#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq h HIS 11 N 0.00 0.72 -0.96 2.97 2.07 -2.04 -3.35 115.15 114.56 1yhq h HIS 11 Ca 0.00 -0.53 0.20 0.00 -2.85 0.00 0.00 60.37 57.19 1yhq h HIS 11 Cb 0.00 -0.03 -0.11 0.00 2.57 0.00 0.00 27.41 29.84 1yhq h HIS 11 CO 0.00 1.53 0.54 1.49 -3.07 0.00 0.00 177.93 178.42 1yhq h GLU 12 N -0.07 0.62 -0.86 5.12 4.81 -2.05 0.16 114.58 122.31 1yhq h GLU 12 Ca -0.26 -0.04 -0.22 0.00 -0.13 0.00 0.00 59.36 58.71 1yhq h GLU 12 Cb 1.96 -0.14 -0.13 0.00 0.63 0.00 0.00 28.75 31.07 1yhq h GLU 12 CO 0.18 0.41 0.28 -1.33 -0.73 0.00 0.00 179.01 177.82 1yhq n MET 13 N -4.86 2.86 0.00 1.92 2.81 -1.26 -3.98 117.12 114.61 1yhq n MET 13 Ca 0.23 -2.35 0.00 0.00 -1.81 0.00 0.00 57.70 53.77 1yhq n MET 13 Cb 0.60 -1.99 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 1yhq n MET 13 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1yhq n ARG 14 N -0.21 3.82 -2.39 0.03 5.12 0.44 -4.45 116.66 119.03 1yhq n ARG 14 Ca 0.35 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.84 1yhq n ARG 14 Cb 1.21 -0.47 -0.03 0.00 -1.16 0.00 0.00 32.46 32.02 1yhq n ARG 14 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1yhq s GLU 15 N -0.36 4.30 1.01 5.56 -1.05 -0.47 -4.84 118.70 122.85 1yhq s GLU 15 Ca 0.00 1.75 -0.22 0.00 -0.15 0.00 0.00 54.97 56.35 1yhq s GLU 15 Cb 0.00 -3.63 -0.12 0.00 -0.44 0.00 0.00 34.13 29.94 1yhq s GLU 15 CO 0.00 -0.56 -0.94 -2.30 0.95 0.00 0.00 175.26 172.42 1yhq n PRO 16 N 5.68 -0.24 -3.83 -4.83 -0.02 -1.26 -4.54 135.00 125.96 1yhq n PRO 16 Ca 0.12 -0.06 -0.06 0.00 -2.02 0.00 0.00 63.50 61.48 1yhq n PRO 16 Cb 0.45 -1.17 -0.02 0.00 -0.02 0.00 0.00 33.50 32.75 1yhq n PRO 16 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1yhq s ARG 17 N -2.33 1.60 -0.33 -0.52 1.70 -0.66 -4.97 118.95 113.44 1yhq s ARG 17 Ca 0.42 -0.89 -0.10 0.00 -0.47 0.00 0.00 55.73 54.69 1yhq s ARG 17 Cb -0.04 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.88 1yhq s ARG 17 CO 0.72 -0.74 0.18 0.42 -1.08 0.00 0.00 175.30 174.80 1yhq s ILE 18 N -3.72 4.70 0.02 4.99 1.01 -1.26 -2.30 121.20 124.64 1yhq s ILE 18 Ca 0.11 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 1yhq s ILE 18 Cb -0.05 -3.46 -0.32 0.00 0.01 0.00 0.00 42.46 38.65 1yhq s ILE 18 CO 0.05 -0.03 0.95 -0.08 0.00 0.00 0.00 174.94 175.84 1yhq h GLU 19 N 8.40 0.42 -1.68 2.79 4.81 -1.39 -3.41 114.58 124.50 1yhq h GLU 19 Ca -0.30 -0.71 0.04 0.00 -0.13 0.00 0.00 59.36 58.26 1yhq h GLU 19 Cb 1.14 0.26 -0.22 0.00 0.63 0.00 0.00 28.75 30.56 1yhq h GLU 19 CO 0.63 1.33 0.44 -1.59 -0.73 0.00 0.00 179.01 179.09 1yhq s LYS 20 N -2.61 0.72 -0.24 1.92 -2.85 -1.20 -4.62 119.74 110.85 1yhq s LYS 20 Ca -0.09 0.20 0.02 0.00 -1.00 0.00 0.00 55.97 55.10 1yhq s LYS 20 Cb 0.05 0.34 0.05 0.00 -2.06 0.00 0.00 37.83 36.21 1yhq s LYS 20 CO 0.90 -0.22 -0.11 0.08 0.10 0.00 0.00 175.35 176.10 1yhq s VAL 21 N -1.06 1.97 -0.47 1.79 1.01 -0.00 -0.28 120.40 123.37 1yhq s VAL 21 Ca -0.04 -1.38 -0.15 0.00 0.00 0.00 0.00 61.98 60.42 1yhq s VAL 21 Cb -0.01 -2.06 0.08 0.00 0.00 0.00 0.00 36.38 34.39 1yhq s VAL 21 CO 0.04 0.07 0.38 -0.69 0.00 0.00 0.00 175.10 174.90 1yhq s VAL 22 N 1.22 5.09 -0.24 2.92 1.01 -0.06 -0.50 120.40 129.85 1yhq s VAL 22 Ca -0.05 -1.14 -0.14 0.00 0.00 0.00 0.00 61.98 60.65 1yhq s VAL 22 Cb -0.18 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1yhq s VAL 22 CO -0.07 -0.59 0.33 0.68 0.00 0.00 0.00 175.10 175.46 1yhq s VAL 23 N 1.61 5.23 -0.00 2.92 -7.23 0.02 -2.02 120.40 120.92 1yhq s VAL 23 Ca 0.04 0.53 -0.12 0.00 -1.81 0.00 0.00 61.98 60.62 1yhq s VAL 23 Cb -0.24 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 33.05 1yhq s VAL 23 CO 0.06 0.24 0.24 -2.28 -0.31 0.00 0.00 175.10 173.04 1yhq s HIS 24 N 1.56 -0.08 -0.30 2.82 5.04 -0.84 0.05 115.29 123.54 1yhq s HIS 24 Ca 0.15 0.08 0.02 0.00 -1.54 0.00 0.00 55.06 53.77 1yhq s HIS 24 Cb -0.15 0.04 0.08 0.00 0.04 0.00 0.00 32.58 32.59 1yhq s HIS 24 CO 0.08 -0.36 0.00 -1.64 -2.34 0.00 0.00 174.74 170.48 1yhq s MET 25 N -1.48 1.56 -1.07 2.88 -1.94 -0.28 -0.93 119.30 118.03 1yhq s MET 25 Ca -0.13 -1.48 -0.21 0.00 -1.71 0.00 0.00 55.69 52.16 1yhq s MET 25 Cb -0.06 -2.85 0.07 0.00 2.01 0.00 0.00 34.83 34.00 1yhq s MET 25 CO 0.02 -0.80 1.46 0.20 -0.01 0.00 0.00 175.02 175.90 1yhq s GLY 26 N 1.14 1.49 0.00 -0.03 0.00 -1.26 -2.92 107.32 105.73 1yhq s GLY 26 Ca 0.03 -2.52 0.00 0.00 0.00 0.00 0.00 44.72 42.23 1yhq s GLY 26 CO -0.09 2.57 0.00 1.39 0.00 0.00 0.00 173.10 176.97 1yhq n ILE 27 N 6.49 0.00 0.00 0.90 5.41 -0.61 -4.97 119.36 126.58 1yhq n ILE 27 Ca 0.35 0.01 0.00 0.00 1.00 0.00 0.00 62.75 64.11 1yhq n ILE 27 Cb 0.49 -0.22 0.00 0.00 -0.71 0.00 0.00 39.64 39.21 1yhq n ILE 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1yhq n GLY 28 N 3.11 -0.04 0.00 7.39 0.00 0.15 -4.94 105.19 110.86 1yhq n GLY 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1yhq n GLY 28 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1yhq n HIS 29 N 0.00 0.00 0.00 1.61 -0.00 -1.24 -4.89 115.22 110.70 1yhq n HIS 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1yhq n HIS 29 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1yhq n HIS 29 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1yhq n ALA 35 N 0.00 0.00 0.00 1.59 0.00 -1.26 -4.79 120.51 116.05 1yhq n ALA 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yhq n ALA 35 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yhq n ALA 35 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1yhq n ASN 36 N 0.00 0.00 0.09 0.00 6.94 -1.26 -1.03 115.26 120.00 1yhq n ASN 36 Ca 0.00 0.36 0.13 0.00 -0.02 0.00 0.00 54.58 55.04 1yhq n ASN 36 Cb 0.00 -0.36 0.34 0.00 -2.36 0.00 0.00 39.78 37.40 1yhq n ASN 36 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1yhq n ALA 37 N -1.35 2.50 -0.24 -2.53 0.00 -1.26 -3.95 120.51 113.68 1yhq n ALA 37 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 53.44 53.37 1yhq n ALA 37 Cb 0.02 -1.37 0.15 0.00 0.00 0.00 0.00 19.45 18.25 1yhq n ALA 37 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1yhq h GLU 38 N 0.00 0.45 -0.64 0.00 5.08 -1.51 -2.86 114.58 115.10 1yhq h GLU 38 Ca 0.00 -0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.47 1yhq h GLU 38 Cb 0.73 -0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.77 1yhq h GLU 38 CO 0.00 0.30 -0.08 -0.44 -1.00 0.00 0.00 179.01 177.79 1yhq h ASP 39 N 0.46 -0.44 -0.35 1.42 3.32 -1.81 -1.72 116.42 117.30 1yhq h ASP 39 Ca 0.37 0.18 -0.04 0.00 0.02 0.00 0.00 57.03 57.56 1yhq h ASP 39 Cb 0.50 0.34 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 1yhq h ASP 39 CO -0.35 -0.17 0.08 0.16 -1.72 0.00 0.00 179.24 177.24 1yhq h ILE 40 N 0.05 1.22 -0.74 0.35 3.07 -1.77 -2.51 117.51 117.18 1yhq h ILE 40 Ca 0.32 -0.77 0.04 0.00 1.55 0.00 0.00 64.86 66.01 1yhq h ILE 40 Cb 0.52 1.05 -0.04 0.00 -0.27 0.00 0.00 36.82 38.08 1yhq h ILE 40 CO -0.61 0.26 0.49 -0.07 -1.05 0.00 0.00 178.15 177.17 1yhq h LEU 41 N 0.42 0.77 -0.92 0.16 3.38 -1.49 -0.64 115.31 116.98 1yhq h LEU 41 Ca 0.11 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1yhq h LEU 41 Cb 0.31 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1yhq h LEU 41 CO 0.00 0.53 0.18 1.23 0.09 0.00 0.00 178.44 180.47 1yhq h GLY 42 N 0.89 1.04 1.56 0.83 0.00 -0.96 -1.76 103.07 104.67 1yhq h GLY 42 Ca 0.30 -0.60 -0.28 0.00 0.00 0.00 0.00 47.33 46.75 1yhq h GLY 42 CO -0.09 0.56 -1.29 0.83 0.00 0.00 0.00 176.54 176.55 1yhq h GLU 43 N 0.93 0.27 0.00 4.80 5.08 -0.95 -1.66 114.58 123.05 1yhq h GLU 43 Ca 0.20 -0.46 -0.06 0.00 -1.00 0.00 0.00 59.36 58.05 1yhq h GLU 43 Cb 0.29 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1yhq h GLU 43 CO -0.01 1.20 -0.29 0.97 -1.00 0.00 0.00 179.01 179.88 1yhq h ILE 44 N 0.07 0.53 0.01 3.13 2.10 -1.12 -3.36 117.51 118.86 1yhq h ILE 44 Ca -0.15 -1.61 -0.42 0.00 1.08 0.00 0.00 64.86 63.75 1yhq h ILE 44 Cb 1.98 2.15 -0.06 0.00 -1.09 0.00 0.00 36.82 39.80 1yhq h ILE 44 CO 0.20 0.29 -2.41 0.35 -1.08 0.00 0.00 178.15 175.50 1yhq n THR 45 N -3.22 1.53 0.00 2.19 -2.24 -0.67 -4.93 114.28 106.95 1yhq n THR 45 Ca 0.02 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1yhq n THR 45 Cb 0.61 -1.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.08 1yhq n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yhq n GLY 46 N 1.58 0.89 3.26 3.38 0.00 -0.63 -4.90 105.19 108.76 1yhq n GLY 46 Ca -0.50 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.43 1yhq n GLY 46 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1yhq s GLN 47 N -0.32 1.06 0.51 1.61 -2.07 -1.23 -5.03 119.66 114.20 1yhq s GLN 47 Ca 0.00 -1.29 -0.21 0.00 -1.82 0.00 0.00 55.36 52.04 1yhq s GLN 47 Cb 0.00 0.32 -0.09 0.00 -1.09 0.00 0.00 33.01 32.15 1yhq s GLN 47 CO 0.00 -0.36 0.81 -1.33 -1.32 0.00 0.00 175.29 173.09 1yhq n MET 48 N -0.17 0.89 -2.83 9.60 2.81 -1.26 -4.44 117.12 121.73 1yhq n MET 48 Ca -0.06 0.33 -0.20 0.00 -1.81 0.00 0.00 57.70 55.96 1yhq n MET 48 Cb 0.63 -1.92 0.04 0.00 -0.71 0.00 0.00 33.22 31.26 1yhq n MET 48 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1yhq s PRO 49 N -2.19 2.53 -0.05 0.03 0.04 -1.26 -4.83 135.00 129.26 1yhq s PRO 49 Ca 0.68 -1.11 0.02 0.00 0.04 0.00 0.00 61.00 60.64 1yhq s PRO 49 Cb -0.49 -2.60 0.01 0.00 0.04 0.00 0.00 34.50 31.47 1yhq s PRO 49 CO 0.53 -0.64 -0.10 0.08 0.04 0.00 0.00 177.00 176.91 1yhq s VAL 50 N -2.63 0.90 0.94 -0.36 1.01 0.00 -4.93 120.40 115.33 1yhq s VAL 50 Ca 0.58 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.09 1yhq s VAL 50 Cb -0.09 -0.84 0.16 0.00 0.00 0.00 0.00 36.38 35.61 1yhq s VAL 50 CO 0.37 0.30 1.11 -0.13 0.00 0.00 0.00 175.10 176.75 1yhq s ARG 51 N 0.60 0.86 -0.15 2.72 1.81 -1.26 -1.36 118.95 122.16 1yhq s ARG 51 Ca -0.11 1.32 -0.02 0.00 -1.72 0.00 0.00 55.73 55.21 1yhq s ARG 51 Cb -0.14 -1.72 0.05 0.00 -0.45 0.00 0.00 34.95 32.68 1yhq s ARG 51 CO 0.02 -2.67 0.00 0.99 -0.68 0.00 0.00 175.30 172.97 1yhq s THR 52 N -2.67 0.62 0.75 0.02 2.01 0.39 -4.76 115.64 112.01 1yhq s THR 52 Ca 0.66 -0.37 -0.07 0.00 0.31 0.00 0.00 61.69 62.22 1yhq s THR 52 Cb -0.22 -0.94 0.10 0.00 0.01 0.00 0.00 72.50 71.45 1yhq s THR 52 CO 0.59 0.02 1.06 -0.54 -0.69 0.00 0.00 174.62 175.05 1yhq s LYS 53 N 1.84 1.79 0.30 4.92 1.02 -1.26 -1.27 119.74 127.08 1yhq s LYS 53 Ca 0.01 -0.52 0.03 0.00 0.02 0.00 0.00 55.97 55.51 1yhq s LYS 53 Cb -0.15 -2.16 -0.06 0.00 -0.52 0.00 0.00 37.83 34.94 1yhq s LYS 53 CO -0.07 -1.49 0.07 0.00 -0.92 0.00 0.00 175.35 172.95 1yhq s ALA 54 N -3.32 2.15 0.13 5.17 0.00 -1.21 -4.89 121.76 119.79 1yhq s ALA 54 Ca 0.64 -1.99 0.07 0.00 0.00 0.00 0.00 51.96 50.68 1yhq s ALA 54 Cb -0.08 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 1yhq s ALA 54 CO 0.46 -0.36 -0.15 0.15 0.00 0.00 0.00 175.76 175.85 1yhq s LYS 55 N -3.94 1.09 0.39 0.00 1.02 -1.26 -3.95 119.74 113.08 1yhq s LYS 55 Ca 0.37 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 55.08 1yhq s LYS 55 Cb 0.08 -1.02 0.00 0.00 -0.52 0.00 0.00 37.83 36.37 1yhq s LYS 55 CO 0.15 0.20 0.00 0.54 -0.92 0.00 0.00 175.35 175.32 1yhq n ARG 56 N 0.49 -4.63 -2.57 1.68 1.74 -1.26 -4.94 116.66 107.18 1yhq n ARG 56 Ca -0.15 3.36 -0.36 0.00 -0.77 0.00 0.00 57.85 59.93 1yhq n ARG 56 Cb 0.57 -3.73 -0.04 0.00 -1.02 0.00 0.00 32.46 28.24 1yhq n ARG 56 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1yhq s THR 57 N -2.28 3.78 0.03 0.55 2.01 -1.26 -4.91 115.64 113.56 1yhq s THR 57 Ca 0.00 1.32 0.04 0.00 0.31 0.00 0.00 61.69 63.36 1yhq s THR 57 Cb 0.00 -3.66 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 1yhq s THR 57 CO 0.00 -0.03 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.10 1yhq s VAL 58 N -1.72 0.84 0.28 3.82 1.01 0.56 -4.95 120.40 120.25 1yhq s VAL 58 Ca 0.59 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1yhq s VAL 58 Cb -0.21 -0.78 0.28 0.00 0.00 0.00 0.00 36.38 35.67 1yhq s VAL 58 CO 0.26 -0.04 1.84 1.23 0.00 0.00 0.00 175.10 178.39 1yhq h GLY 59 N 5.10 1.62 -6.78 4.51 0.00 -1.98 -2.43 103.07 103.11 1yhq h GLY 59 Ca -0.35 -0.43 -0.61 0.00 0.00 0.00 0.00 47.33 45.93 1yhq h GLY 59 CO 0.45 0.19 1.75 -1.84 0.00 0.00 0.00 176.54 177.09 1yhq n GLU 60 N -4.60 0.63 -3.13 4.80 0.28 -1.26 -4.36 120.64 113.00 1yhq n GLU 60 Ca 0.18 -1.36 -0.08 0.00 -0.16 0.00 0.00 57.16 55.74 1yhq n GLU 60 Cb 0.32 -2.68 -0.02 0.00 1.43 0.00 0.00 31.44 30.49 1yhq n GLU 60 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1yhq n PHE 61 N 8.44 -0.30 -2.98 -1.84 -0.00 -1.24 -4.77 117.46 114.76 1yhq n PHE 61 Ca 0.48 0.11 -0.19 0.00 -0.00 0.00 0.00 57.45 57.86 1yhq n PHE 61 Cb 0.41 -0.66 -0.02 0.00 -0.00 0.00 0.00 39.48 39.21 1yhq n PHE 61 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1yhq n ASP 62 N -0.31 1.97 0.04 -2.13 2.03 -0.92 -4.88 116.55 112.35 1yhq n ASP 62 Ca -0.07 -3.14 -0.19 0.00 0.52 0.00 0.00 54.79 51.92 1yhq n ASP 62 Cb 0.16 -0.58 -0.14 0.00 -0.72 0.00 0.00 41.12 39.84 1yhq n ASP 62 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 1yhq h ILE 63 N 1.91 0.88 -1.69 5.18 3.07 -1.86 0.16 117.51 125.17 1yhq h ILE 63 Ca 0.08 -2.56 -0.61 0.00 1.55 0.00 0.00 64.86 63.32 1yhq h ILE 63 Cb 0.92 2.64 -0.01 0.00 -0.27 0.00 0.00 36.82 40.10 1yhq h ILE 63 CO 0.59 0.82 1.48 -1.14 -1.05 0.00 0.00 178.15 178.85 1yhq n ARG 64 N -3.45 1.65 0.00 0.16 0.63 -1.26 -4.53 116.66 109.86 1yhq n ARG 64 Ca -0.24 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 1yhq n ARG 64 Cb 1.05 -3.01 0.00 0.00 0.45 0.00 0.00 32.46 30.95 1yhq n ARG 64 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1yhq n GLU 65 N 8.61 0.00 -2.51 -0.14 2.13 -1.26 -4.44 120.64 123.03 1yhq n GLU 65 Ca 0.34 0.04 -0.43 0.00 0.66 0.00 0.00 57.16 57.77 1yhq n GLU 65 Cb 0.39 -0.74 -0.02 0.00 0.27 0.00 0.00 31.44 31.33 1yhq n GLU 65 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1yhq s GLY 66 N 0.00 1.30 -0.29 8.31 0.00 -1.25 -3.31 107.32 112.08 1yhq s GLY 66 Ca 0.00 -0.22 -0.26 0.00 0.00 0.00 0.00 44.72 44.24 1yhq s GLY 66 CO 0.00 2.52 1.39 0.51 0.00 0.00 0.00 173.10 177.52 1yhq s ASP 67 N 2.77 -0.07 0.17 1.64 -4.77 -1.26 -4.95 116.67 110.19 1yhq s ASP 67 Ca 0.53 0.12 -0.32 0.00 -3.30 0.00 0.00 52.55 49.58 1yhq s ASP 67 Cb -0.11 0.12 -0.17 0.00 -1.09 0.00 0.00 42.92 41.67 1yhq s ASP 67 CO 0.28 -0.04 0.90 -2.65 0.70 0.00 0.00 175.17 174.37 1yhq n PRO 68 N 1.28 0.61 0.00 2.11 -0.02 -1.26 -3.96 135.00 133.75 1yhq n PRO 68 Ca -0.07 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1yhq n PRO 68 Cb 0.57 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 1yhq n PRO 68 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1yhq n ILE 69 N 0.78 0.00 -3.30 4.25 5.41 -0.39 -4.05 119.36 122.05 1yhq n ILE 69 Ca 0.16 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.90 1yhq n ILE 69 Cb 0.23 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.16 1yhq n ILE 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1yhq n GLY 70 N 0.03 2.33 3.42 7.39 0.00 -1.17 0.29 105.19 117.49 1yhq n GLY 70 Ca 0.00 -1.18 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 1yhq n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yhq s ALA 71 N -1.35 -1.42 0.20 4.61 0.00 -1.15 -0.46 121.76 122.20 1yhq s ALA 71 Ca 0.02 0.76 -0.09 0.00 0.00 0.00 0.00 51.96 52.65 1yhq s ALA 71 Cb -0.00 0.29 -0.01 0.00 0.00 0.00 0.00 23.12 23.39 1yhq s ALA 71 CO 0.02 -0.47 0.32 -1.59 0.00 0.00 0.00 175.76 174.04 1yhq s LYS 72 N -2.12 1.30 -0.10 0.00 -2.85 -0.47 -1.13 119.74 114.38 1yhq s LYS 72 Ca -0.07 -1.29 -0.05 0.00 -1.00 0.00 0.00 55.97 53.57 1yhq s LYS 72 Cb -0.01 0.39 0.05 0.00 -2.06 0.00 0.00 37.83 36.20 1yhq s LYS 72 CO 0.01 -0.49 0.23 0.08 0.10 0.00 0.00 175.35 175.28 1yhq s VAL 73 N -4.02 -0.13 -0.31 1.79 1.01 0.11 -0.82 120.40 118.03 1yhq s VAL 73 Ca 0.23 0.19 -0.10 0.00 0.00 0.00 0.00 61.98 62.30 1yhq s VAL 73 Cb 0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 36.03 1yhq s VAL 73 CO 0.05 0.08 0.16 0.42 0.00 0.00 0.00 175.10 175.81 1yhq s THR 74 N 1.53 4.67 -0.14 3.92 -4.23 -1.26 -0.80 115.64 119.33 1yhq s THR 74 Ca -0.07 -0.39 -0.07 0.00 -1.18 0.00 0.00 61.69 59.98 1yhq s THR 74 Cb -0.11 -3.38 -0.04 0.00 1.34 0.00 0.00 72.50 70.31 1yhq s THR 74 CO -0.08 0.07 0.12 -0.76 -0.54 0.00 0.00 174.62 173.43 1yhq s LEU 75 N 1.63 4.27 -0.01 4.79 1.43 0.35 -4.90 118.68 126.23 1yhq s LEU 75 Ca 0.05 0.38 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 1yhq s LEU 75 Cb -0.17 -2.05 -0.00 0.00 0.03 0.00 0.00 46.19 43.99 1yhq s LEU 75 CO 0.07 0.35 -0.08 -0.13 0.23 0.00 0.00 176.35 176.78 1yhq s ARG 76 N -0.65 0.70 5.89 1.70 0.52 -1.26 -0.82 118.95 125.02 1yhq s ARG 76 Ca 0.13 -0.28 0.00 0.00 -0.52 0.00 0.00 55.73 55.06 1yhq s ARG 76 Cb -0.12 -0.68 0.00 0.00 0.52 0.00 0.00 34.95 34.68 1yhq s ARG 76 CO 0.02 0.15 0.00 -0.25 0.02 0.00 0.00 175.30 175.24 1yhq n ASP 77 N 3.01 0.00 -0.06 0.23 8.00 -1.26 -3.64 116.55 122.84 1yhq n ASP 77 Ca -0.15 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.28 1yhq n ASP 77 Cb 0.56 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.65 1yhq n ASP 77 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1yhq h GLU 78 N 0.00 -0.13 -1.20 -1.24 5.08 -1.98 -0.72 114.58 114.38 1yhq h GLU 78 Ca 0.00 0.01 0.35 0.00 -1.00 0.00 0.00 59.36 58.72 1yhq h GLU 78 Cb 0.00 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 1yhq h GLU 78 CO 0.00 -0.09 0.94 0.52 -1.00 0.00 0.00 179.01 179.38 1yhq h MET 79 N -0.14 0.00 0.03 2.33 2.86 -1.94 0.48 114.93 118.55 1yhq h MET 79 Ca 0.14 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.66 1yhq h MET 79 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1yhq h MET 79 CO -0.35 0.00 -0.64 0.00 1.06 0.00 0.00 176.91 176.98 1yhq h ALA 80 N 1.26 0.09 0.04 6.32 0.00 -1.31 -3.19 119.26 122.47 1yhq h ALA 80 Ca 0.57 -0.81 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1yhq h ALA 80 Cb 2.44 0.29 0.00 0.00 0.00 0.00 0.00 17.79 20.52 1yhq h ALA 80 CO -0.01 0.36 -0.02 0.93 0.00 0.00 0.00 179.25 180.51 1yhq h GLU 81 N -0.85 -0.05 0.00 0.00 5.08 -0.36 0.17 114.58 118.58 1yhq h GLU 81 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1yhq h GLU 81 Cb 1.26 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1yhq h GLU 81 CO -0.04 0.14 0.03 0.93 -1.00 0.00 0.00 179.01 179.07 1yhq h GLU 82 N -0.22 0.00 0.00 2.33 5.08 -0.31 0.91 114.58 122.36 1yhq h GLU 82 Ca -0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 1yhq h GLU 82 Cb 0.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1yhq h GLU 82 CO 0.01 0.00 -1.25 0.35 -1.00 0.00 0.00 179.01 177.11 1yhq h PHE 83 N 0.00 0.00 -0.80 4.33 3.57 -1.34 -3.39 116.94 119.31 1yhq h PHE 83 Ca 0.00 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1yhq h PHE 83 Cb 0.07 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1yhq h PHE 83 CO 0.00 1.49 0.53 -0.07 -2.23 0.00 0.00 178.31 178.03 1yhq h LEU 84 N -1.00 0.89 -1.50 0.59 3.38 0.23 0.48 115.31 118.38 1yhq h LEU 84 Ca -0.35 -0.02 0.22 0.00 0.09 0.00 0.00 57.88 57.83 1yhq h LEU 84 Cb 1.31 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 1yhq h LEU 84 CO -0.21 0.63 0.62 1.56 0.09 0.00 0.00 178.44 181.13 1yhq h GLN 85 N 1.04 0.38 -0.02 1.13 4.20 -1.04 0.30 115.11 121.10 1yhq h GLN 85 Ca 0.31 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.99 1yhq h GLN 85 Cb -0.05 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1yhq h GLN 85 CO -0.08 0.25 -0.04 0.25 -0.67 0.00 0.00 178.83 178.54 1yhq n THR 86 N -4.52 0.00 -0.14 -0.54 -2.24 -0.82 -4.49 114.28 101.53 1yhq n THR 86 Ca 0.21 -0.48 -0.28 0.00 -2.27 0.00 0.00 64.05 61.22 1yhq n THR 86 Cb 0.76 1.28 -0.10 0.00 -2.10 0.00 0.00 70.33 70.17 1yhq n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yhq n ALA 87 N 0.67 1.15 -0.19 6.98 0.00 0.14 -4.55 120.51 124.72 1yhq n ALA 87 Ca 0.08 -1.05 -0.00 0.00 0.00 0.00 0.00 53.44 52.47 1yhq n ALA 87 Cb 0.35 0.08 0.10 0.00 0.00 0.00 0.00 19.45 19.99 1yhq n ALA 87 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1yhq h LEU 88 N -1.00 0.05 0.00 0.00 3.38 -0.78 -0.08 115.31 116.88 1yhq h LEU 88 Ca -0.65 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1yhq h LEU 88 Cb 1.57 0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.45 1yhq h LEU 88 CO -0.40 0.04 0.04 -2.65 0.09 0.00 0.00 178.44 175.56 1yhq n PRO 89 N -5.10 0.00 0.00 1.13 -0.02 -1.26 -0.89 135.00 128.86 1yhq n PRO 89 Ca 0.08 0.17 0.10 0.00 -2.02 0.00 0.00 63.50 61.83 1yhq n PRO 89 Cb 0.30 -1.54 -0.04 0.00 -0.02 0.00 0.00 33.50 32.20 1yhq n PRO 89 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1yhq n LEU 90 N -1.11 0.97 -4.47 2.45 4.77 -0.04 -4.98 117.00 114.58 1yhq n LEU 90 Ca 0.00 -0.42 -0.23 0.00 -0.03 0.00 0.00 56.01 55.33 1yhq n LEU 90 Cb 0.04 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 40.98 1yhq n LEU 90 CO 0.00 0.23 -0.35 0.00 -1.33 0.00 0.00 177.39 175.95 1yhq s ALA 91 N -2.97 2.53 -0.81 -1.18 0.00 -0.07 -5.04 121.76 114.23 1yhq s ALA 91 Ca 0.09 -2.00 0.02 0.00 0.00 0.00 0.00 51.96 50.07 1yhq s ALA 91 Cb 0.16 0.22 0.20 0.00 0.00 0.00 0.00 23.12 23.70 1yhq s ALA 91 CO 0.82 -0.09 0.65 0.39 0.00 0.00 0.00 175.76 177.53 1yhq n GLU 92 N -0.67 2.26 -1.60 0.00 1.02 -1.26 -5.01 120.64 115.37 1yhq n GLU 92 Ca -0.05 -4.49 -0.49 0.00 -0.02 0.00 0.00 57.16 52.11 1yhq n GLU 92 Cb 0.64 -2.35 -0.04 0.00 -0.02 0.00 0.00 31.44 29.67 1yhq n GLU 92 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1yhq n LEU 93 N 2.11 1.91 -4.54 -4.62 4.77 -1.26 -5.00 117.00 110.36 1yhq n LEU 93 Ca 0.21 1.13 -0.26 0.00 -0.03 0.00 0.00 56.01 57.07 1yhq n LEU 93 Cb 0.36 -1.26 -0.11 0.00 -2.33 0.00 0.00 43.42 40.08 1yhq n LEU 93 CO 0.32 -1.05 -0.34 0.00 -1.33 0.00 0.00 177.39 174.99 1yhq s ALA 94 N 0.04 2.88 0.04 -1.18 0.00 -1.24 -3.95 121.76 118.36 1yhq s ALA 94 Ca 0.75 -2.14 -0.23 0.00 0.00 0.00 0.00 51.96 50.34 1yhq s ALA 94 Cb -0.83 0.14 -0.15 0.00 0.00 0.00 0.00 23.12 22.27 1yhq s ALA 94 CO 0.50 -0.05 1.51 1.15 0.00 0.00 0.00 175.76 178.86 1yhq h THR 95 N 1.98 1.21 -0.35 0.00 2.02 -1.89 -3.00 112.91 112.88 1yhq h THR 95 Ca -0.42 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.09 1yhq h THR 95 Cb 1.24 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 1yhq h THR 95 CO 0.74 0.18 0.16 0.77 0.37 0.00 0.00 175.52 177.74 1yhq h SER 96 N -0.14 0.43 0.00 4.18 4.64 -1.97 -2.48 113.55 118.21 1yhq h SER 96 Ca 0.02 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1yhq h SER 96 Cb 0.28 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1yhq h SER 96 CO 0.00 0.38 0.00 0.00 -0.87 0.00 0.00 176.83 176.34 1yhq n GLN 97 N -4.42 0.16 -4.42 4.77 6.02 -1.13 -4.67 117.38 113.69 1yhq n GLN 97 Ca 0.02 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.70 1yhq n GLN 97 Cb 0.12 -1.03 -0.10 0.00 1.02 0.00 0.00 30.24 30.25 1yhq n GLN 97 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1yhq s PHE 98 N -1.68 2.81 0.79 1.08 0.40 -0.93 -3.43 117.98 117.03 1yhq s PHE 98 Ca 0.00 -0.10 -0.13 0.00 -0.60 0.00 0.00 56.93 56.10 1yhq s PHE 98 Cb 0.00 -1.54 0.19 0.00 0.51 0.00 0.00 43.02 42.17 1yhq s PHE 98 CO 0.00 0.37 0.94 -3.47 0.70 0.00 0.00 175.22 173.76 1yhq n ASP 99 N 1.31 -0.55 0.01 1.36 2.03 1.33 -4.92 116.55 117.11 1yhq n ASP 99 Ca -0.15 -1.24 0.06 0.00 0.52 0.00 0.00 54.79 53.99 1yhq n ASP 99 Cb 0.52 -0.76 -0.12 0.00 -0.72 0.00 0.00 41.12 40.04 1yhq n ASP 99 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1yhq n ASP 100 N -3.89 0.30 -0.00 1.67 9.92 -1.26 -3.88 116.55 119.41 1yhq n ASP 100 Ca 0.12 0.12 0.13 0.00 -0.53 0.00 0.00 54.79 54.63 1yhq n ASP 100 Cb 0.43 1.27 0.40 0.00 -0.64 0.00 0.00 41.12 42.59 1yhq n ASP 100 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1yhq n THR 101 N -2.51 0.00 0.00 -3.53 -1.04 -1.26 -4.34 114.28 101.60 1yhq n THR 101 Ca -0.08 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1yhq n THR 101 Cb 0.69 -0.06 0.00 0.00 -1.82 0.00 0.00 70.33 69.14 1yhq n THR 101 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yhq n GLY 102 N 1.50 1.33 3.58 3.41 0.00 -1.25 -3.87 105.19 109.89 1yhq n GLY 102 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1yhq n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yhq s ASN 103 N -2.00 3.91 -0.17 1.61 0.02 -1.26 -4.22 114.94 112.83 1yhq s ASN 103 Ca 0.00 -1.13 -0.20 0.00 -1.02 0.00 0.00 52.86 50.51 1yhq s ASN 103 Cb 0.00 -0.42 0.05 0.00 0.02 0.00 0.00 41.25 40.90 1yhq s ASN 103 CO 0.00 -0.23 0.53 0.72 0.02 0.00 0.00 177.10 178.14 1yhq s PHE 104 N -2.58 -0.56 -0.08 2.20 -0.12 -1.23 0.40 117.98 116.01 1yhq s PHE 104 Ca 0.34 1.29 0.02 0.00 -0.05 0.00 0.00 56.93 58.52 1yhq s PHE 104 Cb 0.02 0.22 0.02 0.00 -0.63 0.00 0.00 43.02 42.64 1yhq s PHE 104 CO 0.18 -0.33 -0.11 0.45 -0.05 0.00 0.00 175.22 175.35 1yhq s SER 105 N -0.05 1.86 0.33 1.98 0.15 -1.22 -2.12 113.70 114.62 1yhq s SER 105 Ca -0.03 -0.30 0.04 0.00 0.70 0.00 0.00 55.95 56.37 1yhq s SER 105 Cb -0.03 -0.83 -0.06 0.00 -1.71 0.00 0.00 66.02 63.38 1yhq s SER 105 CO 0.02 -0.00 0.04 0.72 1.20 0.00 0.00 173.24 175.22 1yhq s PHE 106 N 0.92 2.02 0.00 3.44 -0.71 -0.71 -4.97 117.98 117.97 1yhq s PHE 106 Ca -0.10 -0.90 0.00 0.00 -1.04 0.00 0.00 56.93 54.89 1yhq s PHE 106 Cb -0.15 -1.32 0.00 0.00 -1.21 0.00 0.00 43.02 40.34 1yhq s PHE 106 CO 0.01 0.08 0.00 0.41 -1.34 0.00 0.00 175.22 174.38 1yhq n GLY 107 N -0.70 0.29 0.26 1.99 0.00 -1.26 -1.38 105.19 104.40 1yhq n GLY 107 Ca -0.03 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1yhq n GLY 107 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1yhq n LEU 128 N 0.00 0.00 -4.89 0.99 0.00 -1.26 -4.93 117.00 106.90 1yhq n LEU 128 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 56.01 55.86 1yhq n LEU 128 Cb 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 43.42 43.15 1yhq n LEU 128 CO 0.00 -0.15 -0.16 -1.81 0.00 0.00 0.00 177.39 175.27 1yhq s ASP 129 N 0.00 6.17 -0.21 1.96 1.01 -0.11 -4.99 116.67 120.50 1yhq s ASP 129 Ca 0.00 0.18 -0.04 0.00 0.71 0.00 0.00 52.55 53.40 1yhq s ASP 129 Cb 0.00 -1.84 0.08 0.00 1.01 0.00 0.00 42.92 42.17 1yhq s ASP 129 CO 0.00 0.14 0.12 -0.69 0.21 0.00 0.00 175.17 174.96 1yhq s VAL 130 N -1.54 -0.12 -0.03 -1.27 1.01 -0.48 -1.98 120.40 116.00 1yhq s VAL 130 Ca 0.34 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 1yhq s VAL 130 Cb -0.12 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 1yhq s VAL 130 CO 0.27 -0.42 0.05 -0.89 0.00 0.00 0.00 175.10 174.11 1yhq s THR 131 N 2.15 4.58 -0.18 3.92 2.01 -0.86 -1.73 115.64 125.53 1yhq s THR 131 Ca 0.05 -0.37 0.01 0.00 0.31 0.00 0.00 61.69 61.69 1yhq s THR 131 Cb -0.16 -3.04 0.03 0.00 0.01 0.00 0.00 72.50 69.34 1yhq s THR 131 CO -0.19 0.43 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.31 1yhq s VAL 132 N -1.09 1.95 -0.36 3.82 1.01 -0.90 -0.88 120.40 123.94 1yhq s VAL 132 Ca 0.20 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 61.04 1yhq s VAL 132 Cb -0.12 -1.82 -0.00 0.00 0.00 0.00 0.00 36.38 34.44 1yhq s VAL 132 CO 0.10 0.43 0.42 0.21 0.00 0.00 0.00 175.10 176.26 1yhq s ASN 133 N 1.31 6.22 -0.03 3.32 3.04 0.62 -3.55 114.94 125.88 1yhq s ASN 133 Ca 0.03 -0.25 0.01 0.00 0.04 0.00 0.00 52.86 52.69 1yhq s ASN 133 Cb -0.14 -2.22 -0.03 0.00 -1.54 0.00 0.00 41.25 37.31 1yhq s ASN 133 CO -0.11 -0.43 -0.04 -0.76 -3.04 0.00 0.00 177.10 172.72 1yhq s LEU 134 N 2.16 3.31 0.26 3.21 1.43 -1.26 -0.96 118.68 126.83 1yhq s LEU 134 Ca 0.14 -0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 53.00 1yhq s LEU 134 Cb -0.16 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.27 1yhq s LEU 134 CO 0.13 0.32 0.78 0.54 0.23 0.00 0.00 176.35 178.35 1yhq s VAL 135 N -0.94 0.00 0.54 -1.59 0.11 -0.97 -4.83 120.40 112.73 1yhq s VAL 135 Ca 0.15 -0.92 -0.00 0.00 -2.93 0.00 0.00 61.98 58.28 1yhq s VAL 135 Cb -0.11 -2.09 0.02 0.00 -1.53 0.00 0.00 36.38 32.68 1yhq s VAL 135 CO 0.05 0.00 0.78 -0.13 -3.33 0.00 0.00 175.10 172.47 1yhq s ARG 136 N -3.62 2.68 0.28 1.54 0.52 -1.26 -1.65 118.95 117.42 1yhq s ARG 136 Ca 0.12 -0.60 -0.01 0.00 -0.52 0.00 0.00 55.73 54.72 1yhq s ARG 136 Cb -0.05 -2.46 0.61 0.00 0.52 0.00 0.00 34.95 33.57 1yhq s ARG 136 CO 0.06 -0.64 1.44 -2.30 0.02 0.00 0.00 175.30 173.87 1yhq n PRO 137 N -2.34 -0.08 -1.35 3.54 -0.02 -1.26 -3.00 135.00 130.48 1yhq n PRO 137 Ca 0.06 1.39 -0.29 0.00 -2.02 0.00 0.00 63.50 62.65 1yhq n PRO 137 Cb 0.59 -2.17 0.03 0.00 -0.02 0.00 0.00 33.50 31.93 1yhq n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yhq n GLY 138 N -1.50 4.91 0.15 -1.23 0.00 -1.26 -4.55 105.19 101.71 1yhq n GLY 138 Ca 0.19 -1.88 -0.04 0.00 0.00 0.00 0.00 46.02 44.29 1yhq n GLY 138 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1yhq h TYR 139 N 2.29 0.15 -1.16 1.61 3.20 -1.94 -3.12 116.97 117.99 1yhq h TYR 139 Ca 0.45 -0.06 0.33 0.00 3.14 0.00 0.00 58.73 62.59 1yhq h TYR 139 Cb 0.67 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.86 1yhq h TYR 139 CO 1.21 0.73 0.82 -0.09 -1.64 0.00 0.00 178.16 179.19 1yhq h ARG 140 N 0.08 0.08 -0.39 1.82 2.43 -1.89 0.11 114.38 116.62 1yhq h ARG 140 Ca -0.01 -0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 1yhq h ARG 140 Cb 1.15 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 1yhq h ARG 140 CO 0.09 0.05 0.48 0.28 -1.51 0.00 0.00 179.97 179.36 1yhq h VAL 141 N 0.08 0.30 -0.11 0.20 2.07 -1.87 0.16 116.25 117.08 1yhq h VAL 141 Ca 0.58 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.10 1yhq h VAL 141 Cb 2.13 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1yhq h VAL 141 CO -0.07 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.52 1yhq n ALA 142 N -2.27 2.42 0.06 1.67 0.00 0.39 -0.56 120.51 122.22 1yhq n ALA 142 Ca 0.07 -0.74 0.01 0.00 0.00 0.00 0.00 53.44 52.78 1yhq n ALA 142 Cb 0.64 -0.49 -0.00 0.00 0.00 0.00 0.00 19.45 19.60 1yhq n ALA 142 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1yhq n LYS 143 N 0.78 5.28 -2.14 0.00 4.76 0.43 -4.79 118.16 122.49 1yhq n LYS 143 Ca 0.10 -0.10 -0.28 0.00 -2.87 0.00 0.00 58.31 55.15 1yhq n LYS 143 Cb 0.37 -0.64 0.05 0.00 -1.84 0.00 0.00 35.03 32.97 1yhq n LYS 143 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1yhq s ARG 144 N -0.95 2.74 -0.09 1.97 1.70 -0.37 -5.04 118.95 118.92 1yhq s ARG 144 Ca 0.01 0.16 -0.10 0.00 -0.47 0.00 0.00 55.73 55.32 1yhq s ARG 144 Cb 0.01 -2.14 -0.08 0.00 -0.57 0.00 0.00 34.95 32.17 1yhq s ARG 144 CO 0.05 -0.96 0.35 -0.44 -1.08 0.00 0.00 175.30 173.22 1yhq h ASP 145 N -0.48 -0.10 -3.70 -2.89 3.45 -1.96 -3.40 116.42 107.35 1yhq h ASP 145 Ca -0.45 -0.22 -0.51 0.00 0.43 0.00 0.00 57.03 56.28 1yhq h ASP 145 Cb 1.27 0.02 0.02 0.00 -0.56 0.00 0.00 39.33 40.08 1yhq h ASP 145 CO 0.62 0.49 0.50 -0.54 -1.57 0.00 0.00 179.24 178.74 1yhq s LYS 146 N -2.20 4.59 -1.67 3.56 1.02 -1.26 -3.82 119.74 119.96 1yhq s LYS 146 Ca -0.06 1.81 -0.21 0.00 0.02 0.00 0.00 55.97 57.54 1yhq s LYS 146 Cb -0.00 -3.21 0.20 0.00 -0.52 0.00 0.00 37.83 34.30 1yhq s LYS 146 CO 0.22 0.12 0.57 0.00 -0.92 0.00 0.00 175.35 175.34 1yhq n ALA 147 N 1.65 -1.19 -0.59 5.17 0.00 -1.26 -4.89 120.51 119.40 1yhq n ALA 147 Ca 0.01 -0.15 -0.30 0.00 0.00 0.00 0.00 53.44 53.00 1yhq n ALA 147 Cb 0.45 -2.47 0.22 0.00 0.00 0.00 0.00 19.45 17.64 1yhq n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1yhq s SER 148 N -3.12 1.81 0.05 0.00 1.04 -1.25 -5.00 113.70 107.23 1yhq s SER 148 Ca 0.74 1.86 -0.25 0.00 0.48 0.00 0.00 55.95 58.77 1yhq s SER 148 Cb -0.42 -2.45 0.06 0.00 0.10 0.00 0.00 66.02 63.31 1yhq s SER 148 CO 0.90 -3.74 0.59 -0.60 0.98 0.00 0.00 173.24 171.38 1yhq s ARG 149 N -4.53 1.12 0.15 4.02 6.06 0.28 -4.99 118.95 121.06 1yhq s ARG 149 Ca 0.68 -0.15 -0.22 0.00 -2.50 0.00 0.00 55.73 53.53 1yhq s ARG 149 Cb -0.24 0.52 -0.08 0.00 0.06 0.00 0.00 34.95 35.21 1yhq s ARG 149 CO 0.62 -0.42 0.70 0.45 -2.50 0.00 0.00 175.30 174.15 1yhq s SER 150 N -1.97 7.22 0.02 -2.12 0.15 -1.26 -3.14 113.70 112.59 1yhq s SER 150 Ca -0.05 1.48 -0.30 0.00 0.70 0.00 0.00 55.95 57.78 1yhq s SER 150 Cb -0.01 -2.44 -0.07 0.00 -1.71 0.00 0.00 66.02 61.80 1yhq s SER 150 CO -0.02 0.19 1.59 -0.63 1.20 0.00 0.00 173.24 175.57 1yhq s ILE 151 N -1.23 3.35 0.56 6.45 -1.09 -1.26 -4.97 121.20 123.02 1yhq s ILE 151 Ca 0.35 0.70 -0.21 0.00 -2.23 0.00 0.00 60.65 59.27 1yhq s ILE 151 Cb -0.21 -3.45 -0.05 0.00 -1.58 0.00 0.00 42.46 37.18 1yhq s ILE 151 CO 0.23 -0.02 1.18 -2.65 -1.23 0.00 0.00 174.94 172.45 1yhq n PRO 152 N 5.96 1.33 -0.35 2.79 -0.02 -1.26 -4.79 135.00 138.65 1yhq n PRO 152 Ca 0.16 0.50 0.08 0.00 -2.02 0.00 0.00 63.50 62.21 1yhq n PRO 152 Cb 0.42 -2.38 0.25 0.00 -0.02 0.00 0.00 33.50 31.78 1yhq n PRO 152 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1yhq h THR 153 N 1.03 0.85 -0.83 3.45 1.35 -1.95 -1.05 112.91 115.75 1yhq h THR 153 Ca -0.49 -0.31 0.06 0.00 -0.55 0.00 0.00 66.41 65.12 1yhq h THR 153 Cb 1.33 -0.12 -0.05 0.00 -1.73 0.00 0.00 68.15 67.58 1yhq h THR 153 CO 0.54 0.16 0.54 0.11 -0.25 0.00 0.00 175.52 176.63 1yhq h LYS 154 N 0.89 0.91 -0.13 4.72 6.56 -2.01 -0.73 116.57 126.78 1yhq h LYS 154 Ca 0.51 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 60.04 1yhq h LYS 154 Cb 0.60 -0.20 0.00 0.00 -0.57 0.00 0.00 32.23 32.06 1yhq h LYS 154 CO -0.30 0.60 0.00 1.58 -2.06 0.00 0.00 179.45 179.27 1yhq n HIS 155 N -4.48 0.16 -2.95 -1.35 -0.00 -0.45 -4.88 115.22 101.27 1yhq n HIS 155 Ca 0.12 -0.08 -0.36 0.00 0.46 0.00 0.00 57.72 57.87 1yhq n HIS 155 Cb 0.20 0.00 -0.06 0.00 -0.12 0.00 0.00 29.99 30.00 1yhq n HIS 155 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1yhq s ARG 156 N -1.84 4.35 0.72 1.57 1.81 -0.28 -4.67 118.95 120.61 1yhq s ARG 156 Ca 0.34 1.05 -0.11 0.00 -1.72 0.00 0.00 55.73 55.30 1yhq s ARG 156 Cb 0.19 -2.71 0.03 0.00 -0.45 0.00 0.00 34.95 32.01 1yhq s ARG 156 CO 0.29 0.27 1.07 -1.17 -0.68 0.00 0.00 175.30 175.08 1yhq s LEU 157 N -2.28 3.10 0.28 2.53 2.96 -1.25 -5.01 118.68 119.01 1yhq s LEU 157 Ca 0.49 1.71 0.10 0.00 -0.22 0.00 0.00 54.13 56.22 1yhq s LEU 157 Cb -0.16 -4.51 -0.05 0.00 0.50 0.00 0.00 46.19 41.97 1yhq s LEU 157 CO 0.21 -1.69 -0.15 0.20 -1.32 0.00 0.00 176.35 173.60 1yhq s ASN 158 N -3.59 3.33 0.13 3.68 -0.87 -1.26 -4.19 114.94 112.17 1yhq s ASN 158 Ca 0.60 -1.08 -0.19 0.00 -1.57 0.00 0.00 52.86 50.62 1yhq s ASN 158 Cb -0.15 -0.26 -0.01 0.00 -0.02 0.00 0.00 41.25 40.80 1yhq s ASN 158 CO 0.55 -0.09 1.72 -0.65 -2.57 0.00 0.00 177.10 176.06 1yhq h PRO 159 N 2.28 0.08 0.49 -0.60 0.11 -1.79 0.16 132.00 132.74 1yhq h PRO 159 Ca -0.40 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.69 1yhq h PRO 159 Cb 1.25 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1yhq h PRO 159 CO 0.63 0.06 -0.28 0.00 -0.21 0.00 0.00 178.00 178.19 1yhq h ALA 160 N 1.19 -0.73 -0.56 -0.75 0.00 -1.96 0.14 119.26 116.59 1yhq h ALA 160 Ca 0.11 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 55.00 1yhq h ALA 160 Cb 0.13 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1yhq h ALA 160 CO -0.17 -0.92 0.39 -0.44 0.00 0.00 0.00 179.25 178.11 1yhq h ASP 161 N -0.73 0.15 0.19 0.00 3.32 -1.91 -1.38 116.42 116.06 1yhq h ASP 161 Ca -0.06 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1yhq h ASP 161 Cb 0.59 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1yhq h ASP 161 CO 0.07 0.09 -0.09 0.00 -1.72 0.00 0.00 179.24 177.59 1yhq h ALA 162 N 1.72 -0.25 -0.78 3.45 0.00 -0.15 -2.72 119.26 120.54 1yhq h ALA 162 Ca 0.27 -0.17 0.18 0.00 0.00 0.00 0.00 54.91 55.18 1yhq h ALA 162 Cb 0.82 0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.57 1yhq h ALA 162 CO -0.04 -0.28 -0.05 0.28 0.00 0.00 0.00 179.25 179.17 1yhq h VAL 163 N -0.98 0.28 0.00 0.00 2.07 -0.34 -1.25 116.25 116.03 1yhq h VAL 163 Ca -0.03 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1yhq h VAL 163 Cb 0.43 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1yhq h VAL 163 CO 0.04 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.64 1yhq n ALA 164 N -3.05 -0.33 -0.35 1.67 0.00 -0.56 0.19 120.51 118.09 1yhq n ALA 164 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.51 1yhq n ALA 164 Cb 0.48 0.15 -0.04 0.00 0.00 0.00 0.00 19.45 20.03 1yhq n ALA 164 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1yhq n PHE 165 N -2.21 -0.23 0.48 0.00 7.35 -0.80 0.91 117.46 122.95 1yhq n PHE 165 Ca 0.00 1.05 -0.19 0.00 -0.76 0.00 0.00 57.45 57.56 1yhq n PHE 165 Cb 0.00 -0.65 -0.09 0.00 0.35 0.00 0.00 39.48 39.09 1yhq n PHE 165 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1yhq h ILE 166 N 0.00 0.00 -1.09 -2.13 2.04 -1.19 -2.64 117.51 112.50 1yhq h ILE 166 Ca 0.19 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.35 1yhq h ILE 166 Cb 0.40 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.38 1yhq h ILE 166 CO -0.81 0.00 0.70 -0.08 0.00 0.00 0.00 178.15 177.96 1yhq h GLU 167 N -1.22 0.32 -1.07 2.37 4.81 0.81 0.59 114.58 121.20 1yhq h GLU 167 Ca -0.12 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1yhq h GLU 167 Cb 0.94 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.24 1yhq h GLU 167 CO 0.20 0.21 0.00 0.45 -0.73 0.00 0.00 179.01 179.14 1yhq n SER 168 N -4.66 1.45 -2.81 1.04 2.88 0.26 -4.18 113.62 107.60 1yhq n SER 168 Ca 0.28 -1.32 -0.05 0.00 -1.33 0.00 0.00 58.87 56.45 1yhq n SER 168 Cb 0.99 -0.33 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1yhq n SER 168 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1yhq s THR 169 N -0.20 -0.94 -0.62 2.46 2.01 0.21 -5.00 115.64 113.56 1yhq s THR 169 Ca 0.00 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 1yhq s THR 169 Cb 0.00 -0.06 -0.01 0.00 0.01 0.00 0.00 72.50 72.44 1yhq s THR 169 CO 0.00 -0.06 0.57 -1.22 -0.69 0.00 0.00 174.62 173.23 1yhq n TYR 170 N 3.02 -2.15 -3.73 4.92 4.02 -1.26 -4.99 117.16 117.00 1yhq n TYR 170 Ca 0.18 0.80 0.00 0.00 -0.01 0.00 0.00 57.90 58.87 1yhq n TYR 170 Cb 0.56 -3.55 0.00 0.00 -0.02 0.00 0.00 39.34 36.33 1yhq n TYR 170 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1yhq n ASP 171 N -1.92 0.00 -4.17 7.72 5.68 -1.26 -4.91 116.55 117.69 1yhq n ASP 171 Ca -0.01 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.16 1yhq n ASP 171 Cb 0.53 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.40 1yhq n ASP 171 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1yhq s VAL 172 N -2.95 0.77 0.00 2.12 1.01 -1.26 -4.86 120.40 115.22 1yhq s VAL 172 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.11 1yhq s VAL 172 Cb 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.77 1yhq s VAL 172 CO 0.00 -0.80 0.00 -1.84 0.00 0.00 0.00 175.10 172.46 1yhq n GLU 173 N 0.08 2.50 0.00 2.72 0.28 -1.26 -4.73 120.64 120.24 1yhq n GLU 173 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.87 1yhq n GLU 173 Cb 0.60 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.47 1yhq n GLU 173 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25