 Ca -0.13 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 58.70 2o9a s THR 93 Cb 0.11 -2.50 0.34 0.00 1.34 0.00 0.00 72.50 71.79 2o9a s THR 93 CO 0.78 0.00 1.98 1.12 -0.54 0.00 0.00 174.62 177.95 2o9a h HIS 94 N 2.36 0.00 0.00 3.99 2.07 -1.91 -2.62 115.15 119.04 2o9a h HIS 94 Ca -0.31 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.18 2o9a h HIS 94 Cb 1.24 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.22 2o9a h HIS 94 CO 1.03 0.00 -0.88 0.00 -3.07 0.00 0.00 177.93 175.01 2o9a h ALA 95 N 2.05 0.62 -2.25 6.11 0.00 -1.90 -3.47 119.26 120.42 2o9a h ALA 95 Ca 0.00 -0.18 -0.59 0.00 0.00 0.00 0.00 54.91 54.14 2o9a h ALA 95 Cb 0.17 0.05 0.08 0.00 0.00 0.00 0.00 17.79 18.09 2o9a h ALA 95 CO 0.00 0.20 0.62 2.41 0.00 0.00 0.00 179.25 182.48 2o9a n THR 96 N -2.82 0.73 -2.49 0.00 -1.04 -0.99 -4.81 114.28 102.86 2o9a n THR 96 Ca -0.01 -0.18 -0.41 0.00 -2.04 0.00 0.00 64.05 61.41 2o9a n THR 96 Cb 0.61 -1.41 -0.03 0.00 -1.82 0.00 0.00 70.33 67.68 2o9a n THR 96 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2o9a s LEU 97 N 0.31 3.28 0.00 -4.42 1.43 -1.26 -4.80 118.68 113.22 2o9a s LEU 97 Ca 0.71 -0.13 0.12 0.00 -1.03 0.00 0.00 54.13 53.80 2o9a s LEU 97 Cb -0.68 -2.80 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 2o9a s LEU 97 CO 0.47 -1.77 0.62 1.33 0.23 0.00 0.00 176.35 177.24 2o9a n VAL 98 N 6.60 0.00 -3.37 -1.59 0.24 -1.26 -4.83 118.33 114.11 2o9a n VAL 98 Ca 0.07 -0.33 -0.39 0.00 -2.04 0.00 0.00 64.34 61.66 2o9a n VAL 98 Cb 0.49 1.09 -0.08 0.00 -1.47 0.00 0.00 33.84 33.88 2o9a n VAL 98 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2o9a s SER 99 N -1.71 6.38 0.34 -1.34 0.15 -1.26 -4.91 113.70 111.35 2o9a s SER 99 Ca 0.08 0.45 0.07 0.00 0.70 0.00 0.00 55.95 57.25 2o9a s SER 99 Cb 0.09 -2.23 0.77 0.00 -1.71 0.00 0.00 66.02 62.94 2o9a s SER 99 CO 0.35 -0.13 1.85 -0.65 1.20 0.00 0.00 173.24 175.86 2o9a h PRO 100 N 7.66 0.73 -0.65 5.44 0.11 -1.99 -0.98 132.00 142.32 2o9a h PRO 100 Ca -0.34 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 2o9a h PRO 100 Cb 1.16 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 2o9a h PRO 100 CO 0.70 0.48 0.37 -0.24 -0.21 0.00 0.00 178.00 179.10 2o9a h VAL 101 N 0.75 1.20 -0.02 3.15 3.04 -1.99 0.04 116.25 122.41 2o9a h VAL 101 Ca 0.48 -0.48 -0.18 0.00 -1.01 0.00 0.00 66.70 65.51 2o9a h VAL 101 Cb 0.73 0.34 -0.01 0.00 -2.01 0.00 0.00 31.29 30.34 2o9a h VAL 101 CO -0.24 0.21 -0.79 0.45 -1.01 0.00 0.00 177.57 176.19 2o9a h HIS 102 N 0.88 0.29 -0.23 3.17 3.86 -1.80 -2.11 115.15 119.21 2o9a h HIS 102 Ca 0.23 -0.14 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 2o9a h HIS 102 Cb 0.02 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 2o9a h HIS 102 CO -0.01 0.91 0.04 1.25 0.86 0.00 0.00 177.93 180.97 2o9a h LEU 103 N 0.13 0.37 -1.04 2.43 5.85 -1.04 -1.23 115.31 120.79 2o9a h LEU 103 Ca -0.03 -0.26 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 2o9a h LEU 103 Cb 1.38 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2o9a h LEU 103 CO 0.12 0.54 0.25 0.11 -0.34 0.00 0.00 178.44 179.12 2o9a h LYS 104 N 0.19 0.94 -0.29 1.25 1.57 -0.89 0.28 116.57 119.62 2o9a h LYS 104 Ca 0.07 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2o9a h LYS 104 Cb 0.33 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2o9a h LYS 104 CO 0.00 0.77 0.14 1.49 -0.57 0.00 0.00 179.45 181.29 2o9a h GLU 105 N 0.93 0.42 -0.90 3.15 4.57 -1.34 0.41 114.58 121.81 2o9a h GLU 105 Ca 0.22 -0.06 0.10 0.00 -1.18 0.00 0.00 59.36 58.44 2o9a h GLU 105 Cb 0.18 -0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 28.62 2o9a h GLU 105 CO -0.02 0.40 0.54 0.22 -1.18 0.00 0.00 179.01 178.97 2o9a h ASP 106 N 0.34 0.78 -0.33 1.04 3.58 -0.37 -1.02 116.42 120.42 2o9a h ASP 106 Ca 0.10 0.05 -0.13 0.00 0.42 0.00 0.00 57.03 57.47 2o9a h ASP 106 Cb 0.12 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 2o9a h ASP 106 CO -0.01 0.43 -0.26 -0.07 -2.88 0.00 0.00 179.24 176.45 2o9a h LEU 107 N 0.88 0.86 -0.39 2.28 3.38 -0.55 -0.03 115.31 121.74 2o9a h LEU 107 Ca 0.44 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2o9a h LEU 107 Cb 0.41 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2o9a h LEU 107 CO -0.25 1.08 0.25 0.00 0.09 0.00 0.00 178.44 179.60 2o9a h ALA 108 N 0.98 0.50 -0.77 1.53 0.00 -0.49 -1.38 119.26 119.63 2o9a h ALA 108 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2o9a h ALA 108 Cb 0.80 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2o9a h ALA 108 CO 0.07 -0.07 0.49 1.96 0.00 0.00 0.00 179.25 181.69 2o9a h GLN 109 N 0.50 1.02 -0.12 0.00 1.08 -0.91 -1.98 115.11 114.70 2o9a h GLN 109 Ca 0.15 -0.07 0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2o9a h GLN 109 Cb -0.03 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.16 2o9a h GLN 109 CO -0.05 0.69 0.02 1.15 -0.95 0.00 0.00 178.83 179.69 2o9a h THR 110 N 1.05 0.94 -0.82 -0.54 2.02 -0.59 -0.00 112.91 114.96 2o9a h THR 110 Ca 0.28 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.42 2o9a h THR 110 Cb -0.09 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.15 2o9a h THR 110 CO -0.06 0.01 0.46 0.03 0.37 0.00 0.00 175.52 176.33 2o9a h ARG 111 N 0.07 1.14 -0.01 6.66 3.08 -1.07 -0.19 114.38 124.06 2o9a h ARG 111 Ca 0.06 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2o9a h ARG 111 Cb 0.05 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 29.88 2o9a h ARG 111 CO -0.08 0.83 0.00 -0.22 -1.07 0.00 0.00 179.97 179.43 2o9a h LYS 112 N 1.14 0.01 0.00 0.04 3.64 -0.91 -3.17 116.57 117.32 2o9a h LYS 112 Ca 0.29 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2o9a h LYS 112 Cb 0.02 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2o9a h LYS 112 CO -0.05 0.25 -0.41 2.89 -2.27 0.00 0.00 179.45 179.87 2o9a n ARG 113 N -4.96 0.13 -0.47 1.90 1.85 -0.06 -4.94 116.66 110.11 2o9a n ARG 113 Ca -0.08 0.05 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 2o9a n ARG 113 Cb 0.14 -1.60 0.00 0.00 -1.05 0.00 0.00 32.46 29.96 2o9a n ARG 113 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2o9a n GLY 114 N 1.42 0.73 3.18 2.89 0.00 -0.10 -4.99 105.19 108.33 2o9a n GLY 114 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 2o9a n GLY 114 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2o9a s TYR 115 N -2.94 -0.07 0.35 1.61 -0.85 -1.14 -4.75 117.35 109.56 2o9a s TYR 115 Ca 0.00 0.07 -0.05 0.00 -0.52 0.00 0.00 57.07 56.56 2o9a s TYR 115 Cb 0.00 0.03 -0.05 0.00 0.38 0.00 0.00 41.96 42.32 2o9a s TYR 115 CO 0.00 -0.35 0.63 -1.54 -1.52 0.00 0.00 175.55 172.77 2o9a s SER 116 N -1.38 6.41 -0.04 -0.18 1.04 0.10 -4.48 113.70 115.18 2o9a s SER 116 Ca -0.14 0.79 -0.02 0.00 0.48 0.00 0.00 55.95 57.06 2o9a s SER 116 Cb -0.06 -2.18 0.03 0.00 0.10 0.00 0.00 66.02 63.91 2o9a s SER 116 CO 0.03 -0.30 0.04 0.12 0.98 0.00 0.00 173.24 174.11 2o9a s PHE 117 N -2.26 0.17 -0.39 5.02 5.36 -1.26 -1.75 117.98 122.86 2o9a s PHE 117 Ca 0.45 0.16 -0.14 0.00 -0.96 0.00 0.00 56.93 56.45 2o9a s PHE 117 Cb -0.10 -0.51 0.02 0.00 -0.34 0.00 0.00 43.02 42.08 2o9a s PHE 117 CO 0.33 -0.20 0.27 0.34 -1.46 0.00 0.00 175.22 174.50 2o9a s ASP 118 N 1.98 6.02 -0.98 6.13 2.15 0.30 -4.87 116.67 127.40 2o9a s ASP 118 Ca 0.03 -0.85 -0.04 0.00 0.43 0.00 0.00 52.55 52.12 2o9a s ASP 118 Cb -0.12 -2.13 0.25 0.00 -0.30 0.00 0.00 42.92 40.62 2o9a s ASP 118 CO -0.03 -0.41 0.98 -0.67 -0.17 0.00 0.00 175.17 174.87 2o9a n ASP 119 N 5.12 4.90 -2.78 -0.34 2.03 -1.26 -1.65 116.55 122.56 2o9a n ASP 119 Ca -0.11 -3.16 -0.22 0.00 0.52 0.00 0.00 54.79 51.82 2o9a n ASP 119 Cb 0.47 -1.16 0.02 0.00 -0.72 0.00 0.00 41.12 39.72 2o9a n ASP 119 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2o9a n GLU 120 N 2.20 -3.62 0.07 -0.67 1.02 -0.57 -4.88 120.64 114.19 2o9a n GLU 120 Ca 0.24 0.94 0.01 0.00 -0.02 0.00 0.00 57.16 58.33 2o9a n GLU 120 Cb 0.37 -5.72 -0.04 0.00 -0.02 0.00 0.00 31.44 26.03 2o9a n GLU 120 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2o9a h GLU 121 N -0.84 0.00 0.03 3.49 5.08 -1.81 -3.38 114.58 117.15 2o9a h GLU 121 Ca -0.51 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.46 2o9a h GLU 121 Cb 1.36 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.56 2o9a h GLU 121 CO 0.57 0.35 -2.29 1.58 -1.00 0.00 0.00 179.01 178.23 2o9a n HIS 122 N -3.00 0.40 -3.77 4.33 -0.00 -1.11 -4.20 115.22 107.88 2o9a n HIS 122 Ca -0.05 0.10 -0.13 0.00 0.46 0.00 0.00 57.72 58.10 2o9a n HIS 122 Cb 0.79 -1.05 -0.10 0.00 -0.12 0.00 0.00 29.99 29.51 2o9a n HIS 122 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2o9a s ALA 123 N -2.52 -0.77 0.34 1.57 0.00 -1.26 -4.71 121.76 114.42 2o9a s ALA 123 Ca -0.32 0.53 -0.29 0.00 0.00 0.00 0.00 51.96 51.88 2o9a s ALA 123 Cb 0.09 -0.16 -0.11 0.00 0.00 0.00 0.00 23.12 22.94 2o9a s ALA 123 CO 0.63 -0.22 1.46 -0.51 0.00 0.00 0.00 175.76 177.13 2o9a s LEU 124 N -0.75 4.35 0.00 0.00 1.43 -1.26 -2.17 118.68 120.28 2o9a s LEU 124 Ca -0.08 2.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.95 2o9a s LEU 124 Cb -0.04 -3.66 0.00 0.00 0.03 0.00 0.00 46.19 42.52 2o9a s LEU 124 CO 0.03 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.42 2o9a n GLY 125 N 0.92 0.99 3.32 -3.19 0.00 -1.26 -5.02 105.19 100.95 2o9a n GLY 125 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2o9a n GLY 125 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2o9a s LEU 126 N 0.00 2.56 0.11 0.99 2.96 -0.92 -0.91 118.68 123.46 2o9a s LEU 126 Ca 0.00 -0.40 0.10 0.00 -0.22 0.00 0.00 54.13 53.62 2o9a s LEU 126 Cb 0.00 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.09 2o9a s LEU 126 CO 0.00 0.15 -0.27 -0.13 -1.32 0.00 0.00 176.35 174.78 2o9a s ARG 127 N 0.46 1.49 0.02 1.98 0.52 0.47 -1.52 118.95 122.37 2o9a s ARG 127 Ca -0.11 -1.28 -0.03 0.00 -0.52 0.00 0.00 55.73 53.79 2o9a s ARG 127 Cb -0.16 -1.90 -0.01 0.00 0.52 0.00 0.00 34.95 33.40 2o9a s ARG 127 CO 0.05 0.46 0.04 0.00 0.02 0.00 0.00 175.30 175.87 2o9a s LEU 129 N -1.67 2.05 0.08 0.00 1.02 -0.15 -0.54 118.68 119.46 2o9a s LEU 129 Ca -0.12 -0.47 -0.12 0.00 0.02 0.00 0.00 54.13 53.44 2o9a s LEU 129 Cb -0.06 -1.33 0.01 0.00 0.02 0.00 0.00 46.19 44.83 2o9a s LEU 129 CO -0.02 0.31 0.28 0.00 0.02 0.00 0.00 176.35 176.94 2o9a s ALA 130 N -0.53 -0.56 0.00 4.21 0.00 -0.72 -0.67 121.76 123.50 2o9a s ALA 130 Ca 0.08 -0.24 -0.06 0.00 0.00 0.00 0.00 51.96 51.73 2o9a s ALA 130 Cb -0.10 0.46 -0.00 0.00 0.00 0.00 0.00 23.12 23.47 2o9a s ALA 130 CO -0.00 -0.49 0.12 0.00 0.00 0.00 0.00 175.76 175.38 2o9a s ALA 131 N -3.29 -0.28 0.36 0.00 0.00 -0.83 0.01 121.76 117.74 2o9a s ALA 131 Ca 0.00 -0.18 -0.25 0.00 0.00 0.00 0.00 51.96 51.54 2o9a s ALA 131 Cb 0.02 0.11 -0.10 0.00 0.00 0.00 0.00 23.12 23.15 2o9a s ALA 131 CO -0.08 -0.20 0.96 0.00 0.00 0.00 0.00 175.76 176.44 2o9a s ILE 133 N -1.74 3.16 0.02 0.00 1.01 0.11 -4.80 121.20 118.96 2o9a s ILE 133 Ca 0.54 -0.73 0.08 0.00 0.00 0.00 0.00 60.65 60.53 2o9a s ILE 133 Cb -0.17 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.01 2o9a s ILE 133 CO 0.22 0.56 -0.23 -0.36 0.00 0.00 0.00 174.94 175.13 2o9a s PHE 134 N -0.78 2.43 0.00 3.97 0.40 -1.26 -1.57 117.98 121.17 2o9a s PHE 134 Ca 0.12 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.11 2o9a s PHE 134 Cb -0.11 -1.46 0.00 0.00 0.51 0.00 0.00 43.02 41.96 2o9a s PHE 134 CO 0.02 0.13 0.00 -0.40 0.70 0.00 0.00 175.22 175.67 2o9a n ASP 135 N 1.91 0.00 -0.01 1.36 3.85 -0.64 -4.74 116.55 118.28 2o9a n ASP 135 Ca -0.17 0.00 -0.09 0.00 -0.71 0.00 0.00 54.79 53.82 2o9a n ASP 135 Cb 0.52 0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 40.26 2o9a n ASP 135 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2o9a h GLU 136 N 0.00 -0.30 0.00 0.11 9.09 -1.89 -0.24 114.58 121.35 2o9a h GLU 136 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.43 2o9a h GLU 136 Cb 0.00 0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 2o9a h GLU 136 CO 0.00 -0.20 0.00 0.72 0.05 0.00 0.00 179.01 179.58 2o9a n HIS 137 N -5.38 0.00 -2.08 2.06 -0.00 -1.26 -4.99 115.22 103.58 2o9a n HIS 137 Ca -0.02 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.49 2o9a n HIS 137 Cb 0.29 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.24 2o9a n HIS 137 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2o9a n ARG 138 N -0.21 -1.57 -3.72 -0.41 1.74 -0.10 -4.99 116.66 107.39 2o9a n ARG 138 Ca 0.00 1.10 -0.37 0.00 -0.77 0.00 0.00 57.85 57.81 2o9a n ARG 138 Cb 0.00 -5.64 -0.06 0.00 -1.02 0.00 0.00 32.46 25.74 2o9a n ARG 138 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2o9a s GLU 139 N -4.53 3.64 0.26 5.56 2.56 -1.26 -4.83 118.70 120.10 2o9a s GLU 139 Ca 0.00 0.09 -0.31 0.00 0.00 0.00 0.00 54.97 54.75 2o9a s GLU 139 Cb 0.00 -3.19 -0.12 0.00 2.00 0.00 0.00 34.13 32.82 2o9a s GLU 139 CO 0.00 0.73 1.61 -0.35 -0.56 0.00 0.00 175.26 176.69 2o9a n PRO 140 N 1.84 2.63 0.00 4.30 -0.04 -1.26 -1.62 135.00 140.84 2o9a n PRO 140 Ca -0.17 0.94 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 2o9a n PRO 140 Cb 0.54 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 2o9a n PRO 140 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2o9a n PHE 141 N 2.64 0.00 -4.08 0.54 1.16 -0.61 -4.88 117.46 112.22 2o9a n PHE 141 Ca 0.11 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.59 2o9a n PHE 141 Cb 0.35 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.15 2o9a n PHE 141 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2o9a s ALA 142 N -0.29 0.35 -0.11 1.98 0.00 -1.06 -1.90 121.76 120.73 2o9a s ALA 142 Ca 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 51.96 50.64 2o9a s ALA 142 Cb 0.00 1.19 0.03 0.00 0.00 0.00 0.00 23.12 24.34 2o9a s ALA 142 CO 0.00 -0.74 0.29 0.00 0.00 0.00 0.00 175.76 175.32 2o9a s ALA 143 N -4.07 -0.72 -0.11 0.00 0.00 -0.23 0.04 121.76 116.67 2o9a s ALA 143 Ca 0.29 0.84 -0.03 0.00 0.00 0.00 0.00 51.96 53.06 2o9a s ALA 143 Cb 0.03 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 2o9a s ALA 143 CO 0.10 -0.14 0.02 -1.50 0.00 0.00 0.00 175.76 174.23 2o9a s ILE 144 N 0.22 4.43 0.06 0.00 2.07 -0.61 -1.23 121.20 126.13 2o9a s ILE 144 Ca -0.01 -0.19 0.04 0.00 -1.41 0.00 0.00 60.65 59.08 2o9a s ILE 144 Cb -0.02 -2.89 -0.03 0.00 0.13 0.00 0.00 42.46 39.65 2o9a s ILE 144 CO -0.00 0.58 -0.12 -0.94 -1.91 0.00 0.00 174.94 172.54 2o9a s SER 145 N -0.60 1.39 -0.19 4.50 1.04 0.01 -1.96 113.70 117.89 2o9a s SER 145 Ca 0.10 -0.57 -0.08 0.00 0.48 0.00 0.00 55.95 55.88 2o9a s SER 145 Cb -0.12 -0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 2o9a s SER 145 CO 0.02 -0.11 0.08 -0.63 0.98 0.00 0.00 173.24 173.59 2o9a s ILE 146 N -1.26 4.94 -0.04 -1.02 1.01 0.16 -0.87 121.20 124.13 2o9a s ILE 146 Ca -0.04 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.64 2o9a s ILE 146 Cb -0.10 -3.24 0.02 0.00 0.01 0.00 0.00 42.46 39.15 2o9a s ILE 146 CO 0.02 0.45 -0.05 -0.44 0.00 0.00 0.00 174.94 174.91 2o9a s SER 147 N 0.44 0.91 0.12 3.58 0.01 -0.23 -0.98 113.70 117.56 2o9a s SER 147 Ca 0.04 -0.13 -0.25 0.00 1.31 0.00 0.00 55.95 56.92 2o9a s SER 147 Cb -0.12 -0.39 0.08 0.00 0.21 0.00 0.00 66.02 65.80 2o9a s SER 147 CO 0.00 -0.03 1.06 -0.83 0.41 0.00 0.00 173.24 173.85 2o9a s GLY 148 N 0.71 -0.17 0.50 3.44 0.00 -0.39 -3.07 107.32 108.33 2o9a s GLY 148 Ca -0.10 0.11 -0.19 0.00 0.00 0.00 0.00 44.72 44.54 2o9a s GLY 148 CO 0.00 0.86 1.03 2.56 0.00 0.00 0.00 173.10 177.55 2o9a s PRO 149 N -2.77 3.76 0.50 2.90 0.04 -1.26 -0.40 135.00 137.78 2o9a s PRO 149 Ca 0.16 1.31 0.24 0.00 0.04 0.00 0.00 61.00 62.75 2o9a s PRO 149 Cb -0.00 -2.09 1.33 0.00 0.04 0.00 0.00 34.50 33.78 2o9a s PRO 149 CO 0.02 -0.45 2.05 -0.84 0.04 0.00 0.00 177.00 177.81 2o9a h ILE 150 N 1.39 0.70 -0.05 0.56 3.07 -1.28 0.76 117.51 122.66 2o9a h ILE 150 Ca -0.49 -0.58 0.01 0.00 1.55 0.00 0.00 64.86 65.35 2o9a h ILE 150 Cb 1.22 1.36 -0.00 0.00 -0.27 0.00 0.00 36.82 39.12 2o9a h ILE 150 CO 0.59 0.14 0.04 0.77 -1.05 0.00 0.00 178.15 178.64 2o9a h SER 151 N 0.00 0.00 0.00 2.16 4.64 -1.92 -3.25 113.55 115.19 2o9a h SER 151 Ca -0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.00 2o9a h SER 151 Cb 0.35 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.38 2o9a h SER 151 CO 0.02 0.00 -2.19 0.54 -0.87 0.00 0.00 176.83 174.32 2o9a n ARG 152 N -4.43 0.58 -2.54 4.77 1.74 -0.32 -4.66 116.66 111.80 2o9a n ARG 152 Ca -0.02 0.11 -0.43 0.00 -0.77 0.00 0.00 57.85 56.74 2o9a n ARG 152 Cb 0.14 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 2o9a n ARG 152 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2o9a n ILE 153 N -3.08 4.27 -1.36 0.55 5.41 0.11 -4.96 119.36 120.30 2o9a n ILE 153 Ca -0.37 -4.47 -0.30 0.00 1.00 0.00 0.00 62.75 58.62 2o9a n ILE 153 Cb 0.91 -2.40 0.12 0.00 -0.71 0.00 0.00 39.64 37.56 2o9a n ILE 153 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2o9a s THR 154 N 1.01 2.70 0.30 1.39 -4.23 -1.24 -4.62 115.64 110.96 2o9a s THR 154 Ca 0.41 0.23 0.06 0.00 -1.18 0.00 0.00 61.69 61.21 2o9a s THR 154 Cb 0.05 -2.83 0.30 0.00 1.34 0.00 0.00 72.50 71.36 2o9a s THR 154 CO 0.00 -0.30 1.76 0.44 -0.54 0.00 0.00 174.62 175.99 2o9a h ASP 155 N -1.40 0.74 1.03 3.99 3.32 -1.94 0.32 116.42 122.47 2o9a h ASP 155 Ca -0.49 0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.67 2o9a h ASP 155 Cb 1.29 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2o9a h ASP 155 CO 0.57 0.23 0.00 -2.24 -1.72 0.00 0.00 179.24 176.08 2o9a h ASP 156 N 0.71 0.00 0.40 6.45 2.03 -1.99 -2.51 116.42 121.52 2o9a h ASP 156 Ca 0.59 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.89 2o9a h ASP 156 Cb 0.96 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.46 2o9a h ASP 156 CO -0.41 0.00 -0.38 0.54 -1.03 0.00 0.00 179.24 177.97 2o9a n ARG 157 N -2.56 0.36 0.40 4.15 1.74 0.10 -4.51 116.66 116.34 2o9a n ARG 157 Ca 0.02 -0.20 -0.18 0.00 -0.77 0.00 0.00 57.85 56.72 2o9a n ARG 157 Cb 0.31 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.16 2o9a n ARG 157 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2o9a h VAL 158 N 0.49 0.20 0.00 1.55 2.07 -1.44 0.15 116.25 119.27 2o9a h VAL 158 Ca 0.00 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 2o9a h VAL 158 Cb 0.50 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2o9a h VAL 158 CO 0.00 0.01 -0.35 0.71 0.02 0.00 0.00 177.57 177.96 2o9a h THR 159 N -1.10 1.18 0.19 2.57 1.35 -1.81 0.11 112.91 115.41 2o9a h THR 159 Ca -0.10 -1.23 -0.01 0.00 -0.55 0.00 0.00 66.41 64.52 2o9a h THR 159 Cb 0.80 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 2o9a h THR 159 CO 0.17 0.34 -0.09 -0.08 -0.25 0.00 0.00 175.52 175.61 2o9a h GLU 160 N 0.00 -0.25 -0.37 4.72 4.81 -1.76 -1.15 114.58 120.57 2o9a h GLU 160 Ca -0.00 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 2o9a h GLU 160 Cb 0.65 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2o9a h GLU 160 CO 0.05 -0.16 -0.16 0.74 -0.73 0.00 0.00 179.01 178.74 2o9a h PHE 161 N -0.27 0.77 -0.47 0.92 0.05 -0.41 -2.24 116.94 115.28 2o9a h PHE 161 Ca -0.03 -0.15 0.10 0.00 3.82 0.00 0.00 57.97 61.71 2o9a h PHE 161 Cb 0.21 -0.19 -0.10 0.00 2.00 0.00 0.00 35.95 37.87 2o9a h PHE 161 CO -0.06 0.81 -0.17 0.78 -0.18 0.00 0.00 178.31 179.49 2o9a h GLY 162 N 0.98 0.23 0.99 -1.45 0.00 -0.79 -0.95 103.07 102.07 2o9a h GLY 162 Ca 0.10 0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.66 2o9a h GLY 162 CO 0.04 -0.20 0.64 0.00 0.00 0.00 0.00 176.54 177.02 2o9a h ALA 163 N 1.33 1.22 -0.65 3.60 0.00 -0.91 -1.49 119.26 122.38 2o9a h ALA 163 Ca 0.23 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2o9a h ALA 163 Cb 0.41 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2o9a h ALA 163 CO -0.52 0.60 0.21 0.52 0.00 0.00 0.00 179.25 180.06 2o9a h MET 164 N 1.29 1.00 0.01 0.00 2.07 -0.76 -1.75 114.93 116.80 2o9a h MET 164 Ca 0.36 -0.21 -0.20 0.00 -2.07 0.00 0.00 59.70 57.57 2o9a h MET 164 Cb -0.13 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 29.44 2o9a h MET 164 CO -0.08 0.87 -0.90 -0.39 1.07 0.00 0.00 176.91 177.48 2o9a h VAL 165 N 0.93 1.49 0.07 -2.22 -1.51 -1.00 -1.35 116.25 112.66 2o9a h VAL 165 Ca 0.21 -2.63 0.02 0.00 -1.23 0.00 0.00 66.70 63.07 2o9a h VAL 165 Cb 0.29 2.48 -0.03 0.00 -2.13 0.00 0.00 31.29 31.90 2o9a h VAL 165 CO -0.01 0.77 -0.21 0.40 -1.23 0.00 0.00 177.57 177.29 2o9a h ILE 166 N 0.12 0.53 -0.42 7.19 2.04 -1.13 0.11 117.51 125.94 2o9a h ILE 166 Ca -0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.83 2o9a h ILE 166 Cb 1.53 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 2o9a h ILE 166 CO 0.14 0.00 0.25 0.50 0.00 0.00 0.00 178.15 179.04 2o9a h LYS 167 N -0.37 0.49 -0.43 2.37 3.64 -1.08 -2.15 116.57 119.04 2o9a h LYS 167 Ca 0.04 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2o9a h LYS 167 Cb 0.41 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2o9a h LYS 167 CO -0.14 0.33 0.26 0.00 -2.27 0.00 0.00 179.45 177.63 2o9a h ALA 168 N 1.19 0.55 -0.70 5.00 0.00 -1.09 -1.99 119.26 122.22 2o9a h ALA 168 Ca 0.17 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.11 2o9a h ALA 168 Cb 0.01 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.55 2o9a h ALA 168 CO -0.08 0.04 0.36 0.00 0.00 0.00 0.00 179.25 179.57 2o9a h ALA 169 N 1.12 0.97 -0.63 0.00 0.00 -0.57 -0.00 119.26 120.13 2o9a h ALA 169 Ca 0.16 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2o9a h ALA 169 Cb -0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2o9a h ALA 169 CO -0.03 -0.03 0.15 0.87 0.00 0.00 0.00 179.25 180.21 2o9a h LYS 170 N 0.62 1.02 -0.78 0.00 6.56 -1.12 0.90 116.57 123.75 2o9a h LYS 170 Ca 0.34 -0.25 -0.04 0.00 -1.06 0.00 0.00 60.65 59.64 2o9a h LYS 170 Cb 0.34 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.83 2o9a h LYS 170 CO -0.25 0.93 0.33 0.93 -2.06 0.00 0.00 179.45 179.32 2o9a h GLU 171 N 0.94 1.16 -0.39 3.15 5.08 -0.53 -0.75 114.58 123.23 2o9a h GLU 171 Ca 0.20 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 2o9a h GLU 171 Cb 0.37 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2o9a h GLU 171 CO 0.00 0.93 -0.19 0.28 -1.00 0.00 0.00 179.01 179.04 2o9a h VAL 172 N 1.13 1.28 -0.32 3.13 2.07 -0.38 -1.15 116.25 122.01 2o9a h VAL 172 Ca 0.26 -1.32 0.06 0.00 0.82 0.00 0.00 66.70 66.53 2o9a h VAL 172 Cb 0.19 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 2o9a h VAL 172 CO -0.02 0.44 -0.08 0.74 0.02 0.00 0.00 177.57 178.67 2o9a h THR 173 N 0.62 0.68 -0.66 2.57 2.02 -0.70 0.22 112.91 117.66 2o9a h THR 173 Ca 0.09 -0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.22 2o9a h THR 173 Cb 0.74 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 2o9a h THR 173 CO 0.06 0.00 0.24 0.25 0.37 0.00 0.00 175.52 176.44 2o9a h LEU 174 N 0.00 0.93 -0.03 2.58 6.46 -1.03 -1.94 115.31 122.28 2o9a h LEU 174 Ca 0.16 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2o9a h LEU 174 Cb 0.24 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 39.92 2o9a h LEU 174 CO -0.33 0.86 0.02 0.00 -0.62 0.00 0.00 178.44 178.37 2o9a h ALA 175 N 1.10 0.04 -0.27 1.25 0.00 -0.50 -0.87 119.26 120.01 2o9a h ALA 175 Ca 0.22 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.17 2o9a h ALA 175 Cb 0.24 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 2o9a h ALA 175 CO -0.01 -0.46 -0.08 -0.92 0.00 0.00 0.00 179.25 177.78 2o9a h TYR 176 N 0.03 -0.17 -0.51 0.00 3.20 -0.41 -1.75 116.97 117.34 2o9a h TYR 176 Ca 0.01 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.98 2o9a h TYR 176 Cb 0.01 0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.34 2o9a h TYR 176 CO -0.07 -0.13 0.16 0.78 -1.64 0.00 0.00 178.16 177.25 2o9a h GLY 177 N -0.02 0.67 -0.30 1.82 0.00 -1.24 -1.57 103.07 102.42 2o9a h GLY 177 Ca 0.13 -0.07 0.12 0.00 0.00 0.00 0.00 47.33 47.51 2o9a h GLY 177 CO -0.29 -0.02 -0.21 -1.33 0.00 0.00 0.00 176.54 174.69 2o9a h GLY 178 N 0.32 0.29 0.64 4.60 0.00 -0.44 -3.51 103.07 104.97 2o9a h GLY 178 Ca 0.25 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.85 2o9a h GLY 178 CO -0.28 -0.24 0.00 1.15 0.00 0.00 0.00 176.54 177.17