#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq s GLN 2 N 0.00 2.34 -0.09 2.12 1.03 -1.26 0.61 119.66 124.41 1yhq s GLN 2 Ca 0.00 -0.86 0.03 0.00 0.04 0.00 0.00 55.36 54.57 1yhq s GLN 2 Cb 0.00 -2.38 0.01 0.00 0.03 0.00 0.00 33.01 30.67 1yhq s GLN 2 CO 0.00 0.56 -0.17 0.00 -2.54 0.00 0.00 175.29 173.15 1yhq s ALA 3 N -1.04 1.68 -0.15 2.60 0.00 0.16 -4.76 121.76 120.25 1yhq s ALA 3 Ca 0.18 -0.69 -0.29 0.00 0.00 0.00 0.00 51.96 51.16 1yhq s ALA 3 Cb -0.11 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.27 1yhq s ALA 3 CO 0.09 0.11 1.22 0.99 0.00 0.00 0.00 175.76 178.17 1yhq s THR 4 N 0.67 4.33 0.30 0.00 2.01 -1.26 -1.31 115.64 120.38 1yhq s THR 4 Ca -0.13 1.62 -0.19 0.00 0.31 0.00 0.00 61.69 63.29 1yhq s THR 4 Cb -0.16 -4.04 -0.09 0.00 0.01 0.00 0.00 72.50 68.21 1yhq s THR 4 CO 0.04 -0.12 0.79 -0.63 -0.69 0.00 0.00 174.62 174.01 1yhq s ILE 5 N 3.23 4.53 -0.01 1.82 1.01 -1.05 -4.24 121.20 126.48 1yhq s ILE 5 Ca 0.54 1.29 0.06 0.00 0.00 0.00 0.00 60.65 62.53 1yhq s ILE 5 Cb -0.21 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1yhq s ILE 5 CO 0.15 0.00 -0.20 -0.31 0.00 0.00 0.00 174.94 174.58 1yhq s TYR 6 N -1.77 1.81 0.68 3.97 1.51 -0.93 -1.14 117.35 121.49 1yhq s TYR 6 Ca 0.50 -0.35 -0.06 0.00 -1.01 0.00 0.00 57.07 56.15 1yhq s TYR 6 Cb -0.14 -1.16 0.05 0.00 -0.11 0.00 0.00 41.96 40.61 1yhq s TYR 6 CO 0.19 -0.02 1.00 0.16 -1.11 0.00 0.00 175.55 175.77 1yhq s ASP 7 N -0.55 4.96 0.00 2.29 -4.77 -0.86 -1.20 116.67 116.53 1yhq s ASP 7 Ca 0.08 0.51 0.02 0.00 -3.30 0.00 0.00 52.55 49.86 1yhq s ASP 7 Cb -0.08 -1.22 0.13 0.00 -1.09 0.00 0.00 42.92 40.67 1yhq s ASP 7 CO -0.00 -1.50 0.44 0.18 0.70 0.00 0.00 175.17 174.98 1yhq n LEU 8 N -2.86 0.00 -0.17 2.11 4.77 -1.26 -0.30 117.00 119.28 1yhq n LEU 8 Ca 0.07 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.11 1yhq n LEU 8 Cb 0.60 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.66 1yhq n LEU 8 CO 0.52 0.00 0.13 0.47 -1.33 0.00 0.00 177.39 177.18 1yhq n ASP 9 N -0.74 1.07 0.00 -1.43 8.00 -1.26 -4.77 116.55 117.42 1yhq n ASP 9 Ca 0.02 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1yhq n ASP 9 Cb 0.01 0.68 0.00 0.00 -0.02 0.00 0.00 41.12 41.79 1yhq n ASP 9 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yhq n GLY 10 N 1.12 0.69 3.81 0.44 0.00 0.59 -4.93 105.19 106.90 1yhq n GLY 10 Ca 0.04 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 1yhq n GLY 10 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yhq s ASN 11 N -2.26 5.87 0.47 1.61 0.01 -1.26 -4.86 114.94 114.52 1yhq s ASN 11 Ca 0.00 0.26 -0.23 0.00 -0.71 0.00 0.00 52.86 52.18 1yhq s ASN 11 Cb 0.00 -1.76 -0.09 0.00 0.41 0.00 0.00 41.25 39.80 1yhq s ASN 11 CO 0.00 0.33 0.94 0.35 -1.51 0.00 0.00 177.10 177.20 1yhq n THR 12 N 1.53 2.63 -2.78 1.60 -2.24 -1.26 -2.03 114.28 111.72 1yhq n THR 12 Ca -0.15 -0.50 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 1yhq n THR 12 Cb 0.53 -1.09 0.05 0.00 -2.10 0.00 0.00 70.33 67.73 1yhq n THR 12 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1yhq n ASP 13 N 0.30 -0.12 0.00 3.42 -0.08 -0.29 -4.78 116.55 115.01 1yhq n ASP 13 Ca 0.10 -2.84 0.00 0.00 -1.51 0.00 0.00 54.79 50.55 1yhq n ASP 13 Cb 0.41 0.22 0.00 0.00 2.34 0.00 0.00 41.12 44.09 1yhq n ASP 13 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yhq n GLY 14 N -0.08 -1.74 3.58 0.27 0.00 -1.26 -4.74 105.19 101.23 1yhq n GLY 14 Ca 0.08 -1.87 -0.07 0.00 0.00 0.00 0.00 46.02 44.17 1yhq n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yhq s GLU 15 N 0.00 0.44 0.31 1.61 -1.05 -1.26 -2.54 118.70 116.21 1yhq s GLU 15 Ca 0.00 -0.02 0.03 0.00 -0.15 0.00 0.00 54.97 54.83 1yhq s GLU 15 Cb 0.00 0.21 -0.06 0.00 -0.44 0.00 0.00 34.13 33.84 1yhq s GLU 15 CO 0.00 -0.16 0.07 0.08 0.95 0.00 0.00 175.26 176.20 1yhq s VAL 16 N -1.74 1.02 0.12 1.83 1.01 -0.43 -4.92 120.40 117.30 1yhq s VAL 16 Ca 0.04 -2.00 -0.30 0.00 0.00 0.00 0.00 61.98 59.72 1yhq s VAL 16 Cb -0.01 -2.75 -0.07 0.00 0.00 0.00 0.00 36.38 33.55 1yhq s VAL 16 CO -0.04 0.00 1.14 -1.81 0.00 0.00 0.00 175.10 174.39 1yhq s ASP 17 N -3.44 7.18 -0.24 3.32 1.01 -1.26 0.39 116.67 123.63 1yhq s ASP 17 Ca 0.37 2.05 -0.29 0.00 0.71 0.00 0.00 52.55 55.39 1yhq s ASP 17 Cb 0.08 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.43 1yhq s ASP 17 CO 0.15 -0.34 1.12 -0.22 0.21 0.00 0.00 175.17 176.10 1yhq s LEU 18 N 0.28 4.07 0.74 1.23 2.96 0.20 -4.81 118.68 123.36 1yhq s LEU 18 Ca 0.53 1.39 -0.16 0.00 -0.22 0.00 0.00 54.13 55.67 1yhq s LEU 18 Cb -0.29 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.84 1yhq s LEU 18 CO 0.32 -0.76 0.69 -0.81 -1.32 0.00 0.00 176.35 174.47 1yhq n PRO 19 N 6.56 0.32 -0.25 0.98 -0.04 -1.26 -3.81 135.00 137.51 1yhq n PRO 19 Ca 0.13 0.16 0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1yhq n PRO 19 Cb 0.46 -1.98 0.36 0.00 -0.04 0.00 0.00 33.50 32.30 1yhq n PRO 19 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1yhq h ASP 20 N -0.43 0.67 -1.05 3.54 3.32 -1.94 -2.56 116.42 117.97 1yhq h ASP 20 Ca -0.46 0.03 0.28 0.00 0.02 0.00 0.00 57.03 56.90 1yhq h ASP 20 Cb 1.34 -0.11 -0.07 0.00 0.22 0.00 0.00 39.33 40.71 1yhq h ASP 20 CO 0.44 0.37 0.71 -0.37 -1.72 0.00 0.00 179.24 178.67 1yhq h VAL 21 N 0.73 0.51 0.00 -1.35 -1.51 -1.91 0.63 116.25 113.35 1yhq h VAL 21 Ca 0.41 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.80 1yhq h VAL 21 Cb 0.56 0.26 0.00 0.00 -2.13 0.00 0.00 31.29 29.99 1yhq h VAL 21 CO -0.17 0.04 0.00 0.49 -1.23 0.00 0.00 177.57 176.70 1yhq n PHE 22 N -4.44 0.00 0.62 5.19 3.01 -0.97 -0.63 117.46 120.25 1yhq n PHE 22 Ca 0.24 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.77 1yhq n PHE 22 Cb 0.98 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 40.50 1yhq n PHE 22 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1yhq n GLU 23 N -0.97 1.24 -1.73 -1.08 1.02 0.22 -4.65 120.64 114.69 1yhq n GLU 23 Ca 0.09 -1.24 -0.42 0.00 -0.02 0.00 0.00 57.16 55.57 1yhq n GLU 23 Cb 0.04 -1.27 -0.03 0.00 -0.02 0.00 0.00 31.44 30.16 1yhq n GLU 23 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1yhq s THR 24 N -1.35 2.51 0.02 2.62 2.01 0.20 -4.88 115.64 116.77 1yhq s THR 24 Ca 0.16 0.07 -0.35 0.00 0.31 0.00 0.00 61.69 61.88 1yhq s THR 24 Cb 0.12 -3.04 -0.13 0.00 0.01 0.00 0.00 72.50 69.46 1yhq s THR 24 CO 0.22 0.00 1.70 -0.81 -0.69 0.00 0.00 174.62 175.05 1yhq n PRO 25 N 5.52 2.02 -1.69 4.92 -0.04 -1.26 -4.71 135.00 139.75 1yhq n PRO 25 Ca 0.17 0.73 -0.42 0.00 -0.04 0.00 0.00 63.50 63.95 1yhq n PRO 25 Cb 0.38 -2.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.29 1yhq n PRO 25 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1yhq s VAL 26 N 2.41 2.89 -0.57 0.52 1.01 -1.26 -4.81 120.40 120.60 1yhq s VAL 26 Ca 0.87 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.93 1yhq s VAL 26 Cb -0.73 -3.03 0.14 0.00 0.00 0.00 0.00 36.38 32.76 1yhq s VAL 26 CO 0.46 -0.00 0.33 -0.60 0.00 0.00 0.00 175.10 175.29 1yhq s ARG 27 N 3.97 2.05 0.45 2.72 6.06 -1.26 -4.97 118.95 127.97 1yhq s ARG 27 Ca 0.86 -2.79 0.11 0.00 -2.50 0.00 0.00 55.73 51.41 1yhq s ARG 27 Cb -0.43 -3.25 1.00 0.00 0.06 0.00 0.00 34.95 32.33 1yhq s ARG 27 CO 0.40 -1.17 2.08 0.66 -2.50 0.00 0.00 175.30 174.77 1yhq h SER 28 N 6.17 0.32 -0.41 -2.12 4.64 -1.94 -1.36 113.55 118.84 1yhq h SER 28 Ca -0.00 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 1yhq h SER 28 Cb 0.85 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1yhq h SER 28 CO 0.68 0.23 -0.27 -2.24 -0.87 0.00 0.00 176.83 174.35 1yhq h ASP 29 N 0.37 0.95 -0.26 4.97 2.03 -1.94 -0.89 116.42 121.66 1yhq h ASP 29 Ca 0.12 -0.43 -0.16 0.00 -0.73 0.00 0.00 57.03 55.83 1yhq h ASP 29 Cb 0.03 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.25 1yhq h ASP 29 CO -0.03 1.18 -0.43 -0.07 -1.03 0.00 0.00 179.24 178.86 1yhq h LEU 30 N 0.74 0.88 -0.13 0.15 3.38 -1.86 -2.21 115.31 116.25 1yhq h LEU 30 Ca 0.08 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1yhq h LEU 30 Cb 0.85 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1yhq h LEU 30 CO 0.07 1.18 0.06 0.40 0.09 0.00 0.00 178.44 180.25 1yhq h ILE 31 N 0.66 1.13 -0.96 1.22 2.04 -1.19 -1.85 117.51 118.54 1yhq h ILE 31 Ca 0.04 -0.36 0.10 0.00 1.00 0.00 0.00 64.86 65.64 1yhq h ILE 31 Cb 1.00 1.13 -0.07 0.00 -0.74 0.00 0.00 36.82 38.14 1yhq h ILE 31 CO 0.10 0.11 0.61 1.23 0.00 0.00 0.00 178.15 180.21 1yhq h GLY 32 N 0.08 1.47 0.92 5.37 0.00 -1.06 -0.87 103.07 108.98 1yhq h GLY 32 Ca 0.05 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.92 1yhq h GLY 32 CO -0.01 0.22 0.08 1.70 0.00 0.00 0.00 176.54 178.54 1yhq h LYS 33 N 1.00 0.59 -0.45 4.80 3.64 -1.03 -0.02 116.57 125.10 1yhq h LYS 33 Ca 0.45 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1yhq h LYS 33 Cb 0.38 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1yhq h LYS 33 CO -0.20 0.64 0.28 0.00 -2.27 0.00 0.00 179.45 177.89 1yhq h ALA 34 N 0.93 0.57 -0.46 5.00 0.00 -0.50 -1.51 119.26 123.28 1yhq h ALA 34 Ca 0.11 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1yhq h ALA 34 Cb 0.32 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1yhq h ALA 34 CO 0.00 0.05 0.02 0.28 0.00 0.00 0.00 179.25 179.60 1yhq h VAL 35 N 0.60 1.26 -0.86 0.00 2.07 -1.06 -2.15 116.25 116.11 1yhq h VAL 35 Ca 0.16 -1.02 0.06 0.00 0.82 0.00 0.00 66.70 66.73 1yhq h VAL 35 Cb -0.02 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 1yhq h VAL 35 CO -0.03 0.35 0.53 -0.09 0.02 0.00 0.00 177.57 178.35 1yhq h ARG 36 N 0.65 0.93 -0.27 1.57 2.43 -0.76 -1.29 114.38 117.64 1yhq h ARG 36 Ca 0.13 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 1yhq h ARG 36 Cb 0.47 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1yhq h ARG 36 CO 0.02 0.62 -0.07 0.00 -1.51 0.00 0.00 179.97 179.02 1yhq h ALA 37 N 1.41 0.37 -0.63 2.80 0.00 -1.02 -1.47 119.26 120.73 1yhq h ALA 37 Ca 0.38 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1yhq h ALA 37 Cb 0.19 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1yhq h ALA 37 CO -0.18 0.19 0.28 0.00 0.00 0.00 0.00 179.25 179.54 1yhq h ALA 38 N 0.77 1.30 -0.42 0.00 0.00 -1.01 -0.21 119.26 119.69 1yhq h ALA 38 Ca 0.07 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1yhq h ALA 38 Cb 0.55 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1yhq h ALA 38 CO 0.03 0.53 -0.23 1.96 0.00 0.00 0.00 179.25 181.54 1yhq h GLN 39 N 0.90 0.90 -0.46 0.00 4.20 -1.15 -3.15 115.11 116.35 1yhq h GLN 39 Ca 0.22 -0.40 -0.13 0.00 0.06 0.00 0.00 58.65 58.40 1yhq h GLN 39 Cb 0.13 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1yhq h GLN 39 CO -0.02 1.05 -0.22 0.00 -0.67 0.00 0.00 178.83 178.97 1yhq h ALA 40 N 0.82 0.73 0.00 3.87 0.00 -0.82 -3.18 119.26 120.69 1yhq h ALA 40 Ca 0.09 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1yhq h ALA 40 Cb 0.80 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1yhq h ALA 40 CO 0.07 0.67 0.00 0.09 0.00 0.00 0.00 179.25 180.07 1yhq n ASN 41 N -4.11 0.24 -1.04 0.00 3.02 -0.13 -2.00 115.26 111.25 1yhq n ASN 41 Ca 0.00 0.57 0.10 0.00 -0.03 0.00 0.00 54.58 55.22 1yhq n ASN 41 Cb 0.45 -0.62 0.22 0.00 -0.61 0.00 0.00 39.78 39.23 1yhq n ASN 41 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1yhq n ARG 42 N -1.78 2.50 -2.75 3.52 1.85 -1.20 -4.96 116.66 113.84 1yhq n ARG 42 Ca 0.02 -2.26 -0.40 0.00 -1.00 0.00 0.00 57.85 54.21 1yhq n ARG 42 Cb 0.15 -1.45 -0.05 0.00 -1.05 0.00 0.00 32.46 30.06 1yhq n ARG 42 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1yhq s LYS 43 N -1.16 4.80 0.17 2.89 3.01 -0.85 -5.04 119.74 123.56 1yhq s LYS 43 Ca 0.36 1.47 -0.14 0.00 -1.01 0.00 0.00 55.97 56.66 1yhq s LYS 43 Cb 0.20 -3.31 -0.07 0.00 -1.01 0.00 0.00 37.83 33.64 1yhq s LYS 43 CO 0.27 0.42 0.56 -0.65 0.51 0.00 0.00 175.35 176.46 1yhq s GLN 44 N -0.79 3.96 0.46 1.68 -0.21 -1.26 -4.99 119.66 118.50 1yhq s GLN 44 Ca 0.43 0.47 -0.23 0.00 0.02 0.00 0.00 55.36 56.04 1yhq s GLN 44 Cb -0.25 -2.86 -0.07 0.00 1.00 0.00 0.00 33.01 30.82 1yhq s GLN 44 CO 0.31 0.44 1.21 -0.51 -2.12 0.00 0.00 175.29 174.62 1yhq s ASP 45 N -1.85 6.10 0.33 5.90 -0.00 -1.26 -5.03 116.67 120.86 1yhq s ASP 45 Ca 0.40 2.43 -0.08 0.00 -0.00 0.00 0.00 52.55 55.30 1yhq s ASP 45 Cb -0.14 -2.61 0.01 0.00 -0.00 0.00 0.00 42.92 40.18 1yhq s ASP 45 CO 0.19 -0.98 0.56 -0.72 -0.00 0.00 0.00 175.17 174.23 1yhq s TYR 46 N -1.45 0.65 0.00 4.23 -0.85 -1.26 -5.02 117.35 113.65 1yhq s TYR 46 Ca 0.63 -1.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.15 1yhq s TYR 46 Cb -0.32 0.23 0.00 0.00 0.38 0.00 0.00 41.96 42.25 1yhq s TYR 46 CO 0.39 -1.22 0.00 0.41 -1.52 0.00 0.00 175.55 173.61 1yhq n GLY 47 N -0.52 3.62 3.79 5.49 0.00 -1.26 -2.26 105.19 114.05 1yhq n GLY 47 Ca -0.02 -0.66 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 1yhq n GLY 47 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yhq s SER 48 N 0.00 5.00 0.11 1.61 1.04 -1.21 -4.86 113.70 115.38 1yhq s SER 48 Ca 0.00 1.79 -0.34 0.00 0.48 0.00 0.00 55.95 57.88 1yhq s SER 48 Cb 0.00 -2.52 -0.13 0.00 0.10 0.00 0.00 66.02 63.47 1yhq s SER 48 CO 0.00 -1.70 1.64 -0.67 0.98 0.00 0.00 173.24 173.49 1yhq n ASP 49 N -3.07 3.17 0.30 7.02 -0.08 -1.26 -4.85 116.55 117.78 1yhq n ASP 49 Ca 0.09 1.06 0.19 0.00 -1.51 0.00 0.00 54.79 54.61 1yhq n ASP 49 Cb 0.53 -1.42 1.00 0.00 2.34 0.00 0.00 41.12 43.57 1yhq n ASP 49 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1yhq h GLU 50 N 6.62 0.00 -0.25 -0.67 5.08 -1.98 -1.81 114.58 121.57 1yhq h GLU 50 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1yhq h GLU 50 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1yhq h GLU 50 CO 0.90 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 179.57 1yhq n TYR 51 N -3.44 0.32 -1.67 4.33 4.02 -1.26 -4.94 117.16 114.52 1yhq n TYR 51 Ca -0.02 -0.24 -0.47 0.00 -0.01 0.00 0.00 57.90 57.16 1yhq n TYR 51 Cb 0.17 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.44 1yhq n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1yhq n ALA 52 N 0.92 1.05 0.00 -0.72 0.00 -0.68 -0.53 120.51 120.55 1yhq n ALA 52 Ca 0.13 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1yhq n ALA 52 Cb 0.45 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.35 1yhq n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yhq n GLY 53 N 4.48 1.93 0.46 0.00 0.00 -1.26 -4.26 105.19 106.53 1yhq n GLY 53 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1yhq n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yhq n LEU 54 N 0.00 1.76 -3.63 0.99 4.77 0.31 -3.78 117.00 117.42 1yhq n LEU 54 Ca 0.00 -0.60 -0.41 0.00 -0.03 0.00 0.00 56.01 54.97 1yhq n LEU 54 Cb 0.00 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 1yhq n LEU 54 CO 0.00 0.32 2.80 0.54 -1.33 0.00 0.00 177.39 179.72 1yhq n ARG 55 N -0.06 3.17 -3.59 3.23 1.74 -1.24 -4.82 116.66 115.10 1yhq n ARG 55 Ca 0.12 -2.60 -0.12 0.00 -0.77 0.00 0.00 57.85 54.48 1yhq n ARG 55 Cb 0.43 -3.12 -0.06 0.00 -1.02 0.00 0.00 32.46 28.69 1yhq n ARG 55 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1yhq s THR 56 N 2.60 0.00 -1.22 0.55 -1.32 -1.26 -5.02 115.64 109.97 1yhq s THR 56 Ca 0.52 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 61.14 1yhq s THR 56 Cb 0.15 -1.00 0.56 0.00 -1.51 0.00 0.00 72.50 70.70 1yhq s THR 56 CO -0.08 0.00 1.43 -0.81 -2.21 0.00 0.00 174.62 172.95 1yhq n PRO 57 N 1.40 3.13 -1.46 7.08 -0.04 -1.26 -4.99 135.00 138.86 1yhq n PRO 57 Ca -0.13 -2.20 -0.51 0.00 -0.04 0.00 0.00 63.50 60.62 1yhq n PRO 57 Cb 0.57 -1.76 -0.04 0.00 -0.04 0.00 0.00 33.50 32.23 1yhq n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yhq n ALA 58 N 0.81 -2.67 -2.50 0.55 0.00 -1.26 -4.98 120.51 110.46 1yhq n ALA 58 Ca 0.20 0.48 -0.15 0.00 0.00 0.00 0.00 53.44 53.97 1yhq n ALA 58 Cb 0.72 -1.72 -0.11 0.00 0.00 0.00 0.00 19.45 18.34 1yhq n ALA 58 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1yhq s GLU 59 N -0.73 0.85 0.11 0.00 2.12 -0.84 -4.67 118.70 115.55 1yhq s GLU 59 Ca 0.71 -1.15 -0.19 0.00 0.36 0.00 0.00 54.97 54.70 1yhq s GLU 59 Cb -0.99 -0.57 -0.07 0.00 0.26 0.00 0.00 34.13 32.76 1yhq s GLU 59 CO 0.56 0.09 0.61 0.45 -0.54 0.00 0.00 175.26 176.43 1yhq s SER 60 N -2.41 7.07 0.13 -1.70 0.15 -1.26 0.15 113.70 115.83 1yhq s SER 60 Ca 0.05 1.30 0.27 0.00 0.70 0.00 0.00 55.95 58.27 1yhq s SER 60 Cb -0.03 -2.37 0.96 0.00 -1.71 0.00 0.00 66.02 62.87 1yhq s SER 60 CO 0.00 0.22 1.82 0.49 1.20 0.00 0.00 173.24 176.97 1yhq n PHE 61 N 1.46 0.58 -4.41 3.44 3.01 -1.26 -4.96 117.46 115.31 1yhq n PHE 61 Ca -0.08 0.17 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1yhq n PHE 61 Cb 0.51 -0.78 0.00 0.00 -0.01 0.00 0.00 39.48 39.19 1yhq n PHE 61 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1yhq n GLY 62 N 1.26 -0.35 3.79 1.37 0.00 -1.26 -4.83 105.19 105.17 1yhq n GLY 62 Ca 0.06 -1.07 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 1yhq n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yhq s SER 63 N -4.00 5.44 0.00 1.61 0.01 -1.26 -4.60 113.70 110.89 1yhq s SER 63 Ca 0.00 1.88 0.00 0.00 1.31 0.00 0.00 55.95 59.14 1yhq s SER 63 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1yhq s SER 63 CO 0.00 -1.41 0.00 0.61 0.41 0.00 0.00 173.24 172.85 1yhq n GLY 64 N -0.85 4.10 1.25 3.44 0.00 -1.26 -4.97 105.19 106.90 1yhq n GLY 64 Ca 0.09 -0.92 0.08 0.00 0.00 0.00 0.00 46.02 45.27 1yhq n GLY 64 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1yhq n ARG 65 N 0.00 3.63 -2.89 1.61 1.85 -1.26 -4.93 116.66 114.66 1yhq n ARG 65 Ca 0.00 -2.94 -0.18 0.00 -1.00 0.00 0.00 57.85 53.73 1yhq n ARG 65 Cb 0.00 -1.98 0.03 0.00 -1.05 0.00 0.00 32.46 29.46 1yhq n ARG 65 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1yhq n GLY 66 N -0.06 -0.27 3.28 2.89 0.00 -1.26 -5.01 105.19 104.76 1yhq n GLY 66 Ca 0.24 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1yhq n GLY 66 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1yhq s GLN 67 N -5.49 1.11 0.44 1.61 0.74 -1.26 -5.11 119.66 111.69 1yhq s GLN 67 Ca 0.26 -1.14 -0.25 0.00 0.05 0.00 0.00 55.36 54.28 1yhq s GLN 67 Cb -0.11 -1.35 -0.08 0.00 1.10 0.00 0.00 33.01 32.57 1yhq s GLN 67 CO 0.32 0.31 1.30 0.00 -0.55 0.00 0.00 175.29 176.67 1yhq s ALA 68 N -1.16 3.13 -0.97 1.58 0.00 -1.26 -4.84 121.76 118.24 1yhq s ALA 68 Ca 0.06 1.22 -0.22 0.00 0.00 0.00 0.00 51.96 53.01 1yhq s ALA 68 Cb -0.10 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.41 1yhq s ALA 68 CO 0.04 -0.93 1.92 0.72 0.00 0.00 0.00 175.76 177.51 1yhq n HIS 69 N -0.22 2.32 -5.12 0.00 -0.00 -1.26 -4.88 115.22 106.06 1yhq n HIS 69 Ca 0.06 -1.66 -0.32 0.00 -0.00 0.00 0.00 57.72 55.80 1yhq n HIS 69 Cb 0.44 -2.15 -0.15 0.00 -0.00 0.00 0.00 29.99 28.13 1yhq n HIS 69 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1yhq s VAL 70 N 7.83 2.41 0.21 1.59 1.01 -1.26 -4.97 120.40 127.22 1yhq s VAL 70 Ca 0.63 -0.94 -0.32 0.00 0.00 0.00 0.00 61.98 61.35 1yhq s VAL 70 Cb 0.07 -1.91 -0.13 0.00 0.00 0.00 0.00 36.38 34.41 1yhq s VAL 70 CO 0.13 0.57 1.61 -2.65 0.00 0.00 0.00 175.10 174.76 1yhq n PRO 71 N 2.88 2.46 -4.12 2.72 -0.02 -1.26 -4.32 135.00 133.34 1yhq n PRO 71 Ca -0.17 0.88 -0.12 0.00 -2.02 0.00 0.00 63.50 62.07 1yhq n PRO 71 Cb 0.52 -2.67 -0.11 0.00 -0.02 0.00 0.00 33.50 31.23 1yhq n PRO 71 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1yhq s LYS 72 N 0.54 0.69 -0.07 -0.52 1.02 0.12 -1.16 119.74 120.37 1yhq s LYS 72 Ca 0.73 -1.03 -0.03 0.00 0.02 0.00 0.00 55.97 55.66 1yhq s LYS 72 Cb -0.58 -0.30 0.04 0.00 -0.52 0.00 0.00 37.83 36.47 1yhq s LYS 72 CO 0.40 0.03 0.15 -1.17 -0.92 0.00 0.00 175.35 173.84 1yhq s LEU 73 N -2.25 0.73 -1.54 3.17 2.96 0.99 -1.99 118.68 120.75 1yhq s LEU 73 Ca 0.00 0.32 -0.13 0.00 -0.22 0.00 0.00 54.13 54.10 1yhq s LEU 73 Cb -0.03 0.40 0.09 0.00 0.50 0.00 0.00 46.19 47.14 1yhq s LEU 73 CO -0.02 -0.15 0.88 0.47 -1.32 0.00 0.00 176.35 176.22 1yhq n ASP 74 N 4.15 -3.83 -0.49 3.68 8.00 -1.26 -0.53 116.55 126.27 1yhq n ASP 74 Ca -0.26 -0.85 -0.06 0.00 0.71 0.00 0.00 54.79 54.33 1yhq n ASP 74 Cb 0.52 -3.59 -0.03 0.00 -0.02 0.00 0.00 41.12 38.00 1yhq n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yhq n GLY 75 N -1.64 0.77 3.31 0.44 0.00 -1.26 -4.99 105.19 101.82 1yhq n GLY 75 Ca -0.01 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 1yhq n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yhq s ARG 76 N -2.17 2.81 0.37 1.61 6.06 0.31 -5.10 118.95 122.84 1yhq s ARG 76 Ca 0.00 -0.82 -0.26 0.00 -2.50 0.00 0.00 55.73 52.15 1yhq s ARG 76 Cb 0.00 -2.32 -0.09 0.00 0.06 0.00 0.00 34.95 32.60 1yhq s ARG 76 CO 0.00 0.35 1.11 0.00 -2.50 0.00 0.00 175.30 174.26 1yhq s ALA 77 N -0.05 3.19 0.30 6.12 0.00 -1.26 -0.01 121.76 130.04 1yhq s ALA 77 Ca -0.05 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 52.65 1yhq s ALA 77 Cb -0.14 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.65 1yhq s ALA 77 CO 0.05 -0.34 0.56 1.03 0.00 0.00 0.00 175.76 177.05 1yhq s ARG 78 N -2.17 1.78 0.00 0.00 0.52 -0.31 -4.73 118.95 114.03 1yhq s ARG 78 Ca 0.54 -1.37 0.00 0.00 -0.52 0.00 0.00 55.73 54.39 1yhq s ARG 78 Cb -0.28 0.51 0.00 0.00 0.52 0.00 0.00 34.95 35.70 1yhq s ARG 78 CO 0.35 -0.77 0.00 -2.13 0.02 0.00 0.00 175.30 172.78 1yhq n ARG 79 N -0.46 0.00 -1.72 3.54 0.63 -1.25 -4.48 116.66 112.92 1yhq n ARG 79 Ca -0.02 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.52 1yhq n ARG 79 Cb 0.61 0.00 0.04 0.00 0.45 0.00 0.00 32.46 33.56 1yhq n ARG 79 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1yhq n VAL 80 N 0.00 3.52 -0.19 5.15 0.24 -1.26 0.23 118.33 126.02 1yhq n VAL 80 Ca 0.00 -0.50 0.24 0.00 -2.04 0.00 0.00 64.34 62.04 1yhq n VAL 80 Cb 0.00 -1.60 0.63 0.00 -1.47 0.00 0.00 33.84 31.40 1yhq n VAL 80 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1yhq h PRO 81 N 1.50 0.16 -0.00 7.34 0.11 -1.90 0.60 132.00 139.82 1yhq h PRO 81 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1yhq h PRO 81 Cb 1.31 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1yhq h PRO 81 CO 0.57 0.11 -0.06 0.00 -0.21 0.00 0.00 178.00 178.41 1yhq n GLN 82 N -4.38 0.75 -3.44 1.05 0.00 -1.26 -4.82 117.38 105.27 1yhq n GLN 82 Ca 0.18 -0.20 -0.38 0.00 0.00 0.00 0.00 57.00 56.60 1yhq n GLN 82 Cb 0.81 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 29.50 1yhq n GLN 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1yhq s ALA 83 N -2.38 3.65 0.26 2.61 0.00 0.20 -5.01 121.76 121.09 1yhq s ALA 83 Ca 0.33 -0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.79 1yhq s ALA 83 Cb 0.20 -2.46 -0.11 0.00 0.00 0.00 0.00 23.12 20.75 1yhq s ALA 83 CO 0.45 0.39 1.60 0.08 0.00 0.00 0.00 175.76 178.27 1yhq s VAL 84 N -0.79 2.18 0.00 0.00 1.01 -1.26 -0.13 120.40 121.40 1yhq s VAL 84 Ca 0.25 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1yhq s VAL 84 Cb -0.17 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1yhq s VAL 84 CO 0.13 0.02 0.00 0.29 0.00 0.00 0.00 175.10 175.54 1yhq n LYS 85 N 2.69 -0.03 -1.93 2.72 4.76 -1.26 -4.73 118.16 120.38 1yhq n LYS 85 Ca 0.10 0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.26 1yhq n LYS 85 Cb 0.37 -2.75 0.12 0.00 -1.84 0.00 0.00 35.03 30.94 1yhq n LYS 85 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1yhq s GLY 86 N -2.00 1.66 0.87 0.72 0.00 0.81 -4.46 107.32 104.92 1yhq s GLY 86 Ca 0.00 -0.86 -0.11 0.00 0.00 0.00 0.00 44.72 43.75 1yhq s GLY 86 CO 0.00 -0.28 1.11 1.09 0.00 0.00 0.00 173.10 175.02 1yhq s ARG 87 N -5.67 1.43 -0.20 2.90 1.70 0.13 -4.74 118.95 114.50 1yhq s ARG 87 Ca 0.66 1.24 -0.21 0.00 -0.47 0.00 0.00 55.73 56.94 1yhq s ARG 87 Cb -0.08 -1.80 -0.02 0.00 -0.57 0.00 0.00 34.95 32.48 1yhq s ARG 87 CO 0.50 -2.24 0.66 0.45 -1.08 0.00 0.00 175.30 173.59 1yhq s SER 88 N -3.07 6.72 0.11 -2.89 0.15 -1.26 -3.95 113.70 109.50 1yhq s SER 88 Ca 0.64 0.87 -0.21 0.00 0.70 0.00 0.00 55.95 57.95 1yhq s SER 88 Cb -0.20 -2.36 -0.09 0.00 -1.71 0.00 0.00 66.02 61.66 1yhq s SER 88 CO 0.57 -0.30 1.72 0.00 1.20 0.00 0.00 173.24 176.44 1yhq h ALA 89 N 7.49 0.06 -2.08 5.45 0.00 -1.94 -3.36 119.26 124.88 1yhq h ALA 89 Ca -0.31 0.04 -0.57 0.00 0.00 0.00 0.00 54.91 54.07 1yhq h ALA 89 Cb 1.14 0.08 -0.39 0.00 0.00 0.00 0.00 17.79 18.62 1yhq h ALA 89 CO 0.78 -0.49 -1.05 0.72 0.00 0.00 0.00 179.25 179.21 1yhq n HIS 90 N -5.15 -0.13 -1.83 0.00 8.25 -1.26 -5.13 115.22 109.96 1yhq n HIS 90 Ca -0.05 -3.57 -0.29 0.00 -0.26 0.00 0.00 57.72 53.55 1yhq n HIS 90 Cb 0.08 -0.27 0.09 0.00 1.12 0.00 0.00 29.99 31.01 1yhq n HIS 90 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1yhq s PRO 91 N -1.09 2.02 0.54 -0.41 0.04 -1.26 -5.01 135.00 129.84 1yhq s PRO 91 Ca 0.35 0.22 -0.22 0.00 0.04 0.00 0.00 61.00 61.39 1yhq s PRO 91 Cb 0.15 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.69 1yhq s PRO 91 CO -0.12 -1.58 1.37 -2.14 0.04 0.00 0.00 177.00 174.58 1yhq s PRO 92 N -5.48 3.16 -0.00 0.56 0.02 -1.26 -4.95 135.00 127.05 1yhq s PRO 92 Ca 0.61 2.27 0.05 0.00 0.02 0.00 0.00 61.00 63.95 1yhq s PRO 92 Cb -0.12 -2.28 -0.01 0.00 0.02 0.00 0.00 34.50 32.11 1yhq s PRO 92 CO 0.50 -1.19 -0.16 0.15 -0.33 0.00 0.00 177.00 175.98 1yhq s LYS 93 N -2.88 1.22 0.21 5.54 1.02 -1.25 -3.34 119.74 120.28 1yhq s LYS 93 Ca 0.71 -0.59 -0.10 0.00 0.02 0.00 0.00 55.97 56.01 1yhq s LYS 93 Cb -0.41 -1.20 0.17 0.00 -0.52 0.00 0.00 37.83 35.87 1yhq s LYS 93 CO 0.49 0.32 1.88 1.15 -0.92 0.00 0.00 175.35 178.28 1yhq h THR 94 N 4.71 1.21 -0.00 2.17 2.02 -1.79 -2.86 112.91 118.38 1yhq h THR 94 Ca -0.36 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.44 1yhq h THR 94 Cb 1.16 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1yhq h THR 94 CO 0.48 0.20 0.01 -0.33 0.37 0.00 0.00 175.52 176.25 1yhq h GLU 95 N 1.07 0.00 -6.74 6.66 3.07 -1.96 -3.44 114.58 113.25 1yhq h GLU 95 Ca 0.29 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.62 1yhq h GLU 95 Cb -0.11 0.00 0.06 0.00 -0.84 0.00 0.00 28.75 27.86 1yhq h GLU 95 CO -0.06 0.00 0.84 0.21 -1.40 0.00 0.00 179.01 178.60 1yhq s LYS 96 N -4.17 4.20 -0.52 2.33 2.20 -1.08 -4.95 119.74 117.75 1yhq s LYS 96 Ca -0.05 2.43 -0.27 0.00 -0.36 0.00 0.00 55.97 57.72 1yhq s LYS 96 Cb 0.13 -3.09 0.03 0.00 -1.51 0.00 0.00 37.83 33.40 1yhq s LYS 96 CO 0.41 -0.55 1.06 0.34 -0.36 0.00 0.00 175.35 176.26 1yhq s ASP 97 N 0.59 6.48 -0.08 1.43 3.68 -1.26 -4.89 116.67 122.63 1yhq s ASP 97 Ca 0.63 0.10 0.17 0.00 2.13 0.00 0.00 52.55 55.59 1yhq s ASP 97 Cb -0.45 -2.50 0.63 0.00 -1.45 0.00 0.00 42.92 39.15 1yhq s ASP 97 CO 0.42 -1.27 1.53 0.54 0.13 0.00 0.00 175.17 176.52 1yhq n ARG 98 N 7.78 3.24 -3.74 4.34 1.74 -1.26 -4.95 116.66 123.80 1yhq n ARG 98 Ca 0.07 -2.51 -0.26 0.00 -0.77 0.00 0.00 57.85 54.38 1yhq n ARG 98 Cb 0.49 -1.76 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1yhq n ARG 98 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1yhq s SER 99 N -0.88 6.36 -0.11 0.55 1.04 -1.26 -4.53 113.70 114.87 1yhq s SER 99 Ca 0.45 0.32 0.03 0.00 0.48 0.00 0.00 55.95 57.24 1yhq s SER 99 Cb 0.28 -1.97 -0.00 0.00 0.10 0.00 0.00 66.02 64.42 1yhq s SER 99 CO 0.24 -0.06 -0.22 -0.76 0.98 0.00 0.00 173.24 173.42 1yhq s LEU 100 N -3.51 2.20 0.57 2.42 1.43 -1.26 -5.01 118.68 115.52 1yhq s LEU 100 Ca 0.37 -0.53 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 1yhq s LEU 100 Cb -0.11 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 1yhq s LEU 100 CO 0.30 0.15 0.91 -1.81 0.23 0.00 0.00 176.35 176.13 1yhq s ASP 101 N 0.40 5.95 -0.29 2.29 1.11 -1.26 -4.90 116.67 119.98 1yhq s ASP 101 Ca -0.16 1.00 -0.13 0.00 0.18 0.00 0.00 52.55 53.43 1yhq s ASP 101 Cb -0.17 -2.09 0.11 0.00 1.07 0.00 0.00 42.92 41.83 1yhq s ASP 101 CO 0.07 -0.88 0.69 -0.22 1.18 0.00 0.00 175.17 176.01 1yhq s LEU 102 N -4.99 -1.01 0.37 1.23 2.96 -1.26 -5.04 118.68 110.95 1yhq s LEU 102 Ca 0.52 1.50 -0.28 0.00 -0.22 0.00 0.00 54.13 55.65 1yhq s LEU 102 Cb -0.11 2.31 -0.11 0.00 0.50 0.00 0.00 46.19 48.78 1yhq s LEU 102 CO 0.48 -0.22 1.45 0.59 -1.32 0.00 0.00 176.35 177.33 1yhq n ASN 103 N 4.78 3.60 -0.37 3.68 4.13 -1.26 -4.83 115.26 124.99 1yhq n ASN 103 Ca -0.16 1.22 0.03 0.00 1.68 0.00 0.00 54.58 57.35 1yhq n ASN 103 Cb 0.55 -1.59 0.18 0.00 -1.54 0.00 0.00 39.78 37.37 1yhq n ASN 103 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 1yhq h ASP 104 N 2.89 1.02 -0.26 6.41 3.32 -2.00 -0.85 116.42 126.94 1yhq h ASP 104 Ca -0.50 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 1yhq h ASP 104 Cb 1.25 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 1yhq h ASP 104 CO 0.64 0.64 0.10 0.11 -1.72 0.00 0.00 179.24 179.01 1yhq h LYS 105 N 1.15 0.39 -0.72 3.56 1.57 -1.99 0.20 116.57 120.75 1yhq h LYS 105 Ca 0.44 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 59.14 1yhq h LYS 105 Cb 0.20 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 1yhq h LYS 105 CO -0.18 0.43 0.42 1.49 -0.57 0.00 0.00 179.45 181.03 1yhq h GLU 106 N 0.27 0.98 -0.30 3.15 4.81 -1.84 0.59 114.58 122.24 1yhq h GLU 106 Ca 0.09 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 1yhq h GLU 106 Cb 0.18 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1yhq h GLU 106 CO -0.01 0.71 -0.12 -0.09 -0.73 0.00 0.00 179.01 178.77 1yhq h ARG 107 N 0.98 0.62 -0.55 1.92 2.43 -0.90 -2.34 114.38 116.55 1yhq h ARG 107 Ca 0.26 -0.26 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1yhq h ARG 107 Cb -0.01 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 1yhq h ARG 107 CO -0.05 0.84 0.14 1.96 -1.51 0.00 0.00 179.97 181.36 1yhq h GLN 108 N 0.38 0.83 -0.56 0.20 4.20 -0.31 -1.27 115.11 118.58 1yhq h GLN 108 Ca 0.07 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1yhq h GLN 108 Cb 0.64 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 1yhq h GLN 108 CO 0.04 0.74 0.20 1.25 -0.67 0.00 0.00 178.83 180.39 1yhq h LEU 109 N 0.80 0.75 -0.74 1.46 5.85 -0.76 -1.84 115.31 120.83 1yhq h LEU 109 Ca 0.18 -0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 1yhq h LEU 109 Cb 0.28 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1yhq h LEU 109 CO -0.00 0.70 -0.47 0.00 -0.34 0.00 0.00 178.44 178.32 1yhq h ALA 110 N 1.41 0.91 0.08 1.25 0.00 -0.76 -0.39 119.26 121.76 1yhq h ALA 110 Ca 0.19 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1yhq h ALA 110 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1yhq h ALA 110 CO -0.01 0.65 -0.04 0.28 0.00 0.00 0.00 179.25 180.13 1yhq h VAL 111 N 0.31 1.01 -0.85 0.00 2.07 -0.60 0.46 116.25 118.65 1yhq h VAL 111 Ca 0.02 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.27 1yhq h VAL 111 Cb 0.95 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.86 1yhq h VAL 111 CO 0.08 0.07 0.55 0.03 0.02 0.00 0.00 177.57 178.32 1yhq h ARG 112 N -0.23 1.05 -0.44 1.57 3.08 -1.25 -0.08 114.38 118.07 1yhq h ARG 112 Ca -0.01 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.87 1yhq h ARG 112 Cb 0.20 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1yhq h ARG 112 CO 0.02 0.69 -0.15 1.03 -1.07 0.00 0.00 179.97 180.50 1yhq h SER 113 N 1.08 0.83 0.40 7.04 0.87 -0.85 -1.23 113.55 121.69 1yhq h SER 113 Ca 0.33 -0.27 -0.12 0.00 -1.23 0.00 0.00 61.79 60.50 1yhq h SER 113 Cb -0.03 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 1yhq h SER 113 CO -0.10 0.98 -0.52 0.00 -0.53 0.00 0.00 176.83 176.66 1yhq h ALA 114 N 1.09 1.05 -0.16 6.23 0.00 -0.38 -1.91 119.26 125.17 1yhq h ALA 114 Ca 0.12 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1yhq h ALA 114 Cb 0.65 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1yhq h ALA 114 CO 0.05 0.66 0.01 1.25 0.00 0.00 0.00 179.25 181.22 1yhq h LEU 115 N 0.10 0.27 -1.42 0.00 5.85 -0.59 -2.94 115.31 116.58 1yhq h LEU 115 Ca 0.00 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 1yhq h LEU 115 Cb 0.95 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.89 1yhq h LEU 115 CO 0.07 0.49 0.13 0.00 -0.34 0.00 0.00 178.44 178.79 1yhq h ALA 116 N 0.79 1.55 0.00 1.25 0.00 -1.01 -0.98 119.26 120.86 1yhq h ALA 116 Ca 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1yhq h ALA 116 Cb 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1yhq h ALA 116 CO 0.01 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.61 1yhq h ALA 117 N 1.63 1.00 0.00 0.00 0.00 -1.16 -1.82 119.26 118.91 1yhq h ALA 117 Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1yhq h ALA 117 Cb 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1yhq h ALA 117 CO -0.01 0.00 -0.18 1.15 0.00 0.00 0.00 179.25 180.21 1yhq h THR 118 N 0.00 0.42 -0.48 0.00 2.02 -1.15 -3.16 112.91 110.56 1yhq h THR 118 Ca 0.00 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.10 1yhq h THR 118 Cb 0.15 1.79 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1yhq h THR 118 CO 0.00 0.18 0.00 0.00 0.37 0.00 0.00 175.52 176.07 1yhq n ALA 119 N -2.19 2.79 -3.85 6.16 0.00 -0.68 -3.02 120.51 119.72 1yhq n ALA 119 Ca 0.01 -1.07 -0.33 0.00 0.00 0.00 0.00 53.44 52.05 1yhq n ALA 119 Cb 0.44 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.76 1yhq n ALA 119 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1yhq s ASP 120 N -0.84 4.80 0.47 0.00 -1.08 -1.19 -4.72 116.67 114.10 1yhq s ASP 120 Ca 0.36 -2.80 0.32 0.00 -0.52 0.00 0.00 52.55 49.91 1yhq s ASP 120 Cb 0.22 -1.74 1.44 0.00 -1.46 0.00 0.00 42.92 41.38 1yhq s ASP 120 CO 0.19 -0.32 1.68 0.00 0.52 0.00 0.00 175.17 177.23 1yhq h ALA 121 N 6.93 2.88 -0.21 3.66 0.00 -1.84 0.68 119.26 131.36 1yhq h ALA 121 Ca -0.05 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1yhq h ALA 121 Cb 0.94 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1yhq h ALA 121 CO 0.68 -1.41 -0.26 -0.44 0.00 0.00 0.00 179.25 177.82 1yhq h ASP 122 N 0.12 0.59 -0.11 0.00 3.32 -1.95 -1.22 116.42 117.17 1yhq h ASP 122 Ca 0.75 -0.50 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 1yhq h ASP 122 Cb 2.50 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 41.88 1yhq h ASP 122 CO -0.26 0.97 0.07 -0.07 -1.72 0.00 0.00 179.24 178.23 1yhq h LEU 123 N 0.23 0.13 -1.20 1.55 3.38 -1.22 0.77 115.31 118.95 1yhq h LEU 123 Ca 0.03 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.05 1yhq h LEU 123 Cb 0.82 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 1yhq h LEU 123 CO 0.06 0.14 0.57 0.58 0.09 0.00 0.00 178.44 179.88 1yhq h VAL 124 N 0.12 0.98 -0.04 1.22 2.07 -1.31 0.19 116.25 119.49 1yhq h VAL 124 Ca 0.04 -0.31 -0.19 0.00 0.82 0.00 0.00 66.70 67.06 1yhq h VAL 124 Cb 0.03 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1yhq h VAL 124 CO -0.01 0.16 -0.79 0.00 0.02 0.00 0.00 177.57 176.95 1yhq h ALA 125 N 1.55 0.57 -0.34 1.67 0.00 -0.70 -3.14 119.26 118.88 1yhq h ALA 125 Ca 0.41 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 1yhq h ALA 125 Cb 0.38 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1yhq h ALA 125 CO -0.17 0.81 -0.31 -0.44 0.00 0.00 0.00 179.25 179.14 1yhq h ASP 126 N 0.20 0.75 -0.15 0.00 3.32 0.54 -2.52 116.42 118.56 1yhq h ASP 126 Ca -0.04 -0.30 0.04 0.00 0.02 0.00 0.00 57.03 56.75 1yhq h ASP 126 Cb 1.39 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.72 1yhq h ASP 126 CO 0.13 1.00 0.13 -0.09 -1.72 0.00 0.00 179.24 178.69 1yhq h ARG 127 N 0.61 0.00 0.00 3.56 2.43 -0.64 -3.46 114.38 116.89 1yhq h ARG 127 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1yhq h ARG 127 Cb 0.83 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 1yhq h ARG 127 CO 0.07 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.94 1yhq n GLY 128 N -1.47 1.63 3.71 2.80 0.00 -0.95 -5.11 105.19 105.79 1yhq n GLY 128 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1yhq n GLY 128 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1yhq n HIS 129 N 0.00 1.98 -3.98 1.61 8.25 -1.20 -5.00 115.22 116.88 1yhq n HIS 129 Ca 0.00 0.46 -0.35 0.00 -0.26 0.00 0.00 57.72 57.57 1yhq n HIS 129 Cb 0.00 -2.33 -0.10 0.00 1.12 0.00 0.00 29.99 28.68 1yhq n HIS 129 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1yhq s GLU 130 N -2.61 3.92 -0.20 -0.41 0.41 -1.26 -4.68 118.70 113.87 1yhq s GLU 130 Ca 0.68 -0.37 -0.32 0.00 -0.41 0.00 0.00 54.97 54.55 1yhq s GLU 130 Cb -0.45 -3.23 0.15 0.00 -1.78 0.00 0.00 34.13 28.82 1yhq s GLU 130 CO 0.52 0.20 1.18 -0.59 -0.49 0.00 0.00 175.26 176.08 1yhq s PHE 131 N 0.57 -0.17 -0.75 1.61 -0.12 -1.26 -1.99 117.98 115.88 1yhq s PHE 131 Ca 0.03 0.20 0.04 0.00 -0.05 0.00 0.00 56.93 57.15 1yhq s PHE 131 Cb -0.13 0.50 0.20 0.00 -0.63 0.00 0.00 43.02 42.96 1yhq s PHE 131 CO 0.01 -0.21 0.64 -0.25 -0.05 0.00 0.00 175.22 175.36 1yhq n ASP 132 N 0.23 3.54 -3.80 1.98 8.00 -0.47 -5.04 116.55 121.00 1yhq n ASP 132 Ca -0.02 -3.25 -0.09 0.00 0.71 0.00 0.00 54.79 52.13 1yhq n ASP 132 Cb 0.58 -0.82 -0.07 0.00 -0.02 0.00 0.00 41.12 40.80 1yhq n ASP 132 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1yhq s ARG 133 N -1.71 0.88 -0.11 -1.24 3.52 -1.26 -4.76 118.95 114.27 1yhq s ARG 133 Ca 0.29 -0.84 0.02 0.00 -0.13 0.00 0.00 55.73 55.06 1yhq s ARG 133 Cb -0.01 0.37 -0.08 0.00 -1.56 0.00 0.00 34.95 33.67 1yhq s ARG 133 CO -0.12 -0.30 -0.08 -0.25 -0.81 0.00 0.00 175.30 173.74 1yhq n ASP 134 N 0.00 3.08 -4.78 -2.12 8.00 -1.26 -4.98 116.55 114.49 1yhq n ASP 134 Ca -0.16 -0.05 -0.39 0.00 0.71 0.00 0.00 54.79 54.90 1yhq n ASP 134 Cb 0.62 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.63 1yhq n ASP 134 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1yhq s GLU 135 N -2.22 4.43 -0.20 -1.24 2.02 -1.26 -4.72 118.70 115.50 1yhq s GLU 135 Ca -0.13 0.99 -0.27 0.00 0.02 0.00 0.00 54.97 55.57 1yhq s GLU 135 Cb 0.04 -3.29 0.08 0.00 0.10 0.00 0.00 34.13 31.06 1yhq s GLU 135 CO 0.28 0.50 0.75 0.54 0.02 0.00 0.00 175.26 177.35 1yhq s VAL 136 N -0.79 0.00 1.17 2.63 0.11 -1.26 -4.62 120.40 117.63 1yhq s VAL 136 Ca 0.34 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 59.24 1yhq s VAL 136 Cb -0.21 -1.00 0.27 0.00 -1.53 0.00 0.00 36.38 33.91 1yhq s VAL 136 CO 0.23 0.00 1.05 -2.16 -3.33 0.00 0.00 175.10 170.88 1yhq s PRO 137 N -0.16 -0.93 -0.28 1.54 0.04 -1.17 -4.29 135.00 129.75 1yhq s PRO 137 Ca -0.03 0.43 -0.18 0.00 0.04 0.00 0.00 61.00 61.26 1yhq s PRO 137 Cb -0.03 -1.59 -0.02 0.00 0.04 0.00 0.00 34.50 32.90 1yhq s PRO 137 CO 0.03 -3.63 0.52 0.08 0.04 0.00 0.00 177.00 174.04 1yhq s VAL 138 N -2.70 5.05 -0.10 -0.36 1.01 -0.97 -4.95 120.40 117.38 1yhq s VAL 138 Ca 0.68 0.78 -0.06 0.00 0.00 0.00 0.00 61.98 63.39 1yhq s VAL 138 Cb -0.18 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 1yhq s VAL 138 CO 0.60 0.02 0.13 -0.69 0.00 0.00 0.00 175.10 175.16 1yhq s VAL 139 N 2.34 5.36 0.07 2.92 1.01 -1.26 -0.89 120.40 129.96 1yhq s VAL 139 Ca 0.21 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.30 1yhq s VAL 139 Cb -0.16 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1yhq s VAL 139 CO 0.10 0.57 -0.06 -0.69 0.00 0.00 0.00 175.10 175.02 1yhq s VAL 140 N -1.06 0.53 0.62 2.92 1.01 -0.88 -2.18 120.40 121.35 1yhq s VAL 140 Ca 0.17 -1.69 -0.18 0.00 0.00 0.00 0.00 61.98 60.28 1yhq s VAL 140 Cb -0.12 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 1yhq s VAL 140 CO 0.06 -0.79 1.20 -0.94 0.00 0.00 0.00 175.10 174.63 1yhq s SER 141 N -2.66 5.06 0.00 3.32 1.04 -0.34 -0.13 113.70 119.99 1yhq s SER 141 Ca 0.05 2.35 0.04 0.00 0.48 0.00 0.00 55.95 58.87 1yhq s SER 141 Cb 0.02 -2.59 0.21 0.00 0.10 0.00 0.00 66.02 63.76 1yhq s SER 141 CO -0.05 -1.68 0.82 0.47 0.98 0.00 0.00 173.24 173.78 1yhq n ASP 142 N -1.80 0.00 0.07 7.02 8.00 -1.26 -1.61 116.55 126.98 1yhq n ASP 142 Ca 0.13 0.04 0.12 0.00 0.71 0.00 0.00 54.79 55.80 1yhq n ASP 142 Cb 0.50 -0.13 0.46 0.00 -0.02 0.00 0.00 41.12 41.93 1yhq n ASP 142 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1yhq n ASP 143 N -1.13 0.48 0.07 -2.24 8.00 -1.26 -2.59 116.55 117.88 1yhq n ASP 143 Ca 0.02 0.57 0.06 0.00 0.71 0.00 0.00 54.79 56.16 1yhq n ASP 143 Cb 0.02 -0.69 0.50 0.00 -0.02 0.00 0.00 41.12 40.93 1yhq n ASP 143 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1yhq h PHE 144 N 0.00 0.34 0.00 1.24 3.57 -1.66 -0.87 116.94 119.56 1yhq h PHE 144 Ca 0.00 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1yhq h PHE 144 Cb 0.52 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.15 1yhq h PHE 144 CO 0.00 0.21 -0.03 0.93 -2.23 0.00 0.00 178.31 177.19 1yhq h GLU 145 N 0.37 0.00 -0.01 1.11 5.08 -1.74 -2.41 114.58 116.97 1yhq h GLU 145 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1yhq h GLU 145 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1yhq h GLU 145 CO -0.03 0.03 -0.17 -0.25 -1.00 0.00 0.00 179.01 177.59 1yhq n ASP 146 N -3.25 1.24 -4.73 1.42 8.00 -0.33 -4.91 116.55 113.98 1yhq n ASP 146 Ca -0.01 -1.12 -0.34 0.00 0.71 0.00 0.00 54.79 54.02 1yhq n ASP 146 Cb 0.20 0.10 0.08 0.00 -0.02 0.00 0.00 41.12 41.47 1yhq n ASP 146 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1yhq s LEU 147 N -2.33 3.38 0.00 0.64 1.43 -0.91 -4.96 118.68 115.94 1yhq s LEU 147 Ca 0.29 2.31 0.00 0.00 -1.03 0.00 0.00 54.13 55.69 1yhq s LEU 147 Cb 0.20 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 41.83 1yhq s LEU 147 CO 0.46 -2.06 0.00 0.52 0.23 0.00 0.00 176.35 175.50 1yhq n VAL 148 N -2.49 0.00 -3.05 -1.59 0.31 -1.26 -4.61 118.33 105.64 1yhq n VAL 148 Ca 0.13 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 64.06 1yhq n VAL 148 Cb 0.50 -0.63 -0.05 0.00 -0.91 0.00 0.00 33.84 32.75 1yhq n VAL 148 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1yhq s LYS 149 N -1.82 4.44 0.19 5.55 -0.14 -1.26 -4.29 119.74 122.41 1yhq s LYS 149 Ca 0.00 0.95 -0.12 0.00 -1.36 0.00 0.00 55.97 55.45 1yhq s LYS 149 Cb 0.00 -3.37 0.15 0.00 -1.68 0.00 0.00 37.83 32.93 1yhq s LYS 149 CO 0.00 0.27 1.81 1.15 -0.76 0.00 0.00 175.35 177.82 1yhq h THR 150 N 4.23 1.02 -0.84 2.17 2.02 -1.91 -1.92 112.91 117.68 1yhq h THR 150 Ca -0.44 -0.22 0.13 0.00 0.77 0.00 0.00 66.41 66.65 1yhq h THR 150 Cb 1.20 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 67.86 1yhq h THR 150 CO 0.71 0.12 0.55 1.56 0.37 0.00 0.00 175.52 178.83 1yhq h GLN 151 N 0.65 0.63 -0.76 6.66 1.08 -1.93 0.32 115.11 121.76 1yhq h GLN 151 Ca 0.24 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.36 1yhq h GLN 151 Cb 0.08 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 1yhq h GLN 151 CO -0.13 0.42 0.30 0.93 -0.95 0.00 0.00 178.83 179.40 1yhq h GLU 152 N 0.65 1.13 0.00 1.46 5.08 -1.74 -1.00 114.58 120.16 1yhq h GLU 152 Ca 0.41 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 1yhq h GLU 152 Cb 0.67 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1yhq h GLU 152 CO -0.17 0.91 -0.28 0.28 -1.00 0.00 0.00 179.01 178.76 1yhq h VAL 153 N 1.10 1.05 0.03 3.13 2.07 -0.88 -2.38 116.25 120.38 1yhq h VAL 153 Ca 0.25 -1.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1yhq h VAL 153 Cb 0.21 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1yhq h VAL 153 CO -0.02 0.27 -0.02 0.58 0.02 0.00 0.00 177.57 178.40 1yhq h VAL 154 N 0.00 1.13 -0.17 2.57 2.07 -0.35 -1.20 116.25 120.30 1yhq h VAL 154 Ca -0.00 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.04 1yhq h VAL 154 Cb 0.54 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 1yhq h VAL 154 CO 0.04 0.13 -0.09 0.28 0.02 0.00 0.00 177.57 177.95 1yhq h SER 155 N -0.27 -0.29 -0.74 0.57 0.02 -1.06 0.22 113.55 111.99 1yhq h SER 155 Ca -0.00 0.07 0.08 0.00 -0.84 0.00 0.00 61.79 61.10 1yhq h SER 155 Cb 0.25 0.16 -0.07 0.00 0.14 0.00 0.00 62.40 62.89 1yhq h SER 155 CO 0.01 -0.12 0.40 0.25 -1.14 0.00 0.00 176.83 176.23 1yhq h LEU 156 N -0.08 0.57 -1.03 5.07 5.85 -1.36 0.14 115.31 124.48 1yhq h LEU 156 Ca 0.09 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.78 1yhq h LEU 156 Cb 0.22 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1yhq h LEU 156 CO -0.22 0.34 -0.18 -0.07 -0.34 0.00 0.00 178.44 177.98 1yhq h LEU 157 N 0.70 0.48 -0.50 2.25 3.38 -0.51 -1.25 115.31 119.86 1yhq h LEU 157 Ca 0.35 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 58.02 1yhq h LEU 157 Cb 0.30 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1yhq h LEU 157 CO -0.23 0.68 -0.46 -0.33 0.09 0.00 0.00 178.44 178.19 1yhq h GLU 158 N 0.45 0.71 0.00 1.13 5.08 0.12 -1.56 114.58 120.51 1yhq h GLU 158 Ca 0.08 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1yhq h GLU 158 Cb 0.56 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1yhq h GLU 158 CO 0.04 1.02 -0.01 0.00 -1.00 0.00 0.00 179.01 179.05 1yhq h ALA 159 N 0.92 1.01 -0.73 3.43 0.00 -0.33 -2.16 119.26 121.39 1yhq h ALA 159 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1yhq h ALA 159 Cb 1.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1yhq h ALA 159 CO 0.10 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.64 1yhq n LEU 160 N -3.11 4.20 -3.13 0.00 4.77 -0.51 -4.88 117.00 114.34 1yhq n LEU 160 Ca 0.00 -2.11 -0.21 0.00 -0.03 0.00 0.00 56.01 53.66 1yhq n LEU 160 Cb 0.28 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1yhq n LEU 160 CO 0.27 0.96 -0.05 0.47 -1.33 0.00 0.00 177.39 177.70 1yhq n ASP 161 N 1.56 -4.28 0.00 -1.43 8.00 -0.81 -4.81 116.55 114.78 1yhq n ASP 161 Ca 0.25 -0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1yhq n ASP 161 Cb 0.70 -3.53 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 1yhq n ASP 161 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1yhq n VAL 162 N -3.97 0.33 0.26 2.53 3.14 -0.63 -1.36 118.33 118.62 1yhq n VAL 162 Ca -0.06 -0.51 0.15 0.00 -2.96 0.00 0.00 64.34 60.96 1yhq n VAL 162 Cb 0.57 1.00 0.50 0.00 -1.06 0.00 0.00 33.84 34.85 1yhq n VAL 162 CO 0.00 0.00 0.00 -0.74 -6.46 0.00 0.00 176.83 169.63 1yhq h HIS 163 N 0.00 0.00 -0.19 1.45 6.17 -1.82 -3.21 115.15 117.56 1yhq h HIS 163 Ca 0.00 0.00 0.05 0.00 0.71 0.00 0.00 60.37 61.13 1yhq h HIS 163 Cb 0.38 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.31 1yhq h HIS 163 CO 0.00 0.00 0.16 0.00 0.71 0.00 0.00 177.93 178.80 1yhq h ALA 164 N 2.01 1.99 -0.55 5.26 0.00 -1.85 -1.29 119.26 124.83 1yhq h ALA 164 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1yhq h ALA 164 Cb 0.68 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1yhq h ALA 164 CO 0.00 -0.25 -0.07 0.22 0.00 0.00 0.00 179.25 179.15 1yhq h ASP 165 N 0.00 0.99 0.29 0.00 3.58 -1.40 -1.54 116.42 118.34 1yhq h ASP 165 Ca 0.09 -0.30 -0.08 0.00 0.42 0.00 0.00 57.03 57.16 1yhq h ASP 165 Cb 0.41 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1yhq h ASP 165 CO -0.00 1.08 -0.34 0.40 -2.88 0.00 0.00 179.24 177.50 1yhq h ILE 166 N 0.90 1.26 -0.40 2.25 2.04 -1.46 -1.14 117.51 120.95 1yhq h ILE 166 Ca 0.15 -1.23 -0.09 0.00 1.00 0.00 0.00 64.86 64.69 1yhq h ILE 166 Cb 0.62 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 1yhq h ILE 166 CO 0.04 0.36 -0.13 0.44 0.00 0.00 0.00 178.15 178.86 1yhq h ASP 167 N 0.07 0.72 -0.41 1.72 3.45 -1.10 -1.89 116.42 118.98 1yhq h ASP 167 Ca 0.01 -0.21 -0.03 0.00 0.43 0.00 0.00 57.03 57.23 1yhq h ASP 167 Cb 0.64 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 39.20 1yhq h ASP 167 CO 0.05 0.86 0.15 -0.09 -1.57 0.00 0.00 179.24 178.64 1yhq h ARG 168 N 0.66 0.61 0.00 3.56 2.43 -0.27 -2.49 114.38 118.88 1yhq h ARG 168 Ca 0.11 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1yhq h ARG 168 Cb 0.59 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1yhq h ARG 168 CO 0.04 0.58 0.00 0.00 -1.51 0.00 0.00 179.97 179.08 1yhq n ALA 169 N -2.31 2.34 -1.27 2.80 0.00 -0.61 -4.09 120.51 117.37 1yhq n ALA 169 Ca -0.00 -0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.10 1yhq n ALA 169 Cb 0.15 -1.41 -0.11 0.00 0.00 0.00 0.00 19.45 18.08 1yhq n ALA 169 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1yhq n ASP 170 N -1.17 5.98 -3.33 0.00 4.64 -0.74 -4.42 116.55 117.51 1yhq n ASP 170 Ca 0.15 -2.86 -0.01 0.00 -1.38 0.00 0.00 54.79 50.69 1yhq n ASP 170 Cb 0.16 -1.33 -0.04 0.00 -1.04 0.00 0.00 41.12 38.87 1yhq n ASP 170 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1yhq s GLU 171 N -0.37 0.49 0.28 -0.67 2.02 -1.26 -5.05 118.70 114.14 1yhq s GLU 171 Ca 0.63 0.96 -0.12 0.00 0.02 0.00 0.00 54.97 56.45 1yhq s GLU 171 Cb 0.35 0.32 -0.08 0.00 0.10 0.00 0.00 34.13 34.81 1yhq s GLU 171 CO -0.11 -0.53 0.65 0.95 0.02 0.00 0.00 175.26 176.24 1yhq s THR 172 N 2.76 4.80 -0.11 3.63 -4.23 -1.26 -4.44 115.64 116.80 1yhq s THR 172 Ca 0.13 0.70 -0.02 0.00 -1.18 0.00 0.00 61.69 61.32 1yhq s THR 172 Cb -0.14 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.05 1yhq s THR 172 CO -0.19 -0.14 -0.04 -0.75 -0.54 0.00 0.00 174.62 172.96 1yhq s LYS 173 N -2.94 3.18 -0.56 3.99 2.20 0.19 -4.94 119.74 120.87 1yhq s LYS 173 Ca 0.51 -0.50 -0.18 0.00 -0.36 0.00 0.00 55.97 55.44 1yhq s LYS 173 Cb -0.11 -2.77 0.10 0.00 -1.51 0.00 0.00 37.83 33.54 1yhq s LYS 173 CO 0.20 0.50 0.61 0.42 -0.36 0.00 0.00 175.35 176.72 1yhq s ILE 174 N -0.35 4.97 0.52 5.43 1.01 -1.26 -1.95 121.20 129.56 1yhq s ILE 174 Ca 0.06 -1.06 -0.21 0.00 0.00 0.00 0.00 60.65 59.44 1yhq s ILE 174 Cb -0.12 -4.39 -0.08 0.00 0.01 0.00 0.00 42.46 37.87 1yhq s ILE 174 CO 0.02 -0.96 0.86 0.29 0.00 0.00 0.00 174.94 175.15 1yhq n LYS 175 N 5.92 0.96 -2.92 2.79 5.02 -0.39 -5.00 118.16 124.53 1yhq n LYS 175 Ca -0.11 0.36 -0.37 0.00 -2.02 0.00 0.00 58.31 56.17 1yhq n LYS 175 Cb 0.42 -1.97 -0.06 0.00 -0.02 0.00 0.00 35.03 33.40 1yhq n LYS 175 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yhq s ALA 176 N -1.47 3.31 0.00 7.82 0.00 -1.26 -4.90 121.76 125.26 1yhq s ALA 176 Ca 0.69 0.37 0.00 0.00 0.00 0.00 0.00 51.96 53.01 1yhq s ALA 176 Cb -0.49 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1yhq s ALA 176 CO 0.53 0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.94 1yhq n GLY 177 N 0.68 1.40 0.00 0.00 0.00 -1.26 -4.73 105.19 101.28 1yhq n GLY 177 Ca -0.00 -2.04 0.05 0.00 0.00 0.00 0.00 46.02 44.03 1yhq n GLY 177 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yhq n GLN 178 N 1.27 0.79 0.28 1.61 6.02 -1.26 -3.46 117.38 122.63 1yhq n GLN 178 Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.10 1yhq n GLN 178 Cb 0.00 -1.21 0.77 0.00 1.02 0.00 0.00 30.24 30.82 1yhq n GLN 178 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1yhq h GLY 179 N 4.44 0.00 0.49 1.08 0.00 -1.85 -0.77 103.07 106.45 1yhq h GLY 179 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.47 1yhq h GLY 179 CO 0.00 0.00 0.59 0.23 0.00 0.00 0.00 176.54 177.36 1yhq h SER 180 N 0.00 0.73 1.03 0.19 0.87 -1.64 0.87 113.55 115.60 1yhq h SER 180 Ca -0.00 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1yhq h SER 180 Cb 0.00 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1yhq h SER 180 CO 0.00 0.37 0.00 0.00 -0.53 0.00 0.00 176.83 176.67 1yhq h ALA 181 N 1.59 1.00 -0.39 6.23 0.00 -1.42 -3.04 119.26 123.23 1yhq h ALA 181 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1yhq h ALA 181 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1yhq h ALA 181 CO -0.23 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.56 1yhq n ARG 182 N -2.33 3.09 -0.30 0.00 1.74 0.16 -4.96 116.66 114.06 1yhq n ARG 182 Ca 0.03 -2.52 0.00 0.00 -0.77 0.00 0.00 57.85 54.59 1yhq n ARG 182 Cb 0.31 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1yhq n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yhq n GLY 183 N 0.29 0.79 2.73 -0.13 0.00 -1.04 -4.98 105.19 102.85 1yhq n GLY 183 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1yhq n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yhq n ARG 184 N -2.21 3.60 -0.01 1.61 1.74 -0.40 -4.78 116.66 116.21 1yhq n ARG 184 Ca 0.00 -4.48 -0.17 0.00 -0.77 0.00 0.00 57.85 52.43 1yhq n ARG 184 Cb 0.00 -2.29 -0.09 0.00 -1.02 0.00 0.00 32.46 29.06 1yhq n ARG 184 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1yhq h LYS 185 N 3.07 0.54 -6.15 5.56 3.64 -1.80 -3.30 116.57 118.13 1yhq h LYS 185 Ca 0.33 -0.50 -0.52 0.00 -1.27 0.00 0.00 60.65 58.69 1yhq h LYS 185 Cb 0.52 0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.40 1yhq h LYS 185 CO 1.00 1.13 -0.52 0.71 -2.27 0.00 0.00 179.45 179.50 1yhq s TYR 186 N -3.50 2.82 0.02 1.91 1.51 -1.26 -1.27 117.35 117.58 1yhq s TYR 186 Ca -0.12 -0.31 -0.28 0.00 -1.01 0.00 0.00 57.07 55.36 1yhq s TYR 186 Cb 0.05 -1.62 0.08 0.00 -0.11 0.00 0.00 41.96 40.37 1yhq s TYR 186 CO 0.85 0.34 0.72 -0.98 -1.11 0.00 0.00 175.55 175.37 1yhq s ARG 187 N -3.88 1.05 0.08 -0.62 1.04 -0.82 -4.92 118.95 110.87 1yhq s ARG 187 Ca 0.37 -0.11 -0.11 0.00 -1.04 0.00 0.00 55.73 54.84 1yhq s ARG 187 Cb -0.05 0.49 0.01 0.00 -2.04 0.00 0.00 34.95 33.36 1yhq s ARG 187 CO 0.24 -0.40 0.24 -0.98 -0.04 0.00 0.00 175.30 174.36 1yhq s ARG 188 N -2.43 0.84 0.69 3.89 1.70 -1.26 0.53 118.95 122.91 1yhq s ARG 188 Ca -0.03 -0.77 -0.17 0.00 -0.47 0.00 0.00 55.73 54.30 1yhq s ARG 188 Cb -0.01 0.35 -0.00 0.00 -0.57 0.00 0.00 34.95 34.73 1yhq s ARG 188 CO -0.02 -0.27 1.07 -2.30 -1.08 0.00 0.00 175.30 172.70 1yhq n PRO 189 N 0.19 0.70 -3.21 3.89 -0.02 -1.26 -4.97 135.00 130.31 1yhq n PRO 189 Ca -0.17 0.30 -0.39 0.00 -2.02 0.00 0.00 63.50 61.22 1yhq n PRO 189 Cb 0.61 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.72 1yhq n PRO 189 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yhq s ALA 190 N -1.68 3.45 0.00 3.55 0.00 -1.26 -4.44 121.76 121.37 1yhq s ALA 190 Ca 0.76 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.69 1yhq s ALA 190 Cb -0.36 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.01 1yhq s ALA 190 CO 0.47 0.04 0.00 -1.13 0.00 0.00 0.00 175.76 175.13 1yhq n SER 191 N 3.37 0.00 -4.75 0.00 3.41 0.33 -4.95 113.62 111.04 1yhq n SER 191 Ca -0.06 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.15 1yhq n SER 191 Cb 0.51 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 1yhq n SER 191 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1yhq s ILE 192 N 3.96 3.57 -0.18 -1.33 1.01 -1.26 -4.62 121.20 122.35 1yhq s ILE 192 Ca 0.00 1.45 -0.08 0.00 0.00 0.00 0.00 60.65 62.02 1yhq s ILE 192 Cb 0.00 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1yhq s ILE 192 CO 0.00 0.29 0.07 -0.22 0.00 0.00 0.00 174.94 175.08 1yhq s LEU 193 N -0.86 3.83 -0.25 2.97 2.96 -0.99 -1.83 118.68 124.51 1yhq s LEU 193 Ca 0.48 0.09 -0.05 0.00 -0.22 0.00 0.00 54.13 54.42 1yhq s LEU 193 Cb -0.32 -1.97 -0.01 0.00 0.50 0.00 0.00 46.19 44.39 1yhq s LEU 193 CO 0.39 0.17 0.01 -0.36 -1.32 0.00 0.00 176.35 175.24 1yhq s PHE 194 N 0.38 3.04 -0.32 5.38 0.40 0.30 -1.75 117.98 125.42 1yhq s PHE 194 Ca 0.03 -0.86 -0.07 0.00 -0.60 0.00 0.00 56.93 55.43 1yhq s PHE 194 Cb -0.12 -2.17 0.02 0.00 0.51 0.00 0.00 43.02 41.26 1yhq s PHE 194 CO 0.00 -0.52 0.10 0.08 0.70 0.00 0.00 175.22 175.58 1yhq s VAL 195 N 1.51 3.95 0.00 -0.44 1.01 -0.71 -0.56 120.40 125.16 1yhq s VAL 195 Ca 0.05 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.13 1yhq s VAL 195 Cb -0.15 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1yhq s VAL 195 CO -0.00 -0.07 0.00 0.35 0.00 0.00 0.00 175.10 175.38 1yhq n THR 196 N 4.86 0.00 -0.00 3.92 -2.24 -0.52 -1.76 114.28 118.54 1yhq n THR 196 Ca -0.13 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1yhq n THR 196 Cb 0.46 -0.65 -0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1yhq n THR 196 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1yhq n SER 197 N -1.71 2.71 -0.03 3.42 2.88 -1.26 -1.76 113.62 117.87 1yhq n SER 197 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 1yhq n SER 197 Cb 0.00 -0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.32 1yhq n SER 197 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1yhq h ASP 198 N -0.00 0.22 -5.03 -3.46 3.32 -1.99 -3.44 116.42 106.05 1yhq h ASP 198 Ca -0.01 -0.83 -0.06 0.00 0.02 0.00 0.00 57.03 56.15 1yhq h ASP 198 Cb 1.01 -0.07 -0.16 0.00 0.22 0.00 0.00 39.33 40.32 1yhq h ASP 198 CO -0.00 1.41 -0.00 -1.61 -1.72 0.00 0.00 179.24 177.31 1yhq s GLU 199 N -2.38 1.01 0.44 3.56 2.02 -1.26 -5.11 118.70 116.98 1yhq s GLU 199 Ca -0.20 -0.30 -0.26 0.00 0.02 0.00 0.00 54.97 54.23 1yhq s GLU 199 Cb 0.02 0.46 -0.09 0.00 0.10 0.00 0.00 34.13 34.62 1yhq s GLU 199 CO 0.72 -0.37 1.41 -2.30 0.02 0.00 0.00 175.26 174.74 1yhq n PRO 200 N 0.37 2.23 -1.92 0.39 -0.02 -1.26 -4.74 135.00 130.05 1yhq n PRO 200 Ca -0.18 0.79 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 1yhq n PRO 200 Cb 0.60 -2.59 -0.03 0.00 -0.02 0.00 0.00 33.50 31.47 1yhq n PRO 200 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1yhq s SER 201 N -0.45 5.45 0.35 2.55 0.15 -1.26 -4.83 113.70 115.66 1yhq s SER 201 Ca 0.60 1.00 0.07 0.00 0.70 0.00 0.00 55.95 58.32 1yhq s SER 201 Cb -0.46 -2.52 0.65 0.00 -1.71 0.00 0.00 66.02 61.98 1yhq s SER 201 CO 0.58 -2.11 1.85 0.74 1.20 0.00 0.00 173.24 175.50 1yhq h THR 202 N 6.98 1.21 -0.06 6.45 2.02 -1.90 -2.16 112.91 125.46 1yhq h THR 202 Ca -0.30 -0.96 -0.08 0.00 0.77 0.00 0.00 66.41 65.84 1yhq h THR 202 Cb 1.19 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.85 1yhq h THR 202 CO 1.11 0.30 -0.32 0.00 0.37 0.00 0.00 175.52 176.98 1yhq h ALA 203 N 1.54 1.37 0.00 6.16 0.00 -1.82 -3.29 119.26 123.22 1yhq h ALA 203 Ca 0.05 -0.32 -0.35 0.00 0.00 0.00 0.00 54.91 54.30 1yhq h ALA 203 Cb 0.47 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1yhq h ALA 203 CO 0.03 0.45 -2.20 0.00 0.00 0.00 0.00 179.25 177.53 1yhq n ALA 204 N -2.48 1.51 -0.40 0.00 0.00 -1.09 -3.55 120.51 114.51 1yhq n ALA 204 Ca -0.02 -1.18 0.32 0.00 0.00 0.00 0.00 53.44 52.56 1yhq n ALA 204 Cb 0.38 -0.36 0.60 0.00 0.00 0.00 0.00 19.45 20.07 1yhq n ALA 204 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1yhq h ARG 205 N 0.00 0.18 -0.00 0.00 0.11 -1.47 0.12 114.38 113.32 1yhq h ARG 205 Ca -0.47 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.59 1yhq h ARG 205 Cb 2.17 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 33.21 1yhq h ARG 205 CO 0.04 0.12 -0.02 -1.71 0.10 0.00 0.00 179.97 178.50 1yhq n ASN 206 N -4.70 0.16 -4.77 0.08 5.15 -1.26 -4.65 115.26 105.27 1yhq n ASN 206 Ca 0.33 -0.58 -0.41 0.00 -0.60 0.00 0.00 54.58 53.33 1yhq n ASN 206 Cb 1.24 -0.13 -0.01 0.00 -0.53 0.00 0.00 39.78 40.35 1yhq n ASN 206 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1yhq s LEU 207 N -2.34 4.34 -0.28 1.20 1.43 0.43 -4.83 118.68 118.63 1yhq s LEU 207 Ca 0.35 2.97 -0.41 0.00 -1.03 0.00 0.00 54.13 56.02 1yhq s LEU 207 Cb 0.21 -3.66 -0.16 0.00 0.03 0.00 0.00 46.19 42.61 1yhq s LEU 207 CO 0.43 -0.83 1.71 0.00 0.23 0.00 0.00 176.35 177.89 1yhq n ALA 208 N 0.80 -0.35 -0.86 4.21 0.00 -1.26 -0.89 120.51 122.16 1yhq n ALA 208 Ca 0.02 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1yhq n ALA 208 Cb 0.39 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1yhq n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yhq n GLY 209 N 4.09 0.37 3.83 0.00 0.00 -1.26 -4.61 105.19 107.61 1yhq n GLY 209 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.96 1yhq n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yhq s ALA 210 N -2.01 3.04 -0.02 4.61 0.00 -0.07 -0.51 121.76 126.80 1yhq s ALA 210 Ca 0.00 0.31 0.02 0.00 0.00 0.00 0.00 51.96 52.30 1yhq s ALA 210 Cb 0.00 -3.14 -0.00 0.00 0.00 0.00 0.00 23.12 19.98 1yhq s ALA 210 CO 0.00 -0.06 -0.08 -0.51 0.00 0.00 0.00 175.76 175.11 1yhq s ASP 211 N -2.57 1.06 0.06 0.00 1.01 -0.76 -4.88 116.67 110.60 1yhq s ASP 211 Ca 0.61 -0.16 0.06 0.00 0.71 0.00 0.00 52.55 53.77 1yhq s ASP 211 Cb -0.10 -0.21 -0.04 0.00 1.01 0.00 0.00 42.92 43.59 1yhq s ASP 211 CO 0.22 0.08 -0.11 0.68 0.21 0.00 0.00 175.17 176.24 1yhq s VAL 212 N 0.02 3.28 0.29 -1.27 -7.23 -1.26 -0.54 120.40 113.70 1yhq s VAL 212 Ca -0.00 -1.11 -0.12 0.00 -1.81 0.00 0.00 61.98 58.94 1yhq s VAL 212 Cb -0.06 -2.46 0.01 0.00 0.56 0.00 0.00 36.38 34.43 1yhq s VAL 212 CO -0.00 0.25 0.56 0.00 -0.31 0.00 0.00 175.10 175.60 1yhq s ALA 213 N -1.07 -0.24 0.02 1.32 0.00 0.28 -4.91 121.76 117.15 1yhq s ALA 213 Ca 0.18 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.31 1yhq s ALA 213 Cb -0.11 0.99 -0.02 0.00 0.00 0.00 0.00 23.12 23.98 1yhq s ALA 213 CO 0.10 -0.89 -0.24 0.99 0.00 0.00 0.00 175.76 175.71 1yhq s THR 214 N -3.53 1.96 0.43 0.00 2.01 -1.26 -1.43 115.64 113.82 1yhq s THR 214 Ca 0.21 -1.21 0.15 0.00 0.31 0.00 0.00 61.69 61.15 1yhq s THR 214 Cb -0.02 -1.66 0.34 0.00 0.01 0.00 0.00 72.50 71.17 1yhq s THR 214 CO 0.11 0.41 1.95 0.00 -0.69 0.00 0.00 174.62 176.40 1yhq h ALA 215 N 5.10 2.08 0.00 7.40 0.00 -1.64 0.33 119.26 132.54 1yhq h ALA 215 Ca -0.44 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1yhq h ALA 215 Cb 1.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1yhq h ALA 215 CO 0.45 -0.24 -0.32 0.66 0.00 0.00 0.00 179.25 179.80 1yhq h SER 216 N 0.40 0.00 0.00 0.00 4.64 -1.89 -3.34 113.55 113.36 1yhq h SER 216 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1yhq h SER 216 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1yhq h SER 216 CO -0.09 0.32 -0.17 -1.84 -0.87 0.00 0.00 176.83 174.18 1yhq n GLU 217 N -4.04 0.75 -1.78 4.77 0.28 -0.65 -5.06 120.64 114.90 1yhq n GLU 217 Ca -0.02 -1.23 -0.42 0.00 -0.16 0.00 0.00 57.16 55.33 1yhq n GLU 217 Cb 0.37 -0.77 -0.02 0.00 1.43 0.00 0.00 31.44 32.45 1yhq n GLU 217 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1yhq s VAL 218 N -0.71 2.10 0.37 3.84 0.11 0.11 -4.88 120.40 121.34 1yhq s VAL 218 Ca 0.06 0.08 0.02 0.00 -2.93 0.00 0.00 61.98 59.21 1yhq s VAL 218 Cb 0.05 -3.05 0.02 0.00 -1.53 0.00 0.00 36.38 31.88 1yhq s VAL 218 CO 0.01 0.01 0.20 -0.46 -3.33 0.00 0.00 175.10 171.53 1yhq n ASN 219 N 2.54 2.44 -0.15 3.54 0.23 -1.26 -5.02 115.26 117.57 1yhq n ASN 219 Ca 0.10 -2.39 0.01 0.00 -0.53 0.00 0.00 54.58 51.76 1yhq n ASN 219 Cb 0.37 0.05 0.28 0.00 -2.08 0.00 0.00 39.78 38.40 1yhq n ASN 219 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1yhq h THR 220 N 0.78 1.18 -0.40 5.53 2.02 -1.91 -2.48 112.91 117.63 1yhq h THR 220 Ca -0.26 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 66.48 1yhq h THR 220 Cb 0.89 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 1yhq h THR 220 CO 0.41 0.19 0.06 -0.33 0.37 0.00 0.00 175.52 176.22 1yhq h GLU 221 N 0.88 0.66 -0.34 6.66 5.08 -1.93 0.45 114.58 126.03 1yhq h GLU 221 Ca 0.23 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 1yhq h GLU 221 Cb -0.04 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1yhq h GLU 221 CO -0.04 0.72 -0.29 0.38 -1.00 0.00 0.00 179.01 178.77 1yhq h ASP 222 N 0.51 0.74 0.59 1.42 3.04 -1.93 -0.52 116.42 120.26 1yhq h ASP 222 Ca 0.12 -0.29 -0.13 0.00 -3.24 0.00 0.00 57.03 53.49 1yhq h ASP 222 Cb 0.38 -0.20 -0.02 0.00 -1.04 0.00 0.00 39.33 38.45 1yhq h ASP 222 CO 0.01 0.98 -0.61 -0.07 -2.04 0.00 0.00 179.24 177.51 1yhq h LEU 223 N 0.61 0.03 -5.77 0.15 4.07 -1.29 -3.38 115.31 109.72 1yhq h LEU 223 Ca 0.07 -0.02 -0.48 0.00 0.08 0.00 0.00 57.88 57.54 1yhq h LEU 223 Cb 0.80 -0.01 -0.34 0.00 1.08 0.00 0.00 40.66 42.19 1yhq h LEU 223 CO 0.07 0.63 -0.98 0.00 -1.08 0.00 0.00 178.44 177.08 1yhq n ALA 224 N -2.43 1.54 -1.57 1.53 0.00 0.16 -3.32 120.51 116.41 1yhq n ALA 224 Ca -0.01 -2.95 -0.51 0.00 0.00 0.00 0.00 53.44 49.97 1yhq n ALA 224 Cb 0.61 -0.94 -0.05 0.00 0.00 0.00 0.00 19.45 19.07 1yhq n ALA 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1yhq n PRO 225 N 1.30 1.06 -1.01 0.00 -0.04 -0.22 0.09 135.00 136.18 1yhq n PRO 225 Ca 0.19 0.38 -0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1yhq n PRO 225 Cb 0.57 -1.93 -0.00 0.00 -0.04 0.00 0.00 33.50 32.10 1yhq n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yhq n GLY 226 N 2.21 0.24 1.94 0.55 0.00 -1.26 -2.19 105.19 106.69 1yhq n GLY 226 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1yhq n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yhq n GLY 227 N -0.82 0.81 3.59 -0.02 0.00 0.11 -5.00 105.19 103.87 1yhq n GLY 227 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1yhq n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yhq s ALA 228 N -3.14 3.48 0.71 4.61 0.00 -0.93 -4.22 121.76 122.27 1yhq s ALA 228 Ca 0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 51.96 51.19 1yhq s ALA 228 Cb 0.00 -3.25 0.03 0.00 0.00 0.00 0.00 23.12 19.90 1yhq s ALA 228 CO 0.00 -1.29 1.10 -2.14 0.00 0.00 0.00 175.76 173.43 1yhq s PRO 229 N 2.87 2.56 0.00 0.00 0.02 -1.26 -3.96 135.00 135.23 1yhq s PRO 229 Ca 0.29 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.58 1yhq s PRO 229 Cb -0.14 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.45 1yhq s PRO 229 CO 0.14 -1.42 0.00 0.41 -0.33 0.00 0.00 177.00 175.80 1yhq n GLY 230 N -0.89 0.50 3.74 0.52 0.00 -1.26 -4.70 105.19 103.10 1yhq n GLY 230 Ca 0.10 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 1yhq n GLY 230 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yhq s ARG 231 N -1.76 4.61 -0.19 1.61 3.52 -1.21 -3.94 118.95 121.58 1yhq s ARG 231 Ca 0.00 1.25 -0.29 0.00 -0.13 0.00 0.00 55.73 56.56 1yhq s ARG 231 Cb 0.00 -3.35 -0.05 0.00 -1.56 0.00 0.00 34.95 29.99 1yhq s ARG 231 CO 0.00 0.31 1.98 -1.17 -0.81 0.00 0.00 175.30 175.62 1yhq s LEU 232 N -0.26 3.72 0.36 -0.88 2.96 -1.26 -4.76 118.68 118.55 1yhq s LEU 232 Ca 0.41 1.88 0.09 0.00 -0.22 0.00 0.00 54.13 56.29 1yhq s LEU 232 Cb -0.22 -3.52 -0.06 0.00 0.50 0.00 0.00 46.19 42.89 1yhq s LEU 232 CO 0.27 -1.62 0.02 -0.89 -1.32 0.00 0.00 176.35 172.81 1yhq s THR 233 N 6.75 2.44 -0.22 3.68 2.01 -1.26 -2.35 115.64 126.70 1yhq s THR 233 Ca 0.89 -1.97 -0.04 0.00 0.31 0.00 0.00 61.69 60.89 1yhq s THR 233 Cb -0.31 -2.83 0.09 0.00 0.01 0.00 0.00 72.50 69.46 1yhq s THR 233 CO 0.35 -0.14 0.20 0.54 -0.69 0.00 0.00 174.62 174.88 1yhq s VAL 234 N -2.57 -0.27 0.60 3.82 0.11 -0.72 -2.29 120.40 119.08 1yhq s VAL 234 Ca 0.35 -0.24 -0.01 0.00 -2.93 0.00 0.00 61.98 59.15 1yhq s VAL 234 Cb 0.02 -0.73 0.05 0.00 -1.53 0.00 0.00 36.38 34.19 1yhq s VAL 234 CO 0.19 -0.31 0.85 -0.36 -3.33 0.00 0.00 175.10 172.15 1yhq s PHE 235 N 2.28 2.78 0.08 1.54 0.40 -0.07 -1.74 117.98 123.25 1yhq s PHE 235 Ca 0.07 0.09 0.04 0.00 -0.60 0.00 0.00 56.93 56.52 1yhq s PHE 235 Cb -0.16 -2.89 -0.04 0.00 0.51 0.00 0.00 43.02 40.44 1yhq s PHE 235 CO -0.17 -1.08 0.03 -0.08 0.70 0.00 0.00 175.22 174.62 1yhq s THR 236 N -2.92 4.23 0.15 0.64 -1.32 -0.72 -2.06 115.64 113.63 1yhq s THR 236 Ca 0.59 -0.87 -0.26 0.00 -1.21 0.00 0.00 61.69 59.93 1yhq s THR 236 Cb -0.10 -3.01 -0.04 0.00 -1.51 0.00 0.00 72.50 67.84 1yhq s THR 236 CO 0.40 0.14 1.36 1.21 -2.21 0.00 0.00 174.62 175.53 1yhq n GLU 237 N 0.59 -0.37 -0.13 7.08 4.07 0.82 0.75 120.64 133.45 1yhq n GLU 237 Ca -0.10 1.34 -0.10 0.00 -0.06 0.00 0.00 57.16 58.23 1yhq n GLU 237 Cb 0.52 -1.97 0.03 0.00 -0.06 0.00 0.00 31.44 29.97 1yhq n GLU 237 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1yhq h SER 238 N 0.00 0.94 -0.27 4.31 0.02 -1.95 -3.01 113.55 113.58 1yhq h SER 238 Ca 0.16 -0.35 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 1yhq h SER 238 Cb 0.38 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 1yhq h SER 238 CO -0.83 1.12 0.01 0.00 -1.14 0.00 0.00 176.83 175.99 1yhq h ALA 239 N 0.95 0.25 -0.95 3.77 0.00 -0.80 -0.07 119.26 122.40 1yhq h ALA 239 Ca 0.10 0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.22 1yhq h ALA 239 Cb 0.78 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.59 1yhq h ALA 239 CO 0.06 -0.40 0.57 1.25 0.00 0.00 0.00 179.25 180.73 1yhq h LEU 240 N 0.10 0.78 -0.14 0.00 6.46 0.45 -0.12 115.31 122.84 1yhq h LEU 240 Ca 0.13 0.07 -0.06 0.00 -0.12 0.00 0.00 57.88 57.90 1yhq h LEU 240 Cb 0.16 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.01 1yhq h LEU 240 CO -0.20 0.37 -0.13 0.00 -0.62 0.00 0.00 178.44 177.85 1yhq h ALA 241 N 1.56 0.21 -0.72 1.25 0.00 -1.17 -3.14 119.26 117.25 1yhq h ALA 241 Ca 0.50 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1yhq h ALA 241 Cb 0.61 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1yhq h ALA 241 CO -0.31 0.08 0.48 0.93 0.00 0.00 0.00 179.25 180.42 1yhq h GLU 242 N -0.03 0.94 -0.05 0.00 5.08 -0.27 -1.92 114.58 118.33 1yhq h GLU 242 Ca 0.02 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1yhq h GLU 242 Cb 0.66 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1yhq h GLU 242 CO 0.03 0.62 0.06 0.28 -1.00 0.00 0.00 179.01 179.01 1yhq h VAL 243 N 0.97 0.50 -0.46 3.13 2.07 -1.08 -2.74 116.25 118.64 1yhq h VAL 243 Ca 0.26 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.88 1yhq h VAL 243 Cb -0.11 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1yhq h VAL 243 CO -0.06 0.00 0.32 0.00 0.02 0.00 0.00 177.57 177.85 1yhq h ALA 244 N 1.93 2.20 -0.53 1.67 0.00 -1.30 -2.50 119.26 120.73 1yhq h ALA 244 Ca 0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1yhq h ALA 244 Cb 0.14 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1yhq h ALA 244 CO -0.00 -0.31 0.08 0.39 0.00 0.00 0.00 179.25 179.41 1yhq n GLU 245 N -4.45 3.86 0.00 0.00 1.02 -1.03 -4.67 120.64 115.37 1yhq n GLU 245 Ca 0.07 -3.06 0.15 0.00 -0.02 0.00 0.00 57.16 54.30 1yhq n GLU 245 Cb 0.40 -2.12 0.90 0.00 -0.02 0.00 0.00 31.44 30.60 1yhq n GLU 245 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85