#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o16 s LEU 19 N 0.00 4.40 -0.16 2.46 1.02 -1.26 -4.97 118.68 120.16 2o16 s LEU 19 Ca 0.00 1.89 0.16 0.00 0.02 0.00 0.00 54.13 56.20 2o16 s LEU 19 Cb 0.00 -3.93 0.70 0.00 0.02 0.00 0.00 46.19 42.98 2o16 s LEU 19 CO 0.00 -0.06 1.62 0.23 0.02 0.00 0.00 176.35 178.16 2o16 n MET 20 N 0.72 3.97 -1.70 1.70 2.81 -1.26 -4.99 117.12 118.38 2o16 n MET 20 Ca 0.01 -2.94 -0.42 0.00 -1.81 0.00 0.00 57.70 52.55 2o16 n MET 20 Cb 0.49 -1.98 -0.03 0.00 -0.71 0.00 0.00 33.22 30.99 2o16 n MET 20 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 2o16 n ILE 21 N 0.60 0.31 -3.96 2.02 5.41 -1.26 -4.92 119.36 117.56 2o16 n ILE 21 Ca 0.25 -0.06 -0.23 0.00 1.00 0.00 0.00 62.75 63.72 2o16 n ILE 21 Cb 0.98 -2.12 -0.02 0.00 -0.71 0.00 0.00 39.64 37.76 2o16 n ILE 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2o16 s LYS 22 N 2.48 3.43 0.22 0.38 1.02 -1.26 -0.28 119.74 125.74 2o16 s LYS 22 Ca 0.81 -0.71 -0.08 0.00 0.02 0.00 0.00 55.97 56.01 2o16 s LYS 22 Cb -0.48 -2.91 0.35 0.00 -0.52 0.00 0.00 37.83 34.27 2o16 s LYS 22 CO 0.36 0.46 1.69 0.28 -0.92 0.00 0.00 175.35 177.23 2o16 h VAL 23 N 1.34 0.58 0.00 3.17 2.07 -0.68 -0.60 116.25 122.13 2o16 h VAL 23 Ca -0.51 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2o16 h VAL 23 Cb 1.22 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2o16 h VAL 23 CO 0.64 0.04 0.06 1.05 0.02 0.00 0.00 177.57 179.38 2o16 h GLU 24 N 0.25 0.00 0.00 1.57 4.11 -1.55 -1.29 114.58 117.67 2o16 h GLU 24 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.78 2o16 h GLU 24 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2o16 h GLU 24 CO -0.46 0.00 0.00 -0.44 0.07 0.00 0.00 179.01 178.18 2o16 h ASP 25 N 0.00 0.00 0.00 3.06 3.32 -1.39 -3.36 116.42 118.04 2o16 h ASP 25 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2o16 h ASP 25 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2o16 h ASP 25 CO 0.00 0.00 0.00 1.15 -1.72 0.00 0.00 179.24 178.67 2o16 n MET 26 N -3.08 2.77 -1.55 3.56 0.00 -0.59 -5.05 117.12 113.19 2o16 n MET 26 Ca 0.03 -0.04 -0.32 0.00 0.00 0.00 0.00 57.70 57.36 2o16 n MET 26 Cb 0.43 -0.32 0.07 0.00 0.00 0.00 0.00 33.22 33.40 2o16 n MET 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2o16 s MET 27 N -0.41 2.51 -0.21 3.17 0.23 -0.61 -4.82 119.30 119.17 2o16 s MET 27 Ca 0.00 1.37 -0.29 0.00 -1.03 0.00 0.00 55.69 55.74 2o16 s MET 27 Cb 0.00 -1.92 -0.01 0.00 -1.53 0.00 0.00 34.83 31.38 2o16 s MET 27 CO 0.00 -1.47 1.29 0.99 -2.03 0.00 0.00 175.02 173.80 2o16 s THR 28 N -2.47 4.22 0.52 3.16 2.01 -0.07 -4.91 115.64 118.09 2o16 s THR 28 Ca 0.66 1.44 -0.02 0.00 0.31 0.00 0.00 61.69 64.08 2o16 s THR 28 Cb -0.20 -4.04 0.01 0.00 0.01 0.00 0.00 72.50 68.27 2o16 s THR 28 CO 0.46 -0.25 0.77 -0.13 -0.69 0.00 0.00 174.62 174.78 2o16 s ARG 29 N 3.76 2.90 -1.43 4.92 0.52 -1.26 -1.30 118.95 127.06 2o16 s ARG 29 Ca 0.56 -0.38 -0.03 0.00 -0.52 0.00 0.00 55.73 55.35 2o16 s ARG 29 Cb -0.20 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 32.82 2o16 s ARG 29 CO 0.18 -0.51 0.30 0.72 0.02 0.00 0.00 175.30 176.01 2o16 n HIS 30 N -2.30 -1.50 -1.93 -0.53 8.25 -1.25 -4.89 115.22 111.06 2o16 n HIS 30 Ca 0.04 0.64 -0.35 0.00 -0.26 0.00 0.00 57.72 57.79 2o16 n HIS 30 Cb 0.58 -3.32 0.04 0.00 1.12 0.00 0.00 29.99 28.41 2o16 n HIS 30 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2o16 s PRO 31 N -6.89 2.93 0.13 -0.41 0.04 -1.26 -4.96 135.00 124.58 2o16 s PRO 31 Ca 0.06 1.62 -0.31 0.00 0.04 0.00 0.00 61.00 62.41 2o16 s PRO 31 Cb -0.03 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.49 2o16 s PRO 31 CO 0.93 -1.19 1.37 -1.01 0.04 0.00 0.00 177.00 177.15 2o16 s HIS 32 N -1.93 3.25 0.31 0.56 3.76 -1.26 -5.03 115.29 114.94 2o16 s HIS 32 Ca 0.72 1.00 0.04 0.00 -0.15 0.00 0.00 55.06 56.68 2o16 s HIS 32 Cb -0.25 -3.67 -0.06 0.00 1.11 0.00 0.00 32.58 29.71 2o16 s HIS 32 CO 0.35 -2.29 0.03 0.95 -0.85 0.00 0.00 174.74 172.93 2o16 s THR 33 N 0.92 1.25 0.04 1.30 -4.23 -1.26 -4.14 115.64 109.52 2o16 s THR 33 Ca 0.63 -2.02 0.01 0.00 -1.18 0.00 0.00 61.69 59.13 2o16 s THR 33 Cb -0.37 -2.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.76 2o16 s THR 33 CO 0.32 -0.09 -0.06 -0.76 -0.54 0.00 0.00 174.62 173.49 2o16 s LEU 34 N -3.46 2.28 0.64 4.79 1.43 -0.61 -5.00 118.68 118.74 2o16 s LEU 34 Ca 0.34 -0.58 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 2o16 s LEU 34 Cb 0.08 -0.03 -0.01 0.00 0.03 0.00 0.00 46.19 46.25 2o16 s LEU 34 CO 0.14 -0.28 1.09 -0.76 0.23 0.00 0.00 176.35 176.77 2o16 s LEU 35 N -1.70 3.40 0.44 1.79 1.43 -1.26 -1.60 118.68 121.18 2o16 s LEU 35 Ca -0.10 1.91 0.30 0.00 -1.03 0.00 0.00 54.13 55.21 2o16 s LEU 35 Cb -0.08 -4.54 1.30 0.00 0.03 0.00 0.00 46.19 42.90 2o16 s LEU 35 CO -0.01 -1.46 1.90 0.08 0.23 0.00 0.00 176.35 177.08 2o16 h ARG 36 N 0.11 0.00 -0.01 1.70 0.11 -1.94 -1.79 114.38 112.56 2o16 h ARG 36 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2o16 h ARG 36 Cb 1.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.31 2o16 h ARG 36 CO 0.55 0.00 -0.43 0.25 0.10 0.00 0.00 179.97 180.44 2o16 n THR 37 N -2.72 0.00 -0.91 0.08 -2.24 -1.26 -0.71 114.28 106.51 2o16 n THR 37 Ca 0.01 -0.11 -0.29 0.00 -2.27 0.00 0.00 64.05 61.39 2o16 n THR 37 Cb 0.24 0.60 0.22 0.00 -2.10 0.00 0.00 70.33 69.29 2o16 n THR 37 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2o16 s HIS 38 N -2.66 1.48 0.43 4.78 3.76 -0.67 -4.74 115.29 117.67 2o16 s HIS 38 Ca 0.19 0.93 0.07 0.00 -0.15 0.00 0.00 55.06 56.09 2o16 s HIS 38 Cb 0.18 -3.22 -0.06 0.00 1.11 0.00 0.00 32.58 30.60 2o16 s HIS 38 CO 0.61 -3.51 0.12 0.95 -0.85 0.00 0.00 174.74 172.05 2o16 s THR 39 N -2.77 2.07 0.26 1.30 -4.23 -1.26 -0.59 115.64 110.42 2o16 s THR 39 Ca 0.67 -1.82 -0.03 0.00 -1.18 0.00 0.00 61.69 59.34 2o16 s THR 39 Cb -0.19 -2.89 0.26 0.00 1.34 0.00 0.00 72.50 71.01 2o16 s THR 39 CO 0.60 0.00 1.68 0.25 -0.54 0.00 0.00 174.62 176.60 2o16 h LEU 40 N 1.51 0.04 -0.73 4.79 6.46 -1.26 -1.83 115.31 124.28 2o16 h LEU 40 Ca -0.43 0.16 0.02 0.00 -0.12 0.00 0.00 57.88 57.50 2o16 h LEU 40 Cb 1.26 0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 41.35 2o16 h LEU 40 CO 0.74 -0.06 0.48 -1.13 -0.62 0.00 0.00 178.44 177.85 2o16 h ASN 41 N 0.27 0.82 -0.45 1.25 -1.24 -1.38 0.21 115.58 115.05 2o16 h ASN 41 Ca 0.46 -0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.44 2o16 h ASN 41 Cb 0.83 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.66 2o16 h ASN 41 CO -0.55 0.58 0.22 0.44 -1.29 0.00 0.00 177.43 176.84 2o16 h ASP 42 N 0.97 0.58 -0.38 1.15 3.32 -1.69 -1.26 116.42 119.11 2o16 h ASP 42 Ca 0.28 -0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.16 2o16 h ASP 42 Cb -0.07 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2o16 h ASP 42 CO -0.08 0.54 0.04 0.00 -1.72 0.00 0.00 179.24 178.02 2o16 h ALA 43 N 1.07 0.51 -0.25 3.45 0.00 -0.86 -0.87 119.26 122.31 2o16 h ALA 43 Ca 0.16 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 54.90 2o16 h ALA 43 Cb 0.10 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 2o16 h ALA 43 CO -0.02 0.24 -0.26 -0.22 0.00 0.00 0.00 179.25 178.99 2o16 h LYS 44 N 0.48 -0.25 -0.84 0.00 3.64 -0.52 -0.35 116.57 118.73 2o16 h LYS 44 Ca 0.11 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2o16 h LYS 44 Cb 0.40 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 2o16 h LYS 44 CO 0.01 -0.17 0.54 0.45 -2.27 0.00 0.00 179.45 178.01 2o16 h HIS 45 N -0.26 1.08 -0.40 1.91 3.86 -1.06 -0.72 115.15 119.55 2o16 h HIS 45 Ca 0.14 0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.29 2o16 h HIS 45 Cb 0.48 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 2o16 h HIS 45 CO -0.42 0.70 -0.02 1.25 0.86 0.00 0.00 177.93 180.30 2o16 h LEU 46 N 1.15 0.72 -0.60 2.43 5.85 -0.96 0.59 115.31 124.49 2o16 h LEU 46 Ca 0.31 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 58.71 2o16 h LEU 46 Cb -0.09 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 2o16 h LEU 46 CO -0.06 0.87 0.39 0.24 -0.34 0.00 0.00 178.44 179.54 2o16 h MET 47 N 0.55 0.78 -0.39 1.25 2.86 -0.74 -2.38 114.93 116.86 2o16 h MET 47 Ca 0.11 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.66 2o16 h MET 47 Cb 0.51 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2o16 h MET 47 CO 0.03 0.52 0.08 0.93 1.06 0.00 0.00 176.91 179.52 2o16 h GLU 48 N 0.80 0.64 -0.94 1.72 5.08 -0.98 0.17 114.58 121.07 2o16 h GLU 48 Ca 0.22 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2o16 h GLU 48 Cb -0.07 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.05 2o16 h GLU 48 CO -0.06 0.69 0.57 0.00 -1.00 0.00 0.00 179.01 179.21 2o16 h ALA 49 N 0.93 1.24 -0.02 3.43 0.00 -0.74 -3.02 119.26 121.08 2o16 h ALA 49 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2o16 h ALA 49 Cb 0.35 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2o16 h ALA 49 CO 0.01 0.66 -0.26 1.28 0.00 0.00 0.00 179.25 180.93 2o16 n LEU 50 N -4.36 2.06 -3.63 0.00 4.77 -0.91 -4.99 117.00 109.94 2o16 n LEU 50 Ca 0.10 -0.84 -0.26 0.00 -0.03 0.00 0.00 56.01 54.99 2o16 n LEU 50 Cb 0.06 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2o16 n LEU 50 CO 0.38 0.37 -0.07 -0.67 -1.33 0.00 0.00 177.39 176.08 2o16 n ASP 51 N 0.30 -4.14 -4.44 -1.43 2.03 0.47 -5.02 116.55 104.32 2o16 n ASP 51 Ca 0.09 -0.91 -0.24 0.00 0.52 0.00 0.00 54.79 54.24 2o16 n ASP 51 Cb 0.42 -3.85 -0.10 0.00 -0.72 0.00 0.00 41.12 36.87 2o16 n ASP 51 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2o16 s ILE 52 N -3.54 1.19 -0.00 5.18 -4.36 -0.54 -5.04 121.20 114.09 2o16 s ILE 52 Ca 0.32 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.71 2o16 s ILE 52 Cb -0.10 -2.69 0.01 0.00 1.25 0.00 0.00 42.46 40.93 2o16 s ILE 52 CO 0.83 0.00 0.74 0.54 0.24 0.00 0.00 174.94 177.29 2o16 n ARG 53 N -0.81 1.25 -3.71 0.37 1.74 -1.26 -4.59 116.66 109.64 2o16 n ARG 53 Ca -0.05 -0.98 -0.15 0.00 -0.77 0.00 0.00 57.85 55.91 2o16 n ARG 53 Cb 0.66 -0.73 -0.15 0.00 -1.02 0.00 0.00 32.46 31.23 2o16 n ARG 53 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2o16 s HIS 54 N -0.48 -0.17 -0.23 -1.55 3.76 -1.26 -0.89 115.29 114.46 2o16 s HIS 54 Ca 0.01 0.54 -0.01 0.00 -0.15 0.00 0.00 55.06 55.45 2o16 s HIS 54 Cb 0.01 -0.15 0.07 0.00 1.11 0.00 0.00 32.58 33.61 2o16 s HIS 54 CO 0.00 -0.21 0.01 0.08 -0.85 0.00 0.00 174.74 173.77 2o16 s VAL 55 N 1.64 1.06 0.42 -0.90 1.01 -0.43 -4.96 120.40 118.24 2o16 s VAL 55 Ca -0.04 -1.02 -0.26 0.00 0.00 0.00 0.00 61.98 60.66 2o16 s VAL 55 Cb -0.12 -1.50 -0.09 0.00 0.00 0.00 0.00 36.38 34.68 2o16 s VAL 55 CO -0.06 -0.25 1.35 -2.84 0.00 0.00 0.00 175.10 173.31 2o16 s PRO 56 N 1.60 3.86 -0.23 2.72 0.02 -1.26 -1.33 135.00 140.38 2o16 s PRO 56 Ca -0.01 2.26 -0.09 0.00 0.02 0.00 0.00 61.00 63.18 2o16 s PRO 56 Cb -0.18 -2.72 -0.04 0.00 0.02 0.00 0.00 34.50 31.57 2o16 s PRO 56 CO -0.10 -0.62 0.12 0.42 -0.33 0.00 0.00 177.00 176.50 2o16 s ILE 57 N -1.24 5.08 0.19 2.83 -1.09 0.72 -1.58 121.20 126.12 2o16 s ILE 57 Ca 0.58 0.08 0.04 0.00 -2.23 0.00 0.00 60.65 59.12 2o16 s ILE 57 Cb -0.40 -3.35 -0.05 0.00 -1.58 0.00 0.00 42.46 37.08 2o16 s ILE 57 CO 0.52 0.38 -0.04 0.68 -1.23 0.00 0.00 174.94 175.25 2o16 s VAL 58 N 0.93 1.02 0.37 2.92 -7.23 -0.63 -0.46 120.40 117.32 2o16 s VAL 58 Ca 0.06 -2.03 -0.02 0.00 -1.81 0.00 0.00 61.98 58.18 2o16 s VAL 58 Cb -0.13 -2.11 0.08 0.00 0.56 0.00 0.00 36.38 34.77 2o16 s VAL 58 CO 0.03 -0.51 0.50 -0.90 -0.31 0.00 0.00 175.10 173.91 2o16 n ASP 59 N -0.30 0.50 0.29 4.85 5.68 -0.51 -4.13 116.55 122.93 2o16 n ASP 59 Ca -0.07 -1.46 0.15 0.00 -0.50 0.00 0.00 54.79 52.90 2o16 n ASP 59 Cb 0.62 -0.34 0.89 0.00 -1.14 0.00 0.00 41.12 41.15 2o16 n ASP 59 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2o16 h ALA 60 N -0.84 1.48 -0.56 2.12 0.00 -2.00 -1.33 119.26 118.13 2o16 h ALA 60 Ca -0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2o16 h ALA 60 Cb 0.57 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2o16 h ALA 60 CO 0.16 0.03 0.01 0.09 0.00 0.00 0.00 179.25 179.53 2o16 n ASN 61 N -3.81 5.57 -0.79 0.00 3.02 -1.26 -4.92 115.26 113.07 2o16 n ASN 61 Ca -0.03 -2.91 -0.10 0.00 -0.03 0.00 0.00 54.58 51.51 2o16 n ASN 61 Cb 0.11 -0.68 -0.04 0.00 -0.61 0.00 0.00 39.78 38.55 2o16 n ASN 61 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2o16 n LYS 62 N 0.59 -0.87 -2.75 3.52 5.02 -0.50 -4.85 118.16 118.32 2o16 n LYS 62 Ca 0.27 0.84 -0.40 0.00 -2.02 0.00 0.00 58.31 56.99 2o16 n LYS 62 Cb 1.18 -4.82 -0.05 0.00 -0.02 0.00 0.00 35.03 31.31 2o16 n LYS 62 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2o16 s LYS 63 N -2.77 4.79 -0.03 1.97 1.02 -1.26 -0.86 119.74 122.60 2o16 s LYS 63 Ca 0.00 1.46 -0.30 0.00 0.02 0.00 0.00 55.97 57.15 2o16 s LYS 63 Cb 0.00 -3.32 -0.04 0.00 -0.52 0.00 0.00 37.83 33.95 2o16 s LYS 63 CO 0.00 0.40 1.20 -1.17 -0.92 0.00 0.00 175.35 174.86 2o16 s LEU 64 N -0.71 4.30 -0.09 3.17 2.96 -0.86 -1.42 118.68 126.02 2o16 s LEU 64 Ca 0.43 1.86 0.12 0.00 -0.22 0.00 0.00 54.13 56.32 2o16 s LEU 64 Cb -0.25 -3.56 -0.18 0.00 0.50 0.00 0.00 46.19 42.70 2o16 s LEU 64 CO 0.31 -0.56 0.12 0.18 -1.32 0.00 0.00 176.35 175.08 2o16 n LEU 65 N 4.95 0.00 0.00 -0.68 4.77 0.39 -4.94 117.00 121.50 2o16 n LEU 65 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2o16 n LEU 65 Cb 0.46 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 2o16 n LEU 65 CO 0.55 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2o16 n GLY 66 N 2.05 -1.33 3.35 -0.72 0.00 -1.03 -4.98 105.19 102.54 2o16 n GLY 66 Ca -0.15 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 2o16 n GLY 66 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2o16 s ILE 67 N -2.93 0.01 -0.07 -0.61 2.07 -1.26 -0.20 121.20 118.20 2o16 s ILE 67 Ca 0.00 -0.05 0.04 0.00 -1.41 0.00 0.00 60.65 59.22 2o16 s ILE 67 Cb 0.00 -0.65 -0.02 0.00 0.13 0.00 0.00 42.46 41.92 2o16 s ILE 67 CO 0.00 -0.03 -0.18 0.68 -1.91 0.00 0.00 174.94 173.51 2o16 s VAL 68 N 0.01 2.73 0.36 4.00 -7.23 -0.44 -4.36 120.40 115.46 2o16 s VAL 68 Ca -0.02 -0.82 0.07 0.00 -1.81 0.00 0.00 61.98 59.40 2o16 s VAL 68 Cb -0.03 -2.07 -0.02 0.00 0.56 0.00 0.00 36.38 34.82 2o16 s VAL 68 CO 0.01 0.57 0.35 -0.94 -0.31 0.00 0.00 175.10 174.79 2o16 s SER 69 N -0.28 5.33 0.31 4.85 1.04 -1.26 -1.31 113.70 122.38 2o16 s SER 69 Ca 0.01 -0.52 0.04 0.00 0.48 0.00 0.00 55.95 55.96 2o16 s SER 69 Cb -0.13 -0.88 0.65 0.00 0.10 0.00 0.00 66.02 65.76 2o16 s SER 69 CO 0.03 -0.47 1.84 -0.61 0.98 0.00 0.00 173.24 175.01 2o16 h GLN 70 N 1.11 0.86 -0.95 4.02 4.15 -1.37 -1.67 115.11 121.27 2o16 h GLN 70 Ca -0.44 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 58.93 2o16 h GLN 70 Cb 1.26 -0.19 -0.05 0.00 0.21 0.00 0.00 27.48 28.71 2o16 h GLN 70 CO 0.57 0.57 0.59 -0.09 -1.93 0.00 0.00 178.83 178.54 2o16 h ARG 71 N 0.89 1.28 -0.30 1.69 2.43 -1.95 0.14 114.38 118.56 2o16 h ARG 71 Ca 0.49 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.56 2o16 h ARG 71 Cb 0.60 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2o16 h ARG 71 CO -0.26 0.88 0.19 -0.44 -1.51 0.00 0.00 179.97 178.83 2o16 h ASP 72 N 1.30 0.33 -0.46 -3.80 3.32 -1.71 -0.64 116.42 114.76 2o16 h ASP 72 Ca 0.34 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.32 2o16 h ASP 72 Cb -0.08 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 2o16 h ASP 72 CO -0.07 0.24 0.01 -0.07 -1.72 0.00 0.00 179.24 177.64 2o16 h LEU 73 N 0.40 0.79 -0.56 1.55 3.38 -0.81 -1.60 115.31 118.46 2o16 h LEU 73 Ca 0.11 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 2o16 h LEU 73 Cb -0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2o16 h LEU 73 CO -0.03 0.90 0.13 -0.07 0.09 0.00 0.00 178.44 179.46 2o16 h LEU 74 N 0.66 0.86 -0.91 1.67 3.38 -0.67 -1.12 115.31 119.18 2o16 h LEU 74 Ca 0.13 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2o16 h LEU 74 Cb 0.48 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2o16 h LEU 74 CO 0.02 0.87 0.09 0.00 0.09 0.00 0.00 178.44 179.51 2o16 h ALA 75 N 1.02 1.10 -0.40 1.53 0.00 -0.99 -0.06 119.26 121.45 2o16 h ALA 75 Ca 0.18 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2o16 h ALA 75 Cb 0.35 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2o16 h ALA 75 CO 0.00 0.59 -0.24 0.00 0.00 0.00 0.00 179.25 179.60 2o16 h ALA 76 N 1.25 0.57 -0.27 0.00 0.00 -1.04 -0.12 119.26 119.65 2o16 h ALA 76 Ca 0.17 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2o16 h ALA 76 Cb 0.38 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2o16 h ALA 76 CO 0.01 0.56 0.06 1.96 0.00 0.00 0.00 179.25 181.84 2o16 h GLN 77 N 0.68 0.44 -0.72 0.00 4.20 -1.03 -2.13 115.11 116.54 2o16 h GLN 77 Ca 0.08 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 2o16 h GLN 77 Cb 0.81 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.50 2o16 h GLN 77 CO 0.07 0.54 0.28 0.93 -0.67 0.00 0.00 178.83 179.97 2o16 h GLU 78 N 0.26 1.09 0.00 1.46 5.08 -1.00 -2.20 114.58 119.27 2o16 h GLU 78 Ca 0.08 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2o16 h GLU 78 Cb 0.30 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2o16 h GLU 78 CO 0.00 0.91 0.00 0.45 -1.00 0.00 0.00 179.01 179.37 2o16 n SER 79 N -4.33 0.30 -0.03 1.42 2.88 -0.06 -2.70 113.62 111.09 2o16 n SER 79 Ca 0.06 0.58 -0.12 0.00 -1.33 0.00 0.00 58.87 58.05 2o16 n SER 79 Cb 0.19 -0.64 -0.14 0.00 -0.75 0.00 0.00 64.21 62.87 2o16 n SER 79 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2o16 n SER 80 N -1.83 1.08 -4.56 -3.46 2.88 -0.81 -4.59 113.62 102.32 2o16 n SER 80 Ca 0.03 0.29 -0.23 0.00 -1.33 0.00 0.00 58.87 57.63 2o16 n SER 80 Cb 0.19 -0.11 -0.06 0.00 -0.75 0.00 0.00 64.21 63.48 2o16 n SER 80 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2o16 s LEU 81 N -6.23 3.04 0.00 2.46 1.43 -1.02 -5.11 118.68 113.24 2o16 s LEU 81 Ca -0.11 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 2o16 s LEU 81 Cb 0.07 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.73 2o16 s LEU 81 CO 0.80 -3.16 0.00 1.67 0.23 0.00 0.00 176.35 175.89 2o16 n GLN 82 N 8.74 0.00 0.00 1.70 -0.06 -1.26 -5.01 117.38 121.49 2o16 n GLN 82 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.42 2o16 n GLN 82 Cb 0.46 -0.12 0.00 0.00 -4.06 0.00 0.00 30.24 26.52 2o16 n GLN 82 CO 0.00 0.00 0.00 1.97 -0.20 0.00 0.00 177.06 178.83 2o16 n PHE 92 N -1.12 0.00 0.71 3.69 -1.74 -1.26 -5.22 117.46 112.53 2o16 n PHE 92 Ca 0.00 0.00 0.12 0.00 -0.56 0.00 0.00 57.45 57.01 2o16 n PHE 92 Cb 0.00 0.00 0.18 0.00 1.52 0.00 0.00 39.48 41.18 2o16 n PHE 92 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 2o16 n GLU 93 N -0.08 2.37 -1.67 3.97 -0.58 -1.26 -1.06 120.64 122.34 2o16 n GLU 93 Ca 0.00 -2.03 -0.48 0.00 -0.42 0.00 0.00 57.16 54.22 2o16 n GLU 93 Cb 0.00 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.34 2o16 n GLU 93 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2o16 n THR 94 N 1.34 0.21 -1.91 2.62 -1.04 -1.26 -4.75 114.28 109.50 2o16 n THR 94 Ca 0.17 -0.04 -0.40 0.00 -2.04 0.00 0.00 64.05 61.74 2o16 n THR 94 Cb 0.59 -1.53 0.01 0.00 -1.82 0.00 0.00 70.33 67.58 2o16 n THR 94 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2o16 s PRO 95 N 2.05 3.85 0.40 -2.82 0.02 -1.26 -1.30 135.00 135.95 2o16 s PRO 95 Ca 0.85 2.33 0.08 0.00 0.02 0.00 0.00 61.00 64.28 2o16 s PRO 95 Cb -0.75 -2.74 0.86 0.00 0.02 0.00 0.00 34.50 31.90 2o16 s PRO 95 CO 0.45 -0.65 2.00 -0.07 -0.33 0.00 0.00 177.00 178.41 2o16 h LEU 96 N 2.55 0.51 -2.11 -5.54 3.38 -0.50 -1.23 115.31 112.37 2o16 h LEU 96 Ca -0.50 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.55 2o16 h LEU 96 Cb 1.25 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2o16 h LEU 96 CO 0.62 0.34 0.28 2.19 0.09 0.00 0.00 178.44 181.97 2o16 h PHE 97 N 0.59 0.00 0.00 1.13 -5.15 -1.18 0.97 116.94 113.29 2o16 h PHE 97 Ca 0.24 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.97 2o16 h PHE 97 Cb 0.20 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.37 2o16 h PHE 97 CO -0.00 0.00 -0.30 0.93 -2.00 0.00 0.00 178.31 176.94 2o16 h GLU 98 N 0.00 0.00 0.06 6.09 5.08 -1.51 -3.36 114.58 120.95 2o16 h GLU 98 Ca 0.14 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.14 2o16 h GLU 98 Cb 0.71 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 2o16 h GLU 98 CO -0.00 0.16 -2.10 0.28 -1.00 0.00 0.00 179.01 176.35 2o16 n VAL 99 N -3.09 1.65 -2.26 3.13 0.31 -0.05 -4.97 118.33 113.06 2o16 n VAL 99 Ca 0.02 -0.68 -0.38 0.00 -0.01 0.00 0.00 64.34 63.30 2o16 n VAL 99 Cb 0.61 -1.43 -0.02 0.00 -0.91 0.00 0.00 33.84 32.09 2o16 n VAL 99 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2o16 s MET 100 N -2.55 4.00 0.34 5.55 0.23 0.13 -4.97 119.30 122.04 2o16 s MET 100 Ca -0.21 1.87 -0.29 0.00 -1.03 0.00 0.00 55.69 56.03 2o16 s MET 100 Cb 0.07 -2.65 -0.10 0.00 -1.53 0.00 0.00 34.83 30.62 2o16 s MET 100 CO 0.74 -0.37 1.36 -1.01 -2.03 0.00 0.00 175.02 173.70 2o16 s HIS 101 N -1.41 2.92 -0.18 3.16 3.76 -1.26 -4.93 115.29 117.35 2o16 s HIS 101 Ca 0.58 1.35 0.24 0.00 -0.15 0.00 0.00 55.06 57.08 2o16 s HIS 101 Cb -0.31 -3.77 0.62 0.00 1.11 0.00 0.00 32.58 30.22 2o16 s HIS 101 CO 0.39 -2.17 1.70 1.79 -0.85 0.00 0.00 174.74 175.60 2o16 h THR 102 N 3.01 0.23 -3.39 1.30 1.35 -1.95 -3.42 112.91 110.05 2o16 h THR 102 Ca -0.49 -1.12 -0.59 0.00 -0.55 0.00 0.00 66.41 63.66 2o16 h THR 102 Cb 1.23 1.92 -0.09 0.00 -1.73 0.00 0.00 68.15 69.49 2o16 h THR 102 CO 0.65 0.12 0.18 -1.81 -0.25 0.00 0.00 175.52 174.41 2o16 s ASP 103 N -6.13 6.76 -0.15 5.36 1.01 -1.26 -5.05 116.67 117.22 2o16 s ASP 103 Ca 0.04 0.93 0.01 0.00 0.71 0.00 0.00 52.55 54.24 2o16 s ASP 103 Cb 0.07 -2.37 0.02 0.00 1.01 0.00 0.00 42.92 41.64 2o16 s ASP 103 CO 0.65 -0.29 -0.18 -0.69 0.21 0.00 0.00 175.17 174.87 2o16 s VAL 104 N 1.90 1.79 -0.16 -1.27 1.01 -1.26 -5.00 120.40 117.41 2o16 s VAL 104 Ca 0.31 -0.79 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2o16 s VAL 104 Cb -0.16 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2o16 s VAL 104 CO 0.11 0.50 0.08 -0.89 0.00 0.00 0.00 175.10 174.90 2o16 s THR 105 N 1.18 4.97 0.28 3.92 2.01 -1.26 -5.09 115.64 121.64 2o16 s THR 105 Ca -0.00 0.02 -0.03 0.00 0.31 0.00 0.00 61.69 62.00 2o16 s THR 105 Cb -0.14 -3.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.14 2o16 s THR 105 CO -0.07 0.50 0.34 -0.94 -0.69 0.00 0.00 174.62 173.76 2o16 s SER 106 N -0.04 0.60 0.05 3.53 1.04 -1.26 -4.14 113.70 113.49 2o16 s SER 106 Ca 0.07 -1.38 -0.05 0.00 0.48 0.00 0.00 55.95 55.07 2o16 s SER 106 Cb -0.12 0.54 -0.02 0.00 0.10 0.00 0.00 66.02 66.53 2o16 s SER 106 CO 0.01 -1.09 0.09 0.54 0.98 0.00 0.00 173.24 173.77 2o16 s VAL 107 N -3.66 0.16 0.36 5.02 0.11 -0.63 -4.99 120.40 116.77 2o16 s VAL 107 Ca 0.33 -1.28 -0.19 0.00 -2.93 0.00 0.00 61.98 57.90 2o16 s VAL 107 Cb 0.02 -1.15 -0.10 0.00 -1.53 0.00 0.00 36.38 33.62 2o16 s VAL 107 CO 0.17 -0.71 0.86 0.00 -3.33 0.00 0.00 175.10 172.09 2o16 s ALA 108 N -3.24 3.19 0.52 1.54 0.00 -1.26 -0.82 121.76 121.70 2o16 s ALA 108 Ca 0.00 0.27 0.29 0.00 0.00 0.00 0.00 51.96 52.53 2o16 s ALA 108 Cb 0.03 -2.99 1.70 0.00 0.00 0.00 0.00 23.12 21.85 2o16 s ALA 108 CO -0.08 0.22 2.19 -1.00 0.00 0.00 0.00 175.76 177.09 2o16 h PRO 109 N 2.32 0.00 -0.00 0.00 0.13 -1.93 -2.25 132.00 130.27 2o16 h PRO 109 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2o16 h PRO 109 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2o16 h PRO 109 CO 0.63 0.05 -0.07 0.00 -0.23 0.00 0.00 178.00 178.38 2o16 n GLN 110 N -3.73 0.61 -1.68 0.86 0.00 -1.26 -1.55 117.38 110.63 2o16 n GLN 110 Ca -0.02 -0.14 -0.37 0.00 0.00 0.00 0.00 57.00 56.46 2o16 n GLN 110 Cb 0.14 -1.50 0.06 0.00 0.00 0.00 0.00 30.24 28.95 2o16 n GLN 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2o16 n ALA 111 N -1.08 0.76 -1.77 2.61 0.00 -0.85 -4.68 120.51 115.51 2o16 n ALA 111 Ca 0.15 0.01 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 2o16 n ALA 111 Cb 0.26 -2.23 -0.03 0.00 0.00 0.00 0.00 19.45 17.44 2o16 n ALA 111 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2o16 s GLY 112 N -1.28 2.99 0.06 0.00 0.00 -1.26 -0.27 107.32 107.55 2o16 s GLY 112 Ca 0.79 1.01 -0.22 0.00 0.00 0.00 0.00 44.72 46.30 2o16 s GLY 112 CO 0.44 1.60 1.52 -2.00 0.00 0.00 0.00 173.10 174.65 2o16 h LEU 113 N 3.37 0.20 -0.60 0.66 5.85 -0.90 -1.63 115.31 122.26 2o16 h LEU 113 Ca -0.48 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 57.93 2o16 h LEU 113 Cb 1.22 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 2o16 h LEU 113 CO 0.65 0.42 0.20 0.50 -0.34 0.00 0.00 178.44 179.87 2o16 h LYS 114 N -0.02 0.92 -0.69 1.25 3.64 -1.93 0.09 116.57 119.82 2o16 h LYS 114 Ca 0.04 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 2o16 h LYS 114 Cb 0.31 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2o16 h LYS 114 CO 0.00 0.82 0.39 1.49 -2.27 0.00 0.00 179.45 179.88 2o16 h GLU 115 N 0.84 0.95 -0.37 1.90 4.81 -1.94 -0.67 114.58 120.11 2o16 h GLU 115 Ca 0.19 -0.10 -0.16 0.00 -0.13 0.00 0.00 59.36 59.16 2o16 h GLU 115 Cb 0.27 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2o16 h GLU 115 CO -0.01 0.71 -0.39 0.77 -0.73 0.00 0.00 179.01 179.36 2o16 h SER 116 N 0.94 0.96 -0.49 1.04 0.02 -0.70 -1.73 113.55 113.61 2o16 h SER 116 Ca 0.24 -0.44 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 2o16 h SER 116 Cb 0.02 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 2o16 h SER 116 CO -0.04 1.23 0.21 0.00 -1.14 0.00 0.00 176.83 177.09 2o16 h ALA 117 N 0.81 0.63 -0.76 3.77 0.00 -0.74 -0.89 119.26 122.08 2o16 h ALA 117 Ca 0.06 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2o16 h ALA 117 Cb 0.98 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2o16 h ALA 117 CO 0.09 0.23 0.49 0.82 0.00 0.00 0.00 179.25 180.88 2o16 h ILE 118 N 0.64 1.16 -0.39 0.00 2.04 -0.98 0.12 117.51 120.11 2o16 h ILE 118 Ca 0.16 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.72 2o16 h ILE 118 Cb 0.17 0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.30 2o16 h ILE 118 CO -0.02 0.18 0.16 0.22 0.00 0.00 0.00 178.15 178.69 2o16 h TYR 119 N 0.99 0.28 -0.75 1.37 3.20 -1.07 0.14 116.97 121.13 2o16 h TYR 119 Ca 0.29 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.13 2o16 h TYR 119 Cb -0.07 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.10 2o16 h TYR 119 CO -0.02 0.13 0.28 0.52 -1.64 0.00 0.00 178.16 177.42 2o16 h MET 120 N 0.33 1.14 0.24 1.82 2.86 -0.56 -1.08 114.93 119.67 2o16 h MET 120 Ca 0.17 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2o16 h MET 120 Cb 0.13 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.61 2o16 h MET 120 CO -0.16 0.94 -0.12 0.37 1.06 0.00 0.00 176.91 179.01 2o16 h GLN 121 N 1.10 -0.31 -0.65 1.72 4.15 -0.49 -0.37 115.11 120.26 2o16 h GLN 121 Ca 0.25 0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.61 2o16 h GLN 121 Cb 0.25 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.98 2o16 h GLN 121 CO -0.02 -0.17 0.09 -0.22 -1.93 0.00 0.00 178.83 176.59 2o16 h LYS 122 N -0.37 1.09 -0.66 1.69 3.64 -0.80 -2.85 116.57 118.29 2o16 h LYS 122 Ca -0.03 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2o16 h LYS 122 Cb 0.29 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2o16 h LYS 122 CO 0.05 1.01 0.00 0.72 -2.27 0.00 0.00 179.45 178.96 2o16 n HIS 123 N -4.23 0.98 -4.00 1.91 8.25 -0.42 -4.96 115.22 112.74 2o16 n HIS 123 Ca 0.04 -0.46 -0.27 0.00 -0.26 0.00 0.00 57.72 56.77 2o16 n HIS 123 Cb 0.30 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.34 2o16 n HIS 123 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2o16 n LYS 124 N 1.38 -3.09 -3.44 -0.41 4.76 -0.53 -4.95 118.16 111.86 2o16 n LYS 124 Ca 0.23 0.38 -0.40 0.00 -2.87 0.00 0.00 58.31 55.64 2o16 n LYS 124 Cb 0.61 -4.49 -0.10 0.00 -1.84 0.00 0.00 35.03 29.21 2o16 n LYS 124 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2o16 s ILE 125 N -3.95 5.20 0.12 -0.18 -1.09 -0.26 -4.97 121.20 116.07 2o16 s ILE 125 Ca 0.05 0.04 -0.03 0.00 -2.23 0.00 0.00 60.65 58.48 2o16 s ILE 125 Cb -0.03 -3.77 -0.20 0.00 -1.58 0.00 0.00 42.46 36.88 2o16 s ILE 125 CO 0.90 -0.03 1.27 1.23 -1.23 0.00 0.00 174.94 177.08 2o16 h GLY 126 N 8.65 0.38 -6.28 6.18 0.00 -1.92 -3.43 103.07 106.65 2o16 h GLY 126 Ca -0.31 -0.74 -0.37 0.00 0.00 0.00 0.00 47.33 45.91 2o16 h GLY 126 CO 0.67 0.65 -0.76 0.00 0.00 0.00 0.00 176.54 177.10 2o16 s LEU 128 N 0.92 3.72 0.49 0.00 2.96 -0.26 -4.95 118.68 121.55 2o16 s LEU 128 Ca -0.11 -1.63 -0.24 0.00 -0.22 0.00 0.00 54.13 51.93 2o16 s LEU 128 Cb -0.14 -1.50 -0.07 0.00 0.50 0.00 0.00 46.19 44.99 2o16 s LEU 128 CO -0.01 -0.27 1.40 -2.84 -1.32 0.00 0.00 176.35 173.31 2o16 s PRO 129 N 1.10 3.47 -0.19 0.98 0.02 -1.26 -0.46 135.00 138.66 2o16 s PRO 129 Ca -0.01 2.35 -0.03 0.00 0.02 0.00 0.00 61.00 63.33 2o16 s PRO 129 Cb -0.19 -2.50 -0.01 0.00 0.02 0.00 0.00 34.50 31.82 2o16 s PRO 129 CO -0.07 -0.97 -0.07 0.08 -0.33 0.00 0.00 177.00 175.64 2o16 s VAL 130 N -1.24 3.28 -0.00 3.83 1.01 0.51 -1.61 120.40 126.17 2o16 s VAL 130 Ca 0.65 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.14 2o16 s VAL 130 Cb -0.42 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 2o16 s VAL 130 CO 0.53 0.46 -0.16 0.68 0.00 0.00 0.00 175.10 176.61 2o16 s VAL 131 N 1.05 1.27 -0.14 2.92 -7.23 0.00 -0.77 120.40 117.50 2o16 s VAL 131 Ca 0.00 -0.74 -0.00 0.00 -1.81 0.00 0.00 61.98 59.43 2o16 s VAL 131 Cb -0.15 -1.07 0.03 0.00 0.56 0.00 0.00 36.38 35.76 2o16 s VAL 131 CO -0.01 0.32 -0.07 0.00 -0.31 0.00 0.00 175.10 175.03 2o16 s ALA 132 N -0.44 1.43 -1.31 1.32 0.00 -0.19 -4.12 121.76 118.46 2o16 s ALA 132 Ca 0.06 -0.70 -0.03 0.00 0.00 0.00 0.00 51.96 51.29 2o16 s ALA 132 Cb -0.06 -1.01 0.01 0.00 0.00 0.00 0.00 23.12 22.05 2o16 s ALA 132 CO -0.00 -0.57 0.92 1.63 0.00 0.00 0.00 175.76 177.74 2o16 n LYS 133 N 4.90 -6.10 0.00 0.00 5.02 -1.26 -1.56 118.16 119.16 2o16 n LYS 133 Ca -0.13 0.73 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 2o16 n LYS 133 Cb 0.49 -5.58 0.00 0.00 -0.02 0.00 0.00 35.03 29.92 2o16 n LYS 133 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2o16 n ASP 134 N -3.05 0.00 -4.72 4.39 8.00 -1.26 -4.98 116.55 114.93 2o16 n ASP 134 Ca -0.20 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 54.88 2o16 n ASP 134 Cb 0.64 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 2o16 n ASP 134 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2o16 s VAL 135 N -0.29 3.64 -0.22 2.53 1.01 -0.60 -2.04 120.40 124.43 2o16 s VAL 135 Ca 0.00 1.25 -0.29 0.00 0.00 0.00 0.00 61.98 62.93 2o16 s VAL 135 Cb 0.00 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2o16 s VAL 135 CO 0.00 0.13 1.47 -0.22 0.00 0.00 0.00 175.10 176.49 2o16 s LEU 136 N 0.61 3.98 -0.01 3.92 2.96 -0.04 -1.02 118.68 129.08 2o16 s LEU 136 Ca 0.58 1.57 0.16 0.00 -0.22 0.00 0.00 54.13 56.22 2o16 s LEU 136 Cb -0.33 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 42.63 2o16 s LEU 136 CO 0.32 -1.10 0.56 1.33 -1.32 0.00 0.00 176.35 176.14 2o16 n VAL 137 N 6.10 0.00 -3.95 1.68 0.24 0.05 -4.96 118.33 117.49 2o16 n VAL 137 Ca 0.17 -0.21 0.04 0.00 -2.04 0.00 0.00 64.34 62.29 2o16 n VAL 137 Cb 0.45 0.72 0.01 0.00 -1.47 0.00 0.00 33.84 33.55 2o16 n VAL 137 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2o16 s GLY 138 N -2.91 -0.22 0.05 7.63 0.00 -1.08 -3.94 107.32 106.85 2o16 s GLY 138 Ca 0.02 0.22 0.02 0.00 0.00 0.00 0.00 44.72 44.98 2o16 s GLY 138 CO 0.65 5.35 -0.08 -0.26 0.00 0.00 0.00 173.10 178.75 2o16 s ILE 139 N -2.04 0.60 -0.24 0.90 -4.36 -0.42 -0.36 121.20 115.29 2o16 s ILE 139 Ca 0.28 -1.18 -0.07 0.00 -0.26 0.00 0.00 60.65 59.43 2o16 s ILE 139 Cb 0.01 -0.74 -0.03 0.00 1.25 0.00 0.00 42.46 42.94 2o16 s ILE 139 CO -0.02 -0.41 0.06 -0.63 0.24 0.00 0.00 174.94 174.17 2o16 s ILE 140 N -1.57 4.31 0.37 8.37 1.01 0.39 -0.89 121.20 133.19 2o16 s ILE 140 Ca -0.07 -0.18 0.04 0.00 0.00 0.00 0.00 60.65 60.44 2o16 s ILE 140 Cb -0.09 -3.00 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 2o16 s ILE 140 CO 0.00 0.36 0.05 0.42 0.00 0.00 0.00 174.94 175.77 2o16 s THR 141 N 1.41 1.36 0.32 2.92 -4.23 -1.26 -1.10 115.64 115.04 2o16 s THR 141 Ca 0.05 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.65 2o16 s THR 141 Cb -0.15 -2.78 0.31 0.00 1.34 0.00 0.00 72.50 71.22 2o16 s THR 141 CO 0.03 0.00 1.72 0.44 -0.54 0.00 0.00 174.62 176.27 2o16 h ASP 142 N 1.95 0.59 -0.84 3.99 3.32 -1.98 0.15 116.42 123.61 2o16 h ASP 142 Ca -0.41 0.15 0.08 0.00 0.02 0.00 0.00 57.03 56.86 2o16 h ASP 142 Cb 1.25 0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.80 2o16 h ASP 142 CO 0.72 0.06 0.55 0.28 -1.72 0.00 0.00 179.24 179.13 2o16 h SER 143 N 0.52 0.77 -0.50 6.45 0.02 -1.95 -0.77 113.55 118.09 2o16 h SER 143 Ca 0.64 0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.52 2o16 h SER 143 Cb 1.24 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 2o16 h SER 143 CO -0.50 0.47 -0.01 0.44 -1.14 0.00 0.00 176.83 176.09 2o16 h ASP 144 N 0.86 0.91 -0.28 3.07 3.32 -1.28 -2.79 116.42 120.24 2o16 h ASP 144 Ca 0.38 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 57.09 2o16 h ASP 144 Cb 0.34 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2o16 h ASP 144 CO -0.15 0.98 -0.13 -0.26 -1.72 0.00 0.00 179.24 177.96 2o16 h PHE 145 N 0.86 0.77 -0.38 4.55 0.04 -1.13 -1.38 116.94 120.28 2o16 h PHE 145 Ca 0.16 -0.14 0.05 0.00 2.80 0.00 0.00 57.97 60.84 2o16 h PHE 145 Cb 0.52 -0.20 -0.05 0.00 2.20 0.00 0.00 35.95 38.43 2o16 h PHE 145 CO 0.03 0.80 0.10 0.28 -0.60 0.00 0.00 178.31 178.93 2o16 h VAL 146 N 0.64 0.85 -0.35 -0.55 2.07 -0.98 0.87 116.25 118.79 2o16 h VAL 146 Ca 0.11 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 2o16 h VAL 146 Cb 0.59 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 2o16 h VAL 146 CO 0.04 0.04 0.20 0.74 0.02 0.00 0.00 177.57 178.62 2o16 h THR 147 N 0.24 1.13 -0.28 2.57 2.02 -1.29 -1.22 112.91 116.07 2o16 h THR 147 Ca 0.18 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 66.94 2o16 h THR 147 Cb 0.19 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2o16 h THR 147 CO -0.21 0.13 -0.29 -0.29 0.37 0.00 0.00 175.52 175.23 2o16 h ILE 148 N 0.45 1.28 -0.66 3.11 6.09 -1.11 -1.51 117.51 125.17 2o16 h ILE 148 Ca 0.12 -1.38 0.00 0.00 -1.37 0.00 0.00 64.86 62.24 2o16 h ILE 148 Cb 0.02 1.37 -0.03 0.00 0.47 0.00 0.00 36.82 38.66 2o16 h ILE 148 CO -0.02 0.44 0.41 0.00 -3.07 0.00 0.00 178.15 175.91 2o16 h ALA 149 N 1.19 0.83 -0.10 0.18 0.00 -0.45 -0.96 119.26 119.95 2o16 h ALA 149 Ca 0.06 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2o16 h ALA 149 Cb 0.75 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2o16 h ALA 149 CO 0.06 0.29 0.04 0.82 0.00 0.00 0.00 179.25 180.46 2o16 h ILE 150 N 0.89 0.98 -0.69 0.00 2.04 -0.99 0.00 117.51 119.75 2o16 h ILE 150 Ca 0.24 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 66.02 2o16 h ILE 150 Cb -0.06 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 2o16 h ILE 150 CO -0.05 0.02 0.26 0.78 0.00 0.00 0.00 178.15 179.15 2o16 h ASN 151 N 0.09 0.95 -0.52 1.72 -0.26 -0.99 0.13 115.58 116.70 2o16 h ASN 151 Ca 0.04 -0.15 -0.10 0.00 -0.56 0.00 0.00 56.30 55.53 2o16 h ASN 151 Cb 0.02 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.01 2o16 h ASN 151 CO -0.04 0.86 -0.08 -0.07 -1.06 0.00 0.00 177.43 177.04 2o16 h LEU 152 N 1.00 0.98 -0.57 1.61 3.38 -1.01 -1.32 115.31 119.38 2o16 h LEU 152 Ca 0.23 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2o16 h LEU 152 Cb 0.22 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2o16 h LEU 152 CO -0.02 1.09 0.06 -0.07 0.09 0.00 0.00 178.44 179.58 2o16 h LEU 153 N 0.85 0.93 -0.76 1.67 3.38 -0.53 -0.25 115.31 120.60 2o16 h LEU 153 Ca 0.14 -0.28 0.06 0.00 0.09 0.00 0.00 57.88 57.88 2o16 h LEU 153 Cb 0.63 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 2o16 h LEU 153 CO 0.04 0.98 0.45 -0.33 0.09 0.00 0.00 178.44 179.67 2o16 h GLU 154 N 0.85 0.81 -0.33 1.13 5.08 -0.63 -0.36 114.58 121.13 2o16 h GLU 154 Ca 0.17 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2o16 h GLU 154 Cb 0.47 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2o16 h GLU 154 CO 0.02 0.54 0.17 1.25 -1.00 0.00 0.00 179.01 179.98 2o16 h LEU 155 N 0.84 0.43 -1.24 1.33 5.85 -0.92 -0.98 115.31 120.62 2o16 h LEU 155 Ca 0.33 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 2o16 h LEU 155 Cb 0.15 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2o16 h LEU 155 CO -0.17 0.42 0.34 1.56 -0.34 0.00 0.00 178.44 180.26 2o16 h GLN 156 N 0.41 0.86 -0.32 1.25 4.20 -0.64 -2.63 115.11 118.25 2o16 h GLN 156 Ca 0.12 -0.09 -0.06 0.00 0.06 0.00 0.00 58.65 58.68 2o16 h GLN 156 Cb 0.10 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 2o16 h GLN 156 CO -0.02 0.64 -0.03 0.93 -0.67 0.00 0.00 178.83 179.68 2o16 h GLU 157 N 0.87 0.58 0.00 1.46 5.08 -0.80 -3.51 114.58 118.26 2o16 h GLU 157 Ca 0.22 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2o16 h GLU 157 Cb 0.03 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2o16 h GLU 157 CO -0.04 0.73 0.00 0.39 -1.00 0.00 0.00 179.01 179.10