#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hky n LYS 1 N 0.00 1.27 0.00 2.12 0.00 -1.26 -5.11 118.16 115.18 2hky n LYS 1 Ca 0.00 -3.91 0.00 0.00 -0.00 0.00 0.00 58.31 54.40 2hky n LYS 1 Cb 0.00 -1.92 0.00 0.00 -0.00 0.00 0.00 35.03 33.11 2hky n LYS 1 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 2hky n PRO 2 N 1.94 0.78 -3.59 -1.58 -0.02 -1.26 -5.06 135.00 126.21 2hky n PRO 2 Ca 0.25 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.72 2hky n PRO 2 Cb 0.43 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.85 2hky n PRO 2 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2hky s LYS 3 N -0.90 0.30 -0.15 -0.52 -2.85 -1.26 -4.90 119.74 109.47 2hky s LYS 3 Ca 0.00 0.57 0.00 0.00 -1.00 0.00 0.00 55.97 55.54 2hky s LYS 3 Cb 0.00 0.13 0.00 0.00 -2.06 0.00 0.00 37.83 35.90 2hky s LYS 3 CO 0.00 -0.07 0.00 0.41 0.10 0.00 0.00 175.35 175.79 2hky n GLY 4 N 3.88 0.45 2.43 0.59 0.00 -1.26 -4.87 105.19 106.41 2hky n GLY 4 Ca -0.16 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 2hky n GLY 4 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2hky n MET 5 N -1.89 1.05 -0.84 1.61 2.81 -1.26 -4.88 117.12 113.73 2hky n MET 5 Ca -0.01 -3.24 -0.34 0.00 -1.81 0.00 0.00 57.70 52.29 2hky n MET 5 Cb 0.18 -1.44 0.10 0.00 -0.71 0.00 0.00 33.22 31.36 2hky n MET 5 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2hky n THR 6 N 0.11 0.00 0.11 2.03 -1.04 -1.26 -4.17 114.28 110.05 2hky n THR 6 Ca 0.17 -0.27 -0.16 0.00 -2.04 0.00 0.00 64.05 61.75 2hky n THR 6 Cb 0.74 -0.41 -0.10 0.00 -1.82 0.00 0.00 70.33 68.74 2hky n THR 6 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2hky h SER 7 N -1.49 -1.61 -0.57 8.00 4.64 -1.96 0.24 113.55 120.80 2hky h SER 7 Ca -0.45 0.17 -0.08 0.00 -0.47 0.00 0.00 61.79 60.96 2hky h SER 7 Cb 1.32 0.59 -0.02 0.00 -0.31 0.00 0.00 62.40 63.98 2hky h SER 7 CO 0.31 -0.56 0.07 -1.28 -0.87 0.00 0.00 176.83 174.50 2hky h SER 8 N -0.75 0.96 -0.28 4.97 0.87 -1.84 -2.41 113.55 115.07 2hky h SER 8 Ca -0.00 -0.23 0.06 0.00 -1.23 0.00 0.00 61.79 60.39 2hky h SER 8 Cb 0.76 -0.25 -0.07 0.00 -0.44 0.00 0.00 62.40 62.40 2hky h SER 8 CO -0.30 0.97 -0.15 -0.61 -0.53 0.00 0.00 176.83 176.22 2hky h GLN 9 N 0.93 -0.11 -0.32 2.24 5.75 -1.60 0.35 115.11 122.35 2hky h GLN 9 Ca 0.18 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.66 2hky h GLN 9 Cb 0.45 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.01 2hky h GLN 9 CO 0.02 -0.07 0.09 2.35 -2.65 0.00 0.00 178.83 178.56 2hky h TRP 10 N -0.11 0.46 -0.00 3.99 -0.00 -0.34 -1.14 115.95 118.81 2hky h TRP 10 Ca 0.15 -0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.02 2hky h TRP 10 Cb 0.34 -0.14 0.00 0.00 -0.00 0.00 0.00 29.16 29.35 2hky h TRP 10 CO -0.34 0.40 -0.02 1.19 -0.00 0.00 0.00 178.44 179.68 2hky n PHE 11 N -4.37 0.00 0.01 2.65 3.01 0.14 -2.04 117.46 116.86 2hky n PHE 11 Ca 0.02 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.41 2hky n PHE 11 Cb 0.17 -0.47 -0.12 0.00 -0.01 0.00 0.00 39.48 39.04 2hky n PHE 11 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2hky h LYS 12 N 0.00 0.00 0.00 -1.08 5.09 0.86 0.44 116.57 121.88 2hky h LYS 12 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2hky h LYS 12 Cb 0.48 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.81 2hky h LYS 12 CO 0.00 0.55 -0.12 -0.84 -2.09 0.00 0.00 179.45 176.95 2hky h ILE 13 N 0.00 0.00 0.00 0.07 3.07 -1.38 0.25 117.51 119.53 2hky h ILE 13 Ca -0.21 -0.95 0.00 0.00 1.55 0.00 0.00 64.86 65.25 2hky h ILE 13 Cb 1.89 1.89 0.00 0.00 -0.27 0.00 0.00 36.82 40.33 2hky h ILE 13 CO 0.08 0.00 -1.17 0.00 -1.05 0.00 0.00 178.15 176.02 2hky n GLN 14 N -2.98 0.78 -0.71 0.16 10.64 -0.86 -4.67 117.38 119.73 2hky n GLN 14 Ca 0.04 -0.05 -0.00 0.00 -1.83 0.00 0.00 57.00 55.15 2hky n GLN 14 Cb 0.52 -1.40 -0.01 0.00 -0.86 0.00 0.00 30.24 28.50 2hky n GLN 14 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 2hky n HIS 15 N -1.65 0.00 -3.51 2.61 8.25 0.15 -4.64 115.22 116.44 2hky n HIS 15 Ca 0.01 -0.14 -0.37 0.00 -0.26 0.00 0.00 57.72 56.96 2hky n HIS 15 Cb 0.35 0.13 -0.08 0.00 1.12 0.00 0.00 29.99 31.51 2hky n HIS 15 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2hky s MET 16 N 0.00 4.18 0.00 -0.41 0.23 0.88 -1.13 119.30 123.05 2hky s MET 16 Ca 0.05 0.04 0.14 0.00 -1.03 0.00 0.00 55.69 54.89 2hky s MET 16 Cb 0.05 -3.50 -0.14 0.00 -1.53 0.00 0.00 34.83 29.71 2hky s MET 16 CO -0.02 0.08 0.60 0.94 -2.03 0.00 0.00 175.02 174.58 2hky n GLN 17 N 4.13 2.40 -0.51 3.16 7.27 0.31 -4.18 117.38 129.96 2hky n GLN 17 Ca -0.11 -0.04 0.44 0.00 0.07 0.00 0.00 57.00 57.36 2hky n GLN 17 Cb 0.52 -1.16 0.74 0.00 2.41 0.00 0.00 30.24 32.74 2hky n GLN 17 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 2hky h PRO 18 N 0.09 0.00 0.00 3.69 0.11 -1.88 -3.37 132.00 130.63 2hky h PRO 18 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2hky h PRO 18 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2hky h PRO 18 CO 0.00 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.66 2hky n SER 19 N -3.84 0.00 -3.32 -2.05 3.41 -1.26 -5.07 113.62 101.49 2hky n SER 19 Ca 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 2hky n SER 19 Cb 1.73 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.68 2hky n SER 19 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2hky n PRO 20 N 0.00 1.07 -2.74 4.33 -0.04 -1.26 -4.96 135.00 131.40 2hky n PRO 20 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2hky n PRO 20 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 2hky n PRO 20 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2hky n GLN 21 N 0.00 3.83 -1.22 0.54 6.02 -1.26 -5.00 117.38 120.29 2hky n GLN 21 Ca 0.00 -4.69 0.00 0.00 -0.01 0.00 0.00 57.00 52.30 2hky n GLN 21 Cb 0.00 -2.30 0.00 0.00 1.02 0.00 0.00 30.24 28.96 2hky n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hky n ALA 22 N -0.25 -2.39 -0.29 -1.58 0.00 -1.26 -3.01 120.51 111.74 2hky n ALA 22 Ca 0.38 0.30 0.32 0.00 0.00 0.00 0.00 53.44 54.44 2hky n ALA 22 Cb 0.38 -1.11 0.71 0.00 0.00 0.00 0.00 19.45 19.43 2hky n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hky h ASN 24 N 0.05 -0.82 0.58 0.00 2.35 -1.79 0.39 115.58 116.34 2hky h ASN 24 Ca 0.53 0.13 -0.28 0.00 -0.55 0.00 0.00 56.30 56.13 2hky h ASN 24 Cb 2.03 0.36 -0.01 0.00 0.05 0.00 0.00 38.32 40.75 2hky h ASN 24 CO -0.04 -0.32 -1.39 0.77 -1.65 0.00 0.00 177.43 174.80 2hky h SER 25 N -0.35 0.31 -0.90 5.81 4.64 -0.08 -2.49 113.55 120.49 2hky h SER 25 Ca 0.10 -0.40 0.10 0.00 -0.47 0.00 0.00 61.79 61.12 2hky h SER 25 Cb 0.49 -0.10 -0.07 0.00 -0.31 0.00 0.00 62.40 62.41 2hky h SER 25 CO -0.31 1.32 0.58 0.00 -0.87 0.00 0.00 176.83 177.55 2hky h ALA 26 N 0.63 1.62 0.00 5.18 0.00 0.11 0.35 119.26 127.16 2hky h ALA 26 Ca -0.18 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.57 2hky h ALA 26 Cb 1.97 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.53 2hky h ALA 26 CO 0.16 0.19 -0.71 1.98 0.00 0.00 0.00 179.25 180.87 2hky h MET 27 N 0.90 0.00 -0.22 0.00 -1.53 -0.27 -3.08 114.93 110.73 2hky h MET 27 Ca 0.42 0.00 0.06 0.00 -3.44 0.00 0.00 59.70 56.74 2hky h MET 27 Cb 0.41 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.45 2hky h MET 27 CO -0.18 0.71 0.17 0.87 0.14 0.00 0.00 176.91 178.62 2hky h LYS 28 N 0.00 0.00 0.00 0.39 1.79 0.17 0.48 116.57 119.40 2hky h LYS 28 Ca -0.01 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.32 2hky h LYS 28 Cb 1.48 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.11 2hky h LYS 28 CO 0.09 0.00 -0.67 -0.97 -1.08 0.00 0.00 179.45 176.82 2hky h ASN 29 N 0.00 0.00 0.66 0.86 -0.73 -1.36 -2.64 115.58 112.37 2hky h ASN 29 Ca 0.10 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.05 2hky h ASN 29 Cb 0.45 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.03 2hky h ASN 29 CO -0.00 0.67 -1.01 0.40 -0.37 0.00 0.00 177.43 177.12 2hky h ILE 30 N 0.00 1.53 0.00 2.57 2.04 -0.28 -2.85 117.51 120.52 2hky h ILE 30 Ca -0.01 -2.89 0.00 0.00 1.00 0.00 0.00 64.86 62.96 2hky h ILE 30 Cb 1.37 2.68 0.00 0.00 -0.74 0.00 0.00 36.82 40.13 2hky h ILE 30 CO 0.09 0.84 0.00 -0.55 0.00 0.00 0.00 178.15 178.53 2hky h ASN 31 N 0.09 0.00 0.57 1.72 -1.07 -0.63 -0.81 115.58 115.45 2hky h ASN 31 Ca -0.07 0.00 -0.28 0.00 0.07 0.00 0.00 56.30 56.02 2hky h ASN 31 Cb 1.70 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.94 2hky h ASN 31 CO 0.16 0.00 -1.39 0.07 0.07 0.00 0.00 177.43 176.33 2hky h LYS 32 N 0.00 0.21 0.00 4.14 5.09 -1.39 -0.37 116.57 124.26 2hky h LYS 32 Ca 0.00 -0.36 0.00 0.00 0.09 0.00 0.00 60.65 60.38 2hky h LYS 32 Cb 0.78 0.13 0.00 0.00 0.10 0.00 0.00 32.23 33.24 2hky h LYS 32 CO 0.00 1.09 -0.82 1.12 -2.09 0.00 0.00 179.45 178.75 2hky h HIS 33 N 0.06 0.00 -0.00 0.07 2.07 -1.44 -3.32 115.15 112.59 2hky h HIS 33 Ca -0.18 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.34 2hky h HIS 33 Cb 1.97 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.95 2hky h HIS 33 CO 0.05 0.00 -0.74 0.25 -3.07 0.00 0.00 177.93 174.42 2hky n THR 34 N -2.65 0.00 -2.33 6.12 -2.24 -0.32 -4.96 114.28 107.91 2hky n THR 34 Ca 0.01 -0.13 -0.20 0.00 -2.27 0.00 0.00 64.05 61.46 2hky n THR 34 Cb 0.53 1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 69.79 2hky n THR 34 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2hky n LYS 35 N -1.16 -1.73 -3.59 -0.78 4.76 -0.16 -4.91 118.16 110.58 2hky n LYS 35 Ca 0.04 0.98 -0.07 0.00 -2.87 0.00 0.00 58.31 56.39 2hky n LYS 35 Cb 0.30 -5.61 -0.04 0.00 -1.84 0.00 0.00 35.03 27.84 2hky n LYS 35 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2hky s ARG 36 N -4.92 0.41 -0.65 1.97 6.06 -1.11 -5.03 118.95 115.67 2hky s ARG 36 Ca 0.00 0.01 -0.20 0.00 -2.50 0.00 0.00 55.73 53.04 2hky s ARG 36 Cb 0.00 0.19 0.09 0.00 0.06 0.00 0.00 34.95 35.29 2hky s ARG 36 CO 0.00 -0.15 0.85 0.00 -2.50 0.00 0.00 175.30 173.51 2hky n LYS 38 N 6.88 0.02 0.00 0.00 4.76 -1.26 -4.60 118.16 123.96 2hky n LYS 38 Ca -0.04 0.64 0.00 0.00 -2.87 0.00 0.00 58.31 56.05 2hky n LYS 38 Cb 0.44 -1.73 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 2hky n LYS 38 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2hky n ASP 39 N -1.90 0.00 -3.74 4.39 2.03 -1.26 -4.91 116.55 111.16 2hky n ASP 39 Ca 0.01 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 2hky n ASP 39 Cb 0.70 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.99 2hky n ASP 39 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2hky s LEU 40 N 0.00 0.56 -0.17 -2.67 1.98 -1.26 -0.43 118.68 116.69 2hky s LEU 40 Ca 0.00 0.69 -0.07 0.00 -2.89 0.00 0.00 54.13 51.86 2hky s LEU 40 Cb 0.00 1.14 0.07 0.00 0.66 0.00 0.00 46.19 48.06 2hky s LEU 40 CO 0.00 -0.13 0.37 0.20 -1.89 0.00 0.00 176.35 174.90 2hky s ASN 41 N 0.49 -0.22 0.13 3.68 -0.87 -0.94 -4.97 114.94 112.24 2hky s ASN 41 Ca -0.03 0.85 0.03 0.00 -1.57 0.00 0.00 52.86 52.15 2hky s ASN 41 Cb -0.04 0.97 -0.04 0.00 -0.02 0.00 0.00 41.25 42.12 2hky s ASN 41 CO -0.03 -0.22 0.17 0.42 -2.57 0.00 0.00 177.10 174.88 2hky s THR 42 N 2.09 4.81 0.09 1.60 -4.23 -1.26 -1.21 115.64 117.53 2hky s THR 42 Ca -0.04 -0.84 0.03 0.00 -1.18 0.00 0.00 61.69 59.65 2hky s THR 42 Cb -0.11 -3.42 -0.04 0.00 1.34 0.00 0.00 72.50 70.27 2hky s THR 42 CO -0.12 -0.03 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.49 2hky s PHE 43 N -1.65 0.91 0.15 3.99 0.40 0.89 -4.35 117.98 118.33 2hky s PHE 43 Ca 0.32 -0.73 0.11 0.00 -0.60 0.00 0.00 56.93 56.03 2hky s PHE 43 Cb -0.11 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.86 2hky s PHE 43 CO 0.25 -0.08 -0.24 -0.51 0.70 0.00 0.00 175.22 175.34 2hky s LEU 44 N -2.51 2.43 -0.86 -0.37 1.43 -0.28 0.07 118.68 118.59 2hky s LEU 44 Ca 0.05 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.40 2hky s LEU 44 Cb -0.01 -1.26 0.29 0.00 0.03 0.00 0.00 46.19 45.24 2hky s LEU 44 CO -0.02 0.16 1.17 1.57 0.23 0.00 0.00 176.35 179.46 2hky n HIS 45 N 0.64 2.99 -3.71 0.29 -0.00 -0.76 0.11 115.22 114.79 2hky n HIS 45 Ca -0.16 -3.32 -0.11 0.00 0.46 0.00 0.00 57.72 54.58 2hky n HIS 45 Cb 0.54 -0.91 -0.12 0.00 -0.12 0.00 0.00 29.99 29.38 2hky n HIS 45 CO 0.00 0.00 0.00 -2.00 0.46 0.00 0.00 176.34 174.80 2hky s GLU 46 N -2.85 0.29 0.03 1.57 2.56 -1.26 -4.64 118.70 114.40 2hky s GLU 46 Ca 0.37 0.67 -0.36 0.00 0.00 0.00 0.00 54.97 55.64 2hky s GLU 46 Cb 0.12 -0.06 -0.15 0.00 2.00 0.00 0.00 34.13 36.03 2hky s GLU 46 CO 0.02 -0.17 1.51 -2.30 -0.56 0.00 0.00 175.26 173.77 2hky n PRO 47 N 4.33 1.48 0.31 4.30 -0.02 -1.26 -4.41 135.00 139.74 2hky n PRO 47 Ca -0.23 0.54 0.02 0.00 -2.02 0.00 0.00 63.50 61.80 2hky n PRO 47 Cb 0.54 -2.24 0.10 0.00 -0.02 0.00 0.00 33.50 31.88 2hky n PRO 47 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2hky h PHE 48 N 5.74 0.00 -0.01 6.00 0.04 -1.99 2.29 116.94 129.02 2hky h PHE 48 Ca -0.47 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.05 2hky h PHE 48 Cb 1.31 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.47 2hky h PHE 48 CO 0.66 0.00 -0.99 0.77 -0.60 0.00 0.00 178.31 178.15 2hky h SER 49 N 0.00 0.76 0.18 2.17 0.02 -1.97 0.44 113.55 115.14 2hky h SER 49 Ca 0.00 -0.60 -0.31 0.00 -0.84 0.00 0.00 61.79 60.04 2hky h SER 49 Cb 1.78 -0.23 0.02 0.00 0.14 0.00 0.00 62.40 64.10 2hky h SER 49 CO 0.00 1.40 -1.48 0.28 -1.14 0.00 0.00 176.83 175.89 2hky h SER 50 N 0.33 0.60 0.16 3.07 0.02 0.34 -2.90 113.55 115.18 2hky h SER 50 Ca -0.11 -0.92 -0.06 0.00 -0.84 0.00 0.00 61.79 59.87 2hky h SER 50 Cb 1.64 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.97 2hky h SER 50 CO 0.19 1.68 -0.21 0.58 -1.14 0.00 0.00 176.83 177.92 2hky h VAL 51 N -0.05 1.19 0.26 2.27 2.07 -1.06 0.35 116.25 121.27 2hky h VAL 51 Ca -0.29 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.35 2hky h VAL 51 Cb 1.97 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 2hky h VAL 51 CO 0.17 0.26 -0.20 0.00 0.02 0.00 0.00 177.57 177.82 2hky h ALA 52 N 1.68 -0.45 0.00 1.67 0.00 -0.11 -0.49 119.26 121.56 2hky h ALA 52 Ca 0.02 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2hky h ALA 52 Cb 0.44 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2hky h ALA 52 CO 0.03 -0.77 -0.50 0.00 0.00 0.00 0.00 179.25 178.00 2hky h ALA 53 N 0.23 1.12 -0.40 0.00 0.00 -1.21 -2.56 119.26 116.44 2hky h ALA 53 Ca -0.02 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.46 2hky h ALA 53 Cb 0.42 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2hky h ALA 53 CO -0.01 0.63 0.26 1.15 0.00 0.00 0.00 179.25 181.28 2hky h THR 54 N 0.00 1.06 0.00 0.00 2.02 0.52 0.16 112.91 116.67 2hky h THR 54 Ca -0.01 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2hky h THR 54 Cb 0.92 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2hky h THR 54 CO 0.07 0.08 0.00 0.00 0.37 0.00 0.00 175.52 176.04 2hky n GLN 56 N 0.21 3.37 -0.37 0.00 7.27 0.57 -4.69 117.38 123.74 2hky n GLN 56 Ca 0.00 -0.26 -0.30 0.00 0.07 0.00 0.00 57.00 56.50 2hky n GLN 56 Cb 0.23 -0.94 0.29 0.00 2.41 0.00 0.00 30.24 32.22 2hky n GLN 56 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2hky s THR 57 N -1.47 1.26 -0.20 1.69 -4.23 -1.10 -4.79 115.64 106.81 2hky s THR 57 Ca 0.05 0.00 -0.38 0.00 -1.18 0.00 0.00 61.69 60.18 2hky s THR 57 Cb 0.06 -2.06 -0.14 0.00 1.34 0.00 0.00 72.50 71.70 2hky s THR 57 CO 0.26 0.00 1.77 -2.65 -0.54 0.00 0.00 174.62 173.47 2hky n PRO 58 N -5.61 1.51 -1.04 3.99 -0.02 -1.26 -4.74 135.00 127.82 2hky n PRO 58 Ca 0.12 0.55 -0.30 0.00 -2.02 0.00 0.00 63.50 61.86 2hky n PRO 58 Cb 0.60 -2.29 0.23 0.00 -0.02 0.00 0.00 33.50 32.01 2hky n PRO 58 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2hky s LYS 59 N 3.57 -0.87 -0.18 -0.52 1.02 -1.25 -4.60 119.74 116.91 2hky s LYS 59 Ca 0.96 0.14 -0.15 0.00 0.02 0.00 0.00 55.97 56.94 2hky s LYS 59 Cb -0.93 -1.62 0.05 0.00 -0.52 0.00 0.00 37.83 34.81 2hky s LYS 59 CO 0.60 -3.52 0.48 0.96 -0.92 0.00 0.00 175.35 172.95 2hky s ILE 60 N -2.93 -0.00 -0.30 2.17 -4.36 -1.21 -4.95 121.20 109.61 2hky s ILE 60 Ca 0.69 0.01 -0.08 0.00 -0.26 0.00 0.00 60.65 61.02 2hky s ILE 60 Cb -0.13 -0.67 -0.07 0.00 1.25 0.00 0.00 42.46 42.83 2hky s ILE 60 CO 0.57 0.01 1.30 0.00 0.24 0.00 0.00 174.94 177.06 2hky n ALA 61 N 3.10 0.40 -0.01 2.27 0.00 -1.26 -2.74 120.51 122.26 2hky n ALA 61 Ca -0.15 -1.35 -0.01 0.00 0.00 0.00 0.00 53.44 51.93 2hky n ALA 61 Cb 0.57 -1.32 -0.00 0.00 0.00 0.00 0.00 19.45 18.69 2hky n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hky h LYS 63 N -0.01 0.00 0.00 0.00 1.79 -1.95 -3.46 116.57 112.95 2hky h LYS 63 Ca 0.01 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2hky h LYS 63 Cb 0.02 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 2hky h LYS 63 CO -0.04 0.00 -0.19 -1.71 -1.08 0.00 0.00 179.45 176.44 2hky n ASN 64 N -2.57 -0.03 0.00 0.86 2.85 -1.25 -4.90 115.26 110.22 2hky n ASN 64 Ca -0.00 -1.37 0.00 0.00 -0.11 0.00 0.00 54.58 53.10 2hky n ASN 64 Cb 0.01 -0.05 0.00 0.00 1.24 0.00 0.00 39.78 40.99 2hky n ASN 64 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2hky n GLY 65 N 0.01 -0.36 0.23 8.20 0.00 -1.26 -4.99 105.19 107.02 2hky n GLY 65 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 2hky n GLY 65 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2hky h ASP 66 N 0.00 0.36 -6.01 1.61 5.19 -1.84 -3.45 116.42 112.28 2hky h ASP 66 Ca 0.00 0.04 -0.41 0.00 -0.62 0.00 0.00 57.03 56.05 2hky h ASP 66 Cb 0.00 -0.02 0.07 0.00 0.18 0.00 0.00 39.33 39.56 2hky h ASP 66 CO 0.00 0.24 -0.80 0.29 -3.12 0.00 0.00 179.24 175.85 2hky n LYS 67 N -4.90 -5.48 -0.66 3.56 5.02 -1.11 -4.78 118.16 109.82 2hky n LYS 67 Ca 0.07 0.67 0.06 0.00 -2.02 0.00 0.00 58.31 57.09 2hky n LYS 67 Cb 0.19 -5.39 0.14 0.00 -0.02 0.00 0.00 35.03 29.95 2hky n LYS 67 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2hky n ASN 68 N -3.05 1.57 -4.29 4.39 3.02 -1.25 -4.51 115.26 111.14 2hky n ASN 68 Ca -0.25 -3.22 -0.21 0.00 -0.03 0.00 0.00 54.58 50.88 2hky n ASN 68 Cb 0.65 -0.44 -0.11 0.00 -0.61 0.00 0.00 39.78 39.27 2hky n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hky s HIS 70 N -1.87 -0.60 0.20 0.00 0.09 -1.02 -3.32 115.29 108.77 2hky s HIS 70 Ca 0.11 1.33 -0.06 0.00 -0.00 0.00 0.00 55.06 56.44 2hky s HIS 70 Cb -0.06 0.26 -0.06 0.00 -0.00 0.00 0.00 32.58 32.71 2hky s HIS 70 CO 0.05 -0.31 0.47 1.14 -0.00 0.00 0.00 174.74 176.08 2hky s GLN 71 N 0.91 3.67 0.40 1.40 0.00 -1.25 -2.15 119.66 122.64 2hky s GLN 71 Ca -0.05 0.03 -0.27 0.00 -0.00 0.00 0.00 55.36 55.06 2hky s GLN 71 Cb -0.06 -2.74 -0.10 0.00 0.00 0.00 0.00 33.01 30.11 2hky s GLN 71 CO -0.07 0.36 1.48 0.45 0.00 0.00 0.00 175.29 177.51 2hky s SER 72 N -2.61 6.22 0.00 12.60 0.15 -0.05 -4.77 113.70 125.24 2hky s SER 72 Ca 0.43 3.03 0.00 0.00 0.70 0.00 0.00 55.95 60.12 2hky s SER 72 Cb -0.11 -2.67 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 2hky s SER 72 CO 0.25 -0.96 0.40 1.41 1.20 0.00 0.00 173.24 175.55 2hky n HIS 73 N 0.29 0.00 -2.59 3.44 -0.00 -1.26 -4.74 115.22 110.36 2hky n HIS 73 Ca 0.02 -0.20 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 2hky n HIS 73 Cb 0.40 -0.16 0.00 0.00 -0.00 0.00 0.00 29.99 30.22 2hky n HIS 73 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2hky n GLY 74 N 0.81 -1.83 3.67 -1.41 0.00 -1.26 -5.11 105.19 100.06 2hky n GLY 74 Ca 0.00 -1.22 -0.43 0.00 0.00 0.00 0.00 46.02 44.37 2hky n GLY 74 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hky s PRO 75 N -1.85 4.29 -0.09 1.61 0.04 -1.26 -3.19 135.00 134.55 2hky s PRO 75 Ca 0.00 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 62.59 2hky s PRO 75 Cb 0.00 -3.66 -0.03 0.00 0.04 0.00 0.00 34.50 30.84 2hky s PRO 75 CO 0.00 -0.58 0.03 0.54 0.04 0.00 0.00 177.00 177.03 2hky s VAL 76 N 2.95 4.55 -1.02 -0.36 0.11 -0.69 -4.66 120.40 121.28 2hky s VAL 76 Ca 0.52 -0.17 -0.26 0.00 -2.93 0.00 0.00 61.98 59.15 2hky s VAL 76 Cb -0.21 -2.94 -0.17 0.00 -1.53 0.00 0.00 36.38 31.54 2hky s VAL 76 CO 0.15 0.60 2.14 -0.94 -3.33 0.00 0.00 175.10 173.72 2hky s SER 77 N -0.95 3.91 0.73 3.54 1.04 -1.26 -2.31 113.70 118.40 2hky s SER 77 Ca 0.14 -0.83 0.01 0.00 0.48 0.00 0.00 55.95 55.75 2hky s SER 77 Cb -0.11 -2.58 0.14 0.00 0.10 0.00 0.00 66.02 63.56 2hky s SER 77 CO 0.03 -4.16 0.99 0.00 0.98 0.00 0.00 173.24 171.08 2hky n LEU 78 N 18.23 0.00 -3.54 2.42 -0.00 0.11 -1.83 117.00 132.38 2hky n LEU 78 Ca 0.43 -2.22 -0.22 0.00 -0.00 0.00 0.00 56.01 54.00 2hky n LEU 78 Cb 0.46 -0.63 -0.15 0.00 -0.00 0.00 0.00 43.42 43.11 2hky n LEU 78 CO 0.60 -0.96 -0.27 -0.89 -0.00 0.00 0.00 177.39 175.87 2hky s THR 79 N -3.09 -0.21 -0.50 1.47 2.01 0.11 -0.56 115.64 114.88 2hky s THR 79 Ca 0.67 -0.21 -0.23 0.00 0.31 0.00 0.00 61.69 62.23 2hky s THR 79 Cb -0.04 -0.67 0.04 0.00 0.01 0.00 0.00 72.50 71.83 2hky s THR 79 CO 0.44 -0.29 0.82 -0.04 -0.69 0.00 0.00 174.62 174.85 2hky s MET 80 N 2.23 3.33 0.11 4.92 -1.94 0.97 -0.07 119.30 128.84 2hky s MET 80 Ca 0.05 -0.28 -0.08 0.00 -1.71 0.00 0.00 55.69 53.66 2hky s MET 80 Cb -0.16 -4.00 -0.06 0.00 2.01 0.00 0.00 34.83 32.62 2hky s MET 80 CO -0.14 -1.27 0.41 0.00 -0.01 0.00 0.00 175.02 174.01 2hky s LYS 82 N -2.20 0.87 -0.42 0.00 -2.85 -1.03 -2.22 119.74 111.89 2hky s LYS 82 Ca 0.37 -1.14 -0.29 0.00 -1.00 0.00 0.00 55.97 53.91 2hky s LYS 82 Cb -0.13 -0.63 0.00 0.00 -2.06 0.00 0.00 37.83 35.01 2hky s LYS 82 CO 0.20 0.11 1.50 -1.17 0.10 0.00 0.00 175.35 176.09 2hky s LEU 83 N -2.35 3.54 0.03 2.77 2.96 0.43 -2.25 118.68 123.81 2hky s LEU 83 Ca 0.05 0.85 -0.24 0.00 -0.22 0.00 0.00 54.13 54.56 2hky s LEU 83 Cb -0.04 -3.46 -0.18 0.00 0.50 0.00 0.00 46.19 43.02 2hky s LEU 83 CO 0.01 -1.55 1.50 0.71 -1.32 0.00 0.00 176.35 175.70 2hky h THR 84 N 6.54 1.20 0.00 3.68 1.35 -0.97 -3.48 112.91 121.24 2hky h THR 84 Ca -0.29 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 2hky h THR 84 Cb 1.12 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2hky h THR 84 CO 1.09 0.16 0.00 -1.20 -0.25 0.00 0.00 175.52 175.32 2hky n SER 85 N -4.96 0.00 0.00 5.36 7.64 -1.11 -5.00 113.62 115.55 2hky n SER 85 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2hky n SER 85 Cb 0.15 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 2hky n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hky n GLY 86 N -1.03 -0.18 0.00 0.23 0.00 -1.26 -2.52 105.19 100.42 2hky n GLY 86 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2hky n GLY 86 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2hky n LYS 87 N 0.00 0.00 -0.13 1.61 2.85 -1.25 -4.82 118.16 116.43 2hky n LYS 87 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 2hky n LYS 87 Cb 0.00 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.29 2hky n LYS 87 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 177.40 178.33 2hky n TYR 88 N 0.00 0.00 1.81 5.58 9.36 -1.26 -3.57 117.16 129.08 2hky n TYR 88 Ca 0.00 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.35 2hky n TYR 88 Cb 0.00 -0.92 0.69 0.00 -0.63 0.00 0.00 39.34 38.48 2hky n TYR 88 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2hky n PRO 89 N -4.08 1.21 -2.12 2.98 -0.04 -1.26 -3.94 135.00 127.75 2hky n PRO 89 Ca -0.50 -0.31 -0.01 0.00 -0.04 0.00 0.00 63.50 62.64 2hky n PRO 89 Cb 0.87 -1.42 0.04 0.00 -0.04 0.00 0.00 33.50 32.94 2hky n PRO 89 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2hky n ASN 90 N -0.57 -0.02 -4.70 3.54 5.15 -1.26 -5.10 115.26 112.31 2hky n ASN 90 Ca 0.19 -2.07 -0.41 0.00 -0.60 0.00 0.00 54.58 51.70 2hky n ASN 90 Cb 0.17 0.08 -0.04 0.00 -0.53 0.00 0.00 39.78 39.45 2hky n ASN 90 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2hky s ARG 92 N 1.35 3.41 0.32 0.00 1.70 -1.05 -4.92 118.95 119.76 2hky s ARG 92 Ca 0.39 -0.42 0.08 0.00 -0.47 0.00 0.00 55.73 55.31 2hky s ARG 92 Cb -0.18 -2.93 -0.04 0.00 -0.57 0.00 0.00 34.95 31.23 2hky s ARG 92 CO 0.17 0.48 0.11 0.71 -1.08 0.00 0.00 175.30 175.69 2hky s TYR 93 N -0.26 2.72 -0.05 5.89 1.51 -1.26 -0.29 117.35 125.61 2hky s TYR 93 Ca 0.06 -0.34 0.06 0.00 -1.01 0.00 0.00 57.07 55.84 2hky s TYR 93 Cb -0.12 -1.53 -0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2hky s TYR 93 CO 0.02 0.41 -0.24 0.15 -1.11 0.00 0.00 175.55 174.79 2hky s LYS 94 N -3.81 2.34 -0.18 -0.62 -0.14 -0.96 -3.87 119.74 112.51 2hky s LYS 94 Ca 0.36 -0.85 -0.18 0.00 -1.36 0.00 0.00 55.97 53.94 2hky s LYS 94 Cb -0.04 -2.02 -0.04 0.00 -1.68 0.00 0.00 37.83 34.06 2hky s LYS 94 CO 0.22 0.38 0.49 -1.83 -0.76 0.00 0.00 175.35 173.85 2hky s GLU 95 N -0.18 4.23 -0.33 1.68 -1.05 -1.26 -2.46 118.70 119.33 2hky s GLU 95 Ca -0.02 0.39 -0.03 0.00 -0.15 0.00 0.00 54.97 55.16 2hky s GLU 95 Cb -0.13 -3.52 0.06 0.00 -0.44 0.00 0.00 34.13 30.10 2hky s GLU 95 CO 0.03 -0.04 0.07 0.21 0.95 0.00 0.00 175.26 176.47 2hky s LYS 96 N 1.29 2.39 -0.40 -4.83 2.36 -0.89 -4.96 119.74 114.71 2hky s LYS 96 Ca 0.24 -1.36 -0.29 0.00 -2.55 0.00 0.00 55.97 52.01 2hky s LYS 96 Cb -0.15 -3.34 0.01 0.00 -1.05 0.00 0.00 37.83 33.30 2hky s LYS 96 CO 0.10 -0.73 1.44 0.50 1.55 0.00 0.00 175.35 178.21 2hky s ARG 97 N 1.27 3.58 0.38 4.03 3.52 -1.26 -0.02 118.95 130.45 2hky s ARG 97 Ca -0.02 1.00 0.06 0.00 -0.13 0.00 0.00 55.73 56.65 2hky s ARG 97 Cb -0.20 -4.03 -0.07 0.00 -1.56 0.00 0.00 34.95 29.08 2hky s ARG 97 CO -0.01 -1.56 0.01 -0.65 -0.81 0.00 0.00 175.30 172.29 2hky s GLN 98 N 4.94 1.86 -0.23 5.12 -1.52 0.28 -4.95 119.66 125.16 2hky s GLN 98 Ca 0.62 -2.04 -0.01 0.00 -1.95 0.00 0.00 55.36 51.99 2hky s GLN 98 Cb -0.15 -1.45 0.07 0.00 -0.22 0.00 0.00 33.01 31.26 2hky s GLN 98 CO 0.32 -0.06 -0.00 0.54 -0.25 0.00 0.00 175.29 175.84 2hky s ASN 99 N -3.64 3.53 0.06 5.90 4.22 -1.26 0.06 114.94 123.81 2hky s ASN 99 Ca 0.35 -1.11 -0.20 0.00 -2.14 0.00 0.00 52.86 49.76 2hky s ASN 99 Cb 0.09 -0.93 0.05 0.00 1.28 0.00 0.00 41.25 41.74 2hky s ASN 99 CO 0.17 -0.29 0.48 -0.54 -2.04 0.00 0.00 177.10 174.88 2hky s LYS 100 N 1.59 1.02 -0.35 3.55 1.02 -0.98 -4.71 119.74 120.89 2hky s LYS 100 Ca -0.02 -0.35 -0.27 0.00 0.02 0.00 0.00 55.97 55.35 2hky s LYS 100 Cb -0.18 0.46 0.01 0.00 -0.52 0.00 0.00 37.83 37.61 2hky s LYS 100 CO -0.09 -0.37 0.97 -1.12 -0.92 0.00 0.00 175.35 173.82 2hky s SER 101 N -2.15 6.77 0.17 2.83 0.01 -1.19 -1.71 113.70 118.43 2hky s SER 101 Ca -0.04 0.76 0.03 0.00 1.31 0.00 0.00 55.95 58.01 2hky s SER 101 Cb -0.00 -2.49 0.03 0.00 0.21 0.00 0.00 66.02 63.76 2hky s SER 101 CO -0.04 -0.85 0.22 0.00 0.41 0.00 0.00 173.24 172.98 2hky n TYR 102 N 6.78 -2.65 -3.77 2.43 0.18 -1.26 0.04 117.16 118.91 2hky n TYR 102 Ca 0.09 -0.62 -0.27 0.00 1.88 0.00 0.00 57.90 58.97 2hky n TYR 102 Cb 0.48 -0.16 -0.17 0.00 -0.38 0.00 0.00 39.34 39.11 2hky n TYR 102 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2hky s VAL 103 N -0.12 0.63 0.02 -3.48 1.01 0.92 -0.88 120.40 118.51 2hky s VAL 103 Ca 0.17 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.67 2hky s VAL 103 Cb -0.01 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2hky s VAL 103 CO 0.11 -0.11 -0.06 0.54 0.00 0.00 0.00 175.10 175.59 2hky s VAL 104 N 1.82 3.71 0.49 2.92 0.11 -0.91 0.34 120.40 128.88 2hky s VAL 104 Ca -0.00 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.22 2hky s VAL 104 Cb -0.16 -2.64 0.01 0.00 -1.53 0.00 0.00 36.38 32.05 2hky s VAL 104 CO -0.07 0.34 0.72 0.00 -3.33 0.00 0.00 175.10 172.75 2hky s ALA 105 N -1.06 3.79 0.16 1.54 0.00 0.11 -2.43 121.76 123.87 2hky s ALA 105 Ca 0.19 -1.14 0.06 0.00 0.00 0.00 0.00 51.96 51.07 2hky s ALA 105 Cb -0.11 -2.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.83 2hky s ALA 105 CO 0.09 -0.54 -0.13 0.00 0.00 0.00 0.00 175.76 175.18 2hky s LYS 107 N -3.23 0.89 0.26 0.00 -0.14 -0.54 -4.84 119.74 112.14 2hky s LYS 107 Ca 0.15 -0.96 -0.30 0.00 -1.36 0.00 0.00 55.97 53.51 2hky s LYS 107 Cb -0.02 0.36 -0.10 0.00 -1.68 0.00 0.00 37.83 36.39 2hky s LYS 107 CO 0.04 -0.30 1.39 -2.14 -0.76 0.00 0.00 175.35 173.58 2hky s PRO 108 N -3.87 4.30 -0.68 -1.68 0.02 -1.26 -0.24 135.00 131.60 2hky s PRO 108 Ca 0.06 2.25 -0.31 0.00 0.02 0.00 0.00 61.00 63.02 2hky s PRO 108 Cb 0.04 -3.11 -0.15 0.00 0.02 0.00 0.00 34.50 31.30 2hky s PRO 108 CO -0.10 -0.35 2.48 -2.30 -0.33 0.00 0.00 177.00 176.40 2hky n PRO 109 N 2.05 0.56 0.00 5.54 -0.02 -1.26 -4.85 135.00 137.02 2hky n PRO 109 Ca 0.05 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2hky n PRO 109 Cb 0.41 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2hky n PRO 109 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2hky n GLN 110 N 8.56 0.00 0.00 -0.52 1.13 -1.26 -4.67 117.38 120.62 2hky n GLN 110 Ca 0.51 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 2hky n GLN 110 Cb 0.24 -0.15 0.00 0.00 0.11 0.00 0.00 30.24 30.44 2hky n GLN 110 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 2hky n LYS 111 N 0.00 1.35 -0.07 -1.09 2.85 -1.26 -4.72 118.16 115.21 2hky n LYS 111 Ca 0.00 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2hky n LYS 111 Cb 0.00 -0.75 0.27 0.00 -0.65 0.00 0.00 35.03 33.91 2hky n LYS 111 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2hky h LYS 112 N 0.00 0.70 -0.29 -1.58 3.11 -1.94 -3.47 116.57 113.09 2hky h LYS 112 Ca 0.00 -0.11 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 2hky h LYS 112 Cb 0.50 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.61 2hky h LYS 112 CO 0.00 0.60 0.00 -3.47 -2.81 0.00 0.00 179.45 173.77 2hky n ASP 113 N -4.33 -0.35 0.28 4.20 2.03 -1.26 -4.68 116.55 112.44 2hky n ASP 113 Ca 0.03 0.05 0.13 0.00 0.52 0.00 0.00 54.79 55.52 2hky n ASP 113 Cb 0.18 -0.07 0.82 0.00 -0.72 0.00 0.00 41.12 41.33 2hky n ASP 113 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2hky h SER 114 N 2.19 0.00 0.00 1.67 0.02 -1.98 -3.41 113.55 112.04 2hky h SER 114 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2hky h SER 114 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2hky h SER 114 CO 0.00 0.03 0.00 0.00 -1.14 0.00 0.00 176.83 175.72 2hky n GLN 115 N -3.93 0.00 0.00 3.45 6.02 -1.26 -5.05 117.38 116.62 2hky n GLN 115 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2hky n GLN 115 Cb 0.12 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.38 2hky n GLN 115 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hky n GLN 116 N -2.96 0.00 0.00 -1.09 10.64 -1.26 -5.06 117.38 117.64 2hky n GLN 116 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2hky n GLN 116 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2hky n GLN 116 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2hky n PHE 117 N 0.00 0.00 0.00 2.61 3.01 -1.26 -4.58 117.46 117.24 2hky n PHE 117 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2hky n PHE 117 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2hky n PHE 117 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 2hky n HIS 118 N 0.00 0.00 0.00 1.38 -0.00 -1.26 -4.84 115.22 110.50 2hky n HIS 118 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2hky n HIS 118 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2hky n HIS 118 CO 0.00 0.00 0.00 1.47 0.46 0.00 0.00 176.34 178.27 2hky n LEU 119 N 0.00 0.00 -3.36 0.27 -0.00 -1.17 -4.56 117.00 108.17 2hky n LEU 119 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 56.01 55.70 2hky n LEU 119 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.44 2hky n LEU 119 CO 0.00 0.00 -0.74 1.33 -0.00 0.00 0.00 177.39 177.98 2hky n VAL 120 N 0.00 0.00 -2.47 1.47 0.24 0.67 -3.74 118.33 114.50 2hky n VAL 120 Ca 0.00 -0.40 -0.40 0.00 -2.04 0.00 0.00 64.34 61.49 2hky n VAL 120 Cb 0.00 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.34 2hky n VAL 120 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2hky s PRO 121 N -1.13 3.18 0.00 7.34 0.04 -1.26 -1.46 135.00 141.71 2hky s PRO 121 Ca 0.41 -0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.13 2hky s PRO 121 Cb -0.30 -4.48 0.00 0.00 0.04 0.00 0.00 34.50 29.75 2hky s PRO 121 CO 0.59 -2.28 0.00 1.55 0.04 0.00 0.00 177.00 176.90 2hky n VAL 122 N 6.65 0.00 -2.69 -0.36 3.14 -0.63 -4.06 118.33 120.38 2hky n VAL 122 Ca 0.13 0.04 -0.22 0.00 -2.96 0.00 0.00 64.34 61.33 2hky n VAL 122 Cb 0.50 -0.69 0.06 0.00 -1.06 0.00 0.00 33.84 32.65 2hky n VAL 122 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 2hky s HIS 123 N -0.07 2.20 -0.29 1.45 2.46 -1.21 -4.58 115.29 115.25 2hky s HIS 123 Ca 0.00 -0.22 0.03 0.00 0.47 0.00 0.00 55.06 55.33 2hky s HIS 123 Cb 0.00 -2.75 0.07 0.00 -0.13 0.00 0.00 32.58 29.77 2hky s HIS 123 CO 0.00 -1.19 -0.05 -1.17 -2.47 0.00 0.00 174.74 169.85 2hky s LEU 124 N -4.87 3.85 0.09 8.88 2.96 -1.26 0.08 118.68 128.42 2hky s LEU 124 Ca 0.61 -1.59 -0.17 0.00 -0.22 0.00 0.00 54.13 52.76 2hky s LEU 124 Cb -0.08 -1.59 -0.07 0.00 0.50 0.00 0.00 46.19 44.95 2hky s LEU 124 CO 0.40 -0.25 1.51 -0.78 -1.32 0.00 0.00 176.35 175.91 2hky h ASP 125 N 7.76 0.53 -5.81 3.68 3.58 0.55 -3.47 116.42 123.24 2hky h ASP 125 Ca -0.15 -0.34 0.33 0.00 0.42 0.00 0.00 57.03 57.29 2hky h ASP 125 Cb 1.04 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.88 2hky h ASP 125 CO 0.49 0.75 0.89 0.00 -2.88 0.00 0.00 179.24 178.48 2hky s ARG 126 N -4.86 0.43 -0.09 0.28 1.70 -0.83 -4.95 118.95 110.63 2hky s ARG 126 Ca -0.13 -0.28 0.04 0.00 -0.47 0.00 0.00 55.73 54.89 2hky s ARG 126 Cb 0.08 0.12 -0.00 0.00 -0.57 0.00 0.00 34.95 34.58 2hky s ARG 126 CO 0.77 -0.20 -0.23 0.08 -1.08 0.00 0.00 175.30 174.64 2hky s VAL 127 N -2.03 2.17 0.00 4.99 1.01 -1.26 -0.05 120.40 125.22 2hky s VAL 127 Ca 0.29 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2hky s VAL 127 Cb -0.01 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.55 2hky s VAL 127 CO -0.00 0.56 0.44 -0.11 0.00 0.00 0.00 175.10 175.99