#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hky s LYS 1 N 0.00 3.61 0.41 0.03 -2.85 -1.26 -5.01 119.74 114.67 2hky s LYS 1 Ca 0.00 1.41 -0.03 0.00 -1.00 0.00 0.00 55.97 56.34 2hky s LYS 1 Cb 0.00 -2.06 0.05 0.00 -2.06 0.00 0.00 37.83 33.76 2hky s LYS 1 CO 0.00 -0.60 0.12 -2.30 0.10 0.00 0.00 175.35 172.67 2hky n PRO 2 N -1.21 0.62 -3.59 1.78 -0.02 -1.26 -5.05 135.00 126.26 2hky n PRO 2 Ca 0.10 -0.20 -0.02 0.00 -2.02 0.00 0.00 63.50 61.36 2hky n PRO 2 Cb 0.52 -0.67 -0.06 0.00 -0.02 0.00 0.00 33.50 33.27 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 -1.85 0.45 -0.09 -0.52 -2.85 -1.26 -4.88 119.74 108.73 2hky s LYS 3 Ca 0.09 0.87 0.00 0.00 -1.00 0.00 0.00 55.97 55.93 2hky s LYS 3 Cb -0.02 0.25 0.00 0.00 -2.06 0.00 0.00 37.83 36.00 2hky s LYS 3 CO 0.08 -0.11 0.00 0.41 0.10 0.00 0.00 175.35 175.83 2hky n GLY 4 N 4.27 0.42 2.41 0.59 0.00 -1.26 -4.89 105.19 106.73 2hky n GLY 4 Ca -0.16 -0.10 -0.17 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 -1.93 0.80 -0.94 1.61 2.81 -1.26 -4.96 117.12 113.25 2hky n MET 5 Ca -0.01 -2.67 -0.36 0.00 -1.81 0.00 0.00 57.70 52.85 2hky n MET 5 Cb 0.16 -1.34 0.06 0.00 -0.71 0.00 0.00 33.22 31.39 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 1.22 0.00 -0.05 2.03 -1.04 -1.26 -3.96 114.28 111.22 2hky n THR 6 Ca 0.17 -0.34 -0.13 0.00 -2.04 0.00 0.00 64.05 61.70 2hky n THR 6 Cb 0.59 -0.16 -0.07 0.00 -1.82 0.00 0.00 70.33 68.87 2hky n THR 6 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 2hky h SER 7 N -1.17 -1.55 -0.76 8.00 0.87 -1.97 0.13 113.55 117.10 2hky h SER 7 Ca -0.44 0.20 -0.02 0.00 -1.23 0.00 0.00 61.79 60.31 2hky h SER 7 Cb 1.32 0.63 -0.04 0.00 -0.44 0.00 0.00 62.40 63.87 2hky h SER 7 CO 0.26 -0.43 0.40 -1.28 -0.53 0.00 0.00 176.83 175.24 2hky h SER 8 N -0.47 0.97 -0.16 6.23 0.87 -1.86 -2.44 113.55 116.69 2hky h SER 8 Ca 0.08 -0.09 0.04 0.00 -1.23 0.00 0.00 61.79 60.58 2hky h SER 8 Cb 0.63 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.30 2hky h SER 8 CO -0.48 0.80 -0.11 1.56 -0.53 0.00 0.00 176.83 178.07 2hky h GLN 9 N 1.08 -0.11 -0.59 2.24 1.08 -1.20 0.36 115.11 117.97 2hky h GLN 9 Ca 0.27 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.53 2hky h GLN 9 Cb 0.07 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.49 2hky h GLN 9 CO -0.04 -0.07 0.39 2.35 -0.95 0.00 0.00 178.83 180.51 2hky h TRP 10 N -0.11 0.59 0.00 2.96 -0.00 -0.50 0.37 115.95 119.26 2hky h TRP 10 Ca 0.10 0.01 0.00 0.00 -0.00 0.00 0.00 58.89 59.00 2hky h TRP 10 Cb 0.26 -0.19 0.00 0.00 -0.00 0.00 0.00 29.16 29.22 2hky h TRP 10 CO -0.25 0.32 -0.01 1.19 -0.00 0.00 0.00 178.44 179.69 2hky n PHE 11 N -4.47 0.34 0.03 2.65 3.01 0.16 -2.06 117.46 117.12 2hky n PHE 11 Ca 0.08 0.10 -0.04 0.00 1.01 0.00 0.00 57.45 58.60 2hky n PHE 11 Cb 0.21 -0.66 -0.10 0.00 -0.01 0.00 0.00 39.48 38.93 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 0.18 0.43 116.57 121.19 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 0.59 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.92 2hky h LYS 12 CO 0.00 0.51 -0.17 -0.84 -2.09 0.00 0.00 179.45 176.86 2hky h ILE 13 N 0.00 0.00 0.00 0.07 3.07 -1.36 0.30 117.51 119.59 2hky h ILE 13 Ca -0.16 -0.90 0.00 0.00 1.55 0.00 0.00 64.86 65.34 2hky h ILE 13 Cb 1.75 1.81 0.00 0.00 -0.27 0.00 0.00 36.82 40.12 2hky h ILE 13 CO 0.08 0.00 -1.24 0.00 -1.05 0.00 0.00 178.15 175.94 2hky n GLN 14 N -2.88 0.64 -0.43 0.16 10.64 -0.87 -4.64 117.38 120.00 2hky n GLN 14 Ca 0.04 -0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.15 2hky n GLN 14 Cb 0.51 -1.43 0.00 0.00 -0.86 0.00 0.00 30.24 28.47 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 -1.70 0.00 -3.73 2.61 8.25 0.15 -4.64 115.22 116.17 2hky n HIS 15 Ca 0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.11 2hky n HIS 15 Cb 0.37 0.04 -0.11 0.00 1.12 0.00 0.00 29.99 31.41 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 3.83 0.00 -0.41 0.23 0.10 -0.96 119.30 122.09 2hky s MET 16 Ca 0.00 -0.39 0.14 0.00 -1.03 0.00 0.00 55.69 54.41 2hky s MET 16 Cb 0.00 -3.44 -0.01 0.00 -1.53 0.00 0.00 34.83 29.86 2hky s MET 16 CO 0.00 -0.10 0.77 0.00 -2.03 0.00 0.00 175.02 173.66 2hky n GLN 17 N 4.73 1.84 0.22 3.16 10.64 -1.12 -4.11 117.38 132.73 2hky n GLN 17 Ca -0.15 -0.72 0.03 0.00 -1.83 0.00 0.00 57.00 54.32 2hky n GLN 17 Cb 0.52 -1.20 0.15 0.00 -0.86 0.00 0.00 30.24 28.85 2hky n GLN 17 CO 0.00 0.00 0.00 -1.35 -1.83 0.00 0.00 177.06 173.88 2hky h PRO 18 N 1.51 0.00 0.00 2.61 0.11 -1.93 -3.35 132.00 130.95 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 0.47 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2hky h PRO 18 CO 0.00 0.00 0.00 0.45 -0.21 0.00 0.00 178.00 178.24 2hky n SER 19 N -2.09 0.00 0.04 -2.05 2.88 -1.26 -5.06 113.62 106.08 2hky n SER 19 Ca -0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 2hky n SER 19 Cb 0.68 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.07 2hky n SER 19 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2hky n PRO 20 N 0.00 0.63 0.00 -1.46 -0.04 -1.26 -4.98 135.00 127.89 2hky n PRO 20 Ca 0.00 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 2hky n PRO 20 Cb 0.00 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 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 -2.68 0.00 -0.14 0.54 1.13 -1.26 -4.36 117.38 110.60 2hky n GLN 21 Ca -0.06 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.00 2hky n GLN 21 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.05 2hky n GLN 21 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2hky n ALA 22 N 0.00 -2.93 -0.15 -1.58 0.00 -1.26 -3.63 120.51 110.96 2hky n ALA 22 Ca 0.00 0.03 0.27 0.00 0.00 0.00 0.00 53.44 53.75 2hky n ALA 22 Cb 0.00 -0.57 0.72 0.00 0.00 0.00 0.00 19.45 19.60 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 0.00 -0.47 0.37 0.00 -1.24 -1.82 0.44 115.58 112.86 2hky h ASN 24 Ca 0.40 0.13 -0.32 0.00 0.71 0.00 0.00 56.30 57.21 2hky h ASN 24 Cb 1.59 0.28 0.02 0.00 0.73 0.00 0.00 38.32 40.95 2hky h ASN 24 CO -0.01 -0.17 -1.47 -1.28 -1.29 0.00 0.00 177.43 173.22 2hky h SER 25 N -0.06 0.66 -0.80 1.15 0.87 -0.28 -2.42 113.55 112.67 2hky h SER 25 Ca 0.18 -0.76 0.13 0.00 -1.23 0.00 0.00 61.79 60.11 2hky h SER 25 Cb 0.34 -0.22 -0.09 0.00 -0.44 0.00 0.00 62.40 62.00 2hky h SER 25 CO -0.41 1.60 0.40 0.00 -0.53 0.00 0.00 176.83 177.89 2hky h ALA 26 N 0.30 1.16 0.00 6.23 0.00 0.09 0.42 119.26 127.46 2hky h ALA 26 Ca -0.24 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 2hky h ALA 26 Cb 2.10 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.84 2hky h ALA 26 CO 0.23 -0.07 -0.67 1.98 0.00 0.00 0.00 179.25 180.72 2hky h MET 27 N 0.61 0.00 -0.46 0.00 -1.53 -0.19 -2.89 114.93 110.48 2hky h MET 27 Ca 0.42 0.00 0.13 0.00 -3.44 0.00 0.00 59.70 56.81 2hky h MET 27 Cb 0.54 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.57 2hky h MET 27 CO -0.33 0.67 0.34 0.87 0.14 0.00 0.00 176.91 178.60 2hky h LYS 28 N 0.00 0.00 0.00 0.39 1.79 0.36 1.20 116.57 120.31 2hky h LYS 28 Ca -0.01 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2hky h LYS 28 Cb 1.21 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.85 2hky h LYS 28 CO 0.09 0.00 -0.15 -0.97 -1.08 0.00 0.00 179.45 177.33 2hky h ASN 29 N 0.00 0.00 0.48 0.86 -1.24 -1.23 -2.23 115.58 112.23 2hky h ASN 29 Ca 0.22 0.00 -0.30 0.00 0.71 0.00 0.00 56.30 56.93 2hky h ASN 29 Cb 0.89 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.91 2hky h ASN 29 CO -0.00 0.15 -1.61 0.40 -1.29 0.00 0.00 177.43 175.08 2hky h ILE 30 N 0.00 1.02 0.00 2.57 2.04 0.12 -2.94 117.51 120.31 2hky h ILE 30 Ca -0.00 -2.76 0.00 0.00 1.00 0.00 0.00 64.86 63.10 2hky h ILE 30 Cb 0.83 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 2hky h ILE 30 CO 0.02 0.72 0.00 -0.55 0.00 0.00 0.00 178.15 178.34 2hky h ASN 31 N 0.03 0.00 0.24 1.72 -1.07 -0.49 -0.79 115.58 115.22 2hky h ASN 31 Ca -0.26 0.00 -0.34 0.00 0.07 0.00 0.00 56.30 55.77 2hky h ASN 31 Cb 1.99 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 38.24 2hky h ASN 31 CO 0.11 0.00 -1.75 0.07 0.07 0.00 0.00 177.43 175.93 2hky h LYS 32 N 0.00 0.34 0.00 4.14 2.10 -1.48 0.19 116.57 121.85 2hky h LYS 32 Ca 0.00 -0.58 0.00 0.00 -2.00 0.00 0.00 60.65 58.07 2hky h LYS 32 Cb 0.78 0.21 0.00 0.00 -0.90 0.00 0.00 32.23 32.32 2hky h LYS 32 CO 0.00 1.24 -0.21 1.12 -2.00 0.00 0.00 179.45 179.60 2hky h HIS 33 N 0.09 0.00 -0.00 0.07 2.07 -1.49 -3.25 115.15 112.64 2hky h HIS 33 Ca -0.34 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.18 2hky h HIS 33 Cb 2.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.05 2hky h HIS 33 CO 0.09 0.00 -0.49 0.25 -3.07 0.00 0.00 177.93 174.71 2hky n THR 34 N -2.64 0.00 -1.45 6.12 -2.24 -0.31 -4.95 114.28 108.80 2hky n THR 34 Ca 0.04 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.41 2hky n THR 34 Cb 0.49 1.06 -0.07 0.00 -2.10 0.00 0.00 70.33 69.71 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 -0.89 -1.59 -3.54 -0.78 4.76 0.03 -4.90 118.16 111.26 2hky n LYS 35 Ca 0.04 1.05 -0.16 0.00 -2.87 0.00 0.00 58.31 56.36 2hky n LYS 35 Cb 0.23 -5.45 -0.06 0.00 -1.84 0.00 0.00 35.03 27.91 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 -3.32 1.04 -0.67 1.97 6.06 -1.08 -4.98 118.95 117.96 2hky s ARG 36 Ca 0.00 0.08 -0.20 0.00 -2.50 0.00 0.00 55.73 53.11 2hky s ARG 36 Cb 0.00 0.49 0.10 0.00 0.06 0.00 0.00 34.95 35.60 2hky s ARG 36 CO 0.00 -0.35 0.84 0.00 -2.50 0.00 0.00 175.30 173.30 2hky n LYS 38 N 6.63 0.02 0.00 0.00 4.76 -1.26 -4.59 118.16 123.71 2hky n LYS 38 Ca -0.02 0.48 0.00 0.00 -2.87 0.00 0.00 58.31 55.90 2hky n LYS 38 Cb 0.44 -1.65 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 2hky n LYS 38 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2hky n ASP 39 N -1.55 0.00 -3.76 4.39 8.00 -1.26 -4.91 116.55 117.46 2hky n ASP 39 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 2hky n ASP 39 Cb 0.59 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.58 2hky n ASP 39 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2hky s LEU 40 N 0.00 0.69 -0.19 0.64 1.98 -1.26 -0.42 118.68 120.12 2hky s LEU 40 Ca 0.00 0.65 -0.08 0.00 -2.89 0.00 0.00 54.13 51.82 2hky s LEU 40 Cb 0.00 1.09 0.08 0.00 0.66 0.00 0.00 46.19 48.02 2hky s LEU 40 CO 0.00 -0.12 0.42 0.20 -1.89 0.00 0.00 176.35 174.96 2hky s ASN 41 N 0.33 -0.35 0.13 3.68 -0.87 -1.02 -4.97 114.94 111.87 2hky s ASN 41 Ca -0.01 0.97 0.03 0.00 -1.57 0.00 0.00 52.86 52.28 2hky s ASN 41 Cb -0.03 1.17 -0.04 0.00 -0.02 0.00 0.00 41.25 42.33 2hky s ASN 41 CO -0.01 -0.22 0.21 0.42 -2.57 0.00 0.00 177.10 174.93 2hky s THR 42 N 2.22 5.04 0.08 1.60 -4.23 -1.26 -1.45 115.64 117.64 2hky s THR 42 Ca -0.04 -0.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.76 2hky s THR 42 Cb -0.11 -3.54 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 2hky s THR 42 CO -0.13 -0.02 -0.07 -0.36 -0.54 0.00 0.00 174.62 173.50 2hky s PHE 43 N -1.65 0.86 0.09 3.99 0.40 0.71 -4.33 117.98 118.05 2hky s PHE 43 Ca 0.33 -0.79 0.09 0.00 -0.60 0.00 0.00 56.93 55.97 2hky s PHE 43 Cb -0.11 -0.50 -0.04 0.00 0.51 0.00 0.00 43.02 42.89 2hky s PHE 43 CO 0.26 -0.12 -0.24 -0.51 0.70 0.00 0.00 175.22 175.32 2hky s LEU 44 N -2.63 2.40 -1.01 -0.37 1.43 -0.13 0.10 118.68 118.47 2hky s LEU 44 Ca 0.06 -0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 52.51 2hky s LEU 44 Cb 0.01 -1.35 0.29 0.00 0.03 0.00 0.00 46.19 45.16 2hky s LEU 44 CO -0.03 0.21 1.23 1.57 0.23 0.00 0.00 176.35 179.57 2hky n HIS 45 N 1.24 3.33 -3.67 0.29 -0.00 -0.56 -2.79 115.22 113.05 2hky n HIS 45 Ca -0.17 -3.26 -0.09 0.00 0.46 0.00 0.00 57.72 54.67 2hky n HIS 45 Cb 0.52 -1.26 -0.09 0.00 -0.12 0.00 0.00 29.99 29.05 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 -2.26 0.52 -0.01 1.57 2.56 -1.26 -4.58 118.70 115.24 2hky s GLU 46 Ca 0.32 1.00 -0.37 0.00 0.00 0.00 0.00 54.97 55.92 2hky s GLU 46 Cb 0.01 0.09 -0.16 0.00 2.00 0.00 0.00 34.13 36.08 2hky s GLU 46 CO 0.02 -0.16 1.52 -2.30 -0.56 0.00 0.00 175.26 173.78 2hky n PRO 47 N 4.40 1.39 0.31 4.30 -0.02 -1.26 -4.38 135.00 139.73 2hky n PRO 47 Ca -0.21 0.51 0.02 0.00 -2.02 0.00 0.00 63.50 61.80 2hky n PRO 47 Cb 0.56 -2.20 0.12 0.00 -0.02 0.00 0.00 33.50 31.96 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 5.81 0.00 0.01 6.00 0.04 -1.98 2.59 116.94 129.41 2hky h PHE 48 Ca -0.47 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.06 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 0.67 0.00 -0.98 0.77 -0.60 0.00 0.00 178.31 178.17 2hky h SER 49 N 0.00 0.61 0.16 2.17 0.02 -1.97 0.40 113.55 114.93 2hky h SER 49 Ca 0.00 -0.50 -0.31 0.00 -0.84 0.00 0.00 61.79 60.14 2hky h SER 49 Cb 1.72 -0.19 0.01 0.00 0.14 0.00 0.00 62.40 64.08 2hky h SER 49 CO 0.00 1.30 -1.54 0.28 -1.14 0.00 0.00 176.83 175.72 2hky h SER 50 N 0.26 0.52 -0.07 3.07 0.02 0.41 -2.88 113.55 114.89 2hky h SER 50 Ca -0.09 -0.90 -0.05 0.00 -0.84 0.00 0.00 61.79 59.90 2hky h SER 50 Cb 1.62 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.98 2hky h SER 50 CO 0.17 1.69 -0.09 0.58 -1.14 0.00 0.00 176.83 178.05 2hky h VAL 51 N -0.10 1.18 0.27 2.27 2.07 -1.02 0.34 116.25 121.26 2hky h VAL 51 Ca -0.31 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2hky h VAL 51 Cb 1.93 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 2hky h VAL 51 CO 0.13 0.25 -0.28 0.00 0.02 0.00 0.00 177.57 177.69 2hky h ALA 52 N 1.60 -0.59 -0.14 1.67 0.00 -0.22 0.13 119.26 121.71 2hky h ALA 52 Ca 0.07 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2hky h ALA 52 Cb 0.36 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2hky h ALA 52 CO 0.02 -0.86 -0.21 0.00 0.00 0.00 0.00 179.25 178.19 2hky h ALA 53 N 0.01 1.38 -0.49 0.00 0.00 -1.17 -1.59 119.26 117.40 2hky h ALA 53 Ca -0.01 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.65 2hky h ALA 53 Cb 0.55 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2hky h ALA 53 CO -0.07 0.43 0.33 1.15 0.00 0.00 0.00 179.25 181.09 2hky h THR 54 N 0.22 1.09 0.00 0.00 2.02 0.93 0.18 112.91 117.34 2hky h THR 54 Ca 0.04 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2hky h THR 54 Cb 0.51 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 2hky h THR 54 CO 0.03 0.11 0.00 0.00 0.37 0.00 0.00 175.52 176.04 2hky n GLN 56 N 0.26 4.53 -1.18 0.00 7.27 0.62 -4.74 117.38 124.15 2hky n GLN 56 Ca 0.00 -0.01 -0.31 0.00 0.07 0.00 0.00 57.00 56.75 2hky n GLN 56 Cb 0.30 -0.76 0.10 0.00 2.41 0.00 0.00 30.24 32.29 2hky n GLN 56 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 2hky s THR 57 N -1.54 3.13 -0.40 1.69 -1.32 -1.11 -4.80 115.64 111.29 2hky s THR 57 Ca 0.01 0.37 -0.37 0.00 -1.21 0.00 0.00 61.69 60.49 2hky s THR 57 Cb 0.03 -2.79 -0.16 0.00 -1.51 0.00 0.00 72.50 68.07 2hky s THR 57 CO 0.15 -0.48 1.41 -2.65 -2.21 0.00 0.00 174.62 170.84 2hky n PRO 58 N -3.64 0.00 -0.00 7.08 -0.02 -1.26 -4.73 135.00 132.43 2hky n PRO 58 Ca 0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2hky n PRO 58 Cb 0.53 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.81 2hky n PRO 58 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2hky n LYS 59 N 4.05 1.13 -3.61 -0.52 0.00 -1.26 -4.42 118.16 113.53 2hky n LYS 59 Ca 0.31 0.00 -0.16 0.00 -0.00 0.00 0.00 58.31 58.46 2hky n LYS 59 Cb -0.04 0.00 -0.07 0.00 -0.00 0.00 0.00 35.03 34.92 2hky n LYS 59 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 2hky s ILE 60 N 0.13 0.02 -0.67 0.58 -4.36 -1.23 -4.96 121.20 110.71 2hky s ILE 60 Ca 0.00 -0.15 -0.14 0.00 -0.26 0.00 0.00 60.65 60.11 2hky s ILE 60 Cb 0.00 -0.86 -0.17 0.00 1.25 0.00 0.00 42.46 42.68 2hky s ILE 60 CO 0.00 -0.08 1.84 0.00 0.24 0.00 0.00 174.94 176.94 2hky n ALA 61 N 1.23 0.56 -1.00 2.27 0.00 -1.26 -3.12 120.51 119.19 2hky n ALA 61 Ca -0.19 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 51.93 2hky n ALA 61 Cb 0.57 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.81 2hky n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hky n LYS 63 N -0.30 0.00 -0.87 0.00 4.76 -1.26 -4.71 118.16 115.78 2hky n LYS 63 Ca 0.00 0.30 -0.01 0.00 -2.87 0.00 0.00 58.31 55.73 2hky n LYS 63 Cb 0.00 -1.23 -0.02 0.00 -1.84 0.00 0.00 35.03 31.94 2hky n LYS 63 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2hky n ASN 64 N -1.40 -0.12 0.00 4.39 2.85 -1.26 -4.90 115.26 114.83 2hky n ASN 64 Ca 0.00 -1.72 0.00 0.00 -0.11 0.00 0.00 54.58 52.75 2hky n ASN 64 Cb 0.00 -0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 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 0.10 -0.56 0.27 8.20 0.00 -1.26 -5.01 105.19 106.94 2hky n GLY 65 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 0.92 -5.75 1.61 5.19 -1.85 -3.46 116.42 113.08 2hky h ASP 66 Ca 0.00 -0.37 -0.36 0.00 -0.62 0.00 0.00 57.03 55.68 2hky h ASP 66 Cb 0.00 -0.25 0.15 0.00 0.18 0.00 0.00 39.33 39.41 2hky h ASP 66 CO 0.00 1.13 -0.74 0.29 -3.12 0.00 0.00 179.24 176.80 2hky n LYS 67 N -4.09 -6.98 -0.02 3.56 5.02 -1.18 -4.77 118.16 109.70 2hky n LYS 67 Ca -0.01 0.83 0.01 0.00 -2.02 0.00 0.00 58.31 57.12 2hky n LYS 67 Cb 0.48 -5.84 0.02 0.00 -0.02 0.00 0.00 35.03 29.67 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 -3.08 1.84 -4.99 4.39 3.02 -1.25 -4.65 115.26 110.54 2hky n ASN 68 Ca -0.19 -1.71 -0.19 0.00 -0.03 0.00 0.00 54.58 52.47 2hky n ASN 68 Cb 0.63 -0.03 -0.00 0.00 -0.61 0.00 0.00 39.78 39.77 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 -2.19 -0.72 -0.10 0.00 3.76 0.14 -3.51 115.29 112.67 2hky s HIS 70 Ca 0.44 1.38 -0.15 0.00 -0.15 0.00 0.00 55.06 56.58 2hky s HIS 70 Cb -0.10 0.22 -0.05 0.00 1.11 0.00 0.00 32.58 33.77 2hky s HIS 70 CO 0.31 -0.47 0.38 -1.14 -0.85 0.00 0.00 174.74 172.98 2hky s GLN 71 N 2.57 4.15 0.40 1.40 -0.44 -1.26 -0.67 119.66 125.82 2hky s GLN 71 Ca -0.00 0.30 -0.25 0.00 -2.50 0.00 0.00 55.36 52.90 2hky s GLN 71 Cb -0.12 -3.36 -0.11 0.00 -1.64 0.00 0.00 33.01 27.78 2hky s GLN 71 CO -0.12 0.37 1.09 -1.13 0.50 0.00 0.00 175.29 176.00 2hky n SER 72 N 3.01 1.66 -0.72 6.67 3.41 0.47 -4.78 113.62 123.34 2hky n SER 72 Ca -0.11 1.08 0.00 0.00 -0.26 0.00 0.00 58.87 59.58 2hky n SER 72 Cb 0.52 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.08 2hky n SER 72 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2hky n HIS 73 N -0.28 0.00 -0.54 7.33 -0.00 -1.26 -4.76 115.22 115.71 2hky n HIS 73 Ca 0.08 -0.17 0.00 0.00 0.46 0.00 0.00 57.72 58.10 2hky n HIS 73 Cb 0.38 -0.14 0.00 0.00 -0.12 0.00 0.00 29.99 30.11 2hky n HIS 73 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2hky n GLY 74 N 0.35 -1.97 3.69 1.57 0.00 -1.26 -5.12 105.19 102.44 2hky n GLY 74 Ca 0.00 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.86 4.32 -0.08 1.61 0.04 -1.26 -3.42 135.00 134.36 2hky s PRO 75 Ca 0.00 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2hky s PRO 75 Cb 0.00 -3.58 -0.03 0.00 0.04 0.00 0.00 34.50 30.93 2hky s PRO 75 CO 0.00 -0.50 -0.05 0.54 0.04 0.00 0.00 177.00 177.02 2hky s VAL 76 N 2.37 3.82 -0.94 -0.36 0.11 -0.70 -4.70 120.40 120.00 2hky s VAL 76 Ca 0.58 -0.43 -0.25 0.00 -2.93 0.00 0.00 61.98 58.95 2hky s VAL 76 Cb -0.26 -2.58 -0.13 0.00 -1.53 0.00 0.00 36.38 31.88 2hky s VAL 76 CO 0.23 0.59 2.17 -0.44 -3.33 0.00 0.00 175.10 174.32 2hky s SER 77 N -0.76 4.23 0.72 3.54 0.01 -1.26 -2.26 113.70 117.92 2hky s SER 77 Ca 0.12 -0.58 0.01 0.00 1.31 0.00 0.00 55.95 56.80 2hky s SER 77 Cb -0.11 -2.57 0.14 0.00 0.21 0.00 0.00 66.02 63.69 2hky s SER 77 CO 0.02 -3.71 0.99 -1.48 0.41 0.00 0.00 173.24 169.47 2hky s LEU 78 N 13.68 2.95 -0.23 2.44 0.05 0.15 -1.50 118.68 136.22 2hky s LEU 78 Ca 0.81 -0.54 -0.04 0.00 0.05 0.00 0.00 54.13 54.41 2hky s LEU 78 Cb -0.08 -1.73 0.08 0.00 -2.05 0.00 0.00 46.19 42.41 2hky s LEU 78 CO 0.09 -1.89 0.10 -0.89 -0.55 0.00 0.00 176.35 173.22 2hky s THR 79 N -3.11 -0.00 -0.47 5.48 2.01 0.11 -0.76 115.64 118.90 2hky s THR 79 Ca 0.67 -0.51 -0.24 0.00 0.31 0.00 0.00 61.69 61.93 2hky s THR 79 Cb -0.04 -0.83 0.03 0.00 0.01 0.00 0.00 72.50 71.67 2hky s THR 79 CO 0.44 -0.49 0.83 -0.04 -0.69 0.00 0.00 174.62 174.67 2hky s MET 80 N 2.08 3.41 0.11 4.92 -1.94 0.89 -0.20 119.30 128.57 2hky s MET 80 Ca 0.05 -0.09 -0.05 0.00 -1.71 0.00 0.00 55.69 53.89 2hky s MET 80 Cb -0.16 -3.96 -0.05 0.00 2.01 0.00 0.00 34.83 32.67 2hky s MET 80 CO -0.22 -1.20 0.34 0.00 -0.01 0.00 0.00 175.02 173.94 2hky s LYS 82 N -2.45 0.79 -0.44 0.00 -2.85 -1.05 -2.42 119.74 111.31 2hky s LYS 82 Ca 0.38 -1.09 -0.29 0.00 -1.00 0.00 0.00 55.97 53.97 2hky s LYS 82 Cb -0.13 -0.48 0.01 0.00 -2.06 0.00 0.00 37.83 35.18 2hky s LYS 82 CO 0.23 0.07 1.38 -1.17 0.10 0.00 0.00 175.35 175.97 2hky s LEU 83 N -2.30 3.56 0.01 2.77 2.96 0.44 -2.31 118.68 123.82 2hky s LEU 83 Ca 0.03 0.70 -0.25 0.00 -0.22 0.00 0.00 54.13 54.40 2hky s LEU 83 Cb -0.04 -3.48 -0.18 0.00 0.50 0.00 0.00 46.19 42.99 2hky s LEU 83 CO -0.00 -1.45 1.39 0.71 -1.32 0.00 0.00 176.35 175.67 2hky h THR 84 N 6.43 1.29 0.00 3.68 1.35 -1.31 -3.49 112.91 120.87 2hky h THR 84 Ca -0.27 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.71 2hky h THR 84 Cb 1.10 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 2hky h THR 84 CO 1.10 0.23 0.00 -1.54 -0.25 0.00 0.00 175.52 175.07 2hky n SER 85 N -4.88 0.00 0.00 5.36 3.41 -1.13 -5.00 113.62 111.38 2hky n SER 85 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 2hky n SER 85 Cb 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2hky n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hky n GLY 86 N -1.08 1.21 0.00 5.00 0.00 -1.25 -2.05 105.19 107.02 2hky n GLY 86 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hky n GLY 86 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hky n LYS 87 N 0.00 0.00 -0.05 1.61 5.02 -1.25 -3.99 118.16 119.50 2hky n LYS 87 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.08 2hky n LYS 87 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 34.88 2hky n LYS 87 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 2hky h TYR 88 N 0.00 0.21 -0.02 2.13 3.20 -1.96 -2.18 116.97 118.34 2hky h TYR 88 Ca 0.00 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.72 2hky h TYR 88 Cb 0.00 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.26 2hky h TYR 88 CO 0.00 1.54 0.00 -0.35 -1.64 0.00 0.00 178.16 177.71 2hky n PRO 89 N -4.11 1.11 -1.25 1.82 -0.04 -1.26 -3.70 135.00 127.56 2hky n PRO 89 Ca -0.29 -0.17 -0.02 0.00 -0.04 0.00 0.00 63.50 62.98 2hky n PRO 89 Cb 0.80 -1.31 -0.03 0.00 -0.04 0.00 0.00 33.50 32.93 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 -0.62 -0.04 -4.70 3.54 2.85 -1.26 -5.10 115.26 109.93 2hky n ASN 90 Ca 0.15 -2.00 -0.42 0.00 -0.11 0.00 0.00 54.58 52.20 2hky n ASN 90 Cb 0.11 0.01 -0.03 0.00 1.24 0.00 0.00 39.78 41.11 2hky n ASN 90 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2hky s ARG 92 N 1.48 3.17 0.31 0.00 1.70 -0.87 -4.95 118.95 119.79 2hky s ARG 92 Ca 0.48 -0.65 0.08 0.00 -0.47 0.00 0.00 55.73 55.17 2hky s ARG 92 Cb -0.19 -2.62 -0.04 0.00 -0.57 0.00 0.00 34.95 31.53 2hky s ARG 92 CO 0.21 0.36 0.14 0.71 -1.08 0.00 0.00 175.30 175.64 2hky s TYR 93 N -0.01 2.80 -0.05 5.89 1.51 -1.26 -0.85 117.35 125.39 2hky s TYR 93 Ca -0.03 -0.29 0.06 0.00 -1.01 0.00 0.00 57.07 55.81 2hky s TYR 93 Cb -0.14 -1.52 -0.02 0.00 -0.11 0.00 0.00 41.96 40.17 2hky s TYR 93 CO 0.04 0.41 -0.24 0.15 -1.11 0.00 0.00 175.55 174.80 2hky s LYS 94 N -3.83 2.42 -0.14 -0.62 -0.14 -0.98 -3.78 119.74 112.68 2hky s LYS 94 Ca 0.36 -0.88 -0.18 0.00 -1.36 0.00 0.00 55.97 53.91 2hky s LYS 94 Cb -0.05 -2.16 -0.04 0.00 -1.68 0.00 0.00 37.83 33.90 2hky s LYS 94 CO 0.23 0.47 0.47 -1.83 -0.76 0.00 0.00 175.35 173.93 2hky s GLU 95 N -0.37 4.30 -0.32 1.68 -1.05 -1.26 -2.52 118.70 119.16 2hky s GLU 95 Ca 0.03 0.42 -0.02 0.00 -0.15 0.00 0.00 54.97 55.25 2hky s GLU 95 Cb -0.12 -3.47 0.06 0.00 -0.44 0.00 0.00 34.13 30.16 2hky s GLU 95 CO 0.02 0.09 0.03 0.21 0.95 0.00 0.00 175.26 176.56 2hky s LYS 96 N 0.85 2.32 -0.42 -4.83 2.47 -0.78 -4.97 119.74 114.40 2hky s LYS 96 Ca 0.25 -1.37 -0.29 0.00 -1.56 0.00 0.00 55.97 53.00 2hky s LYS 96 Cb -0.15 -3.24 0.01 0.00 -1.46 0.00 0.00 37.83 32.99 2hky s LYS 96 CO 0.10 -0.70 1.37 0.50 0.16 0.00 0.00 175.35 176.78 2hky s ARG 97 N 1.22 3.61 0.36 4.03 3.52 -1.26 -0.08 118.95 130.35 2hky s ARG 97 Ca -0.03 0.90 0.07 0.00 -0.13 0.00 0.00 55.73 56.55 2hky s ARG 97 Cb -0.20 -4.00 -0.07 0.00 -1.56 0.00 0.00 34.95 29.11 2hky s ARG 97 CO -0.02 -1.52 -0.03 -0.65 -0.81 0.00 0.00 175.30 172.27 2hky s GLN 98 N 4.84 1.83 -0.23 5.12 -1.52 0.06 -4.96 119.66 124.80 2hky s GLN 98 Ca 0.59 -2.00 -0.01 0.00 -1.95 0.00 0.00 55.36 52.00 2hky s GLN 98 Cb -0.13 -1.52 0.07 0.00 -0.22 0.00 0.00 33.01 31.21 2hky s GLN 98 CO 0.32 0.01 0.00 0.54 -0.25 0.00 0.00 175.29 175.91 2hky s ASN 99 N -3.62 3.49 0.08 5.90 2.20 -1.26 0.31 114.94 122.04 2hky s ASN 99 Ca 0.34 -1.10 -0.21 0.00 -0.94 0.00 0.00 52.86 50.95 2hky s ASN 99 Cb 0.07 -0.91 0.05 0.00 -2.00 0.00 0.00 41.25 38.46 2hky s ASN 99 CO 0.17 -0.29 0.51 -0.54 -2.94 0.00 0.00 177.10 174.01 2hky s LYS 100 N 1.61 1.08 -0.33 3.55 1.02 -0.96 -4.73 119.74 120.98 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 0.49 0.01 0.00 -0.52 0.00 0.00 37.83 37.63 2hky s LYS 100 CO -0.09 -0.41 0.96 -1.12 -0.92 0.00 0.00 175.35 173.77 2hky s SER 101 N -2.24 6.80 0.24 2.83 0.01 -1.22 -1.73 113.70 118.39 2hky s SER 101 Ca -0.03 0.84 0.04 0.00 1.31 0.00 0.00 55.95 58.11 2hky s SER 101 Cb -0.00 -2.49 0.04 0.00 0.21 0.00 0.00 66.02 63.78 2hky s SER 101 CO -0.05 -0.80 0.32 0.00 0.41 0.00 0.00 173.24 173.11 2hky n TYR 102 N 6.67 -2.62 -3.83 2.43 0.18 -1.26 -0.12 117.16 118.60 2hky n TYR 102 Ca 0.09 -0.87 -0.29 0.00 1.88 0.00 0.00 57.90 58.71 2hky n TYR 102 Cb 0.48 -0.22 -0.16 0.00 -0.38 0.00 0.00 39.34 39.05 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 -0.50 0.96 0.07 -3.48 1.01 0.90 -0.39 120.40 118.96 2hky s VAL 103 Ca 0.24 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.49 2hky s VAL 103 Cb -0.02 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 2hky s VAL 103 CO 0.15 -0.11 -0.10 0.54 0.00 0.00 0.00 175.10 175.57 2hky s VAL 104 N 1.66 3.34 0.51 2.92 0.11 0.16 0.29 120.40 129.39 2hky s VAL 104 Ca -0.02 -1.14 -0.00 0.00 -2.93 0.00 0.00 61.98 57.89 2hky s VAL 104 Cb -0.17 -2.51 0.01 0.00 -1.53 0.00 0.00 36.38 32.18 2hky s VAL 104 CO -0.07 0.22 0.75 0.00 -3.33 0.00 0.00 175.10 172.66 2hky s ALA 105 N -1.12 3.72 0.14 1.54 0.00 0.88 -0.68 121.76 126.25 2hky s ALA 105 Ca 0.19 -1.10 0.07 0.00 0.00 0.00 0.00 51.96 51.13 2hky s ALA 105 Cb -0.11 -2.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 2hky s ALA 105 CO 0.11 -0.59 -0.17 0.00 0.00 0.00 0.00 175.76 175.11 2hky s LYS 107 N -2.67 0.85 0.19 0.00 -0.14 -0.86 -4.86 119.74 112.26 2hky s LYS 107 Ca 0.12 -1.02 -0.30 0.00 -1.36 0.00 0.00 55.97 53.41 2hky s LYS 107 Cb -0.06 0.33 -0.08 0.00 -1.68 0.00 0.00 37.83 36.34 2hky s LYS 107 CO 0.05 -0.27 1.22 -1.25 -0.76 0.00 0.00 175.35 174.34 2hky s PRO 108 N -3.88 4.47 -0.56 -1.68 0.04 -1.26 -0.30 135.00 131.83 2hky s PRO 108 Ca 0.07 1.91 -0.33 0.00 0.04 0.00 0.00 61.00 62.69 2hky s PRO 108 Cb 0.05 -3.23 -0.14 0.00 0.04 0.00 0.00 34.50 31.22 2hky s PRO 108 CO -0.09 -0.11 2.36 -2.30 0.04 0.00 0.00 177.00 176.90 2hky n PRO 109 N 2.46 0.67 0.00 0.56 -0.02 -1.26 -4.87 135.00 132.54 2hky n PRO 109 Ca 0.04 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2hky n PRO 109 Cb 0.44 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 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 8.36 0.00 0.00 -0.52 1.13 -1.26 -4.69 117.38 120.40 2hky n GLN 110 Ca 0.48 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.54 2hky n GLN 110 Cb 0.21 -0.04 0.00 0.00 0.11 0.00 0.00 30.24 30.53 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 2.93 0.07 -1.09 2.85 -1.26 -4.70 118.16 116.96 2hky n LYS 111 Ca 0.00 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.20 2hky n LYS 111 Cb 0.00 -0.75 -0.09 0.00 -0.65 0.00 0.00 35.03 33.54 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 0.00 0.00 -1.58 3.11 -1.94 -3.48 116.57 112.68 2hky h LYS 112 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2hky h LYS 112 Cb 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.25 2hky h LYS 112 CO 0.00 0.95 0.00 -0.40 -2.81 0.00 0.00 179.45 177.19 2hky n ASP 113 N -3.40 0.00 0.31 4.20 5.75 -1.26 -4.59 116.55 117.57 2hky n ASP 113 Ca -0.00 0.00 0.18 0.00 -0.01 0.00 0.00 54.79 54.96 2hky n ASP 113 Cb 0.90 0.00 0.95 0.00 -1.03 0.00 0.00 41.12 41.94 2hky n ASP 113 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2hky h SER 114 N 1.52 0.00 0.00 -1.12 0.02 -1.98 -3.40 113.55 108.59 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 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2hky n GLN 115 N -3.08 0.00 0.00 3.45 10.64 -1.26 -5.04 117.38 122.08 2hky n GLN 115 Ca -0.02 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.15 2hky n GLN 115 Cb 0.28 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.66 2hky n GLN 115 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2hky n GLN 116 N -2.50 0.00 0.00 2.61 10.64 -1.26 -5.06 117.38 121.81 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 -4.57 117.46 117.25 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 0.72 1.01 0.00 0.00 176.76 178.49 2hky n HIS 118 N 0.00 0.00 0.00 1.38 8.25 -1.26 -4.84 115.22 118.75 2hky n HIS 118 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2hky n HIS 118 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2hky n HIS 118 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 2hky n LEU 119 N 0.00 0.00 -3.27 2.41 -0.00 -1.10 -4.57 117.00 110.47 2hky n LEU 119 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.71 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 -0.85 1.33 -0.00 0.00 0.00 177.39 177.87 2hky n VAL 120 N 0.00 0.00 -2.46 1.47 0.24 0.59 -3.79 118.33 114.39 2hky n VAL 120 Ca 0.00 -0.40 -0.40 0.00 -2.04 0.00 0.00 64.34 61.50 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 -1.28 3.21 0.00 7.34 0.04 -1.26 -2.02 135.00 141.02 2hky s PRO 121 Ca 0.37 -0.43 0.00 0.00 0.04 0.00 0.00 61.00 60.98 2hky s PRO 121 Cb -0.24 -4.65 0.00 0.00 0.04 0.00 0.00 34.50 29.64 2hky s PRO 121 CO 0.61 -2.33 0.00 1.55 0.04 0.00 0.00 177.00 176.87 2hky n VAL 122 N 6.75 0.00 -2.67 -0.36 3.14 -0.88 -4.28 118.33 120.04 2hky n VAL 122 Ca 0.18 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.34 2hky n VAL 122 Cb 0.50 -0.58 0.07 0.00 -1.06 0.00 0.00 33.84 32.76 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 0.00 2.16 -0.24 1.45 5.65 -1.22 -4.61 115.29 118.48 2hky s HIS 123 Ca 0.00 -0.21 0.02 0.00 0.25 0.00 0.00 55.06 55.11 2hky s HIS 123 Cb 0.00 -2.78 0.06 0.00 -1.18 0.00 0.00 32.58 28.67 2hky s HIS 123 CO 0.00 -1.25 -0.09 -1.17 -0.65 0.00 0.00 174.74 171.58 2hky s LEU 124 N -4.90 2.95 0.05 8.88 2.96 -1.26 -0.08 118.68 127.28 2hky s LEU 124 Ca 0.62 -1.23 -0.17 0.00 -0.22 0.00 0.00 54.13 53.13 2hky s LEU 124 Cb -0.08 -1.38 -0.19 0.00 0.50 0.00 0.00 46.19 45.05 2hky s LEU 124 CO 0.41 -0.19 1.23 -0.78 -1.32 0.00 0.00 176.35 175.69 2hky h ASP 125 N 7.87 0.70 -5.88 3.68 3.58 0.41 -3.47 116.42 123.31 2hky h ASP 125 Ca -0.21 -0.66 0.36 0.00 0.42 0.00 0.00 57.03 56.95 2hky h ASP 125 Cb 1.06 -0.21 -0.07 0.00 1.72 0.00 0.00 39.33 41.83 2hky h ASP 125 CO 0.45 1.25 0.94 0.00 -2.88 0.00 0.00 179.24 179.00 2hky s ARG 126 N -3.61 0.28 -0.07 0.28 1.70 -0.85 -4.96 118.95 111.72 2hky s ARG 126 Ca -0.12 -0.18 0.05 0.00 -0.47 0.00 0.00 55.73 55.01 2hky s ARG 126 Cb 0.06 0.08 -0.01 0.00 -0.57 0.00 0.00 34.95 34.50 2hky s ARG 126 CO 0.85 -0.13 -0.22 0.08 -1.08 0.00 0.00 175.30 174.80 2hky s VAL 127 N -2.02 2.32 0.00 4.99 1.01 -1.26 -0.07 120.40 125.36 2hky s VAL 127 Ca 0.30 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2hky s VAL 127 Cb -0.00 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.50 2hky s VAL 127 CO -0.01 0.57 0.41 -0.11 0.00 0.00 0.00 175.10 175.96