#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2py2 n PRO 5 N 0.00 0.92 0.00 0.00 -0.04 -1.26 -4.80 135.00 129.82 2py2 n PRO 5 Ca 0.00 0.38 0.00 0.00 -0.04 0.00 0.00 63.50 63.84 2py2 n PRO 5 Cb 0.00 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 30.97 2py2 n PRO 5 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2py2 n THR 6 N -2.17 0.00 1.41 0.52 -1.04 -1.26 -0.43 114.28 111.31 2py2 n THR 6 Ca 0.15 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.21 2py2 n THR 6 Cb 0.48 0.00 0.30 0.00 -1.82 0.00 0.00 70.33 69.30 2py2 n THR 6 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2py2 n ASP 7 N -0.01 0.00 -4.89 8.00 8.00 -1.26 -4.84 116.55 121.54 2py2 n ASP 7 Ca 0.00 -1.09 -0.31 0.00 0.71 0.00 0.00 54.79 54.10 2py2 n ASP 7 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 2py2 n ASP 7 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2py2 s TRP 8 N -2.00 3.46 -0.10 1.24 0.52 0.43 -4.84 118.94 117.65 2py2 s TRP 8 Ca 0.15 0.61 -0.00 0.00 0.02 0.00 0.00 56.10 56.88 2py2 s TRP 8 Cb 0.07 -2.05 -0.02 0.00 -1.15 0.00 0.00 33.47 30.31 2py2 s TRP 8 CO 0.12 0.39 -0.09 0.15 0.02 0.00 0.00 176.95 177.54 2py2 s LYS 9 N -2.74 3.13 0.04 4.98 -0.14 0.39 -4.71 119.74 120.69 2py2 s LYS 9 Ca 0.42 -0.60 -0.25 0.00 -1.36 0.00 0.00 55.97 54.18 2py2 s LYS 9 Cb -0.12 -2.65 -0.05 0.00 -1.68 0.00 0.00 37.83 33.33 2py2 s LYS 9 CO 0.24 0.42 0.77 1.41 -0.76 0.00 0.00 175.35 177.43 2py2 s MET 10 N -0.17 4.49 -0.26 1.68 -2.45 -1.26 0.14 119.30 121.47 2py2 s MET 10 Ca 0.01 1.06 -0.01 0.00 -1.25 0.00 0.00 55.69 55.51 2py2 s MET 10 Cb -0.13 -3.37 0.14 0.00 1.25 0.00 0.00 34.83 32.72 2py2 s MET 10 CO 0.03 0.27 0.38 0.12 1.05 0.00 0.00 175.02 176.87 2py2 s PHE 11 N -0.01 -0.86 -0.97 4.11 5.36 -0.00 -4.99 117.98 120.61 2py2 s PHE 11 Ca 0.39 0.62 -0.13 0.00 -0.96 0.00 0.00 56.93 56.84 2py2 s PHE 11 Cb -0.20 -0.06 0.02 0.00 -0.34 0.00 0.00 43.02 42.43 2py2 s PHE 11 CO 0.23 -0.81 0.64 0.09 -1.46 0.00 0.00 175.22 173.91 2py2 n ASN 12 N 5.36 -4.67 0.00 6.13 3.02 -1.26 -2.37 115.26 121.47 2py2 n ASN 12 Ca -0.02 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.45 2py2 n ASN 12 Cb 0.50 -1.79 0.00 0.00 -0.61 0.00 0.00 39.78 37.87 2py2 n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2py2 n GLY 13 N -1.82 1.41 3.24 7.41 0.00 -1.26 -5.03 105.19 109.15 2py2 n GLY 13 Ca -0.23 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.63 2py2 n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2py2 s ARG 14 N -0.26 1.04 -0.08 1.61 0.52 -1.00 -0.92 118.95 119.87 2py2 s ARG 14 Ca 0.00 -1.33 0.02 0.00 -0.52 0.00 0.00 55.73 53.90 2py2 s ARG 14 Cb 0.00 -0.77 -0.02 0.00 0.52 0.00 0.00 34.95 34.68 2py2 s ARG 14 CO 0.00 0.13 -0.13 0.00 0.02 0.00 0.00 175.30 175.32 2py2 s PHE 16 N -0.42 2.14 -0.07 0.00 0.08 0.12 -1.55 117.98 118.27 2py2 s PHE 16 Ca 0.05 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.65 2py2 s PHE 16 Cb -0.12 -1.14 0.02 0.00 -0.57 0.00 0.00 43.02 41.21 2py2 s PHE 16 CO 0.02 0.33 0.19 -1.17 -0.10 0.00 0.00 175.22 174.49 2py2 s LEU 17 N -2.16 1.20 -0.24 -0.37 0.20 0.01 -0.46 118.68 116.86 2py2 s LEU 17 Ca 0.13 0.38 -0.12 0.00 0.69 0.00 0.00 54.13 55.21 2py2 s LEU 17 Cb -0.09 0.63 -0.05 0.00 -0.43 0.00 0.00 46.19 46.25 2py2 s LEU 17 CO 0.06 -0.08 0.25 0.12 -0.29 0.00 0.00 176.35 176.41 2py2 s PHE 18 N 0.22 3.30 -0.43 5.38 5.36 -1.26 -0.28 117.98 130.28 2py2 s PHE 18 Ca -0.01 0.32 -0.11 0.00 -0.96 0.00 0.00 56.93 56.17 2py2 s PHE 18 Cb -0.02 -2.39 0.07 0.00 -0.34 0.00 0.00 43.02 40.34 2py2 s PHE 18 CO -0.01 -0.03 0.29 1.21 -1.46 0.00 0.00 175.22 175.22 2py2 s ASN 19 N 1.25 5.78 0.35 6.13 2.47 0.25 -4.96 114.94 126.21 2py2 s ASN 19 Ca 0.11 -1.40 0.27 0.00 0.42 0.00 0.00 52.86 52.26 2py2 s ASN 19 Cb -0.14 -2.04 1.12 0.00 -1.45 0.00 0.00 41.25 38.74 2py2 s ASN 19 CO 0.07 -0.55 1.80 1.55 -3.72 0.00 0.00 177.10 176.25 2py2 h PRO 20 N 8.50 0.00 -6.67 0.43 0.13 -1.96 -1.51 132.00 130.92 2py2 h PRO 20 Ca -0.25 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.32 2py2 h PRO 20 Cb 1.09 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.31 2py2 h PRO 20 CO 0.78 0.00 0.73 -0.11 -0.23 0.00 0.00 178.00 179.16 2py2 n LEU 21 N -2.49 3.60 -4.57 1.56 7.94 -1.26 -4.59 117.00 117.19 2py2 n LEU 21 Ca 0.01 1.14 -0.43 0.00 -1.11 0.00 0.00 56.01 55.63 2py2 n LEU 21 Cb 0.24 -1.49 -0.03 0.00 0.53 0.00 0.00 43.42 42.67 2py2 n LEU 21 CO 0.22 -0.23 0.89 -1.10 -1.11 0.00 0.00 177.39 176.06 2py2 s GLN 22 N -0.41 3.57 0.08 1.96 -1.52 -1.26 -4.01 119.66 118.08 2py2 s GLN 22 Ca 0.67 0.27 0.02 0.00 -1.95 0.00 0.00 55.36 54.36 2py2 s GLN 22 Cb -0.59 -3.95 -0.04 0.00 -0.22 0.00 0.00 33.01 28.22 2py2 s GLN 22 CO 0.49 -1.37 -0.07 -0.51 -0.25 0.00 0.00 175.29 173.58 2py2 s LEU 23 N 4.18 2.43 0.86 2.90 1.43 -0.79 -4.71 118.68 124.99 2py2 s LEU 23 Ca 0.41 -0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 2py2 s LEU 23 Cb -0.09 -0.09 0.11 0.00 0.03 0.00 0.00 46.19 46.15 2py2 s LEU 23 CO 0.27 -0.39 1.14 -1.38 0.23 0.00 0.00 176.35 176.22 2py2 s HIS 24 N -2.95 2.69 0.22 0.29 -3.43 -1.26 -1.37 115.29 109.48 2py2 s HIS 24 Ca 0.05 0.88 -0.08 0.00 -0.80 0.00 0.00 55.06 55.11 2py2 s HIS 24 Cb 0.01 -3.36 0.32 0.00 -1.43 0.00 0.00 32.58 28.12 2py2 s HIS 24 CO -0.03 -2.10 1.72 2.35 -2.00 0.00 0.00 174.74 174.68 2py2 h TRP 25 N -1.31 0.34 -0.47 0.38 7.01 -1.20 -1.25 115.95 119.45 2py2 h TRP 25 Ca -0.49 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.54 2py2 h TRP 25 Cb 1.32 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 28.30 2py2 h TRP 25 CO 0.33 0.04 0.26 0.00 -2.79 0.00 0.00 178.44 176.28 2py2 h ALA 26 N 1.47 0.60 -0.23 2.65 0.00 -1.92 -1.15 119.26 120.68 2py2 h ALA 26 Ca 0.33 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2py2 h ALA 26 Cb 0.47 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2py2 h ALA 26 CO -0.37 0.12 -0.24 -0.44 0.00 0.00 0.00 179.25 178.32 2py2 h ASP 27 N 0.62 0.43 -0.58 0.00 3.32 -1.81 -0.81 116.42 117.59 2py2 h ASP 27 Ca 0.17 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 2py2 h ASP 27 Cb 0.04 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2py2 h ASP 27 CO -0.03 0.67 0.05 0.00 -1.72 0.00 0.00 179.24 178.22 2py2 h ALA 28 N 1.36 0.95 -0.40 3.45 0.00 -0.84 0.77 119.26 124.55 2py2 h ALA 28 Ca 0.06 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 2py2 h ALA 28 Cb 0.63 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2py2 h ALA 28 CO 0.05 0.64 -0.19 0.37 0.00 0.00 0.00 179.25 180.11 2py2 h GLN 29 N 0.94 0.84 -0.88 0.00 5.75 -0.94 -2.23 115.11 118.59 2py2 h GLN 29 Ca 0.18 -0.37 -0.01 0.00 -0.15 0.00 0.00 58.65 58.30 2py2 h GLN 29 Cb 0.47 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.96 2py2 h GLN 29 CO 0.02 1.01 0.51 0.93 -2.65 0.00 0.00 178.83 178.65 2py2 h GLU 30 N 0.65 1.21 -0.75 1.69 5.08 -0.82 -1.32 114.58 120.32 2py2 h GLU 30 Ca 0.09 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 2py2 h GLU 30 Cb 0.75 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2py2 h GLU 30 CO 0.06 0.87 0.26 1.03 -1.00 0.00 0.00 179.01 180.23 2py2 h SER 31 N 1.22 1.06 -0.31 1.42 0.87 -0.63 -2.26 113.55 114.93 2py2 h SER 31 Ca 0.32 -0.18 -0.11 0.00 -1.23 0.00 0.00 61.79 60.58 2py2 h SER 31 Cb -0.02 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.65 2py2 h SER 31 CO -0.06 0.96 -0.19 0.00 -0.53 0.00 0.00 176.83 177.02 2py2 h MET 33 N 0.69 0.15 0.00 0.00 2.07 -0.80 0.16 114.93 117.19 2py2 h MET 33 Ca 0.10 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.70 2py2 h MET 33 Cb 0.70 -0.02 0.00 0.00 -1.87 0.00 0.00 31.60 30.41 2py2 h MET 33 CO 0.05 0.31 0.00 0.87 1.07 0.00 0.00 176.91 179.21 2py2 h LYS 34 N 0.14 0.00 -0.13 1.72 1.57 -1.16 -1.16 116.57 117.55 2py2 h LYS 34 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2py2 h LYS 34 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2py2 h LYS 34 CO 0.02 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.29 2py2 n GLU 35 N -2.43 2.10 -1.82 3.15 1.02 -0.53 -4.96 120.64 117.17 2py2 n GLU 35 Ca -0.00 -2.67 -0.12 0.00 -0.02 0.00 0.00 57.16 54.34 2py2 n GLU 35 Cb 0.13 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 29.87 2py2 n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2py2 n GLY 36 N -0.96 0.55 1.64 0.62 0.00 -0.44 -5.01 105.19 101.60 2py2 n GLY 36 Ca 0.18 -0.41 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 2py2 n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2py2 n ALA 37 N -0.27 0.20 -2.18 4.61 0.00 0.43 -4.82 120.51 118.49 2py2 n ALA 37 Ca -0.14 -1.03 -0.08 0.00 0.00 0.00 0.00 53.44 52.19 2py2 n ALA 37 Cb 0.52 0.57 -0.10 0.00 0.00 0.00 0.00 19.45 20.43 2py2 n ALA 37 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2py2 s ASN 38 N -2.26 0.63 0.42 0.00 0.01 -0.61 -3.02 114.94 110.11 2py2 s ASN 38 Ca 0.01 -0.96 -0.26 0.00 -0.71 0.00 0.00 52.86 50.93 2py2 s ASN 38 Cb 0.00 0.17 -0.09 0.00 0.41 0.00 0.00 41.25 41.73 2py2 s ASN 38 CO 0.00 -0.54 1.45 -0.76 -1.51 0.00 0.00 177.10 175.74 2py2 s LEU 39 N -2.83 4.19 0.72 0.60 1.43 -1.26 -0.69 118.68 120.84 2py2 s LEU 39 Ca 0.06 2.98 -0.15 0.00 -1.03 0.00 0.00 54.13 55.99 2py2 s LEU 39 Cb 0.06 -3.83 0.03 0.00 0.03 0.00 0.00 46.19 42.48 2py2 s LEU 39 CO -0.08 -1.06 1.19 0.00 0.23 0.00 0.00 176.35 176.63 2py2 s ALA 40 N -1.17 2.18 0.13 4.21 0.00 0.72 -3.84 121.76 123.98 2py2 s ALA 40 Ca 0.58 0.82 0.08 0.00 0.00 0.00 0.00 51.96 53.44 2py2 s ALA 40 Cb -0.45 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 2py2 s ALA 40 CO 0.59 -1.77 -0.12 -1.54 0.00 0.00 0.00 175.76 172.93 2py2 s SER 41 N -2.12 4.26 -0.08 0.00 1.04 -1.26 -0.42 113.70 115.12 2py2 s SER 41 Ca 0.73 -0.47 0.03 0.00 0.48 0.00 0.00 55.95 56.72 2py2 s SER 41 Cb -0.28 -0.75 0.01 0.00 0.10 0.00 0.00 66.02 65.10 2py2 s SER 41 CO 0.44 0.16 -0.16 -0.63 0.98 0.00 0.00 173.24 174.03 2py2 s ILE 42 N -1.32 1.42 0.00 -1.02 1.01 -1.26 -5.04 121.20 114.99 2py2 s ILE 42 Ca 0.21 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.22 2py2 s ILE 42 Cb -0.10 -1.26 0.00 0.00 0.01 0.00 0.00 42.46 41.10 2py2 s ILE 42 CO 0.13 0.42 0.71 1.41 0.00 0.00 0.00 174.94 177.61 2py2 n HIS 43 N 3.71 0.00 -3.67 3.97 8.25 -1.26 -4.55 115.22 121.67 2py2 n HIS 43 Ca -0.22 -0.24 -0.05 0.00 -0.26 0.00 0.00 57.72 56.96 2py2 n HIS 43 Cb 0.52 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 31.59 2py2 n HIS 43 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2py2 s SER 44 N -0.48 -0.23 0.22 0.41 1.04 -1.26 -4.63 113.70 108.77 2py2 s SER 44 Ca 0.00 -0.27 -0.07 0.00 0.48 0.00 0.00 55.95 56.09 2py2 s SER 44 Cb 0.00 0.44 0.18 0.00 0.10 0.00 0.00 66.02 66.74 2py2 s SER 44 CO 0.00 -0.78 1.77 0.25 0.98 0.00 0.00 173.24 175.46 2py2 h LEU 45 N 2.00 1.07 -0.74 2.42 5.85 -1.98 -0.90 115.31 123.02 2py2 h LEU 45 Ca -0.24 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.31 2py2 h LEU 45 Cb 1.23 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 2py2 h LEU 45 CO 0.27 0.97 0.48 -0.33 -0.34 0.00 0.00 178.44 179.49 2py2 h GLU 46 N 1.11 0.99 -0.37 1.25 3.07 -1.99 0.89 114.58 119.54 2py2 h GLU 46 Ca 0.25 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.90 2py2 h GLU 46 Cb 0.26 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2py2 h GLU 46 CO -0.01 0.67 -0.31 1.49 -1.40 0.00 0.00 179.01 179.44 2py2 h GLU 47 N 1.01 0.80 -0.43 2.33 4.81 -1.85 -1.85 114.58 119.40 2py2 h GLU 47 Ca 0.27 -0.38 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 2py2 h GLU 47 Cb -0.09 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2py2 h GLU 47 CO -0.06 1.00 0.18 1.03 -0.73 0.00 0.00 179.01 180.44 2py2 h SER 48 N 0.68 0.58 -0.92 1.04 0.87 -0.62 -1.12 113.55 114.06 2py2 h SER 48 Ca 0.07 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2py2 h SER 48 Cb 0.86 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.62 2py2 h SER 48 CO 0.08 0.58 0.58 0.74 -0.53 0.00 0.00 176.83 178.28 2py2 h THR 49 N 0.55 1.24 -0.10 2.23 2.02 -0.72 -0.96 112.91 117.17 2py2 h THR 49 Ca 0.14 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 2py2 h THR 49 Cb 0.17 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.50 2py2 h THR 49 CO -0.01 0.25 0.04 0.15 0.37 0.00 0.00 175.52 176.31 2py2 h PHE 50 N 1.25 0.16 -0.96 3.16 3.57 -0.87 -2.73 116.94 120.52 2py2 h PHE 50 Ca 0.33 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.82 2py2 h PHE 50 Cb -0.10 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.55 2py2 h PHE 50 CO -0.00 0.26 0.58 0.28 -2.23 0.00 0.00 178.31 177.20 2py2 h VAL 51 N 0.01 1.26 -0.19 1.41 2.07 -0.94 -1.94 116.25 117.94 2py2 h VAL 51 Ca 0.03 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.01 2py2 h VAL 51 Cb 0.17 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 2py2 h VAL 51 CO -0.00 0.27 0.12 0.11 0.02 0.00 0.00 177.57 178.09 2py2 h LYS 52 N 1.32 0.20 0.00 1.57 1.57 -1.00 0.20 116.57 120.43 2py2 h LYS 52 Ca 0.34 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 2py2 h LYS 52 Cb -0.07 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.20 2py2 h LYS 52 CO -0.07 0.13 0.00 0.93 -0.57 0.00 0.00 179.45 179.88 2py2 h GLU 53 N 0.20 0.00 0.00 3.15 5.08 -1.04 -1.66 114.58 120.31 2py2 h GLU 53 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2py2 h GLU 53 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2py2 h GLU 53 CO -0.01 0.00 -0.58 1.28 -1.00 0.00 0.00 179.01 178.69 2py2 n LEU 54 N -2.44 0.57 -1.79 1.33 4.77 0.06 -4.21 117.00 115.29 2py2 n LEU 54 Ca 0.01 -0.06 -0.02 0.00 -0.03 0.00 0.00 56.01 55.91 2py2 n LEU 54 Cb 0.18 -0.21 0.29 0.00 -2.33 0.00 0.00 43.42 41.35 2py2 n LEU 54 CO 0.18 0.13 0.89 0.35 -1.33 0.00 0.00 177.39 177.62 2py2 n THR 55 N -1.53 2.51 -0.78 -5.08 -2.24 -0.62 -4.76 114.28 101.77 2py2 n THR 55 Ca 0.05 -1.32 0.10 0.00 -2.27 0.00 0.00 64.05 60.62 2py2 n THR 55 Cb 0.34 -0.38 -0.04 0.00 -2.10 0.00 0.00 70.33 68.15 2py2 n THR 55 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2py2 n SER 56 N 0.12 -4.68 0.28 3.42 3.41 -1.26 -1.73 113.62 113.19 2py2 n SER 56 Ca 0.32 0.52 0.13 0.00 -0.26 0.00 0.00 58.87 59.58 2py2 n SER 56 Cb 1.19 -2.50 0.83 0.00 -0.26 0.00 0.00 64.21 63.47 2py2 n SER 56 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2py2 h ALA 57 N -0.74 1.57 -0.00 7.33 0.00 -1.92 -0.55 119.26 124.95 2py2 h ALA 57 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2py2 h ALA 57 Cb 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2py2 h ALA 57 CO 0.02 0.03 -0.03 -0.25 0.00 0.00 0.00 179.25 179.03 2py2 n ASP 58 N -3.95 0.16 -3.65 0.00 10.43 -1.26 -4.95 116.55 113.33 2py2 n ASP 58 Ca -0.03 -0.52 -0.21 0.00 2.57 0.00 0.00 54.79 56.60 2py2 n ASP 58 Cb 0.11 -0.15 0.00 0.00 1.84 0.00 0.00 41.12 42.93 2py2 n ASP 58 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2py2 n LEU 59 N -1.08 -2.86 -4.71 0.64 4.77 -0.21 -4.83 117.00 108.71 2py2 n LEU 59 Ca 0.17 -0.81 -0.42 0.00 -0.03 0.00 0.00 56.01 54.92 2py2 n LEU 59 Cb 0.22 -2.02 -0.03 0.00 -2.33 0.00 0.00 43.42 39.26 2py2 n LEU 59 CO 0.22 0.10 1.26 -0.63 -1.33 0.00 0.00 177.39 177.01 2py2 s ILE 60 N -3.05 2.64 0.23 -0.08 1.01 -0.70 -4.88 121.20 116.37 2py2 s ILE 60 Ca 0.06 0.41 -0.32 0.00 0.00 0.00 0.00 60.65 60.80 2py2 s ILE 60 Cb -0.03 -3.26 -0.13 0.00 0.01 0.00 0.00 42.46 39.05 2py2 s ILE 60 CO 0.87 0.03 1.49 -2.65 0.00 0.00 0.00 174.94 174.68 2py2 n PRO 61 N 4.26 2.21 -3.91 2.79 -0.02 -1.25 -4.77 135.00 134.31 2py2 n PRO 61 Ca 0.14 0.79 -0.10 0.00 -2.02 0.00 0.00 63.50 62.31 2py2 n PRO 61 Cb 0.39 -2.50 -0.10 0.00 -0.02 0.00 0.00 33.50 31.26 2py2 n PRO 61 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2py2 s SER 62 N 0.49 0.10 0.41 2.55 0.01 -0.78 -3.79 113.70 112.69 2py2 s SER 62 Ca 0.70 -0.29 -0.24 0.00 1.31 0.00 0.00 55.95 57.43 2py2 s SER 62 Cb -0.62 0.17 -0.09 0.00 0.21 0.00 0.00 66.02 65.69 2py2 s SER 62 CO 0.46 -0.33 1.07 0.26 0.41 0.00 0.00 173.24 175.11 2py2 s TRP 63 N -1.33 3.19 0.31 2.43 0.23 0.17 -0.23 118.94 123.70 2py2 s TRP 63 Ca -0.14 1.62 0.05 0.00 -2.03 0.00 0.00 56.10 55.60 2py2 s TRP 63 Cb -0.08 -3.16 -0.06 0.00 0.03 0.00 0.00 33.47 30.19 2py2 s TRP 63 CO 0.01 -0.77 0.01 0.42 0.96 0.00 0.00 176.95 177.57 2py2 s ILE 64 N -1.66 1.42 -0.13 2.03 -1.09 -0.78 -2.14 121.20 118.85 2py2 s ILE 64 Ca 0.59 -2.05 0.00 0.00 -2.23 0.00 0.00 60.65 56.97 2py2 s ILE 64 Cb -0.23 -2.65 0.13 0.00 -1.58 0.00 0.00 42.46 38.14 2py2 s ILE 64 CO 0.28 -0.14 1.56 0.61 -1.23 0.00 0.00 174.94 176.03 2py2 n GLY 65 N -0.65 2.90 3.51 6.18 0.00 0.43 -4.50 105.19 113.06 2py2 n GLY 65 Ca -0.04 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 2py2 n GLY 65 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2py2 s GLY 66 N 0.74 1.67 0.15 -0.02 0.00 -1.26 -1.02 107.32 107.57 2py2 s GLY 66 Ca 0.14 -1.19 -0.22 0.00 0.00 0.00 0.00 44.72 43.45 2py2 s GLY 66 CO 0.01 -1.11 0.57 -0.51 0.00 0.00 0.00 173.10 172.07 2py2 s THR 67 N -1.03 0.01 -0.29 0.90 -4.23 -0.72 -0.89 115.64 109.39 2py2 s THR 67 Ca 0.17 -0.09 0.16 0.00 -1.18 0.00 0.00 61.69 60.74 2py2 s THR 67 Cb -0.11 -1.02 0.48 0.00 1.34 0.00 0.00 72.50 73.19 2py2 s THR 67 CO 0.08 -0.05 1.12 -0.90 -0.54 0.00 0.00 174.62 174.33 2py2 n ASP 68 N -0.30 2.92 0.25 3.99 5.75 -0.69 -1.29 116.55 127.17 2py2 n ASP 68 Ca -0.17 -2.80 0.15 0.00 -0.01 0.00 0.00 54.79 51.95 2py2 n ASP 68 Cb 0.64 -0.44 0.46 0.00 -1.03 0.00 0.00 41.12 40.75 2py2 n ASP 68 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2py2 h GLN 70 N 0.00 0.00 -4.10 0.00 7.50 -1.89 -3.46 115.11 113.16 2py2 h GLN 70 Ca 0.00 0.00 -0.50 0.00 0.50 0.00 0.00 58.65 58.65 2py2 h GLN 70 Cb 0.73 0.00 -0.37 0.00 0.05 0.00 0.00 27.48 27.88 2py2 h GLN 70 CO 0.00 0.17 -0.79 0.08 -1.50 0.00 0.00 178.83 176.79 2py2 s VAL 71 N -1.75 0.86 0.19 -0.54 1.01 -1.25 -5.11 120.40 113.81 2py2 s VAL 71 Ca -0.05 -0.19 -0.32 0.00 0.00 0.00 0.00 61.98 61.42 2py2 s VAL 71 Cb -0.00 -0.91 -0.15 0.00 0.00 0.00 0.00 36.38 35.31 2py2 s VAL 71 CO 0.14 0.34 1.14 -0.24 0.00 0.00 0.00 175.10 176.48 2py2 n SER 72 N 4.96 1.33 0.00 3.32 2.88 -1.25 -1.49 113.62 123.37 2py2 n SER 72 Ca -0.11 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.57 2py2 n SER 72 Cb 0.50 -1.23 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 2py2 n SER 72 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2py2 n THR 73 N 1.31 0.00 -3.48 2.46 -2.24 -1.26 -4.98 114.28 106.08 2py2 n THR 73 Ca 0.14 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.50 2py2 n THR 73 Cb 0.26 -0.02 -0.08 0.00 -2.10 0.00 0.00 70.33 68.38 2py2 n THR 73 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2py2 s ARG 74 N -0.05 2.72 0.04 -0.78 1.81 -0.56 -5.06 118.95 117.08 2py2 s ARG 74 Ca 0.00 -1.59 -0.19 0.00 -1.72 0.00 0.00 55.73 52.23 2py2 s ARG 74 Cb 0.00 -4.01 -0.06 0.00 -0.45 0.00 0.00 34.95 30.43 2py2 s ARG 74 CO 0.00 -1.13 0.54 -1.58 -0.68 0.00 0.00 175.30 172.46 2py2 s TRP 75 N 1.48 3.77 0.03 -0.53 0.52 -1.26 -4.27 118.94 118.69 2py2 s TRP 75 Ca 0.04 1.21 0.02 0.00 0.02 0.00 0.00 56.10 57.38 2py2 s TRP 75 Cb -0.26 -2.48 -0.02 0.00 -1.15 0.00 0.00 33.47 29.56 2py2 s TRP 75 CO 0.02 0.55 -0.06 -0.06 0.02 0.00 0.00 176.95 177.42 2py2 s PHE 76 N -0.92 0.55 0.02 -1.98 0.08 -0.41 -4.79 117.98 110.53 2py2 s PHE 76 Ca 0.28 -0.45 -0.01 0.00 0.12 0.00 0.00 56.93 56.87 2py2 s PHE 76 Cb -0.19 -0.34 -0.04 0.00 -0.57 0.00 0.00 43.02 41.88 2py2 s PHE 76 CO 0.18 -0.09 0.18 -1.58 -0.10 0.00 0.00 175.22 173.80 2py2 s TRP 77 N -1.23 3.49 0.04 0.36 0.23 -1.26 -1.75 118.94 118.83 2py2 s TRP 77 Ca -0.10 0.29 0.30 0.00 -2.03 0.00 0.00 56.10 54.57 2py2 s TRP 77 Cb -0.09 -1.78 1.15 0.00 0.03 0.00 0.00 33.47 32.77 2py2 s TRP 77 CO 0.00 0.61 1.90 0.52 0.96 0.00 0.00 176.95 180.95 2py2 h MET 78 N 3.57 0.00 -0.64 4.98 2.86 -1.36 -3.01 114.93 121.33 2py2 h MET 78 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2py2 h MET 78 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2py2 h MET 78 CO 0.70 0.05 0.00 -0.40 1.06 0.00 0.00 176.91 178.32 2py2 n ASP 79 N -3.15 3.28 -0.15 1.22 5.75 -1.26 -4.92 116.55 117.31 2py2 n ASP 79 Ca 0.01 -2.35 -0.02 0.00 -0.01 0.00 0.00 54.79 52.42 2py2 n ASP 79 Cb 0.36 -0.49 -0.01 0.00 -1.03 0.00 0.00 41.12 39.95 2py2 n ASP 79 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2py2 n SER 80 N 0.53 -5.43 -4.89 -1.12 3.41 -1.14 -5.00 113.62 99.98 2py2 n SER 80 Ca 0.16 0.05 -0.29 0.00 -0.26 0.00 0.00 58.87 58.53 2py2 n SER 80 Cb 0.65 -3.11 0.04 0.00 -0.26 0.00 0.00 64.21 61.53 2py2 n SER 80 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2py2 s THR 81 N -1.34 3.65 0.44 6.66 -4.23 -1.26 -5.01 115.64 114.54 2py2 s THR 81 Ca 0.00 0.35 -0.19 0.00 -1.18 0.00 0.00 61.69 60.67 2py2 s THR 81 Cb 0.00 -3.50 -0.10 0.00 1.34 0.00 0.00 72.50 70.24 2py2 s THR 81 CO 0.00 -0.62 0.94 -0.94 -0.54 0.00 0.00 174.62 173.46 2py2 s SER 82 N -4.32 6.84 -0.98 3.99 1.04 -1.26 -4.35 113.70 114.65 2py2 s SER 82 Ca 0.56 1.62 -0.20 0.00 0.48 0.00 0.00 55.95 58.41 2py2 s SER 82 Cb -0.11 -2.51 0.10 0.00 0.10 0.00 0.00 66.02 63.60 2py2 s SER 82 CO 0.50 -0.41 1.28 -0.04 0.98 0.00 0.00 173.24 175.55 2py2 s MET 83 N -3.40 3.62 0.00 4.02 -1.94 -1.26 -4.71 119.30 115.63 2py2 s MET 83 Ca 0.60 -1.53 0.03 0.00 -1.71 0.00 0.00 55.69 53.08 2py2 s MET 83 Cb -0.09 -5.12 0.05 0.00 2.01 0.00 0.00 34.83 31.68 2py2 s MET 83 CO 0.18 -1.96 0.84 -0.40 -0.01 0.00 0.00 175.02 173.67 2py2 n ASP 84 N 7.52 1.77 -3.73 3.03 5.68 -1.26 -5.02 116.55 124.53 2py2 n ASP 84 Ca 0.29 -1.59 -0.14 0.00 -0.50 0.00 0.00 54.79 52.85 2py2 n ASP 84 Cb 0.50 -0.03 -0.09 0.00 -1.14 0.00 0.00 41.12 40.36 2py2 n ASP 84 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2py2 s TYR 85 N -0.64 -0.28 0.01 2.11 5.04 -1.26 -4.99 117.35 117.34 2py2 s TYR 85 Ca 0.05 0.51 -0.18 0.00 -2.44 0.00 0.00 57.07 55.00 2py2 s TYR 85 Cb 0.03 0.14 0.03 0.00 0.35 0.00 0.00 41.96 42.51 2py2 s TYR 85 CO 0.04 -0.37 0.40 0.00 -1.34 0.00 0.00 175.55 174.27 2py2 s ALA 86 N -1.00 -0.99 -0.38 3.97 0.00 -1.26 -4.90 121.76 117.19 2py2 s ALA 86 Ca -0.11 0.42 0.13 0.00 0.00 0.00 0.00 51.96 52.40 2py2 s ALA 86 Cb -0.04 0.20 0.42 0.00 0.00 0.00 0.00 23.12 23.70 2py2 s ALA 86 CO 0.04 -0.37 0.94 -3.47 0.00 0.00 0.00 175.76 172.90 2py2 n ASP 87 N 0.85 2.30 -4.77 0.00 2.03 -1.26 -5.10 116.55 110.60 2py2 n ASP 87 Ca -0.20 -3.08 -0.40 0.00 0.52 0.00 0.00 54.79 51.63 2py2 n ASP 87 Cb 0.58 -0.54 -0.00 0.00 -0.72 0.00 0.00 41.12 40.44 2py2 n ASP 87 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 2py2 s TRP 88 N -3.10 2.71 0.86 -0.67 0.52 -1.26 -0.29 118.94 117.70 2py2 s TRP 88 Ca 0.36 1.31 -0.11 0.00 0.02 0.00 0.00 56.10 57.67 2py2 s TRP 88 Cb 0.41 -3.83 0.11 0.00 -1.15 0.00 0.00 33.47 29.00 2py2 s TRP 88 CO -0.05 -2.51 1.09 0.00 0.02 0.00 0.00 176.95 175.50 2py2 n ALA 90 N -3.74 1.00 -1.08 0.00 0.00 -1.26 -0.81 120.51 114.62 2py2 n ALA 90 Ca 0.07 0.41 -0.03 0.00 0.00 0.00 0.00 53.44 53.90 2py2 n ALA 90 Cb 0.55 -2.25 -0.01 0.00 0.00 0.00 0.00 19.45 17.74 2py2 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2py2 n ALA 91 N 1.68 -0.04 -2.80 0.00 0.00 -1.26 -5.00 120.51 113.09 2py2 n ALA 91 Ca 0.11 0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.30 2py2 n ALA 91 Cb 0.32 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 2py2 n ALA 91 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2py2 s GLN 92 N -1.51 2.94 0.55 0.00 2.00 0.01 -4.55 119.66 119.09 2py2 s GLN 92 Ca 0.00 -0.73 -0.03 0.00 -2.00 0.00 0.00 55.36 52.60 2py2 s GLN 92 Cb 0.00 -2.73 0.01 0.00 0.80 0.00 0.00 33.01 31.09 2py2 s GLN 92 CO 0.00 0.54 0.82 -1.25 -0.50 0.00 0.00 175.29 174.90 2py2 s PRO 93 N -2.64 2.87 0.23 1.67 0.04 -1.26 -4.68 135.00 131.23 2py2 s PRO 93 Ca 0.30 -0.27 0.16 0.00 0.04 0.00 0.00 61.00 61.24 2py2 s PRO 93 Cb -0.12 -2.38 0.02 0.00 0.04 0.00 0.00 34.50 32.06 2py2 s PRO 93 CO 0.23 -0.60 1.28 -0.44 0.04 0.00 0.00 177.00 177.50 2py2 h ASP 94 N 0.01 0.00 0.00 6.66 3.32 -1.89 -3.48 116.42 121.04 2py2 h ASP 94 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2py2 h ASP 94 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2py2 h ASP 94 CO 0.59 0.47 0.00 0.35 -1.72 0.00 0.00 179.24 178.93 2py2 n THR 95 N -3.11 0.00 -2.34 0.35 -2.24 -1.26 -4.97 114.28 100.71 2py2 n THR 95 Ca -0.01 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.39 2py2 n THR 95 Cb 0.74 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.62 2py2 n THR 95 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2py2 s THR 96 N -1.70 3.26 0.51 4.28 -4.23 -1.26 -4.30 115.64 112.20 2py2 s THR 96 Ca 0.00 1.06 0.24 0.00 -1.18 0.00 0.00 61.69 61.81 2py2 s THR 96 Cb 0.00 -3.60 0.29 0.00 1.34 0.00 0.00 72.50 70.54 2py2 s THR 96 CO 0.00 0.10 2.15 -0.07 -0.54 0.00 0.00 174.62 176.26 2py2 h LEU 97 N 2.71 0.00 -2.05 4.79 3.38 -1.93 -2.58 115.31 119.64 2py2 h LEU 97 Ca -0.48 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 2py2 h LEU 97 Cb 1.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 2py2 h LEU 97 CO 0.63 0.06 -0.07 0.71 0.09 0.00 0.00 178.44 179.86 2py2 h THR 98 N 0.00 0.30 -2.33 0.22 1.35 -1.98 -3.28 112.91 107.19 2py2 h THR 98 Ca -0.00 -0.41 -0.59 0.00 -0.55 0.00 0.00 66.41 64.86 2py2 h THR 98 Cb 0.14 1.31 -0.39 0.00 -1.73 0.00 0.00 68.15 67.48 2py2 h THR 98 CO 0.01 0.06 -0.94 -1.84 -0.25 0.00 0.00 175.52 172.56 2py2 n GLU 99 N -3.38 0.70 -0.13 4.72 0.28 -0.97 -4.04 120.64 117.81 2py2 n GLU 99 Ca -0.01 -3.45 0.08 0.00 -0.16 0.00 0.00 57.16 53.62 2py2 n GLU 99 Cb 0.22 -1.65 0.15 0.00 1.43 0.00 0.00 31.44 31.58 2py2 n GLU 99 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2py2 s ILE 102 N -1.00 4.98 -0.08 0.00 1.01 -0.07 0.02 121.20 126.06 2py2 s ILE 102 Ca 0.15 1.49 0.03 0.00 0.00 0.00 0.00 60.65 62.32 2py2 s ILE 102 Cb -0.12 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.26 2py2 s ILE 102 CO 0.04 0.15 -0.17 -1.58 0.00 0.00 0.00 174.94 173.38 2py2 s GLN 103 N 1.43 2.83 0.46 2.79 0.74 -0.86 -1.87 119.66 125.18 2py2 s GLN 103 Ca 0.37 -0.75 0.07 0.00 0.05 0.00 0.00 55.36 55.10 2py2 s GLN 103 Cb -0.17 -2.40 -0.00 0.00 1.10 0.00 0.00 33.01 31.53 2py2 s GLN 103 CO 0.15 0.41 0.40 0.00 -0.55 0.00 0.00 175.29 175.70 2py2 s MET 104 N -0.18 2.42 -1.64 1.67 0.23 0.68 -1.49 119.30 120.98 2py2 s MET 104 Ca -0.01 -1.70 0.00 0.00 -1.03 0.00 0.00 55.69 52.95 2py2 s MET 104 Cb -0.13 -2.29 0.00 0.00 -1.53 0.00 0.00 34.83 30.88 2py2 s MET 104 CO 0.03 -0.34 0.00 0.09 -2.03 0.00 0.00 175.02 172.77 2py2 n ASN 105 N -1.62 -5.47 -4.75 -1.18 5.03 -1.06 -1.86 115.26 104.35 2py2 n ASN 105 Ca 0.03 -0.00 -0.39 0.00 0.87 0.00 0.00 54.58 55.08 2py2 n ASN 105 Cb 0.63 -4.52 -0.05 0.00 -1.02 0.00 0.00 39.78 34.81 2py2 n ASN 105 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2py2 s VAL 106 N -2.94 4.86 0.05 2.41 1.01 -0.27 -3.95 120.40 121.57 2py2 s VAL 106 Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.37 2py2 s VAL 106 Cb 0.00 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2py2 s VAL 106 CO 0.00 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2py2 n GLY 107 N 2.48 -1.75 0.17 4.51 0.00 -1.26 -2.26 105.19 107.09 2py2 n GLY 107 Ca -0.05 -1.27 0.02 0.00 0.00 0.00 0.00 46.02 44.71 2py2 n GLY 107 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2py2 h ILE 108 N -0.21 1.28 0.00 -0.61 3.07 -2.00 -2.54 117.51 116.49 2py2 h ILE 108 Ca 0.00 -1.53 0.00 0.00 1.55 0.00 0.00 64.86 64.89 2py2 h ILE 108 Cb 0.21 1.83 0.00 0.00 -0.27 0.00 0.00 36.82 38.59 2py2 h ILE 108 CO 0.00 0.43 0.00 0.61 -1.05 0.00 0.00 178.15 178.14 2py2 n GLY 109 N -0.22 -1.27 3.89 0.16 0.00 -1.26 -4.93 105.19 101.57 2py2 n GLY 109 Ca -0.02 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2py2 n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2py2 n LYS 110 N -1.46 -2.25 -2.02 1.61 4.76 -0.96 -4.96 118.16 112.88 2py2 n LYS 110 Ca 0.07 0.38 -0.01 0.00 -2.87 0.00 0.00 58.31 55.87 2py2 n LYS 110 Cb 0.26 -4.17 -0.00 0.00 -1.84 0.00 0.00 35.03 29.28 2py2 n LYS 110 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2py2 s TRP 112 N -0.92 3.54 -0.12 0.00 0.52 0.60 -1.12 118.94 121.45 2py2 s TRP 112 Ca 0.00 0.87 -0.06 0.00 0.02 0.00 0.00 56.10 56.93 2py2 s TRP 112 Cb -0.00 -2.23 0.05 0.00 -1.15 0.00 0.00 33.47 30.14 2py2 s TRP 112 CO 0.00 0.43 0.28 1.21 0.02 0.00 0.00 176.95 178.89 2py2 s ASN 113 N -1.95 -0.31 0.08 2.95 3.84 -0.56 -0.81 114.94 118.18 2py2 s ASN 113 Ca 0.39 0.60 -0.30 0.00 0.21 0.00 0.00 52.86 53.75 2py2 s ASN 113 Cb -0.13 0.49 -0.05 0.00 -0.55 0.00 0.00 41.25 41.00 2py2 s ASN 113 CO 0.20 -0.16 1.06 1.51 -2.79 0.00 0.00 177.10 176.91 2py2 s ASP 114 N 1.19 7.30 0.12 -4.21 -4.77 -1.26 -2.02 116.67 113.01 2py2 s ASP 114 Ca -0.09 1.89 0.01 0.00 -3.30 0.00 0.00 52.55 51.06 2py2 s ASP 114 Cb -0.09 -2.58 -0.04 0.00 -1.09 0.00 0.00 42.92 39.11 2py2 s ASP 114 CO -0.09 -0.26 -0.03 0.42 0.70 0.00 0.00 175.17 175.91 2py2 s THR 115 N 0.49 0.60 -0.09 2.11 -4.23 0.10 -4.80 115.64 109.83 2py2 s THR 115 Ca 0.52 -1.94 -0.35 0.00 -1.18 0.00 0.00 61.69 58.74 2py2 s THR 115 Cb -0.26 -1.84 -0.13 0.00 1.34 0.00 0.00 72.50 71.61 2py2 s THR 115 CO 0.30 -0.72 1.79 -2.65 -0.54 0.00 0.00 174.62 172.80 2py2 n PRO 116 N -0.10 1.92 0.30 3.99 -0.02 -1.26 -2.27 135.00 137.57 2py2 n PRO 116 Ca -0.10 0.70 0.19 0.00 -2.02 0.00 0.00 63.50 62.27 2py2 n PRO 116 Cb 0.62 -2.50 1.01 0.00 -0.02 0.00 0.00 33.50 32.62 2py2 n PRO 116 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2py2 n THR 118 N -2.85 0.00 -2.22 0.00 -2.24 -1.26 -0.93 114.28 104.78 2py2 n THR 118 Ca -0.02 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.37 2py2 n THR 118 Cb 0.11 -0.26 -0.01 0.00 -2.10 0.00 0.00 70.33 68.07 2py2 n THR 118 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2py2 s HIS 119 N -2.92 2.90 -0.09 4.78 3.76 -0.70 -4.66 115.29 118.35 2py2 s HIS 119 Ca 0.16 1.52 -0.20 0.00 -0.15 0.00 0.00 55.06 56.39 2py2 s HIS 119 Cb 0.19 -3.44 -0.04 0.00 1.11 0.00 0.00 32.58 30.39 2py2 s HIS 119 CO 0.57 -1.59 0.55 -0.51 -0.85 0.00 0.00 174.74 172.90 2py2 s LEU 120 N -2.81 4.30 0.17 0.89 2.01 -1.26 -4.09 118.68 117.89 2py2 s LEU 120 Ca 0.61 0.95 -0.14 0.00 0.01 0.00 0.00 54.13 55.55 2py2 s LEU 120 Cb -0.31 -2.82 0.02 0.00 0.01 0.00 0.00 46.19 43.09 2py2 s LEU 120 CO 0.38 -0.02 0.42 -1.00 1.01 0.00 0.00 176.35 177.14 2py2 s HIS 121 N 0.60 0.03 1.23 0.29 3.76 -0.47 -4.74 115.29 115.97 2py2 s HIS 121 Ca 0.30 -0.38 -0.20 0.00 -0.15 0.00 0.00 55.06 54.63 2py2 s HIS 121 Cb -0.16 0.23 0.30 0.00 1.11 0.00 0.00 32.58 34.05 2py2 s HIS 121 CO 0.13 -0.81 1.12 -1.12 -0.85 0.00 0.00 174.74 173.21 2py2 s SER 122 N -2.89 0.73 0.24 1.40 0.01 -1.25 -1.88 113.70 110.06 2py2 s SER 122 Ca 0.10 0.54 -0.17 0.00 1.31 0.00 0.00 55.95 57.73 2py2 s SER 122 Cb 0.01 -0.71 0.01 0.00 0.21 0.00 0.00 66.02 65.55 2py2 s SER 122 CO -0.04 -4.23 0.57 -0.94 0.41 0.00 0.00 173.24 169.01 2py2 s SER 123 N -3.99 -0.20 -0.16 2.44 1.04 -0.57 -0.66 113.70 111.60 2py2 s SER 123 Ca 0.72 -0.68 0.02 0.00 0.48 0.00 0.00 55.95 56.49 2py2 s SER 123 Cb -0.08 0.63 0.01 0.00 0.10 0.00 0.00 66.02 66.68 2py2 s SER 123 CO 0.56 -1.17 -0.21 -0.63 0.98 0.00 0.00 173.24 172.77 2py2 s ILE 124 N -3.94 2.09 0.08 -1.02 -1.09 -0.91 -0.58 121.20 115.84 2py2 s ILE 124 Ca 0.14 -0.95 0.03 0.00 -2.23 0.00 0.00 60.65 57.65 2py2 s ILE 124 Cb -0.02 -1.86 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 2py2 s ILE 124 CO 0.04 0.54 0.06 0.00 -1.23 0.00 0.00 174.94 174.36 2py2 s ALA 126 N -1.38 -0.75 0.03 0.00 0.00 0.13 -0.81 121.76 118.98 2py2 s ALA 126 Ca 0.29 0.29 -0.24 0.00 0.00 0.00 0.00 51.96 52.30 2py2 s ALA 126 Cb -0.12 0.08 0.06 0.00 0.00 0.00 0.00 23.12 23.13 2py2 s ALA 126 CO 0.21 -0.26 0.55 -1.59 0.00 0.00 0.00 175.76 174.68 2py2 s LYS 127 N -1.33 1.05 0.61 0.00 -2.85 -0.60 -1.58 119.74 115.04 2py2 s LYS 127 Ca -0.14 -0.15 -0.19 0.00 -1.00 0.00 0.00 55.97 54.50 2py2 s LYS 127 Cb -0.05 0.48 -0.03 0.00 -2.06 0.00 0.00 37.83 36.17 2py2 s LYS 127 CO 0.04 -0.37 1.25 -1.25 0.10 0.00 0.00 175.35 175.12 2py2 s PRO 128 N -2.25 2.81 0.27 1.78 0.04 -1.26 0.03 135.00 136.41 2py2 s PRO 128 Ca -0.06 1.95 -0.29 0.00 0.04 0.00 0.00 61.00 62.63 2py2 s PRO 128 Cb -0.01 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 2py2 s PRO 128 CO 0.00 -1.36 1.02 -1.17 0.04 0.00 0.00 177.00 175.53 2py2 s LEU 129 N -4.16 4.57 0.00 -3.56 2.96 -0.09 -4.67 118.68 113.73 2py2 s LEU 129 Ca 0.79 2.11 0.17 0.00 -0.22 0.00 0.00 54.13 56.98 2py2 s LEU 129 Cb -0.34 -3.65 0.14 0.00 0.50 0.00 0.00 46.19 42.83 2py2 s LEU 129 CO 0.36 -0.02 1.04 0.29 -1.32 0.00 0.00 176.35 176.71