#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 0.73 0.00 0.03 0.00 -1.26 -5.14 118.16 112.53 2hky n LYS 1 Ca 0.00 -2.52 0.00 0.00 -0.00 0.00 0.00 58.31 55.79 2hky n LYS 1 Cb 0.00 -1.34 0.00 0.00 -0.00 0.00 0.00 35.03 33.69 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 1.56 2.04 -3.60 -1.58 -0.02 -1.26 -5.06 135.00 127.08 2hky n PRO 2 Ca 0.16 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.61 2hky n PRO 2 Cb 0.58 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 34.00 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 0.00 0.41 0.00 -0.52 -2.85 -1.26 -4.90 119.74 110.63 2hky s LYS 3 Ca 0.00 0.79 0.00 0.00 -1.00 0.00 0.00 55.97 55.76 2hky s LYS 3 Cb 0.00 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.97 2hky s LYS 3 CO 0.00 -0.10 0.00 0.41 0.10 0.00 0.00 175.35 175.76 2hky n GLY 4 N 4.14 0.90 2.23 0.59 0.00 -1.26 -4.88 105.19 106.90 2hky n GLY 4 Ca -0.16 0.00 -0.27 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 -2.10 2.38 -0.90 1.61 2.81 -1.26 -4.70 117.12 114.96 2hky n MET 5 Ca 0.00 -3.00 -0.35 0.00 -1.81 0.00 0.00 57.70 52.54 2hky n MET 5 Cb 0.00 -2.17 0.08 0.00 -0.71 0.00 0.00 33.22 30.41 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 -0.97 0.00 0.06 2.03 -1.04 -1.26 -4.12 114.28 108.99 2hky n THR 6 Ca 0.59 -0.27 -0.15 0.00 -2.04 0.00 0.00 64.05 62.18 2hky n THR 6 Cb 1.22 -0.24 -0.09 0.00 -1.82 0.00 0.00 70.33 69.40 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 -1.32 -1.52 -0.79 8.00 0.87 -1.95 0.34 113.55 117.18 2hky h SER 7 Ca -0.44 0.17 0.04 0.00 -1.23 0.00 0.00 61.79 60.33 2hky h SER 7 Cb 1.33 0.58 -0.05 0.00 -0.44 0.00 0.00 62.40 63.83 2hky h SER 7 CO 0.28 -0.51 0.52 0.28 -0.53 0.00 0.00 176.83 176.87 2hky h SER 8 N -0.65 0.82 -0.10 6.23 0.02 -1.87 -2.11 113.55 115.89 2hky h SER 8 Ca 0.02 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2hky h SER 8 Cb 0.71 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 2hky h SER 8 CO -0.34 0.55 -0.12 1.56 -1.14 0.00 0.00 176.83 177.34 2hky h GLN 9 N 0.94 -0.15 -0.79 3.45 1.08 -1.28 0.28 115.11 118.64 2hky h GLN 9 Ca 0.32 0.01 0.12 0.00 -1.45 0.00 0.00 58.65 57.65 2hky h GLN 9 Cb 0.09 0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 27.50 2hky h GLN 9 CO -0.10 -0.10 0.52 2.35 -0.95 0.00 0.00 178.83 180.55 2hky h TRP 10 N -0.16 0.69 0.00 2.96 -0.00 -0.40 0.19 115.95 119.24 2hky h TRP 10 Ca 0.08 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 58.99 2hky h TRP 10 Cb 0.27 -0.22 0.00 0.00 -0.00 0.00 0.00 29.16 29.21 2hky h TRP 10 CO -0.23 0.29 0.00 1.19 -0.00 0.00 0.00 178.44 179.70 2hky n PHE 11 N -4.51 0.51 0.09 2.65 3.01 0.10 -2.19 117.46 117.12 2hky n PHE 11 Ca 0.14 0.15 0.05 0.00 1.01 0.00 0.00 57.45 58.80 2hky n PHE 11 Cb 0.41 -0.74 -0.01 0.00 -0.01 0.00 0.00 39.48 39.13 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 0.26 0.39 116.57 121.23 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 0.63 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.96 2hky h LYS 12 CO 0.00 0.22 -0.59 -0.84 -2.09 0.00 0.00 179.45 176.15 2hky h ILE 13 N 0.00 0.00 0.00 0.07 3.07 -1.31 0.17 117.51 119.50 2hky h ILE 13 Ca -0.07 -0.93 0.00 0.00 1.55 0.00 0.00 64.86 65.42 2hky h ILE 13 Cb 1.31 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 39.48 2hky h ILE 13 CO 0.03 0.00 -1.21 1.67 -1.05 0.00 0.00 178.15 177.59 2hky n GLN 14 N -2.74 0.35 -0.67 0.16 7.27 -0.93 -4.65 117.38 116.17 2hky n GLN 14 Ca 0.02 -0.05 -0.01 0.00 0.07 0.00 0.00 57.00 57.04 2hky n GLN 14 Cb 0.53 -1.47 -0.01 0.00 2.41 0.00 0.00 30.24 31.70 2hky n GLN 14 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2hky n HIS 15 N -1.67 0.00 -3.58 3.69 8.25 0.14 -4.67 115.22 117.38 2hky n HIS 15 Ca 0.02 -0.12 -0.37 0.00 -0.26 0.00 0.00 57.72 56.99 2hky n HIS 15 Cb 0.38 0.14 -0.09 0.00 1.12 0.00 0.00 29.99 31.54 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 4.10 -0.01 -0.41 0.23 0.59 -1.40 119.30 122.40 2hky s MET 16 Ca 0.04 -0.13 0.18 0.00 -1.03 0.00 0.00 55.69 54.75 2hky s MET 16 Cb 0.04 -3.54 -0.22 0.00 -1.53 0.00 0.00 34.83 29.59 2hky s MET 16 CO -0.02 0.04 0.69 0.94 -2.03 0.00 0.00 175.02 174.64 2hky n GLN 17 N 4.32 0.90 0.00 3.16 0.00 0.42 -4.12 117.38 122.07 2hky n GLN 17 Ca -0.13 -0.04 0.00 0.00 -0.00 0.00 0.00 57.00 56.83 2hky n GLN 17 Cb 0.52 -1.38 0.00 0.00 0.00 0.00 0.00 30.24 29.38 2hky n GLN 17 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 2hky n PRO 18 N -1.58 0.00 0.00 3.69 -0.02 -1.25 -4.06 135.00 131.77 2hky n PRO 18 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2hky n PRO 18 Cb 0.33 -1.06 0.00 0.00 -0.02 0.00 0.00 33.50 32.75 2hky n PRO 18 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2hky n SER 19 N 0.69 0.00 0.15 2.55 7.64 -1.26 -5.03 113.62 118.36 2hky n SER 19 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 2hky n SER 19 Cb 0.00 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.30 2hky n SER 19 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2hky h PRO 20 N 0.00 0.00 0.00 1.43 0.13 -1.72 -3.48 132.00 128.37 2hky h PRO 20 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2hky h PRO 20 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2hky h PRO 20 CO 0.00 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 178.81 2hky n GLN 21 N -2.80 0.00 -0.35 0.86 1.13 -1.26 -4.44 117.38 110.52 2hky n GLN 21 Ca 0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 2hky n GLN 21 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.88 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 -2.82 -0.12 -1.58 0.00 -1.26 -3.62 120.51 111.10 2hky n ALA 22 Ca 0.00 0.09 0.25 0.00 0.00 0.00 0.00 53.44 53.78 2hky n ALA 22 Cb 0.00 -0.68 0.69 0.00 0.00 0.00 0.00 19.45 19.47 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 0.04 -0.66 0.43 0.00 2.35 -1.81 0.57 115.58 116.49 2hky h ASN 24 Ca 0.37 0.15 -0.31 0.00 -0.55 0.00 0.00 56.30 55.96 2hky h ASN 24 Cb 1.43 0.36 0.02 0.00 0.05 0.00 0.00 38.32 40.17 2hky h ASN 24 CO -0.02 -0.23 -1.43 -1.28 -1.65 0.00 0.00 177.43 172.83 2hky h SER 25 N -0.12 0.59 -0.99 5.81 0.87 -0.61 -2.25 113.55 116.86 2hky h SER 25 Ca 0.19 -0.68 0.08 0.00 -1.23 0.00 0.00 61.79 60.16 2hky h SER 25 Cb 0.42 -0.19 -0.07 0.00 -0.44 0.00 0.00 62.40 62.12 2hky h SER 25 CO -0.47 1.54 0.63 0.00 -0.53 0.00 0.00 176.83 178.00 2hky h ALA 26 N 0.37 1.46 0.00 6.23 0.00 -0.20 0.13 119.26 127.26 2hky h ALA 26 Ca -0.22 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 2hky h ALA 26 Cb 2.06 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.56 2hky h ALA 26 CO 0.22 0.36 -0.79 1.98 0.00 0.00 0.00 179.25 181.03 2hky h MET 27 N 1.10 0.00 -0.30 0.00 -1.53 0.09 -3.10 114.93 111.18 2hky h MET 27 Ca 0.44 0.00 0.07 0.00 -3.44 0.00 0.00 59.70 56.77 2hky h MET 27 Cb 0.27 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.30 2hky h MET 27 CO -0.19 0.79 0.21 0.87 0.14 0.00 0.00 176.91 178.72 2hky h LYS 28 N 0.00 0.11 -0.20 0.39 1.79 -0.11 0.40 116.57 118.95 2hky h LYS 28 Ca -0.01 -0.01 -0.10 0.00 -2.18 0.00 0.00 60.65 58.36 2hky h LYS 28 Cb 1.46 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 32.07 2hky h LYS 28 CO 0.10 0.07 -0.30 -0.97 -1.08 0.00 0.00 179.45 177.27 2hky h ASN 29 N 0.11 0.40 0.74 0.86 -0.73 -1.39 -1.98 115.58 113.60 2hky h ASN 29 Ca 0.14 -0.14 -0.17 0.00 1.87 0.00 0.00 56.30 58.00 2hky h ASN 29 Cb 0.41 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 38.87 2hky h ASN 29 CO -0.02 0.69 -0.79 0.40 -0.37 0.00 0.00 177.43 177.35 2hky h ILE 30 N 0.34 1.55 0.00 2.57 2.04 -1.09 -2.81 117.51 120.11 2hky h ILE 30 Ca 0.05 -2.64 0.00 0.00 1.00 0.00 0.00 64.86 63.26 2hky h ILE 30 Cb 0.70 2.43 0.00 0.00 -0.74 0.00 0.00 36.82 39.22 2hky h ILE 30 CO 0.05 0.76 0.00 0.78 0.00 0.00 0.00 178.15 179.74 2hky h ASN 31 N 0.02 0.00 0.39 1.72 4.21 -0.87 0.53 115.58 121.57 2hky h ASN 31 Ca -0.01 0.00 -0.32 0.00 1.21 0.00 0.00 56.30 57.18 2hky h ASN 31 Cb 1.39 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.57 2hky h ASN 31 CO 0.11 0.00 -1.66 0.07 -1.29 0.00 0.00 177.43 174.66 2hky h LYS 32 N 0.00 0.22 0.00 0.81 5.09 -1.12 -2.36 116.57 119.21 2hky h LYS 32 Ca 0.00 -0.37 -0.15 0.00 0.09 0.00 0.00 60.65 60.22 2hky h LYS 32 Cb 0.64 0.14 -0.03 0.00 0.10 0.00 0.00 32.23 33.09 2hky h LYS 32 CO 0.00 1.05 -1.27 1.12 -2.09 0.00 0.00 179.45 178.25 2hky h HIS 33 N 0.06 0.00 -0.00 0.07 2.07 -1.42 -3.33 115.15 112.60 2hky h HIS 33 Ca -0.29 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.23 2hky h HIS 33 Cb 2.02 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.00 2hky h HIS 33 CO 0.06 0.53 -0.73 0.25 -3.07 0.00 0.00 177.93 174.97 2hky n THR 34 N -2.92 0.00 -2.05 6.12 -2.24 0.17 -4.93 114.28 108.44 2hky n THR 34 Ca -0.08 -0.02 -0.19 0.00 -2.27 0.00 0.00 64.05 61.49 2hky n THR 34 Cb 0.81 0.68 -0.04 0.00 -2.10 0.00 0.00 70.33 69.68 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 -1.37 -1.64 -3.54 -0.78 4.76 -0.89 -4.91 118.16 109.79 2hky n LYS 35 Ca 0.05 1.00 -0.14 0.00 -2.87 0.00 0.00 58.31 56.35 2hky n LYS 35 Cb 0.34 -5.53 -0.05 0.00 -1.84 0.00 0.00 35.03 27.95 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 -4.43 0.86 -0.87 1.97 6.06 -1.20 -5.01 118.95 116.33 2hky s ARG 36 Ca 0.00 0.15 -0.18 0.00 -2.50 0.00 0.00 55.73 53.20 2hky s ARG 36 Cb 0.00 0.41 0.14 0.00 0.06 0.00 0.00 34.95 35.56 2hky s ARG 36 CO 0.00 -0.28 1.02 0.00 -2.50 0.00 0.00 175.30 173.54 2hky n LYS 38 N 6.14 0.01 0.00 0.00 4.76 -1.26 -4.61 118.16 123.20 2hky n LYS 38 Ca 0.18 0.44 0.00 0.00 -2.87 0.00 0.00 58.31 56.06 2hky n LYS 38 Cb 0.48 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 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 -1.73 0.00 -3.78 4.39 2.03 -1.26 -4.93 116.55 111.28 2hky n ASP 39 Ca 0.05 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.23 2hky n ASP 39 Cb 0.55 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.84 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 0.96 -0.22 -2.67 1.98 -1.26 -0.26 118.68 117.21 2hky s LEU 40 Ca 0.00 0.50 -0.10 0.00 -2.89 0.00 0.00 54.13 51.64 2hky s LEU 40 Cb 0.00 0.96 0.08 0.00 0.66 0.00 0.00 46.19 47.89 2hky s LEU 40 CO 0.00 -0.13 0.52 0.20 -1.89 0.00 0.00 176.35 175.05 2hky s ASN 41 N -0.00 -0.65 0.13 3.68 -0.87 -0.97 -4.97 114.94 111.29 2hky s ASN 41 Ca -0.01 1.18 0.03 0.00 -1.57 0.00 0.00 52.86 52.49 2hky s ASN 41 Cb -0.02 1.32 -0.04 0.00 -0.02 0.00 0.00 41.25 42.49 2hky s ASN 41 CO 0.01 -0.22 0.17 0.42 -2.57 0.00 0.00 177.10 174.90 2hky s THR 42 N 2.03 4.81 0.05 1.60 -4.23 -1.26 -1.29 115.64 117.35 2hky s THR 42 Ca -0.07 -0.82 0.01 0.00 -1.18 0.00 0.00 61.69 59.63 2hky s THR 42 Cb -0.09 -3.42 -0.03 0.00 1.34 0.00 0.00 72.50 70.30 2hky s THR 42 CO -0.15 -0.02 -0.06 -0.36 -0.54 0.00 0.00 174.62 173.49 2hky s PHE 43 N -1.63 0.62 0.14 3.99 0.40 0.73 -4.38 117.98 117.85 2hky s PHE 43 Ca 0.32 -0.69 0.08 0.00 -0.60 0.00 0.00 56.93 56.04 2hky s PHE 43 Cb -0.11 -0.39 -0.04 0.00 0.51 0.00 0.00 43.02 42.99 2hky s PHE 43 CO 0.25 -0.16 -0.08 -0.51 0.70 0.00 0.00 175.22 175.42 2hky s LEU 44 N -2.10 3.07 -0.86 -0.37 1.43 -0.49 0.27 118.68 119.63 2hky s LEU 44 Ca -0.03 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 2hky s LEU 44 Cb -0.04 -1.80 0.29 0.00 0.03 0.00 0.00 46.19 44.67 2hky s LEU 44 CO -0.03 0.14 1.17 1.57 0.23 0.00 0.00 176.35 179.43 2hky n HIS 45 N 0.33 2.98 -3.70 0.29 -0.00 -0.77 -0.43 115.22 113.92 2hky n HIS 45 Ca -0.12 -3.32 -0.11 0.00 0.46 0.00 0.00 57.72 54.63 2hky n HIS 45 Cb 0.54 -0.91 -0.11 0.00 -0.12 0.00 0.00 29.99 29.39 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 -2.83 0.37 0.01 1.57 2.56 -1.26 -4.63 118.70 114.49 2hky s GLU 46 Ca 0.36 0.74 -0.36 0.00 0.00 0.00 0.00 54.97 55.71 2hky s GLU 46 Cb 0.12 -0.03 -0.15 0.00 2.00 0.00 0.00 34.13 36.07 2hky s GLU 46 CO 0.03 -0.15 1.54 -2.30 -0.56 0.00 0.00 175.26 173.81 2hky n PRO 47 N 4.19 1.50 0.30 4.30 -0.02 -1.26 -4.43 135.00 139.58 2hky n PRO 47 Ca -0.23 0.55 0.02 0.00 -2.02 0.00 0.00 63.50 61.81 2hky n PRO 47 Cb 0.55 -2.25 0.09 0.00 -0.02 0.00 0.00 33.50 31.87 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 5.92 0.00 -0.05 6.00 0.04 -1.99 2.04 116.94 128.91 2hky h PHE 48 Ca -0.47 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.07 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 -0.91 0.77 -0.60 0.00 0.00 178.31 178.24 2hky h SER 49 N 0.00 0.77 0.13 2.17 0.02 -1.97 0.47 113.55 115.13 2hky h SER 49 Ca 0.00 -0.57 -0.25 0.00 -0.84 0.00 0.00 61.79 60.13 2hky h SER 49 Cb 1.75 -0.23 0.01 0.00 0.14 0.00 0.00 62.40 64.06 2hky h SER 49 CO 0.00 1.37 -1.20 0.28 -1.14 0.00 0.00 176.83 176.13 2hky h SER 50 N 0.38 0.42 -0.31 3.07 0.02 0.29 -2.85 113.55 114.57 2hky h SER 50 Ca -0.08 -0.89 -0.01 0.00 -0.84 0.00 0.00 61.79 59.97 2hky h SER 50 Cb 1.54 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.93 2hky h SER 50 CO 0.17 1.54 0.16 0.58 -1.14 0.00 0.00 176.83 178.14 2hky h VAL 51 N -0.33 1.13 -0.24 2.27 2.07 -1.17 0.20 116.25 120.18 2hky h VAL 51 Ca -0.25 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 66.92 2hky h VAL 51 Cb 1.72 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 2hky h VAL 51 CO 0.09 0.15 0.01 0.00 0.02 0.00 0.00 177.57 177.84 2hky h ALA 52 N 1.68 0.21 -0.06 1.67 0.00 -0.07 -0.20 119.26 122.50 2hky h ALA 52 Ca 0.13 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 2hky h ALA 52 Cb 0.08 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2hky h ALA 52 CO -0.02 -0.42 -0.36 0.00 0.00 0.00 0.00 179.25 178.46 2hky h ALA 53 N 1.20 1.28 -0.71 0.00 0.00 -0.84 -2.55 119.26 117.64 2hky h ALA 53 Ca 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2hky h ALA 53 Cb 0.14 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2hky h ALA 53 CO -0.18 0.51 0.46 1.15 0.00 0.00 0.00 179.25 181.18 2hky h THR 54 N 0.11 1.19 0.00 0.00 2.02 0.11 0.12 112.91 116.45 2hky h THR 54 Ca 0.01 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.84 2hky h THR 54 Cb 0.69 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2hky h THR 54 CO 0.05 0.18 0.00 0.00 0.37 0.00 0.00 175.52 176.12 2hky n GLN 56 N 0.32 1.43 -1.20 0.00 7.27 0.43 -4.75 117.38 120.89 2hky n GLN 56 Ca 0.00 -0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.75 2hky n GLN 56 Cb 0.33 -0.91 0.10 0.00 2.41 0.00 0.00 30.24 32.18 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 -1.82 3.03 -0.48 1.69 -1.32 -1.08 -4.74 115.64 110.92 2hky s THR 57 Ca -0.00 0.35 -0.30 0.00 -1.21 0.00 0.00 61.69 60.54 2hky s THR 57 Cb 0.00 -2.75 -0.15 0.00 -1.51 0.00 0.00 72.50 68.09 2hky s THR 57 CO 0.02 -0.42 1.71 -2.65 -2.21 0.00 0.00 174.62 171.06 2hky n PRO 58 N -3.54 0.00 0.00 7.08 -0.02 -1.26 -4.75 135.00 132.51 2hky n PRO 58 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2hky n PRO 58 Cb 0.53 -1.11 0.00 0.00 -0.02 0.00 0.00 33.50 32.90 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 5.77 1.12 -3.77 -0.52 -0.00 -1.25 -4.61 118.16 114.90 2hky n LYS 59 Ca 0.43 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.64 2hky n LYS 59 Cb -0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 34.96 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 0.00 0.08 -0.92 0.58 -4.36 -0.61 -4.91 121.20 111.06 2hky s ILE 60 Ca 0.00 -0.90 -0.27 0.00 -0.26 0.00 0.00 60.65 59.21 2hky s ILE 60 Cb 0.00 -1.42 -0.25 0.00 1.25 0.00 0.00 42.46 42.04 2hky s ILE 60 CO 0.00 -0.35 2.02 0.00 0.24 0.00 0.00 174.94 176.85 2hky n ALA 61 N -0.21 0.45 -0.97 2.27 0.00 -1.26 -2.62 120.51 118.17 2hky n ALA 61 Ca -0.13 -2.38 0.00 0.00 0.00 0.00 0.00 53.44 50.93 2hky n ALA 61 Cb 0.63 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.65 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 0.00 -0.02 0.00 0.00 1.57 -1.95 -3.44 116.57 112.73 2hky h LYS 63 Ca 0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 2hky h LYS 63 Cb 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.22 2hky h LYS 63 CO 0.00 -0.01 -0.35 -1.71 -0.57 0.00 0.00 179.45 176.81 2hky n ASN 64 N -2.10 -0.08 0.00 0.86 4.05 -1.25 -4.90 115.26 111.84 2hky n ASN 64 Ca -0.00 -1.63 0.00 0.00 0.45 0.00 0.00 54.58 53.40 2hky n ASN 64 Cb 0.01 -0.03 0.00 0.00 1.23 0.00 0.00 39.78 40.99 2hky n ASN 64 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2hky n GLY 65 N 0.08 -0.42 0.26 8.20 0.00 -1.26 -4.98 105.19 107.07 2hky n GLY 65 Ca -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 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 0.79 -3.69 1.61 5.19 -1.82 -3.46 116.42 115.05 2hky h ASP 66 Ca 0.00 -0.17 -0.18 0.00 -0.62 0.00 0.00 57.03 56.06 2hky h ASP 66 Cb 0.00 -0.20 0.08 0.00 0.18 0.00 0.00 39.33 39.39 2hky h ASP 66 CO 0.00 0.74 -0.37 0.29 -3.12 0.00 0.00 179.24 176.78 2hky n LYS 67 N -4.49 -3.61 -0.00 3.56 5.02 -1.08 -4.85 118.16 112.71 2hky n LYS 67 Ca 0.03 0.42 0.01 0.00 -2.02 0.00 0.00 58.31 56.75 2hky n LYS 67 Cb 0.16 -4.20 0.01 0.00 -0.02 0.00 0.00 35.03 30.98 2hky n LYS 67 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2hky n ASN 68 N -1.57 1.17 -4.50 4.39 4.05 -1.25 -4.75 115.26 112.80 2hky n ASN 68 Ca -0.09 -1.11 -0.29 0.00 0.45 0.00 0.00 54.58 53.54 2hky n ASN 68 Cb 0.56 -0.00 -0.11 0.00 1.23 0.00 0.00 39.78 41.46 2hky n ASN 68 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2hky s HIS 70 N -1.21 -0.38 0.00 0.00 3.76 -1.05 -1.57 115.29 114.84 2hky s HIS 70 Ca 0.19 0.89 -0.04 0.00 -0.15 0.00 0.00 55.06 55.95 2hky s HIS 70 Cb -0.10 0.14 -0.04 0.00 1.11 0.00 0.00 32.58 33.68 2hky s HIS 70 CO 0.11 -0.25 0.22 1.14 -0.85 0.00 0.00 174.74 175.11 2hky s GLN 71 N -0.12 3.49 0.00 1.40 -2.07 -1.25 -2.04 119.66 119.08 2hky s GLN 71 Ca -0.03 -0.22 0.00 0.00 -1.82 0.00 0.00 55.36 53.29 2hky s GLN 71 Cb -0.03 -3.08 0.00 0.00 -1.09 0.00 0.00 33.01 28.81 2hky s GLN 71 CO 0.01 0.66 0.14 -1.13 -1.32 0.00 0.00 175.29 173.65 2hky n SER 72 N 0.99 0.00 -1.23 12.60 3.41 -0.87 -4.63 113.62 123.88 2hky n SER 72 Ca -0.11 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.44 2hky n SER 72 Cb 0.53 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 2hky n SER 72 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2hky n HIS 73 N -0.54 -0.74 -3.60 7.33 8.25 -1.26 -4.75 115.22 119.91 2hky n HIS 73 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 2hky n HIS 73 Cb 0.00 -1.75 -0.02 0.00 1.12 0.00 0.00 29.99 29.34 2hky n HIS 73 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2hky s GLY 74 N -1.55 -0.31 -0.12 -1.41 0.00 -1.26 -5.09 107.32 97.59 2hky s GLY 74 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 44.72 45.91 2hky s GLY 74 CO 0.00 0.48 1.55 2.56 0.00 0.00 0.00 173.10 177.69 2hky s PRO 75 N -2.42 4.10 -0.08 2.90 0.04 -1.26 -3.31 135.00 134.96 2hky s PRO 75 Ca 0.10 1.93 -0.01 0.00 0.04 0.00 0.00 61.00 63.05 2hky s PRO 75 Cb -0.00 -3.94 -0.03 0.00 0.04 0.00 0.00 34.50 30.56 2hky s PRO 75 CO -0.04 -0.93 -0.02 0.54 0.04 0.00 0.00 177.00 176.59 2hky s VAL 76 N 4.20 4.15 -0.99 -0.36 0.11 -0.77 -4.69 120.40 122.06 2hky s VAL 76 Ca 0.68 -0.31 -0.25 0.00 -2.93 0.00 0.00 61.98 59.17 2hky s VAL 76 Cb -0.28 -2.74 -0.15 0.00 -1.53 0.00 0.00 36.38 31.68 2hky s VAL 76 CO 0.26 0.60 2.15 -0.44 -3.33 0.00 0.00 175.10 174.34 2hky s SER 77 N -0.85 4.08 0.75 3.54 0.01 -1.26 -2.34 113.70 117.63 2hky s SER 77 Ca 0.13 -0.74 -0.01 0.00 1.31 0.00 0.00 55.95 56.64 2hky s SER 77 Cb -0.11 -2.58 0.15 0.00 0.21 0.00 0.00 66.02 63.69 2hky s SER 77 CO 0.02 -3.92 1.00 0.00 0.41 0.00 0.00 173.24 170.75 2hky n LEU 78 N 17.67 0.00 -3.54 2.44 -0.00 0.15 -1.85 117.00 131.87 2hky n LEU 78 Ca 0.43 -2.07 -0.22 0.00 -0.00 0.00 0.00 56.01 54.15 2hky n LEU 78 Cb 0.46 -0.65 -0.15 0.00 -0.00 0.00 0.00 43.42 43.08 2hky n LEU 78 CO 0.59 -1.00 -0.26 -0.89 -0.00 0.00 0.00 177.39 175.83 2hky s THR 79 N -3.09 -0.21 -0.48 1.47 2.01 0.14 -0.63 115.64 114.85 2hky s THR 79 Ca 0.66 -0.21 -0.22 0.00 0.31 0.00 0.00 61.69 62.23 2hky s THR 79 Cb -0.04 -0.68 0.03 0.00 0.01 0.00 0.00 72.50 71.83 2hky s THR 79 CO 0.44 -0.29 0.76 -0.04 -0.69 0.00 0.00 174.62 174.79 2hky s MET 80 N 2.24 3.31 0.11 4.92 -1.94 0.80 -0.19 119.30 128.54 2hky s MET 80 Ca 0.05 -0.34 -0.08 0.00 -1.71 0.00 0.00 55.69 53.61 2hky s MET 80 Cb -0.16 -3.99 -0.06 0.00 2.01 0.00 0.00 34.83 32.63 2hky s MET 80 CO -0.14 -1.19 0.41 0.00 -0.01 0.00 0.00 175.02 174.09 2hky s LYS 82 N -2.20 0.86 -0.44 0.00 -2.85 -1.05 -2.29 119.74 111.78 2hky s LYS 82 Ca 0.36 -1.14 -0.29 0.00 -1.00 0.00 0.00 55.97 53.91 2hky s LYS 82 Cb -0.13 -0.61 0.01 0.00 -2.06 0.00 0.00 37.83 35.04 2hky s LYS 82 CO 0.20 0.10 1.41 -1.17 0.10 0.00 0.00 175.35 175.99 2hky s LEU 83 N -2.35 3.55 0.04 2.77 2.96 0.65 -2.35 118.68 123.95 2hky s LEU 83 Ca 0.05 0.73 -0.22 0.00 -0.22 0.00 0.00 54.13 54.47 2hky s LEU 83 Cb -0.04 -3.46 -0.15 0.00 0.50 0.00 0.00 46.19 43.04 2hky s LEU 83 CO 0.01 -1.48 1.40 0.71 -1.32 0.00 0.00 176.35 175.67 2hky h THR 84 N 6.46 1.31 0.00 3.68 1.35 -1.18 -3.49 112.91 121.04 2hky h THR 84 Ca -0.27 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 2hky h THR 84 Cb 1.10 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.28 2hky h THR 84 CO 1.10 0.30 0.00 -1.20 -0.25 0.00 0.00 175.52 175.47 2hky n SER 85 N -4.71 0.00 0.00 5.36 7.64 -1.13 -5.00 113.62 115.78 2hky n SER 85 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 2hky n SER 85 Cb 0.27 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.47 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 -1.05 3.19 0.00 0.23 0.00 -1.25 -1.97 105.19 104.34 2hky n GLY 86 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.03 1.61 5.02 -1.25 -4.46 118.16 119.05 2hky n LYS 87 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 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 0.98 -0.52 0.00 0.00 177.40 177.86 2hky n TYR 88 N 3.08 1.19 1.58 2.13 9.36 -1.26 -2.93 117.16 130.31 2hky n TYR 88 Ca 0.00 0.31 0.14 0.00 3.32 0.00 0.00 57.90 61.68 2hky n TYR 88 Cb 0.00 -1.15 0.63 0.00 -0.63 0.00 0.00 39.34 38.19 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 -3.76 1.23 -2.26 2.98 -0.04 -1.26 -4.05 135.00 127.85 2hky n PRO 89 Ca -0.32 -0.54 0.01 0.00 -0.04 0.00 0.00 63.50 62.60 2hky n PRO 89 Cb 0.94 -1.49 0.04 0.00 -0.04 0.00 0.00 33.50 32.95 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 -0.41 0.87 -4.70 3.54 5.15 -1.26 -5.09 115.26 113.37 2hky n ASN 90 Ca 0.19 -2.03 -0.42 0.00 -0.60 0.00 0.00 54.58 51.71 2hky n ASN 90 Cb 0.28 -0.24 -0.03 0.00 -0.53 0.00 0.00 39.78 39.26 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 1.52 3.22 0.32 0.00 1.70 -0.83 -4.93 118.95 119.94 2hky s ARG 92 Ca 0.47 -0.66 0.08 0.00 -0.47 0.00 0.00 55.73 55.15 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 0.32 0.14 0.71 -1.08 0.00 0.00 175.30 175.60 2hky s TYR 93 N 0.08 2.78 -0.05 5.89 1.51 -1.26 -0.62 117.35 125.66 2hky s TYR 93 Ca -0.05 -0.31 0.06 0.00 -1.01 0.00 0.00 57.07 55.76 2hky s TYR 93 Cb -0.14 -1.56 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 2hky s TYR 93 CO 0.04 0.38 -0.25 0.15 -1.11 0.00 0.00 175.55 174.77 2hky s LYS 94 N -3.84 2.51 -0.18 -0.62 -0.14 -0.99 -3.96 119.74 112.52 2hky s LYS 94 Ca 0.37 -0.90 -0.18 0.00 -1.36 0.00 0.00 55.97 53.90 2hky s LYS 94 Cb -0.04 -2.16 -0.03 0.00 -1.68 0.00 0.00 37.83 33.91 2hky s LYS 94 CO 0.23 0.41 0.50 -1.83 -0.76 0.00 0.00 175.35 173.90 2hky s GLU 95 N -0.23 4.22 -0.35 1.68 -1.05 -1.26 -2.54 118.70 119.17 2hky s GLU 95 Ca -0.01 0.41 -0.06 0.00 -0.15 0.00 0.00 54.97 55.16 2hky s GLU 95 Cb -0.13 -3.53 0.06 0.00 -0.44 0.00 0.00 34.13 30.08 2hky s GLU 95 CO 0.03 -0.08 0.12 0.21 0.95 0.00 0.00 175.26 176.49 2hky s LYS 96 N 1.40 2.51 -0.43 -4.83 2.20 -0.86 -4.96 119.74 114.77 2hky s LYS 96 Ca 0.24 -1.31 -0.29 0.00 -0.36 0.00 0.00 55.97 54.26 2hky s LYS 96 Cb -0.15 -3.47 0.01 0.00 -1.51 0.00 0.00 37.83 32.71 2hky s LYS 96 CO 0.10 -0.75 1.38 0.50 -0.36 0.00 0.00 175.35 176.22 2hky s ARG 97 N 1.35 3.57 0.38 4.03 3.52 -1.26 -0.14 118.95 130.41 2hky s ARG 97 Ca -0.00 0.87 0.08 0.00 -0.13 0.00 0.00 55.73 56.54 2hky s ARG 97 Cb -0.20 -4.02 -0.07 0.00 -1.56 0.00 0.00 34.95 29.10 2hky s ARG 97 CO 0.01 -1.57 0.00 -1.14 -0.81 0.00 0.00 175.30 171.79 2hky s GLN 98 N 4.92 1.97 -0.23 5.12 2.00 0.20 -4.96 119.66 128.68 2hky s GLN 98 Ca 0.59 -1.98 -0.01 0.00 -2.00 0.00 0.00 55.36 51.96 2hky s GLN 98 Cb -0.13 -1.74 0.06 0.00 0.80 0.00 0.00 33.01 32.01 2hky s GLN 98 CO 0.32 0.02 -0.00 -0.80 -0.50 0.00 0.00 175.29 174.33 2hky s ASN 99 N -3.71 3.52 0.07 6.67 0.01 -1.26 0.29 114.94 120.54 2hky s ASN 99 Ca 0.35 -1.10 -0.23 0.00 -0.71 0.00 0.00 52.86 51.17 2hky s ASN 99 Cb 0.06 -0.93 0.06 0.00 0.41 0.00 0.00 41.25 40.84 2hky s ASN 99 CO 0.18 -0.28 0.55 -0.54 -1.51 0.00 0.00 177.10 175.50 2hky s LYS 100 N 1.58 1.11 -0.31 -0.60 1.02 -0.99 -4.73 119.74 116.83 2hky s LYS 100 Ca -0.02 -0.28 -0.27 0.00 0.02 0.00 0.00 55.97 55.42 2hky s LYS 100 Cb -0.18 0.51 0.01 0.00 -0.52 0.00 0.00 37.83 37.65 2hky s LYS 100 CO -0.09 -0.42 0.95 0.45 -0.92 0.00 0.00 175.35 175.32 2hky s SER 101 N -2.17 6.83 0.15 2.83 0.15 0.27 -1.85 113.70 119.91 2hky s SER 101 Ca -0.03 0.91 0.02 0.00 0.70 0.00 0.00 55.95 57.55 2hky s SER 101 Cb -0.00 -2.49 0.02 0.00 -1.71 0.00 0.00 66.02 61.84 2hky s SER 101 CO -0.04 -0.76 0.19 0.00 1.20 0.00 0.00 173.24 173.83 2hky n TYR 102 N 6.55 -2.55 -3.77 3.44 0.18 -1.26 0.08 117.16 119.84 2hky n TYR 102 Ca 0.09 -0.55 -0.26 0.00 1.88 0.00 0.00 57.90 59.05 2hky n TYR 102 Cb 0.47 -0.14 -0.17 0.00 -0.38 0.00 0.00 39.34 39.13 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 -0.06 0.56 0.03 -3.48 1.01 0.10 -2.06 120.40 116.51 2hky s VAL 103 Ca 0.14 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 61.79 2hky s VAL 103 Cb -0.01 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 2hky s VAL 103 CO 0.09 -0.03 -0.07 0.54 0.00 0.00 0.00 175.10 175.63 2hky s VAL 104 N 1.86 3.61 0.49 2.92 0.11 -0.86 0.34 120.40 128.86 2hky s VAL 104 Ca 0.01 -0.91 0.01 0.00 -2.93 0.00 0.00 61.98 58.16 2hky s VAL 104 Cb -0.15 -2.61 0.01 0.00 -1.53 0.00 0.00 36.38 32.10 2hky s VAL 104 CO -0.07 0.30 0.71 0.00 -3.33 0.00 0.00 175.10 172.71 2hky s ALA 105 N -1.07 3.82 0.21 1.54 0.00 0.11 -2.53 121.76 123.83 2hky s ALA 105 Ca 0.19 -1.17 0.09 0.00 0.00 0.00 0.00 51.96 51.07 2hky s ALA 105 Cb -0.11 -2.11 -0.05 0.00 0.00 0.00 0.00 23.12 20.85 2hky s ALA 105 CO 0.10 -0.52 -0.16 0.00 0.00 0.00 0.00 175.76 175.18 2hky s LYS 107 N -3.42 0.86 0.17 0.00 -0.14 -0.80 -4.85 119.74 111.56 2hky s LYS 107 Ca 0.22 -0.99 -0.30 0.00 -1.36 0.00 0.00 55.97 53.54 2hky s LYS 107 Cb -0.03 0.34 -0.08 0.00 -1.68 0.00 0.00 37.83 36.38 2hky s LYS 107 CO 0.08 -0.27 1.20 -1.25 -0.76 0.00 0.00 175.35 174.35 2hky s PRO 108 N -3.87 4.48 -0.62 -1.68 0.04 -1.26 -0.38 135.00 131.71 2hky s PRO 108 Ca 0.06 1.87 -0.33 0.00 0.04 0.00 0.00 61.00 62.64 2hky s PRO 108 Cb 0.05 -3.25 -0.15 0.00 0.04 0.00 0.00 34.50 31.19 2hky s PRO 108 CO -0.10 -0.11 2.41 -2.30 0.04 0.00 0.00 177.00 176.93 2hky n PRO 109 N 2.68 0.56 0.00 0.56 -0.02 -1.26 -4.87 135.00 132.64 2hky n PRO 109 Ca 0.05 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2hky n PRO 109 Cb 0.45 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 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 8.39 0.00 0.00 -0.52 1.13 -1.26 -4.67 117.38 120.45 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 0.20 -0.21 0.00 0.00 0.11 0.00 0.00 30.24 30.33 2hky n GLN 110 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2hky n LYS 111 N 0.00 3.82 0.09 -1.09 4.76 -1.26 -4.79 118.16 119.69 2hky n LYS 111 Ca 0.00 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.21 2hky n LYS 111 Cb 0.00 -0.47 -0.15 0.00 -1.84 0.00 0.00 35.03 32.57 2hky n LYS 111 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2hky h LYS 112 N 0.00 0.42 -4.08 1.97 1.79 -1.96 -3.49 116.57 111.21 2hky h LYS 112 Ca 0.00 -0.72 0.00 0.00 -2.18 0.00 0.00 60.65 57.75 2hky h LYS 112 Cb 0.00 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2hky h LYS 112 CO 0.00 1.34 -0.18 -0.40 -1.08 0.00 0.00 179.45 179.14 2hky n ASP 113 N -3.71 -4.72 -0.20 0.86 5.75 -1.26 -4.61 116.55 108.66 2hky n ASP 113 Ca -0.22 0.52 0.30 0.00 -0.01 0.00 0.00 54.79 55.38 2hky n ASP 113 Cb 1.05 -0.99 0.72 0.00 -1.03 0.00 0.00 41.12 40.87 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 3.61 0.00 0.00 -1.12 0.02 -1.97 -3.38 113.55 110.71 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 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 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 -4.08 0.00 0.00 3.45 6.02 -1.26 -5.05 117.38 116.46 2hky n GLN 115 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 2hky n GLN 115 Cb 1.06 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.32 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 -2.85 0.00 0.00 -1.09 10.64 -1.26 -5.06 117.38 117.76 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 -4.85 115.22 110.49 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 -3.54 0.27 -0.00 -1.14 -4.61 117.00 107.98 2hky n LEU 119 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 56.01 55.69 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 -0.79 1.33 -0.00 0.00 0.00 177.39 177.93 2hky n VAL 120 N 0.00 0.00 -2.40 1.47 0.24 0.49 -3.87 118.33 114.26 2hky n VAL 120 Ca 0.00 -0.43 -0.39 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 -1.20 3.15 0.00 7.34 0.04 -1.26 -1.91 135.00 141.15 2hky s PRO 121 Ca 0.43 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.05 2hky s PRO 121 Cb -0.31 -4.74 0.00 0.00 0.04 0.00 0.00 34.50 29.48 2hky s PRO 121 CO 0.62 -2.43 0.00 1.55 0.04 0.00 0.00 177.00 176.78 2hky n VAL 122 N 6.89 0.00 -2.59 -0.36 3.14 -0.80 -4.36 118.33 120.26 2hky n VAL 122 Ca 0.21 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.37 2hky n VAL 122 Cb 0.50 -0.62 0.06 0.00 -1.06 0.00 0.00 33.84 32.71 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 2.52 -0.27 1.45 2.46 -1.21 -4.61 115.29 115.63 2hky s HIS 123 Ca 0.00 -0.04 0.02 0.00 0.47 0.00 0.00 55.06 55.51 2hky s HIS 123 Cb 0.00 -2.85 0.06 0.00 -0.13 0.00 0.00 32.58 29.66 2hky s HIS 123 CO 0.00 -1.14 -0.08 -1.17 -2.47 0.00 0.00 174.74 169.87 2hky s LEU 124 N -4.90 3.59 0.01 8.88 2.96 -1.26 0.06 118.68 128.01 2hky s LEU 124 Ca 0.60 -1.42 -0.23 0.00 -0.22 0.00 0.00 54.13 52.86 2hky s LEU 124 Cb -0.09 -1.58 -0.18 0.00 0.50 0.00 0.00 46.19 44.84 2hky s LEU 124 CO 0.40 -0.21 1.28 -0.78 -1.32 0.00 0.00 176.35 175.72 2hky h ASP 125 N 7.80 0.22 -2.31 3.68 3.58 0.53 -3.47 116.42 126.45 2hky h ASP 125 Ca -0.19 -0.52 0.27 0.00 0.42 0.00 0.00 57.03 57.01 2hky h ASP 125 Cb 1.04 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.98 2hky h ASP 125 CO 0.48 0.69 0.77 -2.11 -2.88 0.00 0.00 179.24 176.19 2hky n ARG 126 N -4.67 0.38 -5.21 0.28 1.85 -0.85 -4.95 116.66 103.50 2hky n ARG 126 Ca -0.07 -1.07 -0.32 0.00 -1.00 0.00 0.00 57.85 55.39 2hky n ARG 126 Cb 0.33 1.58 -0.16 0.00 -1.05 0.00 0.00 32.46 33.16 2hky n ARG 126 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2hky s VAL 127 N -2.03 2.18 0.00 8.89 1.01 -1.26 0.03 120.40 129.22 2hky s VAL 127 Ca 0.27 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.23 2hky s VAL 127 Cb -0.02 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.56 2hky s VAL 127 CO 0.02 0.57 0.28 -0.11 0.00 0.00 0.00 175.10 175.86