#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq s PRO 5 N 0.00 2.77 0.42 1.97 0.02 -1.26 -4.93 135.00 133.99 1yhq s PRO 5 Ca 0.00 1.73 0.23 0.00 0.02 0.00 0.00 61.00 62.98 1yhq s PRO 5 Cb 0.00 -1.91 0.78 0.00 0.02 0.00 0.00 34.50 33.38 1yhq s PRO 5 CO 0.00 -1.35 1.76 0.00 -0.33 0.00 0.00 177.00 177.09 1yhq h ALA 6 N 0.49 0.97 -1.18 -1.55 0.00 -2.02 -2.95 119.26 113.02 1yhq h ALA 6 Ca -0.49 -0.22 0.34 0.00 0.00 0.00 0.00 54.91 54.54 1yhq h ALA 6 Cb 1.29 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 1yhq h ALA 6 CO 0.54 0.30 0.88 0.66 0.00 0.00 0.00 179.25 181.63 1yhq h SER 7 N 0.00 0.00 0.71 0.00 4.64 -2.00 0.57 113.55 117.47 1yhq h SER 7 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1yhq h SER 7 Cb 0.85 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1yhq h SER 7 CO 0.03 0.00 -0.44 0.24 -0.87 0.00 0.00 176.83 175.79 1yhq h MET 8 N 0.00 0.00 0.00 4.77 2.86 -1.90 -3.38 114.93 117.27 1yhq h MET 8 Ca 0.56 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.20 1yhq h MET 8 Cb 2.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.98 1yhq h MET 8 CO -0.01 0.44 0.00 0.66 1.06 0.00 0.00 176.91 179.06 1yhq n TYR 9 N -3.67 0.00 0.26 -0.22 4.02 0.17 -4.86 117.16 112.85 1yhq n TYR 9 Ca -0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.96 1yhq n TYR 9 Cb 0.52 0.00 0.65 0.00 -0.02 0.00 0.00 39.34 40.49 1yhq n TYR 9 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 176.86 175.92 1yhq h ARG 10 N 0.00 0.00 -7.06 -0.72 0.11 -0.84 -3.42 114.38 102.45 1yhq h ARG 10 Ca 0.00 0.00 -0.50 0.00 0.10 0.00 0.00 59.98 59.58 1yhq h ARG 10 Cb 0.11 0.00 0.04 0.00 1.11 0.00 0.00 29.97 31.23 1yhq h ARG 10 CO 0.00 0.00 0.21 -0.51 0.10 0.00 0.00 179.97 179.78 1yhq s ASP 11 N -7.04 6.28 -0.92 0.08 1.01 -1.26 -0.45 116.67 114.38 1yhq s ASP 11 Ca -0.05 1.11 -0.10 0.00 0.71 0.00 0.00 52.55 54.22 1yhq s ASP 11 Cb 0.17 -2.33 0.23 0.00 1.01 0.00 0.00 42.92 42.01 1yhq s ASP 11 CO 0.67 -0.65 0.86 -0.63 0.21 0.00 0.00 175.17 175.62 1yhq s ILE 12 N -2.84 5.41 -0.13 0.77 1.01 -1.26 -4.73 121.20 119.43 1yhq s ILE 12 Ca 0.50 -3.03 0.15 0.00 0.00 0.00 0.00 60.65 58.27 1yhq s ILE 12 Cb -0.10 -4.32 0.34 0.00 0.01 0.00 0.00 42.46 38.38 1yhq s ILE 12 CO 0.46 -1.08 1.17 -0.90 0.00 0.00 0.00 174.94 174.59 1yhq n ASP 13 N 3.27 1.57 -3.85 3.58 5.68 -1.26 -5.05 116.55 120.49 1yhq n ASP 13 Ca 0.18 -3.13 -0.10 0.00 -0.50 0.00 0.00 54.79 51.24 1yhq n ASP 13 Cb 0.42 -0.42 -0.08 0.00 -1.14 0.00 0.00 41.12 39.90 1yhq n ASP 13 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1yhq s LYS 14 N -2.20 0.73 0.93 0.11 1.02 -1.26 -5.15 119.74 113.92 1yhq s LYS 14 Ca 0.31 -0.72 -0.11 0.00 0.02 0.00 0.00 55.97 55.48 1yhq s LYS 14 Cb 0.31 0.30 0.13 0.00 -0.52 0.00 0.00 37.83 38.05 1yhq s LYS 14 CO -0.05 -0.22 0.98 -2.30 -0.92 0.00 0.00 175.35 172.84 1yhq n PRO 15 N 0.48 -0.46 -2.12 -1.68 -0.02 -1.26 -4.88 135.00 125.06 1yhq n PRO 15 Ca -0.18 -0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 60.81 1yhq n PRO 15 Cb 0.60 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 1yhq n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yhq s ALA 16 N -2.58 3.59 -0.47 3.55 0.00 -1.26 -4.95 121.76 119.63 1yhq s ALA 16 Ca 0.65 1.20 0.03 0.00 0.00 0.00 0.00 51.96 53.83 1yhq s ALA 16 Cb -0.23 -3.53 0.15 0.00 0.00 0.00 0.00 23.12 19.51 1yhq s ALA 16 CO 0.60 -0.63 0.29 -0.47 0.00 0.00 0.00 175.76 175.55 1yhq s TYR 17 N 0.40 2.07 0.00 0.00 5.04 -1.26 -4.91 117.35 118.69 1yhq s TYR 17 Ca 0.60 -2.54 0.00 0.00 -2.44 0.00 0.00 57.07 52.70 1yhq s TYR 17 Cb -0.39 -1.85 0.00 0.00 0.35 0.00 0.00 41.96 40.07 1yhq s TYR 17 CO 0.37 -0.75 0.00 0.25 -1.34 0.00 0.00 175.55 174.08 1yhq n THR 18 N 3.21 0.00 -1.66 4.34 -2.24 -1.26 -1.11 114.28 115.56 1yhq n THR 18 Ca 0.14 -0.15 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 1yhq n THR 18 Cb 0.37 0.72 -0.04 0.00 -2.10 0.00 0.00 70.33 69.27 1yhq n THR 18 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1yhq s ARG 19 N -0.68 2.07 0.04 -0.78 1.81 -1.26 -4.81 118.95 115.35 1yhq s ARG 19 Ca 0.00 0.95 0.12 0.00 -1.72 0.00 0.00 55.73 55.09 1yhq s ARG 19 Cb 0.00 -4.64 0.54 0.00 -0.45 0.00 0.00 34.95 30.40 1yhq s ARG 19 CO 0.00 -3.51 1.39 0.54 -0.68 0.00 0.00 175.30 173.04 1yhq n ARG 20 N 8.98 0.03 0.00 3.54 1.74 -1.26 -1.52 116.66 128.17 1yhq n ARG 20 Ca 0.37 0.34 0.14 0.00 -0.77 0.00 0.00 57.85 57.93 1yhq n ARG 20 Cb 0.51 -1.56 0.63 0.00 -1.02 0.00 0.00 32.46 31.02 1yhq n ARG 20 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1yhq n GLU 21 N -1.61 0.02 0.00 5.56 0.00 -1.26 -3.41 120.64 119.94 1yhq n GLU 21 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.18 1yhq n GLU 21 Cb 0.13 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.07 1yhq n GLU 21 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1yhq n TYR 22 N -1.49 0.00 -4.33 -1.84 4.02 -0.57 -5.02 117.16 107.93 1yhq n TYR 22 Ca 0.07 -0.21 -0.21 0.00 -0.01 0.00 0.00 57.90 57.54 1yhq n TYR 22 Cb 0.33 -0.02 -0.16 0.00 -0.02 0.00 0.00 39.34 39.47 1yhq n TYR 22 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1yhq s ILE 23 N -0.42 0.76 0.31 -0.72 1.01 -1.04 -5.08 121.20 116.01 1yhq s ILE 23 Ca 0.00 -0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.46 1yhq s ILE 23 Cb 0.00 -0.73 -0.06 0.00 0.01 0.00 0.00 42.46 41.68 1yhq s ILE 23 CO 0.00 0.27 -0.05 0.42 0.00 0.00 0.00 174.94 175.58 1yhq s THR 24 N 0.75 1.77 -1.03 2.92 -4.23 -1.26 -4.69 115.64 109.88 1yhq s THR 24 Ca -0.12 -2.12 -0.05 0.00 -1.18 0.00 0.00 61.69 58.22 1yhq s THR 24 Cb -0.14 -2.58 0.01 0.00 1.34 0.00 0.00 72.50 71.12 1yhq s THR 24 CO 0.02 -0.22 0.68 0.61 -0.54 0.00 0.00 174.62 175.17 1yhq n GLY 25 N -0.68 -0.14 3.67 3.99 0.00 -1.26 -4.88 105.19 105.90 1yhq n GLY 25 Ca -0.05 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1yhq n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yhq s ILE 26 N -3.13 4.86 0.56 -0.61 1.01 -1.26 -4.85 121.20 117.77 1yhq s ILE 26 Ca 0.34 1.70 -0.20 0.00 0.00 0.00 0.00 60.65 62.49 1yhq s ILE 26 Cb -0.15 -4.17 -0.06 0.00 0.01 0.00 0.00 42.46 38.09 1yhq s ILE 26 CO 0.42 0.02 1.00 -2.65 0.00 0.00 0.00 174.94 173.73 1yhq n PRO 27 N 5.20 1.08 -1.42 2.79 -0.02 -1.26 -4.96 135.00 136.40 1yhq n PRO 27 Ca 0.05 0.41 -0.31 0.00 -2.02 0.00 0.00 63.50 61.62 1yhq n PRO 27 Cb 0.49 -2.17 0.07 0.00 -0.02 0.00 0.00 33.50 31.87 1yhq n PRO 27 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1yhq s GLY 28 N -1.09 1.77 0.32 -1.23 0.00 -1.26 -4.84 107.32 100.99 1yhq s GLY 28 Ca 0.72 0.29 -0.27 0.00 0.00 0.00 0.00 44.72 45.47 1yhq s GLY 28 CO 0.50 0.63 0.97 -0.45 0.00 0.00 0.00 173.10 174.75 1yhq s SER 29 N -3.29 7.29 0.00 1.64 0.15 -1.26 -4.95 113.70 113.28 1yhq s SER 29 Ca 0.62 1.91 0.26 0.00 0.70 0.00 0.00 55.95 59.44 1yhq s SER 29 Cb -0.17 -2.59 0.72 0.00 -1.71 0.00 0.00 66.02 62.28 1yhq s SER 29 CO 0.53 -0.10 1.55 0.29 1.20 0.00 0.00 173.24 176.70 1yhq n LYS 30 N 0.63 0.62 -2.14 5.44 5.02 -1.26 -4.84 118.16 121.63 1yhq n LYS 30 Ca 0.02 -0.35 -0.43 0.00 -2.02 0.00 0.00 58.31 55.53 1yhq n LYS 30 Cb 0.49 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 1yhq n LYS 30 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1yhq s ILE 31 N -2.63 3.76 0.07 -0.18 1.01 -1.26 -4.82 121.20 117.15 1yhq s ILE 31 Ca 0.21 0.88 -0.11 0.00 0.00 0.00 0.00 60.65 61.63 1yhq s ILE 31 Cb 0.19 -3.70 -0.27 0.00 0.01 0.00 0.00 42.46 38.69 1yhq s ILE 31 CO 0.56 -0.23 1.15 0.00 0.00 0.00 0.00 174.94 176.43 1yhq h ALA 32 N 10.10 0.09 -2.59 9.38 0.00 -1.95 -3.47 119.26 130.81 1yhq h ALA 32 Ca -0.34 -0.77 -0.12 0.00 0.00 0.00 0.00 54.91 53.68 1yhq h ALA 32 Cb 1.15 0.07 -0.19 0.00 0.00 0.00 0.00 17.79 18.82 1yhq h ALA 32 CO 0.99 0.75 -0.35 -0.65 0.00 0.00 0.00 179.25 179.99 1yhq s GLN 33 N -3.00 0.65 -0.01 0.00 -0.21 -1.26 -5.03 119.66 110.79 1yhq s GLN 33 Ca -0.08 -0.40 0.07 0.00 0.02 0.00 0.00 55.36 54.97 1yhq s GLN 33 Cb 0.06 0.28 -0.11 0.00 1.00 0.00 0.00 33.01 34.25 1yhq s GLN 33 CO 0.91 -0.18 0.15 0.72 -2.12 0.00 0.00 175.29 174.77 1yhq n HIS 34 N 1.05 0.00 -4.09 0.91 8.25 -1.26 -4.88 115.22 115.20 1yhq n HIS 34 Ca -0.21 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 56.93 1yhq n HIS 34 Cb 0.57 -0.17 -0.16 0.00 1.12 0.00 0.00 29.99 31.35 1yhq n HIS 34 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1yhq s LYS 35 N -2.47 2.63 0.45 -0.41 -0.14 -1.26 -1.68 119.74 116.87 1yhq s LYS 35 Ca -0.03 -1.04 0.05 0.00 -1.36 0.00 0.00 55.97 53.59 1yhq s LYS 35 Cb 0.04 -2.69 -0.05 0.00 -1.68 0.00 0.00 37.83 33.46 1yhq s LYS 35 CO 0.29 -0.37 0.05 -1.64 -0.76 0.00 0.00 175.35 172.93 1yhq s MET 36 N 1.22 2.10 6.02 1.68 -1.94 -0.22 -4.91 119.30 123.24 1yhq s MET 36 Ca -0.01 -2.17 0.00 0.00 -1.71 0.00 0.00 55.69 51.80 1yhq s MET 36 Cb -0.16 -1.67 0.00 0.00 2.01 0.00 0.00 34.83 35.01 1yhq s MET 36 CO -0.09 -0.20 0.00 0.41 -0.01 0.00 0.00 175.02 175.13 1yhq n GLY 37 N -1.15 0.82 3.28 -0.03 0.00 -1.26 -2.59 105.19 104.25 1yhq n GLY 37 Ca -0.09 -0.64 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 1yhq n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yhq s ARG 38 N 0.00 3.51 0.00 1.61 0.52 -0.31 -4.89 118.95 119.39 1yhq s ARG 38 Ca 0.00 -2.64 0.23 0.00 -0.52 0.00 0.00 55.73 52.80 1yhq s ARG 38 Cb 0.00 -4.31 1.38 0.00 0.52 0.00 0.00 34.95 32.54 1yhq s ARG 38 CO 0.00 -1.26 1.76 0.36 0.02 0.00 0.00 175.30 176.18 1yhq n LYS 39 N 3.60 0.70 0.04 3.54 2.85 -1.26 -2.46 118.16 125.16 1yhq n LYS 39 Ca 0.15 0.01 0.12 0.00 -1.05 0.00 0.00 58.31 57.53 1yhq n LYS 39 Cb 0.44 -1.50 0.16 0.00 -0.65 0.00 0.00 35.03 33.47 1yhq n LYS 39 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1yhq n GLN 40 N -1.03 0.23 -3.04 -1.58 6.02 -1.26 -4.89 117.38 111.83 1yhq n GLN 40 Ca 0.17 0.05 -0.20 0.00 -0.01 0.00 0.00 57.00 57.01 1yhq n GLN 40 Cb 0.09 -1.62 0.01 0.00 1.02 0.00 0.00 30.24 29.74 1yhq n GLN 40 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1yhq s LYS 41 N -3.14 2.89 0.34 -1.09 2.20 -1.03 -5.12 119.74 114.80 1yhq s LYS 41 Ca 0.07 -0.88 0.06 0.00 -0.36 0.00 0.00 55.97 54.85 1yhq s LYS 41 Cb 0.14 -2.66 -0.01 0.00 -1.51 0.00 0.00 37.83 33.79 1yhq s LYS 41 CO 0.73 -0.29 0.49 -0.51 -0.36 0.00 0.00 175.35 175.42 1yhq s ASP 42 N -4.29 5.98 0.33 1.43 1.01 -1.26 -5.00 116.67 114.87 1yhq s ASP 42 Ca 0.51 -0.10 0.18 0.00 0.71 0.00 0.00 52.55 53.85 1yhq s ASP 42 Cb -0.10 -1.32 0.30 0.00 1.01 0.00 0.00 42.92 42.82 1yhq s ASP 42 CO 0.35 -0.44 1.56 0.00 0.21 0.00 0.00 175.17 176.84 1yhq h ALA 43 N 0.84 0.80 0.00 5.23 0.00 -1.97 -3.07 119.26 121.09 1yhq h ALA 43 Ca -0.46 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1yhq h ALA 43 Cb 1.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1yhq h ALA 43 CO 0.54 0.48 0.00 -0.44 0.00 0.00 0.00 179.25 179.83 1yhq h ASP 44 N 0.00 0.00 0.00 0.00 3.32 -2.01 -2.91 116.42 114.82 1yhq h ASP 44 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yhq h ASP 44 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1yhq h ASP 44 CO 0.05 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 178.04 1yhq n ASP 45 N -2.66 0.00 -4.28 6.45 8.00 -1.16 -4.78 116.55 118.12 1yhq n ASP 45 Ca 0.02 -1.88 -0.26 0.00 0.71 0.00 0.00 54.79 53.38 1yhq n ASP 45 Cb 0.32 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.29 1yhq n ASP 45 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1yhq s TYR 46 N -2.00 1.91 0.08 1.24 1.51 -1.10 -5.04 117.35 113.95 1yhq s TYR 46 Ca 0.02 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.72 1yhq s TYR 46 Cb 0.01 -1.11 -0.24 0.00 -0.11 0.00 0.00 41.96 40.51 1yhq s TYR 46 CO 0.01 0.14 1.15 -1.35 -1.11 0.00 0.00 175.55 174.39 1yhq h PRO 47 N 4.63 0.11 -5.89 -1.71 0.11 -1.87 -3.46 132.00 123.92 1yhq h PRO 47 Ca -0.44 -0.19 -0.67 0.00 0.11 0.00 0.00 66.00 64.80 1yhq h PRO 47 Cb 1.16 0.07 -0.22 0.00 0.11 0.00 0.00 31.00 32.12 1yhq h PRO 47 CO 0.43 1.05 -0.73 0.08 -0.21 0.00 0.00 178.00 178.62 1yhq s VAL 48 N -2.68 3.39 -0.18 3.15 1.01 -0.98 -4.00 120.40 120.11 1yhq s VAL 48 Ca -0.02 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.34 1yhq s VAL 48 Cb 0.09 -2.39 0.06 0.00 0.00 0.00 0.00 36.38 34.13 1yhq s VAL 48 CO 0.84 0.57 0.07 -1.58 0.00 0.00 0.00 175.10 175.00 1yhq s GLN 49 N -0.36 0.31 -0.09 2.72 0.74 -0.36 -1.51 119.66 121.11 1yhq s GLN 49 Ca 0.04 -0.24 0.02 0.00 0.05 0.00 0.00 55.36 55.24 1yhq s GLN 49 Cb -0.12 -1.94 -0.02 0.00 1.10 0.00 0.00 33.01 32.03 1yhq s GLN 49 CO 0.02 -0.67 -0.15 0.42 -0.55 0.00 0.00 175.29 174.36 1yhq s ILE 50 N 2.02 2.88 0.13 -2.34 1.01 -0.44 0.05 121.20 124.50 1yhq s ILE 50 Ca 0.01 -0.75 0.11 0.00 0.00 0.00 0.00 60.65 60.02 1yhq s ILE 50 Cb -0.16 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 1yhq s ILE 50 CO -0.09 0.55 -0.27 -0.44 0.00 0.00 0.00 174.94 174.70 1yhq s SER 51 N -0.08 3.34 -0.28 3.58 0.01 0.44 -0.13 113.70 120.58 1yhq s SER 51 Ca -0.03 -0.74 -0.12 0.00 1.31 0.00 0.00 55.95 56.37 1yhq s SER 51 Cb -0.14 -0.23 -0.05 0.00 0.21 0.00 0.00 66.02 65.81 1yhq s SER 51 CO 0.04 0.18 0.25 -0.22 0.41 0.00 0.00 173.24 173.90 1yhq s LEU 52 N -2.06 4.03 -0.13 2.44 2.96 0.73 -0.40 118.68 126.25 1yhq s LEU 52 Ca 0.14 0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 54.11 1yhq s LEU 52 Cb -0.10 -2.22 -0.03 0.00 0.50 0.00 0.00 46.19 44.34 1yhq s LEU 52 CO 0.06 -0.09 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.33 1yhq s ILE 53 N 1.85 3.87 0.04 6.68 1.01 0.72 -1.23 121.20 134.15 1yhq s ILE 53 Ca 0.10 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 60.07 1yhq s ILE 53 Cb -0.16 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 1yhq s ILE 53 CO 0.11 0.52 1.01 -0.69 0.00 0.00 0.00 174.94 175.89 1yhq s VAL 54 N 0.06 4.65 -0.74 2.92 1.01 -0.70 -0.76 120.40 126.84 1yhq s VAL 54 Ca -0.00 1.96 0.24 0.00 0.00 0.00 0.00 61.98 64.18 1yhq s VAL 54 Cb -0.13 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 1yhq s VAL 54 CO 0.03 0.19 1.21 -0.62 0.00 0.00 0.00 175.10 175.91 1yhq n GLU 55 N 3.64 0.20 -4.26 2.72 1.02 -0.64 0.15 120.64 123.48 1yhq n GLU 55 Ca 0.06 0.03 -0.18 0.00 -0.02 0.00 0.00 57.16 57.04 1yhq n GLU 55 Cb 0.50 -1.59 -0.13 0.00 -0.02 0.00 0.00 31.44 30.20 1yhq n GLU 55 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1yhq s GLU 56 N -3.13 0.81 0.18 3.49 2.02 -1.26 -4.59 118.70 116.22 1yhq s GLU 56 Ca 0.07 -0.75 -0.30 0.00 0.02 0.00 0.00 54.97 54.01 1yhq s GLU 56 Cb 0.15 -0.77 -0.08 0.00 0.10 0.00 0.00 34.13 33.52 1yhq s GLU 56 CO 0.75 0.18 1.27 0.99 0.02 0.00 0.00 175.26 178.48 1yhq s THR 57 N -0.95 3.38 0.39 3.63 2.01 -1.26 -4.03 115.64 118.80 1yhq s THR 57 Ca -0.01 1.13 -0.15 0.00 0.31 0.00 0.00 61.69 62.97 1yhq s THR 57 Cb -0.08 -3.72 0.05 0.00 0.01 0.00 0.00 72.50 68.76 1yhq s THR 57 CO 0.01 0.17 0.78 0.68 -0.69 0.00 0.00 174.62 175.57 1yhq s VAL 58 N 0.14 0.00 -0.08 3.82 -7.23 0.36 -4.87 120.40 112.54 1yhq s VAL 58 Ca 0.56 -1.02 0.04 0.00 -1.81 0.00 0.00 61.98 59.75 1yhq s VAL 58 Cb -0.35 -2.90 -0.01 0.00 0.56 0.00 0.00 36.38 33.68 1yhq s VAL 58 CO 0.37 0.00 -0.20 -1.10 -0.31 0.00 0.00 175.10 173.86 1yhq s GLN 59 N -2.27 2.80 -0.20 4.82 -0.21 0.40 -0.36 119.66 124.64 1yhq s GLN 59 Ca 0.16 -0.81 0.01 0.00 0.02 0.00 0.00 55.36 54.74 1yhq s GLN 59 Cb -0.05 -2.33 0.04 0.00 1.00 0.00 0.00 33.01 31.67 1yhq s GLN 59 CO 0.12 0.36 -0.15 -0.51 -2.12 0.00 0.00 175.29 172.99 1yhq s LEU 60 N -0.08 2.40 0.49 2.90 1.43 0.23 -4.46 118.68 121.59 1yhq s LEU 60 Ca -0.05 -0.86 -0.23 0.00 -1.03 0.00 0.00 54.13 51.97 1yhq s LEU 60 Cb -0.14 -1.39 -0.06 0.00 0.03 0.00 0.00 46.19 44.63 1yhq s LEU 60 CO 0.04 -0.09 1.25 -0.13 0.23 0.00 0.00 176.35 177.65 1yhq s ARG 61 N 1.30 3.53 0.60 1.70 0.52 -1.26 -0.79 118.95 124.55 1yhq s ARG 61 Ca 0.00 1.97 0.29 0.00 -0.52 0.00 0.00 55.73 57.47 1yhq s ARG 61 Cb -0.15 -2.37 1.54 0.00 0.52 0.00 0.00 34.95 34.49 1yhq s ARG 61 CO -0.10 -0.79 1.94 1.12 0.02 0.00 0.00 175.30 177.49 1yhq h HIS 62 N 1.85 0.00 -0.47 -0.53 2.07 -1.65 0.35 115.15 116.78 1yhq h HIS 62 Ca -0.50 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 56.93 1yhq h HIS 62 Cb 1.27 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.23 1yhq h HIS 62 CO 0.50 0.00 -0.09 0.78 -3.07 0.00 0.00 177.93 176.06 1yhq h GLY 63 N 0.00 0.90 1.18 6.13 0.00 -1.89 -2.18 103.07 107.20 1yhq h GLY 63 Ca 0.15 -0.68 -0.25 0.00 0.00 0.00 0.00 47.33 46.55 1yhq h GLY 63 CO -0.00 0.62 -0.95 1.76 0.00 0.00 0.00 176.54 177.97 1yhq h SER 64 N 0.76 0.91 0.00 0.19 0.02 -0.64 -2.50 113.55 112.30 1yhq h SER 64 Ca 0.13 -0.71 0.02 0.00 -0.84 0.00 0.00 61.79 60.39 1yhq h SER 64 Cb 0.58 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 1yhq h SER 64 CO 0.04 1.49 -0.13 -0.07 -1.14 0.00 0.00 176.83 177.02 1yhq h LEU 65 N 0.41 -0.37 -0.54 5.07 -0.00 -1.32 -0.57 115.31 117.98 1yhq h LEU 65 Ca -0.11 0.06 0.04 0.00 -0.00 0.00 0.00 57.88 57.86 1yhq h LEU 65 Cb 1.60 0.16 -0.04 0.00 -0.00 0.00 0.00 40.66 42.38 1yhq h LEU 65 CO 0.19 -0.18 0.31 -0.08 -0.00 0.00 0.00 178.44 178.67 1yhq h GLU 66 N -0.22 0.58 -0.69 1.13 4.57 -1.45 0.49 114.58 118.99 1yhq h GLU 66 Ca 0.04 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 1yhq h GLU 66 Cb 0.27 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 1yhq h GLU 66 CO -0.12 0.38 0.37 0.00 -1.18 0.00 0.00 179.01 178.46 1yhq h ALA 67 N 1.26 0.88 0.02 2.92 0.00 -1.07 0.18 119.26 123.46 1yhq h ALA 67 Ca 0.23 -0.12 -0.22 0.00 0.00 0.00 0.00 54.91 54.80 1yhq h ALA 67 Cb 0.08 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 17.62 1yhq h ALA 67 CO -0.13 0.41 -0.89 0.66 0.00 0.00 0.00 179.25 179.30 1yhq h SER 68 N 0.94 0.74 -0.84 0.00 4.64 -0.74 -1.58 113.55 116.72 1yhq h SER 68 Ca 0.24 -0.77 -0.01 0.00 -0.47 0.00 0.00 61.79 60.78 1yhq h SER 68 Cb 0.06 -0.23 -0.04 0.00 -0.31 0.00 0.00 62.40 61.88 1yhq h SER 68 CO -0.04 1.42 0.47 -0.09 -0.87 0.00 0.00 176.83 177.73 1yhq h ARG 69 N 0.14 1.17 0.86 4.77 2.43 0.06 -1.84 114.38 121.98 1yhq h ARG 69 Ca -0.12 -0.13 -0.04 0.00 -0.81 0.00 0.00 59.98 58.88 1yhq h ARG 69 Cb 1.58 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 30.90 1yhq h ARG 69 CO 0.17 0.85 -0.42 1.25 -1.51 0.00 0.00 179.97 180.32 1yhq h LEU 70 N 1.17 -0.98 -1.94 3.80 5.85 -0.63 -0.90 115.31 121.67 1yhq h LEU 70 Ca 0.30 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1yhq h LEU 70 Cb 0.01 0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1yhq h LEU 70 CO -0.05 -0.64 0.05 0.77 -0.34 0.00 0.00 178.44 178.23 1yhq h SER 71 N -1.28 0.00 0.00 1.25 4.64 -1.16 0.21 113.55 117.20 1yhq h SER 71 Ca -0.12 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.03 1yhq h SER 71 Cb 0.89 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.96 1yhq h SER 71 CO 0.19 0.00 -1.07 0.00 -0.87 0.00 0.00 176.83 175.08 1yhq n ALA 72 N -1.87 0.70 0.08 5.18 0.00 -0.70 -3.65 120.51 120.26 1yhq n ALA 72 Ca -0.02 -0.49 -0.00 0.00 0.00 0.00 0.00 53.44 52.93 1yhq n ALA 72 Cb 0.10 -0.37 0.29 0.00 0.00 0.00 0.00 19.45 19.47 1yhq n ALA 72 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1yhq h ASN 73 N -1.00 0.29 0.12 0.00 -0.00 -0.89 -1.94 115.58 112.17 1yhq h ASN 73 Ca -0.25 -0.09 -0.03 0.00 -0.00 0.00 0.00 56.30 55.92 1yhq h ASN 73 Cb 1.07 -0.08 -0.01 0.00 -0.00 0.00 0.00 38.32 39.31 1yhq h ASN 73 CO -0.15 0.55 -0.13 -0.09 -0.00 0.00 0.00 177.43 177.61 1yhq h ARG 74 N 0.27 0.03 0.06 6.67 2.43 -0.78 -0.31 114.38 122.75 1yhq h ARG 74 Ca 0.04 -0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.01 1yhq h ARG 74 Cb 0.60 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1yhq h ARG 74 CO 0.04 0.17 -0.79 1.25 -1.51 0.00 0.00 179.97 179.13 1yhq h HIS 75 N 0.03 0.68 -0.53 2.20 2.76 -1.44 -2.66 115.15 116.19 1yhq h HIS 75 Ca 0.01 -0.41 0.04 0.00 -2.20 0.00 0.00 60.37 57.80 1yhq h HIS 75 Cb 0.26 -0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.13 1yhq h HIS 75 CO 0.00 1.26 0.35 -0.07 -1.30 0.00 0.00 177.93 178.18 1yhq h LEU 76 N -0.09 0.50 0.06 0.26 3.38 -0.82 -0.28 115.31 118.33 1yhq h LEU 76 Ca -0.12 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1yhq h LEU 76 Cb 1.53 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1yhq h LEU 76 CO 0.15 0.34 -0.03 0.40 0.09 0.00 0.00 178.44 179.40 1yhq h ILE 77 N 0.58 1.17 0.00 1.22 2.04 -1.08 0.13 117.51 121.58 1yhq h ILE 77 Ca 0.22 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 1yhq h ILE 77 Cb 0.14 1.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1yhq h ILE 77 CO -0.06 0.20 -0.01 0.50 0.00 0.00 0.00 178.15 178.79 1yhq h LYS 78 N -0.45 0.00 0.00 2.37 3.64 -1.02 0.67 116.57 121.79 1yhq h LYS 78 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1yhq h LYS 78 Cb 0.40 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1yhq h LYS 78 CO 0.01 0.01 -1.73 0.39 -2.27 0.00 0.00 179.45 175.86 1yhq n GLU 79 N -4.53 0.52 0.00 1.90 -0.58 -0.18 -4.53 120.64 113.24 1yhq n GLU 79 Ca -0.03 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 1yhq n GLU 79 Cb 0.10 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 1yhq n GLU 79 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1yhq n LEU 80 N -2.06 0.46 0.00 -4.62 4.77 0.46 -5.07 117.00 110.93 1yhq n LEU 80 Ca -0.02 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1yhq n LEU 80 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1yhq n LEU 80 CO 0.44 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1yhq n GLY 81 N 0.29 0.18 0.00 -0.72 0.00 0.23 -2.46 105.19 102.71 1yhq n GLY 81 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1yhq n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yhq n GLU 82 N 0.41 0.00 -0.53 1.61 1.02 -1.25 -1.34 120.64 120.56 1yhq n GLU 82 Ca 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1yhq n GLU 82 Cb 0.00 -1.35 -0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1yhq n GLU 82 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1yhq n GLU 83 N -0.85 0.00 -0.91 3.49 1.02 -1.26 -5.04 120.64 117.08 1yhq n GLU 83 Ca 0.00 -0.50 -0.34 0.00 -0.02 0.00 0.00 57.16 56.30 1yhq n GLU 83 Cb 0.00 -0.22 0.09 0.00 -0.02 0.00 0.00 31.44 31.29 1yhq n GLU 83 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yhq n GLY 84 N 0.01 -2.87 3.54 0.62 0.00 -0.45 -4.80 105.19 101.24 1yhq n GLY 84 Ca -0.00 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 1yhq n GLY 84 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yhq s ASP 85 N -1.62 6.82 0.22 1.61 2.15 -1.26 -4.63 116.67 119.96 1yhq s ASP 85 Ca 0.52 -2.37 -0.23 0.00 0.43 0.00 0.00 52.55 50.90 1yhq s ASP 85 Cb -0.22 -2.52 0.04 0.00 -0.30 0.00 0.00 42.92 39.92 1yhq s ASP 85 CO 0.72 -1.12 0.83 -0.72 -0.17 0.00 0.00 175.17 174.71 1yhq s TYR 86 N 3.60 -0.16 -0.21 -5.34 -0.85 -1.26 -4.33 117.35 108.80 1yhq s TYR 86 Ca 0.48 -0.23 -0.16 0.00 -0.52 0.00 0.00 57.07 56.64 1yhq s TYR 86 Cb 0.01 0.68 0.06 0.00 0.38 0.00 0.00 41.96 43.09 1yhq s TYR 86 CO 0.01 -1.05 0.54 -1.59 -1.52 0.00 0.00 175.55 171.95 1yhq s LYS 87 N -3.62 0.59 0.06 -3.49 -2.85 -0.67 -1.17 119.74 108.59 1yhq s LYS 87 Ca 0.12 0.85 0.06 0.00 -1.00 0.00 0.00 55.97 55.99 1yhq s LYS 87 Cb -0.04 0.20 -0.03 0.00 -2.06 0.00 0.00 37.83 35.91 1yhq s LYS 87 CO 0.05 -0.11 -0.17 1.41 0.10 0.00 0.00 175.35 176.63 1yhq s MET 88 N 0.78 1.07 -0.02 1.78 1.75 -1.07 0.23 119.30 123.83 1yhq s MET 88 Ca -0.04 -0.91 0.03 0.00 -1.25 0.00 0.00 55.69 53.52 1yhq s MET 88 Cb -0.05 -1.15 -0.00 0.00 2.84 0.00 0.00 34.83 36.47 1yhq s MET 88 CO -0.06 0.28 -0.09 0.99 -0.65 0.00 0.00 175.02 175.49 1yhq s THR 89 N -0.95 0.74 -0.43 10.11 2.01 0.44 -1.06 115.64 126.50 1yhq s THR 89 Ca 0.03 -0.36 -0.11 0.00 0.31 0.00 0.00 61.69 61.56 1yhq s THR 89 Cb -0.09 -0.64 0.08 0.00 0.01 0.00 0.00 72.50 71.85 1yhq s THR 89 CO 0.02 0.22 0.30 -0.22 -0.69 0.00 0.00 174.62 174.25 1yhq s LEU 90 N 0.03 5.28 0.27 4.42 2.96 -0.67 -1.63 118.68 129.33 1yhq s LEU 90 Ca -0.00 -1.44 0.24 0.00 -0.22 0.00 0.00 54.13 52.71 1yhq s LEU 90 Cb -0.06 -2.04 0.51 0.00 0.50 0.00 0.00 46.19 45.09 1yhq s LEU 90 CO 0.00 -0.56 1.58 0.08 -1.32 0.00 0.00 176.35 176.13 1yhq h ARG 91 N 8.51 0.00 -6.21 1.98 0.11 -1.76 -3.46 114.38 113.55 1yhq h ARG 91 Ca -0.25 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.26 1yhq h ARG 91 Cb 1.09 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.13 1yhq h ARG 91 CO 0.79 0.00 -0.21 0.15 0.10 0.00 0.00 179.97 180.80 1yhq s LYS 92 N -3.17 3.77 -0.02 0.08 -0.14 -1.26 -5.10 119.74 113.90 1yhq s LYS 92 Ca 0.08 0.19 0.07 0.00 -1.36 0.00 0.00 55.97 54.94 1yhq s LYS 92 Cb 0.10 -2.89 -0.02 0.00 -1.68 0.00 0.00 37.83 33.34 1yhq s LYS 92 CO 0.66 0.49 -0.23 -0.06 -0.76 0.00 0.00 175.35 175.44 1yhq s PHE 93 N -1.53 2.11 -1.05 3.18 0.40 -1.26 -5.06 117.98 114.76 1yhq s PHE 93 Ca 0.38 -0.43 -0.23 0.00 -0.60 0.00 0.00 56.93 56.05 1yhq s PHE 93 Cb -0.13 -1.36 -0.03 0.00 0.51 0.00 0.00 43.02 42.01 1yhq s PHE 93 CO 0.20 -0.06 1.83 -1.25 0.70 0.00 0.00 175.22 176.65 1yhq s PRO 94 N -0.50 2.89 -0.02 0.24 0.04 -1.26 -4.53 135.00 131.86 1yhq s PRO 94 Ca 0.08 -0.90 0.08 0.00 0.04 0.00 0.00 61.00 60.30 1yhq s PRO 94 Cb -0.09 -5.22 -0.24 0.00 0.04 0.00 0.00 34.50 28.99 1yhq s PRO 94 CO -0.00 -3.22 0.76 0.45 0.04 0.00 0.00 177.00 175.02 1yhq h HIS 95 N 10.12 0.10 -2.80 0.56 3.86 -1.79 -3.38 115.15 121.82 1yhq h HIS 95 Ca 0.19 -0.07 -0.56 0.00 -1.16 0.00 0.00 60.37 58.77 1yhq h HIS 95 Cb 0.97 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.41 1yhq h HIS 95 CO 1.25 1.12 0.96 -1.14 0.86 0.00 0.00 177.93 180.98 1yhq s GLN 96 N -2.62 4.22 0.11 2.45 2.00 -0.42 -4.51 119.66 120.90 1yhq s GLN 96 Ca -0.06 1.90 -0.27 0.00 -2.00 0.00 0.00 55.36 54.93 1yhq s GLN 96 Cb 0.08 -3.83 -0.06 0.00 0.80 0.00 0.00 33.01 30.00 1yhq s GLN 96 CO 0.82 -0.74 0.86 0.08 -0.50 0.00 0.00 175.29 175.81 1yhq s VAL 97 N 3.56 4.50 -0.00 1.34 1.01 -0.26 -0.11 120.40 130.44 1yhq s VAL 97 Ca 0.63 1.86 0.02 0.00 0.00 0.00 0.00 61.98 64.49 1yhq s VAL 97 Cb -0.27 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 31.85 1yhq s VAL 97 CO 0.22 0.39 -0.03 -0.76 0.00 0.00 0.00 175.10 174.92 1yhq s LEU 98 N -0.37 3.33 0.40 3.92 1.43 0.58 -4.80 118.68 123.18 1yhq s LEU 98 Ca 0.41 -0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.51 1yhq s LEU 98 Cb -0.23 -1.90 -0.07 0.00 0.03 0.00 0.00 46.19 44.02 1yhq s LEU 98 CO 0.27 0.29 0.06 -0.13 0.23 0.00 0.00 176.35 177.07 1yhq s ARG 99 N -1.45 2.05 -0.19 1.70 0.52 -1.26 -0.96 118.95 119.35 1yhq s ARG 99 Ca 0.18 -1.99 -0.13 0.00 -0.52 0.00 0.00 55.73 53.27 1yhq s ARG 99 Cb -0.11 -1.78 0.06 0.00 0.52 0.00 0.00 34.95 33.64 1yhq s ARG 99 CO 0.08 -0.05 0.48 -2.00 0.02 0.00 0.00 175.30 173.83 1yhq s GLU 100 N -3.77 0.50 -1.09 3.54 2.12 -0.58 -4.83 118.70 114.59 1yhq s GLU 100 Ca 0.37 0.80 -0.14 0.00 0.36 0.00 0.00 54.97 56.37 1yhq s GLU 100 Cb 0.07 0.11 0.20 0.00 0.26 0.00 0.00 34.13 34.77 1yhq s GLU 100 CO 0.20 -0.12 1.21 1.21 -0.54 0.00 0.00 175.26 177.22 1yhq s ASN 101 N 1.00 7.02 -1.02 -1.70 2.47 -1.26 -0.98 114.94 120.46 1yhq s ASN 101 Ca -0.06 -2.94 -0.03 0.00 0.42 0.00 0.00 52.86 50.25 1yhq s ASN 101 Cb -0.06 -2.33 0.30 0.00 -1.45 0.00 0.00 41.25 37.71 1yhq s ASN 101 CO -0.09 -0.67 1.37 2.29 -3.72 0.00 0.00 177.10 176.29 1yhq n LYS 102 N 4.85 4.18 -0.81 0.43 2.85 -1.26 -5.04 118.16 123.36 1yhq n LYS 102 Ca 0.28 -4.57 0.00 0.00 -1.05 0.00 0.00 58.31 52.97 1yhq n LYS 102 Cb 0.44 -2.48 0.00 0.00 -0.65 0.00 0.00 35.03 32.34 1yhq n LYS 102 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1yhq n ASP 114 N 1.31 -2.53 0.00 -5.58 -0.08 -1.26 -4.99 116.55 103.41 1yhq n ASP 114 Ca 0.26 0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.66 1yhq n ASP 114 Cb 0.34 -1.30 0.00 0.00 2.34 0.00 0.00 41.12 42.50 1yhq n ASP 114 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yhq n GLY 115 N 0.14 1.41 0.87 0.27 0.00 -1.26 -4.89 105.19 101.72 1yhq n GLY 115 Ca 0.00 -0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.01 1yhq n GLY 115 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1yhq n MET 116 N 0.00 2.12 -2.55 1.61 2.81 -1.26 -4.75 117.12 115.10 1yhq n MET 116 Ca 0.00 -1.71 -0.42 0.00 -1.81 0.00 0.00 57.70 53.77 1yhq n MET 116 Cb 0.00 -1.44 -0.03 0.00 -0.71 0.00 0.00 33.22 31.04 1yhq n MET 116 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1yhq s ARG 117 N -1.57 4.52 -1.35 0.03 3.52 -1.26 -3.44 118.95 119.39 1yhq s ARG 117 Ca 0.35 1.63 -0.09 0.00 -0.13 0.00 0.00 55.73 57.49 1yhq s ARG 117 Cb 0.19 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 30.22 1yhq s ARG 117 CO 0.27 -0.11 0.45 0.00 -0.81 0.00 0.00 175.30 175.11 1yhq n ALA 118 N 3.59 -2.20 0.51 6.12 0.00 -1.26 -4.85 120.51 122.41 1yhq n ALA 118 Ca 0.07 -0.34 0.12 0.00 0.00 0.00 0.00 53.44 53.29 1yhq n ALA 118 Cb 0.48 -2.03 0.46 0.00 0.00 0.00 0.00 19.45 18.36 1yhq n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yhq n ALA 119 N -4.48 1.92 -1.62 0.00 0.00 -1.22 -4.87 120.51 110.22 1yhq n ALA 119 Ca -0.25 0.03 -0.62 0.00 0.00 0.00 0.00 53.44 52.60 1yhq n ALA 119 Cb 0.65 -1.42 -0.09 0.00 0.00 0.00 0.00 19.45 18.59 1yhq n ALA 119 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1yhq n PHE 120 N -2.21 1.72 -1.33 0.00 7.35 -1.26 -4.61 117.46 117.12 1yhq n PHE 120 Ca 0.04 0.85 -0.32 0.00 -0.76 0.00 0.00 57.45 57.25 1yhq n PHE 120 Cb 0.31 -2.33 0.09 0.00 0.35 0.00 0.00 39.48 37.91 1yhq n PHE 120 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1yhq s GLY 121 N 4.02 2.00 0.52 7.13 0.00 -1.26 -4.91 107.32 114.82 1yhq s GLY 121 Ca 1.06 0.58 -0.07 0.00 0.00 0.00 0.00 44.72 46.29 1yhq s GLY 121 CO 0.72 0.96 0.86 -1.59 0.00 0.00 0.00 173.10 174.05 1yhq s LYS 122 N -4.36 3.57 0.02 2.90 -2.85 -0.16 -4.63 119.74 114.25 1yhq s LYS 122 Ca 0.67 0.38 -0.30 0.00 -1.00 0.00 0.00 55.97 55.72 1yhq s LYS 122 Cb -0.22 -2.29 -0.05 0.00 -2.06 0.00 0.00 37.83 33.21 1yhq s LYS 122 CO 0.49 -0.30 1.22 0.42 0.10 0.00 0.00 175.35 177.28 1yhq s ILE 123 N -2.85 4.06 0.00 3.79 1.01 -1.26 -1.53 121.20 124.41 1yhq s ILE 123 Ca 0.50 1.45 0.00 0.00 0.00 0.00 0.00 60.65 62.60 1yhq s ILE 123 Cb -0.10 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.43 1yhq s ILE 123 CO 0.47 0.07 0.00 1.33 0.00 0.00 0.00 174.94 176.81 1yhq n VAL 124 N 4.19 0.00 -3.18 2.92 0.24 -0.14 -4.88 118.33 117.49 1yhq n VAL 124 Ca 0.10 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 1yhq n VAL 124 Cb 0.46 0.96 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 1yhq n VAL 124 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yhq n GLY 125 N 0.71 -1.01 3.07 7.63 0.00 -1.15 -4.85 105.19 109.58 1yhq n GLY 125 Ca 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 1yhq n GLY 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yhq s THR 126 N -3.00 0.10 0.11 2.61 -4.23 -1.26 -0.31 115.64 109.67 1yhq s THR 126 Ca 0.00 -0.87 -0.08 0.00 -1.18 0.00 0.00 61.69 59.57 1yhq s THR 126 Cb 0.00 -0.49 -0.01 0.00 1.34 0.00 0.00 72.50 73.34 1yhq s THR 126 CO 0.00 -0.48 0.20 0.00 -0.54 0.00 0.00 174.62 173.80 1yhq s ALA 127 N -1.70 -0.03 -0.11 3.99 0.00 0.85 -1.54 121.76 123.22 1yhq s ALA 127 Ca -0.13 -0.80 -0.02 0.00 0.00 0.00 0.00 51.96 51.01 1yhq s ALA 127 Cb -0.07 0.62 -0.03 0.00 0.00 0.00 0.00 23.12 23.64 1yhq s ALA 127 CO -0.01 -0.54 -0.04 0.00 0.00 0.00 0.00 175.76 175.17 1yhq s ALA 128 N -3.91 3.07 -0.23 0.00 0.00 0.03 -1.30 121.76 119.41 1yhq s ALA 128 Ca 0.10 -0.84 -0.18 0.00 0.00 0.00 0.00 51.96 51.05 1yhq s ALA 128 Cb 0.05 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.70 1yhq s ALA 128 CO -0.07 0.42 0.50 1.03 0.00 0.00 0.00 175.76 177.65 1yhq s ARG 129 N -0.33 4.12 -0.12 0.00 0.52 -1.26 -0.60 118.95 121.28 1yhq s ARG 129 Ca 0.06 0.34 0.03 0.00 -0.52 0.00 0.00 55.73 55.63 1yhq s ARG 129 Cb -0.12 -3.61 0.01 0.00 0.52 0.00 0.00 34.95 31.74 1yhq s ARG 129 CO 0.02 -0.25 -0.20 0.08 0.02 0.00 0.00 175.30 174.97 1yhq s VAL 130 N 1.99 1.84 0.33 3.52 1.01 0.51 -5.00 120.40 124.60 1yhq s VAL 130 Ca 0.22 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 61.18 1yhq s VAL 130 Cb -0.15 -1.63 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 1yhq s VAL 130 CO 0.09 0.51 0.77 -1.10 0.00 0.00 0.00 175.10 175.37 1yhq s GLN 131 N 0.77 4.05 0.34 2.72 -1.52 -1.26 -0.49 119.66 124.28 1yhq s GLN 131 Ca -0.10 0.75 -0.28 0.00 -1.95 0.00 0.00 55.36 53.78 1yhq s GLN 131 Cb -0.16 -2.43 -0.12 0.00 -0.22 0.00 0.00 33.01 30.08 1yhq s GLN 131 CO 0.01 0.15 1.33 0.00 -0.25 0.00 0.00 175.29 176.52 1yhq n ALA 132 N -0.33 1.49 -0.55 6.09 0.00 -1.26 -2.21 120.51 123.74 1yhq n ALA 132 Ca 0.04 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1yhq n ALA 132 Cb 0.53 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.70 1yhq n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yhq n GLY 133 N 0.80 0.77 3.91 0.00 0.00 0.40 -4.92 105.19 106.16 1yhq n GLY 133 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 1yhq n GLY 133 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yhq s GLU 134 N -0.45 3.57 -0.27 1.61 2.02 -0.94 -4.83 118.70 119.41 1yhq s GLU 134 Ca 0.00 -0.00 -0.20 0.00 0.02 0.00 0.00 54.97 54.78 1yhq s GLU 134 Cb 0.00 -2.55 -0.01 0.00 0.10 0.00 0.00 34.13 31.67 1yhq s GLU 134 CO 0.00 0.05 0.64 -0.65 0.02 0.00 0.00 175.26 175.32 1yhq s GLN 135 N -4.16 4.03 -0.20 1.61 -0.21 -1.26 -1.72 119.66 117.75 1yhq s GLN 135 Ca 0.44 0.46 -0.22 0.00 0.02 0.00 0.00 55.36 56.06 1yhq s GLN 135 Cb -0.10 -3.68 -0.20 0.00 1.00 0.00 0.00 33.01 30.03 1yhq s GLN 135 CO 0.36 -0.48 0.29 1.25 -2.12 0.00 0.00 175.29 174.59 1yhq h LEU 136 N 9.04 0.00 -8.77 2.90 5.85 -1.55 -3.45 115.31 119.33 1yhq h LEU 136 Ca -0.27 -0.57 -0.66 0.00 0.84 0.00 0.00 57.88 57.22 1yhq h LEU 136 Cb 1.12 -0.00 -0.24 0.00 0.37 0.00 0.00 40.66 41.91 1yhq h LEU 136 CO 0.79 1.43 -0.87 -0.36 -0.34 0.00 0.00 178.44 179.10 1yhq s PHE 137 N -2.35 2.20 -0.10 1.25 0.40 -1.22 -2.32 117.98 115.84 1yhq s PHE 137 Ca -0.28 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 55.62 1yhq s PHE 137 Cb 0.05 -1.25 0.05 0.00 0.51 0.00 0.00 43.02 42.37 1yhq s PHE 137 CO 0.61 0.21 0.19 0.99 0.70 0.00 0.00 175.22 177.91 1yhq s THR 138 N -0.94 -0.29 0.19 0.64 2.01 -0.64 -0.19 115.64 116.42 1yhq s THR 138 Ca 0.11 0.33 0.09 0.00 0.31 0.00 0.00 61.69 62.53 1yhq s THR 138 Cb -0.10 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.04 1yhq s THR 138 CO 0.04 0.14 -0.10 0.00 -0.69 0.00 0.00 174.62 174.01 1yhq s ALA 139 N 2.27 2.94 -0.07 7.40 0.00 0.82 -0.42 121.76 134.70 1yhq s ALA 139 Ca 0.02 -1.51 0.02 0.00 0.00 0.00 0.00 51.96 50.49 1yhq s ALA 139 Cb -0.12 -0.71 0.02 0.00 0.00 0.00 0.00 23.12 22.31 1yhq s ALA 139 CO -0.07 0.44 -0.10 0.71 0.00 0.00 0.00 175.76 176.74 1yhq s TYR 140 N -1.78 1.36 0.16 0.00 1.51 0.14 -1.33 117.35 117.41 1yhq s TYR 140 Ca 0.25 -0.52 -0.01 0.00 -1.01 0.00 0.00 57.07 55.79 1yhq s TYR 140 Cb -0.08 -1.04 0.00 0.00 -0.11 0.00 0.00 41.96 40.73 1yhq s TYR 140 CO 0.15 -0.30 0.22 0.00 -1.11 0.00 0.00 175.55 174.52 1yhq s ASN 142 N -2.02 6.35 0.47 0.00 0.01 -1.26 -2.31 114.94 116.18 1yhq s ASN 142 Ca 0.14 0.34 0.29 0.00 -0.71 0.00 0.00 52.86 52.92 1yhq s ASN 142 Cb -0.00 -1.98 1.36 0.00 0.41 0.00 0.00 41.25 41.04 1yhq s ASN 142 CO 0.10 -0.12 1.76 0.58 -1.51 0.00 0.00 177.10 177.91 1yhq h VAL 143 N 1.24 0.41 0.14 1.60 2.07 -1.95 -1.34 116.25 118.42 1yhq h VAL 143 Ca -0.49 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1yhq h VAL 143 Cb 1.21 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1yhq h VAL 143 CO 0.65 0.03 -0.07 -0.33 0.02 0.00 0.00 177.57 177.87 1yhq h GLU 144 N 0.17 -0.18 -0.97 1.57 5.08 -2.01 -3.13 114.58 115.10 1yhq h GLU 144 Ca 0.62 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.96 1yhq h GLU 144 Cb 2.05 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 31.32 1yhq h GLU 144 CO -0.17 0.08 0.04 -0.25 -1.00 0.00 0.00 179.01 177.71 1yhq n ASP 145 N -5.06 2.26 -0.06 1.42 8.00 -0.51 -4.21 116.55 118.38 1yhq n ASP 145 Ca -0.09 -2.16 -0.13 0.00 0.71 0.00 0.00 54.79 53.11 1yhq n ASP 145 Cb 0.19 -0.53 -0.02 0.00 -0.02 0.00 0.00 41.12 40.74 1yhq n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yhq h ALA 146 N 2.10 0.53 0.00 2.24 0.00 -1.48 -2.93 119.26 119.73 1yhq h ALA 146 Ca 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1yhq h ALA 146 Cb 0.93 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1yhq h ALA 146 CO 0.10 0.68 0.00 0.93 0.00 0.00 0.00 179.25 180.96 1yhq h GLU 147 N 0.62 0.00 0.17 0.00 4.39 -1.84 -2.79 114.58 115.13 1yhq h GLU 147 Ca 0.02 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.41 1yhq h GLU 147 Cb 1.13 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.79 1yhq h GLU 147 CO 0.12 0.00 -1.41 0.45 -1.16 0.00 0.00 179.01 177.00 1yhq h HIS 148 N 0.00 0.65 -0.06 4.33 3.86 -1.83 -2.86 115.15 119.24 1yhq h HIS 148 Ca 0.00 -0.48 -0.15 0.00 -1.16 0.00 0.00 60.37 58.59 1yhq h HIS 148 Cb 0.63 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.06 1yhq h HIS 148 CO 0.00 1.42 -0.61 -0.24 0.86 0.00 0.00 177.93 179.36 1yhq h VAL 149 N 0.10 1.39 0.00 2.45 3.04 -1.46 -1.64 116.25 120.13 1yhq h VAL 149 Ca -0.21 -2.00 -0.07 0.00 -1.01 0.00 0.00 66.70 63.40 1yhq h VAL 149 Cb 2.05 2.02 -0.01 0.00 -2.01 0.00 0.00 31.29 33.34 1yhq h VAL 149 CO 0.22 0.59 -0.36 0.11 -1.01 0.00 0.00 177.57 177.12 1yhq h LYS 150 N 0.17 0.00 0.03 4.17 1.57 -1.54 -2.09 116.57 118.88 1yhq h LYS 150 Ca -0.01 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.55 1yhq h LYS 150 Cb 1.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 1yhq h LYS 150 CO 0.09 0.36 -1.02 1.49 -0.57 0.00 0.00 179.45 179.79 1yhq h GLU 151 N 0.00 0.10 -0.54 3.15 4.57 -1.22 -2.53 114.58 118.11 1yhq h GLU 151 Ca -0.00 -0.16 -0.12 0.00 -1.18 0.00 0.00 59.36 57.90 1yhq h GLU 151 Cb 0.65 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 1yhq h GLU 151 CO 0.05 1.03 -0.13 0.00 -1.18 0.00 0.00 179.01 178.78 1yhq h ALA 152 N 0.90 0.74 -0.33 2.92 0.00 -0.91 -2.79 119.26 119.79 1yhq h ALA 152 Ca -0.05 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.37 1yhq h ALA 152 Cb 1.75 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1yhq h ALA 152 CO 0.15 0.68 -0.32 0.74 0.00 0.00 0.00 179.25 180.49 1yhq h PHE 153 N 0.92 0.85 -0.99 0.00 0.05 -1.41 -1.41 116.94 114.96 1yhq h PHE 153 Ca 0.14 -0.23 0.04 0.00 3.82 0.00 0.00 57.97 61.74 1yhq h PHE 153 Cb 0.71 -0.19 -0.06 0.00 2.00 0.00 0.00 35.95 38.41 1yhq h PHE 153 CO 0.05 0.96 0.65 -0.09 -0.18 0.00 0.00 178.31 179.69 1yhq h ARG 154 N 0.62 1.21 0.00 1.51 2.43 -1.29 0.44 114.38 119.30 1yhq h ARG 154 Ca 0.07 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 1yhq h ARG 154 Cb 0.85 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 1yhq h ARG 154 CO 0.07 0.80 -0.62 0.00 -1.51 0.00 0.00 179.97 178.72 1yhq h ARG 155 N 1.25 0.00 -0.15 0.20 3.08 -1.25 -3.24 114.38 114.27 1yhq h ARG 155 Ca 0.40 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.36 1yhq h ARG 155 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 1yhq h ARG 155 CO -0.13 0.62 -0.24 0.00 -1.07 0.00 0.00 179.97 179.15 1yhq h ALA 156 N 1.38 0.23 0.00 0.04 0.00 -0.00 -3.12 119.26 117.80 1yhq h ALA 156 Ca -0.01 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1yhq h ALA 156 Cb 1.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1yhq h ALA 156 CO 0.08 0.20 0.00 2.48 0.00 0.00 0.00 179.25 182.01 1yhq n TYR 157 N -4.45 0.00 1.31 0.00 0.18 -0.01 -1.70 117.16 112.50 1yhq n TYR 157 Ca -0.06 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.85 1yhq n TYR 157 Cb 0.43 -0.02 0.42 0.00 -0.38 0.00 0.00 39.34 39.79 1yhq n TYR 157 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1yhq n ASN 158 N -1.02 1.84 -0.01 9.48 3.02 -1.18 -3.98 115.26 123.41 1yhq n ASN 158 Ca 0.15 -1.64 0.01 0.00 -0.03 0.00 0.00 54.58 53.07 1yhq n ASN 158 Cb 0.08 -0.03 0.01 0.00 -0.61 0.00 0.00 39.78 39.22 1yhq n ASN 158 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1yhq n LYS 159 N 0.44 2.31 -4.44 3.52 5.02 -0.69 -5.02 118.16 119.31 1yhq n LYS 159 Ca 0.18 -1.36 -0.21 0.00 -2.02 0.00 0.00 58.31 54.90 1yhq n LYS 159 Cb 0.40 -0.92 -0.14 0.00 -0.02 0.00 0.00 35.03 34.34 1yhq n LYS 159 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1yhq s ILE 160 N -0.89 1.18 0.18 -0.18 -4.36 -1.25 -4.70 121.20 111.17 1yhq s ILE 160 Ca 0.02 -0.95 -0.28 0.00 -0.26 0.00 0.00 60.65 59.18 1yhq s ILE 160 Cb 0.01 -1.04 0.00 0.00 1.25 0.00 0.00 42.46 42.68 1yhq s ILE 160 CO 0.00 0.08 1.54 0.41 0.24 0.00 0.00 174.94 177.21 1yhq n THR 161 N 2.04 -0.64 -1.59 8.37 -1.04 -1.26 -4.79 114.28 115.37 1yhq n THR 161 Ca -0.17 2.40 -0.31 0.00 -2.04 0.00 0.00 64.05 63.93 1yhq n THR 161 Cb 0.55 -3.01 0.05 0.00 -1.82 0.00 0.00 70.33 66.09 1yhq n THR 161 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1yhq s PRO 162 N -5.60 2.95 0.50 -2.82 0.04 -1.26 -5.06 135.00 123.76 1yhq s PRO 162 Ca -0.12 0.93 -0.18 0.00 0.04 0.00 0.00 61.00 61.67 1yhq s PRO 162 Cb 0.13 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.60 1yhq s PRO 162 CO 0.64 -1.08 1.00 -1.12 0.04 0.00 0.00 177.00 176.48 1yhq s SER 163 N -3.82 6.45 0.27 6.66 0.01 -1.26 -4.90 113.70 117.11 1yhq s SER 163 Ca 0.58 1.73 0.02 0.00 1.31 0.00 0.00 55.95 59.59 1yhq s SER 163 Cb -0.14 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 1yhq s SER 163 CO 0.55 -0.70 0.11 0.00 0.41 0.00 0.00 173.24 173.61 1yhq s ARG 165 N -3.99 2.14 -0.47 0.00 0.52 0.06 -4.93 118.95 112.27 1yhq s ARG 165 Ca 0.37 -0.79 -0.16 0.00 -0.52 0.00 0.00 55.73 54.63 1yhq s ARG 165 Cb 0.07 -1.88 0.06 0.00 0.52 0.00 0.00 34.95 33.72 1yhq s ARG 165 CO 0.14 0.37 0.43 0.42 0.02 0.00 0.00 175.30 176.68 1yhq s ILE 166 N -0.20 5.15 -0.13 1.52 1.01 -1.26 -0.20 121.20 127.09 1yhq s ILE 166 Ca -0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 60.65 59.79 1yhq s ILE 166 Cb -0.12 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 1yhq s ILE 166 CO 0.02 -0.57 -0.03 -0.75 0.00 0.00 0.00 174.94 173.61 1yhq s LYS 167 N 1.89 3.45 -0.40 2.79 2.20 0.47 -4.96 119.74 125.19 1yhq s LYS 167 Ca 0.07 -0.49 -0.22 0.00 -0.36 0.00 0.00 55.97 54.97 1yhq s LYS 167 Cb -0.22 -2.87 0.01 0.00 -1.51 0.00 0.00 37.83 33.25 1yhq s LYS 167 CO 0.09 0.38 0.72 0.08 -0.36 0.00 0.00 175.35 176.26 1yhq s VAL 168 N -0.01 4.76 0.00 4.02 1.01 -1.26 -0.42 120.40 128.50 1yhq s VAL 168 Ca 0.01 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.56 1yhq s VAL 168 Cb -0.13 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1yhq s VAL 168 CO 0.02 -0.51 0.00 1.21 0.00 0.00 0.00 175.10 175.83 1yhq n GLU 169 N 6.38 0.00 -2.55 2.72 4.07 0.11 -4.75 120.64 126.62 1yhq n GLU 169 Ca 0.01 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.70 1yhq n GLU 169 Cb 0.48 -0.14 -0.03 0.00 -0.06 0.00 0.00 31.44 31.70 1yhq n GLU 169 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1yhq s ARG 170 N 0.00 3.27 0.00 5.31 0.52 -1.19 -4.88 118.95 121.98 1yhq s ARG 170 Ca 0.00 -0.41 0.00 0.00 -0.52 0.00 0.00 55.73 54.80 1yhq s ARG 170 Cb 0.00 -4.40 0.00 0.00 0.52 0.00 0.00 34.95 31.07 1yhq s ARG 170 CO 0.00 -2.16 0.00 0.41 0.02 0.00 0.00 175.30 173.57 1yhq n GLY 171 N 5.67 1.92 0.12 -3.53 0.00 -1.26 -1.22 105.19 106.88 1yhq n GLY 171 Ca 0.09 0.37 0.01 0.00 0.00 0.00 0.00 46.02 46.49 1yhq n GLY 171 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yhq n GLU 172 N 0.00 0.70 -2.59 1.61 1.02 -1.26 -4.96 120.64 115.16 1yhq n GLU 172 Ca 0.00 -0.99 -0.42 0.00 -0.02 0.00 0.00 57.16 55.73 1yhq n GLU 172 Cb 0.00 -0.68 -0.02 0.00 -0.02 0.00 0.00 31.44 30.71 1yhq n GLU 172 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1yhq s GLU 173 N -0.45 3.69 0.00 3.49 8.01 -1.26 -5.28 118.70 126.90 1yhq s GLU 173 Ca 0.03 -1.38 0.00 0.00 0.01 0.00 0.00 54.97 53.63 1yhq s GLU 173 Cb 0.02 -5.38 0.00 0.00 -4.31 0.00 0.00 34.13 24.46 1yhq s GLU 173 CO 0.00 -2.20 0.44 1.28 0.01 0.00 0.00 175.26 174.79